A0A5K4F257_SCHMA Loading...

Serine/threonine-protein

AlphaFold DB , UniProt , Accession A0A5K4F257, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 586 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure 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	32.2	Very low	32.5	Very low	249 Å²	249	181.2 Å²	181.2	100%	1.227	88%	0.884	S	S	*	*				0	153.5	0	-77.1	167.9	158.9	0	0	109.5
2	M	34.3	Very low	31.9	Very low	180 Å²	180	175.6 Å²	175.6	89%	0.887	88%	0.877	S	S	*	*			trans	-87.7	166.9	174.9	-59.8	175	171.7	0	0	109.8
3	K	35.7	Very low	31.9	Very low	198 Å²	198	172.2 Å²	172.2	86%	0.861	88%	0.875	S	S	*	*			cis	-139	155.3	20.4	-65.2	170.3	177.2	175.7	0	112.2
4	R	29.5	Very low	31.6	Very low	247 Å²	247	167.6 Å²	167.6	93%	0.932	87%	0.867	S	S	*	*			trans	-101.5	149.9	155.5	-88.9	176.3	161.5	169.8	-6.4	108.6
5	S	41	Very low	31.2	Very low	126 Å²	126	164.3 Å²	164.3	88%	0.881	86%	0.863	S	S	*	*			trans	-133.8	162	160.6	-87.1	0	0	0	0	110.4
6	K	34.2	Very low	31.2	Very low	194 Å²	194	161.2 Å²	161.2	84%	0.843	86%	0.86	S	S	*	*			trans	-127.3	156.9	-172.6	-77.9	-178.4	174.2	178.3	0	111.3
7	R	29	Very low	31	Very low	229 Å²	229	160.1 Å²	160.1	86%	0.864	86%	0.861	S	S	*	*			trans	57.6	122.3	154.5	-75.4	178.3	170.3	176	-5.3	117.9
8	T	32	Very low	31	Very low	140 Å²	140	157.6 Å²	157.6	86%	0.859	85%	0.854	S	S	*	*				-135.3	154.4	111.1	-9.4	0	0	0	0	109.1
9	V	27.1	Very low	31	Very low	119 Å²	119	156.2 Å²	156.2	72%	0.721	85%	0.852	S	S	*	*			trans	-116.6	138.3	170.2	172.6	0	0	0	0	106.1
10	V	32.7	Very low	30.6	Very low	140 Å²	140	156.3 Å²	156.3	85%	0.848	85%	0.849	S	S	*	*			trans	-115.5	128	171.6	-179.7	0	0	0	0	107.5
11	Q	30.4	Very low	30.6	Very low	171 Å²	171	154.3 Å²	154.3	80%	0.799	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-98	155.3	175.7	-66.6	173.8	-85.1	0	0	109.7
12	S	24.8	Very low	30.3	Very low	114 Å²	114	152.5 Å²	152.5	80%	0.797	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-67.7	143.4	173	39.8	0	0	0	0	111.9
13	P	32.4	Very low	30.1	Very low	132 Å²	132	152.7 Å²	152.7	86%	0.857	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-82.7	130.8	167.9	32.5	-31.1	0	0	0	110.6
14	S	27.7	Very low	29.8	Very low	108 Å²	108	146.2 Å²	146.2	76%	0.755	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-93.1	163.8	173.7	51.2	0	0	0	0	112.5
15	S	24.9	Very low	29.8	Very low	117 Å²	117	142.4 Å²	142.4	82%	0.818	81%	0.812	S	S	*	*			trans	-35.9	143.2	172.6	55.4	0	0	0	0	117
16	S	31.7	Very low	29.2	Very low	115 Å²	115	142.2 Å²	142.2	80%	0.804	80%	0.801	S	S	*	*			trans	-148.8	100.8	164.8	47.6	0	0	0	0	113.8
17	T	27.8	Very low	29.1	Very low	143 Å²	143	141.5 Å²	141.5	88%	0.877	80%	0.801	S	S	*	*			trans	-97.8	136	156.6	17.1	0	0	0	0	110.1
18	P	31.5	Very low	29	Very low	114 Å²	114	135.8 Å²	135.8	74%	0.74	80%	0.796	S	S	*	*			trans	-145.4	172.4	137.5	36.6	-21.8	0	0	0	112.6
19	T	29.4	Very low	29.4	Very low	132 Å²	132	134.2 Å²	134.2	81%	0.81	79%	0.788	S	S	*	*			cis	-172.1	150.2	-29.8	-81.3	0	0	0	0	105.4
20	I	24.7	Very low	29.5	Very low	157 Å²	157	135.2 Å²	135.2	81%	0.805	79%	0.789	S	S	*	*			trans	-77	143	-178.7	-65.5	166.2	0	0	0	112.3
21	S	30.3	Very low	29.5	Very low	116 Å²	116	137.2 Å²	137.2	81%	0.811	79%	0.786	S	S	*	*			trans	-145.5	168.6	155.2	72.7	0	0	0	0	111.9
22	R	25.3	Very low	29.5	Very low	211 Å²	211	133.3 Å²	133.3	80%	0.796	78%	0.778	S	S	*	*			trans	-141.4	162.7	-175.4	-82.8	-176.3	165.5	-176.5	-2.6	111.7
23	H	31	Very low	29.8	Very low	183 Å²	183	135.2 Å²	135.2	85%	0.847	78%	0.778	S	S	*	*			trans	73.4	141.5	170.9	-51.6	-82.5	0	0	0	116.1
24	G	28	Very low	29.9	Very low	63 Å²	63	133.6 Å²	133.6	65%	0.649	77%	0.769	S	S	*	*			cis	159	159.5	-11.6	0	0	0	0	0	114
25	L	30.6	Very low	30	Very low	166 Å²	166	135 Å²	135	87%	0.869	77%	0.768	S	S	*	*			trans	70.3	148.2	168.6	-50.4	173.9	0	0	0	115.7
26	D	27.9	Very low	30.3	Very low	123 Å²	123	139.6 Å²	139.6	66%	0.658	77%	0.767	S	S	*	*			cis	-159.8	179.7	-11.1	-134.3	-32	0	0	0	113.2
27	H	31.8	Very low	30	Very low	178 Å²	178	141.6 Å²	141.6	82%	0.824	77%	0.769	S	S	*	*			trans	98.2	153.2	162.2	-60.9	-56.1	0	0	0	121.9
28	S	27.3	Very low	30.3	Very low	109 Å²	109	139.8 Å²	139.8	76%	0.762	76%	0.762	S	S	*	*			trans	-136	-156.7	-155	-42.8	0	0	0	0	111
29	P	39.3	Very low	30.2	Very low	107 Å²	107	142.2 Å²	142.2	70%	0.695	77%	0.769	S	S	*	*			cis	-143.9	-176.5	-7.3	44.4	-25.4	0	0	0	118
30	L	31.2	Very low	30.5	Very low	141 Å²	141	144 Å²	144	74%	0.738	77%	0.774	S	S	*	*			trans	67.3	153.5	159.1	-68.7	162.5	0	0	0	118.8
31	F	31.7	Very low	30.7	Very low	182 Å²	182	143 Å²	143	80%	0.798	77%	0.77	S	S	*	*			cis	-120.8	142.8	11	-90.7	-109.9	0	0	0	111.6
32	S	30.8	Very low	30.8	Very low	89 Å²	89	143.9 Å²	143.9	62%	0.622	77%	0.766	S	S	*	*				66.8	128.9	88.7	-136.2	0	0	0	0	114.2
33	L	31.4	Very low	31	Very low	154 Å²	154	139.1 Å²	139.1	81%	0.806	77%	0.765	S	S	*	*			cis	-146.3	175.1	25.3	-66.4	155.4	0	0	0	109.1
34	C	32.7	Very low	31.1	Very low	97 Å²	97	134.9 Å²	134.9	66%	0.655	76%	0.761	S	S	*	*			cis	-162.2	161.7	-6.7	-129.1	0	0	0	0	112.6
35	N	30.3	Very low	31.1	Very low	139 Å²	139	139.7 Å²	139.7	74%	0.743	77%	0.767	S	S	*	*			trans	8.2	147.4	137.5	-65.9	-8.1	0	0	0	121.7
36	R	31.1	Very low	31.1	Very low	212 Å²	212	140.5 Å²	140.5	80%	0.8	77%	0.766	S	S	*	*			cis	-166.9	151.8	4	-134.9	178.4	172.4	176.9	-4.7	112.3
37	D	26.3	Very low	31	Very low	157 Å²	157	143.5 Å²	143.5	84%	0.84	77%	0.773	S	S	*	*			trans	-108.5	150.7	160	-66.5	-56.4	0	0	0	111.7
38	S	34.5	Very low	30.8	Very low	105 Å²	105	138.6 Å²	138.6	73%	0.734	77%	0.771	S	S	*	*			trans	-168.9	121.4	161.5	-70.3	0	0	0	0	110.7
39	D	29.7	Very low	30.8	Very low	166 Å²	166	141.1 Å²	141.1	89%	0.888	78%	0.775	S	S	*	*			trans	-74.5	153.7	171.5	-50.2	-84.1	0	0	0	112.1
40	N	35.6	Very low	30.2	Very low	170 Å²	170	144.4 Å²	144.4	91%	0.909	78%	0.781	S	S	*	*			trans	-157.3	159.1	142.3	-150.4	3	0	0	0	111.3
41	D	28.2	Very low	30.2	Very low	136 Å²	136	143.7 Å²	143.7	73%	0.727	78%	0.782	S	S	*	*			trans	-117.1	176.6	-161.8	-147.4	-20.7	0	0	0	113.8
42	N	31.2	Very low	30.1	Very low	134 Å²	134	140.5 Å²	140.5	72%	0.717	78%	0.783	S	S	*	*			trans	82.5	104.1	162.9	-68.3	-65.8	0	0	0	122.2
43	S	31.1	Very low	30.2	Very low	111 Å²	111	141.3 Å²	141.3	78%	0.776	79%	0.786	S	S	*	*				115.2	147.7	102.3	72.2	0	0	0	0	122.2
44	A	31.7	Very low	30.1	Very low	94 Å²	94	142 Å²	142	78%	0.777	79%	0.789	S	S	*	*			trans	78.5	94.1	151.9	0	0	0	0	0	122
45	E	28.3	Very low	30	Very low	164 Å²	164	147.7 Å²	147.7	77%	0.766	80%	0.803	S	S	*	*			trans	11.9	138.8	138.8	-55.2	-174.2	179.8	0	0	122.8
46	H	31	Very low	30.1	Very low	183 Å²	183	146.5 Å²	146.5	85%	0.847	81%	0.806	S	S	*	*				-157	169.3	108	-132.2	31	0	0	0	114.1
47	F	26.5	Very low	30	Very low	185 Å²	185	148.4 Å²	148.4	81%	0.811	81%	0.814	S	S	*	*			trans	-88.2	152	-170.2	-85.8	-108	0	0	0	115
48	G	27.9	Very low	30.3	Very low	76 Å²	76	145.9 Å²	145.9	78%	0.784	81%	0.808	S	S	*	*			trans	-159.9	137.7	166.2	0	0	0	0	0	111.3
49	L	27	Very low	30.1	Very low	162 Å²	162	152.2 Å²	152.2	85%	0.848	82%	0.816	S	S	*	*			trans	-123.7	159.8	-168.1	-102.9	173.8	0	0	0	113.5
50	Q	26.7	Very low	30	Very low	175 Å²	175	152.9 Å²	152.9	82%	0.818	82%	0.819	S	S	*	*			trans	82.1	159.5	162.7	-66.9	-173.9	3.4	0	0	121.3
51	V	30.3	Very low	29.6	Very low	126 Å²	126	149 Å²	149	76%	0.764	81%	0.805	S	S	*	*			trans	78	96.7	166.9	-162.7	0	0	0	0	118
52	S	29.3	Very low	29.7	Very low	116 Å²	116	147.9 Å²	147.9	81%	0.811	81%	0.807	S	S	*	*			trans	-78.8	150.6	154.4	-44	0	0	0	0	111
53	P	33.7	Very low	29.4	Very low	105 Å²	105	145.9 Å²	145.9	68%	0.682	81%	0.81	S	S	*	*			trans	-141.2	137.7	134.9	31.1	-14.8	0	0	0	115.5
54	L	29.6	Very low	29.3	Very low	168 Å²	168	148.6 Å²	148.6	88%	0.88	81%	0.814	S	S	*	*			trans	52.6	97.8	140.5	-56.1	174.2	0	0	0	119.3
55	F	30.9	Very low	29.1	Very low	217 Å²	217	149.7 Å²	149.7	95%	0.952	81%	0.814	S	S	*	*			trans	-65	140.8	156.2	-87	-89.2	0	0	0	111.8
56	S	32.1	Very low	29.1	Very low	115 Å²	115	147.3 Å²	147.3	80%	0.804	82%	0.816	S	S	*	*			trans	-78.6	154	-179.1	50.4	0	0	0	0	113.5
57	R	27.6	Very low	29.1	Very low	252 Å²	252	144 Å²	144	95%	0.951	81%	0.811	S	S	*	*			trans	-105.3	113.5	-179.8	-75.8	175.8	165.6	176.6	-4.9	112.2
58	S	33	Very low	29.1	Very low	104 Å²	104	143.1 Å²	143.1	73%	0.727	81%	0.813	S	S	*	*			trans	-150.8	93.2	158.9	45.7	0	0	0	0	109.4
59	R	31	Very low	29.2	Very low	238 Å²	238	148.5 Å²	148.5	90%	0.898	82%	0.818	S	S	*	*				52.6	94.5	99.3	-70.4	-166.4	-178.8	-161.9	2.7	113.5
60	L	27.1	Very low	29.3	Very low	180 Å²	180	148.1 Å²	148.1	94%	0.942	82%	0.815	S	S	*	*			trans	-109.6	115.9	152.6	-83.9	168.3	0	0	0	108.2
61	S	28.1	Very low	29.3	Very low	88 Å²	88	147.3 Å²	147.3	62%	0.615	82%	0.817	S	S	*	*			trans	-164.1	134.6	178.4	55.3	0	0	0	0	109
62	S	30.6	Very low	29.4	Very low	112 Å²	112	145.4 Å²	145.4	78%	0.783	81%	0.809	S	S	*	*			trans	57.4	127.1	-171.8	40.1	0	0	0	0	114.1
63	A	24.3	Very low	29.4	Very low	93 Å²	93	148.3 Å²	148.3	77%	0.769	81%	0.81	S	S	*	*			cis	65.9	87.3	37.8	0	0	0	0	0	113.4
64	I	28.1	Very low	29.4	Very low	167 Å²	167	148.7 Å²	148.7	86%	0.856	81%	0.812	S	S	*	*			trans	-161.9	143.9	154.9	-100.4	150	0	0	0	106.8
65	C	27.6	Very low	29.6	Very low	117 Å²	117	145.1 Å²	145.1	79%	0.791	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-77.3	146.6	176.4	-57	0	0	0	0	110.9	P67	C65-P67 WeakPolarHBondContact O-CD 3.21Å
66	S	28.1	Very low	29.5	Very low	115 Å²	115	145 Å²	145	80%	0.804	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-76	122.2	170.3	54	0	0	0	0	111.1
67	P	31.2	Very low	29.5	Very low	114 Å²	114	143.2 Å²	143.2	74%	0.74	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-73.9	155.5	162.2	33	-33.2	0	0	0	110.4	C65	C65-P67 WeakPolarHBondContact O-CD 3.21Å
68	L	27.2	Very low	29.5	Very low	165 Å²	165	141.6 Å²	141.6	86%	0.864	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-89	132.7	165.6	-77	155.4	0	0	0	108.8
69	E	29.9	Very low	29.5	Very low	190 Å²	190	146 Å²	146	89%	0.888	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-103.2	145.9	163.4	-68.9	-172	144.6	0	0	109.6
70	I	28.4	Very low	29.5	Very low	153 Å²	153	140 Å²	140	79%	0.785	80%	0.802	S	S	*	*			trans	-137.5	131.2	-177.6	-63.9	176.2	0	0	0	108.7
71	D	27.7	Very low	29.5	Very low	159 Å²	159	136.1 Å²	136.1	85%	0.85	79%	0.789	S	S	*	*			trans	-152.6	141.6	159.9	-120.1	-4.8	0	0	0	107.4
72	S	31.4	Very low	29.6	Very low	86 Å²	86	139.9 Å²	139.9	60%	0.601	80%	0.799	S	S	*	*			cis	-161.2	162.9	-2.5	68.5	0	0	0	0	112.9
73	Q	29.1	Very low	29.6	Very low	177 Å²	177	139.7 Å²	139.7	83%	0.827	80%	0.797	S	S	*	*			trans	76.3	151.3	153.6	-64.4	-82.7	-34.1	0	0	120.3
74	P	35.4	Very low	29.9	Very low	112 Å²	112	140.6 Å²	140.6	73%	0.727	80%	0.795	S	S	*	*			trans	-143	176.2	-134.3	44	-25.9	0	0	0	118.6
75	A	31.9	Very low	30.1	Very low	94 Å²	94	140 Å²	140	78%	0.777	79%	0.794	S	S	*	*			trans	-153.1	113.5	161.4	0	0	0	0	0	116
76	K	30.7	Very low	30	Very low	215 Å²	215	141 Å²	141	94%	0.935	80%	0.801	S	S	*	*			trans	32.4	124.5	146.8	-57.3	177.2	-178.1	176.2	0	121.7
77	G	30.3	Very low	30.1	Very low	77 Å²	77	139 Å²	139	79%	0.794	80%	0.799	S	S	*	*			trans	178.5	95	159.5	0	0	0	0	0	116.9
78	Y	28.4	Very low	30.2	Very low	217 Å²	217	144.5 Å²	144.5	85%	0.851	80%	0.804	S	S	*	*			trans	-32	138.9	174.6	-65.5	-99.5	0	0	0	117.2
79	F	32.6	Very low	30.4	Very low	198 Å²	198	143.2 Å²	143.2	87%	0.868	80%	0.799	S	S	*	*				-164.3	168.3	72.7	-111.7	-84.6	0	0	0	115.4
80	S	31	Very low	30.6	Very low	110 Å²	110	141.1 Å²	141.1	77%	0.769	80%	0.799	S	S	*	*			trans	-71.7	167.7	179.3	-134.7	0	0	0	0	113.9
81	C	28.5	Very low	30.9	Very low	99 Å²	99	139.6 Å²	139.6	67%	0.669	80%	0.799	S	S	*	*			cis	-156.3	167.1	13	45.2	0	0	0	0	108.9
82	M	28.8	Very low	31	Very low	167 Å²	167	137.4 Å²	137.4	82%	0.823	80%	0.796	S	S	*	*				-158.4	-177.4	59.9	-72	-117.2	74.5	0	0	113.5
83	S	32	Very low	31.2	Very low	108 Å²	108	138.4 Å²	138.4	76%	0.755	80%	0.8	S	S	*	*			trans	-55.1	162.1	-166.5	-49.6	0	0	0	0	120.6
84	P	29.9	Very low	31.2	Very low	112 Å²	112	137.8 Å²	137.8	73%	0.727	80%	0.803	S	S	*	*			trans	-109.7	-174.3	-176.8	43.9	-37.5	0	0	0	115.9
85	N	32.7	Very low	31.1	Very low	154 Å²	154	136.1 Å²	136.1	82%	0.824	81%	0.806	S	S	*	*			trans	93.7	124.2	160.3	-64	-9.3	0	0	0	119.7
86	C	25.5	Very low	30.9	Very low	140 Å²	140	141.2 Å²	141.2	95%	0.946	81%	0.813	S	S	*	*			trans	-140.6	147.6	157.3	-80.9	0	0	0	0	107.7
87	G	30.6	Very low	31	Very low	73 Å²	73	137.6 Å²	137.6	75%	0.753	81%	0.809	S	S	*	*			trans	-179.8	94.2	-178.4	0	0	0	0	0	117.8
88	R	33.2	Very low	30.9	Very low	228 Å²	228	143.6 Å²	143.6	86%	0.86	81%	0.814	S	S	*	*			trans	75	95.5	148.8	-60.2	-175.6	178.4	-178	-0.9	121.1
89	D	29.5	Very low	31	Very low	139 Å²	139	140.3 Å²	140.3	74%	0.743	81%	0.811	S	S	*	*				47.8	114	110.3	-39.2	-35.6	0	0	0	121
90	T	35.1	Very low	31.1	Very low	146 Å²	146	135.1 Å²	135.1	90%	0.896	80%	0.797	S	S	*	*				-170.4	160.7	118.6	19	0	0	0	0	110.3
91	P	34.1	Very low	30.9	Very low	120 Å²	120	136.3 Å²	136.3	78%	0.779	80%	0.795	S	S	*	*			trans	-104.4	158.2	-144.1	38.2	-37.7	0	0	0	119.5
92	S	30.2	Very low	31	Very low	114 Å²	114	137.4 Å²	137.4	80%	0.797	79%	0.793	S	S	*	*			trans	0.6	152.1	151.6	-104.4	0	0	0	0	121.6
93	P	35.5	Very low	31.3	Very low	106 Å²	106	134.3 Å²	134.3	69%	0.688	79%	0.788	S	S	*	*				-143	-177.2	57.3	42.7	-25.1	0	0	0	118.6
94	D	29.1	Very low	31.3	Very low	165 Å²	165	134.7 Å²	134.7	88%	0.882	78%	0.782	S	S	*	*			trans	70.1	117.6	163.6	-59.9	-22.2	0	0	0	120.6
95	G	33.9	Very low	31.4	Very low	77 Å²	77	139.3 Å²	139.3	79%	0.794	78%	0.784	S	S	*	*			trans	164.2	100.7	171.7	0	0	0	0	0	113.6	V97	G95-V97 PolarHBondContact O-N 2.53Å
96	H	27.9	Very low	31.6	Very low	200 Å²	200	136.5 Å²	136.5	93%	0.926	78%	0.777	S	S	*	*			trans	-71.1	121.1	-179.2	-72.7	-87.3	0	0	0	113.5
97	V	33	Very low	32	Very low	140 Å²	140	137.1 Å²	137.1	85%	0.848	77%	0.769	S	S	*	*			trans	-139.4	140	150.1	-176.4	0	0	0	0	109	G95	G95-V97 PolarHBondContact O-N 2.53Å
98	F	27.4	Very low	32.6	Very low	203 Å²	203	137.1 Å²	137.1	89%	0.89	77%	0.77	S	S	*	*			trans	-64.8	133.9	173.5	-95.9	-113.3	0	0	0	111.6
99	N	31.4	Very low	33.2	Very low	148 Å²	148	134.5 Å²	134.5	79%	0.791	77%	0.765	S	S	*	*			trans	-152.2	122.1	147.6	-132	-9.1	0	0	0	109.1
100	P	33.1	Very low	34	Very low	88 Å²	88	130.1 Å²	130.1	57%	0.571	75%	0.752	S	S	*	*			trans	-70.1	145.3	170.3	30.6	-33	0	0	0	109.6	L102	P100-L102 HydrophobicContact CG-CG 4.41Å; P100-L102 PolarHBondContact O-N 3.2Å
101	D	27.5	Very low	34.5	Very low	135 Å²	135	133 Å²	133	72%	0.722	75%	0.748	S	S	*	*			trans	-71.5	90.6	-179.4	-164.6	-28.3	0	0	0	110.8	S103	D101-S103 PolarHBondContact O-N 2.94Å; D101-S103 VanDerWaalsContact O-N 3.16Å; D101-S103 VanDerWaalsContact OD1-CB 3.24Å; D101-S103 WeakPolarHBondContact OD1-CB 3.3Å; D101-S103 PolarHBondContact OD1-N 3.07Å; D101-S103 PolarHBondContact OD1-OG 3.37Å
102	L	30.4	Very low	35.4	Very low	122 Å²	122	131.9 Å²	131.9	64%	0.639	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	38.2	177.9	-73.6	172.3	0	0	0	112.6	P100	P100-L102 HydrophobicContact CG-CG 4.41Å; P100-L102 PolarHBondContact O-N 3.2Å
103	S	34.8	Very low	37.1	Very low	102 Å²	102	129.2 Å²	129.2	71%	0.713	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	-11.3	163.6	53.6	0	0	0	0	113.2	D101 R105	D101-S103 PolarHBondContact O-N 2.94Å; D101-S103 VanDerWaalsContact O-N 3.16Å; D101-S103 VanDerWaalsContact OD1-CB 3.24Å; D101-S103 WeakPolarHBondContact OD1-CB 3.3Å; D101-S103 PolarHBondContact OD1-N 3.07Å; D101-S103 PolarHBondContact OD1-OG 3.37Å; S103-R105 PolarHBondContact O-N 2.76Å
104	D	32.2	Very low	38.8	Very low	116 Å²	116	129 Å²	129	62%	0.62	71%	0.709	S	S	*	*			trans	-87.2	73.1	171.4	-165.5	6.2	0	0	0	113
105	R	31.5	Very low	40.5	Very low	209 Å²	209	127 Å²	127	79%	0.789	69%	0.694	S	S	*	*			trans	-135.8	54.2	165.8	-80.5	-162.7	171.6	-166.4	-0.9	112.9	S103 I107	S103-R105 PolarHBondContact O-N 2.76Å; R105-I107 VanDerWaalsContact C-N 3.34Å
106	S	37.8	Very low	42.3	Very low	95 Å²	95	125.2 Å²	125.2	66%	0.664	67%	0.666	S	S	*	*			trans	-97.8	23.9	158.5	62.1	0	0	0	0	113.3	G108	S106-G108 VanDerWaalsContact C-N 3.27Å; S106-G108 PolarHBondContact O-N 3.17Å
107	I	35	Very low	44.6	Very low	153 Å²	153	121.5 Å²	121.5	79%	0.785	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	84.2	175.6	-54	175.3	0	0	0	109.1	R105	R105-I107 VanDerWaalsContact C-N 3.34Å
108	G	41.3	Very low	46.8	Very low	74 Å²	74	120.4 Å²	120.4	76%	0.763	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	178.9	-15.4	-176.4	0	0	0	0	0	115.9	S106	S106-G108 VanDerWaalsContact C-N 3.27Å; S106-G108 PolarHBondContact O-N 3.17Å
109	K	47.1	Very low	49.2	Very low	173 Å²	173	111.9 Å²	111.9	75%	0.752	60%	0.6	S	S	*	*	S	Bend	trans	-106.3	-11.5	178.1	-65.2	-174.3	175.5	-175.8	0	115	Y111 S113	K109-Y111 PolarHBondContact O-N 3.07Å; K109-S113 WeakPolarHBondContact O-CB 3.44Å
110	G	44.8	Very low	51.4	Low	46 Å²	46	106.7 Å²	106.7	47%	0.474	57%	0.572	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.8	30.5	-149.5	0	0	0	0	0	120.2
111	Y	47.1	Very low	53.8	Low	208 Å²	208	105.4 Å²	105.4	82%	0.816	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-144.5	-52.7	170.1	-73.2	-72.8	0	0	0	113.4	K109 S113 D114 H115	K109-Y111 PolarHBondContact O-N 3.07Å; Y111-S113 VanDerWaalsContact C-N 3.3Å; Y111-S113 PolarHBondContact O-N 3.27Å; Y111-D114 PolarHBondContact O-N 3.01Å; Y111-H115 PolarHBondContact O-N 2.58Å; Y111-H115 VanDerWaalsContact O-N 3.08Å
112	L	52.8	Low	56.4	Low	95 Å²	95	104.1 Å²	104.1	50%	0.497	55%	0.551	S	S	.	*	H	α-helix	trans	-65	-34.8	176.4	-94.1	165.3	0	0	0	112.1	D114 L116	L112-D114 VanDerWaalsContact C-N 3.34Å; L112-D114 PolarHBondContact O-N 2.84Å; L112-L116 WeakPolarHBondContact O-CB 3.39Å; L112-L116 PolarHBondContact O-N 3.45Å
113	S	65.7	Low	58.7	Low	58 Å²	58	98.4 Å²	98.4	41%	0.406	52%	0.522	S	S	.	.	H	α-helix	trans	-46.8	-57.1	167.5	162.8	0	0	0	0	111.4	K109 Y111 L116 Q117	K109-S113 WeakPolarHBondContact O-CB 3.44Å; Y111-S113 VanDerWaalsContact C-N 3.3Å; Y111-S113 PolarHBondContact O-N 3.27Å; S113-L116 PolarHBondContact O-N 2.94Å; S113-Q117 VanDerWaalsContact O-CB 3.26Å; S113-Q117 WeakPolarHBondContact O-CB 3.28Å; S113-Q117 PolarHBondContact O-N 2.79Å
114	D	70.5	Confident	61	Low	102 Å²	102	100.8 Å²	100.8	55%	0.545	52%	0.515	S	S	.	.	H	α-helix	trans	-79.3	-33.9	-165.1	-63.9	16.6	0	0	0	110.7	Y111 L112 H118	Y111-D114 PolarHBondContact O-N 3.01Å; L112-D114 VanDerWaalsContact C-N 3.34Å; L112-D114 PolarHBondContact O-N 2.84Å; D114-H118 WeakPolarHBondContact O-CB 3.16Å; D114-H118 PolarHBondContact O-N 3.32Å
115	H	66.2	Low	63.4	Low	122 Å²	122	102.8 Å²	102.8	57%	0.565	51%	0.514	S	S	*	.	H	α-helix	trans	-64.2	-43.7	169.3	-177.9	-89.9	0	0	0	112.4	Y111 S119	Y111-H115 PolarHBondContact O-N 2.58Å; Y111-H115 VanDerWaalsContact O-N 3.08Å; H115-S119 PolarHBondContact CE1-OG 2.89Å; H115-S119 WeakPolarHBondContact O-CB 3.48Å; H115-S119 PolarHBondContact O-N 3.09Å; H115-S119 PolarHBondContact O-OG 3.26Å
116	L	71.4	Confident	65.6	Low	40 Å²	40	93.6 Å²	93.6	21%	0.209	48%	0.48	C	S	.	.	H	α-helix	trans	-66.8	-43.2	177.6	-177.2	65.6	0	0	0	111.1	L112 S113 S119 L120 V194 A198	L112-L116 WeakPolarHBondContact O-CB 3.39Å; L112-L116 PolarHBondContact O-N 3.45Å; S113-L116 PolarHBondContact O-N 2.94Å; L116-S119 WeakPolarHBondContact O-CB 3.45Å; L116-S119 PolarHBondContact O-N 3.36Å; L116-L120 HydrophobicContact CG-CD1 4.16Å; L116-L120 WeakPolarHBondContact O-CB 3.21Å; L116-L120 WeakPolarHBondContact O-CG 3.42Å; L116-L120 PolarHBondContact O-N 2.92Å; L116-V194 HydrophobicContact CD1-CG1 4.21Å; L116-A198 HydrophobicContact CD1-CB 4.28Å; L116-A198 HydrophobicContact CD2-CB 4.17Å
117	Q	76.5	Confident	67.5	Low	122 Å²	122	93.4 Å²	93.4	57%	0.57	47%	0.468	S	S	*	.	H	α-helix	trans	-64.6	-41.3	176.8	-177.8	66.7	-12.4	0	0	111.7	S113 L120 S121	S113-Q117 VanDerWaalsContact O-CB 3.26Å; S113-Q117 WeakPolarHBondContact O-CB 3.28Å; S113-Q117 PolarHBondContact O-N 2.79Å; Q117-L120 PolarHBondContact O-N 3.03Å; Q117-S121 WeakPolarHBondContact O-CB 3.35Å; Q117-S121 PolarHBondContact O-N 3.1Å
118	H	78.1	Confident	69.8	Low	118 Å²	118	92.4 Å²	92.4	55%	0.546	46%	0.46	S	S	.	.	H	α-helix	trans	-59	-48.5	170.2	175.9	-99.2	0	0	0	110.9	D114 L120 S121 Y122	D114-H118 WeakPolarHBondContact O-CB 3.16Å; D114-H118 PolarHBondContact O-N 3.32Å; H118-L120 PolarHBondContact O-N 2.67Å; H118-S121 PolarHBondContact O-N 3.04Å; H118-S121 VanDerWaalsContact O-N 3.15Å; H118-S121 PolarHBondContact O-OG 3.49Å; H118-Y122 WeakPolarHBondContact O-CB 3.44Å; H118-Y122 PolarHBondContact O-N 2.92Å
119	S	77.5	Confident	71.6	Confident	24 Å²	24	95.6 Å²	95.6	17%	0.168	45%	0.449	C	S	.	.	H	α-helix	trans	-60.6	-42.1	179.2	-59.1	0	0	0	0	112.6	H115 L116 Y122 A123	H115-S119 PolarHBondContact CE1-OG 2.89Å; H115-S119 WeakPolarHBondContact O-CB 3.48Å; H115-S119 PolarHBondContact O-N 3.09Å; H115-S119 PolarHBondContact O-OG 3.26Å; L116-S119 WeakPolarHBondContact O-CB 3.45Å; L116-S119 PolarHBondContact O-N 3.36Å; S119-Y122 PolarHBondContact O-N 3.37Å; S119-A123 WeakPolarHBondContact O-CB 3.16Å; S119-A123 PolarHBondContact O-N 3.24Å
120	L	78.4	Confident	73.1	Confident	39 Å²	39	87.5 Å²	87.5	20%	0.204	42%	0.415	C	S	.	.	H	α-helix	trans	-64.1	-41.6	174	-75.8	166	0	0	0	111.6	L116 Q117 H118 Y122 R124 V194	L116-L120 HydrophobicContact CG-CD1 4.16Å; L116-L120 WeakPolarHBondContact O-CB 3.21Å; L116-L120 WeakPolarHBondContact O-CG 3.42Å; L116-L120 PolarHBondContact O-N 2.92Å; Q117-L120 PolarHBondContact O-N 3.03Å; H118-L120 PolarHBondContact O-N 2.67Å; L120-Y122 VanDerWaalsContact C-N 3.33Å; L120-R124 WeakPolarHBondContact O-CB 3.37Å; L120-R124 VanDerWaalsContact O-CG 3.32Å; L120-R124 WeakPolarHBondContact O-CG 3.43Å; L120-R124 PolarHBondContact O-N 3.43Å; L120-R124 VanDerWaalsContact O-N 3.08Å; L120-V194 HydrophobicContact CB-CG1 4.39Å; L120-V194 HydrophobicContact CD2-CG1 3.56Å; L120-V194 HydrophobicContact CG-CG1 3.63Å
121	S	84.2	Confident	74.7	Confident	61 Å²	61	90.4 Å²	90.4	43%	0.427	42%	0.419	S	S	.	.	H	α-helix	trans	-66	-36	176.1	83.1	0	0	0	0	112.4	Q117 H118 R125	Q117-S121 WeakPolarHBondContact O-CB 3.35Å; Q117-S121 PolarHBondContact O-N 3.1Å; H118-S121 PolarHBondContact O-N 3.04Å; H118-S121 VanDerWaalsContact O-N 3.15Å; H118-S121 PolarHBondContact O-OG 3.49Å; S121-R125 WeakPolarHBondContact O-CB 3.3Å; S121-R125 PolarHBondContact O-N 3.31Å; S121-R125 VanDerWaalsContact O-N 3.08Å
122	Y	81.3	Confident	76.2	Confident	108 Å²	108	86.5 Å²	86.5	42%	0.424	41%	0.408	S	S	.	.	H	α-helix	trans	-70	-46.6	176.6	176.8	-98.5	0	0	0	111.5	H118 S119 L120 R124 R125 M126 T190	H118-Y122 WeakPolarHBondContact O-CB 3.44Å; H118-Y122 PolarHBondContact O-N 2.92Å; S119-Y122 PolarHBondContact O-N 3.37Å; L120-Y122 VanDerWaalsContact C-N 3.33Å; Y122-R124 PolarHBondContact O-N 3.05Å; Y122-R125 CarbonylContact O-C 3.42Å; Y122-R125 PolarHBondContact O-N 3.4Å; Y122-R125 VanDerWaalsContact O-N 3.1Å; Y122-M126 HydrophobicContact CD1-CG 4.24Å; Y122-M126 HydrophobicContact CE1-CG 3.74Å; Y122-M126 HydrophobicContact CE2-CG 4.15Å; Y122-M126 HydrophobicContact CE2-SD 4.37Å; Y122-M126 WeakPolarHBondContact O-CG 3.44Å; Y122-M126 PolarHBondContact O-N 3.27Å; Y122-T190 HydrophobicContact CD1-CG2 4.4Å; Y122-T190 HydrophobicContact CE1-CG2 4.34Å
123	A	78.3	Confident	77.2	Confident	2 Å²	2	85.2 Å²	85.2	2%	0.017	40%	0.401	C	S	.	.	H	α-helix	trans	-56.9	-49.8	175.8	0	0	0	0	0	111.5	S119 R125 M126 E127 T190 V194	S119-A123 WeakPolarHBondContact O-CB 3.16Å; S119-A123 PolarHBondContact O-N 3.24Å; A123-R125 VanDerWaalsContact C-N 3.29Å; A123-R125 PolarHBondContact O-N 3.44Å; A123-M126 PolarHBondContact O-N 2.92Å; A123-M126 VanDerWaalsContact O-N 3.11Å; A123-E127 PolarHBondContact O-N 3.03Å; A123-T190 HydrophobicContact CB-CG2 4.19Å; A123-V194 HydrophobicContact CB-CG2 4.34Å
124	R	82.8	Confident	77.5	Confident	152 Å²	152	84.3 Å²	84.3	57%	0.574	40%	0.395	S	S	*	.	H	α-helix	trans	-58.1	-37.3	174.3	-72.1	172.9	177.9	175.7	1.4	112.9	L120 Y122 Q128	L120-R124 WeakPolarHBondContact O-CB 3.37Å; L120-R124 VanDerWaalsContact O-CG 3.32Å; L120-R124 WeakPolarHBondContact O-CG 3.43Å; L120-R124 PolarHBondContact O-N 3.43Å; L120-R124 VanDerWaalsContact O-N 3.08Å; Y122-R124 PolarHBondContact O-N 3.05Å; R124-Q128 WeakPolarHBondContact O-CB 3.27Å; R124-Q128 VanDerWaalsContact O-CG 3.23Å; R124-Q128 WeakPolarHBondContact O-CG 3.46Å; R124-Q128 PolarHBondContact O-N 3.47Å
125	R	82.8	Confident	77.6	Confident	157 Å²	157	81.9 Å²	81.9	59%	0.592	39%	0.388	S	S	*	.	H	α-helix	trans	-72.4	-32.2	176.9	-175.9	176.7	-73.6	172.5	-2.2	112.6	S121 Y122 A123 R129	S121-R125 WeakPolarHBondContact O-CB 3.3Å; S121-R125 PolarHBondContact O-N 3.31Å; S121-R125 VanDerWaalsContact O-N 3.08Å; Y122-R125 CarbonylContact O-C 3.42Å; Y122-R125 PolarHBondContact O-N 3.4Å; Y122-R125 VanDerWaalsContact O-N 3.1Å; A123-R125 VanDerWaalsContact C-N 3.29Å; A123-R125 PolarHBondContact O-N 3.44Å; R125-R129 WeakPolarHBondContact O-CG 3.23Å; R125-R129 PolarHBondContact O-N 2.96Å; R125-R129 VanDerWaalsContact O-N 3.17Å
126	M	77	Confident	77.7	Confident	17 Å²	17	83.4 Å²	83.4	8%	0.084	39%	0.389	C	S	.	.	H	α-helix	trans	-69	-44.8	171.8	-72.4	-66.6	-76.3	0	0	110.8	Y122 A123 Q128 R129 A130 F183	Y122-M126 HydrophobicContact CD1-CG 4.24Å; Y122-M126 HydrophobicContact CE1-CG 3.74Å; Y122-M126 HydrophobicContact CE2-CG 4.15Å; Y122-M126 HydrophobicContact CE2-SD 4.37Å; Y122-M126 WeakPolarHBondContact O-CG 3.44Å; Y122-M126 PolarHBondContact O-N 3.27Å; A123-M126 PolarHBondContact O-N 2.92Å; A123-M126 VanDerWaalsContact O-N 3.11Å; M126-Q128 PolarHBondContact O-N 3.17Å; M126-R129 WeakPolarHBondContact O-CA 3.2Å; M126-R129 WeakPolarHBondContact O-CB 3.47Å; M126-R129 PolarHBondContact O-N 3.02Å; M126-R129 VanDerWaalsContact O-N 3.09Å; M126-A130 PolarHBondContact O-N 3.11Å; M126-F183 HydrophobicContact CE-CE1 4.42Å; M126-F183 HydrophobicContact CE-CE2 3.96Å; M126-F183 HydrophobicContact CE-CZ 3.67Å; M126-F183 WeakPolarHBondContact O-CE1 3.45Å; M126-F183 HydrophobicContact SD-CZ 4.05Å
127	E	78.7	Confident	77.3	Confident	90 Å²	90	82.8 Å²	82.8	42%	0.421	39%	0.386	S	S	.	.	H	α-helix	trans	-58.5	-46.9	175.6	-177.8	-178.3	-165.3	0	0	112.1	A123 R129 A130 L131 S187	A123-E127 PolarHBondContact O-N 3.03Å; E127-R129 VanDerWaalsContact C-N 3.3Å; E127-R129 PolarHBondContact O-N 3.05Å; E127-A130 WeakPolarHBondContact O-CB 3.41Å; E127-A130 PolarHBondContact O-N 3.17Å; E127-A130 VanDerWaalsContact O-N 3.1Å; E127-L131 HydrophobicContact CG-CD1 4.42Å; E127-L131 WeakPolarHBondContact O-CG 3.24Å; E127-L131 PolarHBondContact O-N 3.45Å; E127-S187 VanDerWaalsContact CA-OG 3.28Å; E127-S187 WeakPolarHBondContact CA-OG 3.29Å; E127-S187 PolarHBondContact N-OG 3.04Å; E127-S187 VanDerWaalsContact N-OG 3.16Å
128	Q	83.3	Confident	76.8	Confident	132 Å²	132	80.5 Å²	80.5	62%	0.617	38%	0.384	S	S	*	.	H	α-helix	trans	-58.5	-39.6	173.7	-74.7	170.3	-3.5	0	0	112.7	R124 M126 H132	R124-Q128 WeakPolarHBondContact O-CB 3.27Å; R124-Q128 VanDerWaalsContact O-CG 3.23Å; R124-Q128 WeakPolarHBondContact O-CG 3.46Å; R124-Q128 PolarHBondContact O-N 3.47Å; M126-Q128 PolarHBondContact O-N 3.17Å; Q128-H132 WeakPolarHBondContact O-CB 3.49Å; Q128-H132 PolarHBondContact O-N 3.17Å
129	R	78.2	Confident	76	Confident	141 Å²	141	81.6 Å²	81.6	53%	0.532	39%	0.389	S	S	.	.	H	α-helix	trans	-66	-40.2	174.1	-76.7	171.1	169.3	-173.7	-5.2	111.7	R125 M126 E127 H132 I133 F183	R125-R129 WeakPolarHBondContact O-CG 3.23Å; R125-R129 PolarHBondContact O-N 2.96Å; R125-R129 VanDerWaalsContact O-N 3.17Å; M126-R129 WeakPolarHBondContact O-CA 3.2Å; M126-R129 WeakPolarHBondContact O-CB 3.47Å; M126-R129 PolarHBondContact O-N 3.02Å; M126-R129 VanDerWaalsContact O-N 3.09Å; E127-R129 VanDerWaalsContact C-N 3.3Å; E127-R129 PolarHBondContact O-N 3.05Å; R129-H132 PolarHBondContact O-N 3.02Å; R129-I133 WeakPolarHBondContact O-CD1 3.49Å; R129-I133 VanDerWaalsContact O-CG1 3.25Å; R129-I133 WeakPolarHBondContact O-CG1 3.46Å; R129-I133 PolarHBondContact O-N 3.37Å; R129-F183 HydrophobicContact CB-CE1 4.1Å; R129-F183 HydrophobicContact CB-CZ 3.82Å
130	A	78.6	Confident	75.1	Confident	3 Å²	3	83.8 Å²	83.8	3%	0.025	40%	0.404	C	S	.	.	H	α-helix	trans	-58.6	-53.5	177.4	0	0	0	0	0	110.4	M126 E127 H132 I133 S134 F183 M184	M126-A130 PolarHBondContact O-N 3.11Å; E127-A130 WeakPolarHBondContact O-CB 3.41Å; E127-A130 PolarHBondContact O-N 3.17Å; E127-A130 VanDerWaalsContact O-N 3.1Å; A130-H132 VanDerWaalsContact C-N 3.32Å; A130-H132 PolarHBondContact O-N 3.41Å; A130-I133 PolarHBondContact O-N 2.96Å; A130-S134 WeakPolarHBondContact O-CB 3.4Å; A130-S134 PolarHBondContact O-N 2.84Å; A130-F183 HydrophobicContact CB-CD1 3.64Å; A130-F183 HydrophobicContact CB-CE1 3.64Å; A130-M184 VanDerWaalsContact C-CE 3.44Å; A130-M184 HydrophobicContact CB-CE 3.74Å; A130-M184 HydrophobicContact CB-SD 3.69Å; A130-M184 VanDerWaalsContact O-CE 3.22Å; A130-M184 WeakPolarHBondContact O-CE 3.43Å
131	L	80.3	Confident	73.9	Confident	107 Å²	107	84.8 Å²	84.8	56%	0.56	42%	0.418	S	S	*	.	H	α-helix	trans	-59.8	-39.9	178.2	-66	172	0	0	0	112.2	E127 S134 A135	E127-L131 HydrophobicContact CG-CD1 4.42Å; E127-L131 WeakPolarHBondContact O-CG 3.24Å; E127-L131 PolarHBondContact O-N 3.45Å; L131-S134 PolarHBondContact O-N 2.85Å; L131-A135 WeakPolarHBondContact O-CB 3.43Å; L131-A135 PolarHBondContact O-N 2.88Å
132	H	77.8	Confident	72.2	Confident	127 Å²	127	88.1 Å²	88.1	59%	0.588	43%	0.431	S	S	*	.	H	α-helix	trans	-66.4	-43.4	178.1	-169	113.2	0	0	0	112.8	Q128 R129 A130 R136	Q128-H132 WeakPolarHBondContact O-CB 3.49Å; Q128-H132 PolarHBondContact O-N 3.17Å; R129-H132 PolarHBondContact O-N 3.02Å; A130-H132 VanDerWaalsContact C-N 3.32Å; A130-H132 PolarHBondContact O-N 3.41Å; H132-R136 PolarHBondContact NE2-NE 3.45Å; H132-R136 PolarHBondContact NE2-NH2 2.75Å; H132-R136 PolarHBondContact O-N 2.97Å
133	I	73.9	Confident	70.5	Confident	68 Å²	68	90.3 Å²	90.3	35%	0.349	45%	0.449	S	S	.	.	H	α-helix	trans	-69.6	-37.6	177.5	-56.6	160.2	0	0	0	109.6	R129 A130 R136 I137 M180	R129-I133 WeakPolarHBondContact O-CD1 3.49Å; R129-I133 VanDerWaalsContact O-CG1 3.25Å; R129-I133 WeakPolarHBondContact O-CG1 3.46Å; R129-I133 PolarHBondContact O-N 3.37Å; A130-I133 PolarHBondContact O-N 2.96Å; I133-R136 WeakPolarHBondContact O-CB 3.39Å; I133-R136 PolarHBondContact O-N 2.97Å; I133-I137 HydrophobicContact CG2-CD1 4.22Å; I133-I137 PolarHBondContact O-N 3.12Å; I133-M180 VanDerWaalsContact C-CE 3.43Å; I133-M180 HydrophobicContact CB-CE 3.55Å; I133-M180 HydrophobicContact CG2-CE 3.37Å
134	S	71.9	Confident	68.8	Low	39 Å²	39	95.2 Å²	95.2	27%	0.273	48%	0.484	S	S	.	.	H	α-helix	trans	-63.4	-45.9	175.9	177.6	0	0	0	0	112	A130 L131 R136 I137 S138 M184	A130-S134 WeakPolarHBondContact O-CB 3.4Å; A130-S134 PolarHBondContact O-N 2.84Å; L131-S134 PolarHBondContact O-N 2.85Å; S134-R136 PolarHBondContact O-N 3.41Å; S134-I137 PolarHBondContact O-N 3Å; S134-S138 PolarHBondContact O-N 3.36Å; S134-S138 PolarHBondContact O-OG 3.25Å; S134-M184 VanDerWaalsContact CB-CE 3.43Å
135	A	73.3	Confident	66.8	Low	50 Å²	50	94.5 Å²	94.5	41%	0.413	49%	0.488	S	S	.	.	H	α-helix	trans	-59.3	-34.9	175.1	0	0	0	0	0	112.7	L131 Q139	L131-A135 WeakPolarHBondContact O-CB 3.43Å; L131-A135 PolarHBondContact O-N 2.88Å; A135-Q139 VanDerWaalsContact O-CG 3.24Å; A135-Q139 WeakPolarHBondContact O-CG 3.32Å; A135-Q139 PolarHBondContact O-N 3.44Å
136	R	67.6	Low	65	Low	154 Å²	154	90.3 Å²	90.3	58%	0.581	48%	0.483	S	S	*	.	H	α-helix	trans	-68.6	-42.8	171.8	-75.6	-177.7	170.5	-176	-0.9	112.6	H132 I133 S134 Q139 S140	H132-R136 PolarHBondContact NE2-NE 3.45Å; H132-R136 PolarHBondContact NE2-NH2 2.75Å; H132-R136 PolarHBondContact O-N 2.97Å; I133-R136 WeakPolarHBondContact O-CB 3.39Å; I133-R136 PolarHBondContact O-N 2.97Å; S134-R136 PolarHBondContact O-N 3.41Å; R136-Q139 WeakPolarHBondContact O-CB 3.47Å; R136-Q139 PolarHBondContact O-N 2.89Å; R136-Q139 VanDerWaalsContact O-N 3.12Å; R136-S140 PolarHBondContact O-N 2.69Å; R136-S140 VanDerWaalsContact O-N 3.11Å; R136-S140 PolarHBondContact O-OG 3.02Å
137	I	63.1	Low	63.6	Low	27 Å²	27	94.3 Å²	94.3	14%	0.138	51%	0.51	C	S	.	.	H	α-helix	trans	-67.7	-40	179.3	-71.9	176.5	0	0	0	111.1	I133 S134 Q139 S140 A141 M180	I133-I137 HydrophobicContact CG2-CD1 4.22Å; I133-I137 PolarHBondContact O-N 3.12Å; S134-I137 PolarHBondContact O-N 3Å; I137-Q139 PolarHBondContact O-N 3.06Å; I137-S140 WeakPolarHBondContact CA-OG 3.3Å; I137-S140 CarbonylContact O-C 3.59Å; I137-S140 PolarHBondContact O-N 3.44Å; I137-S140 PolarHBondContact O-OG 3.44Å; I137-S140 VanDerWaalsContact O-OG 3.07Å; I137-A141 WeakPolarHBondContact O-CB 3.45Å; I137-A141 PolarHBondContact O-N 3.1Å; I137-M180 HydrophobicContact CD1-CB 3.56Å; I137-M180 HydrophobicContact CD1-CE 4Å; I137-M180 HydrophobicContact CD1-CG 3.95Å
138	S	65	Low	62	Low	75 Å²	75	100.5 Å²	100.5	52%	0.524	53%	0.53	S	S	.	.	H	α-helix	trans	-61	-23.5	171.6	-59.4	0	0	0	0	113.4	S134 N142	S134-S138 PolarHBondContact O-N 3.36Å; S134-S138 PolarHBondContact O-OG 3.25Å; S138-N142 PolarHBondContact O-ND2 2.71Å
139	Q	62.4	Low	60.4	Low	141 Å²	141	97.2 Å²	97.2	66%	0.659	52%	0.516	S	S	*	.	H	α-helix	trans	-78.8	-38.4	172.4	-70.5	163.6	5.1	0	0	111.8	A135 R136 I137 N142	A135-Q139 VanDerWaalsContact O-CG 3.24Å; A135-Q139 WeakPolarHBondContact O-CG 3.32Å; A135-Q139 PolarHBondContact O-N 3.44Å; R136-Q139 WeakPolarHBondContact O-CB 3.47Å; R136-Q139 PolarHBondContact O-N 2.89Å; R136-Q139 VanDerWaalsContact O-N 3.12Å; I137-Q139 PolarHBondContact O-N 3.06Å; Q139-N142 PolarHBondContact O-ND2 3.01Å
140	S	59.4	Low	58.8	Low	70 Å²	70	94 Å²	94	49%	0.49	51%	0.509	S	S	.	.	H	α-helix	trans	-80.5	-24.3	175.9	52.8	0	0	0	0	114.8	R136 I137 N142 L143	R136-S140 PolarHBondContact O-N 2.69Å; R136-S140 VanDerWaalsContact O-N 3.11Å; R136-S140 PolarHBondContact O-OG 3.02Å; I137-S140 WeakPolarHBondContact CA-OG 3.3Å; I137-S140 CarbonylContact O-C 3.59Å; I137-S140 PolarHBondContact O-N 3.44Å; I137-S140 PolarHBondContact O-OG 3.44Å; I137-S140 VanDerWaalsContact O-OG 3.07Å; S140-N142 PolarHBondContact O-N 2.88Å; S140-L143 PolarHBondContact O-N 2.76Å
141	A	51.9	Low	57.4	Low	60 Å²	60	102.4 Å²	102.4	50%	0.496	55%	0.546	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-4.9	-177.8	0	0	0	0	0	114.3	I137 L143	I137-A141 WeakPolarHBondContact O-CB 3.45Å; I137-A141 PolarHBondContact O-N 3.1Å; A141-L143 PolarHBondContact O-N 3.09Å
142	N	48	Very low	55.8	Low	131 Å²	131	101.6 Å²	101.6	70%	0.701	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	8.2	168.9	-60.8	-71.5	0	0	0	113.5	S138 Q139 S140	S138-N142 PolarHBondContact O-ND2 2.71Å; Q139-N142 PolarHBondContact O-ND2 3.01Å; S140-N142 PolarHBondContact O-N 2.88Å
143	L	46.8	Very low	54.3	Low	154 Å²	154	100.6 Å²	100.6	81%	0.806	55%	0.55	S	S	*	.	S	Bend	trans	-119.8	69.7	175.3	-64.2	175.3	0	0	0	110.3	S140 A141	S140-L143 PolarHBondContact O-N 2.76Å; A141-L143 PolarHBondContact O-N 3.09Å
144	S	41.7	Very low	53	Low	105 Å²	105	104.2 Å²	104.2	73%	0.734	57%	0.565	S	S	*	*			trans	-70.4	131.2	-174.9	52.1	0	0	0	0	113.6
145	M	42.3	Very low	51.7	Low	136 Å²	136	108.3 Å²	108.3	67%	0.67	59%	0.589	S	S	*	*			trans	-146.8	156.5	165.4	-84.8	-54.1	-66.3	0	0	112.4	K170	M145-K170 HydrophobicContact CG-CD 4.45Å
146	S	43.6	Very low	50.2	Low	70 Å²	70	111.3 Å²	111.3	49%	0.49	61%	0.605	S	S	.	*			trans	-74.2	148.2	-167.2	-176.4	0	0	0	0	115.2	R148	S146-R148 PolarHBondContact O-N 3.3Å
147	P	47.3	Very low	48.8	Very low	100 Å²	100	111.4 Å²	111.4	65%	0.649	62%	0.618	S	S	*	*	G	3₁₀ helix	trans	-61.4	-3.1	-178.6	-26.5	35.8	0	0	0	118.3	L149	P147-L149 PolarHBondContact O-N 3.38Å
148	R	46.5	Very low	47.6	Very low	220 Å²	220	115 Å²	115	83%	0.83	65%	0.645	S	S	*	*	G	3₁₀ helix	trans	-62.9	-9.5	-175.2	-88.9	-177.2	166	158.4	-2.8	115.6	S146	S146-R148 PolarHBondContact O-N 3.3Å
149	L	48.8	Very low	46.7	Very low	64 Å²	64	116.9 Å²	116.9	34%	0.335	66%	0.658	S	S	.	*	G	3₁₀ helix	trans	-94.7	0.8	-170.5	-64	169.8	0	0	0	115.1	P147 F151 K170	P147-L149 PolarHBondContact O-N 3.38Å; L149-F151 VanDerWaalsContact C-N 3.35Å; L149-K170 HydrophobicContact CD1-CB 3.74Å; L149-K170 HydrophobicContact CD1-CD 3.35Å; L149-K170 HydrophobicContact CD1-CG 4.08Å
150	L	45.5	Very low	46.1	Very low	73 Å²	73	115.8 Å²	115.8	38%	0.382	66%	0.657	S	S	.	*	G	3₁₀ helix	trans	-72	-25.6	177.1	-81.6	169.1	0	0	0	114.1	V174	L150-V174 HydrophobicContact CD1-CG1 4.03Å; L150-V174 HydrophobicContact CD2-CB 4.13Å; L150-V174 HydrophobicContact CD2-CG1 3.76Å; L150-V174 HydrophobicContact CG-CG1 4.11Å
