A0A087Y4Q9_POEFO Loading...

Adenosine deaminase RNA specific B2 (inactive)

AlphaFold DB , UniProt , Accession A0A087Y4Q9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 709 aa.

Structure Viewer

Loading PAE data...

(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	S	34.8	Very low	32.4	Very low	177 Å²	177	141.9 Å²	141.9	100%	1.238	82%	0.824	S	S	*	*				0	119	0	31.8	0	0	0	0	107.5
2	S	32.7	Very low	32.1	Very low	102 Å²	102	139.1 Å²	139.1	71%	0.713	82%	0.818	S	S	*	*			cis	-115	160.5	-4.9	57	0	0	0	0	108.2
3	T	36.5	Very low	31.8	Very low	116 Å²	116	137.2 Å²	137.2	71%	0.712	82%	0.817	S	S	*	*			cis	55.1	136.5	48.7	69.3	0	0	0	0	111.7
4	E	37.6	Very low	31.5	Very low	185 Å²	185	134.1 Å²	134.1	86%	0.864	81%	0.814	S	S	*	*			cis	-133.1	177.9	19.7	-67.4	168	142.2	0	0	112.9
5	D	37.2	Very low	31.3	Very low	159 Å²	159	136.5 Å²	136.5	85%	0.85	81%	0.813	S	S	*	*			trans	-93.2	172.5	-175.2	-49.4	-92.4	0	0	0	113.8
6	E	33.8	Very low	31.1	Very low	189 Å²	189	137 Å²	137	88%	0.883	82%	0.817	S	S	*	*			trans	-164	144	142.9	-111	-72.7	88.5	0	0	110.3
7	D	32.5	Very low	30.8	Very low	143 Å²	143	139.8 Å²	139.8	77%	0.765	82%	0.816	S	S	*	*			trans	-102.2	165	-171	-121.8	-41.3	0	0	0	112.5
8	S	28.5	Very low	30.7	Very low	99 Å²	99	141 Å²	141	69%	0.692	81%	0.812	S	S	*	*			trans	173.3	122.4	133.6	39.9	0	0	0	0	116.4
9	L	29.1	Very low	30.4	Very low	161 Å²	161	141.6 Å²	141.6	84%	0.843	81%	0.813	S	S	*	*				49.5	142.9	124.3	-50.9	175.8	0	0	0	120.4
10	S	27.3	Very low	30.4	Very low	106 Å²	106	145.5 Å²	145.5	74%	0.741	81%	0.813	S	S	*	*			cis	-167.1	177.2	-7	-113.4	0	0	0	0	111.1
11	T	27	Very low	30.2	Very low	124 Å²	124	146.3 Å²	146.3	76%	0.761	82%	0.816	S	S	*	*			trans	-113.1	151.3	-169.4	51.8	0	0	0	0	116
12	S	28.5	Very low	30	Very low	108 Å²	108	144.2 Å²	144.2	76%	0.755	80%	0.795	S	S	*	*			trans	69.1	148.2	147.9	77.3	0	0	0	0	121.2
13	S	27.9	Very low	29.7	Very low	114 Å²	114	142.3 Å²	142.3	80%	0.797	79%	0.792	S	S	*	*				-179	160	129.7	-85.9	0	0	0	0	113.9
14	A	28.3	Very low	29.2	Very low	95 Å²	95	144.7 Å²	144.7	79%	0.785	80%	0.801	S	S	*	*			trans	68.1	140.4	159	0	0	0	0	0	120.4
15	E	28.1	Very low	28.7	Very low	170 Å²	170	143.3 Å²	143.3	79%	0.794	80%	0.796	S	S	*	*			cis	-163.7	156.3	-30	-136.9	175.6	-134.9	0	0	109.5
16	V	27.3	Very low	28.3	Very low	144 Å²	144	143.9 Å²	143.9	87%	0.873	79%	0.794	S	S	*	*			trans	-133.5	133.9	172.4	176	0	0	0	0	108.8
17	K	26.7	Very low	28	Very low	184 Å²	184	141.1 Å²	141.1	80%	0.8	79%	0.785	S	S	*	*			trans	-120.1	107.4	-177	-155.4	158.2	-167	157.8	0	112
18	E	28	Very low	27.7	Very low	162 Å²	162	141.1 Å²	141.1	76%	0.757	78%	0.784	S	S	*	*			trans	-102.3	144.7	172.5	-178.3	179.1	-135.5	0	0	109.2
19	N	26.2	Very low	27.4	Very low	153 Å²	153	140.9 Å²	140.9	82%	0.818	78%	0.783	S	S	*	*			trans	-126.8	121.3	173.8	-92.3	0.1	0	0	0	110.2
20	R	29.2	Very low	27.3	Very low	218 Å²	218	141.5 Å²	141.5	82%	0.823	79%	0.785	S	S	*	*			trans	-92.3	162.5	166.6	-75	176.1	166.5	173.2	-6.1	110.8
21	N	26.8	Very low	27.1	Very low	164 Å²	164	140.1 Å²	140.1	88%	0.877	79%	0.788	S	S	*	*			trans	-144.1	155	149.5	-156.5	7.6	0	0	0	109.5
22	V	30	Very low	26.9	Very low	132 Å²	132	140.4 Å²	140.4	80%	0.8	79%	0.794	S	S	*	*			trans	-142.5	150.3	-165.3	-178.9	0	0	0	0	111.2
23	G	27.4	Very low	26.8	Very low	63 Å²	63	139 Å²	139	65%	0.649	80%	0.797	S	S	*	*			trans	108.1	136	178.7	0	0	0	0	0	112.2
24	N	24.9	Very low	26.6	Very low	165 Å²	165	142.9 Å²	142.9	88%	0.882	80%	0.803	S	S	*	*			cis	-148.5	162.7	2.6	-132.4	42.8	0	0	0	110.9
25	M	27.5	Very low	26.4	Very low	156 Å²	156	143 Å²	143	77%	0.768	80%	0.797	S	S	*	*			trans	-92.3	176.6	155.2	-69	-173.5	59.8	0	0	108.3
26	E	30	Very low	26.1	Very low	171 Å²	171	143.1 Å²	143.1	80%	0.799	80%	0.797	S	S	*	*			cis	-132.2	-165.2	16.2	-62.5	163.5	127.2	0	0	109.1
27	D	26.9	Very low	25.9	Very low	131 Å²	131	140.3 Å²	140.3	70%	0.701	78%	0.784	S	S	*	*			cis	-156.3	-173	8.3	-165	22.5	0	0	0	112.9
28	L	26.7	Very low	25.7	Very low	143 Å²	143	138.9 Å²	138.9	75%	0.749	79%	0.785	S	S	*	*			trans	-49.2	169.7	164.6	-65.3	162.4	0	0	0	115.4
29	S	22.5	Very low	25.4	Very low	95 Å²	95	139.9 Å²	139.9	66%	0.664	79%	0.787	S	S	*	*			cis	-160.4	165	12.5	28.9	0	0	0	0	113.6
30	I	25.9	Very low	25.2	Very low	174 Å²	174	137.6 Å²	137.6	89%	0.892	78%	0.781	S	S	*	*			trans	40	127.9	142	-57.3	162.8	0	0	0	120.5
31	G	23.4	Very low	24.9	Very low	77 Å²	77	132.2 Å²	132.2	79%	0.794	78%	0.777	S	S	*	*			trans	176.4	133.2	157.5	0	0	0	0	0	115.1
32	S	23.4	Very low	24.7	Very low	129 Å²	129	132.5 Å²	132.5	90%	0.902	77%	0.773	S	S	*	*			trans	-105.4	150.7	174.2	49.5	0	0	0	0	111.5
33	G	25.1	Very low	24.5	Very low	79 Å²	79	133.6 Å²	133.6	81%	0.814	77%	0.774	S	S	*	*			trans	-178.2	114	177.1	0	0	0	0	0	117.4
34	E	23.9	Very low	24.4	Very low	195 Å²	195	135.3 Å²	135.3	91%	0.911	78%	0.776	S	S	*	*			trans	-55.1	166.6	144.3	-80.5	174.6	153.7	0	0	112
35	C	23.8	Very low	24.5	Very low	99 Å²	99	138.9 Å²	138.9	67%	0.669	78%	0.777	S	S	*	*			cis	-163.6	-165.6	-15.1	-173.5	0	0	0	0	106.8
36	Q	22.6	Very low	24.3	Very low	171 Å²	171	134.8 Å²	134.8	80%	0.799	78%	0.775	S	S	*	*			trans	14	141	152.2	-77.6	161.4	19.5	0	0	119.3
37	S	22.2	Very low	24.1	Very low	86 Å²	86	131.5 Å²	131.5	60%	0.601	78%	0.777	S	S	*	*			cis	157.1	171.5	8.3	57.1	0	0	0	0	105.6
38	L	23.6	Very low	24.2	Very low	154 Å²	154	130.5 Å²	130.5	81%	0.806	78%	0.78	S	S	*	*			trans	65.4	168.1	167	-56.8	166	0	0	0	116
39	F	21.6	Very low	24.2	Very low	183 Å²	183	129.6 Å²	129.6	80%	0.803	79%	0.786	S	S	*	*				-166.4	151.9	-58.3	-135.5	-92.3	0	0	0	106.9
40	C	22.6	Very low	24.5	Very low	104 Å²	104	128.2 Å²	128.2	70%	0.703	79%	0.786	S	S	*	*			trans	66.4	127.9	172.3	-76.1	0	0	0	0	117.2
41	S	22.9	Very low	24.8	Very low	106 Å²	106	127.2 Å²	127.2	74%	0.741	78%	0.782	S	S	*	*				90.6	143.9	78.9	-58.8	0	0	0	0	112
42	E	22.4	Very low	25	Very low	169 Å²	169	131.7 Å²	131.7	79%	0.79	78%	0.78	S	S	*	*			cis	-140.4	165.7	16.4	-77.5	-163.4	126.2	0	0	115.3
43	L	24.2	Very low	25.4	Very low	156 Å²	156	137.3 Å²	137.3	82%	0.817	78%	0.781	S	S	*	*			trans	8.9	146.6	138.9	-57.2	166.4	0	0	0	119.4
44	S	25.4	Very low	25.5	Very low	99 Å²	99	142.1 Å²	142.1	69%	0.692	78%	0.779	S	S	*	*			cis	-159	-161.3	25.7	54.9	0	0	0	0	110.4
45	R	27.1	Very low	25.7	Very low	240 Å²	240	143.5 Å²	143.5	91%	0.906	78%	0.777	S	S	*	*			cis	-162.3	164.6	6.5	-143.8	163.4	-174.2	174.3	1.2	110.6
46	G	24.1	Very low	26.2	Very low	70 Å²	70	143.8 Å²	143.8	72%	0.722	78%	0.777	S	S	*	*			trans	88	115.7	168.3	0	0	0	0	0	114.7
47	A	26.1	Very low	26.5	Very low	102 Å²	102	143.5 Å²	143.5	84%	0.843	78%	0.78	S	S	*	*			cis	91.9	131.5	47.2	0	0	0	0	0	113.1
48	S	28.2	Very low	26.8	Very low	109 Å²	109	148.1 Å²	148.1	76%	0.762	79%	0.792	S	S	*	*			cis	-164	174.6	-9.3	62.1	0	0	0	0	113.2
49	S	28.1	Very low	27	Very low	125 Å²	125	150 Å²	150	87%	0.874	80%	0.797	S	S	*	*			trans	76.3	135.2	173	80.8	0	0	0	0	118.1
50	G	28.7	Very low	27.3	Very low	65 Å²	65	148.5 Å²	148.5	67%	0.67	80%	0.797	S	S	*	*			cis	174.4	129.8	-16.6	0	0	0	0	0	117
51	L	30.8	Very low	27.7	Very low	153 Å²	153	150.9 Å²	150.9	80%	0.801	80%	0.803	S	S	*	*			trans	63.4	141.5	143.6	-55.2	177.6	0	0	0	118.1
52	K	28.9	Very low	27.9	Very low	172 Å²	172	153 Å²	153	75%	0.748	81%	0.806	S	S	*	*			cis	-154.6	162	4.5	-99.7	146.6	-175.7	169.7	0	105.4
53	R	30.3	Very low	28.4	Very low	246 Å²	246	148.5 Å²	148.5	93%	0.928	81%	0.805	S	S	*	*			cis	-148.8	175	27.9	-118	154.6	-177.8	158.2	-2	109.4
54	K	28	Very low	28.6	Very low	180 Å²	180	152.3 Å²	152.3	78%	0.783	81%	0.809	S	S	*	*			trans	-120.4	143.9	-170.4	-76.6	-176.3	176.4	178	0	113.6
55	R	27.9	Very low	28.8	Very low	225 Å²	225	156 Å²	156	85%	0.849	82%	0.819	S	S	*	*				60.3	169	124.9	-66.3	-170.6	-178	-169.5	-0.3	119.8
56	P	33.8	Very low	28.7	Very low	105 Å²	105	150.6 Å²	150.6	68%	0.682	82%	0.817	S	S	*	*			cis	-127.1	171.7	7	42.1	-26.8	0	0	0	117.7
57	L	29.5	Very low	28.8	Very low	164 Å²	164	156 Å²	156	86%	0.859	82%	0.824	S	S	*	*			trans	-96.5	151.1	144.1	-90.5	83.4	0	0	0	107.7
58	E	29.3	Very low	28.9	Very low	183 Å²	183	159.3 Å²	159.3	86%	0.855	83%	0.826	S	S	*	*			trans	-117.6	130.1	159.2	-69.3	177.7	146.8	0	0	108.3
59	E	28.1	Very low	28.7	Very low	195 Å²	195	165.3 Å²	165.3	91%	0.911	83%	0.832	S	S	*	*			trans	-101.5	129.1	157.7	-68.6	-176.5	129.6	0	0	106.2
60	D	27	Very low	28.9	Very low	151 Å²	151	166.6 Å²	166.6	81%	0.807	83%	0.828	S	S	*	*			trans	-128.1	140.6	167.7	-171.1	20	0	0	0	109.3
61	N	30.3	Very low	28.9	Very low	153 Å²	153	170.2 Å²	170.2	82%	0.818	83%	0.831	S	S	*	*			trans	-126	92.1	-155.6	-166.4	7.3	0	0	0	110.7
62	N	27.8	Very low	28.8	Very low	150 Å²	150	172.9 Å²	172.9	80%	0.802	83%	0.832	S	S	*	*			trans	-144.4	125.1	176.8	-106.9	-58.5	0	0	0	112.4
63	G	33.9	Very low	28.8	Very low	75 Å²	75	173.2 Å²	173.2	77%	0.773	83%	0.833	S	S	*	*			trans	-82.4	125.7	-175.6	0	0	0	0	0	113.5
64	R	26.4	Very low	28.7	Very low	237 Å²	237	171.3 Å²	171.3	89%	0.894	83%	0.832	S	S	*	*			trans	-139.1	153.9	161.4	-74.4	-165.1	172.3	-159.6	-2.4	111.1	C66	R64-C66 PolarHBondContact O-N 2.96Å