151	F	48.3	Very low	45.9	Very low	180 Å²	180	118.1 Å²	118.1	79%	0.789	67%	0.668	S	S	*	*	S	Bend	trans	-124	6.8	-163.1	-57.4	-69.1	0	0	0	114.9	L149	L149-F151 VanDerWaalsContact C-N 3.35Å
152	T	47.4	Very low	46.2	Very low	90 Å²	90	118.6 Å²	118.6	55%	0.552	67%	0.673	S	S	*	*			trans	-76	124.2	172.3	34.7	0	0	0	0	110.9
153	P	45.9	Very low	46.6	Very low	105 Å²	105	117.8 Å²	117.8	68%	0.682	67%	0.668	S	S	*	*			trans	-74.7	151.4	-178.1	31	-35.6	0	0	0	112.7	T155	P153-T155 PolarHBondContact O-N 3.07Å
154	E	46.3	Very low	47.3	Very low	144 Å²	144	114.5 Å²	114.5	67%	0.673	66%	0.658	S	S	*	*			trans	-80.8	58.4	-178	-68.9	172.1	-132	0	0	113	C156 R171	E154-C156 PolarHBondContact O-N 2.83Å; E154-R171 IonicContact OE1-CZ 2.99Å; E154-R171 IonicContact OE1-NH1 2.91Å; E154-R171 PolarHBondContact OE1-NH1 3.12Å; E154-R171 IonicContact OE1-NH2 3.62Å; E154-R171 PolarHBondContact OE1-NH2 3.26Å
155	T	44.1	Very low	48.3	Very low	125 Å²	125	113.7 Å²	113.7	77%	0.767	65%	0.645	S	S	*	*			trans	-82.6	88.4	171	53.6	0	0	0	0	110.5	P153 N157	P153-T155 PolarHBondContact O-N 3.07Å; T155-N157 PolarHBondContact O-N 2.96Å
156	C	43.4	Very low	49.4	Very low	113 Å²	113	108.6 Å²	108.6	76%	0.764	62%	0.623	S	S	*	*			trans	-65	129.8	175.9	-69	0	0	0	0	112.2	E154	E154-C156 PolarHBondContact O-N 2.83Å
157	N	37.1	Very low	50.5	Low	157 Å²	157	106.6 Å²	106.6	84%	0.84	61%	0.613	S	S	*	*			trans	-167.6	159.5	140.8	-98.1	-32.7	0	0	0	110.9	T155	T155-N157 PolarHBondContact O-N 2.96Å
158	S	38.5	Very low	51.4	Low	103 Å²	103	108 Å²	108	72%	0.72	61%	0.611	S	S	*	*	S	Bend	trans	62.1	102	175.1	40.5	0	0	0	0	119.4	D160	S158-D160 PolarHBondContact O-N 3.09Å; S158-D160 VanDerWaalsContact O-N 3.11Å
159	S	44.9	Very low	52.5	Low	114 Å²	114	106.6 Å²	106.6	80%	0.797	61%	0.605	S	S	*	*	S	Bend		70	-13.4	127.7	58.5	0	0	0	0	124.7
160	D	50.2	Low	53.4	Low	118 Å²	118	106.6 Å²	106.6	63%	0.631	60%	0.603	S	S	*	*			trans	-114.3	95.6	179.3	-85.8	-68	0	0	0	115.1	S158 A162	S158-D160 PolarHBondContact O-N 3.09Å; S158-D160 VanDerWaalsContact O-N 3.11Å; D160-A162 VanDerWaalsContact C-N 3.35Å; D160-A162 PolarHBondContact O-N 3.47Å
161	T	55.9	Low	54.4	Low	118 Å²	118	108.9 Å²	108.9	72%	0.724	61%	0.606	S	S	*	*	H	α-helix	trans	-70.5	-27.1	-179.6	52.8	0	0	0	0	113.7	L165	T161-L165 WeakPolarHBondContact O-CG 3.49Å; T161-L165 PolarHBondContact O-N 2.79Å
162	A	57	Low	55.4	Low	71 Å²	71	105 Å²	105	59%	0.587	59%	0.591	S	S	*	*	H	α-helix	trans	-66.2	-42.9	178.9	0	0	0	0	0	112	D160 L165 S166	D160-A162 VanDerWaalsContact C-N 3.35Å; D160-A162 PolarHBondContact O-N 3.47Å; A162-L165 PolarHBondContact O-N 3.33Å; A162-S166 PolarHBondContact O-N 3.46Å
163	D	56.8	Low	56.6	Low	113 Å²	113	103.3 Å²	103.3	60%	0.604	58%	0.583	S	S	*	*	H	α-helix	trans	-78.6	-31.1	-176.3	-108.7	-27	0	0	0	113.4	L165 S166 G167	D163-L165 VanDerWaalsContact C-N 3.33Å; D163-L165 PolarHBondContact O-N 2.91Å; D163-S166 WeakPolarHBondContact O-CB 3.25Å; D163-S166 PolarHBondContact O-N 3.37Å; D163-S166 VanDerWaalsContact O-N 3.11Å; D163-S166 PolarHBondContact O-OG 2.99Å; D163-S166 PolarHBondContact OD1-OG 2.87Å; D163-G167 PolarHBondContact O-N 3.02Å
164	S	61.8	Low	57.9	Low	85 Å²	85	100.8 Å²	100.8	59%	0.594	57%	0.565	S	S	*	*	H	α-helix	trans	-57.1	-46.8	169.1	-176.4	0	0	0	0	111.5	S166 G167 Q168	S164-S166 VanDerWaalsContact C-N 3.33Å; S164-S166 PolarHBondContact O-N 3.19Å; S164-G167 PolarHBondContact O-N 2.67Å; S164-Q168 WeakPolarHBondContact O-CB 3.39Å; S164-Q168 PolarHBondContact O-N 3.16Å
165	L	63.1	Low	59.1	Low	89 Å²	89	97 Å²	97	47%	0.466	55%	0.552	S	S	.	*	H	α-helix	trans	-66.2	-33.3	174.2	-68.8	172.1	0	0	0	112.6	T161 A162 D163 R169	T161-L165 WeakPolarHBondContact O-CG 3.49Å; T161-L165 PolarHBondContact O-N 2.79Å; A162-L165 PolarHBondContact O-N 3.33Å; D163-L165 VanDerWaalsContact C-N 3.33Å; D163-L165 PolarHBondContact O-N 2.91Å; L165-R169 WeakPolarHBondContact O-CB 3.44Å; L165-R169 VanDerWaalsContact O-CG 3.28Å; L165-R169 WeakPolarHBondContact O-CG 3.1Å; L165-R169 PolarHBondContact O-N 3.42Å; L165-R169 VanDerWaalsContact O-N 3.08Å
166	S	66	Low	60.5	Low	29 Å²	29	94.2 Å²	94.2	20%	0.203	53%	0.532	C	S	.	.	H	α-helix	trans	-65.8	-42.9	175.4	113.9	0	0	0	0	111.3	A162 D163 S164 K170	A162-S166 PolarHBondContact O-N 3.46Å; D163-S166 WeakPolarHBondContact O-CB 3.25Å; D163-S166 PolarHBondContact O-N 3.37Å; D163-S166 VanDerWaalsContact O-N 3.11Å; D163-S166 PolarHBondContact O-OG 2.99Å; D163-S166 PolarHBondContact OD1-OG 2.87Å; S164-S166 VanDerWaalsContact C-N 3.33Å; S164-S166 PolarHBondContact O-N 3.19Å; S166-K170 VanDerWaalsContact O-CD 3.25Å; S166-K170 WeakPolarHBondContact O-CD 3.42Å; S166-K170 WeakPolarHBondContact O-CE 3.47Å; S166-K170 WeakPolarHBondContact O-CG 3.5Å; S166-K170 PolarHBondContact O-N 3.13Å; S166-K170 PolarHBondContact OG-NZ 3.43Å
167	G	65.7	Low	62	Low	27 Å²	27	92.3 Å²	92.3	28%	0.278	51%	0.514	S	S	.	.	H	α-helix	trans	-65	-47.1	174	0	0	0	0	0	112.8	D163 S164 R169 K170 R171	D163-G167 PolarHBondContact O-N 3.02Å; S164-G167 PolarHBondContact O-N 2.67Å; G167-R169 PolarHBondContact O-N 2.93Å; G167-K170 PolarHBondContact O-N 3.42Å; G167-R171 PolarHBondContact O-N 3.22Å
168	Q	67.4	Low	63.7	Low	131 Å²	131	90.2 Å²	90.2	61%	0.612	50%	0.503	S	S	*	.	H	α-helix	trans	-59.5	-44.3	179.1	-169.7	-178.8	11.3	0	0	112	S164 R171 Q172	S164-Q168 WeakPolarHBondContact O-CB 3.39Å; S164-Q168 PolarHBondContact O-N 3.16Å; Q168-R171 PolarHBondContact O-N 2.92Å; Q168-Q172 WeakPolarHBondContact O-CB 3.34Å; Q168-Q172 PolarHBondContact O-N 3.39Å
169	R	68.6	Low	65.2	Low	189 Å²	189	89.8 Å²	89.8	71%	0.713	49%	0.492	S	S	*	.	H	α-helix	trans	-62	-42.3	175.8	-73.8	174	-177.1	-176.3	2.7	112.7	L165 G167 Q172 S173	L165-R169 WeakPolarHBondContact O-CB 3.44Å; L165-R169 VanDerWaalsContact O-CG 3.28Å; L165-R169 WeakPolarHBondContact O-CG 3.1Å; L165-R169 PolarHBondContact O-N 3.42Å; L165-R169 VanDerWaalsContact O-N 3.08Å; G167-R169 PolarHBondContact O-N 2.93Å; R169-Q172 PolarHBondContact O-N 2.85Å; R169-S173 PolarHBondContact O-N 3.04Å
170	K	66.8	Low	66.6	Low	65 Å²	65	85.4 Å²	85.4	28%	0.283	46%	0.459	S	S	.	.	H	α-helix	trans	-66.8	-39.3	178.7	-67.4	161.8	-163.7	161.6	0	111.2	M145 L149 S166 G167 S173 V174	M145-K170 HydrophobicContact CG-CD 4.45Å; L149-K170 HydrophobicContact CD1-CB 3.74Å; L149-K170 HydrophobicContact CD1-CD 3.35Å; L149-K170 HydrophobicContact CD1-CG 4.08Å; S166-K170 VanDerWaalsContact O-CD 3.25Å; S166-K170 WeakPolarHBondContact O-CD 3.42Å; S166-K170 WeakPolarHBondContact O-CE 3.47Å; S166-K170 WeakPolarHBondContact O-CG 3.5Å; S166-K170 PolarHBondContact O-N 3.13Å; S166-K170 PolarHBondContact OG-NZ 3.43Å; G167-K170 PolarHBondContact O-N 3.42Å; K170-S173 WeakPolarHBondContact O-CB 3.37Å; K170-S173 PolarHBondContact O-N 2.67Å; K170-V174 PolarHBondContact O-N 2.93Å
171	R	66.8	Low	67.8	Low	120 Å²	120	86 Å²	86	45%	0.453	46%	0.458	S	S	.	.	H	α-helix	trans	-64.2	-41.5	173.6	-162	-170.8	-161.2	176.2	11.5	112.2	E154 G167 Q168 V174 V175	E154-R171 IonicContact OE1-CZ 2.99Å; E154-R171 IonicContact OE1-NH1 2.91Å; E154-R171 PolarHBondContact OE1-NH1 3.12Å; E154-R171 IonicContact OE1-NH2 3.62Å; E154-R171 PolarHBondContact OE1-NH2 3.26Å; G167-R171 PolarHBondContact O-N 3.22Å; Q168-R171 PolarHBondContact O-N 2.92Å; R171-V174 PolarHBondContact O-N 3.04Å; R171-V175 WeakPolarHBondContact O-CG2 3.38Å; R171-V175 PolarHBondContact O-N 3.34Å
172	Q	71	Confident	68.5	Low	100 Å²	100	83.6 Å²	83.6	47%	0.467	44%	0.443	S	S	.	.	H	α-helix	trans	-59.4	-46.1	174.9	-176	60.7	50.8	0	0	111.2	Q168 R169 V174 V175 D176	Q168-Q172 WeakPolarHBondContact O-CB 3.34Å; Q168-Q172 PolarHBondContact O-N 3.39Å; R169-Q172 PolarHBondContact O-N 2.85Å; Q172-V174 VanDerWaalsContact C-N 3.34Å; Q172-V174 PolarHBondContact O-N 3.34Å; Q172-V175 WeakPolarHBondContact O-CB 3.48Å; Q172-V175 PolarHBondContact O-N 3.03Å; Q172-V175 VanDerWaalsContact O-N 3.11Å; Q172-D176 WeakPolarHBondContact CG-OD2 3.24Å; Q172-D176 VanDerWaalsContact NE2-CG 3.32Å; Q172-D176 PolarHBondContact NE2-OD1 3.2Å; Q172-D176 PolarHBondContact NE2-OD2 3.46Å; Q172-D176 VanDerWaalsContact NE2-OD2 3.16Å; Q172-D176 VanDerWaalsContact O-CG 3.3Å; Q172-D176 PolarHBondContact O-N 3.34Å
173	S	71.7	Confident	69.3	Low	54 Å²	54	82.6 Å²	82.6	38%	0.378	43%	0.426	S	S	.	.	H	α-helix	trans	-53.8	-46.7	177.6	-165	0	0	0	0	112.7	R169 K170 V175 D176 D177	R169-S173 PolarHBondContact O-N 3.04Å; K170-S173 WeakPolarHBondContact O-CB 3.37Å; K170-S173 PolarHBondContact O-N 2.67Å; S173-V175 VanDerWaalsContact C-N 3.34Å; S173-V175 PolarHBondContact O-N 3.28Å; S173-D176 PolarHBondContact O-N 2.9Å; S173-D176 VanDerWaalsContact O-N 3.16Å; S173-D177 VanDerWaalsContact O-CG 3.31Å; S173-D177 PolarHBondContact O-N 3.34Å
174	V	73.5	Confident	70.2	Confident	52 Å²	52	79.3 Å²	79.3	32%	0.315	41%	0.407	S	S	.	.	H	α-helix	trans	-71.9	-29.9	-178.6	-170.5	0	0	0	0	112.2	L150 K170 R171 Q172 D176 L178	L150-V174 HydrophobicContact CD1-CG1 4.03Å; L150-V174 HydrophobicContact CD2-CB 4.13Å; L150-V174 HydrophobicContact CD2-CG1 3.76Å; L150-V174 HydrophobicContact CG-CG1 4.11Å; K170-V174 PolarHBondContact O-N 2.93Å; R171-V174 PolarHBondContact O-N 3.04Å; Q172-V174 VanDerWaalsContact C-N 3.34Å; Q172-V174 PolarHBondContact O-N 3.34Å; V174-D176 VanDerWaalsContact C-N 3.34Å; V174-L178 WeakPolarHBondContact O-CB 3.44Å; V174-L178 PolarHBondContact O-N 2.9Å
175	V	71.3	Confident	70.9	Confident	65 Å²	65	77.6 Å²	77.6	39%	0.394	39%	0.393	S	S	.	.	H	α-helix	trans	-65.7	-39.7	170	169.7	0	0	0	0	110.6	R171 Q172 S173 L178 N179	R171-V175 WeakPolarHBondContact O-CG2 3.38Å; R171-V175 PolarHBondContact O-N 3.34Å; Q172-V175 WeakPolarHBondContact O-CB 3.48Å; Q172-V175 PolarHBondContact O-N 3.03Å; Q172-V175 VanDerWaalsContact O-N 3.11Å; S173-V175 VanDerWaalsContact C-N 3.34Å; S173-V175 PolarHBondContact O-N 3.28Å; V175-L178 PolarHBondContact O-N 3.49Å; V175-N179 WeakPolarHBondContact O-CB 3.47Å; V175-N179 PolarHBondContact O-N 3.41Å; V175-N179 PolarHBondContact O-ND2 2.84Å
176	D	74.1	Confident	71.3	Confident	65 Å²	65	77.1 Å²	77.1	35%	0.348	39%	0.391	S	S	.	.	H	α-helix	trans	-69.4	-38.7	177.2	-64.5	-29.3	0	0	0	112.2	Q172 S173 V174 N179 M180	Q172-D176 WeakPolarHBondContact CG-OD2 3.24Å; Q172-D176 VanDerWaalsContact NE2-CG 3.32Å; Q172-D176 PolarHBondContact NE2-OD1 3.2Å; Q172-D176 PolarHBondContact NE2-OD2 3.46Å; Q172-D176 VanDerWaalsContact NE2-OD2 3.16Å; Q172-D176 VanDerWaalsContact O-CG 3.3Å; Q172-D176 PolarHBondContact O-N 3.34Å; S173-D176 PolarHBondContact O-N 2.9Å; S173-D176 VanDerWaalsContact O-N 3.16Å; V174-D176 VanDerWaalsContact C-N 3.34Å; D176-N179 PolarHBondContact O-N 3.18Å; D176-M180 VanDerWaalsContact O-CB 3.28Å; D176-M180 WeakPolarHBondContact O-CB 3.35Å; D176-M180 PolarHBondContact O-N 3.11Å
177	D	73.8	Confident	71.8	Confident	73 Å²	73	76 Å²	76	39%	0.39	38%	0.383	S	S	.	.	H	α-helix	trans	-63.1	-41.6	172.7	-69.1	-38.7	0	0	0	112.2	S173 M180 H181	S173-D177 VanDerWaalsContact O-CG 3.31Å; S173-D177 PolarHBondContact O-N 3.34Å; D177-M180 WeakPolarHBondContact O-CB 3.35Å; D177-M180 PolarHBondContact O-N 3.25Å; D177-H181 PolarHBondContact O-N 2.97Å
178	L	72.4	Confident	72.4	Confident	114 Å²	114	81.2 Å²	81.2	60%	0.597	40%	0.4	S	S	*	.	H	α-helix	trans	-65.2	-48.2	175.1	-179.9	62.1	0	0	0	111.2	V174 V175 M180 H181 T182	V174-L178 WeakPolarHBondContact O-CB 3.44Å; V174-L178 PolarHBondContact O-N 2.9Å; V175-L178 PolarHBondContact O-N 3.49Å; L178-M180 PolarHBondContact O-N 3.41Å; L178-H181 PolarHBondContact O-N 3.29Å; L178-T182 PolarHBondContact O-N 3.34Å; L178-T182 PolarHBondContact O-OG1 3.12Å
179	N	71.6	Confident	72.8	Confident	94 Å²	94	79.9 Å²	79.9	50%	0.503	39%	0.394	S	S	.	.	H	α-helix	trans	-57.3	-38.9	175.6	-74.9	-34.7	0	0	0	111.7	V175 D176 F183	V175-N179 WeakPolarHBondContact O-CB 3.47Å; V175-N179 PolarHBondContact O-N 3.41Å; V175-N179 PolarHBondContact O-ND2 2.84Å; D176-N179 PolarHBondContact O-N 3.18Å; N179-F183 WeakPolarHBondContact O-CB 3.22Å; N179-F183 PolarHBondContact O-N 3.42Å
180	M	74.1	Confident	73	Confident	22 Å²	22	72.6 Å²	72.6	11%	0.108	37%	0.37	C	S	.	.	H	α-helix	trans	-62.3	-52.5	175	164.5	47.6	51.9	0	0	112.4	I133 I137 D176 D177 L178 T182 F183 M184	I133-M180 VanDerWaalsContact C-CE 3.43Å; I133-M180 HydrophobicContact CB-CE 3.55Å; I133-M180 HydrophobicContact CG2-CE 3.37Å; I137-M180 HydrophobicContact CD1-CB 3.56Å; I137-M180 HydrophobicContact CD1-CE 4Å; I137-M180 HydrophobicContact CD1-CG 3.95Å; D176-M180 VanDerWaalsContact O-CB 3.28Å; D176-M180 WeakPolarHBondContact O-CB 3.35Å; D176-M180 PolarHBondContact O-N 3.11Å; D177-M180 WeakPolarHBondContact O-CB 3.35Å; D177-M180 PolarHBondContact O-N 3.25Å; L178-M180 PolarHBondContact O-N 3.41Å; M180-T182 VanDerWaalsContact C-N 3.32Å; M180-T182 PolarHBondContact O-N 2.8Å; M180-F183 PolarHBondContact O-N 3.26Å; M180-F183 VanDerWaalsContact O-N 3.17Å; M180-M184 HydrophobicContact CE-CE 4.47Å; M180-M184 PolarHBondContact O-N 2.9Å; M180-M184 HydrophobicContact SD-CE 3.72Å; M180-M184 HydrophobicContact SD-CG 3.64Å
181	H	75.2	Confident	73.5	Confident	130 Å²	130	70.9 Å²	70.9	60%	0.602	37%	0.365	S	S	*	.	H	α-helix	trans	-59	-45.2	178.3	-170.3	-66.2	0	0	0	111.1	D177 L178 F183 M184 T185	D177-H181 PolarHBondContact O-N 2.97Å; L178-H181 PolarHBondContact O-N 3.29Å; H181-F183 PolarHBondContact O-N 2.93Å; H181-M184 PolarHBondContact O-N 2.89Å; H181-T185 PolarHBondContact O-N 2.03Å; H181-T185 PolarHBondContact O-OG1 3.12Å; H181-T185 VanDerWaalsContact O-OG1 3.08Å
182	T	70.1	Confident	74.2	Confident	68 Å²	68	67.9 Å²	67.9	42%	0.417	36%	0.362	S	S	.	.	H	α-helix	trans	-60	-43.7	175.6	-60.8	0	0	0	0	112.1	L178 M180 M184 T185 I186	L178-T182 PolarHBondContact O-N 3.34Å; L178-T182 PolarHBondContact O-OG1 3.12Å; M180-T182 VanDerWaalsContact C-N 3.32Å; M180-T182 PolarHBondContact O-N 2.8Å; T182-M184 PolarHBondContact O-N 3.26Å; T182-T185 PolarHBondContact O-N 3.41Å; T182-I186 HydrophobicContact CG2-CD1 3.73Å; T182-I186 HydrophobicContact CG2-CG1 4.48Å; T182-I186 WeakPolarHBondContact O-CB 3.46Å; T182-I186 VanDerWaalsContact O-CG1 3.27Å; T182-I186 WeakPolarHBondContact O-CG1 3.14Å; T182-I186 PolarHBondContact O-N 2.97Å
183	F	74.3	Confident	74.4	Confident	50 Å²	50	64 Å²	64	22%	0.219	35%	0.346	C	S	.	.	H	α-helix	trans	-63.1	-42	177.7	-165.6	-76.9	0	0	0	112	M126 R129 A130 N179 M180 H181 I186 S187	M126-F183 HydrophobicContact CE-CE1 4.42Å; M126-F183 HydrophobicContact CE-CE2 3.96Å; M126-F183 HydrophobicContact CE-CZ 3.67Å; M126-F183 WeakPolarHBondContact O-CE1 3.45Å; M126-F183 HydrophobicContact SD-CZ 4.05Å; R129-F183 HydrophobicContact CB-CE1 4.1Å; R129-F183 HydrophobicContact CB-CZ 3.82Å; A130-F183 HydrophobicContact CB-CD1 3.64Å; A130-F183 HydrophobicContact CB-CE1 3.64Å; N179-F183 WeakPolarHBondContact O-CB 3.22Å; N179-F183 PolarHBondContact O-N 3.42Å; M180-F183 PolarHBondContact O-N 3.26Å; M180-F183 VanDerWaalsContact O-N 3.17Å; H181-F183 PolarHBondContact O-N 2.93Å; F183-I186 PolarHBondContact O-N 3.29Å; F183-S187 WeakPolarHBondContact O-CB 3.5Å; F183-S187 PolarHBondContact O-N 3.43Å
184	M	75.9	Confident	74.7	Confident	44 Å²	44	62.2 Å²	62.2	22%	0.217	33%	0.333	C	S	.	.	H	α-helix	trans	-60.1	-50.4	176.3	-78.3	-68.1	174	0	0	112	A130 S134 M180 H181 T182 I186 S187 Q188	A130-M184 VanDerWaalsContact C-CE 3.44Å; A130-M184 HydrophobicContact CB-CE 3.74Å; A130-M184 HydrophobicContact CB-SD 3.69Å; A130-M184 VanDerWaalsContact O-CE 3.22Å; A130-M184 WeakPolarHBondContact O-CE 3.43Å; S134-M184 VanDerWaalsContact CB-CE 3.43Å; M180-M184 HydrophobicContact CE-CE 4.47Å; M180-M184 PolarHBondContact O-N 2.9Å; M180-M184 HydrophobicContact SD-CE 3.72Å; M180-M184 HydrophobicContact SD-CG 3.64Å; H181-M184 PolarHBondContact O-N 2.89Å; T182-M184 PolarHBondContact O-N 3.26Å; M184-I186 PolarHBondContact O-N 3.29Å; M184-S187 PolarHBondContact O-N 2.94Å; M184-Q188 WeakPolarHBondContact O-CG 3.34Å; M184-Q188 PolarHBondContact O-N 2.74Å
185	T	76.6	Confident	75	Confident	49 Å²	49	63.5 Å²	63.5	30%	0.301	34%	0.335	S	S	.	.	H	α-helix	trans	-59.6	-45.5	178.5	-52.3	0	0	0	0	111.4	H181 T182 S187 Q188 Q189	H181-T185 PolarHBondContact O-N 2.03Å; H181-T185 PolarHBondContact O-OG1 3.12Å; H181-T185 VanDerWaalsContact O-OG1 3.08Å; T182-T185 PolarHBondContact O-N 3.41Å; T185-S187 PolarHBondContact O-N 3.04Å; T185-Q188 PolarHBondContact O-N 3.38Å; T185-Q189 WeakPolarHBondContact O-CB 3.39Å; T185-Q189 VanDerWaalsContact O-CG 3.3Å; T185-Q189 WeakPolarHBondContact O-CG 3.49Å; T185-Q189 PolarHBondContact O-N 3.16Å
186	I	71.6	Confident	75.3	Confident	79 Å²	79	64.4 Å²	64.4	41%	0.405	33%	0.331	S	S	.	.	H	α-helix	trans	-61.7	-43	177.3	-69.7	168.9	0	0	0	111.2	T182 F183 M184 Q189 T190	T182-I186 HydrophobicContact CG2-CD1 3.73Å; T182-I186 HydrophobicContact CG2-CG1 4.48Å; T182-I186 WeakPolarHBondContact O-CB 3.46Å; T182-I186 VanDerWaalsContact O-CG1 3.27Å; T182-I186 WeakPolarHBondContact O-CG1 3.14Å; T182-I186 PolarHBondContact O-N 2.97Å; F183-I186 PolarHBondContact O-N 3.29Å; M184-I186 PolarHBondContact O-N 3.29Å; I186-Q189 PolarHBondContact O-N 3.47Å; I186-T190 WeakPolarHBondContact O-CB 3.01Å; I186-T190 PolarHBondContact O-N 3.34Å; I186-T190 PolarHBondContact O-OG1 3.45Å
187	S	75.3	Confident	75.3	Confident	5 Å²	5	65 Å²	65	4%	0.035	33%	0.329	C	S	.	.	H	α-helix	trans	-64.4	-44.3	179.7	-165.7	0	0	0	0	111.9	E127 F183 M184 T185 T190 T191	E127-S187 VanDerWaalsContact CA-OG 3.28Å; E127-S187 WeakPolarHBondContact CA-OG 3.29Å; E127-S187 PolarHBondContact N-OG 3.04Å; E127-S187 VanDerWaalsContact N-OG 3.16Å; F183-S187 WeakPolarHBondContact O-CB 3.5Å; F183-S187 PolarHBondContact O-N 3.43Å; M184-S187 PolarHBondContact O-N 2.94Å; T185-S187 PolarHBondContact O-N 3.04Å; S187-T190 WeakPolarHBondContact O-CB 3.48Å; S187-T190 PolarHBondContact O-N 2.81Å; S187-T191 PolarHBondContact O-N 3.2Å; S187-T191 PolarHBondContact O-OG1 2.88Å
188	Q	79.5	Confident	75.5	Confident	136 Å²	136	62.3 Å²	62.3	64%	0.636	32%	0.317	S	S	*	.	H	α-helix	trans	-64.7	-43.7	177.8	-71.2	175.1	-9.5	0	0	111.9	M184 T185 T190 T191 S192	M184-Q188 WeakPolarHBondContact O-CG 3.34Å; M184-Q188 PolarHBondContact O-N 2.74Å; T185-Q188 PolarHBondContact O-N 3.38Å; Q188-T190 VanDerWaalsContact C-N 3.31Å; Q188-T190 PolarHBondContact O-N 3.26Å; Q188-T191 PolarHBondContact O-N 3.22Å; Q188-S192 VanDerWaalsContact O-CB 3.26Å; Q188-S192 WeakPolarHBondContact O-CB 3.19Å; Q188-S192 PolarHBondContact O-N 3.29Å
189	Q	75.8	Confident	75.9	Confident	104 Å²	104	64.4 Å²	64.4	49%	0.486	32%	0.317	S	S	.	.	H	α-helix	trans	-62.1	-38	174.6	-73.9	176.3	-11	0	0	112.2	T185 I186 T193	T185-Q189 WeakPolarHBondContact O-CB 3.39Å; T185-Q189 VanDerWaalsContact O-CG 3.3Å; T185-Q189 WeakPolarHBondContact O-CG 3.49Å; T185-Q189 PolarHBondContact O-N 3.16Å; I186-Q189 PolarHBondContact O-N 3.47Å; Q189-T193 WeakPolarHBondContact O-CB 3.22Å; Q189-T193 PolarHBondContact O-N 2.61Å; Q189-T193 PolarHBondContact O-OG1 2.91Å
190	T	71.6	Confident	76.1	Confident	35 Å²	35	61.6 Å²	61.6	22%	0.215	30%	0.302	C	S	.	.	H	α-helix	trans	-62.8	-55.4	176	-57.4	0	0	0	0	110.6	Y122 A123 I186 S187 Q188 S192 T193 V194	Y122-T190 HydrophobicContact CD1-CG2 4.4Å; Y122-T190 HydrophobicContact CE1-CG2 4.34Å; A123-T190 HydrophobicContact CB-CG2 4.19Å; I186-T190 WeakPolarHBondContact O-CB 3.01Å; I186-T190 PolarHBondContact O-N 3.34Å; I186-T190 PolarHBondContact O-OG1 3.45Å; S187-T190 WeakPolarHBondContact O-CB 3.48Å; S187-T190 PolarHBondContact O-N 2.81Å; Q188-T190 VanDerWaalsContact C-N 3.31Å; Q188-T190 PolarHBondContact O-N 3.26Å; T190-S192 PolarHBondContact O-N 3.34Å; T190-T193 PolarHBondContact O-N 3.22Å; T190-V194 WeakPolarHBondContact O-CG2 3.21Å; T190-V194 PolarHBondContact O-N 3.3Å
191	T	77.3	Confident	76.3	Confident	29 Å²	29	62.1 Å²	62.1	18%	0.178	31%	0.31	C	S	.	.	H	α-helix	trans	-59.7	-46.6	179.8	-58.6	0	0	0	0	111.6	S187 Q188 T193 V194 E195	S187-T191 PolarHBondContact O-N 3.2Å; S187-T191 PolarHBondContact O-OG1 2.88Å; Q188-T191 PolarHBondContact O-N 3.22Å; T191-T193 VanDerWaalsContact C-N 3.26Å; T191-T193 PolarHBondContact O-N 2.82Å; T191-V194 PolarHBondContact O-N 3.16Å; T191-E195 WeakPolarHBondContact O-CB 3.43Å; T191-E195 PolarHBondContact O-N 3.04Å
192	S	80.9	Confident	76.5	Confident	57 Å²	57	62.3 Å²	62.3	40%	0.399	32%	0.315	S	S	.	.	H	α-helix	trans	-58.4	-35.5	177.4	-179.2	0	0	0	0	113.2	Q188 T190 R196	Q188-S192 VanDerWaalsContact O-CB 3.26Å; Q188-S192 WeakPolarHBondContact O-CB 3.19Å; Q188-S192 PolarHBondContact O-N 3.29Å; T190-S192 PolarHBondContact O-N 3.34Å; S192-R196 WeakPolarHBondContact O-CB 3.33Å; S192-R196 VanDerWaalsContact O-CG 3.25Å; S192-R196 WeakPolarHBondContact O-CG 3.47Å; S192-R196 PolarHBondContact O-N 2.9Å; S192-R196 VanDerWaalsContact O-N 3.08Å; S192-R196 PolarHBondContact O-NE 3.19Å
193	T	76.2	Confident	77.1	Confident	19 Å²	19	64.5 Å²	64.5	12%	0.117	33%	0.328	C	S	.	.	H	α-helix	trans	-76.5	-40.5	179.8	-55.5	0	0	0	0	112	Q189 T190 T191 R196 Y197	Q189-T193 WeakPolarHBondContact O-CB 3.22Å; Q189-T193 PolarHBondContact O-N 2.61Å; Q189-T193 PolarHBondContact O-OG1 2.91Å; T190-T193 PolarHBondContact O-N 3.22Å; T191-T193 VanDerWaalsContact C-N 3.26Å; T191-T193 PolarHBondContact O-N 2.82Å; T193-R196 PolarHBondContact O-N 3.21Å; T193-R196 PolarHBondContact OG1-NH2 3.45Å; T193-Y197 HydrophobicContact CG2-CD2 4.3Å; T193-Y197 HydrophobicContact CG2-CE2 4.29Å; T193-Y197 WeakPolarHBondContact O-CD2 3.45Å; T193-Y197 PolarHBondContact O-N 3.27Å
194	V	77	Confident	77.2	Confident	17 Å²	17	64.6 Å²	64.6	10%	0.103	34%	0.335	C	S	.	.	H	α-helix	trans	-67.7	-37.7	174.8	-176.4	0	0	0	0	111.3	L116 L120 A123 T190 T191 Y197 A198	L116-V194 HydrophobicContact CD1-CG1 4.21Å; L120-V194 HydrophobicContact CB-CG1 4.39Å; L120-V194 HydrophobicContact CD2-CG1 3.56Å; L120-V194 HydrophobicContact CG-CG1 3.63Å; A123-V194 HydrophobicContact CB-CG2 4.34Å; T190-V194 WeakPolarHBondContact O-CG2 3.21Å; T190-V194 PolarHBondContact O-N 3.3Å; T191-V194 PolarHBondContact O-N 3.16Å; V194-Y197 PolarHBondContact O-N 2.9Å; V194-A198 PolarHBondContact O-N 3.5Å
195	E	79.8	Confident	77.2	Confident	79 Å²	79	65.2 Å²	65.2	37%	0.369	34%	0.342	S	S	.	.	H	α-helix	trans	-61.6	-41.4	171.8	-83.1	-166.4	-140.7	0	0	112.8	T191 Y197 A198 R199	T191-E195 WeakPolarHBondContact O-CB 3.43Å; T191-E195 PolarHBondContact O-N 3.04Å; E195-Y197 VanDerWaalsContact C-N 3.3Å; E195-Y197 PolarHBondContact O-N 3.37Å; E195-A198 PolarHBondContact O-N 3.38Å; E195-R199 WeakPolarHBondContact O-CB 3.37Å; E195-R199 VanDerWaalsContact O-CG 3.25Å; E195-R199 WeakPolarHBondContact O-CG 3.39Å; E195-R199 PolarHBondContact O-N 3.01Å; E195-R199 IonicContact OE2-CZ 3.61Å; E195-R199 IonicContact OE2-NE 3.14Å; E195-R199 IonicContact OE2-NH2 2.76Å; E195-R199 PolarHBondContact OE2-NH2 3.33Å
196	R	77.3	Confident	77.2	Confident	83 Å²	83	69.2 Å²	69.2	31%	0.313	36%	0.362	S	S	.	.	H	α-helix	trans	-63	-37.2	175.1	-76	179	-64.6	161.7	8.6	111.7	S192 T193 L200 I237 F238	S192-R196 WeakPolarHBondContact O-CB 3.33Å; S192-R196 VanDerWaalsContact O-CG 3.25Å; S192-R196 WeakPolarHBondContact O-CG 3.47Å; S192-R196 PolarHBondContact O-N 2.9Å; S192-R196 VanDerWaalsContact O-N 3.08Å; S192-R196 PolarHBondContact O-NE 3.19Å; T193-R196 PolarHBondContact O-N 3.21Å; T193-R196 PolarHBondContact OG1-NH2 3.45Å; R196-L200 WeakPolarHBondContact O-CB 3.48Å; R196-L200 PolarHBondContact O-N 3.49Å; R196-I237 HydrophobicContact CB-CG2 3.92Å; R196-I237 HydrophobicContact CG-CG2 4.35Å; R196-I237 PolarHBondContact NE-O 3.37Å; R196-I237 PolarHBondContact NH1-O 3.16Å; R196-I237 PolarHBondContact NH2-O 2.82Å; R196-F238 HydrophobicContact CB-CE1 4.2Å
197	Y	75.3	Confident	77.2	Confident	77 Å²	77	69.1 Å²	69.1	30%	0.302	36%	0.361	S	S	.	.	H	α-helix	trans	-65.8	-45.8	173.8	-92.4	-67.7	0	0	0	112.2	T193 V194 E195 L200 A201 F238	T193-Y197 HydrophobicContact CG2-CD2 4.3Å; T193-Y197 HydrophobicContact CG2-CE2 4.29Å; T193-Y197 WeakPolarHBondContact O-CD2 3.45Å; T193-Y197 PolarHBondContact O-N 3.27Å; V194-Y197 PolarHBondContact O-N 2.9Å; E195-Y197 VanDerWaalsContact C-N 3.3Å; E195-Y197 PolarHBondContact O-N 3.37Å; Y197-L200 PolarHBondContact O-N 3.44Å; Y197-A201 PolarHBondContact O-N 3.37Å; Y197-F238 AromaticContact CD1-CD1 3.88Å; Y197-F238 HydrophobicContact CD1-CD1 3.88Å; Y197-F238 AromaticContact CD1-CE1 3.42Å; Y197-F238 HydrophobicContact CD1-CE1 3.42Å; Y197-F238 VanDerWaalsContact CD1-CE1 3.42Å; Y197-F238 HydrophobicContact CD1-CE2 4.15Å; Y197-F238 HydrophobicContact CD1-CG 4.43Å; Y197-F238 AromaticContact CD1-CZ 3.57Å; Y197-F238 HydrophobicContact CD1-CZ 3.57Å; Y197-F238 AromaticContact CD2-CD1 3.49Å; Y197-F238 HydrophobicContact CD2-CD1 3.49Å; Y197-F238 VanDerWaalsContact CD2-CD1 3.49Å; Y197-F238 AromaticContact CD2-CE1 3.58Å; Y197-F238 HydrophobicContact CD2-CE1 3.58Å; Y197-F238 HydrophobicContact CD2-CG 4.4Å; Y197-F238 AromaticContact CE1-CD1 3.65Å; Y197-F238 HydrophobicContact CE1-CD1 3.65Å; Y197-F238 AromaticContact CE1-CD2 3.87Å; Y197-F238 HydrophobicContact CE1-CD2 3.87Å; Y197-F238 AromaticContact CE1-CE1 3.63Å; Y197-F238 HydrophobicContact CE1-CE1 3.63Å; Y197-F238 AromaticContact CE1-CE2 3.83Å; Y197-F238 HydrophobicContact CE1-CE2 3.83Å; Y197-F238 AromaticContact CE1-CG 3.78Å; Y197-F238 HydrophobicContact CE1-CG 3.78Å; Y197-F238 AromaticContact CE1-CZ 3.71Å; Y197-F238 HydrophobicContact CE1-CZ 3.71Å; Y197-F238 HydrophobicContact CE2-CB 4.11Å; Y197-F238 AromaticContact CE2-CD1 3.24Å; Y197-F238 HydrophobicContact CE2-CD1 3.24Å; Y197-F238 AromaticContact CE2-CE1 3.78Å; Y197-F238 HydrophobicContact CE2-CE1 3.78Å; Y197-F238 AromaticContact CE2-CG 3.75Å; Y197-F238 HydrophobicContact CE2-CG 3.75Å; Y197-F238 AromaticContact CG-CD1 3.8Å; Y197-F238 HydrophobicContact CG-CD1 3.8Å; Y197-F238 AromaticContact CG-CE1 3.39Å; Y197-F238 HydrophobicContact CG-CE1 3.39Å; Y197-F238 HydrophobicContact CG-CZ 4.01Å; Y197-F238 AromaticContact CZ-CD1 3.33Å; Y197-F238 AromaticContact CZ-CD2 3.92Å; Y197-F238 AromaticContact CZ-CE1 3.8Å; Y197-F238 AromaticContact CZ-CG 3.39Å; Y197-F238 WeakPolarHBondContact OH-CB 3.21Å; Y197-F238 WeakPolarHBondContact OH-CG 3.48Å
198	A	78.9	Confident	76.9	Confident	17 Å²	17	70.8 Å²	70.8	14%	0.14	37%	0.37	C	S	.	.	H	α-helix	trans	-60.4	-50.6	177.5	0	0	0	0	0	111.5	L116 V194 E195 L200 A201 D202	L116-A198 HydrophobicContact CD1-CB 4.28Å; L116-A198 HydrophobicContact CD2-CB 4.17Å; V194-A198 PolarHBondContact O-N 3.5Å; E195-A198 PolarHBondContact O-N 3.38Å; A198-L200 VanDerWaalsContact C-N 3.28Å; A198-L200 PolarHBondContact O-N 3.45Å; A198-A201 WeakPolarHBondContact O-CA 3.41Å; A198-A201 WeakPolarHBondContact O-CB 3.35Å; A198-A201 PolarHBondContact O-N 3.47Å; A198-D202 PolarHBondContact O-N 3.09Å
199	R	79.6	Confident	76.6	Confident	159 Å²	159	69.4 Å²	69.4	60%	0.6	37%	0.367	S	S	*	.	H	α-helix	trans	-60.1	-35.1	178	-66.8	170.4	-165.7	-118.8	9.4	112.6	E195 V203	E195-R199 WeakPolarHBondContact O-CB 3.37Å; E195-R199 VanDerWaalsContact O-CG 3.25Å; E195-R199 WeakPolarHBondContact O-CG 3.39Å; E195-R199 PolarHBondContact O-N 3.01Å; E195-R199 IonicContact OE2-CZ 3.61Å; E195-R199 IonicContact OE2-NE 3.14Å; E195-R199 IonicContact OE2-NH2 2.76Å; E195-R199 PolarHBondContact OE2-NH2 3.33Å; R199-V203 WeakPolarHBondContact O-CB 3.33Å; R199-V203 VanDerWaalsContact O-CG2 3.24Å; R199-V203 WeakPolarHBondContact O-CG2 3.31Å; R199-V203 PolarHBondContact O-N 2.87Å
200	L	75.3	Confident	76.4	Confident	35 Å²	35	70.1 Å²	70.1	18%	0.183	37%	0.365	C	S	.	.	H	α-helix	trans	-71.3	-36.6	174.3	-173	66.8	0	0	0	112.2	R196 Y197 A198 D202 V203 C204 L207 L208 F238	R196-L200 WeakPolarHBondContact O-CB 3.48Å; R196-L200 PolarHBondContact O-N 3.49Å; Y197-L200 PolarHBondContact O-N 3.44Å; A198-L200 VanDerWaalsContact C-N 3.28Å; A198-L200 PolarHBondContact O-N 3.45Å; L200-D202 VanDerWaalsContact C-N 3.32Å; L200-V203 PolarHBondContact O-N 2.97Å; L200-C204 HydrophobicContact CD1-CB 4.04Å; L200-C204 CarbonylContact O-C 3.56Å; L200-C204 WeakPolarHBondContact O-CA 3.49Å; L200-C204 PolarHBondContact O-N 3.47Å; L200-L207 HydrophobicContact CD2-CD2 4.15Å; L200-L208 HydrophobicContact CB-CD1 4.09Å; L200-L208 HydrophobicContact CD2-CD1 4.02Å; L200-L208 HydrophobicContact CD2-CD2 4.28Å; L200-L208 HydrophobicContact CD2-CG 4.09Å; L200-L208 HydrophobicContact CG-CD1 3.82Å; L200-L208 HydrophobicContact CG-CG 4.31Å; L200-F238 HydrophobicContact CB-CZ 4.12Å; L200-F238 HydrophobicContact CD2-CE2 3.44Å; L200-F238 VanDerWaalsContact CD2-CE2 3.44Å; L200-F238 HydrophobicContact CD2-CZ 3.46Å; L200-F238 VanDerWaalsContact CD2-CZ 3.46Å; L200-F238 HydrophobicContact CG-CZ 4.43Å
201	A	78.2	Confident	76.4	Confident	33 Å²	33	79.1 Å²	79.1	27%	0.273	40%	0.395	S	S	.	.	H	α-helix	trans	-64.3	-36.7	174.8	0	0	0	0	0	112.2	Y197 A198 P205 L208	Y197-A201 PolarHBondContact O-N 3.37Å; A198-A201 WeakPolarHBondContact O-CA 3.41Å; A198-A201 WeakPolarHBondContact O-CB 3.35Å; A198-A201 PolarHBondContact O-N 3.47Å; A201-P205 WeakPolarHBondContact O-CB 3.17Å; A201-L208 HydrophobicContact CB-CD1 3.89Å
202	D	80.8	Confident	76.3	Confident	133 Å²	133	82.8 Å²	82.8	71%	0.711	42%	0.417	S	S	*	.	H	α-helix	trans	-72.4	-38.8	176.4	-62.7	-34.1	0	0	0	112.6	A198 L200	A198-D202 PolarHBondContact O-N 3.09Å; L200-D202 VanDerWaalsContact C-N 3.32Å
203	V	81.3	Confident	76.3	Confident	115 Å²	115	84 Å²	84	70%	0.697	42%	0.423	S	S	*	.	H	α-helix	trans	-91.7	-33.2	-172.6	175.9	0	0	0	0	113.6	R199 L200	R199-V203 WeakPolarHBondContact O-CB 3.33Å; R199-V203 VanDerWaalsContact O-CG2 3.24Å; R199-V203 WeakPolarHBondContact O-CG2 3.31Å; R199-V203 PolarHBondContact O-N 2.87Å; L200-V203 PolarHBondContact O-N 2.97Å
204	C	77.3	Confident	76.8	Confident	52 Å²	52	84.2 Å²	84.2	35%	0.351	42%	0.423	S	S	.	.			trans	-139.9	62.5	-178.6	-67.8	0	0	0	0	111.9	L200 D206 L207	L200-C204 HydrophobicContact CD1-CB 4.04Å; L200-C204 CarbonylContact O-C 3.56Å; L200-C204 WeakPolarHBondContact O-CA 3.49Å; L200-C204 PolarHBondContact O-N 3.47Å; C204-D206 PolarHBondContact O-N 3.4Å; C204-L207 HydrophobicContact CB-CB 4.03Å; C204-L207 PolarHBondContact O-N 2.89Å; C204-L207 VanDerWaalsContact O-N 3.08Å
205	P	76	Confident	77.3	Confident	56 Å²	56	85 Å²	85	36%	0.364	42%	0.424	S	S	.	.	H	α-helix	trans	-57.3	-35.5	-179.8	23.3	-34	0	0	0	112.7	A201 L207 L208 N209	A201-P205 WeakPolarHBondContact O-CB 3.17Å; P205-L207 VanDerWaalsContact C-N 3.28Å; P205-L207 PolarHBondContact O-N 3.12Å; P205-L208 PolarHBondContact O-N 3.15Å; P205-N209 WeakPolarHBondContact O-CB 3.09Å; P205-N209 PolarHBondContact O-N 2.95Å; P205-N209 PolarHBondContact O-ND2 3.01Å
206	D	76.5	Confident	77.8	Confident	134 Å²	134	81.5 Å²	81.5	72%	0.717	41%	0.408	S	S	*	.	H	α-helix	trans	-64.9	-30.8	179.6	-57	-46.9	0	0	0	112.9	C204 R210	C204-D206 PolarHBondContact O-N 3.4Å; D206-R210 WeakPolarHBondContact O-CB 3.15Å; D206-R210 PolarHBondContact O-N 3.29Å
207	L	72	Confident	78.3	Confident	76 Å²	76	84 Å²	84	40%	0.398	42%	0.424	S	S	.	.	H	α-helix	trans	-73	-32.9	179.3	-174.8	140	0	0	0	111.9	L200 C204 P205 I232	L200-L207 HydrophobicContact CD2-CD2 4.15Å; C204-L207 HydrophobicContact CB-CB 4.03Å; C204-L207 PolarHBondContact O-N 2.89Å; C204-L207 VanDerWaalsContact O-N 3.08Å; P205-L207 VanDerWaalsContact C-N 3.28Å; P205-L207 PolarHBondContact O-N 3.12Å; L207-I232 HydrophobicContact CD1-CD1 4.15Å; L207-I232 HydrophobicContact CD1-CG2 4.35Å; L207-I232 HydrophobicContact CG-CD1 3.93Å; L207-I232 HydrophobicContact CG-CG2 4.48Å
208	L	68.9	Low	78.5	Confident	41 Å²	41	82.8 Å²	82.8	22%	0.215	43%	0.427	C	S	.	.	H	α-helix	trans	-81.8	-27.5	174.7	-78.9	159.9	0	0	0	112.9	L200 A201 P205 M234	L200-L208 HydrophobicContact CB-CD1 4.09Å; L200-L208 HydrophobicContact CD2-CD1 4.02Å; L200-L208 HydrophobicContact CD2-CD2 4.28Å; L200-L208 HydrophobicContact CD2-CG 4.09Å; L200-L208 HydrophobicContact CG-CD1 3.82Å; L200-L208 HydrophobicContact CG-CG 4.31Å; A201-L208 HydrophobicContact CB-CD1 3.89Å; P205-L208 PolarHBondContact O-N 3.15Å; L208-M234 HydrophobicContact CD2-CE 4.08Å
209	N	72.6	Confident	78.1	Confident	106 Å²	106	88.6 Å²	88.6	57%	0.567	45%	0.451	S	S	*	.	H	α-helix	trans	-91.8	-4.7	177.1	-68.7	-62	0	0	0	113.8	P205 R211	P205-N209 WeakPolarHBondContact O-CB 3.09Å; P205-N209 PolarHBondContact O-N 2.95Å; P205-N209 PolarHBondContact O-ND2 3.01Å; N209-R211 PolarHBondContact O-N 3.44Å
210	R	71.9	Confident	77.7	Confident	119 Å²	119	84 Å²	84	45%	0.449	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-62.3	122	178.1	-170.4	-177.8	-173.1	162.3	4.6	110.3	D206 T212 E229	D206-R210 WeakPolarHBondContact O-CB 3.15Å; D206-R210 PolarHBondContact O-N 3.29Å; R210-T212 PolarHBondContact O-N 3.47Å; R210-E229 IonicContact CZ-OE1 2.67Å; R210-E229 IonicContact NE-OE1 3.65Å; R210-E229 IonicContact NE-OE2 3.6Å; R210-E229 IonicContact NH2-OE1 3.6Å; R210-E229 PolarHBondContact NH2-OE1 2.96Å; R210-E229 IonicContact NH2-OE2 3.85Å
211	R	72.2	Confident	77.6	Confident	224 Å²	224	84.9 Å²	84.9	85%	0.845	44%	0.441	S	S	*	.	P	Polyproline II helix	trans	-62.3	122.5	173	-64.4	-178.6	179.8	-176.8	-0.5	109.3	N209	N209-R211 PolarHBondContact O-N 3.44Å
212	T	75.2	Confident	77.1	Confident	106 Å²	106	88.6 Å²	88.6	65%	0.65	46%	0.462	S	S	*	.	P	Polyproline II helix	trans	-82.4	126	169.5	-62.3	0	0	0	0	108.9	R210 P231	R210-T212 PolarHBondContact O-N 3.47Å; T212-P231 HydrophobicContact CG2-CB 4.4Å
213	V	79.4	Confident	76.3	Confident	84 Å²	84	85.8 Å²	85.8	51%	0.509	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-92.1	131.6	177.5	-175.7	0	0	0	0	109.7	Q300	V213-Q300 PolarHBondContact O-NE2 3.42Å
214	N	88.2	Confident	75.6	Confident	23 Å²	23	85.8 Å²	85.8	12%	0.123	46%	0.457	C	S	.	.	P	Polyproline II helix	trans	-87.4	118.4	168.7	179.4	-26.8	0	0	0	109	F216 M217 Q300 L304	N214-F216 PolarHBondContact O-N 3.21Å; N214-F216 VanDerWaalsContact O-N 3.1Å; N214-F216 PolarHBondContact OD1-N 2.93Å; N214-M217 HydrophobicContact CB-CG 3.91Å; N214-M217 HydrophobicContact CB-SD 3.89Å; N214-M217 PolarHBondContact O-N 3.24Å; N214-M217 VanDerWaalsContact O-N 3.12Å; N214-Q300 PolarHBondContact ND2-O 3.23Å; N214-Q300 PolarHBondContact OD1-O 3.37Å; N214-L304 WeakPolarHBondContact ND2-CG 3.45Å
215	R	86.3	Confident	74.4	Confident	34 Å²	34	94.9 Å²	94.9	13%	0.128	48%	0.484	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-14	-174.7	75	-173.9	-120.3	89.2	32.8	114.4	E228 N297 Q300 R465 E468	R215-E228 IonicContact CZ-OE1 3.85Å; R215-E228 IonicContact NE-OE1 2.74Å; R215-E228 IonicContact NH1-OE1 3.69Å; R215-E228 PolarHBondContact NH1-OE1 3.47Å; R215-N297 PolarHBondContact NE-OD1 3.37Å; R215-Q300 VanDerWaalsContact CG-OE1 3.25Å; R215-R465 PolarHBondContact O-NE 3.39Å; R215-R465 PolarHBondContact O-NH2 3.47Å; R215-E468 IonicContact CZ-OE1 3.6Å; R215-E468 VanDerWaalsContact CZ-OE1 3.31Å; R215-E468 IonicContact CZ-OE2 2.98Å; R215-E468 IonicContact NH1-OE1 2.73Å; R215-E468 PolarHBondContact NH1-OE1 2.83Å; R215-E468 IonicContact NH2-OE1 2.86Å; R215-E468 PolarHBondContact NH2-OE1 2.78Å; R215-E468 IonicContact NH2-OE2 3.9Å; R215-E468 PolarHBondContact NH2-OE2 2.52Å
216	F	90.4	Very high	73.4	Confident	5 Å²	5	96.6 Å²	96.6	2%	0.022	48%	0.484	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-1.6	177.3	-61.6	-78.7	0	0	0	113.9	N214 N297 Q300 A301 L304 M405 A463 R465	N214-F216 PolarHBondContact O-N 3.21Å; N214-F216 VanDerWaalsContact O-N 3.1Å; N214-F216 PolarHBondContact OD1-N 2.93Å; F216-N297 WeakPolarHBondContact CZ-OD1 3.18Å; F216-Q300 HydrophobicContact CD2-CB 3.86Å; F216-Q300 HydrophobicContact CE2-CB 4.05Å; F216-A301 HydrophobicContact CD2-CB 4.14Å; F216-A301 HydrophobicContact CE2-CB 3.96Å; F216-A301 HydrophobicContact CZ-CB 4.33Å; F216-L304 VanDerWaalsContact C-CD1 3.49Å; F216-L304 HydrophobicContact CB-CD1 3.57Å; F216-M405 HydrophobicContact CB-CE 3.83Å; F216-M405 HydrophobicContact CD1-CE 3.77Å; F216-M405 HydrophobicContact CD1-CG 3.96Å; F216-M405 HydrophobicContact CD1-SD 4.27Å; F216-M405 HydrophobicContact CE1-CE 4.47Å; F216-M405 HydrophobicContact CE1-CG 4.06Å; F216-M405 HydrophobicContact CE1-SD 4.43Å; F216-M405 HydrophobicContact CG-CE 3.81Å; F216-A463 HydrophobicContact CZ-CB 4.23Å; F216-R465 HydrophobicContact CD1-CG 4.43Å