65	L	30.3	Very low	28.9	Very low	175 Å²	175	169.9 Å²	169.9	92%	0.916	83%	0.832	S	S	*	*			trans	-64.8	116.5	-179.4	-66.3	109.4	0	0	0	111.3	Q67	L65-Q67 VanDerWaalsContact C-N 3.31Å; L65-Q67 PolarHBondContact O-N 3.06Å
66	C	26.1	Very low	28.9	Very low	128 Å²	128	163.9 Å²	163.9	87%	0.865	82%	0.824	S	S	*	*			trans	-74.2	80.9	174.9	-78.8	0	0	0	0	111.9	R64 L68	R64-C66 PolarHBondContact O-N 2.96Å; C66-L68 PolarHBondContact O-N 3.29Å
67	Q	25	Very low	28.8	Very low	184 Å²	184	165.9 Å²	165.9	86%	0.86	82%	0.818	S	S	*	*			trans	-58.2	121.9	165.7	-162.7	176.5	29.6	0	0	109.3	L65 R69	L65-Q67 VanDerWaalsContact C-N 3.31Å; L65-Q67 PolarHBondContact O-N 3.06Å; Q67-R69 VanDerWaalsContact C-N 3.34Å; Q67-R69 PolarHBondContact O-N 2.56Å
68	L	27.6	Very low	29	Very low	171 Å²	171	163 Å²	163	90%	0.895	81%	0.812	S	S	*	*			trans	-69.4	84.2	-173.8	-82.5	167.5	0	0	0	112.2	C66 L70	C66-L68 PolarHBondContact O-N 3.29Å; L68-L70 PolarHBondContact O-N 3.36Å
69	R	25.2	Very low	29.3	Very low	234 Å²	234	161.9 Å²	161.9	88%	0.883	81%	0.807	S	S	*	*			trans	-73.9	106.9	179.7	-149.5	174.6	-167.7	-177.4	4	110.1	Q67 I71	Q67-R69 VanDerWaalsContact C-N 3.34Å; Q67-R69 PolarHBondContact O-N 2.56Å; R69-I71 PolarHBondContact O-N 3.31Å
70	L	31.8	Very low	30.2	Very low	152 Å²	152	156.9 Å²	156.9	80%	0.796	80%	0.799	S	S	*	*			trans	-61.2	96.8	177.4	-81.9	159.3	0	0	0	111.7	L68 Y72	L68-L70 PolarHBondContact O-N 3.36Å; L70-Y72 PolarHBondContact O-N 2.97Å
71	I	29.4	Very low	31.5	Very low	141 Å²	141	155.8 Å²	155.8	72%	0.723	80%	0.8	S	S	*	*			trans	-79.7	87.8	172.9	-55.9	-178.4	0	0	0	109.3	R69 K73	R69-I71 PolarHBondContact O-N 3.31Å; I71-K73 HydrophobicContact CG2-CG 4.1Å; I71-K73 PolarHBondContact O-N 3.32Å
72	Y	28.8	Very low	33.4	Very low	210 Å²	210	154.6 Å²	154.6	82%	0.824	79%	0.787	S	S	*	*			trans	-65.8	81.9	163.2	-95.9	-90.7	0	0	0	110.1	L70 K74	L70-Y72 PolarHBondContact O-N 2.97Å; Y72-K74 PolarHBondContact O-N 2.64Å
73	K	27.8	Very low	36	Very low	178 Å²	178	151 Å²	151	77%	0.774	77%	0.768	S	S	*	*			trans	-67.8	98.8	164.3	-95.8	-174.4	176.9	-177.8	0	108.6	I71 L75	I71-K73 HydrophobicContact CG2-CG 4.1Å; I71-K73 PolarHBondContact O-N 3.32Å; K73-L75 PolarHBondContact O-N 3.47Å
74	K	29.5	Very low	38.3	Very low	207 Å²	207	148.1 Å²	148.1	90%	0.9	74%	0.737	S	S	*	*			trans	-50.5	96.7	176.4	-170.4	178	-174.5	179.3	0	110.4	Y72 S76	Y72-K74 PolarHBondContact O-N 2.64Å; K74-S76 PolarHBondContact O-N 2.99Å; K74-S76 VanDerWaalsContact O-N 3.14Å
75	L	30.9	Very low	41	Very low	150 Å²	150	139 Å²	139	79%	0.785	71%	0.706	S	S	*	*			trans	-65.4	113.5	176.7	-83.2	99	0	0	0	109.7	K73 W77	K73-L75 PolarHBondContact O-N 3.47Å; L75-W77 PolarHBondContact O-N 3.43Å
76	S	29.4	Very low	43.6	Very low	98 Å²	98	134.4 Å²	134.4	69%	0.685	69%	0.685	S	S	*	*			trans	-69	120.9	167	42.8	0	0	0	0	109.7	K74 S78	K74-S76 PolarHBondContact O-N 2.99Å; K74-S76 VanDerWaalsContact O-N 3.14Å; S76-S78 PolarHBondContact O-N 2.89Å
77	W	30.1	Very low	46.3	Very low	148 Å²	148	132 Å²	132	56%	0.561	66%	0.661	S	S	*	*			trans	-80.3	69.9	176	-70.2	91.1	0	0	0	111.2	L75 R253 A255	L75-W77 PolarHBondContact O-N 3.43Å; W77-R253 VanDerWaalsContact CB-NH1 3.29Å; W77-R253 HydrophobicContact CE3-CB 4.41Å; W77-R253 HydrophobicContact CH2-CB 3.69Å; W77-R253 HydrophobicContact CZ2-CB 4.46Å; W77-R253 HydrophobicContact CZ3-CB 3.67Å; W77-R253 HydrophobicContact CZ3-CG 4.33Å; W77-A255 HydrophobicContact CH2-CB 4.31Å
78	S	34.5	Very low	49.1	Very low	104 Å²	104	123.3 Å²	123.3	73%	0.727	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-77.9	126.3	173.6	-55.5	0	0	0	0	110.7	S76	S76-S78 PolarHBondContact O-N 2.89Å
79	E	36.7	Very low	51.8	Low	158 Å²	158	119.2 Å²	119.2	74%	0.738	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-81.1	137.7	174.3	-58.9	-163	145	0	0	110.8	R253	E79-R253 IonicContact OE1-CZ 3.06Å; E79-R253 IonicContact OE1-NH2 2.74Å; E79-R253 PolarHBondContact OE1-NH2 2.87Å
80	A	45.8	Very low	54.5	Low	90 Å²	90	113.2 Å²	113.2	74%	0.744	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-95.1	132.2	171	0	0	0	0	0	108.9
81	P	53.7	Low	56.7	Low	128 Å²	128	110.7 Å²	110.7	83%	0.831	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-62.5	144.8	-176.5	24.5	-33.8	0	0	0	112.1
82	K	71	Confident	59	Low	128 Å²	128	107.9 Å²	107.9	56%	0.557	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-62.7	152.6	174.3	-68.2	-166.3	-175.2	-169.9	0	110.7	E90	K82-E90 WeakPolarHBondContact CD-OE2 3.46Å; K82-E90 IonicContact NZ-OE1 2.75Å; K82-E90 PolarHBondContact NZ-OE1 3.4Å; K82-E90 IonicContact NZ-OE2 2.63Å; K82-E90 PolarHBondContact NZ-OE2 2.89Å
83	N	83.2	Confident	61.4	Low	74 Å²	74	102.6 Å²	102.6	40%	0.396	54%	0.54	S	S	.	.	P	Polyproline II helix	trans	-76.8	135.4	172.3	-174.3	-70.3	0	0	0	110.2	L85 V86 Q87	N83-L85 PolarHBondContact O-N 2.88Å; N83-L85 VanDerWaalsContact O-N 3.16Å; N83-L85 WeakPolarHBondContact OD1-CB 3Å; N83-L85 PolarHBondContact OD1-N 3.34Å; N83-V86 HydrophobicContact CB-CG2 4.24Å; N83-V86 WeakPolarHBondContact O-CA 3.33Å; N83-V86 WeakPolarHBondContact O-CB 3.42Å; N83-V86 PolarHBondContact O-N 3.47Å; N83-Q87 PolarHBondContact O-N 3.08Å
84	A	80.9	Confident	63.8	Low	16 Å²	16	97.5 Å²	97.5	13%	0.132	54%	0.538	C	S	.	.	H	α-helix	trans	-50.4	-39.1	179.8	0	0	0	0	0	114.2	V86 Q87 L88 A137 E138 L141	A84-V86 VanDerWaalsContact C-N 3.29Å; A84-V86 PolarHBondContact O-N 3.3Å; A84-Q87 PolarHBondContact O-N 3.46Å; A84-L88 VanDerWaalsContact O-CB 3.3Å; A84-L88 WeakPolarHBondContact O-CB 3.46Å; A84-L88 PolarHBondContact O-N 3.44Å; A84-A137 HydrophobicContact CB-CB 4.37Å; A84-E138 HydrophobicContact CB-CG 3.67Å; A84-L141 HydrophobicContact CB-CD1 3.82Å; A84-L141 WeakPolarHBondContact O-CD1 3.38Å
85	L	83.8	Confident	66.3	Low	46 Å²	46	88.8 Å²	88.8	24%	0.241	50%	0.501	C	S	.	.	H	α-helix	trans	-65.8	-31.4	177.4	-74.3	162.8	0	0	0	113.1	N83 N89 Y97 K133 M134 A137	N83-L85 PolarHBondContact O-N 2.88Å; N83-L85 VanDerWaalsContact O-N 3.16Å; N83-L85 WeakPolarHBondContact OD1-CB 3Å; N83-L85 PolarHBondContact OD1-N 3.34Å; L85-N89 WeakPolarHBondContact O-CB 3.13Å; L85-N89 PolarHBondContact O-N 3.17Å; L85-Y97 HydrophobicContact CD2-CE1 4Å; L85-K133 HydrophobicContact CD2-CB 4.15Å; L85-M134 HydrophobicContact CD1-CB 3.97Å; L85-M134 HydrophobicContact CD1-CG 4.16Å; L85-M134 HydrophobicContact CG-CB 4.4Å; L85-M134 HydrophobicContact CG-CG 4.4Å; L85-A137 HydrophobicContact CD2-CB 3.77Å; L85-A137 HydrophobicContact CG-CB 4.15Å
86	V	83.9	Confident	68.8	Low	78 Å²	78	89.8 Å²	89.8	47%	0.473	50%	0.502	S	S	.	.	H	α-helix	trans	-76.9	-48.7	176.6	179.4	0	0	0	0	109.4	N83 A84 L88 N89 E90	N83-V86 HydrophobicContact CB-CG2 4.24Å; N83-V86 WeakPolarHBondContact O-CA 3.33Å; N83-V86 WeakPolarHBondContact O-CB 3.42Å; N83-V86 PolarHBondContact O-N 3.47Å; A84-V86 VanDerWaalsContact C-N 3.29Å; A84-V86 PolarHBondContact O-N 3.3Å; V86-L88 VanDerWaalsContact C-N 3.34Å; V86-L88 PolarHBondContact O-N 3.34Å; V86-N89 CarbonylContact O-C 3.59Å; V86-N89 PolarHBondContact O-N 3.37Å; V86-E90 HydrophobicContact CG1-CG 4.31Å; V86-E90 WeakPolarHBondContact O-CG 3.41Å; V86-E90 PolarHBondContact O-N 2.82Å
87	Q	82.5	Confident	71.7	Confident	78 Å²	78	87.3 Å²	87.3	36%	0.364	48%	0.478	S	S	.	.	H	α-helix	trans	-61.7	-39.7	-179.2	-176.6	177.2	-2.7	0	0	112.4	N83 A84 E90 L91 L141	N83-Q87 PolarHBondContact O-N 3.08Å; A84-Q87 PolarHBondContact O-N 3.46Å; Q87-E90 PolarHBondContact O-N 2.98Å; Q87-L91 WeakPolarHBondContact O-CG 3.44Å; Q87-L91 PolarHBondContact O-N 3.05Å; Q87-L91 VanDerWaalsContact O-N 3.09Å; Q87-L141 HydrophobicContact CB-CD1 3.99Å; Q87-L141 HydrophobicContact CG-CD1 4.09Å; Q87-L141 HydrophobicContact CG-CD2 4.01Å
88	L	83.8	Confident	74.6	Confident	0 Å²	0	86.5 Å²	86.5	0%	0	48%	0.475	C	S	.	.	H	α-helix	trans	-68.7	-36.4	176	-175.1	58.7	0	0	0	112.5	A84 V86 L91 R92 L95 A137 A140 L141 F144	A84-L88 VanDerWaalsContact O-CB 3.3Å; A84-L88 WeakPolarHBondContact O-CB 3.46Å; A84-L88 PolarHBondContact O-N 3.44Å; V86-L88 VanDerWaalsContact C-N 3.34Å; V86-L88 PolarHBondContact O-N 3.34Å; L88-L91 PolarHBondContact O-N 3.29Å; L88-R92 PolarHBondContact O-N 3.05Å; L88-L95 HydrophobicContact CD1-CD1 4.02Å; L88-L95 HydrophobicContact CD2-CD1 4.05Å; L88-L95 HydrophobicContact CG-CD1 3.61Å; L88-A137 HydrophobicContact CB-CB 4.36Å; L88-A137 HydrophobicContact CD2-CB 3.63Å; L88-A140 HydrophobicContact CD1-CB 4.2Å; L88-A140 HydrophobicContact CD2-CB 3.76Å; L88-L141 HydrophobicContact CB-CD1 4.29Å; L88-L141 HydrophobicContact CB-CD2 4.09Å; L88-L141 HydrophobicContact CB-CG 4.02Å; L88-L141 HydrophobicContact CD1-CD2 4.09Å; L88-L141 HydrophobicContact CD1-CG 4.3Å; L88-F144 HydrophobicContact CD1-CD2 3.99Å; L88-F144 HydrophobicContact CD1-CE2 3.59Å
89	N	84.4	Confident	77.2	Confident	86 Å²	86	86.1 Å²	86.1	46%	0.46	46%	0.463	S	S	.	.	H	α-helix	trans	-76.6	-24.3	176	-168.9	106.7	0	0	0	112.7	L85 V86 R92	L85-N89 WeakPolarHBondContact O-CB 3.13Å; L85-N89 PolarHBondContact O-N 3.17Å; V86-N89 CarbonylContact O-C 3.59Å; V86-N89 PolarHBondContact O-N 3.37Å; N89-R92 CarbonylContact O-C 3.58Å