217	M	88.1	Confident	72.2	Confident	134 Å²	134	98.6 Å²	98.6	66%	0.66	49%	0.489	S	S	*	.	S	Bend	trans	-80.6	-12.7	176.9	-69.8	-177.2	70.8	0	0	114.7	N214 L304	N214-M217 HydrophobicContact CB-CG 3.91Å; N214-M217 HydrophobicContact CB-SD 3.89Å; N214-M217 PolarHBondContact O-N 3.24Å; N214-M217 VanDerWaalsContact O-N 3.12Å; M217-L304 HydrophobicContact CG-CD1 3.7Å; M217-L304 HydrophobicContact CG-CD2 3.72Å; M217-L304 HydrophobicContact CG-CG 4.36Å; M217-L304 HydrophobicContact SD-CD2 4.24Å
218	S	78.8	Confident	71.3	Confident	53 Å²	53	100.1 Å²	100.1	37%	0.371	49%	0.494	S	S	.	.	S	Bend	trans	-123.2	148	172	56.9	0	0	0	0	111.4	R465	S218-R465 PolarHBondContact O-NE 2.86Å; S218-R465 PolarHBondContact O-NH2 3.47Å; S218-R465 VanDerWaalsContact O-NH2 3.07Å; S218-R465 PolarHBondContact OG-NH2 2.73Å
219	Q	70.2	Confident	70.6	Confident	138 Å²	138	102.8 Å²	102.8	65%	0.645	51%	0.506	S	S	*	.			trans	-70	158.9	-179	-62.9	-175.6	-0.7	0	0	111.5	T221 Y226 R465	Q219-T221 PolarHBondContact O-N 3.06Å; Q219-Y226 PolarHBondContact O-OH 3.28Å; Q219-R465 PolarHBondContact O-NH1 3.19Å
220	Y	73.2	Confident	69.5	Low	64 Å²	64	107 Å²	107	25%	0.251	51%	0.514	S	S	.	.			trans	-79.3	119.9	173.4	-173.6	-99.5	0	0	0	111.1	P222 G467 E468	Y220-P222 HydrophobicContact CD1-CG 4.01Å; Y220-P222 HydrophobicContact CE1-CB 4.06Å; Y220-P222 HydrophobicContact CE1-CG 3.83Å; Y220-G467 WeakPolarHBondContact CD1-O 3.38Å; Y220-G467 WeakPolarHBondContact CE1-O 3.43Å; Y220-E468 HydrophobicContact CD2-CB 4.04Å; Y220-E468 HydrophobicContact CE2-CB 4.2Å; Y220-E468 HydrophobicContact CE2-CG 4.5Å; Y220-E468 HydrophobicContact CG-CB 4.41Å
221	T	72.2	Confident	68.6	Low	53 Å²	53	103.1 Å²	103.1	33%	0.325	50%	0.504	S	S	.	.			trans	-107.5	102.9	177	24.7	0	0	0	0	108.9	Q219 G223 E224 Y226	Q219-T221 PolarHBondContact O-N 3.06Å; T221-G223 PolarHBondContact O-N 2.89Å; T221-E224 WeakPolarHBondContact CB-OE2 3.38Å; T221-E224 PolarHBondContact O-N 2.83Å; T221-E224 VanDerWaalsContact O-N 3.14Å; T221-E224 PolarHBondContact OG1-OE2 3.33Å; T221-Y226 VanDerWaalsContact OG1-CE2 3.26Å; T221-Y226 WeakPolarHBondContact OG1-CE2 3.42Å; T221-Y226 PolarHBondContact OG1-OH 3.48Å
222	P	67.4	Low	67.8	Low	110 Å²	110	95.4 Å²	95.4	71%	0.714	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	129.1	-175.6	-24.9	33.6	0	0	0	112.6	Y220	Y220-P222 HydrophobicContact CD1-CG 4.01Å; Y220-P222 HydrophobicContact CE1-CB 4.06Å; Y220-P222 HydrophobicContact CE1-CG 3.83Å
223	G	64.3	Low	66.7	Low	74 Å²	74	93.3 Å²	93.3	76%	0.763	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.3	-15.3	-179.1	0	0	0	0	0	115.1	T221 R225	T221-G223 PolarHBondContact O-N 2.89Å; G223-R225 PolarHBondContact O-N 2.8Å
224	E	66.7	Low	65.3	Low	115 Å²	115	93.3 Å²	93.3	54%	0.537	47%	0.474	S	S	.	.			trans	-71.5	122.9	168.5	-70.6	-166.8	148.2	0	0	110	T221 Y226	T221-E224 WeakPolarHBondContact CB-OE2 3.38Å; T221-E224 PolarHBondContact O-N 2.83Å; T221-E224 VanDerWaalsContact O-N 3.14Å; T221-E224 PolarHBondContact OG1-OE2 3.33Å; E224-Y226 VanDerWaalsContact C-N 3.27Å; E224-Y226 HydrophobicContact CB-CD2 4.27Å; E224-Y226 HydrophobicContact CB-CE2 3.91Å; E224-Y226 WeakPolarHBondContact O-CD2 3.37Å; E224-Y226 PolarHBondContact O-N 3.22Å
225	R	52.3	Low	63.5	Low	244 Å²	244	97.5 Å²	97.5	92%	0.921	50%	0.496	S	S	*	.			trans	-76.3	82.2	174	-74.4	-171.7	176	-171	-1	110	G223 Q227	G223-R225 PolarHBondContact O-N 2.8Å; R225-Q227 VanDerWaalsContact C-N 3.29Å; R225-Q227 PolarHBondContact O-N 2.88Å
226	Y	55.5	Low	61.8	Low	92 Å²	92	98.5 Å²	98.5	36%	0.361	51%	0.507	S	S	.	.			trans	-56.9	98.4	155	-67.6	-87.7	0	0	0	108.2	Q219 T221 E224 E228 R465	Q219-Y226 PolarHBondContact O-OH 3.28Å; T221-Y226 VanDerWaalsContact OG1-CE2 3.26Å; T221-Y226 WeakPolarHBondContact OG1-CE2 3.42Å; T221-Y226 PolarHBondContact OG1-OH 3.48Å; E224-Y226 VanDerWaalsContact C-N 3.27Å; E224-Y226 HydrophobicContact CB-CD2 4.27Å; E224-Y226 HydrophobicContact CB-CE2 3.91Å; E224-Y226 WeakPolarHBondContact O-CD2 3.37Å; E224-Y226 PolarHBondContact O-N 3.22Å; Y226-E228 PolarHBondContact O-N 3.4Å; Y226-E228 VanDerWaalsContact O-N 3.15Å; Y226-R465 PolarHBondContact OH-NH1 2.73Å
227	Q	50.4	Low	59.9	Low	176 Å²	176	101.6 Å²	101.6	82%	0.822	52%	0.523	S	S	*	.			trans	-62.7	112.8	151.7	-73.5	-170.1	-6.1	0	0	105.2	R225 E229	R225-Q227 VanDerWaalsContact C-N 3.29Å; R225-Q227 PolarHBondContact O-N 2.88Å; Q227-E229 VanDerWaalsContact C-N 3.29Å; Q227-E229 PolarHBondContact O-N 3.01Å
228	E	53.9	Low	58.3	Low	108 Å²	108	95.8 Å²	95.8	51%	0.505	49%	0.494	S	S	.	.			trans	-62.2	100.4	165.3	-69	-162.6	129	0	0	107.2	R215 Y226 R230	R215-E228 IonicContact CZ-OE1 3.85Å; R215-E228 IonicContact NE-OE1 2.74Å; R215-E228 IonicContact NH1-OE1 3.69Å; R215-E228 PolarHBondContact NH1-OE1 3.47Å; Y226-E228 PolarHBondContact O-N 3.4Å; Y226-E228 VanDerWaalsContact O-N 3.15Å; E228-R230 PolarHBondContact O-N 3.19Å
229	E	52.6	Low	57.2	Low	97 Å²	97	96.7 Å²	96.7	45%	0.453	50%	0.495	S	S	.	.			trans	-61.3	85.9	158.2	-68.7	-149.4	141	0	0	106.7	R210 Q227 P231	R210-E229 IonicContact CZ-OE1 2.67Å; R210-E229 IonicContact NE-OE1 3.65Å; R210-E229 IonicContact NE-OE2 3.6Å; R210-E229 IonicContact NH2-OE1 3.6Å; R210-E229 PolarHBondContact NH2-OE1 2.96Å; R210-E229 IonicContact NH2-OE2 3.85Å; Q227-E229 VanDerWaalsContact C-N 3.29Å; Q227-E229 PolarHBondContact O-N 3.01Å; E229-P231 WeakPolarHBondContact O-CD 3.48Å; E229-P231 VanDerWaalsContact O-N 3.09Å
230	R	50.9	Low	56.7	Low	194 Å²	194	92.6 Å²	92.6	73%	0.732	48%	0.481	S	S	*	.			trans	-48.3	122.5	170.4	-72.6	-174.2	175.1	-173.4	-2.6	106.3	E228 I232	E228-R230 PolarHBondContact O-N 3.19Å; R230-I232 PolarHBondContact O-N 3.33Å
231	P	53.5	Low	56.2	Low	37 Å²	37	93.1 Å²	93.1	24%	0.24	49%	0.494	C	S	.	.			trans	-46.5	130.2	173.4	-29.3	35.8	0	0	0	108.2	T212 E229 G233 L296	T212-P231 HydrophobicContact CG2-CB 4.4Å; E229-P231 WeakPolarHBondContact O-CD 3.48Å; E229-P231 VanDerWaalsContact O-N 3.09Å; P231-G233 VanDerWaalsContact C-N 3.34Å; P231-G233 PolarHBondContact O-N 3.1Å; P231-L296 HydrophobicContact CG-CD1 4.25Å; P231-L296 HydrophobicContact CG-CD2 4.32Å
232	I	53.5	Low	56.3	Low	63 Å²	63	93.2 Å²	93.2	32%	0.323	49%	0.492	S	S	.	.			trans	-60.4	106.3	177.1	-61.7	-178.1	0	0	0	105.7	L207 R230 M234	L207-I232 HydrophobicContact CD1-CD1 4.15Å; L207-I232 HydrophobicContact CD1-CG2 4.35Å; L207-I232 HydrophobicContact CG-CD1 3.93Å; L207-I232 HydrophobicContact CG-CG2 4.48Å; R230-I232 PolarHBondContact O-N 3.33Å; I232-M234 PolarHBondContact O-N 3.24Å
233	G	52.5	Low	56.8	Low	62 Å²	62	88.9 Å²	88.9	64%	0.639	46%	0.463	S	S	*	.			trans	-56.9	106.6	173.2	0	0	0	0	0	106.5	P231 N235	P231-G233 VanDerWaalsContact C-N 3.34Å; P231-G233 PolarHBondContact O-N 3.1Å; G233-N235 PolarHBondContact O-N 3.35Å
234	M	50.2	Low	57.2	Low	84 Å²	84	88.3 Å²	88.3	41%	0.414	45%	0.451	S	S	.	.			trans	-63.9	109.3	-176.5	-69	-154.6	84.6	0	0	106.9	L208 I232 F238	L208-M234 HydrophobicContact CD2-CE 4.08Å; I232-M234 PolarHBondContact O-N 3.24Å; M234-F238 HydrophobicContact CE-CD2 3.8Å; M234-F238 HydrophobicContact CE-CE2 3.86Å
235	N	50.7	Low	57.6	Low	111 Å²	111	85.6 Å²	85.6	59%	0.594	45%	0.454	S	S	*	.			trans	-47.1	143.3	-176.6	-99	-58.3	0	0	0	110.5	G233 I237 F238	G233-N235 PolarHBondContact O-N 3.35Å; N235-I237 HydrophobicContact CB-CB 4.36Å; N235-I237 HydrophobicContact CB-CD1 3.73Å; N235-I237 HydrophobicContact CB-CG1 3.91Å; N235-I237 WeakPolarHBondContact O-CA 3.28Å; N235-I237 PolarHBondContact O-N 3.45Å; N235-F238 PolarHBondContact O-N 3.11Å; N235-F238 VanDerWaalsContact O-N 3.09Å
236	P	50.2	Low	59.2	Low	55 Å²	55	75.5 Å²	75.5	36%	0.357	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-63.2	5.3	-176.9	23.8	-33.5	0	0	0	115.4	F238 N239 Y318 D321	P236-F238 PolarHBondContact O-N 2.89Å; P236-N239 WeakPolarHBondContact O-CB 3.41Å; P236-N239 PolarHBondContact O-N 3.44Å; P236-Y318 HydrophobicContact CB-CE1 4.47Å; P236-D321 WeakPolarHBondContact CB-OD1 3.33Å; P236-D321 WeakPolarHBondContact CG-OD1 3.42Å
237	I	50.7	Low	60.9	Low	69 Å²	69	71.3 Å²	71.3	35%	0.354	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-38.3	-31.6	150.3	-59.7	172	0	0	0	112.1	R196 N235	R196-I237 HydrophobicContact CB-CG2 3.92Å; R196-I237 HydrophobicContact CG-CG2 4.35Å; R196-I237 PolarHBondContact NE-O 3.37Å; R196-I237 PolarHBondContact NH1-O 3.16Å; R196-I237 PolarHBondContact NH2-O 2.82Å; N235-I237 HydrophobicContact CB-CB 4.36Å; N235-I237 HydrophobicContact CB-CD1 3.73Å; N235-I237 HydrophobicContact CB-CG1 3.91Å; N235-I237 WeakPolarHBondContact O-CA 3.28Å; N235-I237 PolarHBondContact O-N 3.45Å
238	F	55.5	Low	62.8	Low	13 Å²	13	64.3 Å²	64.3	6%	0.057	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-111.4	38.2	178.2	-53	-52.9	0	0	0	115.1	R196 Y197 L200 M234 N235 P236 C240	R196-F238 HydrophobicContact CB-CE1 4.2Å; Y197-F238 AromaticContact CD1-CD1 3.88Å; Y197-F238 HydrophobicContact CD1-CD1 3.88Å; Y197-F238 AromaticContact CD1-CE1 3.42Å; Y197-F238 HydrophobicContact CD1-CE1 3.42Å; Y197-F238 VanDerWaalsContact CD1-CE1 3.42Å; Y197-F238 HydrophobicContact CD1-CE2 4.15Å; Y197-F238 HydrophobicContact CD1-CG 4.43Å; Y197-F238 AromaticContact CD1-CZ 3.57Å; Y197-F238 HydrophobicContact CD1-CZ 3.57Å; Y197-F238 AromaticContact CD2-CD1 3.49Å; Y197-F238 HydrophobicContact CD2-CD1 3.49Å; Y197-F238 VanDerWaalsContact CD2-CD1 3.49Å; Y197-F238 AromaticContact CD2-CE1 3.58Å; Y197-F238 HydrophobicContact CD2-CE1 3.58Å; Y197-F238 HydrophobicContact CD2-CG 4.4Å; Y197-F238 AromaticContact CE1-CD1 3.65Å; Y197-F238 HydrophobicContact CE1-CD1 3.65Å; Y197-F238 AromaticContact CE1-CD2 3.87Å; Y197-F238 HydrophobicContact CE1-CD2 3.87Å; Y197-F238 AromaticContact CE1-CE1 3.63Å; Y197-F238 HydrophobicContact CE1-CE1 3.63Å; Y197-F238 AromaticContact CE1-CE2 3.83Å; Y197-F238 HydrophobicContact CE1-CE2 3.83Å; Y197-F238 AromaticContact CE1-CG 3.78Å; Y197-F238 HydrophobicContact CE1-CG 3.78Å; Y197-F238 AromaticContact CE1-CZ 3.71Å; Y197-F238 HydrophobicContact CE1-CZ 3.71Å; Y197-F238 HydrophobicContact CE2-CB 4.11Å; Y197-F238 AromaticContact CE2-CD1 3.24Å; Y197-F238 HydrophobicContact CE2-CD1 3.24Å; Y197-F238 AromaticContact CE2-CE1 3.78Å; Y197-F238 HydrophobicContact CE2-CE1 3.78Å; Y197-F238 AromaticContact CE2-CG 3.75Å; Y197-F238 HydrophobicContact CE2-CG 3.75Å; Y197-F238 AromaticContact CG-CD1 3.8Å; Y197-F238 HydrophobicContact CG-CD1 3.8Å; Y197-F238 AromaticContact CG-CE1 3.39Å; Y197-F238 HydrophobicContact CG-CE1 3.39Å; Y197-F238 HydrophobicContact CG-CZ 4.01Å; Y197-F238 AromaticContact CZ-CD1 3.33Å; Y197-F238 AromaticContact CZ-CD2 3.92Å; Y197-F238 AromaticContact CZ-CE1 3.8Å; Y197-F238 AromaticContact CZ-CG 3.39Å; Y197-F238 WeakPolarHBondContact OH-CB 3.21Å; Y197-F238 WeakPolarHBondContact OH-CG 3.48Å; L200-F238 HydrophobicContact CB-CZ 4.12Å; L200-F238 HydrophobicContact CD2-CE2 3.44Å; L200-F238 VanDerWaalsContact CD2-CE2 3.44Å; L200-F238 HydrophobicContact CD2-CZ 3.46Å; L200-F238 VanDerWaalsContact CD2-CZ 3.46Å; L200-F238 HydrophobicContact CG-CZ 4.43Å; M234-F238 HydrophobicContact CE-CD2 3.8Å; M234-F238 HydrophobicContact CE-CE2 3.86Å; N235-F238 PolarHBondContact O-N 3.11Å; N235-F238 VanDerWaalsContact O-N 3.09Å; P236-F238 PolarHBondContact O-N 2.89Å; F238-C240 VanDerWaalsContact C-N 3.3Å; F238-C240 PolarHBondContact O-N 2.85Å
239	N	55.6	Low	64.5	Low	72 Å²	72	63.7 Å²	63.7	39%	0.385	38%	0.375	S	S	.	.			trans	-65.7	86.1	169.5	-170.4	6.4	0	0	0	111.5	P236 A320	P236-N239 WeakPolarHBondContact O-CB 3.41Å; P236-N239 PolarHBondContact O-N 3.44Å; N239-A320 PolarHBondContact OD1-N 3.42Å
240	C	58.4	Low	66.3	Low	52 Å²	52	62.5 Å²	62.5	35%	0.351	37%	0.371	S	S	.	.			trans	-92.6	127.2	176.8	-64.4	0	0	0	0	110	F238 N242 E319	F238-C240 VanDerWaalsContact C-N 3.3Å; F238-C240 PolarHBondContact O-N 2.85Å; C240-N242 PolarHBondContact O-N 3.48Å; C240-E319 WeakPolarHBondContact O-CG 3.49Å
241	S	64.2	Low	68.2	Low	74 Å²	74	56.7 Å²	56.7	52%	0.517	36%	0.357	S	S	.	.			trans	-77.3	52.3	-177.3	45.3	0	0	0	0	114.2	L243 G245 E319	S241-L243 VanDerWaalsContact C-N 3.35Å; S241-L243 PolarHBondContact O-N 2.89Å; S241-G245 PolarHBondContact O-N 2.89Å; S241-E319 VanDerWaalsContact CA-OE1 3.27Å; S241-E319 WeakPolarHBondContact CA-OE1 3.41Å
242	N	72.9	Confident	70	Confident	55 Å²	55	58.6 Å²	58.6	29%	0.294	37%	0.365	S	S	.	.	H	α-helix	trans	-62.3	-38.9	-175.5	-177.7	22.4	0	0	0	112.1	C240 A244 G245 S246 W317 E319	C240-N242 PolarHBondContact O-N 3.48Å; N242-A244 PolarHBondContact O-N 2.84Å; N242-G245 PolarHBondContact O-N 3.39Å; N242-S246 VanDerWaalsContact O-CB 3.23Å; N242-S246 WeakPolarHBondContact O-CB 3.42Å; N242-S246 PolarHBondContact O-N 3.47Å; N242-S246 PolarHBondContact O-OG 3.08Å; N242-S246 WeakPolarHBondContact OD1-CB 3.35Å; N242-S246 PolarHBondContact OD1-OG 2.97Å; N242-W317 HydrophobicContact CB-CG 4.45Å; N242-E319 PolarHBondContact N-OE1 2.91Å; N242-E319 PolarHBondContact N-OE2 3.45Å
243	L	79.3	Confident	71.6	Confident	19 Å²	19	59.9 Å²	59.9	10%	0.099	37%	0.372	C	S	.	.	H	α-helix	trans	-55.4	-51.7	-179.7	-174.2	71.7	0	0	0	111.8	S241 F247 L250 L275 W317 E319 Y324	S241-L243 VanDerWaalsContact C-N 3.35Å; S241-L243 PolarHBondContact O-N 2.89Å; L243-F247 HydrophobicContact CD1-CD2 4.42Å; L243-F247 WeakPolarHBondContact O-CB 3.23Å; L243-F247 PolarHBondContact O-N 2.73Å; L243-L250 HydrophobicContact CD1-CD2 3.95Å; L243-L250 HydrophobicContact CD2-CD2 3.68Å; L243-L250 HydrophobicContact CG-CD2 3.77Å; L243-L275 HydrophobicContact CD1-CD1 3.42Å; L243-L275 VanDerWaalsContact CD1-CD1 3.42Å; L243-W317 HydrophobicContact CB-CZ2 4.44Å; L243-W317 HydrophobicContact CD1-CZ2 4.14Å; L243-E319 VanDerWaalsContact CB-OE1 3.29Å; L243-E319 WeakPolarHBondContact CB-OE1 3.27Å; L243-E319 VanDerWaalsContact CB-OE2 3.3Å; L243-E319 WeakPolarHBondContact CB-OE2 3.35Å; L243-E319 PolarHBondContact N-OE1 2.8Å; L243-E319 PolarHBondContact N-OE2 3.21Å; L243-Y324 HydrophobicContact CD1-CD1 4.07Å; L243-Y324 HydrophobicContact CD1-CE1 3.9Å; L243-Y324 HydrophobicContact CD2-CE1 3.66Å; L243-Y324 HydrophobicContact CG-CE1 4.31Å
244	A	71.5	Confident	73.3	Confident	63 Å²	63	58.3 Å²	58.3	52%	0.521	35%	0.351	S	S	.	.	H	α-helix	trans	-69.7	-38.3	-178.8	0	0	0	0	0	112.6	N242 R267	N242-A244 PolarHBondContact O-N 2.84Å; A244-R267 PolarHBondContact O-NE 3.15Å; A244-R267 PolarHBondContact O-NH2 3.2Å
245	G	74.8	Confident	75	Confident	57 Å²	57	60.7 Å²	60.7	59%	0.588	36%	0.355	S	S	*	.	H	α-helix	trans	-72.1	-36.3	-179.4	0	0	0	0	0	114.1	S241 N242 R267	S241-G245 PolarHBondContact O-N 2.89Å; N242-G245 PolarHBondContact O-N 3.39Å; G245-R267 VanDerWaalsContact O-CD 3.3Å; G245-R267 WeakPolarHBondContact O-CD 3.03Å
246	S	86.9	Confident	76.3	Confident	33 Å²	33	58 Å²	58	23%	0.231	34%	0.343	C	S	.	.	H	α-helix	trans	-99.1	-23.5	-173.6	-61.8	0	0	0	0	113.8	N242 H266 R267	N242-S246 VanDerWaalsContact O-CB 3.23Å; N242-S246 WeakPolarHBondContact O-CB 3.42Å; N242-S246 PolarHBondContact O-N 3.47Å; N242-S246 PolarHBondContact O-OG 3.08Å; N242-S246 WeakPolarHBondContact OD1-CB 3.35Å; N242-S246 PolarHBondContact OD1-OG 2.97Å; S246-H266 PolarHBondContact O-CD2 3.1Å; S246-R267 WeakPolarHBondContact O-CG 3.36Å; S246-R267 PolarHBondContact O-N 3.3Å
247	F	91.6	Very high	77.6	Confident	4 Å²	4	61.6 Å²	61.6	2%	0.018	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	155.6	-174.3	-58.6	-92	0	0	0	113.8	L243 L250 A264 R265 H266 R267 Y273 L275 W317 Q326	L243-F247 HydrophobicContact CD1-CD2 4.42Å; L243-F247 WeakPolarHBondContact O-CB 3.23Å; L243-F247 PolarHBondContact O-N 2.73Å; F247-L250 HydrophobicContact CB-CD1 3.98Å; F247-A264 HydrophobicContact CB-CB 4.09Å; F247-A264 HydrophobicContact CD1-CB 4Å; F247-A264 HydrophobicContact CG-CB 4.32Å; F247-R265 CarbonylContact C-O 3.58Å; F247-R265 WeakPolarHBondContact CA-O 3.33Å; F247-H266 HydrophobicContact CD1-CB 4.01Å; F247-H266 HydrophobicContact CE1-CB 3.86Å; F247-R267 VanDerWaalsContact O-CZ 3.28Å; F247-R267 PolarHBondContact O-NE 3.23Å; F247-R267 PolarHBondContact O-NH2 2.77Å; F247-Y273 HydrophobicContact CE1-CD2 4.16Å; F247-L275 HydrophobicContact CD1-CD1 4.01Å; F247-L275 HydrophobicContact CD2-CD1 4.07Å; F247-L275 HydrophobicContact CE1-CD1 4.21Å; F247-L275 HydrophobicContact CE1-CD2 3.96Å; F247-L275 HydrophobicContact CE2-CD1 4.27Å; F247-L275 HydrophobicContact CG-CD1 3.94Å; F247-L275 HydrophobicContact CZ-CD1 4.34Å; F247-L275 HydrophobicContact CZ-CD2 3.96Å; F247-W317 HydrophobicContact CD2-CH2 4.36Å; F247-W317 AromaticContact CE2-CH2 3.51Å; F247-W317 HydrophobicContact CE2-CH2 3.51Å; F247-W317 HydrophobicContact CE2-CZ2 4.13Å; F247-W317 HydrophobicContact CE2-CZ3 4.25Å; F247-W317 HydrophobicContact CZ-CH2 4.03Å; F247-W317 HydrophobicContact CZ-CZ3 4.5Å; F247-Q326 HydrophobicContact CZ-CG 4.44Å
248	S	89.8	Confident	79.1	Confident	28 Å²	28	60.4 Å²	60.4	20%	0.196	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	169.6	174.5	62.1	0	0	0	0	110.9	L250 R265	S248-L250 VanDerWaalsContact C-N 3.34Å; S248-L250 PolarHBondContact O-N 2.7Å; S248-R265 PolarHBondContact N-O 3.25Å; S248-R265 PolarHBondContact O-N 3.27Å; S248-R265 PolarHBondContact OG-O 3.27Å
249	N	88.4	Confident	80.6	Confident	95 Å²	95	59.9 Å²	59.9	51%	0.508	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	50.3	50.3	-179.5	-60.5	19.5	0	0	0	112.7	V251	N249-V251 PolarHBondContact O-N 3.35Å
250	L	91.2	Very high	82.2	Confident	72 Å²	72	56.6 Å²	56.6	38%	0.377	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	125.5	174.2	-80.7	70.3	0	0	0	109.6	L243 F247 S248 K263 A264	L243-L250 HydrophobicContact CD1-CD2 3.95Å; L243-L250 HydrophobicContact CD2-CD2 3.68Å; L243-L250 HydrophobicContact CG-CD2 3.77Å; F247-L250 HydrophobicContact CB-CD1 3.98Å; S248-L250 VanDerWaalsContact C-N 3.34Å; S248-L250 PolarHBondContact O-N 2.7Å; L250-K263 CarbonylContact C-O 3.48Å; L250-K263 VanDerWaalsContact CA-O 3.31Å; L250-K263 WeakPolarHBondContact CA-O 3.44Å; L250-A264 HydrophobicContact CD1-CB 4.1Å; L250-A264 HydrophobicContact CG-CB 4.08Å
251	V	92.1	Very high	83.8	Confident	72 Å²	72	56 Å²	56	44%	0.436	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	128.5	178.5	-179.5	0	0	0	0	109.1	N249 I253 Y262 K263	N249-V251 PolarHBondContact O-N 3.35Å; V251-I253 PolarHBondContact O-N 2.88Å; V251-Y262 CarbonylContact O-C 3.58Å; V251-Y262 WeakPolarHBondContact O-CA 3.31Å; V251-K263 HydrophobicContact CB-CB 4.47Å; V251-K263 PolarHBondContact N-O 2.91Å; V251-K263 PolarHBondContact O-N 3.35Å
252	D	90.2	Very high	85.2	Confident	77 Å²	77	54.1 Å²	54.1	41%	0.412	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	127.5	174.6	-63	-16.9	0	0	0	110.9	R255 Y262	D252-R255 IonicContact OD1-NH2 2.83Å; D252-R255 IonicContact OD2-CZ 3.79Å; D252-R255 IonicContact OD2-NH1 3.35Å; D252-R255 PolarHBondContact OD2-NH1 3.08Å; D252-R255 IonicContact OD2-NH2 3.29Å; D252-R255 PolarHBondContact OD2-NH2 3.31Å; D252-Y262 VanDerWaalsContact OD1-CD1 3.28Å; D252-Y262 WeakPolarHBondContact OD1-CD1 3.3Å; D252-Y262 WeakPolarHBondContact OD1-CE1 3.31Å
253	I	88	Confident	86.2	Confident	90 Å²	90	52.8 Å²	52.8	46%	0.462	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	-48.3	171.4	-51	172.9	0	0	0	110.1	V251 L261 K263 L329	V251-I253 PolarHBondContact O-N 2.88Å; I253-L261 HydrophobicContact CB-CB 4.46Å; I253-L261 WeakPolarHBondContact CB-O 3.41Å; I253-L261 PolarHBondContact N-O 2.97Å; I253-K263 HydrophobicContact CD1-CB 3.88Å; I253-K263 HydrophobicContact CG1-CB 3.87Å; I253-L329 HydrophobicContact CD1-CD1 3.9Å
254	C	87	Confident	86.9	Confident	30 Å²	30	51.9 Å²	51.9	20%	0.203	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	146.8	-171.8	-176.7	0	0	0	0	110.8	L261	C254-L261 HydrophobicContact CB-CB 4.38Å; C254-L261 PolarHBondContact N-O 3.41Å; C254-L261 PolarHBondContact O-N 3.22Å
255	R	86.2	Confident	87.8	Confident	134 Å²	134	50.6 Å²	50.6	51%	0.506	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	120.7	168.4	-73.7	-177.9	169.9	75.8	8.7	108.7	D252 V260	D252-R255 IonicContact OD1-NH2 2.83Å; D252-R255 IonicContact OD2-CZ 3.79Å; D252-R255 IonicContact OD2-NH1 3.35Å; D252-R255 PolarHBondContact OD2-NH1 3.08Å; D252-R255 IonicContact OD2-NH2 3.29Å; D252-R255 PolarHBondContact OD2-NH2 3.31Å; R255-V260 HydrophobicContact CG-CG1 4.02Å; R255-V260 HydrophobicContact CG-CG2 4.21Å
256	T	78.9	Confident	88.6	Confident	54 Å²	54	49.7 Å²	49.7	33%	0.331	25%	0.248	S	C	.	.			trans	-105.9	-179.9	172	78.8	0	0	0	0	110.4	L258 A259 L261 R279	T256-L258 PolarHBondContact O-N 2.91Å; T256-L258 PolarHBondContact OG1-N 3.47Å; T256-L258 VanDerWaalsContact OG1-N 3.16Å; T256-A259 PolarHBondContact N-O 2.86Å; T256-A259 PolarHBondContact OG1-N 2.79Å; T256-A259 PolarHBondContact OG1-O 3.35Å; T256-L261 HydrophobicContact CG2-CD1 4.43Å; T256-R279 PolarHBondContact O-NH2 3.46Å
257	R	77.5	Confident	88.7	Confident	130 Å²	130	55 Å²	55	49%	0.491	26%	0.263	S	S	.	.	S	Bend	trans	-62.3	-30.2	170.2	-175.6	173.8	65.6	82.9	0.3	112.4	R279 L284	R257-R279 WeakPolarHBondContact O-CG 3.33Å; R257-L284 WeakPolarHBondContact O-CD2 3.42Å
258	L	80.2	Confident	88.5	Confident	45 Å²	45	62.6 Å²	62.6	24%	0.236	30%	0.303	C	S	.	.	S	Bend	trans	-111.7	-20	-168.4	-62.2	168.5	0	0	0	113.8	T256 R279 E294	T256-L258 PolarHBondContact O-N 2.91Å; T256-L258 PolarHBondContact OG1-N 3.47Å; T256-L258 VanDerWaalsContact OG1-N 3.16Å; L258-R279 PolarHBondContact O-N 3.41Å; L258-E294 WeakPolarHBondContact CD1-OE2 3.48Å
259	A	87.3	Confident	88.5	Confident	2 Å²	2	64.2 Å²	64.2	2%	0.017	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	164.6	-175.8	0	0	0	0	0	113.6	T256 L261 K276 R277	T256-A259 PolarHBondContact N-O 2.86Å; T256-A259 PolarHBondContact OG1-N 2.79Å; T256-A259 PolarHBondContact OG1-O 3.35Å; A259-L261 HydrophobicContact CB-CD1 4.13Å; A259-K276 HydrophobicContact CB-CD 4.41Å; A259-K276 HydrophobicContact CB-CG 3.79Å; A259-R277 CarbonylContact C-O 3.46Å; A259-R277 WeakPolarHBondContact CA-O 3.16Å; A259-R277 VanDerWaalsContact CB-O 3.31Å; A259-R277 WeakPolarHBondContact CB-O 3.46Å
260	V	89.4	Confident	88.4	Confident	2 Å²	2	61.3 Å²	61.3	1%	0.012	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	130.1	163.2	-174.2	0	0	0	0	108.1	R255 Y262 R277	R255-V260 HydrophobicContact CG-CG1 4.02Å; R255-V260 HydrophobicContact CG-CG2 4.21Å; V260-Y262 HydrophobicContact CB-CE2 4.05Å; V260-Y262 HydrophobicContact CG1-CD1 4.4Å; V260-Y262 HydrophobicContact CG1-CD2 4.5Å; V260-Y262 HydrophobicContact CG1-CE1 3.77Å; V260-Y262 HydrophobicContact CG1-CE2 3.87Å; V260-Y262 VanDerWaalsContact CG1-CZ 3.46Å; V260-R277 PolarHBondContact N-O 3.38Å; V260-R277 PolarHBondContact O-N 2.96Å
261	L	93.1	Very high	88.3	Confident	40 Å²	40	59.9 Å²	59.9	21%	0.209	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	123.1	-178.7	-71.9	76.5	0	0	0	109.4	I253 C254 T256 A259 L275 K276	I253-L261 HydrophobicContact CB-CB 4.46Å; I253-L261 WeakPolarHBondContact CB-O 3.41Å; I253-L261 PolarHBondContact N-O 2.97Å; C254-L261 HydrophobicContact CB-CB 4.38Å; C254-L261 PolarHBondContact N-O 3.41Å; C254-L261 PolarHBondContact O-N 3.22Å; T256-L261 HydrophobicContact CG2-CD1 4.43Å; A259-L261 HydrophobicContact CB-CD1 4.13Å; L261-L275 WeakPolarHBondContact CA-O 3.39Å; L261-K276 HydrophobicContact CD1-CG 4.32Å; L261-K276 HydrophobicContact CG-CG 4.28Å
262	Y	93.7	Very high	88.3	Confident	34 Å²	34	56.8 Å²	56.8	13%	0.133	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	141	178.4	-50.4	-87.6	0	0	0	111.1	V251 D252 V260 C274 L275 R277 Y324	V251-Y262 CarbonylContact O-C 3.58Å; V251-Y262 WeakPolarHBondContact O-CA 3.31Å; D252-Y262 VanDerWaalsContact OD1-CD1 3.28Å; D252-Y262 WeakPolarHBondContact OD1-CD1 3.3Å; D252-Y262 WeakPolarHBondContact OD1-CE1 3.31Å; V260-Y262 HydrophobicContact CB-CE2 4.05Å; V260-Y262 HydrophobicContact CG1-CD1 4.4Å; V260-Y262 HydrophobicContact CG1-CD2 4.5Å; V260-Y262 HydrophobicContact CG1-CE1 3.77Å; V260-Y262 HydrophobicContact CG1-CE2 3.87Å; V260-Y262 VanDerWaalsContact CG1-CZ 3.46Å; Y262-C274 CarbonylContact O-C 3.6Å; Y262-C274 WeakPolarHBondContact O-CA 3.49Å; Y262-L275 PolarHBondContact N-O 3.3Å; Y262-L275 PolarHBondContact O-N 3.46Å; Y262-R277 HydrophobicContact CD2-CB 4.45Å; Y262-R277 HydrophobicContact CE2-CB 3.71Å; Y262-R277 PolarHBondContact OH-NE 3.18Å; Y262-Y324 HydrophobicContact CE2-CE1 4.46Å
263	K	93.3	Very high	88.5	Confident	28 Å²	28	54.2 Å²	54.2	12%	0.122	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	132.1	159.2	-179.3	175.3	71.2	-179.9	0	107	L250 V251 I253 L272 L329 E434	L250-K263 CarbonylContact C-O 3.48Å; L250-K263 VanDerWaalsContact CA-O 3.31Å; L250-K263 WeakPolarHBondContact CA-O 3.44Å; V251-K263 HydrophobicContact CB-CB 4.47Å; V251-K263 PolarHBondContact N-O 2.91Å; V251-K263 PolarHBondContact O-N 3.35Å; I253-K263 HydrophobicContact CD1-CB 3.88Å; I253-K263 HydrophobicContact CG1-CB 3.87Å; K263-L272 HydrophobicContact CD-CD1 4.41Å; K263-L272 HydrophobicContact CG-CD2 4.25Å; K263-L329 HydrophobicContact CD-CD2 3.96Å; K263-L329 HydrophobicContact CG-CD2 3.98Å; K263-E434 WeakPolarHBondContact CD-OE2 3.43Å; K263-E434 WeakPolarHBondContact CE-OE2 3.39Å; K263-E434 IonicContact NZ-OE1 2.66Å; K263-E434 PolarHBondContact NZ-OE1 2.86Å; K263-E434 IonicContact NZ-OE2 2.65Å; K263-E434 PolarHBondContact NZ-OE2 2.89Å
264	A	93.5	Very high	88.9	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	148.2	176.5	0	0	0	0	0	111.6	F247 L250 L272 Y273 L275	F247-A264 HydrophobicContact CB-CB 4.09Å; F247-A264 HydrophobicContact CD1-CB 4Å; F247-A264 HydrophobicContact CG-CB 4.32Å; L250-A264 HydrophobicContact CD1-CB 4.1Å; L250-A264 HydrophobicContact CG-CB 4.08Å; A264-L272 WeakPolarHBondContact O-CA 3.29Å; A264-Y273 PolarHBondContact N-O 2.88Å; A264-Y273 PolarHBondContact O-N 3.5Å; A264-L275 HydrophobicContact CB-CD1 3.63Å; A264-L275 HydrophobicContact CB-CG 4.04Å
265	R	91.3	Very high	89.3	Confident	35 Å²	35	49.1 Å²	49.1	13%	0.132	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	121.9	174.7	-162.8	172.9	-67.9	-79.5	2.7	109.4	F247 S248 R267 G270 V271 L272 S428 D431	F247-R265 CarbonylContact C-O 3.58Å; F247-R265 WeakPolarHBondContact CA-O 3.33Å; S248-R265 PolarHBondContact N-O 3.25Å; S248-R265 PolarHBondContact O-N 3.27Å; S248-R265 PolarHBondContact OG-O 3.27Å; R265-R267 PolarHBondContact O-N 2.84Å; R265-G270 WeakPolarHBondContact CD-O 3.24Å; R265-G270 VanDerWaalsContact CG-O 3.24Å; R265-G270 WeakPolarHBondContact CG-O 3.31Å; R265-G270 PolarHBondContact NH1-O 3.01Å; R265-V271 WeakPolarHBondContact CA-O 3.04Å; R265-L272 HydrophobicContact CB-CD2 3.89Å; R265-L272 HydrophobicContact CG-CD2 4.2Å; R265-S428 PolarHBondContact NH1-O 3.2Å; R265-S428 PolarHBondContact NH2-O 2.92Å; R265-D431 IonicContact CZ-OD1 2.97Å; R265-D431 IonicContact NH2-OD1 2.73Å; R265-D431 PolarHBondContact NH2-OD1 3.13Å
266	H	91.3	Very high	89.7	Confident	38 Å²	38	44 Å²	44	18%	0.176	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	126.5	176.4	178.1	-119.8	0	0	0	110	S246 F247 L268 S269 G270 V271 Y273	S246-H266 PolarHBondContact O-CD2 3.1Å; F247-H266 HydrophobicContact CD1-CB 4.01Å; F247-H266 HydrophobicContact CE1-CB 3.86Å; H266-L268 PolarHBondContact O-N 2.88Å; H266-S269 PolarHBondContact ND1-N 2.87Å; H266-S269 PolarHBondContact ND1-OG 3.48Å; H266-G270 WeakPolarHBondContact O-CA 3.3Å; H266-G270 PolarHBondContact O-N 3.14Å; H266-V271 PolarHBondContact N-O 3.35Å; H266-Y273 HydrophobicContact CB-CD2 3.82Å; H266-Y273 HydrophobicContact CB-CE2 3.55Å
267	R	89.6	Confident	90.3	Very high	144 Å²	144	42.7 Å²	42.7	54%	0.543	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-36.6	-168.1	-68.6	174.9	-174	-101.1	6.8	113.7	A244 G245 S246 F247 R265	A244-R267 PolarHBondContact O-NE 3.15Å; A244-R267 PolarHBondContact O-NH2 3.2Å; G245-R267 VanDerWaalsContact O-CD 3.3Å; G245-R267 WeakPolarHBondContact O-CD 3.03Å; S246-R267 WeakPolarHBondContact O-CG 3.36Å; S246-R267 PolarHBondContact O-N 3.3Å; F247-R267 VanDerWaalsContact O-CZ 3.28Å; F247-R267 PolarHBondContact O-NE 3.23Å; F247-R267 PolarHBondContact O-NH2 2.77Å; R265-R267 PolarHBondContact O-N 2.84Å
268	L	87	Confident	90.7	Very high	164 Å²	164	36.9 Å²	36.9	86%	0.859	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-27.5	-175.2	-60.9	176.4	0	0	0	113.7	H266	H266-L268 PolarHBondContact O-N 2.88Å
269	S	88.3	Confident	90.9	Very high	62 Å²	62	37.4 Å²	37.4	43%	0.434	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.7	-12.8	-179.8	65	0	0	0	0	114.3	H266 V271	H266-S269 PolarHBondContact ND1-N 2.87Å; H266-S269 PolarHBondContact ND1-OG 3.48Å; S269-V271 PolarHBondContact O-N 2.9Å; S269-V271 VanDerWaalsContact O-N 3.11Å
270	G	87.2	Confident	90.1	Very high	35 Å²	35	37.6 Å²	37.6	36%	0.361	19%	0.189	S	C	.	.			trans	69.6	-3.3	-175.2	0	0	0	0	0	115	R265 H266	R265-G270 WeakPolarHBondContact CD-O 3.24Å; R265-G270 VanDerWaalsContact CG-O 3.24Å; R265-G270 WeakPolarHBondContact CG-O 3.31Å; R265-G270 PolarHBondContact NH1-O 3.01Å; H266-G270 WeakPolarHBondContact O-CA 3.3Å; H266-G270 PolarHBondContact O-N 3.14Å
271	V	89.3	Confident	89	Confident	41 Å²	41	43.1 Å²	43.1	25%	0.248	22%	0.219	C	C	.	.			trans	-76.2	144.1	-175.8	176.8	0	0	0	0	111.1	R265 H266 S269 Y273	R265-V271 WeakPolarHBondContact CA-O 3.04Å; H266-V271 PolarHBondContact N-O 3.35Å; S269-V271 PolarHBondContact O-N 2.9Å; S269-V271 VanDerWaalsContact O-N 3.11Å; V271-Y273 HydrophobicContact CB-CE2 3.69Å; V271-Y273 HydrophobicContact CG1-CD2 4.33Å; V271-Y273 HydrophobicContact CG1-CE1 4.38Å; V271-Y273 HydrophobicContact CG1-CE2 3.69Å; V271-Y273 WeakPolarHBondContact O-CD2 3.37Å
272	L	92.5	Very high	87.5	Confident	7 Å²	7	48.5 Å²	48.5	4%	0.037	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	139.6	171.8	-71.1	178.4	0	0	0	111.8	K263 A264 R265 L329	K263-L272 HydrophobicContact CD-CD1 4.41Å; K263-L272 HydrophobicContact CG-CD2 4.25Å; A264-L272 WeakPolarHBondContact O-CA 3.29Å; R265-L272 HydrophobicContact CB-CD2 3.89Å; R265-L272 HydrophobicContact CG-CD2 4.2Å; L272-L329 HydrophobicContact CB-CD2 3.82Å; L272-L329 HydrophobicContact CD1-CD2 3.96Å; L272-L329 HydrophobicContact CG-CD2 4.47Å
273	Y	94.6	Very high	85.9	Confident	23 Å²	23	49.4 Å²	49.4	9%	0.09	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	157.3	176.5	-65	-87.6	0	0	0	110.7	F247 A264 H266 V271 F314 Q326 L327	F247-Y273 HydrophobicContact CE1-CD2 4.16Å; A264-Y273 PolarHBondContact N-O 2.88Å; A264-Y273 PolarHBondContact O-N 3.5Å; H266-Y273 HydrophobicContact CB-CD2 3.82Å; H266-Y273 HydrophobicContact CB-CE2 3.55Å; V271-Y273 HydrophobicContact CB-CE2 3.69Å; V271-Y273 HydrophobicContact CG1-CD2 4.33Å; V271-Y273 HydrophobicContact CG1-CE1 4.38Å; V271-Y273 HydrophobicContact CG1-CE2 3.69Å; V271-Y273 WeakPolarHBondContact O-CD2 3.37Å; Y273-F314 AromaticContact CD1-CD2 3.93Å; Y273-F314 HydrophobicContact CD1-CD2 3.93Å; Y273-F314 HydrophobicContact CD1-CE2 4.02Å; Y273-F314 HydrophobicContact CD1-CG 4.36Å; Y273-F314 AromaticContact CE1-CD1 3.92Å; Y273-F314 HydrophobicContact CE1-CD1 3.92Å; Y273-F314 AromaticContact CE1-CD2 3.72Å; Y273-F314 HydrophobicContact CE1-CD2 3.72Å; Y273-F314 AromaticContact CE1-CE1 3.9Å; Y273-F314 HydrophobicContact CE1-CE1 3.9Å; Y273-F314 AromaticContact CE1-CE2 3.71Å; Y273-F314 HydrophobicContact CE1-CE2 3.71Å; Y273-F314 AromaticContact CE1-CG 3.83Å; Y273-F314 HydrophobicContact CE1-CG 3.83Å; Y273-F314 AromaticContact CE1-CZ 3.79Å; Y273-F314 HydrophobicContact CE1-CZ 3.79Å; Y273-Q326 HydrophobicContact CD1-CG 3.66Å; Y273-Q326 HydrophobicContact CE1-CG 4.29Å; Y273-Q326 HydrophobicContact CG-CG 3.93Å; Y273-Q326 VanDerWaalsContact CG-NE2 3.32Å; Y273-Q326 VanDerWaalsContact CZ-NE2 3.33Å; Y273-L327 WeakPolarHBondContact CA-O 3.37Å
274	C	95.8	Very high	84.5	Confident	14 Å²	14	48.9 Å²	48.9	10%	0.095	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	123.8	162.3	179.8	0	0	0	0	108.2	Y262 L327 L329	Y262-C274 CarbonylContact O-C 3.6Å; Y262-C274 WeakPolarHBondContact O-CA 3.49Å; C274-L327 HydrophobicContact CB-CB 4.29Å; C274-L327 PolarHBondContact N-O 3.5Å; C274-L327 PolarHBondContact O-N 3.11Å; C274-L329 HydrophobicContact CB-CD1 4.13Å
275	L	95.5	Very high	82.4	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	112.9	175.7	-54.8	-175.4	0	0	0	108.7	L243 F247 L261 Y262 A264 W317 T325 Q326	L243-L275 HydrophobicContact CD1-CD1 3.42Å; L243-L275 VanDerWaalsContact CD1-CD1 3.42Å; F247-L275 HydrophobicContact CD1-CD1 4.01Å; F247-L275 HydrophobicContact CD2-CD1 4.07Å; F247-L275 HydrophobicContact CE1-CD1 4.21Å; F247-L275 HydrophobicContact CE1-CD2 3.96Å; F247-L275 HydrophobicContact CE2-CD1 4.27Å; F247-L275 HydrophobicContact CG-CD1 3.94Å; F247-L275 HydrophobicContact CZ-CD1 4.34Å; F247-L275 HydrophobicContact CZ-CD2 3.96Å; L261-L275 WeakPolarHBondContact CA-O 3.39Å; Y262-L275 PolarHBondContact N-O 3.3Å; Y262-L275 PolarHBondContact O-N 3.46Å; A264-L275 HydrophobicContact CB-CD1 3.63Å; A264-L275 HydrophobicContact CB-CG 4.04Å; L275-W317 HydrophobicContact CD1-CH2 4.48Å; L275-W317 HydrophobicContact CD2-CH2 4.22Å; L275-T325 WeakPolarHBondContact CA-O 3.49Å; L275-Q326 HydrophobicContact CD2-CB 3.93Å; L275-Q326 HydrophobicContact CD2-CG 3.83Å
276	K	94.1	Very high	80.3	Confident	26 Å²	26	63.3 Å²	63.3	11%	0.113	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	107.7	174.9	-168.1	-174.1	-166.8	-171.8	0	108.1	A259 L261 E298 Y324 T325 D459	A259-K276 HydrophobicContact CB-CD 4.41Å; A259-K276 HydrophobicContact CB-CG 3.79Å; L261-K276 HydrophobicContact CD1-CG 4.32Å; L261-K276 HydrophobicContact CG-CG 4.28Å; K276-E298 WeakPolarHBondContact CD-OE2 3.5Å; K276-E298 WeakPolarHBondContact CE-OE2 3.45Å; K276-E298 IonicContact NZ-OE1 3.41Å; K276-E298 PolarHBondContact NZ-OE1 3.22Å; K276-E298 IonicContact NZ-OE2 2.73Å; K276-E298 PolarHBondContact NZ-OE2 2.8Å; K276-Y324 WeakPolarHBondContact O-CA 3.39Å; K276-T325 PolarHBondContact N-O 3.48Å; K276-T325 PolarHBondContact O-N 3.12Å; K276-D459 IonicContact NZ-OD1 3.91Å; K276-D459 PolarHBondContact NZ-OD1 3.32Å
277	R	91.3	Very high	78.2	Confident	26 Å²	26	65.8 Å²	65.8	10%	0.098	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	128.4	169.9	-173.9	-173.7	75.8	85.3	-4.5	108.5	A259 V260 Y262 E283 S322 V323 Y324	A259-R277 CarbonylContact C-O 3.46Å; A259-R277 WeakPolarHBondContact CA-O 3.16Å; A259-R277 VanDerWaalsContact CB-O 3.31Å; A259-R277 WeakPolarHBondContact CB-O 3.46Å; V260-R277 PolarHBondContact N-O 3.38Å; V260-R277 PolarHBondContact O-N 2.96Å; Y262-R277 HydrophobicContact CD2-CB 4.45Å; Y262-R277 HydrophobicContact CE2-CB 3.71Å; Y262-R277 PolarHBondContact OH-NE 3.18Å; R277-E283 IonicContact CZ-OE1 2.79Å; R277-E283 IonicContact CZ-OE2 3.57Å; R277-E283 VanDerWaalsContact CZ-OE2 3.31Å; R277-E283 IonicContact NH1-OE2 2.7Å; R277-E283 PolarHBondContact NH1-OE2 2.85Å; R277-E283 VanDerWaalsContact NH2-CD 3.29Å; R277-E283 IonicContact NH2-OE1 3.86Å; R277-E283 PolarHBondContact NH2-OE1 3.47Å; R277-E283 IonicContact NH2-OE2 3.63Å; R277-E283 PolarHBondContact NH2-OE2 3.27Å; R277-S322 VanDerWaalsContact CG-CB 3.46Å; R277-S322 PolarHBondContact NH1-OG 3.11Å; R277-V323 CarbonylContact C-O 3.55Å; R277-V323 WeakPolarHBondContact CA-O 3.47Å; R277-Y324 HydrophobicContact CB-CD1 3.9Å; R277-Y324 HydrophobicContact CB-CE1 3.68Å; R277-Y324 HydrophobicContact CB-CG 4.49Å; R277-Y324 WeakPolarHBondContact CD-OH 3.27Å; R277-Y324 HydrophobicContact CG-CD1 4.14Å; R277-Y324 HydrophobicContact CG-CD2 4.31Å; R277-Y324 HydrophobicContact CG-CE1 3.67Å; R277-Y324 HydrophobicContact CG-CE2 3.87Å; R277-Y324 HydrophobicContact CG-CG 4.45Å
278	S	87.4	Confident	76	Confident	9 Å²	9	66.7 Å²	66.7	6%	0.063	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	153.6	169.4	65.7	0	0	0	0	111.6	M295 S322 V323	S278-M295 WeakPolarHBondContact CB-SD 3.42Å; S278-M295 PolarHBondContact OG-SD 2.83Å; S278-S322 WeakPolarHBondContact OG-CA 3.32Å; S278-V323 PolarHBondContact N-O 2.79Å; S278-V323 PolarHBondContact OG-N 2.9Å
279	R	83.2	Confident	74	Confident	56 Å²	56	61 Å²	61	21%	0.211	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-67.4	144.1	158	-65.2	-58.6	-170.9	120.3	21.3	109.5	T256 R257 L258 E283 L284	T256-R279 PolarHBondContact O-NH2 3.46Å; R257-R279 WeakPolarHBondContact O-CG 3.33Å; L258-R279 PolarHBondContact O-N 3.41Å; R279-E283 WeakPolarHBondContact CA-OE2 3.49Å; R279-E283 HydrophobicContact CB-CB 4.14Å; R279-E283 WeakPolarHBondContact CD-OE1 3.3Å; R279-E283 IonicContact NH1-OE1 3.26Å; R279-E283 PolarHBondContact NH1-OE1 3.26Å; R279-L284 HydrophobicContact CB-CD1 3.79Å; R279-L284 HydrophobicContact CB-CG 3.84Å