90	E	83.1	Confident	79.8	Confident	108 Å²	108	82.2 Å²	82.2	51%	0.505	45%	0.449	S	S	.	.	H	α-helix	trans	-67.7	-38.6	167.7	-75.1	172.7	164.9	0	0	110.8	K82 V86 Q87	K82-E90 WeakPolarHBondContact CD-OE2 3.46Å; K82-E90 IonicContact NZ-OE1 2.75Å; K82-E90 PolarHBondContact NZ-OE1 3.4Å; K82-E90 IonicContact NZ-OE2 2.63Å; K82-E90 PolarHBondContact NZ-OE2 2.89Å; V86-E90 HydrophobicContact CG1-CG 4.31Å; V86-E90 WeakPolarHBondContact O-CG 3.41Å; V86-E90 PolarHBondContact O-N 2.82Å; Q87-E90 PolarHBondContact O-N 2.98Å
91	L	78.4	Confident	81.9	Confident	99 Å²	99	80 Å²	80	52%	0.518	43%	0.429	S	S	.	.	H	α-helix	trans	-76.5	-29.6	175.6	-69.1	174.5	0	0	0	113.8	Q87 L88 L141 F144	Q87-L91 WeakPolarHBondContact O-CG 3.44Å; Q87-L91 PolarHBondContact O-N 3.05Å; Q87-L91 VanDerWaalsContact O-N 3.09Å; L88-L91 PolarHBondContact O-N 3.29Å; L91-L141 HydrophobicContact CD1-CD2 3.65Å; L91-F144 HydrophobicContact CD1-CD2 4.26Å; L91-F144 HydrophobicContact CD1-CG 4.37Å
92	R	76.3	Confident	83.7	Confident	81 Å²	81	79.5 Å²	79.5	31%	0.306	42%	0.415	S	S	.	.			trans	-149.1	103.9	173.2	-166.3	166.1	-54.2	-170.8	4.6	112.5	L88 N89 L95 N118	L88-R92 PolarHBondContact O-N 3.05Å; N89-R92 CarbonylContact O-C 3.58Å; R92-L95 HydrophobicContact CB-CD1 3.97Å; R92-L95 HydrophobicContact CB-CD2 4.46Å; R92-L95 HydrophobicContact CB-CG 3.98Å; R92-L95 HydrophobicContact CG-CD2 4.22Å; R92-L95 HydrophobicContact CG-CG 4.04Å; R92-N118 PolarHBondContact NH1-OD1 3.17Å; R92-N118 PolarHBondContact NH2-OD1 3.39Å
93	P	80.5	Confident	84.5	Confident	100 Å²	100	77.2 Å²	77.2	65%	0.649	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	151.3	167.9	29	-33.9	0	0	0	110.6
94	G	77.3	Confident	84.8	Confident	71 Å²	71	76.2 Å²	76.2	73%	0.732	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.5	2.4	174.8	0	0	0	0	0	116.5	Q96	G94-Q96 PolarHBondContact O-N 2.85Å
95	L	83.1	Confident	85	Confident	24 Å²	24	78.6 Å²	78.6	13%	0.126	43%	0.434	C	S	.	.			trans	-58.2	125.1	178.8	-78.5	175.1	0	0	0	113.6	L88 R92 Y97 V115 E116 V117	L88-L95 HydrophobicContact CD1-CD1 4.02Å; L88-L95 HydrophobicContact CD2-CD1 4.05Å; L88-L95 HydrophobicContact CG-CD1 3.61Å; R92-L95 HydrophobicContact CB-CD1 3.97Å; R92-L95 HydrophobicContact CB-CD2 4.46Å; R92-L95 HydrophobicContact CB-CG 3.98Å; R92-L95 HydrophobicContact CG-CD2 4.22Å; R92-L95 HydrophobicContact CG-CG 4.04Å; L95-Y97 HydrophobicContact CB-CE2 4.19Å; L95-Y97 WeakPolarHBondContact O-CD2 3.3Å; L95-V115 HydrophobicContact CB-CG2 4.17Å; L95-V115 HydrophobicContact CD1-CG2 4.33Å; L95-V115 HydrophobicContact CD2-CG2 4.23Å; L95-E116 WeakPolarHBondContact CD2-O 3.41Å; L95-V117 HydrophobicContact CD1-CG2 4.31Å; L95-V117 HydrophobicContact CD2-CG2 3.89Å
96	Q	81.4	Confident	85	Confident	170 Å²	170	83.5 Å²	83.5	79%	0.794	47%	0.465	S	S	*	.			trans	-88.7	136.1	176.9	-58.1	-166.3	30.6	0	0	111.4	G94	G94-Q96 PolarHBondContact O-N 2.85Å
97	Y	90.8	Very high	85	Confident	46 Å²	46	87.8 Å²	87.8	18%	0.18	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	101.2	178.9	-70.9	-104.3	0	0	0	109.8	L85 L95 I113 A114 V115 K133	L85-Y97 HydrophobicContact CD2-CE1 4Å; L95-Y97 HydrophobicContact CB-CE2 4.19Å; L95-Y97 WeakPolarHBondContact O-CD2 3.3Å; Y97-I113 HydrophobicContact CD1-CG2 4.3Å; Y97-A114 CarbonylContact C-O 3.48Å; Y97-A114 WeakPolarHBondContact CA-O 3.24Å; Y97-V115 HydrophobicContact CD1-CB 3.79Å; Y97-V115 HydrophobicContact CD1-CG2 4.14Å; Y97-V115 HydrophobicContact CD2-CG2 4.29Å; Y97-V115 HydrophobicContact CE1-CB 3.79Å; Y97-V115 HydrophobicContact CE1-CG1 4.27Å; Y97-V115 HydrophobicContact CE1-CG2 3.93Å; Y97-V115 HydrophobicContact CE2-CG2 4.06Å; Y97-V115 HydrophobicContact CG-CB 4.3Å; Y97-V115 HydrophobicContact CG-CG2 4.32Å; Y97-K133 HydrophobicContact CD1-CB 4.23Å; Y97-K133 HydrophobicContact CD1-CD 4.18Å; Y97-K133 HydrophobicContact CD1-CG 3.8Å; Y97-K133 HydrophobicContact CE1-CB 4.4Å; Y97-K133 HydrophobicContact CE1-CG 4.44Å; Y97-K133 HydrophobicContact CG-CD 4.19Å; Y97-K133 HydrophobicContact CG-CG 4.28Å
98	R	91.1	Very high	85.1	Confident	131 Å²	131	86.7 Å²	86.7	49%	0.494	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	139.1	179.1	61.4	179.8	168.9	-147.4	-9.2	111.5	I113 A114 E116 T121	R98-I113 CarbonylContact O-C 3.56Å; R98-I113 WeakPolarHBondContact O-CA 3.41Å; R98-I113 WeakPolarHBondContact O-CG2 3.37Å; R98-A114 HydrophobicContact CG-CB 4.04Å; R98-A114 PolarHBondContact N-O 3Å; R98-A114 PolarHBondContact O-N 3.06Å; R98-E116 IonicContact CZ-OE2 4Å; R98-E116 IonicContact NH1-OE2 3.82Å; R98-E116 IonicContact NH2-OE2 3.59Å; R98-T121 PolarHBondContact NH2-OG1 3.13Å
99	M	90.5	Very high	85.4	Confident	96 Å²	96	88.2 Å²	88.2	47%	0.473	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	124.9	171	-163.1	176	-33.8	0	0	108.2	I113 K129	M99-I113 HydrophobicContact CG-CG1 4.24Å; M99-K129 HydrophobicContact CE-CD 3.77Å; M99-K129 HydrophobicContact SD-CD 4.36Å
100	V	90	Very high	85.7	Confident	76 Å²	76	87 Å²	87	46%	0.461	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	-45.2	-178.2	-177.7	0	0	0	0	109.8	S112 A114 E123	V100-S112 PolarHBondContact N-O 3.34Å; V100-A114 HydrophobicContact CG2-CB 3.56Å; V100-E123 WeakPolarHBondContact CG1-OE1 3.39Å; V100-E123 HydrophobicContact CG2-CG 4.4Å
101	S	89.8	Confident	86.3	Confident	45 Å²	45	83 Å²	83	32%	0.315	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	160.6	-178.6	62.5	0	0	0	0	112.6	S112	S101-S112 PolarHBondContact N-O 3.18Å; S101-S112 PolarHBondContact O-N 3.49Å; S101-S112 VanDerWaalsContact OG-CB 3.25Å; S101-S112 WeakPolarHBondContact OG-CB 3.38Å
102	Q	91.3	Very high	86.9	Confident	116 Å²	116	78.4 Å²	78.4	54%	0.542	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	116.5	165.5	179.4	-177	-44.2	0	0	107.1	V110 F111	Q102-V110 WeakPolarHBondContact CA-O 3.23Å; Q102-F111 HydrophobicContact CB-CD1 4.23Å; Q102-F111 VanDerWaalsContact CD-CE1 3.47Å; Q102-F111 HydrophobicContact CG-CD1 3.8Å; Q102-F111 HydrophobicContact CG-CE1 3.73Å; Q102-F111 VanDerWaalsContact OE1-CE1 3.25Å
103	T	88.8	Confident	87.8	Confident	80 Å²	80	74.7 Å²	74.7	49%	0.491	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	173.7	-174.7	58.9	0	0	0	0	111	P109 V110	T103-P109 CarbonylContact O-C 3.59Å; T103-P109 WeakPolarHBondContact O-CA 3.4Å; T103-V110 PolarHBondContact N-O 2.9Å; T103-V110 PolarHBondContact O-N 2.91Å
104	G	88.1	Confident	88.4	Confident	54 Å²	54	70 Å²	70	56%	0.557	40%	0.402	S	S	*	.	S	Bend	trans	83.1	168.4	-176.7	0	0	0	0	0	113.9
105	P	86.9	Confident	89.1	Confident	66 Å²	66	66.6 Å²	66.6	43%	0.429	37%	0.367	S	S	.	.			trans	-72.4	160.9	-175.7	31.6	-36.2	0	0	0	111.9	H107 A108	P105-H107 WeakPolarHBondContact CG-NE2 3.46Å; P105-H107 PolarHBondContact O-N 2.68Å; P105-A108 HydrophobicContact CG-CB 4.19Å; P105-A108 CarbonylContact O-C 3.59Å; P105-A108 PolarHBondContact O-N 2.89Å
106	V	82.2	Confident	89.3	Confident	148 Å²	148	70.2 Å²	70.2	90%	0.897	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-30.4	-177	-178	0	0	0	0	113.2
107	H	83.8	Confident	89.4	Confident	169 Å²	169	62.3 Å²	62.3	78%	0.782	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-13.1	177.5	61.2	-108	0	0	0	114.5	P105	P105-H107 WeakPolarHBondContact CG-NE2 3.46Å; P105-H107 PolarHBondContact O-N 2.68Å
108	A	85	Confident	88.6	Confident	54 Å²	54	65.4 Å²	65.4	45%	0.446	37%	0.367	S	S	.	.	S	Bend	trans	-147	61.3	179	0	0	0	0	0	112.5	P105	P105-A108 HydrophobicContact CG-CB 4.19Å; P105-A108 CarbonylContact O-C 3.59Å; P105-A108 PolarHBondContact O-N 2.89Å
109	P	90.5	Very high	87.7	Confident	32 Å²	32	62.1 Å²	62.1	21%	0.208	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-72.3	131.8	-177.8	29.5	-35.3	0	0	0	112.1	T103 F111 P127	T103-P109 CarbonylContact O-C 3.59Å; T103-P109 WeakPolarHBondContact O-CA 3.4Å; P109-F111 HydrophobicContact CB-CE2 3.99Å; P109-F111 HydrophobicContact CB-CZ 3.91Å; P109-F111 HydrophobicContact CG-CE2 3.85Å; P109-F111 HydrophobicContact CG-CZ 3.88Å; P109-P127 WeakPolarHBondContact O-CA 3.24Å
110	V	91.8	Very high	87.3	Confident	61 Å²	61	62 Å²	62	37%	0.37	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	121.4	169.5	-178.1	0	0	0	0	108.3	Q102 T103	Q102-V110 WeakPolarHBondContact CA-O 3.23Å; T103-V110 PolarHBondContact N-O 2.9Å; T103-V110 PolarHBondContact O-N 2.91Å
111	F	94.1	Very high	87.1	Confident	24 Å²	24	61.8 Å²	61.8	11%	0.105	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	135.4	173.7	-54	-88.1	0	0	0	109	Q102 P109 T125 G126 T128 K129 A132	Q102-F111 HydrophobicContact CB-CD1 4.23Å; Q102-F111 VanDerWaalsContact CD-CE1 3.47Å; Q102-F111 HydrophobicContact CG-CD1 3.8Å; Q102-F111 HydrophobicContact CG-CE1 3.73Å; Q102-F111 VanDerWaalsContact OE1-CE1 3.25Å; P109-F111 HydrophobicContact CB-CE2 3.99Å; P109-F111 HydrophobicContact CB-CZ 3.91Å; P109-F111 HydrophobicContact CG-CE2 3.85Å; P109-F111 HydrophobicContact CG-CZ 3.88Å; F111-T125 CarbonylContact O-C 3.19Å; F111-T125 WeakPolarHBondContact O-CA 3.41Å; F111-G126 PolarHBondContact N-O 3.45Å; F111-G126 PolarHBondContact O-N 3.29Å; F111-T128 VanDerWaalsContact CD2-CA 3.47Å; F111-K129 HydrophobicContact CB-CG 4.18Å; F111-K129 HydrophobicContact CD1-CD 4.06Å; F111-K129 HydrophobicContact CD1-CG 3.43Å; F111-K129 VanDerWaalsContact CD1-CG 3.43Å; F111-K129 HydrophobicContact CD2-CG 4.23Å; F111-K129 HydrophobicContact CE1-CD 4.11Å; F111-K129 HydrophobicContact CE1-CG 3.79Å; F111-K129 HydrophobicContact CG-CG 3.66Å; F111-K129 HydrophobicContact CZ-CG 4.32Å; F111-A132 HydrophobicContact CB-CB 4.23Å; F111-A132 WeakPolarHBondContact O-CB 3.35Å