280	C	71	Confident	72.3	Confident	5 Å²	5	60 Å²	60	3%	0.034	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-80.1	160.3	167.2	-57.6	0	0	0	0	110.2	F282 E283 L284 D321 S322	C280-F282 HydrophobicContact CB-CD1 3.43Å; C280-F282 VanDerWaalsContact CB-CD1 3.43Å; C280-F282 HydrophobicContact CB-CE1 3.3Å; C280-F282 HydrophobicContact CB-CG 4.26Å; C280-F282 HydrophobicContact CB-CZ 4.04Å; C280-F282 PolarHBondContact O-N 3.33Å; C280-F282 VanDerWaalsContact O-N 3.15Å; C280-E283 HydrophobicContact CB-CG 4.44Å; C280-E283 PolarHBondContact N-OE2 3.47Å; C280-E283 WeakPolarHBondContact O-CA 3.42Å; C280-E283 WeakPolarHBondContact O-CB 3.28Å; C280-E283 PolarHBondContact O-N 2.62Å; C280-L284 PolarHBondContact O-N 2.58Å; C280-D321 PolarHBondContact SG-O 3.33Å; C280-S322 PolarHBondContact SG-OG 2.83Å
281	D	66.2	Low	71.2	Confident	119 Å²	119	58.8 Å²	58.8	64%	0.636	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-57.6	-30.9	177.7	-66.6	-27.1	0	0	0	112.5	E283 L284	D281-E283 VanDerWaalsContact C-N 3.32Å; D281-E283 PolarHBondContact O-N 3.38Å; D281-L284 CarbonylContact O-C 3.57Å; D281-L284 PolarHBondContact O-N 3.07Å
282	F	61.5	Low	70.1	Confident	152 Å²	152	59.1 Å²	59.1	67%	0.667	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-72.7	-19.5	174.9	76.9	-100.4	0	0	0	114.2	C280 L284	C280-F282 HydrophobicContact CB-CD1 3.43Å; C280-F282 VanDerWaalsContact CB-CD1 3.43Å; C280-F282 HydrophobicContact CB-CE1 3.3Å; C280-F282 HydrophobicContact CB-CG 4.26Å; C280-F282 HydrophobicContact CB-CZ 4.04Å; C280-F282 PolarHBondContact O-N 3.33Å; C280-F282 VanDerWaalsContact O-N 3.15Å; F282-L284 VanDerWaalsContact C-N 3.32Å
283	E	60.8	Low	69.2	Low	53 Å²	53	61.6 Å²	61.6	25%	0.248	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-87.1	-6.4	172.2	-62.1	-177.2	86.6	0	0	112.2	R277 R279 C280 D281	R277-E283 IonicContact CZ-OE1 2.79Å; R277-E283 IonicContact CZ-OE2 3.57Å; R277-E283 VanDerWaalsContact CZ-OE2 3.31Å; R277-E283 IonicContact NH1-OE2 2.7Å; R277-E283 PolarHBondContact NH1-OE2 2.85Å; R277-E283 VanDerWaalsContact NH2-CD 3.29Å; R277-E283 IonicContact NH2-OE1 3.86Å; R277-E283 PolarHBondContact NH2-OE1 3.47Å; R277-E283 IonicContact NH2-OE2 3.63Å; R277-E283 PolarHBondContact NH2-OE2 3.27Å; R279-E283 WeakPolarHBondContact CA-OE2 3.49Å; R279-E283 HydrophobicContact CB-CB 4.14Å; R279-E283 WeakPolarHBondContact CD-OE1 3.3Å; R279-E283 IonicContact NH1-OE1 3.26Å; R279-E283 PolarHBondContact NH1-OE1 3.26Å; C280-E283 HydrophobicContact CB-CG 4.44Å; C280-E283 PolarHBondContact N-OE2 3.47Å; C280-E283 WeakPolarHBondContact O-CA 3.42Å; C280-E283 WeakPolarHBondContact O-CB 3.28Å; C280-E283 PolarHBondContact O-N 2.62Å; D281-E283 VanDerWaalsContact C-N 3.32Å; D281-E283 PolarHBondContact O-N 3.38Å
284	L	62.9	Low	68.4	Low	17 Å²	17	61.5 Å²	61.5	9%	0.089	32%	0.322	C	S	.	.	S	Bend	trans	-114.9	64.9	-175.3	-80.1	164.9	0	0	0	110.2	R257 R279 C280 D281 F282 H286 L287 S291	R257-L284 WeakPolarHBondContact O-CD2 3.42Å; R279-L284 HydrophobicContact CB-CD1 3.79Å; R279-L284 HydrophobicContact CB-CG 3.84Å; C280-L284 PolarHBondContact O-N 2.58Å; D281-L284 CarbonylContact O-C 3.57Å; D281-L284 PolarHBondContact O-N 3.07Å; F282-L284 VanDerWaalsContact C-N 3.32Å; L284-H286 PolarHBondContact O-N 2.84Å; L284-H286 VanDerWaalsContact O-N 3.07Å; L284-L287 HydrophobicContact CD2-CD1 4.2Å; L284-L287 PolarHBondContact O-N 2.8Å; L284-S291 VanDerWaalsContact CD1-CB 3.5Å
285	E	50.2	Low	67.7	Low	161 Å²	161	62.4 Å²	62.4	75%	0.752	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.2	117.9	175.8	-68.1	-171	176.5	0	0	111.5
286	H	46.9	Very low	67	Low	178 Å²	178	65.3 Å²	65.3	82%	0.824	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.4	26.3	171	-48.7	92.7	0	0	0	118.8	L284	L284-H286 PolarHBondContact O-N 2.84Å; L284-H286 VanDerWaalsContact O-N 3.07Å
287	L	47.8	Very low	66.7	Low	89 Å²	89	64.5 Å²	64.5	47%	0.466	34%	0.338	S	S	.	.			trans	-112.7	116	175.1	-84.1	163.1	0	0	0	114.9	L284 G289	L284-L287 HydrophobicContact CD2-CD1 4.2Å; L284-L287 PolarHBondContact O-N 2.8Å; L287-G289 PolarHBondContact O-N 2.88Å
288	N	43.2	Very low	66.7	Low	163 Å²	163	63.7 Å²	63.7	87%	0.872	34%	0.335	S	S	*	.			trans	-68.7	94.3	-179.3	-72.2	-24.8	0	0	0	113.1	S290	N288-S290 PolarHBondContact O-N 2.9Å
289	G	45.5	Very low	66.9	Low	44 Å²	44	64.3 Å²	64.3	45%	0.454	34%	0.339	S	S	.	.	S	Bend	trans	70.8	-20.1	156.8	0	0	0	0	0	118.8	L287 S291 S292	L287-G289 PolarHBondContact O-N 2.88Å; G289-S291 PolarHBondContact O-N 3.11Å; G289-S292 PolarHBondContact O-N 2.72Å; G289-S292 PolarHBondContact O-OG 2.91Å
290	S	52.2	Low	67.4	Low	41 Å²	41	62.7 Å²	62.7	29%	0.287	33%	0.333	S	S	.	.	H	α-helix	trans	-51.1	-44.9	-174.1	159.4	0	0	0	0	114.3	N288 S292 V293 E294	N288-S290 PolarHBondContact O-N 2.9Å; S290-S292 VanDerWaalsContact C-N 3.31Å; S290-S292 PolarHBondContact O-N 2.82Å; S290-V293 PolarHBondContact O-N 3.38Å; S290-E294 PolarHBondContact O-N 3.19Å
291	S	63	Low	68.6	Low	11 Å²	11	62.5 Å²	62.5	8%	0.077	33%	0.332	C	S	.	.	H	α-helix	trans	-61.3	-37	-171.8	-173.9	0	0	0	0	113.2	L284 G289 V293 M295	L284-S291 VanDerWaalsContact CD1-CB 3.5Å; G289-S291 PolarHBondContact O-N 3.11Å; S291-V293 VanDerWaalsContact C-N 3.27Å; S291-V293 PolarHBondContact O-N 3.21Å; S291-M295 WeakPolarHBondContact O-CB 3.2Å; S291-M295 PolarHBondContact O-N 3.29Å; S291-M295 VanDerWaalsContact O-N 3.09Å
292	S	67.5	Low	70	Confident	48 Å²	48	57 Å²	57	34%	0.336	30%	0.303	S	S	.	.	H	α-helix	trans	-60	-35.2	176.5	69.4	0	0	0	0	113.2	G289 S290 L296	G289-S292 PolarHBondContact O-N 2.72Å; G289-S292 PolarHBondContact O-OG 2.91Å; S290-S292 VanDerWaalsContact C-N 3.31Å; S290-S292 PolarHBondContact O-N 2.82Å; S292-L296 WeakPolarHBondContact O-CB 3.2Å; S292-L296 VanDerWaalsContact O-CG 3.27Å; S292-L296 WeakPolarHBondContact O-CG 3.48Å; S292-L296 PolarHBondContact O-N 3.46Å; S292-L296 VanDerWaalsContact O-N 3.17Å
293	V	73	Confident	71.6	Confident	58 Å²	58	52.4 Å²	52.4	35%	0.352	29%	0.293	S	S	.	.	H	α-helix	trans	-80.1	-43.7	-175.6	-176.6	0	0	0	0	111.2	S290 S291 M295 L296 N297	S290-V293 PolarHBondContact O-N 3.38Å; S291-V293 VanDerWaalsContact C-N 3.27Å; S291-V293 PolarHBondContact O-N 3.21Å; V293-M295 VanDerWaalsContact C-N 3.34Å; V293-M295 PolarHBondContact O-N 3.46Å; V293-L296 PolarHBondContact O-N 3Å; V293-N297 WeakPolarHBondContact O-CB 3.46Å; V293-N297 PolarHBondContact O-N 2.95Å; V293-N297 PolarHBondContact O-ND2 2.97Å
294	E	76.7	Confident	73.3	Confident	21 Å²	21	51.3 Å²	51.3	10%	0.098	29%	0.288	C	S	.	.	H	α-helix	trans	-61.1	-44.5	174.3	-66.9	-173.9	134.1	0	0	111.2	L258 S290 L296 N297 E298 G461 R462	L258-E294 WeakPolarHBondContact CD1-OE2 3.48Å; S290-E294 PolarHBondContact O-N 3.19Å; E294-L296 PolarHBondContact O-N 3.42Å; E294-N297 PolarHBondContact O-N 2.57Å; E294-E298 PolarHBondContact O-N 2.88Å; E294-G461 WeakPolarHBondContact CA-O 3.4Å; E294-G461 WeakPolarHBondContact O-CA 3.26Å; E294-R462 IonicContact OE1-CZ 2.98Å; E294-R462 IonicContact OE1-NE 2.88Å; E294-R462 PolarHBondContact OE1-NE 2.81Å; E294-R462 VanDerWaalsContact OE1-NE 3.13Å; E294-R462 IonicContact OE1-NH2 2.62Å; E294-R462 PolarHBondContact OE1-NH2 3.23Å
295	M	81.1	Confident	74.9	Confident	34 Å²	34	50.9 Å²	50.9	17%	0.167	29%	0.286	C	S	.	.	H	α-helix	trans	-60.1	-42.8	178.9	-174	-164.1	-40.2	0	0	112.6	S278 S291 V293 V299 V323	S278-M295 WeakPolarHBondContact CB-SD 3.42Å; S278-M295 PolarHBondContact OG-SD 2.83Å; S291-M295 WeakPolarHBondContact O-CB 3.2Å; S291-M295 PolarHBondContact O-N 3.29Å; S291-M295 VanDerWaalsContact O-N 3.09Å; V293-M295 VanDerWaalsContact C-N 3.34Å; V293-M295 PolarHBondContact O-N 3.46Å; M295-V299 WeakPolarHBondContact O-CG2 3.34Å; M295-V299 PolarHBondContact O-N 3.05Å; M295-V323 HydrophobicContact CG-CB 3.99Å; M295-V323 HydrophobicContact CG-CG2 4.17Å; M295-V323 HydrophobicContact SD-CB 3.54Å; M295-V323 VanDerWaalsContact SD-CB 3.54Å; M295-V323 HydrophobicContact SD-CG2 3.38Å; M295-V323 WeakPolarHBondContact SD-CG2 3.48Å
296	L	82.2	Confident	77	Confident	61 Å²	61	47.9 Å²	47.9	32%	0.319	27%	0.272	S	S	.	.	H	α-helix	trans	-73.5	-36.8	175.8	-71.7	171.4	0	0	0	112.4	P231 S292 V293 E294 V299 Q300	P231-L296 HydrophobicContact CG-CD1 4.25Å; P231-L296 HydrophobicContact CG-CD2 4.32Å; S292-L296 WeakPolarHBondContact O-CB 3.2Å; S292-L296 VanDerWaalsContact O-CG 3.27Å; S292-L296 WeakPolarHBondContact O-CG 3.48Å; S292-L296 PolarHBondContact O-N 3.46Å; S292-L296 VanDerWaalsContact O-N 3.17Å; V293-L296 PolarHBondContact O-N 3Å; E294-L296 PolarHBondContact O-N 3.42Å; L296-V299 PolarHBondContact O-N 2.78Å; L296-Q300 VanDerWaalsContact O-CB 3.31Å; L296-Q300 WeakPolarHBondContact O-CB 3.47Å; L296-Q300 VanDerWaalsContact O-CG 3.31Å; L296-Q300 WeakPolarHBondContact O-CG 3.34Å; L296-Q300 PolarHBondContact O-N 2.97Å
297	N	86.4	Confident	79.4	Confident	9 Å²	9	40.9 Å²	40.9	5%	0.048	24%	0.24	C	C	.	.	H	α-helix	trans	-58.2	-46.8	172.4	-91.8	-39	0	0	0	111.3	R215 F216 V293 E294 V299 Q300 A301	R215-N297 PolarHBondContact NE-OD1 3.37Å; F216-N297 WeakPolarHBondContact CZ-OD1 3.18Å; V293-N297 WeakPolarHBondContact O-CB 3.46Å; V293-N297 PolarHBondContact O-N 2.95Å; V293-N297 PolarHBondContact O-ND2 2.97Å; E294-N297 PolarHBondContact O-N 2.57Å; N297-V299 PolarHBondContact O-N 2.57Å; N297-Q300 PolarHBondContact O-N 3.26Å; N297-A301 VanDerWaalsContact O-CB 3.27Å; N297-A301 WeakPolarHBondContact O-CB 3.24Å; N297-A301 PolarHBondContact O-N 2.98Å
298	E	91.7	Very high	81.6	Confident	9 Å²	9	39.3 Å²	39.3	4%	0.042	24%	0.236	C	C	.	.	H	α-helix	trans	-58.9	-49.8	178.9	178.5	173.5	-142.9	0	0	111.7	K276 E294 A301 L302 F460	K276-E298 WeakPolarHBondContact CD-OE2 3.5Å; K276-E298 WeakPolarHBondContact CE-OE2 3.45Å; K276-E298 IonicContact NZ-OE1 3.41Å; K276-E298 PolarHBondContact NZ-OE1 3.22Å; K276-E298 IonicContact NZ-OE2 2.73Å; K276-E298 PolarHBondContact NZ-OE2 2.8Å; E294-E298 PolarHBondContact O-N 2.88Å; E298-A301 PolarHBondContact O-N 2.69Å; E298-L302 HydrophobicContact CG-CD1 3.72Å; E298-L302 HydrophobicContact CG-CG 4.38Å; E298-L302 VanDerWaalsContact O-CB 3.23Å; E298-L302 WeakPolarHBondContact O-CB 3.2Å; E298-L302 WeakPolarHBondContact O-CG 3.44Å; E298-L302 PolarHBondContact O-N 3.14Å; E298-F460 HydrophobicContact CB-CB 4.42Å; E298-F460 HydrophobicContact CG-CB 4.17Å
299	V	92.9	Very high	84.2	Confident	22 Å²	22	31.6 Å²	31.6	13%	0.133	20%	0.195	C	C	.	.	H	α-helix	trans	-63	-45	179.4	170.5	0	0	0	0	111.3	M295 L296 N297 A303 F313 S316 V323 T325	M295-V299 WeakPolarHBondContact O-CG2 3.34Å; M295-V299 PolarHBondContact O-N 3.05Å; L296-V299 PolarHBondContact O-N 2.78Å; N297-V299 PolarHBondContact O-N 2.57Å; V299-A303 VanDerWaalsContact O-CB 3.25Å; V299-A303 WeakPolarHBondContact O-CB 3.45Å; V299-A303 PolarHBondContact O-N 3.04Å; V299-F313 HydrophobicContact CG1-CZ 4.4Å; V299-S316 VanDerWaalsContact CG1-OG 3.31Å; V299-S316 WeakPolarHBondContact CG1-OG 3.27Å; V299-V323 HydrophobicContact CG2-CG1 4.3Å; V299-T325 WeakPolarHBondContact CG2-OG1 3.22Å
300	Q	93.2	Very high	86.8	Confident	22 Å²	22	29.6 Å²	29.6	10%	0.103	17%	0.173	C	C	.	.	H	α-helix	trans	-69	-37	-178.8	-72.5	-171.4	-13.6	0	0	112.5	V213 N214 R215 F216 L296 N297	V213-Q300 PolarHBondContact O-NE2 3.42Å; N214-Q300 PolarHBondContact ND2-O 3.23Å; N214-Q300 PolarHBondContact OD1-O 3.37Å; R215-Q300 VanDerWaalsContact CG-OE1 3.25Å; F216-Q300 HydrophobicContact CD2-CB 3.86Å; F216-Q300 HydrophobicContact CE2-CB 4.05Å; L296-Q300 VanDerWaalsContact O-CB 3.31Å; L296-Q300 WeakPolarHBondContact O-CB 3.47Å; L296-Q300 VanDerWaalsContact O-CG 3.31Å; L296-Q300 WeakPolarHBondContact O-CG 3.34Å; L296-Q300 PolarHBondContact O-N 2.97Å; N297-Q300 PolarHBondContact O-N 3.26Å
301	A	95.3	Very high	88.9	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-66.7	-53.5	173.1	0	0	0	0	0	111.2	F216 N297 E298 A303 L304 L305 M405 F460 A463	F216-A301 HydrophobicContact CD2-CB 4.14Å; F216-A301 HydrophobicContact CE2-CB 3.96Å; F216-A301 HydrophobicContact CZ-CB 4.33Å; N297-A301 VanDerWaalsContact O-CB 3.27Å; N297-A301 WeakPolarHBondContact O-CB 3.24Å; N297-A301 PolarHBondContact O-N 2.98Å; E298-A301 PolarHBondContact O-N 2.69Å; A301-A303 PolarHBondContact O-N 2.91Å; A301-L304 PolarHBondContact O-N 2.81Å; A301-L305 HydrophobicContact CB-CD1 4.32Å; A301-L305 VanDerWaalsContact O-CG 3.31Å; A301-L305 WeakPolarHBondContact O-CG 3.21Å; A301-L305 PolarHBondContact O-N 3.3Å; A301-M405 HydrophobicContact CB-CE 4Å; A301-M405 HydrophobicContact CB-SD 3.81Å; A301-F460 HydrophobicContact CB-CB 4.17Å; A301-F460 HydrophobicContact CB-CD1 4.32Å; A301-A463 HydrophobicContact CB-CB 4.07Å
302	L	96.6	Very high	90.5	Very high	5 Å²	5	31.8 Å²	31.8	3%	0.026	17%	0.174	C	C	.	.	H	α-helix	trans	-64.4	-25.3	-177.1	-76.2	179.2	0	0	0	114.1	E298 L304 I310 I311 F313 L327 F460	E298-L302 HydrophobicContact CG-CD1 3.72Å; E298-L302 HydrophobicContact CG-CG 4.38Å; E298-L302 VanDerWaalsContact O-CB 3.23Å; E298-L302 WeakPolarHBondContact O-CB 3.2Å; E298-L302 WeakPolarHBondContact O-CG 3.44Å; E298-L302 PolarHBondContact O-N 3.14Å; L302-L304 PolarHBondContact O-N 3.13Å; L302-I310 HydrophobicContact CD2-CG2 4.27Å; L302-I311 HydrophobicContact CD2-CG2 3.93Å; L302-F313 HydrophobicContact CB-CB 3.81Å; L302-F313 HydrophobicContact CB-CD2 3.87Å; L302-F313 HydrophobicContact CB-CG 3.9Å; L302-F313 HydrophobicContact CD1-CB 4.47Å; L302-F313 HydrophobicContact CD1-CD2 4.28Å; L302-L327 HydrophobicContact CD1-CD2 3.87Å; L302-F460 HydrophobicContact CD1-CD2 4.41Å; L302-F460 HydrophobicContact CD2-CD2 3.48Å; L302-F460 VanDerWaalsContact CD2-CD2 3.48Å; L302-F460 HydrophobicContact CD2-CE2 3.68Å; L302-F460 HydrophobicContact CD2-CG 4.07Å; L302-F460 HydrophobicContact CD2-CZ 4.39Å; L302-F460 HydrophobicContact CG-CB 4.31Å; L302-F460 HydrophobicContact CG-CD2 3.95Å; L302-F460 HydrophobicContact CG-CG 4.21Å
303	A	95.3	Very high	92	Very high	55 Å²	55	31.2 Å²	31.2	46%	0.455	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-18.6	173.2	0	0	0	0	0	114	V299 A301 F313	V299-A303 VanDerWaalsContact O-CB 3.25Å; V299-A303 WeakPolarHBondContact O-CB 3.45Å; V299-A303 PolarHBondContact O-N 3.04Å; A301-A303 PolarHBondContact O-N 2.91Å; A303-F313 HydrophobicContact CB-CE1 4.25Å
304	L	95.3	Very high	93	Very high	29 Å²	29	32.3 Å²	32.3	15%	0.152	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.3	-27.9	177.2	-55.5	-178.1	0	0	0	113	N214 F216 M217 A301 L302 Q306 Y398 W403	N214-L304 WeakPolarHBondContact ND2-CG 3.45Å; F216-L304 VanDerWaalsContact C-CD1 3.49Å; F216-L304 HydrophobicContact CB-CD1 3.57Å; M217-L304 HydrophobicContact CG-CD1 3.7Å; M217-L304 HydrophobicContact CG-CD2 3.72Å; M217-L304 HydrophobicContact CG-CG 4.36Å; M217-L304 HydrophobicContact SD-CD2 4.24Å; A301-L304 PolarHBondContact O-N 2.81Å; L302-L304 PolarHBondContact O-N 3.13Å; L304-Q306 PolarHBondContact O-N 3.46Å; L304-Q306 VanDerWaalsContact O-N 3.15Å; L304-Y398 PolarHBondContact O-OH 2.77Å; L304-W403 HydrophobicContact CB-CD2 4.36Å; L304-W403 HydrophobicContact CB-CE3 4.36Å; L304-W403 HydrophobicContact CB-CH2 3.91Å; L304-W403 HydrophobicContact CB-CZ2 3.86Å; L304-W403 HydrophobicContact CB-CZ3 4.17Å; L304-W403 HydrophobicContact CD1-CE3 3.91Å; L304-W403 HydrophobicContact CD1-CH2 4.21Å; L304-W403 HydrophobicContact CD1-CZ3 3.71Å; L304-W403 HydrophobicContact CD2-CH2 4.23Å; L304-W403 HydrophobicContact CD2-CZ3 4.44Å; L304-W403 HydrophobicContact CG-CH2 4.33Å; L304-W403 HydrophobicContact CG-CZ3 4.32Å; L304-W403 WeakPolarHBondContact O-CZ2 3.5Å
305	L	96.3	Very high	93.8	Very high	9 Å²	9	32.2 Å²	32.2	5%	0.047	17%	0.171	C	C	.	.			trans	-84.1	90.8	-169.6	-66.8	173.3	0	0	0	113.2	A301 I310 Y398 M399 W403 M405 F460	A301-L305 HydrophobicContact CB-CD1 4.32Å; A301-L305 VanDerWaalsContact O-CG 3.31Å; A301-L305 WeakPolarHBondContact O-CG 3.21Å; A301-L305 PolarHBondContact O-N 3.3Å; L305-I310 HydrophobicContact CB-CD1 4.12Å; L305-I310 HydrophobicContact CB-CG2 4.26Å; L305-I310 HydrophobicContact CD1-CD1 4.3Å; L305-I310 HydrophobicContact CD2-CD1 4.23Å; L305-I310 HydrophobicContact CG-CD1 4.46Å; L305-Y398 HydrophobicContact CB-CE1 4.4Å; L305-Y398 HydrophobicContact CD2-CD1 4.03Å; L305-Y398 HydrophobicContact CD2-CE1 3.65Å; L305-M399 HydrophobicContact CD1-CG 4.42Å; L305-M399 HydrophobicContact CD2-CG 3.9Å; L305-W403 HydrophobicContact CD2-CG 4.28Å; L305-M405 HydrophobicContact CD1-CE 4.11Å; L305-M405 HydrophobicContact CD1-SD 3.76Å; L305-M405 HydrophobicContact CD2-CE 3.98Å; L305-M405 HydrophobicContact CD2-SD 4.27Å; L305-M405 HydrophobicContact CG-CE 4.01Å; L305-M405 HydrophobicContact CG-SD 4.28Å; L305-F460 HydrophobicContact CD1-CD1 3.57Å; L305-F460 HydrophobicContact CD1-CE1 3.21Å; L305-F460 HydrophobicContact CD1-CZ 3.92Å
306	Q	95.6	Very high	94.3	Very high	97 Å²	97	32.9 Å²	32.9	45%	0.453	18%	0.179	S	C	.	.			trans	-101.8	103.1	167.7	-176.4	165.3	-80	0	0	111.1	L304 Y398	L304-Q306 PolarHBondContact O-N 3.46Å; L304-Q306 VanDerWaalsContact O-N 3.15Å; Q306-Y398 PolarHBondContact N-OH 2.82Å; Q306-Y398 VanDerWaalsContact O-CZ 3.3Å; Q306-Y398 PolarHBondContact O-OH 3.29Å
307	H	95.9	Very high	94.5	Very high	32 Å²	32	32 Å²	32	15%	0.148	17%	0.171	C	C	.	.			trans	-149.3	152.7	174.9	179.4	-101	0	0	0	111.4	N309 I310 S394 Y398	H307-N309 PolarHBondContact CE1-N 2.73Å; H307-N309 PolarHBondContact ND1-N 2.81Å; H307-N309 VanDerWaalsContact ND1-N 3.15Å; H307-N309 PolarHBondContact O-N 2.83Å; H307-I310 HydrophobicContact CB-CB 4.25Å; H307-I310 HydrophobicContact CB-CD1 3.93Å; H307-I310 HydrophobicContact CB-CG1 4.03Å; H307-I310 PolarHBondContact O-N 2.81Å; H307-S394 VanDerWaalsContact CE1-C 3.46Å; H307-S394 PolarHBondContact CE1-OG 3.02Å; H307-S394 VanDerWaalsContact CE1-OG 3.3Å; H307-S394 PolarHBondContact NE2-OG 3.17Å; H307-S394 VanDerWaalsContact NE2-OG 3.1Å; H307-Y398 HydrophobicContact CB-CD1 3.8Å; H307-Y398 HydrophobicContact CB-CE1 4.05Å; H307-Y398 HydrophobicContact CB-CG 4.07Å
308	S	95.5	Very high	94.2	Very high	55 Å²	55	35.7 Å²	35.7	39%	0.385	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-43.1	-175.9	60.7	0	0	0	0	113.5	K456	S308-K456 VanDerWaalsContact O-CE 3.3Å; S308-K456 WeakPolarHBondContact O-CE 3.31Å; S308-K456 PolarHBondContact O-NZ 3.31Å
309	N	97.9	Very high	93.6	Very high	1 Å²	1	36 Å²	36	1%	0.005	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94	19.1	178.6	-55.8	116.4	0	0	0	114.1	H307 H391 A395 V454 F455 K456 L457	H307-N309 PolarHBondContact CE1-N 2.73Å; H307-N309 PolarHBondContact ND1-N 2.81Å; H307-N309 VanDerWaalsContact ND1-N 3.15Å; H307-N309 PolarHBondContact O-N 2.83Å; N309-H391 HydrophobicContact CB-CB 4.26Å; N309-H391 WeakPolarHBondContact CB-O 3.28Å; N309-H391 VanDerWaalsContact ND2-CB 3.33Å; N309-H391 WeakPolarHBondContact ND2-CB 3.29Å; N309-H391 PolarHBondContact ND2-CD2 2.97Å; N309-H391 PolarHBondContact OD1-CD2 3.39Å; N309-H391 PolarHBondContact OD1-O 2.74Å; N309-A395 HydrophobicContact CB-CB 4.13Å; N309-A395 WeakPolarHBondContact O-CB 3.38Å; N309-V454 WeakPolarHBondContact ND2-CG1 3.47Å; N309-F455 WeakPolarHBondContact CA-O 3.3Å; N309-F455 WeakPolarHBondContact CB-O 3.29Å; N309-F455 PolarHBondContact ND2-O 3.18Å; N309-K456 CarbonylContact O-C 3.59Å; N309-K456 WeakPolarHBondContact O-CA 3.21Å; N309-L457 PolarHBondContact O-N 3.22Å
310	I	98.3	Very high	92.8	Very high	2 Å²	2	37.3 Å²	37.3	1%	0.01	20%	0.199	C	C	.	.	B	Isolated β-bridge	trans	-108.7	150.6	166	-66.6	-179.6	0	0	0	108.1	L302 L305 H307 R312 A395 Y398 M399 K456 F460	L302-I310 HydrophobicContact CD2-CG2 4.27Å; L305-I310 HydrophobicContact CB-CD1 4.12Å; L305-I310 HydrophobicContact CB-CG2 4.26Å; L305-I310 HydrophobicContact CD1-CD1 4.3Å; L305-I310 HydrophobicContact CD2-CD1 4.23Å; L305-I310 HydrophobicContact CG-CD1 4.46Å; H307-I310 HydrophobicContact CB-CB 4.25Å; H307-I310 HydrophobicContact CB-CD1 3.93Å; H307-I310 HydrophobicContact CB-CG1 4.03Å; H307-I310 PolarHBondContact O-N 2.81Å; I310-R312 PolarHBondContact O-N 3.41Å; I310-A395 HydrophobicContact CD1-CB 4.43Å; I310-A395 HydrophobicContact CG1-CB 3.82Å; I310-Y398 HydrophobicContact CD1-CD1 4Å; I310-Y398 HydrophobicContact CD1-CE1 4.43Å; I310-M399 HydrophobicContact CD1-CG 4.02Å; I310-M399 HydrophobicContact CD1-SD 4.35Å; I310-K456 PolarHBondContact O-NZ 3.39Å; I310-F460 HydrophobicContact CD1-CZ 4.39Å; I310-F460 HydrophobicContact CG1-CZ 4.38Å; I310-F460 HydrophobicContact CG2-CE2 3.93Å; I310-F460 HydrophobicContact CG2-CZ 3.67Å
311	I	97.7	Very high	92	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.005	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-63.4	127.2	174.2	-169.8	58	0	0	0	110.1	L302 F313 L327 E328 C330 L416 L457 F460	L302-I311 HydrophobicContact CD2-CG2 3.93Å; I311-F313 PolarHBondContact O-N 3.22Å; I311-L327 HydrophobicContact CG1-CB 4.24Å; I311-L327 HydrophobicContact CG1-CD1 4.39Å; I311-E328 HydrophobicContact CD1-CB 3.86Å; I311-E328 HydrophobicContact CD1-CG 4.04Å; I311-C330 WeakPolarHBondContact CD1-SG 3.41Å; I311-L416 HydrophobicContact CD1-CD1 3.79Å; I311-L416 HydrophobicContact CG1-CD1 4.19Å; I311-L457 PolarHBondContact N-O 3.04Å; I311-F460 HydrophobicContact CG2-CE2 4.15Å
312	R	97.1	Very high	91.4	Very high	97 Å²	97	39.6 Å²	39.6	37%	0.366	21%	0.212	S	C	.	.	P	Polyproline II helix	trans	-75.9	116.9	-177.8	-175.8	170.4	-178.9	85.2	3.8	110.9	I310 F314 L327 E328	I310-R312 PolarHBondContact O-N 3.41Å; R312-F314 HydrophobicContact CB-CE2 4.11Å; R312-F314 HydrophobicContact CB-CZ 4.44Å; R312-F314 HydrophobicContact CG-CD2 4.32Å; R312-F314 HydrophobicContact CG-CE1 4.45Å; R312-F314 HydrophobicContact CG-CE2 3.8Å; R312-F314 HydrophobicContact CG-CZ 3.88Å; R312-F314 WeakPolarHBondContact O-CD2 3.38Å; R312-F314 WeakPolarHBondContact O-CE2 3.38Å; R312-L327 CarbonylContact O-C 3.47Å; R312-L327 WeakPolarHBondContact O-CA 3.3Å; R312-E328 HydrophobicContact CB-CB 4Å; R312-E328 WeakPolarHBondContact CB-OE2 3.19Å; R312-E328 PolarHBondContact N-OE2 2.79Å; R312-E328 PolarHBondContact O-N 3.18Å
313	F	97.1	Very high	90.9	Very high	37 Å²	37	40.4 Å²	40.4	16%	0.162	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	146.5	165	174.7	-95.4	0	0	0	111.2	V299 L302 A303 I311 G315 T325 L327	V299-F313 HydrophobicContact CG1-CZ 4.4Å; L302-F313 HydrophobicContact CB-CB 3.81Å; L302-F313 HydrophobicContact CB-CD2 3.87Å; L302-F313 HydrophobicContact CB-CG 3.9Å; L302-F313 HydrophobicContact CD1-CB 4.47Å; L302-F313 HydrophobicContact CD1-CD2 4.28Å; A303-F313 HydrophobicContact CB-CE1 4.25Å; I311-F313 PolarHBondContact O-N 3.22Å; F313-G315 VanDerWaalsContact CZ-C 3.49Å; F313-T325 HydrophobicContact CD2-CG2 3.71Å; F313-T325 HydrophobicContact CE2-CG2 3.77Å; F313-L327 HydrophobicContact CB-CD2 4.28Å; F313-L327 HydrophobicContact CD2-CD2 4.29Å
314	F	95.2	Very high	90.7	Very high	80 Å²	80	38.6 Å²	38.6	35%	0.351	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	-21.2	177.3	-68.4	-93.2	0	0	0	113.2	Y273 R312 Q326 E328	Y273-F314 AromaticContact CD1-CD2 3.93Å; Y273-F314 HydrophobicContact CD1-CD2 3.93Å; Y273-F314 HydrophobicContact CD1-CE2 4.02Å; Y273-F314 HydrophobicContact CD1-CG 4.36Å; Y273-F314 AromaticContact CE1-CD1 3.92Å; Y273-F314 HydrophobicContact CE1-CD1 3.92Å; Y273-F314 AromaticContact CE1-CD2 3.72Å; Y273-F314 HydrophobicContact CE1-CD2 3.72Å; Y273-F314 AromaticContact CE1-CE1 3.9Å; Y273-F314 HydrophobicContact CE1-CE1 3.9Å; Y273-F314 AromaticContact CE1-CE2 3.71Å; Y273-F314 HydrophobicContact CE1-CE2 3.71Å; Y273-F314 AromaticContact CE1-CG 3.83Å; Y273-F314 HydrophobicContact CE1-CG 3.83Å; Y273-F314 AromaticContact CE1-CZ 3.79Å; Y273-F314 HydrophobicContact CE1-CZ 3.79Å; R312-F314 HydrophobicContact CB-CE2 4.11Å; R312-F314 HydrophobicContact CB-CZ 4.44Å; R312-F314 HydrophobicContact CG-CD2 4.32Å; R312-F314 HydrophobicContact CG-CE1 4.45Å; R312-F314 HydrophobicContact CG-CE2 3.8Å; R312-F314 HydrophobicContact CG-CZ 3.88Å; R312-F314 WeakPolarHBondContact O-CD2 3.38Å; R312-F314 WeakPolarHBondContact O-CE2 3.38Å; F314-Q326 HydrophobicContact CB-CB 4.26Å; F314-Q326 HydrophobicContact CB-CG 3.94Å; F314-Q326 PolarHBondContact N-O 2.84Å; F314-E328 HydrophobicContact CE2-CB 4.06Å
315	G	93.2	Very high	90.6	Very high	20 Å²	20	37.4 Å²	37.4	21%	0.206	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	156.9	172	-178.9	0	0	0	0	0	112	F313 Q326	F313-G315 VanDerWaalsContact CZ-C 3.49Å; G315-Q326 PolarHBondContact O-N 3.13Å
316	S	91	Very high	90.6	Very high	48 Å²	48	38.2 Å²	38.2	34%	0.336	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	150.2	176.4	54.8	0	0	0	0	111	V299 Y324	V299-S316 VanDerWaalsContact CG1-OG 3.31Å; V299-S316 WeakPolarHBondContact CG1-OG 3.27Å; S316-Y324 CarbonylContact C-O 3.59Å; S316-Y324 WeakPolarHBondContact CA-O 3.25Å; S316-Y324 WeakPolarHBondContact CB-O 3.43Å
317	W	87.3	Confident	90.7	Very high	41 Å²	41	34.2 Å²	34.2	16%	0.155	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	170	176.5	68.4	96.3	0	0	0	111.4	N242 L243 F247 L275 E319 V323 Y324 Q326	N242-W317 HydrophobicContact CB-CG 4.45Å; L243-W317 HydrophobicContact CB-CZ2 4.44Å; L243-W317 HydrophobicContact CD1-CZ2 4.14Å; F247-W317 HydrophobicContact CD2-CH2 4.36Å; F247-W317 AromaticContact CE2-CH2 3.51Å; F247-W317 HydrophobicContact CE2-CH2 3.51Å; F247-W317 HydrophobicContact CE2-CZ2 4.13Å; F247-W317 HydrophobicContact CE2-CZ3 4.25Å; F247-W317 HydrophobicContact CZ-CH2 4.03Å; F247-W317 HydrophobicContact CZ-CZ3 4.5Å; L275-W317 HydrophobicContact CD1-CH2 4.48Å; L275-W317 HydrophobicContact CD2-CH2 4.22Å; W317-E319 PolarHBondContact NE1-OE2 3.45Å; W317-V323 CarbonylContact O-C 3.57Å; W317-V323 WeakPolarHBondContact O-CA 3.42Å; W317-Y324 VanDerWaalsContact CE2-CB 3.45Å; W317-Y324 AromaticContact CE2-CG 3.95Å; W317-Y324 HydrophobicContact CZ2-CD1 4.21Å; W317-Y324 AromaticContact CZ2-CG 3.95Å; W317-Y324 HydrophobicContact CZ2-CG 3.95Å; W317-Y324 PolarHBondContact N-O 3.34Å; W317-Y324 AromaticContact NE1-CD2 3.95Å; W317-Y324 AromaticContact NE1-CG 4Å; W317-Y324 PolarHBondContact O-N 3.5Å; W317-Q326 HydrophobicContact CZ3-CB 4.16Å
318	Y	79	Confident	90.6	Very high	88 Å²	88	33.8 Å²	33.8	35%	0.345	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	131.3	175.1	-162.2	-115.3	0	0	0	109.9	P236 D321 S322 V323	P236-Y318 HydrophobicContact CB-CE1 4.47Å; Y318-D321 WeakPolarHBondContact OH-CA 3.41Å; Y318-D321 PolarHBondContact OH-O 3.3Å; Y318-S322 WeakPolarHBondContact CA-O 3.15Å; Y318-S322 VanDerWaalsContact CD2-O 3.23Å; Y318-S322 WeakPolarHBondContact CD2-O 3.33Å; Y318-V323 HydrophobicContact CD2-CG2 3.8Å; Y318-V323 HydrophobicContact CE2-CG2 4.3Å
319	E	79.5	Confident	90.6	Very high	15 Å²	15	32 Å²	32	7%	0.07	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	134.7	-177.8	175.8	171.8	178.9	0	0	109.2	C240 S241 N242 L243 W317 D321 S322 Y324	C240-E319 WeakPolarHBondContact O-CG 3.49Å; S241-E319 VanDerWaalsContact CA-OE1 3.27Å; S241-E319 WeakPolarHBondContact CA-OE1 3.41Å; N242-E319 PolarHBondContact N-OE1 2.91Å; N242-E319 PolarHBondContact N-OE2 3.45Å; L243-E319 VanDerWaalsContact CB-OE1 3.29Å; L243-E319 WeakPolarHBondContact CB-OE1 3.27Å; L243-E319 VanDerWaalsContact CB-OE2 3.3Å; L243-E319 WeakPolarHBondContact CB-OE2 3.35Å; L243-E319 PolarHBondContact N-OE1 2.8Å; L243-E319 PolarHBondContact N-OE2 3.21Å; W317-E319 PolarHBondContact NE1-OE2 3.45Å; E319-D321 VanDerWaalsContact C-N 3.34Å; E319-D321 PolarHBondContact O-N 3.42Å; E319-S322 PolarHBondContact N-O 3.15Å; E319-S322 WeakPolarHBondContact O-CB 3.17Å; E319-S322 PolarHBondContact O-N 3.11Å; E319-S322 VanDerWaalsContact O-O 3.1Å; E319-Y324 HydrophobicContact CB-CD2 3.9Å; E319-Y324 HydrophobicContact CB-CE2 3.78Å; E319-Y324 HydrophobicContact CG-CE2 4.16Å; E319-Y324 WeakPolarHBondContact O-CE2 3.33Å
320	A	77.2	Confident	90.5	Very high	49 Å²	49	32.6 Å²	32.6	41%	0.405	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	43.8	55.5	-177.2	0	0	0	0	0	113.5	N239 S322	N239-A320 PolarHBondContact OD1-N 3.42Å; A320-S322 PolarHBondContact O-N 2.85Å; A320-S322 PolarHBondContact O-OG 3.05Å
321	D	75.6	Confident	90.3	Very high	69 Å²	69	32.9 Å²	32.9	37%	0.369	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.2	9.4	-178.5	-53.2	-42.8	0	0	0	116.1	P236 C280 Y318 E319	P236-D321 WeakPolarHBondContact CB-OD1 3.33Å; P236-D321 WeakPolarHBondContact CG-OD1 3.42Å; C280-D321 PolarHBondContact SG-O 3.33Å; Y318-D321 WeakPolarHBondContact OH-CA 3.41Å; Y318-D321 PolarHBondContact OH-O 3.3Å; E319-D321 VanDerWaalsContact C-N 3.34Å; E319-D321 PolarHBondContact O-N 3.42Å
322	S	82.9	Confident	90.1	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.007	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	145.4	177.6	-49.7	0	0	0	0	111.1	R277 S278 C280 Y318 E319 A320	R277-S322 VanDerWaalsContact CG-CB 3.46Å; R277-S322 PolarHBondContact NH1-OG 3.11Å; S278-S322 WeakPolarHBondContact OG-CA 3.32Å; C280-S322 PolarHBondContact SG-OG 2.83Å; Y318-S322 WeakPolarHBondContact CA-O 3.15Å; Y318-S322 VanDerWaalsContact CD2-O 3.23Å; Y318-S322 WeakPolarHBondContact CD2-O 3.33Å; E319-S322 PolarHBondContact N-O 3.15Å; E319-S322 WeakPolarHBondContact O-CB 3.17Å; E319-S322 PolarHBondContact O-N 3.11Å; E319-S322 VanDerWaalsContact O-O 3.1Å; A320-S322 PolarHBondContact O-N 2.85Å; A320-S322 PolarHBondContact O-OG 3.05Å
323	V	85.8	Confident	90	Very high	23 Å²	23	29.2 Å²	29.2	14%	0.139	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	132.7	156.9	177.1	0	0	0	0	108.4	R277 S278 M295 V299 W317 Y318	R277-V323 CarbonylContact C-O 3.55Å; R277-V323 WeakPolarHBondContact CA-O 3.47Å; S278-V323 PolarHBondContact N-O 2.79Å; S278-V323 PolarHBondContact OG-N 2.9Å; M295-V323 HydrophobicContact CG-CB 3.99Å; M295-V323 HydrophobicContact CG-CG2 4.17Å; M295-V323 HydrophobicContact SD-CB 3.54Å; M295-V323 VanDerWaalsContact SD-CB 3.54Å; M295-V323 HydrophobicContact SD-CG2 3.38Å; M295-V323 WeakPolarHBondContact SD-CG2 3.48Å; V299-V323 HydrophobicContact CG2-CG1 4.3Å; W317-V323 CarbonylContact O-C 3.57Å; W317-V323 WeakPolarHBondContact O-CA 3.42Å; Y318-V323 HydrophobicContact CD2-CG2 3.8Å; Y318-V323 HydrophobicContact CE2-CG2 4.3Å
324	Y	91.4	Very high	89.9	Confident	16 Å²	16	28 Å²	28	6%	0.063	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	130.6	166.9	-73.6	-100.8	0	0	0	109.3	L243 Y262 K276 R277 S316 W317 E319	L243-Y324 HydrophobicContact CD1-CD1 4.07Å; L243-Y324 HydrophobicContact CD1-CE1 3.9Å; L243-Y324 HydrophobicContact CD2-CE1 3.66Å; L243-Y324 HydrophobicContact CG-CE1 4.31Å; Y262-Y324 HydrophobicContact CE2-CE1 4.46Å; K276-Y324 WeakPolarHBondContact O-CA 3.39Å; R277-Y324 HydrophobicContact CB-CD1 3.9Å; R277-Y324 HydrophobicContact CB-CE1 3.68Å; R277-Y324 HydrophobicContact CB-CG 4.49Å; R277-Y324 WeakPolarHBondContact CD-OH 3.27Å; R277-Y324 HydrophobicContact CG-CD1 4.14Å; R277-Y324 HydrophobicContact CG-CD2 4.31Å; R277-Y324 HydrophobicContact CG-CE1 3.67Å; R277-Y324 HydrophobicContact CG-CE2 3.87Å; R277-Y324 HydrophobicContact CG-CG 4.45Å; S316-Y324 CarbonylContact C-O 3.59Å; S316-Y324 WeakPolarHBondContact CA-O 3.25Å; S316-Y324 WeakPolarHBondContact CB-O 3.43Å; W317-Y324 VanDerWaalsContact CE2-CB 3.45Å; W317-Y324 AromaticContact CE2-CG 3.95Å; W317-Y324 HydrophobicContact CZ2-CD1 4.21Å; W317-Y324 AromaticContact CZ2-CG 3.95Å; W317-Y324 HydrophobicContact CZ2-CG 3.95Å; W317-Y324 PolarHBondContact N-O 3.34Å; W317-Y324 AromaticContact NE1-CD2 3.95Å; W317-Y324 AromaticContact NE1-CG 4Å; W317-Y324 PolarHBondContact O-N 3.5Å; E319-Y324 HydrophobicContact CB-CD2 3.9Å; E319-Y324 HydrophobicContact CB-CE2 3.78Å; E319-Y324 HydrophobicContact CG-CE2 4.16Å; E319-Y324 WeakPolarHBondContact O-CE2 3.33Å
325	T	93.7	Very high	90	Very high	4 Å²	4	24.2 Å²	24.2	3%	0.025	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	123.9	176.4	-67.5	0	0	0	0	109.9	L275 K276 V299 F313 L327	L275-T325 WeakPolarHBondContact CA-O 3.49Å; K276-T325 PolarHBondContact N-O 3.48Å; K276-T325 PolarHBondContact O-N 3.12Å; V299-T325 WeakPolarHBondContact CG2-OG1 3.22Å; F313-T325 HydrophobicContact CD2-CG2 3.71Å; F313-T325 HydrophobicContact CE2-CG2 3.77Å; T325-L327 HydrophobicContact CG2-CD2 3.72Å; T325-L327 HydrophobicContact CG2-CG 4.03Å
326	Q	96	Very high	90.1	Very high	27 Å²	27	23.5 Å²	23.5	13%	0.126	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	115.7	179	-176.1	-179.6	3.2	0	0	110.8	F247 Y273 L275 F314 G315 W317	F247-Q326 HydrophobicContact CZ-CG 4.44Å; Y273-Q326 HydrophobicContact CD1-CG 3.66Å; Y273-Q326 HydrophobicContact CE1-CG 4.29Å; Y273-Q326 HydrophobicContact CG-CG 3.93Å; Y273-Q326 VanDerWaalsContact CG-NE2 3.32Å; Y273-Q326 VanDerWaalsContact CZ-NE2 3.33Å; L275-Q326 HydrophobicContact CD2-CB 3.93Å; L275-Q326 HydrophobicContact CD2-CG 3.83Å; F314-Q326 HydrophobicContact CB-CB 4.26Å; F314-Q326 HydrophobicContact CB-CG 3.94Å; F314-Q326 PolarHBondContact N-O 2.84Å; G315-Q326 PolarHBondContact O-N 3.13Å; W317-Q326 HydrophobicContact CZ3-CB 4.16Å
327	L	96.5	Very high	90.1	Very high	13 Å²	13	24 Å²	24	7%	0.068	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	158.6	-179.7	-57.1	179.7	0	0	0	111.5	Y273 C274 L302 I311 R312 F313 T325	Y273-L327 WeakPolarHBondContact CA-O 3.37Å; C274-L327 HydrophobicContact CB-CB 4.29Å; C274-L327 PolarHBondContact N-O 3.5Å; C274-L327 PolarHBondContact O-N 3.11Å; L302-L327 HydrophobicContact CD1-CD2 3.87Å; I311-L327 HydrophobicContact CG1-CB 4.24Å; I311-L327 HydrophobicContact CG1-CD1 4.39Å; R312-L327 CarbonylContact O-C 3.47Å; R312-L327 WeakPolarHBondContact O-CA 3.3Å; F313-L327 HydrophobicContact CB-CD2 4.28Å; F313-L327 HydrophobicContact CD2-CD2 4.29Å; T325-L327 HydrophobicContact CG2-CD2 3.72Å; T325-L327 HydrophobicContact CG2-CG 4.03Å
328	E	95.3	Very high	90.5	Very high	22 Å²	22	22 Å²	22	10%	0.103	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54	137.8	162.3	161	177.1	-161.7	0	0	111.6	I311 R312 F314 Q418 K456	I311-E328 HydrophobicContact CD1-CB 3.86Å; I311-E328 HydrophobicContact CD1-CG 4.04Å; R312-E328 HydrophobicContact CB-CB 4Å; R312-E328 WeakPolarHBondContact CB-OE2 3.19Å; R312-E328 PolarHBondContact N-OE2 2.79Å; R312-E328 PolarHBondContact O-N 3.18Å; F314-E328 HydrophobicContact CE2-CB 4.06Å; E328-Q418 WeakPolarHBondContact OE1-CG 3.09Å; E328-Q418 PolarHBondContact OE1-NE2 3.3Å; E328-K456 VanDerWaalsContact OE1-CE 3.22Å; E328-K456 WeakPolarHBondContact OE1-CE 3.46Å; E328-K456 IonicContact OE1-NZ 3.33Å; E328-K456 VanDerWaalsContact OE2-CE 3.27Å; E328-K456 WeakPolarHBondContact OE2-CE 3.39Å; E328-K456 IonicContact OE2-NZ 3.09Å; E328-K456 PolarHBondContact OE2-NZ 2.9Å
329	L	95.1	Very high	91.3	Very high	18 Å²	18	17.9 Å²	17.9	9%	0.094	11%	0.105	C	C	.	.			trans	-85.8	110.3	170.9	-175.1	69.1	0	0	0	109.8	I253 K263 L272 C274 L331 Q418	I253-L329 HydrophobicContact CD1-CD1 3.9Å; K263-L329 HydrophobicContact CD-CD2 3.96Å; K263-L329 HydrophobicContact CG-CD2 3.98Å; L272-L329 HydrophobicContact CB-CD2 3.82Å; L272-L329 HydrophobicContact CD1-CD2 3.96Å; L272-L329 HydrophobicContact CG-CD2 4.47Å; C274-L329 HydrophobicContact CB-CD1 4.13Å; L329-L331 PolarHBondContact O-N 3.2Å; L329-Q418 PolarHBondContact O-NE2 3.45Å
330	C	95.6	Very high	91.9	Very high	13 Å²	13	17.8 Å²	17.8	9%	0.088	10%	0.104	C	C	.	.			trans	-83.7	108.9	175.1	-73.1	0	0	0	0	111.3	I311 G332 G333 L416 I417 Q418	I311-C330 WeakPolarHBondContact CD1-SG 3.41Å; C330-G332 VanDerWaalsContact C-N 3.31Å; C330-G332 PolarHBondContact O-N 3.36Å; C330-G333 PolarHBondContact O-N 3.44Å; C330-L416 HydrophobicContact CB-CB 3.66Å; C330-L416 HydrophobicContact CB-CD1 4.14Å; C330-L416 HydrophobicContact CB-CG 4.4Å; C330-I417 CarbonylContact C-O 3.57Å; C330-I417 WeakPolarHBondContact CB-O 3.35Å; C330-Q418 HydrophobicContact CB-CB 4.4Å
331	L	93.9	Very high	92.5	Very high	8 Å²	8	18.7 Å²	18.7	4%	0.042	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-28.7	-166.4	-63.7	166.1	0	0	0	114.3	L329 G333 L419 A424 A427 E434 A437 K438	L329-L331 PolarHBondContact O-N 3.2Å; L331-G333 VanDerWaalsContact C-N 3.29Å; L331-G333 PolarHBondContact O-N 3.33Å; L331-L419 HydrophobicContact CD1-CD1 4.1Å; L331-A424 HydrophobicContact CD1-CB 4.09Å; L331-A427 HydrophobicContact CD1-CB 3.57Å; L331-E434 HydrophobicContact CD2-CB 4.3Å; L331-E434 HydrophobicContact CD2-CG 3.65Å; L331-A437 HydrophobicContact CB-CB 4.37Å; L331-A437 HydrophobicContact CD1-CB 4.16Å; L331-K438 WeakPolarHBondContact O-CA 3.41Å; L331-K438 WeakPolarHBondContact O-CB 3.11Å; L331-K438 WeakPolarHBondContact O-CG 3.45Å