112	S	92.3	Very high	87.2	Confident	3 Å²	3	61.2 Å²	61.2	2%	0.021	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	132.3	168.7	-151.5	0	0	0	0	111	V100 S101 E123 T125	V100-S112 PolarHBondContact N-O 3.34Å; S101-S112 PolarHBondContact N-O 3.18Å; S101-S112 PolarHBondContact O-N 3.49Å; S101-S112 VanDerWaalsContact OG-CB 3.25Å; S101-S112 WeakPolarHBondContact OG-CB 3.38Å; S112-E123 WeakPolarHBondContact CB-OE1 3.31Å; S112-E123 VanDerWaalsContact OG-CD 3.26Å; S112-E123 WeakPolarHBondContact OG-CG 3.43Å; S112-E123 PolarHBondContact OG-OE1 2.92Å; S112-T125 VanDerWaalsContact OG-CG2 3.3Å; S112-T125 WeakPolarHBondContact OG-CG2 3.47Å
113	I	95.2	Very high	87.2	Confident	3 Å²	3	60.1 Å²	60.1	2%	0.015	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	129.5	-173.3	-63.6	-178.5	0	0	0	108.9	Y97 R98 M99 G124 K129 A132 K133 A136	Y97-I113 HydrophobicContact CD1-CG2 4.3Å; R98-I113 CarbonylContact O-C 3.56Å; R98-I113 WeakPolarHBondContact O-CA 3.41Å; R98-I113 WeakPolarHBondContact O-CG2 3.37Å; M99-I113 HydrophobicContact CG-CG1 4.24Å; I113-G124 PolarHBondContact N-O 2.8Å; I113-G124 VanDerWaalsContact N-O 3.08Å; I113-G124 PolarHBondContact O-N 2.73Å; I113-K129 HydrophobicContact CD1-CB 3.98Å; I113-K129 HydrophobicContact CD1-CG 4.42Å; I113-K129 WeakPolarHBondContact CD1-O 3.39Å; I113-A132 HydrophobicContact CB-CB 4.15Å; I113-A132 HydrophobicContact CD1-CB 3.89Å; I113-A132 HydrophobicContact CG1-CB 3.94Å; I113-K133 HydrophobicContact CB-CG 4.45Å; I113-K133 HydrophobicContact CD1-CG 3.83Å; I113-K133 HydrophobicContact CG2-CG 3.74Å; I113-A136 WeakPolarHBondContact O-CB 3.47Å
114	A	92	Very high	87.5	Confident	1 Å²	1	56.4 Å²	56.4	1%	0.008	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	146.5	177.4	0	0	0	0	0	112.1	Y97 R98 V100 T121 F122 E123	Y97-A114 CarbonylContact C-O 3.48Å; Y97-A114 WeakPolarHBondContact CA-O 3.24Å; R98-A114 HydrophobicContact CG-CB 4.04Å; R98-A114 PolarHBondContact N-O 3Å; R98-A114 PolarHBondContact O-N 3.06Å; V100-A114 HydrophobicContact CG2-CB 3.56Å; A114-T121 HydrophobicContact CB-CG2 3.66Å; A114-F122 CarbonylContact C-O 3.58Å; A114-F122 VanDerWaalsContact CA-O 3.27Å; A114-F122 WeakPolarHBondContact CA-O 3.32Å; A114-E123 HydrophobicContact CB-CB 4.32Å
115	V	92.4	Very high	87.7	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	138.3	169.3	63.9	0	0	0	0	108.8	L95 Y97 V117 F122 A136 A140	L95-V115 HydrophobicContact CB-CG2 4.17Å; L95-V115 HydrophobicContact CD1-CG2 4.33Å; L95-V115 HydrophobicContact CD2-CG2 4.23Å; Y97-V115 HydrophobicContact CD1-CB 3.79Å; Y97-V115 HydrophobicContact CD1-CG2 4.14Å; Y97-V115 HydrophobicContact CD2-CG2 4.29Å; Y97-V115 HydrophobicContact CE1-CB 3.79Å; Y97-V115 HydrophobicContact CE1-CG1 4.27Å; Y97-V115 HydrophobicContact CE1-CG2 3.93Å; Y97-V115 HydrophobicContact CE2-CG2 4.06Å; Y97-V115 HydrophobicContact CG-CB 4.3Å; Y97-V115 HydrophobicContact CG-CG2 4.32Å; V115-V117 HydrophobicContact CG1-CG2 4.39Å; V115-V117 HydrophobicContact CG2-CG2 4.16Å; V115-F122 HydrophobicContact CG1-CB 4.07Å; V115-F122 PolarHBondContact N-O 3.47Å; V115-F122 PolarHBondContact O-N 3.24Å; V115-A136 HydrophobicContact CG1-CB 4.16Å; V115-A140 HydrophobicContact CG1-CB 4.13Å
116	E	87.8	Confident	88	Confident	100 Å²	100	54.3 Å²	54.3	47%	0.467	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	125.5	-179.6	-165.7	179.9	128	0	0	110.4	L95 R98 L120	L95-E116 WeakPolarHBondContact CD2-O 3.41Å; R98-E116 IonicContact CZ-OE2 4Å; R98-E116 IonicContact NH1-OE2 3.82Å; R98-E116 IonicContact NH2-OE2 3.59Å; E116-L120 WeakPolarHBondContact CA-O 3.35Å
117	V	83.4	Confident	88.4	Confident	4 Å²	4	51 Å²	51	2%	0.024	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	122.6	-175.3	-167.4	0	0	0	0	108.9	L95 V115 G119 L120 F122 A140 F144	L95-V117 HydrophobicContact CD1-CG2 4.31Å; L95-V117 HydrophobicContact CD2-CG2 3.89Å; V115-V117 HydrophobicContact CG1-CG2 4.39Å; V115-V117 HydrophobicContact CG2-CG2 4.16Å; V117-G119 PolarHBondContact O-N 2.86Å; V117-L120 PolarHBondContact N-O 2.96Å; V117-L120 WeakPolarHBondContact O-CB 3.37Å; V117-L120 PolarHBondContact O-N 3.02Å; V117-F122 HydrophobicContact CB-CD2 4.3Å; V117-F122 HydrophobicContact CB-CE2 4.08Å; V117-F122 HydrophobicContact CG2-CD2 4.21Å; V117-F122 HydrophobicContact CG2-CE2 4.47Å; V117-A140 HydrophobicContact CG2-CB 4.04Å; V117-F144 HydrophobicContact CG1-CE2 3.59Å; V117-F144 HydrophobicContact CG1-CZ 3.57Å