332	G	94.1	Very high	93	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-7.8	177.1	0	0	0	0	0	114.5	C330 I417 H442	C330-G332 VanDerWaalsContact C-N 3.31Å; C330-G332 PolarHBondContact O-N 3.36Å; G332-I417 WeakPolarHBondContact CA-O 3.35Å; G332-I417 PolarHBondContact N-O 3.45Å; G332-H442 PolarHBondContact O-NE2 2.87Å
333	G	93.9	Very high	93	Very high	21 Å²	21	25.1 Å²	25.1	22%	0.216	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	71.7	-157.9	-169.4	0	0	0	0	0	112.5	C330 L331 L416 I417	C330-G333 PolarHBondContact O-N 3.44Å; L331-G333 VanDerWaalsContact C-N 3.29Å; L331-G333 PolarHBondContact O-N 3.33Å; G333-L416 WeakPolarHBondContact O-CA 3.5Å; G333-I417 PolarHBondContact O-N 3.36Å
334	S	95.4	Very high	92.3	Very high	13 Å²	13	32.1 Å²	32.1	9%	0.091	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	153.9	175.1	64.7	0	0	0	0	113.2	F336 H337 L338 S413 I415	S334-F336 PolarHBondContact O-N 3.35Å; S334-H337 PolarHBondContact O-N 2.84Å; S334-H337 PolarHBondContact OG-ND1 2.84Å; S334-L338 PolarHBondContact O-N 3.22Å; S334-S413 WeakPolarHBondContact CB-O 3.48Å; S334-I415 CarbonylContact C-O 3.44Å; S334-I415 VanDerWaalsContact CA-O 3.28Å; S334-I415 WeakPolarHBondContact CA-O 3.41Å
335	L	97.2	Very high	91.2	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-59.5	-31	177.2	175.3	61.6	0	0	0	112	H337 L338 L339 L380 L388 P412 I415	L335-H337 PolarHBondContact O-N 2.85Å; L335-L338 HydrophobicContact CD1-CD2 4.13Å; L335-L338 WeakPolarHBondContact O-CB 3.35Å; L335-L338 PolarHBondContact O-N 2.79Å; L335-L339 HydrophobicContact CD1-CD1 4.41Å; L335-L339 HydrophobicContact CD1-CG 4.3Å; L335-L339 HydrophobicContact CG-CD1 4.2Å; L335-L339 WeakPolarHBondContact O-CG 3.41Å; L335-L339 PolarHBondContact O-N 3.06Å; L335-L380 HydrophobicContact CD1-CD1 3.95Å; L335-L388 HydrophobicContact CD2-CD1 3.9Å; L335-L388 HydrophobicContact CD2-CD2 3.61Å; L335-L388 HydrophobicContact CD2-CG 4.44Å; L335-P412 CarbonylContact C-O 3.2Å; L335-P412 HydrophobicContact CB-CB 4.25Å; L335-P412 WeakPolarHBondContact CB-O 3.3Å; L335-P412 HydrophobicContact CD2-CB 4.29Å; L335-P412 HydrophobicContact CG-CB 4.08Å; L335-P412 PolarHBondContact N-O 3.46Å; L335-I415 HydrophobicContact CB-CB 4.31Å; L335-I415 HydrophobicContact CB-CG2 4.26Å; L335-I415 HydrophobicContact CD2-CB 4.47Å; L335-I415 HydrophobicContact CD2-CG2 4.25Å; L335-I415 PolarHBondContact N-O 3.34Å
336	F	94.7	Very high	89.9	Confident	4 Å²	4	35 Å²	35	2%	0.018	18%	0.18	C	C	.	.	H	α-helix	trans	-55.9	-48	170.9	179.5	-93.3	0	0	0	112.4	S334 L338 L339 Y340 R343 N345 D346 P412	S334-F336 PolarHBondContact O-N 3.35Å; F336-L338 VanDerWaalsContact C-N 3.26Å; F336-L338 PolarHBondContact O-N 3.07Å; F336-L339 PolarHBondContact O-N 2.87Å; F336-L339 VanDerWaalsContact O-N 3.11Å; F336-Y340 AromaticContact CD2-CD2 3.75Å; F336-Y340 HydrophobicContact CD2-CD2 3.75Å; F336-Y340 HydrophobicContact CD2-CE2 4.2Å; F336-Y340 AromaticContact CE2-CD2 3.45Å; F336-Y340 HydrophobicContact CE2-CD2 3.45Å; F336-Y340 VanDerWaalsContact CE2-CD2 3.45Å; F336-Y340 AromaticContact CE2-CE2 3.86Å; F336-Y340 HydrophobicContact CE2-CE2 3.86Å; F336-Y340 HydrophobicContact CE2-CG 4.16Å; F336-Y340 HydrophobicContact CG-CD2 4.43Å; F336-Y340 AromaticContact CZ-CD2 3.92Å; F336-Y340 HydrophobicContact CZ-CD2 3.92Å; F336-Y340 HydrophobicContact CZ-CG 4.17Å; F336-Y340 PolarHBondContact O-N 3.44Å; F336-R343 HydrophobicContact CE1-CB 3.87Å; F336-R343 HydrophobicContact CZ-CB 4.01Å; F336-N345 WeakPolarHBondContact CE1-O 3.48Å; F336-N345 WeakPolarHBondContact CZ-O 3.24Å; F336-D346 HydrophobicContact CD1-CB 3.95Å; F336-D346 HydrophobicContact CD2-CB 3.6Å; F336-D346 VanDerWaalsContact CD2-OD1 3.31Å; F336-D346 WeakPolarHBondContact CD2-OD1 3.35Å; F336-D346 HydrophobicContact CE1-CB 4Å; F336-D346 HydrophobicContact CE2-CB 3.66Å; F336-D346 VanDerWaalsContact CE2-CG 3.43Å; F336-D346 WeakPolarHBondContact CE2-OD1 3.35Å; F336-D346 HydrophobicContact CG-CB 3.75Å; F336-D346 HydrophobicContact CZ-CB 3.86Å; F336-P412 HydrophobicContact CB-CB 4.17Å; F336-P412 PolarHBondContact N-O 3.3Å
337	H	92.5	Very high	87.9	Confident	58 Å²	58	37.6 Å²	37.6	27%	0.269	20%	0.199	S	C	.	.	H	α-helix	trans	-69.5	-21.4	179.4	-70.5	98.3	0	0	0	113.5	S334 L335 P341 R343 Q344	S334-H337 PolarHBondContact O-N 2.84Å; S334-H337 PolarHBondContact OG-ND1 2.84Å; L335-H337 PolarHBondContact O-N 2.85Å; H337-P341 WeakPolarHBondContact O-CA 3.12Å; H337-R343 PolarHBondContact CD2-O 3.31Å; H337-Q344 PolarHBondContact NE2-O 3.22Å; H337-Q344 VanDerWaalsContact NE2-O 3.11Å
338	L	95.3	Very high	85.4	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-72.9	-42	169	176.9	63.9	0	0	0	111.1	S334 L335 F336 N378 L380 I417 H442 L445 L446	S334-L338 PolarHBondContact O-N 3.22Å; L335-L338 HydrophobicContact CD1-CD2 4.13Å; L335-L338 WeakPolarHBondContact O-CB 3.35Å; L335-L338 PolarHBondContact O-N 2.79Å; F336-L338 VanDerWaalsContact C-N 3.26Å; F336-L338 PolarHBondContact O-N 3.07Å; L338-N378 WeakPolarHBondContact O-CB 3.36Å; L338-N378 PolarHBondContact O-ND2 3.27Å; L338-L380 HydrophobicContact CD2-CD2 3.9Å; L338-I417 HydrophobicContact CB-CD1 3.97Å; L338-I417 HydrophobicContact CD2-CD1 3.77Å; L338-I417 HydrophobicContact CG-CD1 4.49Å; L338-H442 HydrophobicContact CD1-CB 3.87Å; L338-H442 WeakPolarHBondContact CD1-ND1 3.5Å; L338-L445 HydrophobicContact CD2-CB 3.93Å; L338-L445 HydrophobicContact CD2-CD1 3.58Å; L338-L445 HydrophobicContact CD2-CG 4.4Å; L338-L446 HydrophobicContact CD1-CD1 4.17Å; L338-L446 HydrophobicContact CD1-CD2 4.17Å; L338-L446 HydrophobicContact CD1-CG 4.02Å
339	L	95	Very high	82.5	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-73.6	-33	-179.6	-65.2	171.8	0	0	0	112.8	L335 F336 R377 N378 P412	L335-L339 HydrophobicContact CD1-CD1 4.41Å; L335-L339 HydrophobicContact CD1-CG 4.3Å; L335-L339 HydrophobicContact CG-CD1 4.2Å; L335-L339 WeakPolarHBondContact O-CG 3.41Å; L335-L339 PolarHBondContact O-N 3.06Å; F336-L339 PolarHBondContact O-N 2.87Å; F336-L339 VanDerWaalsContact O-N 3.11Å; L339-R377 WeakPolarHBondContact O-CG 3.3Å; L339-N378 WeakPolarHBondContact CD2-O 3.48Å; L339-N378 PolarHBondContact O-N 3.15Å; L339-P412 HydrophobicContact CD1-CB 4.2Å; L339-P412 HydrophobicContact CD1-CG 4.32Å
340	Y	93.2	Very high	79.5	Confident	14 Å²	14	52.5 Å²	52.5	6%	0.055	30%	0.295	C	S	.	.			trans	-131	74.7	-176.8	-62.3	-84.5	0	0	0	111	F336 D342 R343 D374 R377 H508	F336-Y340 AromaticContact CD2-CD2 3.75Å; F336-Y340 HydrophobicContact CD2-CD2 3.75Å; F336-Y340 HydrophobicContact CD2-CE2 4.2Å; F336-Y340 AromaticContact CE2-CD2 3.45Å; F336-Y340 HydrophobicContact CE2-CD2 3.45Å; F336-Y340 VanDerWaalsContact CE2-CD2 3.45Å; F336-Y340 AromaticContact CE2-CE2 3.86Å; F336-Y340 HydrophobicContact CE2-CE2 3.86Å; F336-Y340 HydrophobicContact CE2-CG 4.16Å; F336-Y340 HydrophobicContact CG-CD2 4.43Å; F336-Y340 AromaticContact CZ-CD2 3.92Å; F336-Y340 HydrophobicContact CZ-CD2 3.92Å; F336-Y340 HydrophobicContact CZ-CG 4.17Å; F336-Y340 PolarHBondContact O-N 3.44Å; Y340-D342 PolarHBondContact O-N 2.79Å; Y340-R343 PolarHBondContact O-N 3.07Å; Y340-R343 VanDerWaalsContact O-N 3.12Å; Y340-D374 WeakPolarHBondContact CE1-OD1 3.43Å; Y340-R377 HydrophobicContact CD1-CG 4.08Å; Y340-R377 HydrophobicContact CE1-CG 3.77Å; Y340-R377 PolarHBondContact OH-NE 3.24Å; Y340-R377 VanDerWaalsContact OH-NE 3.12Å; Y340-H508 AromaticContact CE2-CE1 3.46Å; Y340-H508 VanDerWaalsContact CE2-CE1 3.46Å; Y340-H508 WeakPolarHBondContact CE2-CE1 3.42Å; Y340-H508 AromaticContact CE2-NE2 3.01Å; Y340-H508 WeakPolarHBondContact CE2-NE2 3.48Å; Y340-H508 AromaticContact CZ-NE2 2.89Å; Y340-H508 PolarHBondContact OH-NE2 2.95Å
341	P	89.5	Confident	76.5	Confident	67 Å²	67	57.8 Å²	57.8	44%	0.435	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-27.1	-176.4	25.4	-35	0	0	0	113.6	H337	H337-P341 WeakPolarHBondContact O-CA 3.12Å
342	D	86	Confident	73.4	Confident	117 Å²	117	62 Å²	62	63%	0.626	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-3.7	-179.5	-51.2	-41.5	0	0	0	113.9	Y340 N376	Y340-D342 PolarHBondContact O-N 2.79Å; D342-N376 PolarHBondContact OD2-ND2 3.11Å
343	R	82.4	Confident	70.6	Confident	88 Å²	88	69.7 Å²	69.7	33%	0.332	40%	0.398	S	S	.	.			trans	-108.7	128.7	-178.4	-63	-170.9	-173.7	178	11.1	111.1	F336 H337 Y340 D374	F336-R343 HydrophobicContact CE1-CB 3.87Å; F336-R343 HydrophobicContact CZ-CB 4.01Å; H337-R343 PolarHBondContact CD2-O 3.31Å; Y340-R343 PolarHBondContact O-N 3.07Å; Y340-R343 VanDerWaalsContact O-N 3.12Å; R343-D374 IonicContact CZ-OD1 2.72Å; R343-D374 IonicContact NH2-OD1 2.66Å; R343-D374 PolarHBondContact NH2-OD1 2.98Å
344	Q	71.4	Confident	67.6	Low	170 Å²	170	75 Å²	75	79%	0.794	43%	0.426	S	S	*	.	S	Bend	trans	-81.3	-28.3	-179.5	-63.6	-177.3	1.9	0	0	114	H337	H337-Q344 PolarHBondContact NE2-O 3.22Å; H337-Q344 VanDerWaalsContact NE2-O 3.11Å
345	N	68.5	Low	64.5	Low	58 Å²	58	79.6 Å²	79.6	31%	0.31	46%	0.458	S	S	.	.			trans	-135.6	153.1	-177.3	-76.9	-8.9	0	0	0	110.8	F336 T347	F336-N345 WeakPolarHBondContact CE1-O 3.48Å; F336-N345 WeakPolarHBondContact CZ-O 3.24Å; N345-T347 VanDerWaalsContact C-N 3.27Å; N345-T347 PolarHBondContact O-N 3.37Å
346	D	66.1	Low	61.2	Low	22 Å²	22	84.9 Å²	84.9	12%	0.118	49%	0.49	C	S	.	.	S	Bend	trans	-93	30.4	172	-171.2	20.9	0	0	0	112.4	F336 S413 R479	F336-D346 HydrophobicContact CD1-CB 3.95Å; F336-D346 HydrophobicContact CD2-CB 3.6Å; F336-D346 VanDerWaalsContact CD2-OD1 3.31Å; F336-D346 WeakPolarHBondContact CD2-OD1 3.35Å; F336-D346 HydrophobicContact CE1-CB 4Å; F336-D346 HydrophobicContact CE2-CB 3.66Å; F336-D346 VanDerWaalsContact CE2-CG 3.43Å; F336-D346 WeakPolarHBondContact CE2-OD1 3.35Å; F336-D346 HydrophobicContact CG-CB 3.75Å; F336-D346 HydrophobicContact CZ-CB 3.86Å; D346-S413 VanDerWaalsContact OD2-CB 3.27Å; D346-S413 WeakPolarHBondContact OD2-CB 3.47Å; D346-S413 PolarHBondContact OD2-OG 2.84Å; D346-R479 PolarHBondContact O-NH2 3Å; D346-R479 IonicContact OD1-CZ 2.74Å; D346-R479 IonicContact OD1-NH1 2.67Å; D346-R479 PolarHBondContact OD1-NH1 2.8Å; D346-R479 IonicContact OD1-NH2 3.77Å; D346-R479 PolarHBondContact OD1-NH2 3.35Å; D346-R479 IonicContact OD2-NH2 3.4Å; D346-R479 PolarHBondContact OD2-NH2 3.19Å; D346-R479 VanDerWaalsContact OD2-NH2 3.08Å
347	T	53.8	Low	58.1	Low	83 Å²	83	91.5 Å²	91.5	51%	0.509	53%	0.526	S	S	.	.			trans	-105.6	135.8	173.8	51.1	0	0	0	0	109.6	N345 E349	N345-T347 VanDerWaalsContact C-N 3.27Å; N345-T347 PolarHBondContact O-N 3.37Å; T347-E349 VanDerWaalsContact CB-O 3.25Å; T347-E349 WeakPolarHBondContact CB-O 3.5Å; T347-E349 PolarHBondContact O-N 2.88Å; T347-E349 PolarHBondContact OG1-O 2.7Å
348	S	44.7	Very low	55.3	Low	132 Å²	132	97.8 Å²	97.8	92%	0.923	56%	0.555	S	S	*	*	S	Bend	trans	-64.2	-23.6	169.3	43.6	0	0	0	0	112.2
349	E	35.2	Very low	52.2	Low	154 Å²	154	104.3 Å²	104.3	72%	0.72	59%	0.59	S	S	*	*	S	Bend	trans	-98.2	108.5	170.4	-65.4	175.6	173	0	0	109	T347	T347-E349 VanDerWaalsContact CB-O 3.25Å; T347-E349 WeakPolarHBondContact CB-O 3.5Å; T347-E349 PolarHBondContact O-N 2.88Å; T347-E349 PolarHBondContact OG1-O 2.7Å
350	A	30.6	Very low	49.3	Very low	79 Å²	79	111.4 Å²	111.4	65%	0.653	63%	0.628	S	S	*	*			trans	-71.7	124	157.3	0	0	0	0	0	107.3	S352	A350-S352 VanDerWaalsContact C-N 3.3Å; A350-S352 PolarHBondContact O-N 3.14Å
351	V	34.1	Very low	46.5	Very low	125 Å²	125	118 Å²	118	76%	0.758	66%	0.664	S	S	*	*			trans	-67.8	97.1	167	175.5	0	0	0	0	106.2	L353	V351-L353 PolarHBondContact O-N 2.89Å; V351-L353 VanDerWaalsContact O-N 3.14Å
352	S	27.3	Very low	43.8	Very low	97 Å²	97	124 Å²	124	68%	0.678	69%	0.686	S	S	*	*			trans	-54	120.5	177	-67.7	0	0	0	0	109.3	A350 V354	A350-S352 VanDerWaalsContact C-N 3.3Å; A350-S352 PolarHBondContact O-N 3.14Å; S352-V354 PolarHBondContact O-N 3.48Å
353	L	34.9	Very low	41.5	Very low	161 Å²	161	126 Å²	126	84%	0.843	70%	0.695	S	S	*	*			trans	-58.7	113.9	168.1	-75.3	165.7	0	0	0	107.4	V351 S355	V351-L353 PolarHBondContact O-N 2.89Å; V351-L353 VanDerWaalsContact O-N 3.14Å; L353-S355 PolarHBondContact O-N 3.38Å
354	V	31.4	Very low	39.4	Very low	133 Å²	133	127.8 Å²	127.8	81%	0.806	72%	0.718	S	S	*	*			trans	-72.9	79	173.3	-177.4	0	0	0	0	107.8	S352 T356	S352-V354 PolarHBondContact O-N 3.48Å; V354-T356 PolarHBondContact O-N 2.7Å
355	S	30.4	Very low	37.4	Very low	109 Å²	109	123 Å²	123	76%	0.762	71%	0.714	S	S	*	*			trans	-63	111.4	162.8	-66.2	0	0	0	0	107.6	L353	L353-S355 PolarHBondContact O-N 3.38Å
356	T	27.8	Very low	35.5	Very low	111 Å²	111	125.9 Å²	125.9	68%	0.681	74%	0.739	S	S	*	*			trans	-65	152	174.6	39.3	0	0	0	0	111	V354	V354-T356 PolarHBondContact O-N 2.7Å
357	N	29.3	Very low	33.8	Very low	143 Å²	143	130.4 Å²	130.4	77%	0.765	77%	0.77	S	S	*	*			trans	77.9	96.2	176.4	-43.9	-29.4	0	0	0	115.8
358	H	34.9	Very low	32.5	Very low	190 Å²	190	133.1 Å²	133.1	88%	0.88	79%	0.786	S	S	*	*				-164	151.2	98.5	-109.8	-82.9	0	0	0	111.8
359	N	30.5	Very low	31.9	Very low	137 Å²	137	132.6 Å²	132.6	73%	0.733	78%	0.783	S	S	*	*			trans	-78	145.7	162.9	-62.4	-12.4	0	0	0	108.9
360	D	34.2	Very low	31.5	Very low	150 Å²	150	128.6 Å²	128.6	80%	0.802	78%	0.782	S	S	*	*				-176.5	172.9	95.8	-92.7	-38.1	0	0	0	111.2
361	N	33.4	Very low	31.8	Very low	152 Å²	152	129.5 Å²	129.5	81%	0.813	78%	0.784	S	S	*	*			trans	-81.7	133.7	-175.5	-57.6	-79	0	0	0	112.1
362	E	32.8	Very low	32.2	Very low	194 Å²	194	128 Å²	128	91%	0.907	78%	0.777	S	S	*	*			trans	-170.7	159	131.5	-110.6	171.9	-160.8	0	0	113.9
363	I	37.1	Very low	32.9	Very low	158 Å²	158	127.4 Å²	127.4	81%	0.81	77%	0.773	S	S	*	*			trans	-142.8	138.6	177	-71.5	176.2	0	0	0	104.5
364	P	38.3	Very low	33.9	Very low	126 Å²	126	123 Å²	123	82%	0.818	75%	0.75	S	S	*	*			cis	-135	170.4	26.2	35	-15.4	0	0	0	117.1
365	G	31.1	Very low	35	Very low	69 Å²	69	122.5 Å²	122.5	71%	0.711	75%	0.747	S	S	*	*			trans	176.5	119.4	158.1	0	0	0	0	0	111.7	P367	G365-P367 WeakPolarHBondContact O-CD 3.38Å
366	S	27.7	Very low	36.8	Very low	119 Å²	119	122.6 Å²	122.6	83%	0.832	74%	0.739	S	S	*	*			trans	-85.3	109.5	177.5	53.3	0	0	0	0	110.9	T368	S366-T368 PolarHBondContact O-N 2.72Å
367	P	30.7	Very low	39.6	Very low	117 Å²	117	119 Å²	119	76%	0.76	71%	0.713	S	S	*	*			trans	-72.1	120	174.7	30.2	-32.9	0	0	0	109.2	G365 S369	G365-P367 WeakPolarHBondContact O-CD 3.38Å; P367-S369 PolarHBondContact O-N 3.35Å; P367-S369 VanDerWaalsContact O-N 3.09Å
368	T	27.2	Very low	42.6	Very low	139 Å²	139	114.4 Å²	114.4	85%	0.853	69%	0.689	S	S	*	*			trans	-64.3	109.7	162.7	37.6	0	0	0	0	107.7	S366 G370	S366-T368 PolarHBondContact O-N 2.72Å; T368-G370 PolarHBondContact O-N 2.99Å
369	S	31.4	Very low	45.5	Very low	122 Å²	122	113.5 Å²	113.5	85%	0.853	68%	0.678	S	S	*	*			trans	-72.8	71.9	-174.9	43.8	0	0	0	0	111.9	P367 S371	P367-S369 PolarHBondContact O-N 3.35Å; P367-S369 VanDerWaalsContact O-N 3.09Å; S369-S371 PolarHBondContact O-N 3.16Å
370	G	27.6	Very low	48.7	Very low	69 Å²	69	107.3 Å²	107.3	71%	0.711	64%	0.644	S	S	*	*			trans	-58.4	107.4	167.6	0	0	0	0	0	109.6	T368	T368-G370 PolarHBondContact O-N 2.99Å
371	S	36.5	Very low	51.7	Low	98 Å²	98	102.9 Å²	102.9	69%	0.685	63%	0.625	S	S	*	*	P	Polyproline II helix	trans	-47.4	133.1	170.5	174.6	0	0	0	0	109.3	S369 S373	S369-S371 PolarHBondContact O-N 3.16Å; S371-S373 PolarHBondContact O-N 2.88Å; S371-S373 VanDerWaalsContact O-N 3.1Å
372	P	41.5	Very low	54.6	Low	94 Å²	94	99.9 Å²	99.9	61%	0.61	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-56.5	123.3	175.7	24.9	-33.7	0	0	0	108.6	D374	P372-D374 PolarHBondContact O-N 3.42Å
373	S	42.5	Very low	57.6	Low	84 Å²	84	95.3 Å²	95.3	59%	0.587	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-62	133.6	-172.4	54.2	0	0	0	0	110.7	S371 T375	S371-S373 PolarHBondContact O-N 2.88Å; S371-S373 VanDerWaalsContact O-N 3.1Å; S373-T375 PolarHBondContact O-N 3.1Å; S373-T375 PolarHBondContact O-OG1 3.18Å; S373-T375 PolarHBondContact OG-OG1 3.04Å
374	D	55.5	Low	60.5	Low	70 Å²	70	87.8 Å²	87.8	37%	0.374	55%	0.545	S	S	.	.	G	3₁₀ helix	trans	-70.2	29.6	177.3	-76.6	-34.7	0	0	0	113.2	Y340 R343 P372 R377	Y340-D374 WeakPolarHBondContact CE1-OD1 3.43Å; R343-D374 IonicContact CZ-OD1 2.72Å; R343-D374 IonicContact NH2-OD1 2.66Å; R343-D374 PolarHBondContact NH2-OD1 2.98Å; P372-D374 PolarHBondContact O-N 3.42Å; D374-R377 HydrophobicContact CB-CB 4.48Å; D374-R377 WeakPolarHBondContact O-CB 3.44Å
375	T	55.1	Low	63.3	Low	122 Å²	122	81.8 Å²	81.8	75%	0.748	51%	0.506	S	S	*	.	G	3₁₀ helix	trans	-71.1	-29.9	-173.6	39.7	0	0	0	0	114.1	S373	S373-T375 PolarHBondContact O-N 3.1Å; S373-T375 PolarHBondContact O-OG1 3.18Å; S373-T375 PolarHBondContact OG-OG1 3.04Å
376	N	67.1	Low	66.5	Low	110 Å²	110	79.2 Å²	79.2	59%	0.588	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-101.2	34.8	-179.7	-153.1	38.6	0	0	0	112.9	D342	D342-N376 PolarHBondContact OD2-ND2 3.11Å
377	R	86.8	Confident	69.7	Low	36 Å²	36	74 Å²	74	14%	0.136	44%	0.438	C	S	.	.			trans	-98.3	129	-168.8	-169.1	-174.6	170.8	-137.1	-20.6	112.9	L339 Y340 D374 H508 G511 G512	L339-R377 WeakPolarHBondContact O-CG 3.3Å; Y340-R377 HydrophobicContact CD1-CG 4.08Å; Y340-R377 HydrophobicContact CE1-CG 3.77Å; Y340-R377 PolarHBondContact OH-NE 3.24Å; Y340-R377 VanDerWaalsContact OH-NE 3.12Å; D374-R377 HydrophobicContact CB-CB 4.48Å; D374-R377 WeakPolarHBondContact O-CB 3.44Å; R377-H508 VanDerWaalsContact CZ-CD2 3.49Å; R377-H508 PolarHBondContact NH2-CD2 2.86Å; R377-H508 PolarHBondContact NH2-NE2 2.9Å; R377-H508 PolarHBondContact NH2-O 3.44Å; R377-G511 PolarHBondContact NH1-O 3.06Å; R377-G512 PolarHBondContact NH1-O 2.94Å
378	N	93.7	Very high	72.9	Confident	47 Å²	47	68.4 Å²	68.4	25%	0.251	40%	0.402	S	S	.	.			trans	-77.1	153.8	173.5	-78.7	-30.4	0	0	0	112.1	L338 L339 L446	L338-N378 WeakPolarHBondContact O-CB 3.36Å; L338-N378 PolarHBondContact O-ND2 3.27Å; L339-N378 WeakPolarHBondContact CD2-O 3.48Å; L339-N378 PolarHBondContact O-N 3.15Å; N378-L446 HydrophobicContact CB-CD2 3.79Å
379	R	95.3	Very high	76.3	Confident	171 Å²	171	61.8 Å²	61.8	65%	0.645	36%	0.362	S	S	*	.			trans	-139.4	149	173.2	65.9	-176.6	-178.3	-77.8	-1.2	110.7
380	L	97.4	Very high	79.4	Confident	7 Å²	7	56 Å²	56	4%	0.037	32%	0.321	C	S	.	.			trans	-85.7	147.5	172.9	-67.6	-174.7	0	0	0	111.2	L335 L338 P384 L385 L388 L445 S509	L335-L380 HydrophobicContact CD1-CD1 3.95Å; L338-L380 HydrophobicContact CD2-CD2 3.9Å; L380-P384 HydrophobicContact CB-CB 4.2Å; L380-P384 HydrophobicContact CD1-CB 4.21Å; L380-P384 HydrophobicContact CD2-CB 4.03Å; L380-P384 HydrophobicContact CG-CB 4.39Å; L380-L385 HydrophobicContact CB-CD2 3.84Å; L380-L385 HydrophobicContact CB-CG 3.78Å; L380-L385 HydrophobicContact CD1-CD2 4.31Å; L380-L388 HydrophobicContact CD1-CD2 4.04Å; L380-L445 HydrophobicContact CD2-CB 3.99Å; L380-S509 PolarHBondContact N-O 3.15Å
381	S	96.4	Very high	82.7	Confident	56 Å²	56	53.6 Å²	53.6	39%	0.392	29%	0.292	S	S	.	.			trans	-92.5	-178.3	171.2	71.9	0	0	0	0	111.8	K383 P384 L385 G448	S381-K383 PolarHBondContact O-N 2.84Å; S381-P384 WeakPolarHBondContact O-CD 3.31Å; S381-L385 WeakPolarHBondContact O-CB 3.38Å; S381-L385 VanDerWaalsContact O-CG 3.27Å; S381-L385 WeakPolarHBondContact O-CG 3.41Å; S381-L385 PolarHBondContact O-N 3.48Å; S381-G448 WeakPolarHBondContact OG-CA 3.47Å
382	E	96.2	Very high	85.7	Confident	90 Å²	90	49 Å²	49	42%	0.421	26%	0.259	S	S	.	.	H	α-helix	trans	-56.2	-51.5	-168.7	-176.1	167.8	171.1	0	0	114.9	L385 I386 P535 S537	E382-L385 PolarHBondContact O-N 3.41Å; E382-I386 HydrophobicContact CG-CD1 3.68Å; E382-I386 VanDerWaalsContact O-CG1 3.3Å; E382-I386 WeakPolarHBondContact O-CG1 3.5Å; E382-I386 PolarHBondContact O-N 3.19Å; E382-P535 HydrophobicContact CB-CB 3.9Å; E382-P535 HydrophobicContact CB-CG 3.73Å; E382-P535 HydrophobicContact CG-CB 3.7Å; E382-P535 HydrophobicContact CG-CG 3.98Å; E382-S537 VanDerWaalsContact CD-OG 3.23Å; E382-S537 VanDerWaalsContact OE1-CB 3.3Å; E382-S537 WeakPolarHBondContact OE1-CB 3.42Å; E382-S537 PolarHBondContact OE1-OG 3.45Å
383	K	95.7	Very high	88.4	Confident	97 Å²	97	44.6 Å²	44.6	42%	0.422	23%	0.23	S	C	.	.	H	α-helix	trans	-62.6	-50.1	-178.5	177.4	-174.2	-174.7	-170.8	0	112.1	S381 L385 I386 V387 D449	S381-K383 PolarHBondContact O-N 2.84Å; K383-L385 VanDerWaalsContact C-N 3.35Å; K383-L385 PolarHBondContact O-N 3.35Å; K383-I386 PolarHBondContact O-N 2.85Å; K383-V387 WeakPolarHBondContact O-CG2 3.34Å; K383-V387 PolarHBondContact O-N 2.87Å; K383-D449 WeakPolarHBondContact CE-OD1 3.19Å; K383-D449 IonicContact NZ-OD1 2.7Å; K383-D449 PolarHBondContact NZ-OD1 3.21Å
384	P	97.4	Very high	91	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-56.9	-40	171.8	-29.3	36.3	0	0	0	114.7	L380 S381 V387 L388 L445 G448	L380-P384 HydrophobicContact CB-CB 4.2Å; L380-P384 HydrophobicContact CD1-CB 4.21Å; L380-P384 HydrophobicContact CD2-CB 4.03Å; L380-P384 HydrophobicContact CG-CB 4.39Å; S381-P384 WeakPolarHBondContact O-CD 3.31Å; P384-V387 PolarHBondContact O-N 2.82Å; P384-L388 VanDerWaalsContact O-CB 3.24Å; P384-L388 WeakPolarHBondContact O-CB 3.48Å; P384-L388 PolarHBondContact O-N 2.92Å; P384-L445 HydrophobicContact CB-CD2 3.92Å; P384-L445 HydrophobicContact CG-CD2 4.3Å; P384-G448 WeakPolarHBondContact CD-O 3.46Å
385	L	97.7	Very high	93	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-66	-38.7	178	-72.9	168.3	0	0	0	112.6	L380 S381 E382 K383 A389 L506 A510 P535 L538	L380-L385 HydrophobicContact CB-CD2 3.84Å; L380-L385 HydrophobicContact CB-CG 3.78Å; L380-L385 HydrophobicContact CD1-CD2 4.31Å; S381-L385 WeakPolarHBondContact O-CB 3.38Å; S381-L385 VanDerWaalsContact O-CG 3.27Å; S381-L385 WeakPolarHBondContact O-CG 3.41Å; S381-L385 PolarHBondContact O-N 3.48Å; E382-L385 PolarHBondContact O-N 3.41Å; K383-L385 VanDerWaalsContact C-N 3.35Å; K383-L385 PolarHBondContact O-N 3.35Å; L385-A389 WeakPolarHBondContact O-CB 3.18Å; L385-A389 PolarHBondContact O-N 2.9Å; L385-L506 HydrophobicContact CD2-CD2 4.42Å; L385-A510 HydrophobicContact CD1-CB 3.71Å; L385-A510 HydrophobicContact CD2-CB 4.39Å; L385-P535 HydrophobicContact CD1-CG 3.92Å; L385-L538 HydrophobicContact CB-CD2 3.66Å; L385-L538 HydrophobicContact CD1-CD2 4.26Å; L385-L538 HydrophobicContact CG-CD2 4.46Å
386	I	96.8	Very high	95	Very high	14 Å²	14	31.7 Å²	31.7	7%	0.072	15%	0.151	C	C	.	.	H	α-helix	trans	-67.1	-42.6	176.1	-68.2	162.8	0	0	0	110.8	E382 K383 A389 S390 L564 F565	E382-I386 HydrophobicContact CG-CD1 3.68Å; E382-I386 VanDerWaalsContact O-CG1 3.3Å; E382-I386 WeakPolarHBondContact O-CG1 3.5Å; E382-I386 PolarHBondContact O-N 3.19Å; K383-I386 PolarHBondContact O-N 2.85Å; I386-A389 PolarHBondContact O-N 3.01Å; I386-S390 WeakPolarHBondContact O-CB 3.33Å; I386-S390 PolarHBondContact O-N 2.88Å; I386-S390 PolarHBondContact O-OG 3.24Å; I386-L564 HydrophobicContact CD1-CD1 3.67Å; I386-L564 HydrophobicContact CD1-CG 4.15Å; I386-L564 HydrophobicContact CG1-CD1 4.15Å; I386-L564 HydrophobicContact CG1-CD2 4.21Å; I386-L564 HydrophobicContact CG1-CG 4.06Å; I386-L564 HydrophobicContact CG2-CG 4.24Å; I386-L564 VanDerWaalsContact CG2-O 3.3Å; I386-L564 WeakPolarHBondContact CG2-O 3.49Å; I386-F565 HydrophobicContact CG2-CD1 4.37Å
387	V	96.6	Very high	96.5	Very high	9 Å²	9	29.1 Å²	29.1	6%	0.055	14%	0.135	C	C	.	.	H	α-helix	trans	-66.4	-40.9	176.8	173.5	0	0	0	0	111.3	K383 P384 S390 H391 A450 F455	K383-V387 WeakPolarHBondContact O-CG2 3.34Å; K383-V387 PolarHBondContact O-N 2.87Å; P384-V387 PolarHBondContact O-N 2.82Å; V387-S390 PolarHBondContact O-N 3.23Å; V387-H391 VanDerWaalsContact CG1-CE1 3.42Å; V387-H391 WeakPolarHBondContact CG1-CE1 3.44Å; V387-H391 WeakPolarHBondContact CG1-ND1 3.31Å; V387-H391 WeakPolarHBondContact O-CB 3.14Å; V387-H391 VanDerWaalsContact O-CG 3.31Å; V387-H391 PolarHBondContact O-N 2.93Å; V387-H391 PolarHBondContact O-ND1 3.4Å; V387-A450 HydrophobicContact CB-CB 4.02Å; V387-A450 HydrophobicContact CG1-CB 4.1Å; V387-A450 HydrophobicContact CG2-CB 3.95Å; V387-F455 HydrophobicContact CG1-CD2 4.2Å; V387-F455 HydrophobicContact CG1-CE2 4.19Å
388	L	97.9	Very high	96.9	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-57.6	-51.8	172	172.9	61.4	0	0	0	111.7	L335 L380 P384 S390 H391 I392 I415 F455 L506	L335-L388 HydrophobicContact CD2-CD1 3.9Å; L335-L388 HydrophobicContact CD2-CD2 3.61Å; L335-L388 HydrophobicContact CD2-CG 4.44Å; L380-L388 HydrophobicContact CD1-CD2 4.04Å; P384-L388 VanDerWaalsContact O-CB 3.24Å; P384-L388 WeakPolarHBondContact O-CB 3.48Å; P384-L388 PolarHBondContact O-N 2.92Å; L388-S390 PolarHBondContact O-N 3.24Å; L388-H391 PolarHBondContact O-N 2.89Å; L388-I392 HydrophobicContact CD1-CG1 4.08Å; L388-I392 WeakPolarHBondContact O-CG1 3.39Å; L388-I392 PolarHBondContact O-N 2.89Å; L388-I392 VanDerWaalsContact O-N 3.11Å; L388-I415 HydrophobicContact CD1-CD1 4.39Å; L388-I415 HydrophobicContact CD1-CG2 3.94Å; L388-F455 VanDerWaalsContact CA-CD2 3.48Å; L388-F455 HydrophobicContact CB-CD2 3.95Å; L388-F455 HydrophobicContact CB-CE2 3.76Å; L388-F455 HydrophobicContact CB-CG 4.48Å; L388-F455 HydrophobicContact CB-CZ 4.12Å; L388-F455 HydrophobicContact CD1-CB 4.21Å; L388-F455 HydrophobicContact CD1-CD1 3.77Å; L388-F455 HydrophobicContact CD1-CD2 4.12Å; L388-F455 HydrophobicContact CD1-CE1 4.08Å; L388-F455 HydrophobicContact CD1-CE2 4.43Å; L388-F455 HydrophobicContact CD1-CG 3.78Å; L388-F455 HydrophobicContact CD1-CZ 4.4Å; L388-L506 HydrophobicContact CB-CD2 4.5Å; L388-L506 HydrophobicContact CD2-CD2 3.97Å; L388-L506 HydrophobicContact CG-CD2 4.05Å
389	A	97.6	Very high	97.1	Very high	1 Å²	1	26.8 Å²	26.8	1%	0.008	12%	0.123	C	C	.	.	H	α-helix	trans	-57.9	-49.6	177.7	0	0	0	0	0	111.5	L385 I386 H391 I392 L393 L506 F565	L385-A389 WeakPolarHBondContact O-CB 3.18Å; L385-A389 PolarHBondContact O-N 2.9Å; I386-A389 PolarHBondContact O-N 3.01Å; A389-H391 PolarHBondContact O-N 2.81Å; A389-I392 PolarHBondContact O-N 3.17Å; A389-L393 VanDerWaalsContact O-CB 3.31Å; A389-L393 WeakPolarHBondContact O-CB 3.15Å; A389-L393 WeakPolarHBondContact O-CG 3.25Å; A389-L393 PolarHBondContact O-N 2.75Å; A389-L506 HydrophobicContact CB-CD1 3.79Å; A389-L506 HydrophobicContact CB-CD2 3.9Å; A389-L506 HydrophobicContact CB-CG 4.5Å; A389-F565 HydrophobicContact CB-CD1 3.86Å; A389-F565 HydrophobicContact CB-CE1 3.4Å; A389-F565 VanDerWaalsContact CB-CE1 3.4Å; A389-F565 HydrophobicContact CB-CZ 4.06Å
390	S	96.8	Very high	97.1	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-62.1	-43.5	-176.8	-51.7	0	0	0	0	112.4	I386 V387 L388 S394 F565	I386-S390 WeakPolarHBondContact O-CB 3.33Å; I386-S390 PolarHBondContact O-N 2.88Å; I386-S390 PolarHBondContact O-OG 3.24Å; V387-S390 PolarHBondContact O-N 3.23Å; L388-S390 PolarHBondContact O-N 3.24Å; S390-S394 WeakPolarHBondContact O-CB 3.46Å; S390-S394 PolarHBondContact O-N 2.66Å; S390-F565 VanDerWaalsContact OG-CA 3.32Å; S390-F565 WeakPolarHBondContact OG-CA 3.47Å; S390-F565 PolarHBondContact OG-O 3.07Å
391	H	97.5	Very high	96.9	Very high	19 Å²	19	22.7 Å²	22.7	9%	0.088	12%	0.116	C	C	.	.	H	α-helix	trans	-66.5	-43.5	178.6	-76.3	158.2	0	0	0	113	N309 V387 L388 A389 S394 A395 I453 F455	N309-H391 HydrophobicContact CB-CB 4.26Å; N309-H391 WeakPolarHBondContact CB-O 3.28Å; N309-H391 VanDerWaalsContact ND2-CB 3.33Å; N309-H391 WeakPolarHBondContact ND2-CB 3.29Å; N309-H391 PolarHBondContact ND2-CD2 2.97Å; N309-H391 PolarHBondContact OD1-CD2 3.39Å; N309-H391 PolarHBondContact OD1-O 2.74Å; V387-H391 VanDerWaalsContact CG1-CE1 3.42Å; V387-H391 WeakPolarHBondContact CG1-CE1 3.44Å; V387-H391 WeakPolarHBondContact CG1-ND1 3.31Å; V387-H391 WeakPolarHBondContact O-CB 3.14Å; V387-H391 VanDerWaalsContact O-CG 3.31Å; V387-H391 PolarHBondContact O-N 2.93Å; V387-H391 PolarHBondContact O-ND1 3.4Å; L388-H391 PolarHBondContact O-N 2.89Å; A389-H391 PolarHBondContact O-N 2.81Å; H391-S394 WeakPolarHBondContact O-CB 3.31Å; H391-S394 PolarHBondContact O-N 3.16Å; H391-A395 PolarHBondContact O-N 2.98Å; H391-A395 VanDerWaalsContact O-N 3.14Å; H391-I453 PolarHBondContact CE1-O 3.39Å; H391-F455 HydrophobicContact CB-CB 3.98Å; H391-F455 AromaticContact ND1-CD2 3.77Å; H391-F455 PolarHBondContact ND1-N 3.11Å
392	I	98.2	Very high	96.7	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-73.6	-33.9	178.5	-56.8	-58	0	0	0	111.4	L388 A389 S394 A395 L396 V410 I415 L457 L502	L388-I392 HydrophobicContact CD1-CG1 4.08Å; L388-I392 WeakPolarHBondContact O-CG1 3.39Å; L388-I392 PolarHBondContact O-N 2.89Å; L388-I392 VanDerWaalsContact O-N 3.11Å; A389-I392 PolarHBondContact O-N 3.17Å; I392-S394 VanDerWaalsContact C-N 3.34Å; I392-S394 PolarHBondContact O-N 2.67Å; I392-A395 PolarHBondContact O-N 3.38Å; I392-L396 HydrophobicContact CG2-CD1 4.11Å; I392-L396 HydrophobicContact CG2-CG 4.23Å; I392-L396 WeakPolarHBondContact O-CB 3.32Å; I392-L396 WeakPolarHBondContact O-CG 3.41Å; I392-L396 PolarHBondContact O-N 2.89Å; I392-V410 HydrophobicContact CG2-CG1 4.17Å; I392-I415 HydrophobicContact CD1-CD1 4.14Å; I392-I415 HydrophobicContact CD1-CG1 3.9Å; I392-I415 HydrophobicContact CD1-CG2 4.09Å; I392-I415 HydrophobicContact CG1-CD1 4.03Å; I392-I415 HydrophobicContact CG1-CG1 4.35Å; I392-L457 HydrophobicContact CD1-CB 4.24Å; I392-L502 HydrophobicContact CB-CD1 3.99Å; I392-L502 HydrophobicContact CG2-CD1 3.89Å; I392-L502 HydrophobicContact CG2-CD2 4.32Å
393	L	97.9	Very high	96.6	Very high	2 Å²	2	22.6 Å²	22.6	1%	0.01	11%	0.108	C	C	.	.	H	α-helix	trans	-60.4	-41.9	169.3	-72.1	169.3	0	0	0	111.7	A389 A395 L396 H397 L499 L502 V556 L559 I560 F565	A389-L393 VanDerWaalsContact O-CB 3.31Å; A389-L393 WeakPolarHBondContact O-CB 3.15Å; A389-L393 WeakPolarHBondContact O-CG 3.25Å; A389-L393 PolarHBondContact O-N 2.75Å; L393-A395 PolarHBondContact O-N 2.91Å; L393-L396 PolarHBondContact O-N 2.85Å; L393-H397 WeakPolarHBondContact O-CB 3.39Å; L393-H397 PolarHBondContact O-N 2.83Å; L393-L499 HydrophobicContact CD2-CD2 4.06Å; L393-L502 HydrophobicContact CD2-CD2 3.68Å; L393-L502 HydrophobicContact CG-CD2 3.87Å; L393-V556 HydrophobicContact CB-CG1 4.39Å; L393-V556 HydrophobicContact CD2-CG1 4.02Å; L393-V556 VanDerWaalsContact O-CG1 3.3Å; L393-V556 WeakPolarHBondContact O-CG1 3.47Å; L393-L559 HydrophobicContact CD1-CB 4.01Å; L393-L559 HydrophobicContact CD2-CB 3.88Å; L393-L559 HydrophobicContact CD2-CD1 3.76Å; L393-L559 HydrophobicContact CD2-CG 4.43Å; L393-I560 HydrophobicContact CB-CG1 4.1Å; L393-F565 HydrophobicContact CD1-CB 4.38Å; L393-F565 HydrophobicContact CD1-CD1 4.48Å; L393-F565 HydrophobicContact CD1-CD2 3.6Å; L393-F565 HydrophobicContact CD1-CE2 3.94Å; L393-F565 HydrophobicContact CD1-CG 3.91Å
394	S	97	Very high	96.5	Very high	5 Å²	5	19.6 Å²	19.6	4%	0.035	10%	0.1	C	C	.	.	H	α-helix	trans	-59.3	-44.3	175.3	-157.1	0	0	0	0	112.1	H307 S390 H391 I392 Y398	H307-S394 VanDerWaalsContact CE1-C 3.46Å; H307-S394 PolarHBondContact CE1-OG 3.02Å; H307-S394 VanDerWaalsContact CE1-OG 3.3Å; H307-S394 PolarHBondContact NE2-OG 3.17Å; H307-S394 VanDerWaalsContact NE2-OG 3.1Å; S390-S394 WeakPolarHBondContact O-CB 3.46Å; S390-S394 PolarHBondContact O-N 2.66Å; H391-S394 WeakPolarHBondContact O-CB 3.31Å; H391-S394 PolarHBondContact O-N 3.16Å; I392-S394 VanDerWaalsContact C-N 3.34Å; I392-S394 PolarHBondContact O-N 2.67Å; S394-Y398 PolarHBondContact O-N 2.65Å
395	A	98	Very high	96.4	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-64.2	-48.6	176	0	0	0	0	0	112.5	N309 I310 H391 I392 L393 H397 Y398 M399 L457	N309-A395 HydrophobicContact CB-CB 4.13Å; N309-A395 WeakPolarHBondContact O-CB 3.38Å; I310-A395 HydrophobicContact CD1-CB 4.43Å; I310-A395 HydrophobicContact CG1-CB 3.82Å; H391-A395 PolarHBondContact O-N 2.98Å; H391-A395 VanDerWaalsContact O-N 3.14Å; I392-A395 PolarHBondContact O-N 3.38Å; L393-A395 PolarHBondContact O-N 2.91Å; A395-H397 VanDerWaalsContact C-N 3.31Å; A395-H397 PolarHBondContact O-N 3.45Å; A395-Y398 PolarHBondContact O-N 2.66Å; A395-M399 WeakPolarHBondContact O-CG 3.37Å; A395-M399 PolarHBondContact O-N 2.93Å; A395-M399 VanDerWaalsContact O-N 3.11Å; A395-L457 HydrophobicContact CB-CB 4.26Å; A395-L457 HydrophobicContact CB-CD2 4.37Å
396	L	98	Very high	96.2	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-65	-33.8	179.4	-69	178	0	0	0	112.2	I392 L393 M399 H400 H407 V410 L457 D498 L502 V556	I392-L396 HydrophobicContact CG2-CD1 4.11Å; I392-L396 HydrophobicContact CG2-CG 4.23Å; I392-L396 WeakPolarHBondContact O-CB 3.32Å; I392-L396 WeakPolarHBondContact O-CG 3.41Å; I392-L396 PolarHBondContact O-N 2.89Å; L393-L396 PolarHBondContact O-N 2.85Å; L396-M399 HydrophobicContact CD2-SD 4.43Å; L396-M399 PolarHBondContact O-N 2.76Å; L396-H400 WeakPolarHBondContact O-CB 3.2Å; L396-H400 PolarHBondContact O-CD2 3.47Å; L396-H400 PolarHBondContact O-N 3.38Å; L396-H407 HydrophobicContact CD2-CB 4.29Å; L396-V410 HydrophobicContact CD2-CG2 4.15Å; L396-L457 HydrophobicContact CD2-CD2 3.95Å; L396-D498 HydrophobicContact CD1-CB 4.05Å; L396-D498 HydrophobicContact CD2-CB 3.84Å; L396-L502 HydrophobicContact CD1-CD2 4.27Å; L396-V556 HydrophobicContact CB-CG1 4.38Å; L396-V556 HydrophobicContact CB-CG2 4.34Å
397	H	97	Very high	96.2	Very high	56 Å²	56	18.9 Å²	18.9	26%	0.259	10%	0.096	S	C	.	.	H	α-helix	trans	-61.3	-57.2	176.2	-177.3	54.1	0	0	0	110.2	L393 A395 M399 H400 T401 V556 S557 I560	L393-H397 WeakPolarHBondContact O-CB 3.39Å; L393-H397 PolarHBondContact O-N 2.83Å; A395-H397 VanDerWaalsContact C-N 3.31Å; A395-H397 PolarHBondContact O-N 3.45Å; H397-M399 VanDerWaalsContact C-N 3.26Å; H397-M399 PolarHBondContact O-N 3.42Å; H397-H400 PolarHBondContact O-N 3Å; H397-T401 PolarHBondContact O-N 3.13Å; H397-T401 PolarHBondContact O-OG1 3.18Å; H397-V556 HydrophobicContact CB-CB 4.36Å; H397-V556 HydrophobicContact CB-CG1 3.7Å; H397-S557 PolarHBondContact CE1-OG 2.72Å; H397-I560 HydrophobicContact CB-CD1 3.36Å
398	Y	96.9	Very high	96	Very high	35 Å²	35	19 Å²	19	14%	0.137	10%	0.099	C	C	.	.	H	α-helix	trans	-53.1	-41.5	177.9	174.9	-96.3	0	0	0	112.7	L304 L305 Q306 H307 I310 S394 A395 N402 W403	L304-Y398 PolarHBondContact O-OH 2.77Å; L305-Y398 HydrophobicContact CB-CE1 4.4Å; L305-Y398 HydrophobicContact CD2-CD1 4.03Å; L305-Y398 HydrophobicContact CD2-CE1 3.65Å; Q306-Y398 PolarHBondContact N-OH 2.82Å; Q306-Y398 VanDerWaalsContact O-CZ 3.3Å; Q306-Y398 PolarHBondContact O-OH 3.29Å; H307-Y398 HydrophobicContact CB-CD1 3.8Å; H307-Y398 HydrophobicContact CB-CE1 4.05Å; H307-Y398 HydrophobicContact CB-CG 4.07Å; I310-Y398 HydrophobicContact CD1-CD1 4Å; I310-Y398 HydrophobicContact CD1-CE1 4.43Å; S394-Y398 PolarHBondContact O-N 2.65Å; A395-Y398 PolarHBondContact O-N 2.66Å; Y398-N402 HydrophobicContact CD2-CB 4.46Å; Y398-N402 VanDerWaalsContact O-CB 3.3Å; Y398-N402 WeakPolarHBondContact O-CB 3.41Å; Y398-N402 PolarHBondContact O-N 3.38Å; Y398-W403 AromaticContact CE1-CD1 3.75Å; Y398-W403 AromaticContact CE1-NE1 3.54Å; Y398-W403 AromaticContact CZ-CD1 3.96Å; Y398-W403 AromaticContact CZ-NE1 3.37Å; Y398-W403 PolarHBondContact OH-NE1 3.29Å; Y398-W403 VanDerWaalsContact OH-NE1 3.15Å
399	M	96.7	Very high	95.8	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-65.3	-50.8	173.5	-67.9	176	66.9	0	0	112.8	L305 I310 A395 L396 H397 W403 S404 M405 H407 L457 F460	L305-M399 HydrophobicContact CD1-CG 4.42Å; L305-M399 HydrophobicContact CD2-CG 3.9Å; I310-M399 HydrophobicContact CD1-CG 4.02Å; I310-M399 HydrophobicContact CD1-SD 4.35Å; A395-M399 WeakPolarHBondContact O-CG 3.37Å; A395-M399 PolarHBondContact O-N 2.93Å; A395-M399 VanDerWaalsContact O-N 3.11Å; L396-M399 HydrophobicContact CD2-SD 4.43Å; L396-M399 PolarHBondContact O-N 2.76Å; H397-M399 VanDerWaalsContact C-N 3.26Å; H397-M399 PolarHBondContact O-N 3.42Å; M399-W403 PolarHBondContact O-N 3.46Å; M399-S404 PolarHBondContact O-N 3.47Å; M399-M405 CarbonylContact C-O 3.6Å; M399-M405 HydrophobicContact CB-CB 4.45Å; M399-M405 HydrophobicContact CE-CG 4.16Å; M399-M405 HydrophobicContact CE-SD 3.9Å; M399-M405 PolarHBondContact O-N 3.05Å; M399-H407 HydrophobicContact CE-CB 3.8Å; M399-H407 HydrophobicContact SD-CB 4.42Å; M399-L457 HydrophobicContact SD-CD2 4.03Å; M399-F460 HydrophobicContact CE-CD1 4.13Å; M399-F460 HydrophobicContact CE-CE1 3.63Å; M399-F460 HydrophobicContact SD-CE1 3.69Å; M399-F460 HydrophobicContact SD-CZ 4.31Å
400	H	95.3	Very high	95.8	Very high	23 Å²	23	19.7 Å²	19.7	11%	0.106	10%	0.103	C	C	.	.	H	α-helix	trans	-72.4	-34.8	-171.5	-69.3	-164.5	0	0	0	112.4	L396 H397 M405 T495 D498 V556	L396-H400 WeakPolarHBondContact O-CB 3.2Å; L396-H400 PolarHBondContact O-CD2 3.47Å; L396-H400 PolarHBondContact O-N 3.38Å; H397-H400 PolarHBondContact O-N 3Å; H400-M405 PolarHBondContact CD2-O 2.84Å; H400-T495 HydrophobicContact CB-CG2 4.2Å; H400-T495 PolarHBondContact CE1-O 2.88Å; H400-T495 WeakPolarHBondContact ND1-CB 3.48Å; H400-D498 IonicContact CD2-OD2 2.7Å; H400-D498 IonicContact CE1-OD2 3.78Å; H400-D498 IonicContact NE2-OD2 3.43Å; H400-D498 PolarHBondContact NE2-OD2 3.19Å; H400-V556 VanDerWaalsContact ND1-CG2 3.34Å; H400-V556 WeakPolarHBondContact ND1-CG2 3.41Å
401	T	93.4	Very high	95.8	Very high	68 Å²	68	20.9 Å²	20.9	42%	0.417	11%	0.108	S	C	.	.	H	α-helix	trans	-98.1	-36.4	-175.1	56.5	0	0	0	0	114.6	H397	H397-T401 PolarHBondContact O-N 3.13Å; H397-T401 PolarHBondContact O-OG1 3.18Å
402	N	93.3	Very high	95.7	Very high	75 Å²	75	20 Å²	20	40%	0.401	10%	0.104	S	C	.	.	H	α-helix	trans	-92.8	-29.7	-174.4	-57.8	50.8	0	0	0	112	Y398	Y398-N402 HydrophobicContact CD2-CB 4.46Å; Y398-N402 VanDerWaalsContact O-CB 3.3Å; Y398-N402 WeakPolarHBondContact O-CB 3.41Å; Y398-N402 PolarHBondContact O-N 3.38Å
403	W	93.5	Very high	95.5	Very high	69 Å²	69	21.2 Å²	21.2	26%	0.261	11%	0.112	S	C	.	.	S	Bend	trans	-117.9	-3.8	-175.3	-66.3	107.4	0	0	0	114.3	L304 L305 Y398 M399 M405	L304-W403 HydrophobicContact CB-CD2 4.36Å; L304-W403 HydrophobicContact CB-CE3 4.36Å; L304-W403 HydrophobicContact CB-CH2 3.91Å; L304-W403 HydrophobicContact CB-CZ2 3.86Å; L304-W403 HydrophobicContact CB-CZ3 4.17Å; L304-W403 HydrophobicContact CD1-CE3 3.91Å; L304-W403 HydrophobicContact CD1-CH2 4.21Å; L304-W403 HydrophobicContact CD1-CZ3 3.71Å; L304-W403 HydrophobicContact CD2-CH2 4.23Å; L304-W403 HydrophobicContact CD2-CZ3 4.44Å; L304-W403 HydrophobicContact CG-CH2 4.33Å; L304-W403 HydrophobicContact CG-CZ3 4.32Å; L304-W403 WeakPolarHBondContact O-CZ2 3.5Å; L305-W403 HydrophobicContact CD2-CG 4.28Å; Y398-W403 AromaticContact CE1-CD1 3.75Å; Y398-W403 AromaticContact CE1-NE1 3.54Å; Y398-W403 AromaticContact CZ-CD1 3.96Å; Y398-W403 AromaticContact CZ-NE1 3.37Å; Y398-W403 PolarHBondContact OH-NE1 3.29Å; Y398-W403 VanDerWaalsContact OH-NE1 3.15Å; M399-W403 PolarHBondContact O-N 3.46Å; W403-M405 HydrophobicContact CB-CB 3.99Å; W403-M405 HydrophobicContact CB-CE 4.28Å; W403-M405 PolarHBondContact O-N 2.95Å
404	S	93.3	Very high	95.4	Very high	35 Å²	35	21.6 Å²	21.6	25%	0.245	11%	0.114	C	C	.	.			trans	46.8	41.1	-169.7	-62.7	0	0	0	0	112	M399 R465 A466	M399-S404 PolarHBondContact O-N 3.47Å; S404-R465 CarbonylContact O-C 3.57Å; S404-A466 WeakPolarHBondContact O-CB 3.49Å; S404-A466 PolarHBondContact O-N 3.47Å
405	M	94.4	Very high	95.5	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	146	-173.9	-166.8	-166.7	-61.1	0	0	110.7	F216 A301 L305 M399 H400 W403 A463 S464	F216-M405 HydrophobicContact CB-CE 3.83Å; F216-M405 HydrophobicContact CD1-CE 3.77Å; F216-M405 HydrophobicContact CD1-CG 3.96Å; F216-M405 HydrophobicContact CD1-SD 4.27Å; F216-M405 HydrophobicContact CE1-CE 4.47Å; F216-M405 HydrophobicContact CE1-CG 4.06Å; F216-M405 HydrophobicContact CE1-SD 4.43Å; F216-M405 HydrophobicContact CG-CE 3.81Å; A301-M405 HydrophobicContact CB-CE 4Å; A301-M405 HydrophobicContact CB-SD 3.81Å; L305-M405 HydrophobicContact CD1-CE 4.11Å; L305-M405 HydrophobicContact CD1-SD 3.76Å; L305-M405 HydrophobicContact CD2-CE 3.98Å; L305-M405 HydrophobicContact CD2-SD 4.27Å; L305-M405 HydrophobicContact CG-CE 4.01Å; L305-M405 HydrophobicContact CG-SD 4.28Å; M399-M405 CarbonylContact C-O 3.6Å; M399-M405 HydrophobicContact CB-CB 4.45Å; M399-M405 HydrophobicContact CE-CG 4.16Å; M399-M405 HydrophobicContact CE-SD 3.9Å; M399-M405 PolarHBondContact O-N 3.05Å; H400-M405 PolarHBondContact CD2-O 2.84Å; W403-M405 HydrophobicContact CB-CB 3.99Å; W403-M405 HydrophobicContact CB-CE 4.28Å; W403-M405 PolarHBondContact O-N 2.95Å; M405-A463 HydrophobicContact SD-CB 4.26Å; M405-S464 WeakPolarHBondContact CA-O 3.41Å; M405-S464 WeakPolarHBondContact CG-O 3.31Å
406	V	95	Very high	95.5	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	141.6	177.7	173.5	0	0	0	0	108.6	A463 S464 A466 A494 T495 D498	V406-A463 CarbonylContact O-C 3.6Å; V406-A463 VanDerWaalsContact O-CA 3.25Å; V406-A463 WeakPolarHBondContact O-CA 3.2Å; V406-S464 PolarHBondContact N-O 3.32Å; V406-S464 PolarHBondContact O-N 3.44Å; V406-A466 HydrophobicContact CG2-CB 3.97Å; V406-A494 HydrophobicContact CG1-CB 4.41Å; V406-A494 WeakPolarHBondContact CG1-O 3.49Å; V406-A494 HydrophobicContact CG2-CB 3.89Å; V406-T495 HydrophobicContact CG2-CG2 3.86Å; V406-D498 WeakPolarHBondContact CG1-OD2 3.21Å
407	H	95.7	Very high	95.5	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.121	C	C	.	.			trans	-78.6	-41.1	-177.2	-169.9	-93.7	0	0	0	112.8	L396 M399 D409 V410 L457 S458 F460 R462 A463 D498	L396-H407 HydrophobicContact CD2-CB 4.29Å; M399-H407 HydrophobicContact CE-CB 3.8Å; M399-H407 HydrophobicContact SD-CB 4.42Å; H407-D409 PolarHBondContact CE1-O 3.32Å; H407-D409 PolarHBondContact ND1-N 2.92Å; H407-D409 PolarHBondContact ND1-O 2.86Å; H407-D409 PolarHBondContact O-N 3.03Å; H407-D409 VanDerWaalsContact O-N 3.14Å; H407-V410 HydrophobicContact CB-CG2 3.82Å; H407-L457 HydrophobicContact CB-CD2 4.26Å; H407-S458 PolarHBondContact CE1-O 3.02Å; H407-S458 PolarHBondContact NE2-O 2.93Å; H407-F460 AromaticContact CD2-CD1 3.74Å; H407-F460 AromaticContact CD2-CE1 3.54Å; H407-F460 AromaticContact CD2-CZ 3.84Å; H407-R462 CarbonylContact O-C 3.53Å; H407-A463 PolarHBondContact O-N 3.03Å; H407-D498 PolarHBondContact N-OD1 2.84Å; H407-D498 PolarHBondContact N-OD2 3.26Å
408	G	93.4	Very high	95.5	Very high	11 Å²	11	20.8 Å²	20.8	11%	0.113	11%	0.111	C	C	.	.	S	Bend	trans	83.1	-33.5	177.1	0	0	0	0	0	114.7	L475 D498	G408-L475 VanDerWaalsContact O-O 3.1Å; G408-D498 PolarHBondContact N-OD1 2.84Å
409	D	93.7	Very high	95.3	Very high	15 Å²	15	19.9 Å²	19.9	8%	0.08	11%	0.109	C	C	.	.			trans	-132.3	59	-174.1	-160.9	31.7	0	0	0	112.6	H407 K411 N414 R462 D477	H407-D409 PolarHBondContact CE1-O 3.32Å; H407-D409 PolarHBondContact ND1-N 2.92Å; H407-D409 PolarHBondContact ND1-O 2.86Å; H407-D409 PolarHBondContact O-N 3.03Å; H407-D409 VanDerWaalsContact O-N 3.14Å; D409-K411 PolarHBondContact O-N 3.37Å; D409-K411 WeakPolarHBondContact OD1-CE 3.47Å; D409-K411 IonicContact OD1-NZ 3Å; D409-K411 PolarHBondContact OD1-NZ 2.98Å; D409-K411 WeakPolarHBondContact OD2-CE 3.48Å; D409-K411 IonicContact OD2-NZ 2.72Å; D409-K411 PolarHBondContact OD2-NZ 2.8Å; D409-N414 VanDerWaalsContact CG-ND2 3.33Å; D409-N414 PolarHBondContact O-ND2 3.24Å; D409-N414 PolarHBondContact OD2-ND2 3.41Å; D409-R462 HydrophobicContact CB-CB 4.34Å; D409-D477 WeakPolarHBondContact OD1-CB 3.5Å; D409-D477 PolarHBondContact OD1-N 2.92Å
410	V	97.2	Very high	95	Very high	1 Å²	1	21.5 Å²	21.5	1%	0.006	12%	0.12	C	C	.	.			trans	-81.5	104.7	179.9	-177	0	0	0	0	110.7	I392 L396 H407 L457 D498 A501 L502 T505	I392-V410 HydrophobicContact CG2-CG1 4.17Å; L396-V410 HydrophobicContact CD2-CG2 4.15Å; H407-V410 HydrophobicContact CB-CG2 3.82Å; V410-L457 HydrophobicContact CG1-CD1 4.4Å; V410-L457 HydrophobicContact CG2-CD1 4.43Å; V410-D498 HydrophobicContact CG2-CB 4.02Å; V410-A501 HydrophobicContact CB-CB 4Å; V410-A501 WeakPolarHBondContact O-CB 3.45Å; V410-L502 HydrophobicContact CG1-CB 4.37Å; V410-T505 PolarHBondContact O-OG1 3.31Å
411	K	95.8	Very high	94.6	Very high	24 Å²	24	27.5 Å²	27.5	10%	0.104	14%	0.142	C	C	.	.	S	Bend	trans	-154.1	165.2	-176.7	61.3	-177.3	-179.1	-149.7	0	113	D409 S413 N414 I415 D477 Y480 T505	D409-K411 PolarHBondContact O-N 3.37Å; D409-K411 WeakPolarHBondContact OD1-CE 3.47Å; D409-K411 IonicContact OD1-NZ 3Å; D409-K411 PolarHBondContact OD1-NZ 2.98Å; D409-K411 WeakPolarHBondContact OD2-CE 3.48Å; D409-K411 IonicContact OD2-NZ 2.72Å; D409-K411 PolarHBondContact OD2-NZ 2.8Å; K411-S413 VanDerWaalsContact C-N 3.28Å; K411-S413 WeakPolarHBondContact CD-OG 3.23Å; K411-S413 WeakPolarHBondContact CE-OG 3.25Å; K411-S413 WeakPolarHBondContact CG-OG 3.39Å; K411-S413 PolarHBondContact O-N 3.11Å; K411-N414 HydrophobicContact CG-CB 4.04Å; K411-N414 CarbonylContact O-C 3.55Å; K411-N414 PolarHBondContact O-N 3.02Å; K411-I415 WeakPolarHBondContact O-CG1 3.47Å; K411-I415 PolarHBondContact O-N 2.94Å; K411-D477 HydrophobicContact CD-CB 3.9Å; K411-D477 IonicContact NZ-OD2 3.13Å; K411-D477 PolarHBondContact NZ-OD2 2.94Å; K411-Y480 HydrophobicContact CB-CD1 4.01Å; K411-Y480 HydrophobicContact CB-CD2 3.78Å; K411-Y480 HydrophobicContact CB-CE1 3.94Å; K411-Y480 HydrophobicContact CB-CE2 3.67Å; K411-Y480 HydrophobicContact CB-CG 3.96Å; K411-Y480 HydrophobicContact CD-CD2 4.18Å; K411-Y480 HydrophobicContact CD-CE2 4.03Å; K411-Y480 HydrophobicContact CG-CE2 4.5Å; K411-T505 WeakPolarHBondContact CA-OG1 3.48Å
412	P	96.7	Very high	94.2	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-28.7	-178.4	-28.4	36.4	0	0	0	116.4	L335 F336 L339 N414 Y480 T505	L335-P412 CarbonylContact C-O 3.2Å; L335-P412 HydrophobicContact CB-CB 4.25Å; L335-P412 WeakPolarHBondContact CB-O 3.3Å; L335-P412 HydrophobicContact CD2-CB 4.29Å; L335-P412 HydrophobicContact CG-CB 4.08Å; L335-P412 PolarHBondContact N-O 3.46Å; F336-P412 HydrophobicContact CB-CB 4.17Å; F336-P412 PolarHBondContact N-O 3.3Å; L339-P412 HydrophobicContact CD1-CB 4.2Å; L339-P412 HydrophobicContact CD1-CG 4.32Å; P412-N414 VanDerWaalsContact C-N 3.32Å; P412-Y480 WeakPolarHBondContact CD-OH 3.47Å; P412-Y480 HydrophobicContact CG-CE1 4.39Å; P412-T505 HydrophobicContact CG-CG2 4.18Å
413	S	94	Very high	93.8	Very high	26 Å²	26	28 Å²	28	18%	0.182	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-34.2	174.1	30.2	0	0	0	0	112.1	S334 D346 K411	S334-S413 WeakPolarHBondContact CB-O 3.48Å; D346-S413 VanDerWaalsContact OD2-CB 3.27Å; D346-S413 WeakPolarHBondContact OD2-CB 3.47Å; D346-S413 PolarHBondContact OD2-OG 2.84Å; K411-S413 VanDerWaalsContact C-N 3.28Å; K411-S413 WeakPolarHBondContact CD-OG 3.23Å; K411-S413 WeakPolarHBondContact CE-OG 3.25Å; K411-S413 WeakPolarHBondContact CG-OG 3.39Å; K411-S413 PolarHBondContact O-N 3.11Å
414	N	96.1	Very high	93.3	Very high	10 Å²	10	25.1 Å²	25.1	5%	0.053	13%	0.134	C	C	.	.	S	Bend	trans	-92.1	3.5	-177.1	-66.7	8.3	0	0	0	112.9	D409 K411 P412 S458	D409-N414 VanDerWaalsContact CG-ND2 3.33Å; D409-N414 PolarHBondContact O-ND2 3.24Å; D409-N414 PolarHBondContact OD2-ND2 3.41Å; K411-N414 HydrophobicContact CG-CB 4.04Å; K411-N414 CarbonylContact O-C 3.55Å; K411-N414 PolarHBondContact O-N 3.02Å; P412-N414 VanDerWaalsContact C-N 3.32Å; N414-S458 VanDerWaalsContact C-OG 3.3Å; N414-S458 WeakPolarHBondContact CB-O 3.31Å; N414-S458 PolarHBondContact O-N 2.94Å; N414-S458 PolarHBondContact O-OG 3.21Å
415	I	98.4	Very high	92.8	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	120.4	174	-66.8	164.5	0	0	0	109.1	S334 L335 L388 I392 K411 F455 K456 L457 T505	S334-I415 CarbonylContact C-O 3.44Å; S334-I415 VanDerWaalsContact CA-O 3.28Å; S334-I415 WeakPolarHBondContact CA-O 3.41Å; L335-I415 HydrophobicContact CB-CB 4.31Å; L335-I415 HydrophobicContact CB-CG2 4.26Å; L335-I415 HydrophobicContact CD2-CB 4.47Å; L335-I415 HydrophobicContact CD2-CG2 4.25Å; L335-I415 PolarHBondContact N-O 3.34Å; L388-I415 HydrophobicContact CD1-CD1 4.39Å; L388-I415 HydrophobicContact CD1-CG2 3.94Å; I392-I415 HydrophobicContact CD1-CD1 4.14Å; I392-I415 HydrophobicContact CD1-CG1 3.9Å; I392-I415 HydrophobicContact CD1-CG2 4.09Å; I392-I415 HydrophobicContact CG1-CD1 4.03Å; I392-I415 HydrophobicContact CG1-CG1 4.35Å; K411-I415 WeakPolarHBondContact O-CG1 3.47Å; K411-I415 PolarHBondContact O-N 2.94Å; I415-F455 HydrophobicContact CG2-CB 4.3Å; I415-F455 HydrophobicContact CG2-CD1 4.04Å; I415-K456 CarbonylContact C-O 3.45Å; I415-K456 WeakPolarHBondContact CA-O 3.4Å; I415-L457 HydrophobicContact CG1-CD1 4.29Å; I415-T505 HydrophobicContact CD1-CG2 3.67Å
416	L	98	Very high	92.3	Very high	35 Å²	35	34.3 Å²	34.3	18%	0.183	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	148.5	-177.7	-58.3	177.1	0	0	0	111.9	I311 C330 G333 F455 K456 S458	I311-L416 HydrophobicContact CD1-CD1 3.79Å; I311-L416 HydrophobicContact CG1-CD1 4.19Å; C330-L416 HydrophobicContact CB-CB 3.66Å; C330-L416 HydrophobicContact CB-CD1 4.14Å; C330-L416 HydrophobicContact CB-CG 4.4Å; G333-L416 WeakPolarHBondContact O-CA 3.5Å; L416-F455 CarbonylContact O-C 3.6Å; L416-F455 WeakPolarHBondContact O-CA 3.35Å; L416-K456 HydrophobicContact CB-CB 4.43Å; L416-K456 PolarHBondContact N-O 2.89Å; L416-K456 PolarHBondContact O-N 3.47Å; L416-S458 WeakPolarHBondContact CG-OG 3.49Å
417	I	97.9	Very high	91.5	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	125.9	-178.3	-59.2	166.3	0	0	0	108.7	C330 G332 G333 L338 C441 L445 I453 F455	C330-I417 CarbonylContact C-O 3.57Å; C330-I417 WeakPolarHBondContact CB-O 3.35Å; G332-I417 WeakPolarHBondContact CA-O 3.35Å; G332-I417 PolarHBondContact N-O 3.45Å; G333-I417 PolarHBondContact O-N 3.36Å; L338-I417 HydrophobicContact CB-CD1 3.97Å; L338-I417 HydrophobicContact CD2-CD1 3.77Å; L338-I417 HydrophobicContact CG-CD1 4.49Å; I417-C441 HydrophobicContact CG2-CB 4Å; I417-L445 HydrophobicContact CD1-CD1 3.99Å; I417-L445 HydrophobicContact CG1-CD1 4.44Å; I417-L445 HydrophobicContact CG2-CD1 3.9Å; I417-I453 HydrophobicContact CG2-CG2 4.02Å; I417-F455 HydrophobicContact CD1-CE1 4.46Å; I417-F455 HydrophobicContact CG1-CD1 4.04Å; I417-F455 HydrophobicContact CG1-CE1 3.82Å
418	Q	95.9	Very high	90.6	Very high	9 Å²	9	35.2 Å²	35.2	4%	0.042	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	152.7	-176.2	-176.5	63.1	-54.5	0	0	111.1	E328 L329 C330 V454 K456	E328-Q418 WeakPolarHBondContact OE1-CG 3.09Å; E328-Q418 PolarHBondContact OE1-NE2 3.3Å; L329-Q418 PolarHBondContact O-NE2 3.45Å; C330-Q418 HydrophobicContact CB-CB 4.4Å; Q418-V454 PolarHBondContact N-O 2.87Å; Q418-V454 PolarHBondContact O-N 2.93Å; Q418-K456 HydrophobicContact CB-CD 4.13Å; Q418-K456 HydrophobicContact CG-CD 4.38Å
419	L	93.1	Very high	89.8	Confident	17 Å²	17	37.6 Å²	37.6	9%	0.089	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	157.4	170.2	-71.4	174.1	0	0	0	111.6	L331 E423 A424 A437 C441 G452 I453	L331-L419 HydrophobicContact CD1-CD1 4.1Å; L419-E423 HydrophobicContact CB-CB 4.12Å; L419-E423 HydrophobicContact CD1-CB 4.15Å; L419-A424 HydrophobicContact CB-CB 4.07Å; L419-A437 HydrophobicContact CD1-CB 3.85Å; L419-C441 VanDerWaalsContact CD2-SG 3.52Å; L419-G452 CarbonylContact C-O 3.51Å; L419-G452 WeakPolarHBondContact CA-O 3.46Å; L419-I453 HydrophobicContact CD2-CD1 4.17Å
420	S	91.6	Very high	89	Confident	34 Å²	34	43.3 Å²	43.3	24%	0.238	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-56.7	165.2	164.8	47.4	0	0	0	0	112.2	E423 A424 G452	S420-E423 WeakPolarHBondContact CB-OE2 3.42Å; S420-E423 PolarHBondContact O-N 3.5Å; S420-E423 VanDerWaalsContact O-N 3.13Å; S420-E423 PolarHBondContact OG-OE2 3.5Å; S420-A424 PolarHBondContact O-N 2.86Å; S420-G452 PolarHBondContact N-O 2.96Å; S420-G452 WeakPolarHBondContact OG-CA 3.49Å
421	R	85.7	Confident	88.1	Confident	149 Å²	149	46.2 Å²	46.2	56%	0.562	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.9	138.3	163.6	-68.5	179	-178.5	170.2	4.4	107.7	Y425	R421-Y425 HydrophobicContact CG-CD2 4.27Å; R421-Y425 HydrophobicContact CG-CE2 4.11Å; R421-Y425 VanDerWaalsContact CZ-OH 3.29Å; R421-Y425 PolarHBondContact NH2-OH 2.91Å
422	P	85.6	Confident	87.4	Confident	76 Å²	76	48.8 Å²	48.8	49%	0.494	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	cis	-82.9	-10.4	12	32.6	-38.1	0	0	0	116.8	A424 Y425 L426	P422-A424 VanDerWaalsContact C-N 3.34Å; P422-A424 PolarHBondContact O-N 3.39Å; P422-Y425 PolarHBondContact O-N 2.94Å; P422-L426 PolarHBondContact O-N 3.45Å
423	E	84.6	Confident	86.7	Confident	77 Å²	77	52.3 Å²	52.3	36%	0.36	28%	0.276	S	S	.	.	H	α-helix	trans	-56	-42.9	-165	-63.2	64.5	-133.7	0	0	113.3	L419 S420 Y425 L426 A427	L419-E423 HydrophobicContact CB-CB 4.12Å; L419-E423 HydrophobicContact CD1-CB 4.15Å; S420-E423 WeakPolarHBondContact CB-OE2 3.42Å; S420-E423 PolarHBondContact O-N 3.5Å; S420-E423 VanDerWaalsContact O-N 3.13Å; S420-E423 PolarHBondContact OG-OE2 3.5Å; E423-Y425 VanDerWaalsContact C-N 3.27Å; E423-Y425 PolarHBondContact O-N 3.38Å; E423-L426 PolarHBondContact O-N 3.43Å; E423-A427 PolarHBondContact O-N 3.09Å
424	A	82.5	Confident	86.4	Confident	8 Å²	8	52.4 Å²	52.4	7%	0.066	27%	0.273	C	S	.	.	H	α-helix	trans	-59.3	-33.8	179.1	0	0	0	0	0	113.8	L331 L419 S420 P422 S428	L331-A424 HydrophobicContact CD1-CB 4.09Å; L419-A424 HydrophobicContact CB-CB 4.07Å; S420-A424 PolarHBondContact O-N 2.86Å; P422-A424 VanDerWaalsContact C-N 3.34Å; P422-A424 PolarHBondContact O-N 3.39Å; A424-S428 WeakPolarHBondContact O-CB 3.48Å; A424-S428 PolarHBondContact O-N 3.44Å; A424-S428 PolarHBondContact O-OG 2.91Å
425	Y	83.5	Confident	85.8	Confident	113 Å²	113	57.9 Å²	57.9	44%	0.443	30%	0.3	S	S	.	.	H	α-helix	trans	-76.5	-37.5	176.9	-72.8	-49.9	0	0	0	112.1	R421 P422 E423 S428 A429	R421-Y425 HydrophobicContact CG-CD2 4.27Å; R421-Y425 HydrophobicContact CG-CE2 4.11Å; R421-Y425 VanDerWaalsContact CZ-OH 3.29Å; R421-Y425 PolarHBondContact NH2-OH 2.91Å; P422-Y425 PolarHBondContact O-N 2.94Å; E423-Y425 VanDerWaalsContact C-N 3.27Å; E423-Y425 PolarHBondContact O-N 3.38Å; Y425-S428 PolarHBondContact O-N 2.88Å; Y425-A429 PolarHBondContact O-N 3.27Å
426	L	83.7	Confident	85.3	Confident	116 Å²	116	62.3 Å²	62.3	61%	0.607	32%	0.324	S	S	*	.	H	α-helix	trans	-64.7	-42.7	176	-63.1	174.7	0	0	0	111.2	P422 E423 S428 A429	P422-L426 PolarHBondContact O-N 3.45Å; E423-L426 PolarHBondContact O-N 3.43Å; L426-S428 VanDerWaalsContact C-N 3.29Å; L426-S428 PolarHBondContact O-N 3.17Å; L426-A429 VanDerWaalsContact O-CB 3.29Å; L426-A429 WeakPolarHBondContact O-CB 3.27Å; L426-A429 PolarHBondContact O-N 3.49Å
427	A	78.8	Confident	85	Confident	5 Å²	5	61 Å²	61	4%	0.041	32%	0.318	C	S	.	.	H	α-helix	trans	-63.2	-33.5	174	0	0	0	0	0	113.1	L331 E423 A429 I433 E434 A437	L331-A427 HydrophobicContact CD1-CB 3.57Å; E423-A427 PolarHBondContact O-N 3.09Å; A427-A429 PolarHBondContact O-N 2.82Å; A427-I433 HydrophobicContact CB-CG2 4.29Å; A427-E434 PolarHBondContact O-N 2.73Å; A427-A437 HydrophobicContact CB-CB 3.62Å
428	S	75.4	Confident	84.7	Confident	13 Å²	13	65.5 Å²	65.5	9%	0.091	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-11.4	177.7	-61.8	0	0	0	0	114.2	R265 A424 Y425 L426	R265-S428 PolarHBondContact NH1-O 3.2Å; R265-S428 PolarHBondContact NH2-O 2.92Å; A424-S428 WeakPolarHBondContact O-CB 3.48Å; A424-S428 PolarHBondContact O-N 3.44Å; A424-S428 PolarHBondContact O-OG 2.91Å; Y425-S428 PolarHBondContact O-N 2.88Å; L426-S428 VanDerWaalsContact C-N 3.29Å; L426-S428 PolarHBondContact O-N 3.17Å
429	A	77.2	Confident	84.6	Confident	62 Å²	62	73.4 Å²	73.4	51%	0.512	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-30.8	-174.4	0	0	0	0	0	114	Y425 L426 A427	Y425-A429 PolarHBondContact O-N 3.27Å; L426-A429 VanDerWaalsContact O-CB 3.29Å; L426-A429 WeakPolarHBondContact O-CB 3.27Å; L426-A429 PolarHBondContact O-N 3.49Å; A427-A429 PolarHBondContact O-N 2.82Å
430	K	78.1	Confident	84.6	Confident	135 Å²	135	77.3 Å²	77.3	59%	0.587	38%	0.384	S	S	*	.	S	Bend	trans	-147	139.6	179.1	-61.4	-177.2	-176.8	178.5	0	111.1	C432 I433 E434	K430-C432 VanDerWaalsContact C-N 3.25Å; K430-C432 PolarHBondContact O-N 2.99Å; K430-C432 VanDerWaalsContact O-N 3.15Å; K430-I433 HydrophobicContact CB-CD1 3.93Å; K430-I433 HydrophobicContact CB-CG1 4.05Å; K430-I433 HydrophobicContact CD-CD1 4.29Å; K430-I433 HydrophobicContact CG-CD1 4.28Å; K430-I433 PolarHBondContact O-N 2.83Å; K430-E434 PolarHBondContact O-N 2.98Å; K430-E434 VanDerWaalsContact O-N 3.16Å
431	D	77.6	Confident	84.7	Confident	62 Å²	62	75.7 Å²	75.7	33%	0.332	37%	0.373	S	S	.	.	H	α-helix	trans	-62.1	-28	-170.4	-57.5	19.9	0	0	0	113.4	R265 M435	R265-D431 IonicContact CZ-OD1 2.97Å; R265-D431 IonicContact NH2-OD1 2.73Å; R265-D431 PolarHBondContact NH2-OD1 3.13Å; D431-M435 PolarHBondContact O-N 2.73Å
432	C	81.4	Confident	85.2	Confident	78 Å²	78	70.1 Å²	70.1	53%	0.527	35%	0.353	S	S	.	.	H	α-helix	trans	-67.4	-40.1	170.8	51.7	0	0	0	0	113.1	K430 E434 M435 D436	K430-C432 VanDerWaalsContact C-N 3.25Å; K430-C432 PolarHBondContact O-N 2.99Å; K430-C432 VanDerWaalsContact O-N 3.15Å; C432-E434 VanDerWaalsContact C-N 3.32Å; C432-E434 PolarHBondContact O-N 3.01Å; C432-M435 PolarHBondContact O-N 2.94Å; C432-D436 PolarHBondContact O-N 3.41Å
433	I	82.4	Confident	85.7	Confident	74 Å²	74	73.9 Å²	73.9	38%	0.379	36%	0.362	S	S	.	.	H	α-helix	trans	-71.6	-31	-180	-44.2	172.4	0	0	0	110.2	A427 K430 A437	A427-I433 HydrophobicContact CB-CG2 4.29Å; K430-I433 HydrophobicContact CB-CD1 3.93Å; K430-I433 HydrophobicContact CB-CG1 4.05Å; K430-I433 HydrophobicContact CD-CD1 4.29Å; K430-I433 HydrophobicContact CG-CD1 4.28Å; K430-I433 PolarHBondContact O-N 2.83Å; I433-A437 WeakPolarHBondContact O-CB 3.43Å; I433-A437 PolarHBondContact O-N 3.03Å
434	E	85.8	Confident	86.2	Confident	28 Å²	28	72 Å²	72	13%	0.131	35%	0.354	C	S	.	.	H	α-helix	trans	-62.3	-48.1	169.6	178.8	-136.7	126.9	0	0	111.8	K263 L331 A427 K430 C432 D436 A437 K438	K263-E434 WeakPolarHBondContact CD-OE2 3.43Å; K263-E434 WeakPolarHBondContact CE-OE2 3.39Å; K263-E434 IonicContact NZ-OE1 2.66Å; K263-E434 PolarHBondContact NZ-OE1 2.86Å; K263-E434 IonicContact NZ-OE2 2.65Å; K263-E434 PolarHBondContact NZ-OE2 2.89Å; L331-E434 HydrophobicContact CD2-CB 4.3Å; L331-E434 HydrophobicContact CD2-CG 3.65Å; A427-E434 PolarHBondContact O-N 2.73Å; K430-E434 PolarHBondContact O-N 2.98Å; K430-E434 VanDerWaalsContact O-N 3.16Å; C432-E434 VanDerWaalsContact C-N 3.32Å; C432-E434 PolarHBondContact O-N 3.01Å; E434-D436 VanDerWaalsContact C-N 3.33Å; E434-D436 PolarHBondContact O-N 3.27Å; E434-A437 WeakPolarHBondContact O-CB 3.12Å; E434-A437 PolarHBondContact O-N 2.89Å; E434-K438 PolarHBondContact O-N 2.98Å
435	M	85	Confident	86.9	Confident	125 Å²	125	71.6 Å²	71.6	62%	0.616	35%	0.351	S	S	*	.	H	α-helix	trans	-62.1	-40.4	177.1	-70.8	-171.3	73.1	0	0	112.3	D431 C432 K438 R439	D431-M435 PolarHBondContact O-N 2.73Å; C432-M435 PolarHBondContact O-N 2.94Å; M435-K438 PolarHBondContact O-N 3.34Å; M435-R439 PolarHBondContact O-N 3.37Å; M435-R439 VanDerWaalsContact O-N 3.13Å
436	D	87.9	Confident	87.5	Confident	93 Å²	93	69.7 Å²	69.7	50%	0.497	35%	0.348	S	S	.	.	H	α-helix	trans	-69.5	-35.2	175.3	-74.6	-29.5	0	0	0	112.2	C432 E434 R439 H440	C432-D436 PolarHBondContact O-N 3.41Å; E434-D436 VanDerWaalsContact C-N 3.33Å; E434-D436 PolarHBondContact O-N 3.27Å; D436-R439 PolarHBondContact O-N 3.04Å; D436-R439 IonicContact OD1-NE 3.24Å; D436-H440 VanDerWaalsContact O-CB 3.25Å; D436-H440 WeakPolarHBondContact O-CB 3.14Å; D436-H440 PolarHBondContact O-N 3.25Å
437	A	90.9	Very high	88.2	Confident	7 Å²	7	68.2 Å²	68.2	6%	0.058	35%	0.353	C	S	.	.	H	α-helix	trans	-63.5	-43	172.7	0	0	0	0	0	112.2	L331 L419 A427 I433 E434 R439 H440 C441	L331-A437 HydrophobicContact CB-CB 4.37Å; L331-A437 HydrophobicContact CD1-CB 4.16Å; L419-A437 HydrophobicContact CD1-CB 3.85Å; A427-A437 HydrophobicContact CB-CB 3.62Å; I433-A437 WeakPolarHBondContact O-CB 3.43Å; I433-A437 PolarHBondContact O-N 3.03Å; E434-A437 WeakPolarHBondContact O-CB 3.12Å; E434-A437 PolarHBondContact O-N 2.89Å; A437-R439 VanDerWaalsContact C-N 3.34Å; A437-R439 PolarHBondContact O-N 3.46Å; A437-H440 WeakPolarHBondContact O-CB 3.38Å; A437-H440 PolarHBondContact O-N 3.15Å; A437-C441 PolarHBondContact O-N 3.46Å; A437-C441 PolarHBondContact O-SG 2.77Å; A437-C441 VanDerWaalsContact O-SG 3.33Å
438	K	92.5	Very high	89	Confident	94 Å²	94	68.8 Å²	68.8	41%	0.409	36%	0.359	S	S	.	.	H	α-helix	trans	-56.9	-49.1	172.8	-173.8	174.9	179.1	-179.2	0	111	L331 E434 M435 H440 C441 H442	L331-K438 WeakPolarHBondContact O-CA 3.41Å; L331-K438 WeakPolarHBondContact O-CB 3.11Å; L331-K438 WeakPolarHBondContact O-CG 3.45Å; E434-K438 PolarHBondContact O-N 2.98Å; M435-K438 PolarHBondContact O-N 3.34Å; K438-H440 VanDerWaalsContact C-N 3.3Å; K438-H440 PolarHBondContact O-N 3.25Å; K438-C441 PolarHBondContact O-N 3.07Å; K438-H442 PolarHBondContact O-CD2 3.16Å; K438-H442 PolarHBondContact O-N 2.9Å; K438-H442 VanDerWaalsContact O-N 3.16Å
439	R	92.6	Very high	90	Very high	175 Å²	175	70.6 Å²	70.6	66%	0.66	37%	0.367	S	S	*	.	H	α-helix	trans	-61.4	-38.1	177.2	-164.3	-164.9	-57.4	-107.7	3.3	111.8	M435 D436 A437 K443	M435-R439 PolarHBondContact O-N 3.37Å; M435-R439 VanDerWaalsContact O-N 3.13Å; D436-R439 PolarHBondContact O-N 3.04Å; D436-R439 IonicContact OD1-NE 3.24Å; A437-R439 VanDerWaalsContact C-N 3.34Å; A437-R439 PolarHBondContact O-N 3.46Å; R439-K443 VanDerWaalsContact O-CB 3.29Å; R439-K443 WeakPolarHBondContact O-CB 3.28Å; R439-K443 PolarHBondContact O-N 2.84Å
440	H	92.8	Very high	90.8	Very high	99 Å²	99	68 Å²	68	46%	0.458	35%	0.346	S	S	.	.	H	α-helix	trans	-67.4	-48.2	179	-173	72.1	0	0	0	112	D436 A437 K438 H442 K443 L444	D436-H440 VanDerWaalsContact O-CB 3.25Å; D436-H440 WeakPolarHBondContact O-CB 3.14Å; D436-H440 PolarHBondContact O-N 3.25Å; A437-H440 WeakPolarHBondContact O-CB 3.38Å; A437-H440 PolarHBondContact O-N 3.15Å; K438-H440 VanDerWaalsContact C-N 3.3Å; K438-H440 PolarHBondContact O-N 3.25Å; H440-H442 VanDerWaalsContact C-N 3.31Å; H440-H442 PolarHBondContact O-N 2.84Å; H440-K443 PolarHBondContact O-N 3.21Å; H440-L444 WeakPolarHBondContact O-CG 3.46Å; H440-L444 PolarHBondContact O-N 2.72Å
441	C	95.2	Very high	91.5	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-53.7	-48	173.6	-69.9	0	0	0	0	111.9	I417 L419 A437 K438 L445 I453	I417-C441 HydrophobicContact CG2-CB 4Å; L419-C441 VanDerWaalsContact CD2-SG 3.52Å; A437-C441 PolarHBondContact O-N 3.46Å; A437-C441 PolarHBondContact O-SG 2.77Å; A437-C441 VanDerWaalsContact O-SG 3.33Å; K438-C441 PolarHBondContact O-N 3.07Å; C441-L445 WeakPolarHBondContact O-CG 3.49Å; C441-L445 PolarHBondContact O-N 3.07Å; C441-L445 VanDerWaalsContact O-N 3.17Å; C441-I453 HydrophobicContact CB-CD1 4.09Å
442	H	95.8	Very high	92.2	Very high	33 Å²	33	63 Å²	63	15%	0.153	34%	0.342	C	S	.	.	H	α-helix	trans	-64.6	-44.3	178.9	-75.9	-136.6	0	0	0	111.2	G332 L338 K438 H440 L444 L445 L446	G332-H442 PolarHBondContact O-NE2 2.87Å; L338-H442 HydrophobicContact CD1-CB 3.87Å; L338-H442 WeakPolarHBondContact CD1-ND1 3.5Å; K438-H442 PolarHBondContact O-CD2 3.16Å; K438-H442 PolarHBondContact O-N 2.9Å; K438-H442 VanDerWaalsContact O-N 3.16Å; H440-H442 VanDerWaalsContact C-N 3.31Å; H440-H442 PolarHBondContact O-N 2.84Å; H442-L444 PolarHBondContact O-N 3.31Å; H442-L445 PolarHBondContact O-N 3.23Å; H442-L446 WeakPolarHBondContact O-CB 3.48Å; H442-L446 VanDerWaalsContact O-CG 3.24Å; H442-L446 WeakPolarHBondContact O-CG 3.46Å; H442-L446 PolarHBondContact O-N 3.16Å
443	K	95.5	Very high	92.8	Very high	155 Å²	155	59.6 Å²	59.6	67%	0.674	32%	0.318	S	S	*	.	H	α-helix	trans	-61.6	-43.4	178.3	-175.5	-179.9	177.6	-176.5	0	112.8	R439 H440 A447	R439-K443 VanDerWaalsContact O-CB 3.29Å; R439-K443 WeakPolarHBondContact O-CB 3.28Å; R439-K443 PolarHBondContact O-N 2.84Å; H440-K443 PolarHBondContact O-N 3.21Å; K443-A447 WeakPolarHBondContact O-CB 3.23Å; K443-A447 PolarHBondContact O-N 3.47Å
444	L	96.1	Very high	93.5	Very high	36 Å²	36	57.5 Å²	57.5	19%	0.188	31%	0.309	C	S	.	.	H	α-helix	trans	-62.3	-52.7	177.5	-72.6	176.4	0	0	0	111.1	H440 H442 L446 A447 G448 D449 I453	H440-L444 WeakPolarHBondContact O-CG 3.46Å; H440-L444 PolarHBondContact O-N 2.72Å; H442-L444 PolarHBondContact O-N 3.31Å; L444-L446 VanDerWaalsContact C-N 3.34Å; L444-L446 PolarHBondContact O-N 3.12Å; L444-A447 CarbonylContact O-C 3.42Å; L444-A447 PolarHBondContact O-N 2.93Å; L444-A447 VanDerWaalsContact O-N 3.09Å; L444-G448 PolarHBondContact O-N 3.1Å; L444-G448 VanDerWaalsContact O-N 3.1Å; L444-D449 CarbonylContact C-O 3.57Å; L444-D449 HydrophobicContact CD2-CB 4.38Å; L444-D449 PolarHBondContact O-N 2.86Å; L444-D449 VanDerWaalsContact O-O 3.09Å; L444-I453 HydrophobicContact CD1-CD1 4.24Å
445	L	97.4	Very high	94.1	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-62.8	-38.2	-175.7	-70.4	170.3	0	0	0	112.8	L338 L380 P384 I417 C441 H442 G448 D449 A450 I453 F455	L338-L445 HydrophobicContact CD2-CB 3.93Å; L338-L445 HydrophobicContact CD2-CD1 3.58Å; L338-L445 HydrophobicContact CD2-CG 4.4Å; L380-L445 HydrophobicContact CD2-CB 3.99Å; P384-L445 HydrophobicContact CB-CD2 3.92Å; P384-L445 HydrophobicContact CG-CD2 4.3Å; I417-L445 HydrophobicContact CD1-CD1 3.99Å; I417-L445 HydrophobicContact CG1-CD1 4.44Å; I417-L445 HydrophobicContact CG2-CD1 3.9Å; C441-L445 WeakPolarHBondContact O-CG 3.49Å; C441-L445 PolarHBondContact O-N 3.07Å; C441-L445 VanDerWaalsContact O-N 3.17Å; H442-L445 PolarHBondContact O-N 3.23Å; L445-G448 PolarHBondContact O-N 3.03Å; L445-D449 WeakPolarHBondContact CA-O 3.25Å; L445-D449 PolarHBondContact N-O 2.88Å; L445-A450 HydrophobicContact CD2-CB 4.25Å; L445-I453 HydrophobicContact CD1-CG2 4.28Å; L445-I453 HydrophobicContact CD2-CG1 4.27Å; L445-I453 HydrophobicContact CD2-CG2 4.19Å; L445-I453 HydrophobicContact CG-CG1 4.33Å; L445-F455 HydrophobicContact CD1-CE1 4.42Å; L445-F455 HydrophobicContact CD1-CZ 4.22Å; L445-F455 HydrophobicContact CD2-CE2 4.4Å; L445-F455 HydrophobicContact CD2-CZ 3.82Å
446	L	96.4	Very high	94.8	Very high	74 Å²	74	51 Å²	51	39%	0.387	28%	0.277	S	S	.	.	H	α-helix	trans	-76	-26.5	175.8	-62.5	173.2	0	0	0	113	L338 N378 H442 L444 G448	L338-L446 HydrophobicContact CD1-CD1 4.17Å; L338-L446 HydrophobicContact CD1-CD2 4.17Å; L338-L446 HydrophobicContact CD1-CG 4.02Å; N378-L446 HydrophobicContact CB-CD2 3.79Å; H442-L446 WeakPolarHBondContact O-CB 3.48Å; H442-L446 VanDerWaalsContact O-CG 3.24Å; H442-L446 WeakPolarHBondContact O-CG 3.46Å; H442-L446 PolarHBondContact O-N 3.16Å; L444-L446 VanDerWaalsContact C-N 3.34Å; L444-L446 PolarHBondContact O-N 3.12Å; L446-G448 PolarHBondContact O-N 2.84Å
447	A	96.5	Very high	95.3	Very high	85 Å²	85	46.5 Å²	46.5	70%	0.702	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-4.5	168.8	0	0	0	0	0	113.2	K443 L444	K443-A447 WeakPolarHBondContact O-CB 3.23Å; K443-A447 PolarHBondContact O-N 3.47Å; L444-A447 CarbonylContact O-C 3.42Å; L444-A447 PolarHBondContact O-N 2.93Å; L444-A447 VanDerWaalsContact O-N 3.09Å
448	G	96.6	Very high	95.5	Very high	17 Å²	17	46.7 Å²	46.7	18%	0.175	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.3	16.4	-179.9	0	0	0	0	0	115.2	S381 P384 L444 L445 L446	S381-G448 WeakPolarHBondContact OG-CA 3.47Å; P384-G448 WeakPolarHBondContact CD-O 3.46Å; L444-G448 PolarHBondContact O-N 3.1Å; L444-G448 VanDerWaalsContact O-N 3.1Å; L445-G448 PolarHBondContact O-N 3.03Å; L446-G448 PolarHBondContact O-N 2.84Å
449	D	95.6	Very high	95.6	Very high	50 Å²	50	44.9 Å²	44.9	27%	0.267	25%	0.248	S	C	.	.			trans	-104.9	151.3	170.2	-161.6	11.3	0	0	0	112	K383 L444 L445 A451	K383-D449 WeakPolarHBondContact CE-OD1 3.19Å; K383-D449 IonicContact NZ-OD1 2.7Å; K383-D449 PolarHBondContact NZ-OD1 3.21Å; L444-D449 CarbonylContact C-O 3.57Å; L444-D449 HydrophobicContact CD2-CB 4.38Å; L444-D449 PolarHBondContact O-N 2.86Å; L444-D449 VanDerWaalsContact O-O 3.09Å; L445-D449 WeakPolarHBondContact CA-O 3.25Å; L445-D449 PolarHBondContact N-O 2.88Å; D449-A451 PolarHBondContact OD1-N 3.08Å
450	A	94.6	Very high	95.6	Very high	7 Å²	7	36.5 Å²	36.5	6%	0.058	22%	0.217	C	C	.	.			trans	-137.6	11.7	176.4	0	0	0	0	0	112	V387 L445 G452 I453	V387-A450 HydrophobicContact CB-CB 4.02Å; V387-A450 HydrophobicContact CG1-CB 4.1Å; V387-A450 HydrophobicContact CG2-CB 3.95Å; L445-A450 HydrophobicContact CD2-CB 4.25Å; A450-G452 PolarHBondContact O-N 3.35Å; A450-I453 PolarHBondContact O-N 3.02Å
451	A	92.1	Very high	95.5	Very high	57 Å²	57	32.1 Å²	32.1	47%	0.471	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	131	169.7	0	0	0	0	0	110.2	D449 I453	D449-A451 PolarHBondContact OD1-N 3.08Å; A451-I453 PolarHBondContact O-N 3.38Å
452	G	92.5	Very high	95.3	Very high	35 Å²	35	34.2 Å²	34.2	36%	0.361	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.1	6.6	-176	0	0	0	0	0	115.5	L419 S420 A450	L419-G452 CarbonylContact C-O 3.51Å; L419-G452 WeakPolarHBondContact CA-O 3.46Å; S420-G452 PolarHBondContact N-O 2.96Å; S420-G452 WeakPolarHBondContact OG-CA 3.49Å; A450-G452 PolarHBondContact O-N 3.35Å
453	I	95.7	Very high	95.1	Very high	7 Å²	7	32.6 Å²	32.6	4%	0.036	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	130.5	175.7	-55.6	-62.9	0	0	0	110.8	H391 I417 L419 C441 L444 L445 A450 A451 F455	H391-I453 PolarHBondContact CE1-O 3.39Å; I417-I453 HydrophobicContact CG2-CG2 4.02Å; L419-I453 HydrophobicContact CD2-CD1 4.17Å; C441-I453 HydrophobicContact CB-CD1 4.09Å; L444-I453 HydrophobicContact CD1-CD1 4.24Å; L445-I453 HydrophobicContact CD1-CG2 4.28Å; L445-I453 HydrophobicContact CD2-CG1 4.27Å; L445-I453 HydrophobicContact CD2-CG2 4.19Å; L445-I453 HydrophobicContact CG-CG1 4.33Å; A450-I453 PolarHBondContact O-N 3.02Å; A451-I453 PolarHBondContact O-N 3.38Å; I453-F455 HydrophobicContact CG2-CE2 4.25Å; I453-F455 HydrophobicContact CG2-CZ 4.31Å
454	V	96.8	Very high	95	Very high	31 Å²	31	25.4 Å²	25.4	19%	0.188	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	127.6	171.9	-174.5	0	0	0	0	108.7	N309 Q418 K456	N309-V454 WeakPolarHBondContact ND2-CG1 3.47Å; Q418-V454 PolarHBondContact N-O 2.87Å; Q418-V454 PolarHBondContact O-N 2.93Å; V454-K456 HydrophobicContact CG1-CG 4.36Å
455	F	98.2	Very high	94.7	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	140.9	169.2	-66.9	-78.7	0	0	0	109.6	N309 V387 L388 H391 I415 L416 I417 L445 I453	N309-F455 WeakPolarHBondContact CA-O 3.3Å; N309-F455 WeakPolarHBondContact CB-O 3.29Å; N309-F455 PolarHBondContact ND2-O 3.18Å; V387-F455 HydrophobicContact CG1-CD2 4.2Å; V387-F455 HydrophobicContact CG1-CE2 4.19Å; L388-F455 VanDerWaalsContact CA-CD2 3.48Å; L388-F455 HydrophobicContact CB-CD2 3.95Å; L388-F455 HydrophobicContact CB-CE2 3.76Å; L388-F455 HydrophobicContact CB-CG 4.48Å; L388-F455 HydrophobicContact CB-CZ 4.12Å; L388-F455 HydrophobicContact CD1-CB 4.21Å; L388-F455 HydrophobicContact CD1-CD1 3.77Å; L388-F455 HydrophobicContact CD1-CD2 4.12Å; L388-F455 HydrophobicContact CD1-CE1 4.08Å; L388-F455 HydrophobicContact CD1-CE2 4.43Å; L388-F455 HydrophobicContact CD1-CG 3.78Å; L388-F455 HydrophobicContact CD1-CZ 4.4Å; H391-F455 HydrophobicContact CB-CB 3.98Å; H391-F455 AromaticContact ND1-CD2 3.77Å; H391-F455 PolarHBondContact ND1-N 3.11Å; I415-F455 HydrophobicContact CG2-CB 4.3Å; I415-F455 HydrophobicContact CG2-CD1 4.04Å; L416-F455 CarbonylContact O-C 3.6Å; L416-F455 WeakPolarHBondContact O-CA 3.35Å; I417-F455 HydrophobicContact CD1-CE1 4.46Å; I417-F455 HydrophobicContact CG1-CD1 4.04Å; I417-F455 HydrophobicContact CG1-CE1 3.82Å; L445-F455 HydrophobicContact CD1-CE1 4.42Å; L445-F455 HydrophobicContact CD1-CZ 4.22Å; L445-F455 HydrophobicContact CD2-CE2 4.4Å; L445-F455 HydrophobicContact CD2-CZ 3.82Å; I453-F455 HydrophobicContact CG2-CE2 4.25Å; I453-F455 HydrophobicContact CG2-CZ 4.31Å
456	K	98.5	Very high	94.4	Very high	15 Å²	15	25 Å²	25	7%	0.065	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	128.6	-176.2	-80.4	167.1	168.2	-84.4	0	111.6	S308 N309 I310 E328 I415 L416 Q418 V454	S308-K456 VanDerWaalsContact O-CE 3.3Å; S308-K456 WeakPolarHBondContact O-CE 3.31Å; S308-K456 PolarHBondContact O-NZ 3.31Å; N309-K456 CarbonylContact O-C 3.59Å; N309-K456 WeakPolarHBondContact O-CA 3.21Å; I310-K456 PolarHBondContact O-NZ 3.39Å; E328-K456 VanDerWaalsContact OE1-CE 3.22Å; E328-K456 WeakPolarHBondContact OE1-CE 3.46Å; E328-K456 IonicContact OE1-NZ 3.33Å; E328-K456 VanDerWaalsContact OE2-CE 3.27Å; E328-K456 WeakPolarHBondContact OE2-CE 3.39Å; E328-K456 IonicContact OE2-NZ 3.09Å; E328-K456 PolarHBondContact OE2-NZ 2.9Å; I415-K456 CarbonylContact C-O 3.45Å; I415-K456 WeakPolarHBondContact CA-O 3.4Å; L416-K456 HydrophobicContact CB-CB 4.43Å; L416-K456 PolarHBondContact N-O 2.89Å; L416-K456 PolarHBondContact O-N 3.47Å; Q418-K456 HydrophobicContact CB-CD 4.13Å; Q418-K456 HydrophobicContact CG-CD 4.38Å; V454-K456 HydrophobicContact CG1-CG 4.36Å
457	L	98.5	Very high	93.8	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	142.1	172.2	-169.7	59.1	0	0	0	110.5	N309 I311 I392 A395 L396 M399 H407 V410 I415 F460	N309-L457 PolarHBondContact O-N 3.22Å; I311-L457 PolarHBondContact N-O 3.04Å; I392-L457 HydrophobicContact CD1-CB 4.24Å; A395-L457 HydrophobicContact CB-CB 4.26Å; A395-L457 HydrophobicContact CB-CD2 4.37Å; L396-L457 HydrophobicContact CD2-CD2 3.95Å; M399-L457 HydrophobicContact SD-CD2 4.03Å; H407-L457 HydrophobicContact CB-CD2 4.26Å; V410-L457 HydrophobicContact CG1-CD1 4.4Å; V410-L457 HydrophobicContact CG2-CD1 4.43Å; I415-L457 HydrophobicContact CG1-CD1 4.29Å; L457-F460 HydrophobicContact CG-CZ 4.33Å
458	S	96.5	Very high	93.1	Very high	10 Å²	10	19.2 Å²	19.2	7%	0.07	13%	0.126	C	C	.	.			trans	-154.2	170.4	-171.2	67.4	0	0	0	0	112.5	H407 N414 L416	H407-S458 PolarHBondContact CE1-O 3.02Å; H407-S458 PolarHBondContact NE2-O 2.93Å; N414-S458 VanDerWaalsContact C-OG 3.3Å; N414-S458 WeakPolarHBondContact CB-O 3.31Å; N414-S458 PolarHBondContact O-N 2.94Å; N414-S458 PolarHBondContact O-OG 3.21Å; L416-S458 WeakPolarHBondContact CG-OG 3.49Å
459	D	93.4	Very high	91.8	Very high	56 Å²	56	24.6 Å²	24.6	30%	0.299	15%	0.15	S	C	.	.			trans	64.6	69.5	-176.1	-152.2	1	0	0	0	114.2	K276 G461	K276-D459 IonicContact NZ-OD1 3.91Å; K276-D459 PolarHBondContact NZ-OD1 3.32Å; D459-G461 PolarHBondContact O-N 3.46Å
460	F	94.2	Very high	90.4	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-82.1	15.3	-174.9	-71.6	-103.5	0	0	0	113.5	E298 A301 L302 L305 I310 I311 M399 H407 L457 R462 A463	E298-F460 HydrophobicContact CB-CB 4.42Å; E298-F460 HydrophobicContact CG-CB 4.17Å; A301-F460 HydrophobicContact CB-CB 4.17Å; A301-F460 HydrophobicContact CB-CD1 4.32Å; L302-F460 HydrophobicContact CD1-CD2 4.41Å; L302-F460 HydrophobicContact CD2-CD2 3.48Å; L302-F460 VanDerWaalsContact CD2-CD2 3.48Å; L302-F460 HydrophobicContact CD2-CE2 3.68Å; L302-F460 HydrophobicContact CD2-CG 4.07Å; L302-F460 HydrophobicContact CD2-CZ 4.39Å; L302-F460 HydrophobicContact CG-CB 4.31Å; L302-F460 HydrophobicContact CG-CD2 3.95Å; L302-F460 HydrophobicContact CG-CG 4.21Å; L305-F460 HydrophobicContact CD1-CD1 3.57Å; L305-F460 HydrophobicContact CD1-CE1 3.21Å; L305-F460 HydrophobicContact CD1-CZ 3.92Å; I310-F460 HydrophobicContact CD1-CZ 4.39Å; I310-F460 HydrophobicContact CG1-CZ 4.38Å; I310-F460 HydrophobicContact CG2-CE2 3.93Å; I310-F460 HydrophobicContact CG2-CZ 3.67Å; I311-F460 HydrophobicContact CG2-CE2 4.15Å; M399-F460 HydrophobicContact CE-CD1 4.13Å; M399-F460 HydrophobicContact CE-CE1 3.63Å; M399-F460 HydrophobicContact SD-CE1 3.69Å; M399-F460 HydrophobicContact SD-CZ 4.31Å; H407-F460 AromaticContact CD2-CD1 3.74Å; H407-F460 AromaticContact CD2-CE1 3.54Å; H407-F460 AromaticContact CD2-CZ 3.84Å; L457-F460 HydrophobicContact CG-CZ 4.33Å; F460-R462 PolarHBondContact O-N 3.29Å; F460-R462 VanDerWaalsContact O-N 3.16Å; F460-A463 HydrophobicContact CB-CB 4.24Å; F460-A463 HydrophobicContact CD1-CB 4.34Å; F460-A463 WeakPolarHBondContact O-CB 3.31Å; F460-A463 PolarHBondContact O-N 3.41Å
461	G	90.2	Very high	88.6	Confident	6 Å²	6	31.6 Å²	31.6	6%	0.062	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-60.4	-28.2	-177.7	0	0	0	0	0	113.8	E294 D459	E294-G461 WeakPolarHBondContact CA-O 3.4Å; E294-G461 WeakPolarHBondContact O-CA 3.26Å; D459-G461 PolarHBondContact O-N 3.46Å
462	R	90	Very high	86.9	Confident	44 Å²	44	30.8 Å²	30.8	17%	0.166	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-96.3	6.7	176.6	-65.8	-171.1	168.3	-88.4	-16.1	114.3	E294 H407 D409 F460 R470 D474	E294-R462 IonicContact OE1-CZ 2.98Å; E294-R462 IonicContact OE1-NE 2.88Å; E294-R462 PolarHBondContact OE1-NE 2.81Å; E294-R462 VanDerWaalsContact OE1-NE 3.13Å; E294-R462 IonicContact OE1-NH2 2.62Å; E294-R462 PolarHBondContact OE1-NH2 3.23Å; H407-R462 CarbonylContact O-C 3.53Å; D409-R462 HydrophobicContact CB-CB 4.34Å; F460-R462 PolarHBondContact O-N 3.29Å; F460-R462 VanDerWaalsContact O-N 3.16Å; R462-R470 PolarHBondContact O-NH1 3.32Å; R462-D474 IonicContact CZ-OD1 3.31Å; R462-D474 PolarHBondContact NH1-O 2.94Å; R462-D474 IonicContact NH1-OD1 3.31Å; R462-D474 PolarHBondContact NH1-OD1 2.96Å; R462-D474 IonicContact NH2-OD1 3.38Å; R462-D474 PolarHBondContact NH2-OD1 2.76Å
463	A	92.9	Very high	85.1	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.204	C	C	.	.			trans	-58.6	140.3	178.3	0	0	0	0	0	111.9	F216 A301 M405 V406 H407 F460 R470	F216-A463 HydrophobicContact CZ-CB 4.23Å; A301-A463 HydrophobicContact CB-CB 4.07Å; M405-A463 HydrophobicContact SD-CB 4.26Å; V406-A463 CarbonylContact O-C 3.6Å; V406-A463 VanDerWaalsContact O-CA 3.25Å; V406-A463 WeakPolarHBondContact O-CA 3.2Å; H407-A463 PolarHBondContact O-N 3.03Å; F460-A463 HydrophobicContact CB-CB 4.24Å; F460-A463 HydrophobicContact CD1-CB 4.34Å; F460-A463 WeakPolarHBondContact O-CB 3.31Å; F460-A463 PolarHBondContact O-N 3.41Å; A463-R470 PolarHBondContact O-NH1 3.35Å; A463-R470 VanDerWaalsContact O-NH1 3.17Å; A463-R470 PolarHBondContact O-NH2 3.02Å
464	S	91.8	Very high	83.6	Confident	3 Å²	3	41.8 Å²	41.8	2%	0.021	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	163	-178.9	86.8	0	0	0	0	111.5	M405 V406 E468	M405-S464 WeakPolarHBondContact CA-O 3.41Å; M405-S464 WeakPolarHBondContact CG-O 3.31Å; V406-S464 PolarHBondContact N-O 3.32Å; V406-S464 PolarHBondContact O-N 3.44Å; S464-E468 WeakPolarHBondContact CB-OE2 3.4Å
465	R	91.2	Very high	82.6	Confident	12 Å²	12	41 Å²	41	5%	0.045	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	150.4	160.4	-60.9	178.6	176.1	-168.5	-10.6	108.6	R215 F216 S218 Q219 Y226 S404 G467 E468	R215-R465 PolarHBondContact O-NE 3.39Å; R215-R465 PolarHBondContact O-NH2 3.47Å; F216-R465 HydrophobicContact CD1-CG 4.43Å; S218-R465 PolarHBondContact O-NE 2.86Å; S218-R465 PolarHBondContact O-NH2 3.47Å; S218-R465 VanDerWaalsContact O-NH2 3.07Å; S218-R465 PolarHBondContact OG-NH2 2.73Å; Q219-R465 PolarHBondContact O-NH1 3.19Å; Y226-R465 PolarHBondContact OH-NH1 2.73Å; S404-R465 CarbonylContact O-C 3.57Å; R465-G467 PolarHBondContact O-N 3.48Å; R465-E468 HydrophobicContact CB-CB 4.09Å; R465-E468 PolarHBondContact N-OE2 2.83Å; R465-E468 WeakPolarHBondContact O-CB 3.42Å; R465-E468 PolarHBondContact O-N 2.84Å
466	A	89.5	Confident	81.7	Confident	15 Å²	15	41.8 Å²	41.8	12%	0.124	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	122.2	173.9	0	0	0	0	0	109.6	S404 V406 A491 T495	S404-A466 WeakPolarHBondContact O-CB 3.49Å; S404-A466 PolarHBondContact O-N 3.47Å; V406-A466 HydrophobicContact CG2-CB 3.97Å; A466-A491 HydrophobicContact CB-CB 4.09Å; A466-T495 HydrophobicContact CB-CG2 4.26Å
467	G	83.8	Confident	81	Confident	8 Å²	8	42.6 Å²	42.6	8%	0.082	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.2	1.4	-177.7	0	0	0	0	0	115	Y220 R465	Y220-G467 WeakPolarHBondContact CD1-O 3.38Å; Y220-G467 WeakPolarHBondContact CE1-O 3.43Å; R465-G467 PolarHBondContact O-N 3.48Å
468	E	83.4	Confident	80.4	Confident	31 Å²	31	43.8 Å²	43.8	15%	0.145	24%	0.243	C	C	.	.			trans	-69.7	122.8	161.4	174.7	176.3	-105.5	0	0	109.2	R215 Y220 S464 R465 R470	R215-E468 IonicContact CZ-OE1 3.6Å; R215-E468 VanDerWaalsContact CZ-OE1 3.31Å; R215-E468 IonicContact CZ-OE2 2.98Å; R215-E468 IonicContact NH1-OE1 2.73Å; R215-E468 PolarHBondContact NH1-OE1 2.83Å; R215-E468 IonicContact NH2-OE1 2.86Å; R215-E468 PolarHBondContact NH2-OE1 2.78Å; R215-E468 IonicContact NH2-OE2 3.9Å; R215-E468 PolarHBondContact NH2-OE2 2.52Å; Y220-E468 HydrophobicContact CD2-CB 4.04Å; Y220-E468 HydrophobicContact CE2-CB 4.2Å; Y220-E468 HydrophobicContact CE2-CG 4.5Å; Y220-E468 HydrophobicContact CG-CB 4.41Å; S464-E468 WeakPolarHBondContact CB-OE2 3.4Å; R465-E468 HydrophobicContact CB-CB 4.09Å; R465-E468 PolarHBondContact N-OE2 2.83Å; R465-E468 WeakPolarHBondContact O-CB 3.42Å; R465-E468 PolarHBondContact O-N 2.84Å; E468-R470 IonicContact OE2-CZ 3.95Å; E468-R470 IonicContact OE2-NE 2.73Å; E468-R470 PolarHBondContact OE2-NE 3.14Å; E468-R470 IonicContact OE2-NH2 2.82Å; E468-R470 PolarHBondContact OE2-NH2 2.87Å
469	D	67.5	Low	80	Confident	129 Å²	129	46 Å²	46	69%	0.69	25%	0.25	S	C	*	.			trans	-66.3	137.6	174.4	-68.5	-42.2	0	0	0	110.6
470	R	67.4	Low	80	Confident	63 Å²	63	43.5 Å²	43.5	24%	0.238	24%	0.236	C	C	.	.			trans	-142.2	139.8	171.8	-71.6	-166.7	-178	-177.6	2.4	109.8	R462 A463 E468 L475	R462-R470 PolarHBondContact O-NH1 3.32Å; A463-R470 PolarHBondContact O-NH1 3.35Å; A463-R470 VanDerWaalsContact O-NH1 3.17Å; A463-R470 PolarHBondContact O-NH2 3.02Å; E468-R470 IonicContact OE2-CZ 3.95Å; E468-R470 IonicContact OE2-NE 2.73Å; E468-R470 PolarHBondContact OE2-NE 3.14Å; E468-R470 IonicContact OE2-NH2 2.82Å; E468-R470 PolarHBondContact OE2-NH2 2.87Å; R470-L475 HydrophobicContact CB-CD2 3.64Å; R470-L475 WeakPolarHBondContact O-CD2 3.38Å
471	D	56.6	Low	79.7	Confident	142 Å²	142	44 Å²	44	76%	0.759	24%	0.239	S	C	*	.			trans	-67.6	151.6	-177.8	-67.7	-56	0	0	0	112.4	E473 D474	D471-E473 VanDerWaalsContact C-N 3.25Å; D471-E473 PolarHBondContact O-N 3.3Å; D471-E473 VanDerWaalsContact O-N 3.1Å; D471-D474 PolarHBondContact O-N 2.99Å
472	G	55.5	Low	79.6	Confident	39 Å²	39	44 Å²	44	40%	0.402	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-59.1	-28.5	-165.5	0	0	0	0	0	115.8	D474	G472-D474 VanDerWaalsContact C-N 3.34Å
473	E	54.9	Low	79	Confident	192 Å²	192	47.9 Å²	47.9	90%	0.897	25%	0.253	S	S	*	.	G	3₁₀ helix	trans	-73.9	-25.6	177.4	-61.6	-173.2	169.3	0	0	112.3	D471	D471-E473 VanDerWaalsContact C-N 3.25Å; D471-E473 PolarHBondContact O-N 3.3Å; D471-E473 VanDerWaalsContact O-N 3.1Å
474	D	65.6	Low	78.2	Confident	81 Å²	81	52.1 Å²	52.1	43%	0.433	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-95.4	6.4	-177.5	-104.4	-30.6	0	0	0	114.3	R462 D471 G472 G476	R462-D474 IonicContact CZ-OD1 3.31Å; R462-D474 PolarHBondContact NH1-O 2.94Å; R462-D474 IonicContact NH1-OD1 3.31Å; R462-D474 PolarHBondContact NH1-OD1 2.96Å; R462-D474 IonicContact NH2-OD1 3.38Å; R462-D474 PolarHBondContact NH2-OD1 2.76Å; D471-D474 PolarHBondContact O-N 2.99Å; G472-D474 VanDerWaalsContact C-N 3.34Å; D474-G476 PolarHBondContact O-N 3.48Å
475	L	74.8	Confident	77.7	Confident	15 Å²	15	59.3 Å²	59.3	8%	0.079	31%	0.313	C	S	.	.	S	Bend	trans	-77.9	-12.6	-175.2	-65.9	-169.5	0	0	0	115.7	G408 R470 L481 L484	G408-L475 VanDerWaalsContact O-O 3.1Å; R470-L475 HydrophobicContact CB-CD2 3.64Å; R470-L475 WeakPolarHBondContact O-CD2 3.38Å; L475-L481 HydrophobicContact CB-CD1 4.03Å; L475-L481 HydrophobicContact CB-CD2 4.3Å; L475-L484 HydrophobicContact CD1-CD2 3.97Å
476	G	79.5	Confident	77.4	Confident	16 Å²	16	60.1 Å²	60.1	17%	0.165	32%	0.318	C	S	.	.			trans	129.9	-169.9	177.4	0	0	0	0	0	114.1	D474 G478 L481	D474-G476 PolarHBondContact O-N 3.48Å; G476-G478 PolarHBondContact O-N 3.23Å; G476-L481 WeakPolarHBondContact O-CD1 3.46Å
477	D	84.2	Confident	77.4	Confident	33 Å²	33	64.3 Å²	64.3	18%	0.176	34%	0.344	C	S	.	.			trans	-67.4	114.1	179.9	-170.4	-44.1	0	0	0	112.4	D409 K411 R479 Y480 L481	D409-D477 WeakPolarHBondContact OD1-CB 3.5Å; D409-D477 PolarHBondContact OD1-N 2.92Å; K411-D477 HydrophobicContact CD-CB 3.9Å; K411-D477 IonicContact NZ-OD2 3.13Å; K411-D477 PolarHBondContact NZ-OD2 2.94Å; D477-R479 PolarHBondContact O-N 3.32Å; D477-R479 VanDerWaalsContact OD1-CB 3.3Å; D477-R479 WeakPolarHBondContact OD1-CB 3.4Å; D477-R479 WeakPolarHBondContact OD1-CG 3.23Å; D477-R479 IonicContact OD1-CZ 3.99Å; D477-R479 PolarHBondContact OD1-N 3.2Å; D477-R479 VanDerWaalsContact OD1-N 3.08Å; D477-R479 IonicContact OD1-NE 3.32Å; D477-R479 PolarHBondContact OD1-NE 3.39Å; D477-R479 IonicContact OD1-NH2 3.9Å; D477-R479 IonicContact OD2-CZ 2.67Å; D477-R479 IonicContact OD2-NE 3.08Å; D477-R479 PolarHBondContact OD2-NE 2.82Å; D477-R479 IonicContact OD2-NH2 3Å; D477-R479 PolarHBondContact OD2-NH2 2.8Å; D477-Y480 HydrophobicContact CB-CD2 3.9Å; D477-Y480 PolarHBondContact O-N 2.82Å; D477-L481 PolarHBondContact O-N 2.74Å
478	G	84.8	Confident	77.7	Confident	25 Å²	25	64.2 Å²	64.2	26%	0.258	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-23.6	-175.7	0	0	0	0	0	115.3	G476 Y480 R523	G476-G478 PolarHBondContact O-N 3.23Å; G478-Y480 PolarHBondContact O-N 2.87Å; G478-R523 PolarHBondContact O-NE 3.2Å; G478-R523 PolarHBondContact O-NH2 2.93Å
479	R	88.7	Confident	78.1	Confident	55 Å²	55	66.8 Å²	66.8	21%	0.208	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-23.2	175.9	-57.6	175	-67.9	163.9	2.1	112.5	D346 D477 M514 W519	D346-R479 PolarHBondContact O-NH2 3Å; D346-R479 IonicContact OD1-CZ 2.74Å; D346-R479 IonicContact OD1-NH1 2.67Å; D346-R479 PolarHBondContact OD1-NH1 2.8Å; D346-R479 IonicContact OD1-NH2 3.77Å; D346-R479 PolarHBondContact OD1-NH2 3.35Å; D346-R479 IonicContact OD2-NH2 3.4Å; D346-R479 PolarHBondContact OD2-NH2 3.19Å; D346-R479 VanDerWaalsContact OD2-NH2 3.08Å; D477-R479 PolarHBondContact O-N 3.32Å; D477-R479 VanDerWaalsContact OD1-CB 3.3Å; D477-R479 WeakPolarHBondContact OD1-CB 3.4Å; D477-R479 WeakPolarHBondContact OD1-CG 3.23Å; D477-R479 IonicContact OD1-CZ 3.99Å; D477-R479 PolarHBondContact OD1-N 3.2Å; D477-R479 VanDerWaalsContact OD1-N 3.08Å; D477-R479 IonicContact OD1-NE 3.32Å; D477-R479 PolarHBondContact OD1-NE 3.39Å; D477-R479 IonicContact OD1-NH2 3.9Å; D477-R479 IonicContact OD2-CZ 2.67Å; D477-R479 IonicContact OD2-NE 3.08Å; D477-R479 PolarHBondContact OD2-NE 2.82Å; D477-R479 IonicContact OD2-NH2 3Å; D477-R479 PolarHBondContact OD2-NH2 2.8Å; R479-M514 HydrophobicContact CB-CE 4.01Å; R479-M514 WeakPolarHBondContact O-CE 3.34Å; R479-W519 HydrophobicContact CB-CG 4.42Å
480	Y	92.7	Very high	79.1	Confident	4 Å²	4	64.1 Å²	64.1	2%	0.016	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.9	1.5	-175.9	-53.4	-92.8	0	0	0	113.1	K411 P412 D477 G478 Y500 A501 I504 H508 M514	K411-Y480 HydrophobicContact CB-CD1 4.01Å; K411-Y480 HydrophobicContact CB-CD2 3.78Å; K411-Y480 HydrophobicContact CB-CE1 3.94Å; K411-Y480 HydrophobicContact CB-CE2 3.67Å; K411-Y480 HydrophobicContact CB-CG 3.96Å; K411-Y480 HydrophobicContact CD-CD2 4.18Å; K411-Y480 HydrophobicContact CD-CE2 4.03Å; K411-Y480 HydrophobicContact CG-CE2 4.5Å; P412-Y480 WeakPolarHBondContact CD-OH 3.47Å; P412-Y480 HydrophobicContact CG-CE1 4.39Å; D477-Y480 HydrophobicContact CB-CD2 3.9Å; D477-Y480 PolarHBondContact O-N 2.82Å; G478-Y480 PolarHBondContact O-N 2.87Å; Y480-Y500 VanDerWaalsContact O-CD1 3.31Å; Y480-Y500 WeakPolarHBondContact O-CD1 3.48Å; Y480-A501 WeakPolarHBondContact O-CA 3.46Å; Y480-A501 WeakPolarHBondContact O-CB 3.49Å; Y480-I504 HydrophobicContact CD1-CB 3.97Å; Y480-I504 HydrophobicContact CD1-CG2 3.44Å; Y480-I504 VanDerWaalsContact CD1-CG2 3.44Å; Y480-I504 HydrophobicContact CE1-CG2 3.9Å; Y480-I504 HydrophobicContact CG-CG2 4.22Å; Y480-H508 PolarHBondContact OH-CE1 3.06Å; Y480-H508 VanDerWaalsContact OH-CE1 3.25Å; Y480-H508 PolarHBondContact OH-ND1 3.31Å; Y480-M514 HydrophobicContact CD1-CE 4.5Å; Y480-M514 HydrophobicContact CE1-CE 4.08Å
481	L	89.3	Confident	80.2	Confident	11 Å²	11	63.3 Å²	63.3	6%	0.058	36%	0.358	C	S	.	.			trans	-87.2	144.1	-180	-73.7	179.3	0	0	0	113.4	L475 G476 D477 L484 Y500 R523	L475-L481 HydrophobicContact CB-CD1 4.03Å; L475-L481 HydrophobicContact CB-CD2 4.3Å; G476-L481 WeakPolarHBondContact O-CD1 3.46Å; D477-L481 PolarHBondContact O-N 2.74Å; L481-L484 HydrophobicContact CD1-CD2 4.45Å; L481-Y500 VanDerWaalsContact O-CE1 3.3Å; L481-Y500 WeakPolarHBondContact O-CE1 3.25Å; L481-R523 VanDerWaalsContact O-CD 3.24Å; L481-R523 WeakPolarHBondContact O-CD 3.27Å; L481-R523 VanDerWaalsContact O-CG 3.31Å; L481-R523 WeakPolarHBondContact O-CG 3.33Å
482	P	87.7	Confident	82	Confident	5 Å²	5	58.7 Å²	58.7	3%	0.032	33%	0.33	C	S	.	.			trans	-75.2	-172.7	168.9	33.5	-35.6	0	0	0	111.4	L484 R497 Y500 R523	P482-L484 PolarHBondContact O-N 3.16Å; P482-R497 HydrophobicContact CG-CG 4.08Å; P482-Y500 HydrophobicContact CB-CD1 3.85Å; P482-Y500 HydrophobicContact CB-CD2 3.97Å; P482-Y500 HydrophobicContact CB-CE1 4.07Å; P482-Y500 HydrophobicContact CB-CE2 4.17Å; P482-Y500 HydrophobicContact CB-CG 3.79Å; P482-Y500 HydrophobicContact CG-CD1 4.26Å; P482-Y500 HydrophobicContact CG-CG 4.31Å; P482-R523 WeakPolarHBondContact O-CD 3.35Å
483	R	78.2	Confident	83.7	Confident	127 Å²	127	57.4 Å²	57.4	48%	0.479	32%	0.316	S	S	.	.			trans	-54	135.6	163.8	-71.5	-173.2	167	-139	-0.3	110.1	R523 E524	R483-R523 WeakPolarHBondContact CD-O 3.44Å; R483-R523 HydrophobicContact CG-CB 4.32Å; R483-R523 WeakPolarHBondContact CG-O 3.5Å; R483-R523 PolarHBondContact NE-O 3.15Å; R483-E524 PolarHBondContact NH2-O 2.74Å
484	L	75.6	Confident	85.5	Confident	89 Å²	89	48.4 Å²	48.4	47%	0.466	27%	0.274	S	S	.	.	S	Bend	trans	-71.8	-35.9	179	-57.1	172.4	0	0	0	111.8	L475 L481 P482 D486	L475-L484 HydrophobicContact CD1-CD2 3.97Å; L481-L484 HydrophobicContact CD1-CD2 4.45Å; P482-L484 PolarHBondContact O-N 3.16Å; L484-D486 VanDerWaalsContact C-N 3.25Å; L484-D486 PolarHBondContact O-N 2.88Å
485	N	81.2	Confident	86.8	Confident	153 Å²	153	45.3 Å²	45.3	82%	0.818	26%	0.258	S	S	*	.			trans	-83.4	62.2	-177.5	-59.3	8.1	0	0	0	111.2
486	D	84.7	Confident	87.8	Confident	30 Å²	30	44.6 Å²	44.6	16%	0.16	25%	0.254	C	S	.	.			trans	-87.9	117.9	176.1	-163.6	-31.1	0	0	0	110.1	L484 S488 A493 A550	L484-D486 VanDerWaalsContact C-N 3.25Å; L484-D486 PolarHBondContact O-N 2.88Å; D486-S488 PolarHBondContact O-N 3.4Å; D486-S488 WeakPolarHBondContact OD1-CB 3.49Å; D486-S488 PolarHBondContact OD1-N 3.32Å; D486-S488 PolarHBondContact OD1-OG 3.44Å; D486-A493 HydrophobicContact CB-CB 4.43Å; D486-A550 WeakPolarHBondContact OD2-CB 3.26Å; D486-A550 PolarHBondContact OD2-N 3.2Å
487	P	89.2	Confident	88.5	Confident	102 Å²	102	45.8 Å²	45.8	66%	0.662	25%	0.254	S	S	*	.			trans	-79	0	178.9	34.8	-36.7	0	0	0	113.6
488	S	90.7	Very high	89.1	Confident	6 Å²	6	44.2 Å²	44.2	4%	0.042	25%	0.246	C	C	.	.	S	Bend	trans	-60.2	151.3	174.6	-54.1	0	0	0	0	111.1	D486 Q551	D486-S488 PolarHBondContact O-N 3.4Å; D486-S488 WeakPolarHBondContact OD1-CB 3.49Å; D486-S488 PolarHBondContact OD1-N 3.32Å; D486-S488 PolarHBondContact OD1-OG 3.44Å; S488-Q551 PolarHBondContact OG-N 2.9Å
489	P	91	Very high	89.6	Confident	85 Å²	85	43 Å²	43	55%	0.552	23%	0.233	S	C	*	.			trans	-51.5	140.3	176.3	-27.8	35	0	0	0	112.2	A491 R492 A493	P489-A491 VanDerWaalsContact C-N 3.32Å; P489-A491 PolarHBondContact O-N 2.9Å; P489-R492 HydrophobicContact CB-CB 4.48Å; P489-R492 CarbonylContact O-C 3.6Å; P489-R492 WeakPolarHBondContact O-CA 3.28Å; P489-R492 WeakPolarHBondContact O-CB 3.35Å; P489-R492 PolarHBondContact O-N 3.17Å; P489-A493 PolarHBondContact O-N 3.45Å
490	P	89.1	Confident	89.9	Confident	74 Å²	74	40.6 Å²	40.6	48%	0.481	22%	0.224	S	C	.	.	H	α-helix	trans	-51.6	-41.1	-167.2	-32.9	36.8	0	0	0	115.6	A493 A494	P490-A493 PolarHBondContact O-N 3.49Å; P490-A494 VanDerWaalsContact O-CB 3.29Å; P490-A494 WeakPolarHBondContact O-CB 3.27Å; P490-A494 PolarHBondContact O-N 3.25Å
491	A	90.8	Very high	90.1	Very high	45 Å²	45	40.7 Å²	40.7	37%	0.372	23%	0.225	S	C	.	.	H	α-helix	trans	-67.8	-34	175.7	0	0	0	0	0	113.3	A466 P489 T495	A466-A491 HydrophobicContact CB-CB 4.09Å; P489-A491 VanDerWaalsContact C-N 3.32Å; P489-A491 PolarHBondContact O-N 2.9Å; A491-T495 WeakPolarHBondContact O-CB 3.43Å; A491-T495 WeakPolarHBondContact O-CG2 3.42Å; A491-T495 PolarHBondContact O-N 3.01Å; A491-T495 PolarHBondContact O-OG1 2.8Å
492	R	93.2	Very high	90.5	Very high	45 Å²	45	40.1 Å²	40.1	17%	0.17	22%	0.223	C	C	.	.	H	α-helix	trans	-72.6	-42.9	173.4	-175.6	66.5	-158.9	133.6	-10	111.2	P489 T495 G496 A550 R553 P554	P489-R492 HydrophobicContact CB-CB 4.48Å; P489-R492 CarbonylContact O-C 3.6Å; P489-R492 WeakPolarHBondContact O-CA 3.28Å; P489-R492 WeakPolarHBondContact O-CB 3.35Å; P489-R492 PolarHBondContact O-N 3.17Å; R492-T495 PolarHBondContact NH1-OG1 3.46Å; R492-T495 PolarHBondContact O-OG1 2.75Å; R492-G496 WeakPolarHBondContact O-CA 3.4Å; R492-G496 PolarHBondContact O-N 2.87Å; R492-A550 HydrophobicContact CG-CB 4.34Å; R492-A550 VanDerWaalsContact CZ-O 3.29Å; R492-A550 PolarHBondContact NE-O 2.85Å; R492-A550 PolarHBondContact NH2-O 3.03Å; R492-A550 VanDerWaalsContact NH2-O 3.11Å; R492-A550 WeakPolarHBondContact O-CB 3.14Å; R492-R553 PolarHBondContact NH2-O 2.94Å; R492-P554 VanDerWaalsContact NH2-C 3.35Å; R492-P554 PolarHBondContact NH2-O 3.28Å
493	A	92	Very high	90.9	Very high	13 Å²	13	39.9 Å²	39.9	11%	0.107	22%	0.221	C	C	.	.	H	α-helix	trans	-56.2	-51.1	173.3	0	0	0	0	0	110.7	D486 P489 P490 G496 R497	D486-A493 HydrophobicContact CB-CB 4.43Å; P489-A493 PolarHBondContact O-N 3.45Å; P490-A493 PolarHBondContact O-N 3.49Å; A493-G496 CarbonylContact O-C 3.53Å; A493-G496 PolarHBondContact O-N 3.15Å; A493-R497 WeakPolarHBondContact O-CG 3.49Å; A493-R497 PolarHBondContact O-N 2.92Å
494	A	91.9	Very high	91.7	Very high	2 Å²	2	33.9 Å²	33.9	2%	0.017	20%	0.199	C	C	.	.	H	α-helix	trans	-61.8	-52.8	-179.1	0	0	0	0	0	113.1	V406 P490 G496 R497	V406-A494 HydrophobicContact CG1-CB 4.41Å; V406-A494 WeakPolarHBondContact CG1-O 3.49Å; V406-A494 HydrophobicContact CG2-CB 3.89Å; P490-A494 VanDerWaalsContact O-CB 3.29Å; P490-A494 WeakPolarHBondContact O-CB 3.27Å; P490-A494 PolarHBondContact O-N 3.25Å; A494-G496 PolarHBondContact O-N 3.18Å; A494-R497 WeakPolarHBondContact O-CB 3.27Å; A494-R497 PolarHBondContact O-N 2.97Å
495	T	94.5	Very high	92.7	Very high	17 Å²	17	29.7 Å²	29.7	10%	0.104	18%	0.176	C	C	.	.	H	α-helix	trans	-62.4	-31.3	175	52.4	0	0	0	0	112.5	H400 V406 A466 A491 R492 R497	H400-T495 HydrophobicContact CB-CG2 4.2Å; H400-T495 PolarHBondContact CE1-O 2.88Å; H400-T495 WeakPolarHBondContact ND1-CB 3.48Å; V406-T495 HydrophobicContact CG2-CG2 3.86Å; A466-T495 HydrophobicContact CB-CG2 4.26Å; A491-T495 WeakPolarHBondContact O-CB 3.43Å; A491-T495 WeakPolarHBondContact O-CG2 3.42Å; A491-T495 PolarHBondContact O-N 3.01Å; A491-T495 PolarHBondContact O-OG1 2.8Å; R492-T495 PolarHBondContact NH1-OG1 3.46Å; R492-T495 PolarHBondContact O-OG1 2.75Å; T495-R497 VanDerWaalsContact C-N 3.31Å; T495-R497 PolarHBondContact O-N 2.84Å
496	G	94.9	Very high	93.5	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-68.2	-23	173.9	0	0	0	0	0	114.5	R492 A493 A494 Y500 R553	R492-G496 WeakPolarHBondContact O-CA 3.4Å; R492-G496 PolarHBondContact O-N 2.87Å; A493-G496 CarbonylContact O-C 3.53Å; A493-G496 PolarHBondContact O-N 3.15Å; A494-G496 PolarHBondContact O-N 3.18Å; G496-Y500 PolarHBondContact O-N 3.47Å; G496-Y500 VanDerWaalsContact O-N 3.1Å; G496-R553 VanDerWaalsContact C-NH1 3.3Å; G496-R553 PolarHBondContact O-NH1 2.89Å
497	R	93.8	Very high	94	Very high	40 Å²	40	21.3 Å²	21.3	15%	0.151	13%	0.131	C	C	.	.	H	α-helix	trans	-66.9	-50	174.8	-69	-174.2	-65.3	-125.2	6.6	110.8	P482 A493 A494 T495 L499 Y500 A501	P482-R497 HydrophobicContact CG-CG 4.08Å; A493-R497 WeakPolarHBondContact O-CG 3.49Å; A493-R497 PolarHBondContact O-N 2.92Å; A494-R497 WeakPolarHBondContact O-CB 3.27Å; A494-R497 PolarHBondContact O-N 2.97Å; T495-R497 VanDerWaalsContact C-N 3.31Å; T495-R497 PolarHBondContact O-N 2.84Å; R497-L499 VanDerWaalsContact C-N 3.27Å; R497-L499 PolarHBondContact O-N 2.81Å; R497-Y500 PolarHBondContact O-N 3.24Å; R497-A501 WeakPolarHBondContact O-CB 3.43Å; R497-A501 PolarHBondContact O-N 2.93Å
498	D	96.1	Very high	94.3	Very high	1 Å²	1	16.5 Å²	16.5	1%	0.005	10%	0.1	C	C	.	.	H	α-helix	trans	-56.5	-40.9	177.3	-70.1	-12.5	0	0	0	112.1	L396 H400 V406 H407 G408 V410 A501 L502	L396-D498 HydrophobicContact CD1-CB 4.05Å; L396-D498 HydrophobicContact CD2-CB 3.84Å; H400-D498 IonicContact CD2-OD2 2.7Å; H400-D498 IonicContact CE1-OD2 3.78Å; H400-D498 IonicContact NE2-OD2 3.43Å; H400-D498 PolarHBondContact NE2-OD2 3.19Å; V406-D498 WeakPolarHBondContact CG1-OD2 3.21Å; H407-D498 PolarHBondContact N-OD1 2.84Å; H407-D498 PolarHBondContact N-OD2 3.26Å; G408-D498 PolarHBondContact N-OD1 2.84Å; V410-D498 HydrophobicContact CG2-CB 4.02Å; D498-A501 PolarHBondContact O-N 3.37Å; D498-L502 WeakPolarHBondContact O-CB 3.21Å; D498-L502 PolarHBondContact O-N 3.04Å
499	L	97	Very high	94.6	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-67.6	-42.1	178.5	-76.7	174.9	0	0	0	112.9	L393 R497 L502 G503 L545 P554 V556 L559	L393-L499 HydrophobicContact CD2-CD2 4.06Å; R497-L499 VanDerWaalsContact C-N 3.27Å; R497-L499 PolarHBondContact O-N 2.81Å; L499-L502 PolarHBondContact O-N 3.32Å; L499-G503 PolarHBondContact O-N 3.06Å; L499-L545 HydrophobicContact CB-CD2 4.01Å; L499-L545 HydrophobicContact CD2-CD2 3.83Å; L499-L545 HydrophobicContact CG-CD2 4.47Å; L499-P554 VanDerWaalsContact CD1-O 3.24Å; L499-P554 WeakPolarHBondContact CD1-O 3.49Å; L499-V556 HydrophobicContact CD1-CG2 4.2Å; L499-V556 HydrophobicContact CD2-CG2 3.98Å; L499-V556 HydrophobicContact CG-CG2 4.26Å; L499-L559 HydrophobicContact CD2-CD1 3.58Å
500	Y	95.3	Very high	94.9	Very high	4 Å²	4	12.4 Å²	12.4	2%	0.016	7%	0.074	C	C	.	.	H	α-helix	trans	-64.1	-45.1	174	179.6	-86.9	0	0	0	111	Y480 L481 P482 G496 R497 L502 G503 I504 L522 L546	Y480-Y500 VanDerWaalsContact O-CD1 3.31Å; Y480-Y500 WeakPolarHBondContact O-CD1 3.48Å; L481-Y500 VanDerWaalsContact O-CE1 3.3Å; L481-Y500 WeakPolarHBondContact O-CE1 3.25Å; P482-Y500 HydrophobicContact CB-CD1 3.85Å; P482-Y500 HydrophobicContact CB-CD2 3.97Å; P482-Y500 HydrophobicContact CB-CE1 4.07Å; P482-Y500 HydrophobicContact CB-CE2 4.17Å; P482-Y500 HydrophobicContact CB-CG 3.79Å; P482-Y500 HydrophobicContact CG-CD1 4.26Å; P482-Y500 HydrophobicContact CG-CG 4.31Å; G496-Y500 PolarHBondContact O-N 3.47Å; G496-Y500 VanDerWaalsContact O-N 3.1Å; R497-Y500 PolarHBondContact O-N 3.24Å; Y500-L502 VanDerWaalsContact C-N 3.32Å; Y500-L502 PolarHBondContact O-N 3.04Å; Y500-G503 CarbonylContact O-C 3.57Å; Y500-G503 WeakPolarHBondContact O-CA 3.43Å; Y500-G503 PolarHBondContact O-N 3.17Å; Y500-I504 HydrophobicContact CD1-CG1 3.94Å; Y500-I504 HydrophobicContact CE1-CD1 3.91Å; Y500-I504 HydrophobicContact CE1-CG1 3.56Å; Y500-I504 WeakPolarHBondContact O-CG1 3.38Å; Y500-I504 PolarHBondContact O-N 3.07Å; Y500-L522 PolarHBondContact OH-O 2.74Å; Y500-L546 HydrophobicContact CD2-CD2 3.94Å; Y500-L546 HydrophobicContact CE2-CD2 3.85Å; Y500-L546 HydrophobicContact CG-CD2 4.41Å
501	A	96	Very high	95.1	Very high	5 Å²	5	10.1 Å²	10.1	4%	0.041	6%	0.064	C	C	.	.	H	α-helix	trans	-62.7	-35.7	178.3	0	0	0	0	0	112.5	V410 Y480 R497 D498 I504 T505	V410-A501 HydrophobicContact CB-CB 4Å; V410-A501 WeakPolarHBondContact O-CB 3.45Å; Y480-A501 WeakPolarHBondContact O-CA 3.46Å; Y480-A501 WeakPolarHBondContact O-CB 3.49Å; R497-A501 WeakPolarHBondContact O-CB 3.43Å; R497-A501 PolarHBondContact O-N 2.93Å; D498-A501 PolarHBondContact O-N 3.37Å; A501-I504 PolarHBondContact O-N 3.26Å; A501-T505 VanDerWaalsContact O-CB 3.27Å; A501-T505 WeakPolarHBondContact O-CB 3.49Å; A501-T505 PolarHBondContact O-N 2.93Å; A501-T505 PolarHBondContact O-OG1 3.39Å
502	L	97.8	Very high	95.1	Very high	0 Å²	0	8 Å²	8	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-63.7	-42.1	167.2	176.4	59.6	0	0	0	112.1	I392 L393 L396 V410 D498 L499 Y500 I504 T505 L506 L545	I392-L502 HydrophobicContact CB-CD1 3.99Å; I392-L502 HydrophobicContact CG2-CD1 3.89Å; I392-L502 HydrophobicContact CG2-CD2 4.32Å; L393-L502 HydrophobicContact CD2-CD2 3.68Å; L393-L502 HydrophobicContact CG-CD2 3.87Å; L396-L502 HydrophobicContact CD1-CD2 4.27Å; V410-L502 HydrophobicContact CG1-CB 4.37Å; D498-L502 WeakPolarHBondContact O-CB 3.21Å; D498-L502 PolarHBondContact O-N 3.04Å; L499-L502 PolarHBondContact O-N 3.32Å; Y500-L502 VanDerWaalsContact C-N 3.32Å; Y500-L502 PolarHBondContact O-N 3.04Å; L502-I504 PolarHBondContact O-N 2.76Å; L502-T505 WeakPolarHBondContact O-CB 3.35Å; L502-T505 PolarHBondContact O-N 3.07Å; L502-L506 HydrophobicContact CD1-CD1 4.14Å; L502-L506 HydrophobicContact CD1-CG 4.09Å; L502-L506 HydrophobicContact CG-CD1 4.15Å; L502-L506 WeakPolarHBondContact O-CG 3.48Å; L502-L506 PolarHBondContact O-N 2.91Å; L502-L545 HydrophobicContact CG-CD1 4.41Å
503	G	96.3	Very high	95	Very high	0 Å²	0	8.6 Å²	8.6	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-57.9	-46	174.5	0	0	0	0	0	112.6	L499 Y500 L506 Y507 V542	L499-G503 PolarHBondContact O-N 3.06Å; Y500-G503 CarbonylContact O-C 3.57Å; Y500-G503 WeakPolarHBondContact O-CA 3.43Å; Y500-G503 PolarHBondContact O-N 3.17Å; G503-L506 PolarHBondContact O-N 3.46Å; G503-Y507 PolarHBondContact O-N 3.44Å; G503-V542 WeakPolarHBondContact O-CG1 3.39Å
504	I	95.1	Very high	94.7	Very high	1 Å²	1	9 Å²	9	1%	0.005	6%	0.056	C	C	.	.	H	α-helix	trans	-63.7	-44.6	173.8	-60.4	-66.6	0	0	0	110.7	Y480 Y500 A501 L502 L506 Y507 H508 M514 L522 L546	Y480-I504 HydrophobicContact CD1-CB 3.97Å; Y480-I504 HydrophobicContact CD1-CG2 3.44Å; Y480-I504 VanDerWaalsContact CD1-CG2 3.44Å; Y480-I504 HydrophobicContact CE1-CG2 3.9Å; Y480-I504 HydrophobicContact CG-CG2 4.22Å; Y500-I504 HydrophobicContact CD1-CG1 3.94Å; Y500-I504 HydrophobicContact CE1-CD1 3.91Å; Y500-I504 HydrophobicContact CE1-CG1 3.56Å; Y500-I504 WeakPolarHBondContact O-CG1 3.38Å; Y500-I504 PolarHBondContact O-N 3.07Å; A501-I504 PolarHBondContact O-N 3.26Å; L502-I504 PolarHBondContact O-N 2.76Å; I504-L506 VanDerWaalsContact C-N 3.3Å; I504-L506 PolarHBondContact O-N 3.23Å; I504-Y507 PolarHBondContact O-N 2.71Å; I504-H508 WeakPolarHBondContact O-CB 3.3Å; I504-H508 PolarHBondContact O-N 2.91Å; I504-M514 HydrophobicContact CG2-CE 3.48Å; I504-M514 VanDerWaalsContact CG2-CE 3.48Å; I504-M514 HydrophobicContact CG2-SD 4Å; I504-L522 HydrophobicContact CD1-CD1 3.64Å; I504-L522 HydrophobicContact CD1-CD2 3.9Å; I504-L522 HydrophobicContact CD1-CG 4.3Å; I504-L546 HydrophobicContact CD1-CD2 3.52Å; I504-L546 HydrophobicContact CG1-CD2 3.79Å
505	T	96.9	Very high	94.4	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-57.2	-40.7	177.4	-68.5	0	0	0	0	112.2	V410 K411 P412 I415 A501 L502 S509	V410-T505 PolarHBondContact O-OG1 3.31Å; K411-T505 WeakPolarHBondContact CA-OG1 3.48Å; P412-T505 HydrophobicContact CG-CG2 4.18Å; I415-T505 HydrophobicContact CD1-CG2 3.67Å; A501-T505 VanDerWaalsContact O-CB 3.27Å; A501-T505 WeakPolarHBondContact O-CB 3.49Å; A501-T505 PolarHBondContact O-N 2.93Å; A501-T505 PolarHBondContact O-OG1 3.39Å; L502-T505 WeakPolarHBondContact O-CB 3.35Å; L502-T505 PolarHBondContact O-N 3.07Å; T505-S509 WeakPolarHBondContact O-CB 3.45Å; T505-S509 PolarHBondContact O-N 2.74Å; T505-S509 PolarHBondContact O-OG 3.08Å
506	L	97.6	Very high	93.8	Very high	1 Å²	1	13.1 Å²	13.1	1%	0.005	9%	0.087	C	C	.	.	H	α-helix	trans	-72.1	-44.8	177.4	-68.8	169	0	0	0	112	L385 L388 A389 L502 G503 I504 H508 S509 A510 V542 L545	L385-L506 HydrophobicContact CD2-CD2 4.42Å; L388-L506 HydrophobicContact CB-CD2 4.5Å; L388-L506 HydrophobicContact CD2-CD2 3.97Å; L388-L506 HydrophobicContact CG-CD2 4.05Å; A389-L506 HydrophobicContact CB-CD1 3.79Å; A389-L506 HydrophobicContact CB-CD2 3.9Å; A389-L506 HydrophobicContact CB-CG 4.5Å; L502-L506 HydrophobicContact CD1-CD1 4.14Å; L502-L506 HydrophobicContact CD1-CG 4.09Å; L502-L506 HydrophobicContact CG-CD1 4.15Å; L502-L506 WeakPolarHBondContact O-CG 3.48Å; L502-L506 PolarHBondContact O-N 2.91Å; G503-L506 PolarHBondContact O-N 3.46Å; I504-L506 VanDerWaalsContact C-N 3.3Å; I504-L506 PolarHBondContact O-N 3.23Å; L506-H508 VanDerWaalsContact C-N 3.35Å; L506-H508 PolarHBondContact O-N 3.45Å; L506-S509 PolarHBondContact O-N 3.49Å; L506-A510 WeakPolarHBondContact O-CB 3.33Å; L506-A510 PolarHBondContact O-N 3.04Å; L506-V542 HydrophobicContact CB-CG2 3.95Å; L506-V542 HydrophobicContact CD1-CG2 3.99Å; L506-L545 HydrophobicContact CD1-CD1 4.29Å
507	Y	95.5	Very high	93.2	Very high	6 Å²	6	16 Å²	16	2%	0.024	11%	0.108	C	C	.	.	H	α-helix	trans	-56.5	-48.6	173.3	170.2	-106.2	0	0	0	111.7	G503 I504 A510 G512 P513 M514 V518 P529 D530 L531 V533 L534	G503-Y507 PolarHBondContact O-N 3.44Å; I504-Y507 PolarHBondContact O-N 2.71Å; Y507-A510 PolarHBondContact O-N 2.98Å; Y507-G512 WeakPolarHBondContact O-CA 3.45Å; Y507-G512 PolarHBondContact O-N 3.05Å; Y507-P513 WeakPolarHBondContact OH-CD 3.2Å; Y507-M514 HydrophobicContact CD1-SD 4.49Å; Y507-V518 HydrophobicContact CE1-CG1 4.35Å; Y507-P529 HydrophobicContact CE2-CG 4.36Å; Y507-D530 WeakPolarHBondContact CE2-O 3.41Å; Y507-L531 HydrophobicContact CD2-CD2 3.71Å; Y507-L531 HydrophobicContact CE2-CD2 4Å; Y507-V533 HydrophobicContact CD2-CG2 3.86Å; Y507-V533 HydrophobicContact CE2-CG2 3.66Å; Y507-L534 HydrophobicContact CD2-CD1 4.11Å
508	H	94.7	Very high	92.6	Very high	2 Å²	2	14.9 Å²	14.9	1%	0.009	11%	0.105	C	C	.	.	H	α-helix	trans	-59.9	-52.9	176	-176.1	-151.5	0	0	0	110.2	Y340 R377 Y480 I504 L506 A510 G511 G512 M514	Y340-H508 AromaticContact CE2-CE1 3.46Å; Y340-H508 VanDerWaalsContact CE2-CE1 3.46Å; Y340-H508 WeakPolarHBondContact CE2-CE1 3.42Å; Y340-H508 AromaticContact CE2-NE2 3.01Å; Y340-H508 WeakPolarHBondContact CE2-NE2 3.48Å; Y340-H508 AromaticContact CZ-NE2 2.89Å; Y340-H508 PolarHBondContact OH-NE2 2.95Å; R377-H508 VanDerWaalsContact CZ-CD2 3.49Å; R377-H508 PolarHBondContact NH2-CD2 2.86Å; R377-H508 PolarHBondContact NH2-NE2 2.9Å; R377-H508 PolarHBondContact NH2-O 3.44Å; Y480-H508 PolarHBondContact OH-CE1 3.06Å; Y480-H508 VanDerWaalsContact OH-CE1 3.25Å; Y480-H508 PolarHBondContact OH-ND1 3.31Å; I504-H508 WeakPolarHBondContact O-CB 3.3Å; I504-H508 PolarHBondContact O-N 2.91Å; L506-H508 VanDerWaalsContact C-N 3.35Å; L506-H508 PolarHBondContact O-N 3.45Å; H508-A510 PolarHBondContact O-N 2.87Å; H508-G511 WeakPolarHBondContact O-CA 3.37Å; H508-G511 PolarHBondContact O-N 3.37Å; H508-G512 PolarHBondContact O-N 3.09Å; H508-M514 HydrophobicContact CB-CG 4.03Å; H508-M514 HydrophobicContact CB-SD 4.16Å; H508-M514 WeakPolarHBondContact CD2-CG 3.42Å
509	S	97	Very high	91.9	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-60.7	-27.2	-177.9	-60.2	0	0	0	0	114.3	L380 T505 L506 G511	L380-S509 PolarHBondContact N-O 3.15Å; T505-S509 WeakPolarHBondContact O-CB 3.45Å; T505-S509 PolarHBondContact O-N 2.74Å; T505-S509 PolarHBondContact O-OG 3.08Å; L506-S509 PolarHBondContact O-N 3.49Å; S509-G511 PolarHBondContact O-N 2.67Å
510	A	96.5	Very high	91.1	Very high	5 Å²	5	21.4 Å²	21.4	4%	0.041	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-6.7	173.7	0	0	0	0	0	114.1	L385 L506 Y507 H508 L534	L385-A510 HydrophobicContact CD1-CB 3.71Å; L385-A510 HydrophobicContact CD2-CB 4.39Å; L506-A510 WeakPolarHBondContact O-CB 3.33Å; L506-A510 PolarHBondContact O-N 3.04Å; Y507-A510 PolarHBondContact O-N 2.98Å; H508-A510 PolarHBondContact O-N 2.87Å; A510-L534 HydrophobicContact CB-CD2 3.75Å; A510-L534 HydrophobicContact CB-CG 4.15Å
511	G	93.5	Very high	90.3	Very high	26 Å²	26	28.2 Å²	28.2	27%	0.268	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	107.4	5	-176.7	0	0	0	0	0	114.3	R377 H508 S509	R377-G511 PolarHBondContact NH1-O 3.06Å; H508-G511 WeakPolarHBondContact O-CA 3.37Å; H508-G511 PolarHBondContact O-N 3.37Å; S509-G511 PolarHBondContact O-N 2.67Å
512	G	92	Very high	89.3	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.161	C	C	.	.			trans	-58.6	136.1	176.6	0	0	0	0	0	112.4	R377 Y507 H508	R377-G512 PolarHBondContact NH1-O 2.94Å; Y507-G512 WeakPolarHBondContact O-CA 3.45Å; Y507-G512 PolarHBondContact O-N 3.05Å; H508-G512 PolarHBondContact O-N 3.09Å
513	P	89.6	Confident	88.2	Confident	58 Å²	58	31.1 Å²	31.1	38%	0.377	17%	0.17	S	C	.	.			trans	-67	146	177.3	26.7	-35.8	0	0	0	112.4	Y507 V518	Y507-P513 WeakPolarHBondContact OH-CD 3.2Å; P513-V518 HydrophobicContact CB-CG2 4.5Å; P513-V518 HydrophobicContact CG-CG2 4.27Å; P513-V518 WeakPolarHBondContact O-CG1 3.35Å
514	M	86.7	Confident	86.9	Confident	21 Å²	21	37.7 Å²	37.7	10%	0.103	20%	0.201	C	C	.	.			trans	-126.4	32.5	-177.7	-69.4	-64.5	-73.8	0	0	113	R479 Y480 I504 Y507 H508	R479-M514 HydrophobicContact CB-CE 4.01Å; R479-M514 WeakPolarHBondContact O-CE 3.34Å; Y480-M514 HydrophobicContact CD1-CE 4.5Å; Y480-M514 HydrophobicContact CE1-CE 4.08Å; I504-M514 HydrophobicContact CG2-CE 3.48Å; I504-M514 VanDerWaalsContact CG2-CE 3.48Å; I504-M514 HydrophobicContact CG2-SD 4Å; Y507-M514 HydrophobicContact CD1-SD 4.49Å; H508-M514 HydrophobicContact CB-CG 4.03Å; H508-M514 HydrophobicContact CB-SD 4.16Å; H508-M514 WeakPolarHBondContact CD2-CG 3.42Å
515	S	85	Confident	85.3	Confident	60 Å²	60	40.4 Å²	40.4	42%	0.42	22%	0.217	S	C	.	.			trans	-66.2	157.3	169.7	55.5	0	0	0	0	111.2	S517 V518 W519	S515-S517 VanDerWaalsContact C-N 3.32Å; S515-S517 PolarHBondContact O-N 3.45Å; S515-V518 PolarHBondContact O-N 2.64Å; S515-V518 WeakPolarHBondContact OG-CG2 3.34Å; S515-W519 VanDerWaalsContact O-CD1 3.31Å; S515-W519 PolarHBondContact O-N 2.75Å
516	A	82.8	Confident	83.6	Confident	45 Å²	45	47 Å²	47	37%	0.372	25%	0.253	S	S	.	.	H	α-helix	trans	-46.7	-55	179.8	0	0	0	0	0	112.2	V518 W519 E520	A516-V518 PolarHBondContact O-N 2.6Å; A516-W519 HydrophobicContact CB-CZ2 4.04Å; A516-W519 PolarHBondContact O-N 2.92Å; A516-W519 VanDerWaalsContact O-N 3.16Å; A516-E520 VanDerWaalsContact C-OE2 3.25Å; A516-E520 WeakPolarHBondContact O-CB 3.18Å; A516-E520 WeakPolarHBondContact O-CG 3.24Å; A516-E520 PolarHBondContact O-N 2.87Å
517	S	81.1	Confident	82	Confident	61 Å²	61	51.5 Å²	51.5	43%	0.427	28%	0.283	S	S	.	.	H	α-helix	trans	-61.8	-10.6	179.9	67.8	0	0	0	0	115.2	S515 E520 R521	S515-S517 VanDerWaalsContact C-N 3.32Å; S515-S517 PolarHBondContact O-N 3.45Å; S517-E520 WeakPolarHBondContact CA-OE2 3.38Å; S517-E520 PolarHBondContact N-OE2 3.18Å; S517-R521 VanDerWaalsContact O-CZ 3.23Å; S517-R521 PolarHBondContact O-NE 3.1Å; S517-R521 PolarHBondContact O-NH2 3.08Å
518	V	82.4	Confident	80.8	Confident	16 Å²	16	54 Å²	54	10%	0.097	30%	0.297	C	S	.	.	H	α-helix	trans	-90.5	-52	171.7	176.6	0	0	0	0	110.8	Y507 P513 S515 A516 E520 R521 L522	Y507-V518 HydrophobicContact CE1-CG1 4.35Å; P513-V518 HydrophobicContact CB-CG2 4.5Å; P513-V518 HydrophobicContact CG-CG2 4.27Å; P513-V518 WeakPolarHBondContact O-CG1 3.35Å; S515-V518 PolarHBondContact O-N 2.64Å; S515-V518 WeakPolarHBondContact OG-CG2 3.34Å; A516-V518 PolarHBondContact O-N 2.6Å; V518-E520 VanDerWaalsContact C-N 3.31Å; V518-E520 PolarHBondContact O-N 3.17Å; V518-R521 PolarHBondContact O-N 3.31Å; V518-L522 HydrophobicContact CG1-CD1 4.14Å; V518-L522 WeakPolarHBondContact O-CB 3.39Å; V518-L522 PolarHBondContact O-N 3.34Å; V518-L522 VanDerWaalsContact O-N 3.12Å
519	W	80.3	Confident	79.7	Confident	54 Å²	54	55.3 Å²	55.3	21%	0.205	31%	0.305	C	S	.	.	H	α-helix	trans	-72.6	-22.2	-179.5	60.4	-109.2	0	0	0	113.4	R479 S515 A516 R523	R479-W519 HydrophobicContact CB-CG 4.42Å; S515-W519 VanDerWaalsContact O-CD1 3.31Å; S515-W519 PolarHBondContact O-N 2.75Å; A516-W519 HydrophobicContact CB-CZ2 4.04Å; A516-W519 PolarHBondContact O-N 2.92Å; A516-W519 VanDerWaalsContact O-N 3.16Å; W519-R523 VanDerWaalsContact CE3-NH2 3.29Å; W519-R523 PolarHBondContact O-N 3.2Å
520	E	81.4	Confident	79	Confident	85 Å²	85	60.6 Å²	60.6	40%	0.397	33%	0.334	S	S	.	.	H	α-helix	trans	-67.1	-54.5	170.6	-70.6	163.8	164.7	0	0	111	A516 S517 V518 L522 R523 E524	A516-E520 VanDerWaalsContact C-OE2 3.25Å; A516-E520 WeakPolarHBondContact O-CB 3.18Å; A516-E520 WeakPolarHBondContact O-CG 3.24Å; A516-E520 PolarHBondContact O-N 2.87Å; S517-E520 WeakPolarHBondContact CA-OE2 3.38Å; S517-E520 PolarHBondContact N-OE2 3.18Å; V518-E520 VanDerWaalsContact C-N 3.31Å; V518-E520 PolarHBondContact O-N 3.17Å; E520-L522 VanDerWaalsContact C-N 3.26Å; E520-L522 PolarHBondContact O-N 2.85Å; E520-R523 PolarHBondContact O-N 2.89Å; E520-E524 PolarHBondContact O-N 3.31Å
521	R	77.4	Confident	78.7	Confident	146 Å²	146	61 Å²	61	55%	0.551	34%	0.335	S	S	*	.	H	α-helix	trans	-59.5	-34.7	177.5	-85.6	-179.2	-69.7	168.9	0.5	113.4	S517 V518 R523 E524 T525	S517-R521 VanDerWaalsContact O-CZ 3.23Å; S517-R521 PolarHBondContact O-NE 3.1Å; S517-R521 PolarHBondContact O-NH2 3.08Å; V518-R521 PolarHBondContact O-N 3.31Å; R521-R523 VanDerWaalsContact C-N 3.26Å; R521-R523 PolarHBondContact O-N 3.43Å; R521-E524 PolarHBondContact O-N 2.95Å; R521-T525 PolarHBondContact O-N 3.08Å; R521-T525 PolarHBondContact O-OG1 3.45Å
522	L	74.9	Confident	78.6	Confident	15 Å²	15	62.8 Å²	62.8	8%	0.079	34%	0.344	C	S	.	.	H	α-helix	trans	-58.9	-33.1	173	-100.6	160.9	0	0	0	113.2	Y500 I504 V518 E520 P529 L546	Y500-L522 PolarHBondContact OH-O 2.74Å; I504-L522 HydrophobicContact CD1-CD1 3.64Å; I504-L522 HydrophobicContact CD1-CD2 3.9Å; I504-L522 HydrophobicContact CD1-CG 4.3Å; V518-L522 HydrophobicContact CG1-CD1 4.14Å; V518-L522 WeakPolarHBondContact O-CB 3.39Å; V518-L522 PolarHBondContact O-N 3.34Å; V518-L522 VanDerWaalsContact O-N 3.12Å; E520-L522 VanDerWaalsContact C-N 3.26Å; E520-L522 PolarHBondContact O-N 2.85Å; L522-P529 HydrophobicContact CD1-CG 4.07Å; L522-P529 VanDerWaalsContact CD2-CD 3.44Å; L522-P529 HydrophobicContact CD2-CG 3.76Å; L522-P529 HydrophobicContact CG-CG 3.84Å; L522-L546 HydrophobicContact CD2-CD1 4.23Å
523	R	74.8	Confident	78.7	Confident	51 Å²	51	65.6 Å²	65.6	19%	0.192	36%	0.36	C	S	.	.	H	α-helix	trans	-81.5	-45.3	168.9	-60.6	-167.8	-120.1	176.5	6.6	110.9	G478 L481 P482 R483 W519 E520 R521 T525	G478-R523 PolarHBondContact O-NE 3.2Å; G478-R523 PolarHBondContact O-NH2 2.93Å; L481-R523 VanDerWaalsContact O-CD 3.24Å; L481-R523 WeakPolarHBondContact O-CD 3.27Å; L481-R523 VanDerWaalsContact O-CG 3.31Å; L481-R523 WeakPolarHBondContact O-CG 3.33Å; P482-R523 WeakPolarHBondContact O-CD 3.35Å; R483-R523 WeakPolarHBondContact CD-O 3.44Å; R483-R523 HydrophobicContact CG-CB 4.32Å; R483-R523 WeakPolarHBondContact CG-O 3.5Å; R483-R523 PolarHBondContact NE-O 3.15Å; W519-R523 VanDerWaalsContact CE3-NH2 3.29Å; W519-R523 PolarHBondContact O-N 3.2Å; E520-R523 PolarHBondContact O-N 2.89Å; R521-R523 VanDerWaalsContact C-N 3.26Å; R521-R523 PolarHBondContact O-N 3.43Å; R523-T525 PolarHBondContact O-N 2.85Å
524	E	70.2	Confident	79	Confident	139 Å²	139	62.9 Å²	62.9	65%	0.65	34%	0.343	S	S	*	.	H	α-helix	trans	-83.2	-9.9	-163.5	-66.6	-160.7	153.6	0	0	116.4	R483 E520 R521	R483-E524 PolarHBondContact NH2-O 2.74Å; E520-E524 PolarHBondContact O-N 3.31Å; R521-E524 PolarHBondContact O-N 2.95Å
525	T	60.3	Low	79.4	Confident	57 Å²	57	63 Å²	63	35%	0.35	35%	0.345	S	S	.	.			trans	-139.7	154.6	-175.1	61.6	0	0	0	0	114.9	R521 R523 C527	R521-T525 PolarHBondContact O-N 3.08Å; R521-T525 PolarHBondContact O-OG1 3.45Å; R523-T525 PolarHBondContact O-N 2.85Å; T525-C527 PolarHBondContact O-N 3.45Å; T525-C527 WeakPolarHBondContact OG1-CB 3.28Å; T525-C527 PolarHBondContact OG1-N 3.21Å; T525-C527 PolarHBondContact OG1-O 3.12Å
526	D	61.4	Low	79.9	Confident	139 Å²	139	62.6 Å²	62.6	74%	0.743	35%	0.35	S	S	*	.	S	Bend	trans	-66.5	-7.6	162.7	-83.1	-56.6	0	0	0	112.8	L528	D526-L528 PolarHBondContact O-N 3.41Å
527	C	63.8	Low	80.4	Confident	96 Å²	96	62.3 Å²	62.3	65%	0.649	35%	0.346	S	S	*	.			trans	-78.5	85.6	173.7	-62.7	0	0	0	0	110.3	T525	T525-C527 PolarHBondContact O-N 3.45Å; T525-C527 WeakPolarHBondContact OG1-CB 3.28Å; T525-C527 PolarHBondContact OG1-N 3.21Å; T525-C527 PolarHBondContact OG1-O 3.12Å
528	L	70.3	Confident	81.1	Confident	59 Å²	59	59.4 Å²	59.4	31%	0.309	33%	0.326	S	S	.	.			trans	-46.5	142.8	164.7	-71.3	160.8	0	0	0	110.8	D526 K543 L546	D526-L528 PolarHBondContact O-N 3.41Å; L528-K543 HydrophobicContact CD1-CD 3.85Å; L528-K543 HydrophobicContact CD1-CG 3.71Å; L528-L546 HydrophobicContact CD2-CB 3.7Å
529	P	71.9	Confident	81.7	Confident	28 Å²	28	63.1 Å²	63.1	18%	0.182	34%	0.338	C	S	.	.			trans	-65.1	169.8	175.2	31.9	-37.4	0	0	0	110.3	Y507 L522 L531	Y507-P529 HydrophobicContact CE2-CG 4.36Å; L522-P529 HydrophobicContact CD1-CG 4.07Å; L522-P529 VanDerWaalsContact CD2-CD 3.44Å; L522-P529 HydrophobicContact CD2-CG 3.76Å; L522-P529 HydrophobicContact CG-CG 3.84Å; P529-L531 HydrophobicContact CG-CD2 3.97Å; P529-L531 WeakPolarHBondContact O-CG 3.46Å; P529-L531 PolarHBondContact O-N 3.11Å
530	D	82.5	Confident	82.4	Confident	111 Å²	111	63.8 Å²	63.8	59%	0.594	35%	0.349	S	S	*	.			trans	-64.5	107	173.2	-178.8	21.2	0	0	0	110.8	Y507 S532	Y507-D530 WeakPolarHBondContact CE2-O 3.41Å; D530-S532 PolarHBondContact O-N 3.28Å; D530-S532 WeakPolarHBondContact OD1-CB 3.36Å; D530-S532 PolarHBondContact OD1-N 3.19Å; D530-S532 PolarHBondContact OD1-OG 3.31Å; D530-S532 VanDerWaalsContact OD2-CB 3.28Å; D530-S532 WeakPolarHBondContact OD2-CB 3.22Å; D530-S532 PolarHBondContact OD2-OG 2.97Å
531	L	90.3	Very high	83.1	Confident	13 Å²	13	59.9 Å²	59.9	7%	0.068	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-85.9	13.6	176.7	-54.8	-177.2	0	0	0	112.3	Y507 P529 V533 L534 R539 K543 L546	Y507-L531 HydrophobicContact CD2-CD2 3.71Å; Y507-L531 HydrophobicContact CE2-CD2 4Å; P529-L531 HydrophobicContact CG-CD2 3.97Å; P529-L531 WeakPolarHBondContact O-CG 3.46Å; P529-L531 PolarHBondContact O-N 3.11Å; L531-V533 PolarHBondContact O-N 3.38Å; L531-L534 HydrophobicContact CB-CD1 4.19Å; L531-L534 HydrophobicContact CD2-CD1 4.01Å; L531-L534 WeakPolarHBondContact O-CB 3.46Å; L531-L534 PolarHBondContact O-N 3.33Å; L531-L534 VanDerWaalsContact O-N 3.07Å; L531-R539 HydrophobicContact CB-CG 3.78Å; L531-R539 HydrophobicContact CD1-CG 4.33Å; L531-R539 PolarHBondContact O-NE 3.45Å; L531-K543 HydrophobicContact CD1-CB 4.08Å; L531-L546 HydrophobicContact CD2-CD1 4.25Å
532	S	92.1	Very high	83.9	Confident	65 Å²	65	53 Å²	53	46%	0.455	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-51.7	-40.4	175.5	63.3	0	0	0	0	112.8	D530 L534 R539	D530-S532 PolarHBondContact O-N 3.28Å; D530-S532 WeakPolarHBondContact OD1-CB 3.36Å; D530-S532 PolarHBondContact OD1-N 3.19Å; D530-S532 PolarHBondContact OD1-OG 3.31Å; D530-S532 VanDerWaalsContact OD2-CB 3.28Å; D530-S532 WeakPolarHBondContact OD2-CB 3.22Å; D530-S532 PolarHBondContact OD2-OG 2.97Å; S532-L534 PolarHBondContact O-N 3.01Å; S532-L534 VanDerWaalsContact O-N 3.17Å; S532-R539 PolarHBondContact O-NH2 3.33Å
533	V	93.8	Very high	84.8	Confident	58 Å²	58	57.7 Å²	57.7	35%	0.352	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-57.7	-25.5	177.8	-61.3	0	0	0	0	114	Y507 L531	Y507-V533 HydrophobicContact CD2-CG2 3.86Å; Y507-V533 HydrophobicContact CE2-CG2 3.66Å; L531-V533 PolarHBondContact O-N 3.38Å
534	L	95.6	Very high	85.7	Confident	2 Å²	2	57 Å²	57	1%	0.01	33%	0.328	C	S	.	.	S	Bend	trans	-81.8	140.9	177.6	-77.8	157.1	0	0	0	111.1	Y507 A510 L531 S532 L538 R539 V542	Y507-L534 HydrophobicContact CD2-CD1 4.11Å; A510-L534 HydrophobicContact CB-CD2 3.75Å; A510-L534 HydrophobicContact CB-CG 4.15Å; L531-L534 HydrophobicContact CB-CD1 4.19Å; L531-L534 HydrophobicContact CD2-CD1 4.01Å; L531-L534 WeakPolarHBondContact O-CB 3.46Å; L531-L534 PolarHBondContact O-N 3.33Å; L531-L534 VanDerWaalsContact O-N 3.07Å; S532-L534 PolarHBondContact O-N 3.01Å; S532-L534 VanDerWaalsContact O-N 3.17Å; L534-L538 HydrophobicContact CD2-CD2 3.96Å; L534-L538 HydrophobicContact CD2-CG 4.37Å; L534-R539 HydrophobicContact CB-CB 4.36Å; L534-R539 HydrophobicContact CB-CG 4.5Å; L534-R539 PolarHBondContact O-NE 3.43Å; L534-R539 PolarHBondContact O-NH2 2.88Å; L534-V542 HydrophobicContact CD1-CB 3.86Å; L534-V542 HydrophobicContact CD1-CG1 3.65Å; L534-V542 HydrophobicContact CD1-CG2 4.15Å; L534-V542 HydrophobicContact CD2-CG2 4.19Å
535	P	95.6	Very high	86.9	Confident	23 Å²	23	50.5 Å²	50.5	15%	0.149	30%	0.297	C	S	.	.			trans	-52.9	146	171.9	-23.5	30.8	0	0	0	112.8	E382 L385 S537 L538 R539	E382-P535 HydrophobicContact CB-CB 3.9Å; E382-P535 HydrophobicContact CB-CG 3.73Å; E382-P535 HydrophobicContact CG-CB 3.7Å; E382-P535 HydrophobicContact CG-CG 3.98Å; L385-P535 HydrophobicContact CD1-CG 3.92Å; P535-S537 PolarHBondContact O-N 2.87Å; P535-L538 HydrophobicContact CB-CB 4.36Å; P535-L538 PolarHBondContact O-N 3Å; P535-L538 VanDerWaalsContact O-N 3.07Å; P535-R539 WeakPolarHBondContact O-CB 3.44Å; P535-R539 PolarHBondContact O-N 3.1Å
536	G	95	Very high	88.5	Confident	51 Å²	51	48 Å²	48	53%	0.526	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-31.2	-175.8	0	0	0	0	0	114.3	P540	G536-P540 WeakPolarHBondContact O-CD 3.47Å
537	S	94.2	Very high	89.9	Confident	40 Å²	40	47.3 Å²	47.3	28%	0.28	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-39.9	174.6	55.4	0	0	0	0	113.4	E382 P535 P540	E382-S537 VanDerWaalsContact CD-OG 3.23Å; E382-S537 VanDerWaalsContact OE1-CB 3.3Å; E382-S537 WeakPolarHBondContact OE1-CB 3.42Å; E382-S537 PolarHBondContact OE1-OG 3.45Å; P535-S537 PolarHBondContact O-N 2.87Å; S537-P540 WeakPolarHBondContact O-CD 3.42Å
538	L	95.3	Very high	91	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-28.1	-173.8	-175.4	59.7	0	0	0	112.7	L385 L534 P535 P540 A541 V542 L564 F565	L385-L538 HydrophobicContact CB-CD2 3.66Å; L385-L538 HydrophobicContact CD1-CD2 4.26Å; L385-L538 HydrophobicContact CG-CD2 4.46Å; L534-L538 HydrophobicContact CD2-CD2 3.96Å; L534-L538 HydrophobicContact CD2-CG 4.37Å; P535-L538 HydrophobicContact CB-CB 4.36Å; P535-L538 PolarHBondContact O-N 3Å; P535-L538 VanDerWaalsContact O-N 3.07Å; L538-P540 VanDerWaalsContact C-CD 3.46Å; L538-A541 PolarHBondContact O-N 3.36Å; L538-A541 VanDerWaalsContact O-N 3.11Å; L538-V542 HydrophobicContact CD1-CG2 4.26Å; L538-V542 HydrophobicContact CG-CG2 3.97Å; L538-V542 PolarHBondContact O-N 3.09Å; L538-L564 HydrophobicContact CB-CD2 4.41Å; L538-L564 HydrophobicContact CD1-CD2 4.08Å; L538-F565 HydrophobicContact CD1-CE1 3.69Å; L538-F565 HydrophobicContact CD1-CZ 3.68Å
539	R	95.3	Very high	91.9	Very high	94 Å²	94	43.7 Å²	43.7	36%	0.355	25%	0.245	S	C	.	.	H	α-helix	trans	-53.1	-40.4	-177.2	-163.3	-177.9	-62.5	135.5	-2.4	114.5	L531 S532 L534 P535 K543	L531-R539 HydrophobicContact CB-CG 3.78Å; L531-R539 HydrophobicContact CD1-CG 4.33Å; L531-R539 PolarHBondContact O-NE 3.45Å; S532-R539 PolarHBondContact O-NH2 3.33Å; L534-R539 HydrophobicContact CB-CB 4.36Å; L534-R539 HydrophobicContact CB-CG 4.5Å; L534-R539 PolarHBondContact O-NE 3.43Å; L534-R539 PolarHBondContact O-NH2 2.88Å; P535-R539 WeakPolarHBondContact O-CB 3.44Å; P535-R539 PolarHBondContact O-N 3.1Å; R539-K543 VanDerWaalsContact O-CB 3.23Å; R539-K543 WeakPolarHBondContact O-CB 3.47Å; R539-K543 PolarHBondContact O-N 3Å
540	P	94.5	Very high	92.9	Very high	68 Å²	68	42.4 Å²	42.4	44%	0.442	24%	0.237	S	C	.	.	H	α-helix	trans	-65	-39.2	176.7	-22	34.7	0	0	0	113.3	G536 S537 L538 K543 S544	G536-P540 WeakPolarHBondContact O-CD 3.47Å; S537-P540 WeakPolarHBondContact O-CD 3.42Å; L538-P540 VanDerWaalsContact C-CD 3.46Å; P540-K543 PolarHBondContact O-N 2.91Å; P540-S544 PolarHBondContact O-N 3.16Å
541	A	95	Very high	93.4	Very high	3 Å²	3	42.3 Å²	42.3	3%	0.025	23%	0.233	C	C	.	.	H	α-helix	trans	-70.7	-44	178.8	0	0	0	0	0	111.6	L538 K543 S544 L545 F565	L538-A541 PolarHBondContact O-N 3.36Å; L538-A541 VanDerWaalsContact O-N 3.11Å; A541-K543 VanDerWaalsContact C-N 3.28Å; A541-K543 PolarHBondContact O-N 3.11Å; A541-S544 PolarHBondContact O-N 2.87Å; A541-S544 VanDerWaalsContact O-N 3.12Å; A541-S544 PolarHBondContact O-OG 2.89Å; A541-L545 WeakPolarHBondContact O-CG 3.26Å; A541-L545 PolarHBondContact O-N 3.47Å; A541-F565 HydrophobicContact CB-CE2 3.9Å; A541-F565 HydrophobicContact CB-CZ 3.83Å
542	V	95.3	Very high	93.5	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-65.3	-34.6	174.8	178.3	0	0	0	0	111.2	G503 L506 L534 L538 S544 L545 L546	G503-V542 WeakPolarHBondContact O-CG1 3.39Å; L506-V542 HydrophobicContact CB-CG2 3.95Å; L506-V542 HydrophobicContact CD1-CG2 3.99Å; L534-V542 HydrophobicContact CD1-CB 3.86Å; L534-V542 HydrophobicContact CD1-CG1 3.65Å; L534-V542 HydrophobicContact CD1-CG2 4.15Å; L534-V542 HydrophobicContact CD2-CG2 4.19Å; L538-V542 HydrophobicContact CD1-CG2 4.26Å; L538-V542 HydrophobicContact CG-CG2 3.97Å; L538-V542 PolarHBondContact O-N 3.09Å; V542-S544 VanDerWaalsContact C-N 3.28Å; V542-S544 PolarHBondContact O-N 3.08Å; V542-L545 PolarHBondContact O-N 2.82Å; V542-L546 HydrophobicContact CG1-CD1 3.73Å; V542-L546 HydrophobicContact CG1-CG 4.08Å; V542-L546 WeakPolarHBondContact O-CB 3.25Å; V542-L546 WeakPolarHBondContact O-CG 3.49Å; V542-L546 PolarHBondContact O-N 2.9Å
543	K	93.7	Very high	93.7	Very high	115 Å²	115	42.5 Å²	42.5	50%	0.5	23%	0.228	S	C	.	.	H	α-helix	trans	-62.9	-28.3	172.8	177.1	160.7	-178	171.2	0	113.7	L528 L531 R539 P540 A541	L528-K543 HydrophobicContact CD1-CD 3.85Å; L528-K543 HydrophobicContact CD1-CG 3.71Å; L531-K543 HydrophobicContact CD1-CB 4.08Å; R539-K543 VanDerWaalsContact O-CB 3.23Å; R539-K543 WeakPolarHBondContact O-CB 3.47Å; R539-K543 PolarHBondContact O-N 3Å; P540-K543 PolarHBondContact O-N 2.91Å; A541-K543 VanDerWaalsContact C-N 3.28Å; A541-K543 PolarHBondContact O-N 3.11Å
544	S	94.2	Very high	93.7	Very high	35 Å²	35	40.7 Å²	40.7	25%	0.245	22%	0.218	C	C	.	.	H	α-helix	trans	-84.3	-31.8	174.2	68.8	0	0	0	0	112.9	P540 A541 V542 R547 P554	P540-S544 PolarHBondContact O-N 3.16Å; A541-S544 PolarHBondContact O-N 2.87Å; A541-S544 VanDerWaalsContact O-N 3.12Å; A541-S544 PolarHBondContact O-OG 2.89Å; V542-S544 VanDerWaalsContact C-N 3.28Å; V542-S544 PolarHBondContact O-N 3.08Å; S544-R547 WeakPolarHBondContact O-CG 3.41Å; S544-P554 WeakPolarHBondContact O-CD 3.37Å
545	L	94.9	Very high	93.7	Very high	3 Å²	3	42.9 Å²	42.9	2%	0.016	23%	0.231	C	C	.	.	H	α-helix	trans	-62.3	-40	169.6	-66.8	176.1	0	0	0	112.4	L499 L502 L506 A541 V542 R547 R553 L559	L499-L545 HydrophobicContact CB-CD2 4.01Å; L499-L545 HydrophobicContact CD2-CD2 3.83Å; L499-L545 HydrophobicContact CG-CD2 4.47Å; L502-L545 HydrophobicContact CG-CD1 4.41Å; L506-L545 HydrophobicContact CD1-CD1 4.29Å; A541-L545 WeakPolarHBondContact O-CG 3.26Å; A541-L545 PolarHBondContact O-N 3.47Å; V542-L545 PolarHBondContact O-N 2.82Å; L545-R547 PolarHBondContact O-N 2.97Å; L545-R553 VanDerWaalsContact O-CD 3.23Å; L545-R553 WeakPolarHBondContact O-CD 3.32Å; L545-R553 WeakPolarHBondContact O-CG 3.23Å; L545-R553 PolarHBondContact O-NE 3.23Å; L545-L559 HydrophobicContact CD2-CD1 3.59Å; L545-L559 HydrophobicContact CD2-CD2 4.47Å
546	L	92.9	Very high	93.7	Very high	5 Å²	5	42 Å²	42	3%	0.026	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	22.5	-177.5	-62.9	-179.8	0	0	0	114.3	Y500 I504 L522 L528 L531 V542	Y500-L546 HydrophobicContact CD2-CD2 3.94Å; Y500-L546 HydrophobicContact CE2-CD2 3.85Å; Y500-L546 HydrophobicContact CG-CD2 4.41Å; I504-L546 HydrophobicContact CD1-CD2 3.52Å; I504-L546 HydrophobicContact CG1-CD2 3.79Å; L522-L546 HydrophobicContact CD2-CD1 4.23Å; L528-L546 HydrophobicContact CD2-CB 3.7Å; L531-L546 HydrophobicContact CD2-CD1 4.25Å; V542-L546 HydrophobicContact CG1-CD1 3.73Å; V542-L546 HydrophobicContact CG1-CG 4.08Å; V542-L546 WeakPolarHBondContact O-CB 3.25Å; V542-L546 WeakPolarHBondContact O-CG 3.49Å; V542-L546 PolarHBondContact O-N 2.9Å
547	R	91.3	Very high	93.6	Very high	124 Å²	124	41.8 Å²	41.8	47%	0.468	22%	0.216	S	C	.	.			trans	-65.2	142.5	170.2	-76.1	-71.4	-162.4	170.9	6.6	111.1	S544 L545 L549 D552 R553	S544-R547 WeakPolarHBondContact O-CG 3.41Å; L545-R547 PolarHBondContact O-N 2.97Å; R547-L549 PolarHBondContact O-N 3.23Å; R547-D552 HydrophobicContact CB-CB 3.93Å; R547-D552 HydrophobicContact CG-CB 4.1Å; R547-R553 HydrophobicContact CB-CG 3.86Å; R547-R553 VanDerWaalsContact O-CZ 3.27Å; R547-R553 PolarHBondContact O-NE 3.46Å; R547-R553 PolarHBondContact O-NH2 3.05Å
548	P	87.2	Confident	93.6	Very high	33 Å²	33	45 Å²	45	21%	0.214	23%	0.227	C	C	.	.	S	Bend	trans	-62.6	-36.5	-177.4	-26.3	35.7	0	0	0	114.8	R553	P548-R553 VanDerWaalsContact C-NH2 3.28Å; P548-R553 PolarHBondContact O-NH2 3.18Å
549	L	89.4	Confident	93.5	Very high	47 Å²	47	45.3 Å²	45.3	25%	0.246	23%	0.228	C	C	.	.	S	Bend	trans	-103.7	142	179.6	-46.5	-176.9	0	0	0	111.2	R547 Q551 D552 R553	R547-L549 PolarHBondContact O-N 3.23Å; L549-Q551 VanDerWaalsContact C-N 3.32Å; L549-Q551 HydrophobicContact CB-CG 3.96Å; L549-Q551 HydrophobicContact CD1-CG 4.42Å; L549-Q551 PolarHBondContact O-N 3.41Å; L549-D552 PolarHBondContact O-N 2.97Å; L549-D552 VanDerWaalsContact O-N 3.16Å; L549-R553 PolarHBondContact O-N 3.02Å
550	A	92.7	Very high	93.3	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-65.4	-31.9	179	0	0	0	0	0	113.7	D486 R492 D552 R553	D486-A550 WeakPolarHBondContact OD2-CB 3.26Å; D486-A550 PolarHBondContact OD2-N 3.2Å; R492-A550 HydrophobicContact CG-CB 4.34Å; R492-A550 VanDerWaalsContact CZ-O 3.29Å; R492-A550 PolarHBondContact NE-O 2.85Å; R492-A550 PolarHBondContact NH2-O 3.03Å; R492-A550 VanDerWaalsContact NH2-O 3.11Å; R492-A550 WeakPolarHBondContact O-CB 3.14Å; A550-D552 PolarHBondContact O-N 3.32Å; A550-R553 PolarHBondContact O-N 3.44Å
551	Q	92.7	Very high	93	Very high	109 Å²	109	42.8 Å²	42.8	51%	0.509	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-61.9	-28.9	173.1	64.1	175.2	32.5	0	0	113.3	S488 L549	S488-Q551 PolarHBondContact OG-N 2.9Å; L549-Q551 VanDerWaalsContact C-N 3.32Å; L549-Q551 HydrophobicContact CB-CG 3.96Å; L549-Q551 HydrophobicContact CD1-CG 4.42Å; L549-Q551 PolarHBondContact O-N 3.41Å
552	D	93.5	Very high	92.6	Very high	77 Å²	77	47.2 Å²	47.2	41%	0.412	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-88.7	-13.5	-178.2	-58.5	-27.7	0	0	0	112.6	R547 L549 A550	R547-D552 HydrophobicContact CB-CB 3.93Å; R547-D552 HydrophobicContact CG-CB 4.1Å; L549-D552 PolarHBondContact O-N 2.97Å; L549-D552 VanDerWaalsContact O-N 3.16Å; A550-D552 PolarHBondContact O-N 3.32Å
553	R	94.8	Very high	92.3	Very high	6 Å²	6	51.8 Å²	51.8	2%	0.023	26%	0.264	C	S	.	.	S	Bend	trans	-75.1	145	170.4	-61.5	174.2	-162.7	126.1	22.6	108.5	R492 G496 L545 R547 P548 L549 A550	R492-R553 PolarHBondContact NH2-O 2.94Å; G496-R553 VanDerWaalsContact C-NH1 3.3Å; G496-R553 PolarHBondContact O-NH1 2.89Å; L545-R553 VanDerWaalsContact O-CD 3.23Å; L545-R553 WeakPolarHBondContact O-CD 3.32Å; L545-R553 WeakPolarHBondContact O-CG 3.23Å; L545-R553 PolarHBondContact O-NE 3.23Å; R547-R553 HydrophobicContact CB-CG 3.86Å; R547-R553 VanDerWaalsContact O-CZ 3.27Å; R547-R553 PolarHBondContact O-NE 3.46Å; R547-R553 PolarHBondContact O-NH2 3.05Å; P548-R553 VanDerWaalsContact C-NH2 3.28Å; P548-R553 PolarHBondContact O-NH2 3.18Å; L549-R553 PolarHBondContact O-N 3.02Å; A550-R553 PolarHBondContact O-N 3.44Å
554	P	95.7	Very high	92.1	Very high	20 Å²	20	48 Å²	48	13%	0.13	25%	0.25	C	C	.	.	P	Polyproline II helix	trans	-64.4	161.1	170.4	28.4	-34.9	0	0	0	111.3	R492 L499 S544 E558 L559	R492-P554 VanDerWaalsContact NH2-C 3.35Å; R492-P554 PolarHBondContact NH2-O 3.28Å; L499-P554 VanDerWaalsContact CD1-O 3.24Å; L499-P554 WeakPolarHBondContact CD1-O 3.49Å; S544-P554 WeakPolarHBondContact O-CD 3.37Å; P554-E558 WeakPolarHBondContact CA-OE2 3.25Å; P554-E558 HydrophobicContact CB-CB 4.25Å; P554-E558 WeakPolarHBondContact CB-OE2 3.45Å; P554-L559 HydrophobicContact CB-CD2 4.48Å; P554-L559 HydrophobicContact CB-CG 4.17Å; P554-L559 HydrophobicContact CG-CD1 3.97Å; P554-L559 HydrophobicContact CG-CD2 3.8Å; P554-L559 HydrophobicContact CG-CG 3.84Å
555	T	95	Very high	91.9	Very high	47 Å²	47	46.5 Å²	46.5	29%	0.288	24%	0.238	S	C	.	.	P	Polyproline II helix	trans	-77.4	161.8	169.5	67.7	0	0	0	0	111.6	S557 E558 L559	T555-S557 PolarHBondContact O-N 3.26Å; T555-E558 VanDerWaalsContact CB-OE1 3.28Å; T555-E558 WeakPolarHBondContact CB-OE1 3.46Å; T555-E558 WeakPolarHBondContact CG2-OE1 3.49Å; T555-E558 VanDerWaalsContact N-CD 3.3Å; T555-E558 PolarHBondContact N-OE1 3.24Å; T555-E558 PolarHBondContact N-OE2 3.29Å; T555-E558 PolarHBondContact O-N 2.88Å; T555-E558 PolarHBondContact OG1-N 3.46Å; T555-E558 PolarHBondContact OG1-OE1 3.31Å; T555-L559 WeakPolarHBondContact O-CG 3.42Å; T555-L559 PolarHBondContact O-N 2.94Å; T555-L559 VanDerWaalsContact O-N 3.12Å
556	V	95.1	Very high	91.5	Very high	5 Å²	5	54.1 Å²	54.1	3%	0.03	27%	0.267	C	S	.	.	H	α-helix	trans	-60.5	-35.4	173.8	-162.6	0	0	0	0	111	L393 L396 H397 H400 L499 E558 L559 I560	L393-V556 HydrophobicContact CB-CG1 4.39Å; L393-V556 HydrophobicContact CD2-CG1 4.02Å; L393-V556 VanDerWaalsContact O-CG1 3.3Å; L393-V556 WeakPolarHBondContact O-CG1 3.47Å; L396-V556 HydrophobicContact CB-CG1 4.38Å; L396-V556 HydrophobicContact CB-CG2 4.34Å; H397-V556 HydrophobicContact CB-CB 4.36Å; H397-V556 HydrophobicContact CB-CG1 3.7Å; H400-V556 VanDerWaalsContact ND1-CG2 3.34Å; H400-V556 WeakPolarHBondContact ND1-CG2 3.41Å; L499-V556 HydrophobicContact CD1-CG2 4.2Å; L499-V556 HydrophobicContact CD2-CG2 3.98Å; L499-V556 HydrophobicContact CG-CG2 4.26Å; V556-E558 PolarHBondContact O-N 3.05Å; V556-L559 PolarHBondContact O-N 3.21Å; V556-L559 VanDerWaalsContact O-N 3.15Å; V556-I560 HydrophobicContact CG1-CD1 4.43Å; V556-I560 HydrophobicContact CG1-CG1 4.47Å; V556-I560 PolarHBondContact O-N 3.08Å
557	S	93.2	Very high	90.8	Very high	47 Å²	47	61 Å²	61	33%	0.329	30%	0.303	S	S	.	.	H	α-helix	trans	-64	-36.8	178.6	-51.9	0	0	0	0	112.8	H397 T555 N561	H397-S557 PolarHBondContact CE1-OG 2.72Å; T555-S557 PolarHBondContact O-N 3.26Å; S557-N561 PolarHBondContact O-ND2 3.47Å
558	E	94.1	Very high	90.3	Very high	107 Å²	107	58.3 Å²	58.3	50%	0.5	30%	0.296	S	S	.	.	H	α-helix	trans	-67.4	-43.5	170.3	-71.5	142	-126.8	0	0	111.5	P554 T555 V556 N561 Y562	P554-E558 WeakPolarHBondContact CA-OE2 3.25Å; P554-E558 HydrophobicContact CB-CB 4.25Å; P554-E558 WeakPolarHBondContact CB-OE2 3.45Å; T555-E558 VanDerWaalsContact CB-OE1 3.28Å; T555-E558 WeakPolarHBondContact CB-OE1 3.46Å; T555-E558 WeakPolarHBondContact CG2-OE1 3.49Å; T555-E558 VanDerWaalsContact N-CD 3.3Å; T555-E558 PolarHBondContact N-OE1 3.24Å; T555-E558 PolarHBondContact N-OE2 3.29Å; T555-E558 PolarHBondContact O-N 2.88Å; T555-E558 PolarHBondContact OG1-N 3.46Å; T555-E558 PolarHBondContact OG1-OE1 3.31Å; V556-E558 PolarHBondContact O-N 3.05Å; E558-N561 PolarHBondContact O-N 2.81Å; E558-Y562 PolarHBondContact O-N 2.83Å
559	L	94	Very high	89.7	Confident	6 Å²	6	57.5 Å²	57.5	3%	0.031	29%	0.29	C	S	.	.	H	α-helix	trans	-66.8	-41	-176.9	-72.3	162.6	0	0	0	113.1	L393 L499 L545 P554 T555 V556 N561 Y562 F565	L393-L559 HydrophobicContact CD1-CB 4.01Å; L393-L559 HydrophobicContact CD2-CB 3.88Å; L393-L559 HydrophobicContact CD2-CD1 3.76Å; L393-L559 HydrophobicContact CD2-CG 4.43Å; L499-L559 HydrophobicContact CD2-CD1 3.58Å; L545-L559 HydrophobicContact CD2-CD1 3.59Å; L545-L559 HydrophobicContact CD2-CD2 4.47Å; P554-L559 HydrophobicContact CB-CD2 4.48Å; P554-L559 HydrophobicContact CB-CG 4.17Å; P554-L559 HydrophobicContact CG-CD1 3.97Å; P554-L559 HydrophobicContact CG-CD2 3.8Å; P554-L559 HydrophobicContact CG-CG 3.84Å; T555-L559 WeakPolarHBondContact O-CG 3.42Å; T555-L559 PolarHBondContact O-N 2.94Å; T555-L559 VanDerWaalsContact O-N 3.12Å; V556-L559 PolarHBondContact O-N 3.21Å; V556-L559 VanDerWaalsContact O-N 3.15Å; L559-N561 PolarHBondContact O-N 2.93Å; L559-Y562 WeakPolarHBondContact O-CB 3.49Å; L559-Y562 PolarHBondContact O-N 2.82Å; L559-F565 HydrophobicContact CD2-CE2 4.41Å; L559-F565 WeakPolarHBondContact O-CD2 3.24Å
560	I	91	Very high	88.4	Confident	13 Å²	13	60.3 Å²	60.3	7%	0.067	31%	0.305	C	S	.	.	H	α-helix	trans	-62.5	-33.6	175.5	-79.1	-175.8	0	0	0	112	L393 H397 V556 Y562 R566 V569	L393-I560 HydrophobicContact CB-CG1 4.1Å; H397-I560 HydrophobicContact CB-CD1 3.36Å; V556-I560 HydrophobicContact CG1-CD1 4.43Å; V556-I560 HydrophobicContact CG1-CG1 4.47Å; V556-I560 PolarHBondContact O-N 3.08Å; I560-Y562 VanDerWaalsContact C-N 3.25Å; I560-Y562 PolarHBondContact O-N 3.01Å; I560-R566 WeakPolarHBondContact O-CB 3.36Å; I560-V569 HydrophobicContact CD1-CG1 4.08Å; I560-V569 HydrophobicContact CG1-CG1 4.34Å; I560-V569 HydrophobicContact CG1-CG2 4.22Å; I560-V569 HydrophobicContact CG2-CB 4.47Å; I560-V569 HydrophobicContact CG2-CG1 4.08Å; I560-V569 HydrophobicContact CG2-CG2 4.31Å
561	N	87.2	Confident	86.4	Confident	96 Å²	96	65.2 Å²	65.2	51%	0.513	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-8.2	176.3	-76.7	-72.2	0	0	0	113.4	S557 E558 L559	S557-N561 PolarHBondContact O-ND2 3.47Å; E558-N561 PolarHBondContact O-N 2.81Å; L559-N561 PolarHBondContact O-N 2.93Å
562	Y	87.6	Confident	84.1	Confident	97 Å²	97	68.9 Å²	68.9	38%	0.38	34%	0.344	S	S	.	.	S	Bend	trans	-65.8	128.5	177.4	-158.4	-105.4	0	0	0	110.4	E558 L559 I560 L564 F565 R566	E558-Y562 PolarHBondContact O-N 2.83Å; L559-Y562 WeakPolarHBondContact O-CB 3.49Å; L559-Y562 PolarHBondContact O-N 2.82Å; I560-Y562 VanDerWaalsContact C-N 3.25Å; I560-Y562 PolarHBondContact O-N 3.01Å; Y562-L564 HydrophobicContact CD1-CB 3.86Å; Y562-L564 HydrophobicContact CE1-CB 4.16Å; Y562-L564 PolarHBondContact O-N 2.94Å; Y562-F565 HydrophobicContact CD1-CD2 4.27Å; Y562-F565 HydrophobicContact CD1-CE2 4.21Å; Y562-F565 PolarHBondContact O-N 3.27Å; Y562-R566 PolarHBondContact O-N 2.93Å; Y562-R566 VanDerWaalsContact O-N 3.09Å
563	P	87.8	Confident	81.4	Confident	96 Å²	96	70.2 Å²	70.2	62%	0.623	36%	0.36	S	S	*	.	H	α-helix	trans	-55.9	-30.9	-168.9	-30	35.8	0	0	0	115.5	F565	P563-F565 VanDerWaalsContact C-N 3.34Å; P563-F565 PolarHBondContact O-N 3.33Å
564	L	90.5	Very high	78.4	Confident	36 Å²	36	76 Å²	76	19%	0.188	39%	0.391	C	S	.	.	H	α-helix	trans	-62.6	-38.6	178.3	-168.4	67.9	0	0	0	112.7	I386 L538 Y562	I386-L564 HydrophobicContact CD1-CD1 3.67Å; I386-L564 HydrophobicContact CD1-CG 4.15Å; I386-L564 HydrophobicContact CG1-CD1 4.15Å; I386-L564 HydrophobicContact CG1-CD2 4.21Å; I386-L564 HydrophobicContact CG1-CG 4.06Å; I386-L564 HydrophobicContact CG2-CG 4.24Å; I386-L564 VanDerWaalsContact CG2-O 3.3Å; I386-L564 WeakPolarHBondContact CG2-O 3.49Å; L538-L564 HydrophobicContact CB-CD2 4.41Å; L538-L564 HydrophobicContact CD1-CD2 4.08Å; Y562-L564 HydrophobicContact CD1-CB 3.86Å; Y562-L564 HydrophobicContact CE1-CB 4.16Å; Y562-L564 PolarHBondContact O-N 2.94Å
565	F	90.3	Very high	75.6	Confident	3 Å²	3	78.7 Å²	78.7	1%	0.013	40%	0.404	C	S	.	.	H	α-helix	trans	-94.9	-37.9	-173.7	-55.2	-48.9	0	0	0	111.9	I386 A389 S390 L393 L538 A541 L559 Y562 P563 L567 H568 V569	I386-F565 HydrophobicContact CG2-CD1 4.37Å; A389-F565 HydrophobicContact CB-CD1 3.86Å; A389-F565 HydrophobicContact CB-CE1 3.4Å; A389-F565 VanDerWaalsContact CB-CE1 3.4Å; A389-F565 HydrophobicContact CB-CZ 4.06Å; S390-F565 VanDerWaalsContact OG-CA 3.32Å; S390-F565 WeakPolarHBondContact OG-CA 3.47Å; S390-F565 PolarHBondContact OG-O 3.07Å; L393-F565 HydrophobicContact CD1-CB 4.38Å; L393-F565 HydrophobicContact CD1-CD1 4.48Å; L393-F565 HydrophobicContact CD1-CD2 3.6Å; L393-F565 HydrophobicContact CD1-CE2 3.94Å; L393-F565 HydrophobicContact CD1-CG 3.91Å; L538-F565 HydrophobicContact CD1-CE1 3.69Å; L538-F565 HydrophobicContact CD1-CZ 3.68Å; A541-F565 HydrophobicContact CB-CE2 3.9Å; A541-F565 HydrophobicContact CB-CZ 3.83Å; L559-F565 HydrophobicContact CD2-CE2 4.41Å; L559-F565 WeakPolarHBondContact O-CD2 3.24Å; Y562-F565 HydrophobicContact CD1-CD2 4.27Å; Y562-F565 HydrophobicContact CD1-CE2 4.21Å; Y562-F565 PolarHBondContact O-N 3.27Å; P563-F565 VanDerWaalsContact C-N 3.34Å; P563-F565 PolarHBondContact O-N 3.33Å; F565-L567 PolarHBondContact O-N 3.02Å; F565-H568 PolarHBondContact O-N 3.34Å; F565-V569 HydrophobicContact CB-CG2 4.45Å; F565-V569 PolarHBondContact O-N 3.45Å
566	R	84.8	Confident	72.7	Confident	163 Å²	163	81.7 Å²	81.7	62%	0.615	43%	0.425	S	S	*	.	H	α-helix	trans	-50.8	-30.4	-175.2	-170.2	174.6	177	173.1	0.6	114.7	I560 Y562 H568	I560-R566 WeakPolarHBondContact O-CB 3.36Å; Y562-R566 PolarHBondContact O-N 2.93Å; Y562-R566 VanDerWaalsContact O-N 3.09Å; R566-H568 PolarHBondContact O-N 2.95Å
567	L	80.1	Confident	69.8	Low	150 Å²	150	84.8 Å²	84.8	79%	0.785	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-17.9	176.5	-65.3	173.5	0	0	0	114.5	F565	F565-L567 PolarHBondContact O-N 3.02Å
568	H	79.3	Confident	67.1	Low	67 Å²	67	87.8 Å²	87.8	31%	0.31	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.3	-4.8	-175.4	-53.5	98.2	0	0	0	113.3	F565 R566 N570	F565-H568 PolarHBondContact O-N 3.34Å; R566-H568 PolarHBondContact O-N 2.95Å; H568-N570 PolarHBondContact O-N 2.98Å
569	V	75	Confident	64.2	Low	16 Å²	16	90.2 Å²	90.2	10%	0.097	48%	0.479	C	S	.	.			trans	-78.4	105.2	171.5	-172.9	0	0	0	0	108.3	I560 F565 V571	I560-V569 HydrophobicContact CD1-CG1 4.08Å; I560-V569 HydrophobicContact CG1-CG1 4.34Å; I560-V569 HydrophobicContact CG1-CG2 4.22Å; I560-V569 HydrophobicContact CG2-CB 4.47Å; I560-V569 HydrophobicContact CG2-CG1 4.08Å; I560-V569 HydrophobicContact CG2-CG2 4.31Å; F565-V569 HydrophobicContact CB-CG2 4.45Å; F565-V569 PolarHBondContact O-N 3.45Å; V569-V571 HydrophobicContact CB-CG2 4.28Å; V569-V571 HydrophobicContact CG1-CG2 3.43Å; V569-V571 VanDerWaalsContact CG1-CG2 3.43Å; V569-V571 PolarHBondContact O-N 2.85Å
570	N	62.1	Low	61.2	Low	106 Å²	106	96.5 Å²	96.5	57%	0.567	51%	0.512	S	S	*	.			trans	-82	63.1	-176.8	-154.7	-16	0	0	0	111	H568 R572	H568-N570 PolarHBondContact O-N 2.98Å; N570-R572 VanDerWaalsContact C-N 3.33Å; N570-R572 PolarHBondContact O-N 3.35Å
571	V	50.5	Low	58.4	Low	103 Å²	103	103.1 Å²	103.1	62%	0.624	55%	0.548	S	S	*	.			trans	-68.3	89.5	176.8	-171	0	0	0	0	109	V569 S573	V569-V571 HydrophobicContact CB-CG2 4.28Å; V569-V571 HydrophobicContact CG1-CG2 3.43Å; V569-V571 VanDerWaalsContact CG1-CG2 3.43Å; V569-V571 PolarHBondContact O-N 2.85Å; V571-S573 PolarHBondContact O-N 3.08Å
572	R	44.7	Very low	55.8	Low	185 Å²	185	104.8 Å²	104.8	70%	0.698	56%	0.555	S	S	*	*			trans	-70.6	121.4	162.8	-73.4	-174.9	166.9	-156.9	-8	108.1	N570 D574	N570-R572 VanDerWaalsContact C-N 3.33Å; N570-R572 PolarHBondContact O-N 3.35Å; R572-D574 PolarHBondContact O-N 3.22Å; R572-D574 VanDerWaalsContact O-N 3.13Å
573	S	35.8	Very low	53	Low	106 Å²	106	102.6 Å²	102.6	74%	0.741	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	-6.4	171.4	42.9	0	0	0	0	113.9	V571	V571-S573 PolarHBondContact O-N 3.08Å
574	D	32.6	Very low	50.1	Low	127 Å²	127	104 Å²	104	68%	0.679	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.8	19.7	-159.4	-39.9	-29.5	0	0	0	113	R572 P576	R572-D574 PolarHBondContact O-N 3.22Å; R572-D574 VanDerWaalsContact O-N 3.13Å; D574-P576 WeakPolarHBondContact O-CD 3.41Å
575	D	37.7	Very low	47.1	Very low	76 Å²	76	107 Å²	107	41%	0.406	60%	0.598	S	S	.	*	S	Bend	trans	-84.5	98.7	155.1	-94.7	-56.1	0	0	0	106.6	C577	D575-C577 PolarHBondContact O-N 2.76Å
576	P	33.1	Very low	44.4	Very low	111 Å²	111	116.1 Å²	116.1	72%	0.721	66%	0.662	S	S	*	*			trans	-67.2	111.7	178.9	28.2	-34.4	0	0	0	108.9	D574 P578	D574-P576 WeakPolarHBondContact O-CD 3.41Å; P576-P578 VanDerWaalsContact O-CD 3.31Å; P576-P578 WeakPolarHBondContact O-CD 3.24Å
577	C	34.5	Very low	42.4	Very low	69 Å²	69	113.8 Å²	113.8	47%	0.466	66%	0.664	S	S	.	*			trans	-52	124	152.7	-85.1	0	0	0	0	106.9	D575 L579	D575-C577 PolarHBondContact O-N 2.76Å; C577-L579 PolarHBondContact O-N 3.07Å
578	P	36.3	Very low	40.4	Very low	110 Å²	110	111.9 Å²	111.9	71%	0.714	66%	0.658	S	S	*	*			trans	-70.3	83.3	168.1	30.1	-32.6	0	0	0	107.2	P576 L580	P576-P578 VanDerWaalsContact O-CD 3.31Å; P576-P578 WeakPolarHBondContact O-CD 3.24Å; P578-L580 PolarHBondContact O-N 3.18Å
579	L	33.3	Very low	38.2	Very low	158 Å²	158	114.4 Å²	114.4	83%	0.827	68%	0.677	S	S	*	*			trans	-64.4	76.1	155.5	-79.2	168.2	0	0	0	106.8	C577 D581	C577-L579 PolarHBondContact O-N 3.07Å; L579-D581 PolarHBondContact O-N 3.16Å
580	L	31.8	Very low	36.1	Very low	138 Å²	138	120.2 Å²	120.2	72%	0.723	71%	0.711	S	S	*	*			trans	-59.1	90.8	146.4	-74.5	169	0	0	0	105	P578 I582	P578-L580 PolarHBondContact O-N 3.18Å; L580-I582 HydrophobicContact CB-CD1 4.46Å; L580-I582 HydrophobicContact CB-CG1 3.96Å; L580-I582 PolarHBondContact O-N 3.17Å
581	D	30.5	Very low	34.4	Very low	153 Å²	153	121.1 Å²	121.1	82%	0.818	72%	0.72	S	S	*	*			trans	-67	78.3	164.8	-167.7	14.5	0	0	0	106.6	L579 G583	L579-D581 PolarHBondContact O-N 3.16Å; D581-G583 PolarHBondContact O-N 2.88Å
582	I	33.3	Very low	33.4	Very low	130 Å²	130	122.3 Å²	122.3	67%	0.667	73%	0.726	S	S	*	*			trans	-72	81.2	174.2	-56.5	-179.5	0	0	0	105.4	L580 C584	L580-I582 HydrophobicContact CB-CD1 4.46Å; L580-I582 HydrophobicContact CB-CG1 3.96Å; L580-I582 PolarHBondContact O-N 3.17Å; I582-C584 VanDerWaalsContact C-N 3.32Å; I582-C584 PolarHBondContact O-N 3.43Å
583	G	28.9	Very low	32.5	Very low	52 Å²	52	117.8 Å²	117.8	54%	0.536	73%	0.729	S	S	.	*			trans	-59.2	96.5	171.5	0	0	0	0	0	109.1	D581 S585	D581-G583 PolarHBondContact O-N 2.88Å; G583-S585 PolarHBondContact O-N 2.6Å
584	C	27.6	Very low	32.3	Very low	126 Å²	126	118.7 Å²	118.7	85%	0.851	73%	0.728	S	S	*	*			trans	-69.9	63.6	161.2	-70.7	0	0	0	0	109.1	I582	I582-C584 VanDerWaalsContact C-N 3.32Å; I582-C584 PolarHBondContact O-N 3.43Å
585	S	27.8	Very low	32.3	Very low	99 Å²	99	118 Å²	118	69%	0.692	73%	0.732	S	S	*	*			trans	-81.1	112.9	167.4	55.2	0	0	0	0	108.6	G583	G583-S585 PolarHBondContact O-N 2.6Å
586	S	32.7	Very low	31.8	Very low	194 Å²	194	121.8 Å²	121.8	100%	1.357	76%	0.761	S	S	*	*			trans	57.5	0	177.9	68.5	0	0	0	0	116.5

Retrieved 586 of 586 residues in 840.6 ms (Link to these results)

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