118	N	73.6	Confident	88.7	Confident	111 Å²	111	46.4 Å²	46.4	59%	0.594	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	35.1	-176.3	-68.9	-18	0	0	0	114	R92 L120	R92-N118 PolarHBondContact NH1-OD1 3.17Å; R92-N118 PolarHBondContact NH2-OD1 3.39Å; N118-L120 PolarHBondContact O-N 3.41Å
119	G	72.9	Confident	89	Confident	61 Å²	61	48.2 Å²	48.2	63%	0.629	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.4	-7	-174.7	0	0	0	0	0	114.7	V117	V117-G119 PolarHBondContact O-N 2.86Å
120	L	80.9	Confident	89	Confident	94 Å²	94	54.6 Å²	54.6	49%	0.492	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	131.8	173.6	-58.9	177.1	0	0	0	110	E116 V117 N118 F122	E116-L120 WeakPolarHBondContact CA-O 3.35Å; V117-L120 PolarHBondContact N-O 2.96Å; V117-L120 WeakPolarHBondContact O-CB 3.37Å; V117-L120 PolarHBondContact O-N 3.02Å; N118-L120 PolarHBondContact O-N 3.41Å; L120-F122 HydrophobicContact CB-CD2 4.45Å; L120-F122 HydrophobicContact CB-CE2 3.56Å; L120-F122 HydrophobicContact CB-CZ 3.66Å; L120-F122 HydrophobicContact CD1-CZ 3.96Å; L120-F122 HydrophobicContact CG-CZ 4.48Å
121	T	86.3	Confident	88.9	Confident	71 Å²	71	57.2 Å²	57.2	44%	0.436	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	118.1	177.2	-66.9	0	0	0	0	110.2	R98 A114	R98-T121 PolarHBondContact NH2-OG1 3.13Å; A114-T121 HydrophobicContact CB-CG2 3.66Å
122	F	91	Very high	88.9	Confident	34 Å²	34	56.1 Å²	56.1	15%	0.149	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	113.3	178.5	-60.9	-82.2	0	0	0	110.6	A114 V115 V117 L120 L139 A140 S143	A114-F122 CarbonylContact C-O 3.58Å; A114-F122 VanDerWaalsContact CA-O 3.27Å; A114-F122 WeakPolarHBondContact CA-O 3.32Å; V115-F122 HydrophobicContact CG1-CB 4.07Å; V115-F122 PolarHBondContact N-O 3.47Å; V115-F122 PolarHBondContact O-N 3.24Å; V117-F122 HydrophobicContact CB-CD2 4.3Å; V117-F122 HydrophobicContact CB-CE2 4.08Å; V117-F122 HydrophobicContact CG2-CD2 4.21Å; V117-F122 HydrophobicContact CG2-CE2 4.47Å; L120-F122 HydrophobicContact CB-CD2 4.45Å; L120-F122 HydrophobicContact CB-CE2 3.56Å; L120-F122 HydrophobicContact CB-CZ 3.66Å; L120-F122 HydrophobicContact CD1-CZ 3.96Å; L120-F122 HydrophobicContact CG-CZ 4.48Å; F122-L139 HydrophobicContact CB-CB 4.39Å; F122-L139 HydrophobicContact CD1-CB 4.37Å; F122-A140 HydrophobicContact CB-CB 4.11Å; F122-A140 HydrophobicContact CD2-CB 3.65Å; F122-A140 HydrophobicContact CE2-CB 4.23Å; F122-A140 HydrophobicContact CG-CB 3.83Å; F122-S143 VanDerWaalsContact CE1-CB 3.45Å; F122-S143 WeakPolarHBondContact CZ-OG 3.48Å
123	E	92.8	Very high	88.9	Confident	93 Å²	93	59.7 Å²	59.7	44%	0.435	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	130.2	-178.2	-171.8	171.9	-177.7	0	0	112.4	V100 S112 A114 L139	V100-E123 WeakPolarHBondContact CG1-OE1 3.39Å; V100-E123 HydrophobicContact CG2-CG 4.4Å; S112-E123 WeakPolarHBondContact CB-OE1 3.31Å; S112-E123 VanDerWaalsContact OG-CD 3.26Å; S112-E123 WeakPolarHBondContact OG-CG 3.43Å; S112-E123 PolarHBondContact OG-OE1 2.92Å; A114-E123 HydrophobicContact CB-CB 4.32Å; E123-L139 WeakPolarHBondContact O-CD1 3.28Å
124	G	93.7	Very high	88.8	Confident	1 Å²	1	62.1 Å²	62.1	1%	0.01	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	123.4	179.9	0	0	0	0	0	112.7	I113 A132	I113-G124 PolarHBondContact N-O 2.8Å; I113-G124 VanDerWaalsContact N-O 3.08Å; I113-G124 PolarHBondContact O-N 2.73Å; G124-A132 CarbonylContact O-C 3.51Å; G124-A132 WeakPolarHBondContact O-CA 3.45Å; G124-A132 VanDerWaalsContact O-CB 3.32Å; G124-A132 WeakPolarHBondContact O-CB 3.37Å
125	T	92.4	Very high	88.7	Confident	69 Å²	69	68.2 Å²	68.2	42%	0.423	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	154.3	177.7	49.9	0	0	0	0	113	F111 S112 R135	F111-T125 CarbonylContact O-C 3.19Å; F111-T125 WeakPolarHBondContact O-CA 3.41Å; S112-T125 VanDerWaalsContact OG-CG2 3.3Å; S112-T125 WeakPolarHBondContact OG-CG2 3.47Å; T125-R135 WeakPolarHBondContact O-CD 3.43Å
126	G	93.1	Very high	88.7	Confident	8 Å²	8	68.2 Å²	68.2	8%	0.082	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	176.4	165.7	166.8	0	0	0	0	0	115.4	F111 T128	F111-G126 PolarHBondContact N-O 3.45Å; F111-G126 PolarHBondContact O-N 3.29Å; G126-T128 PolarHBondContact O-N 3.43Å
127	P	90.6	Very high	88.9	Confident	79 Å²	79	63.5 Å²	63.5	51%	0.513	33%	0.331	S	S	.	.	S	Bend	trans	-70.4	0.2	-176.5	29.8	-38.2	0	0	0	114.7	P109 K131	P109-P127 WeakPolarHBondContact O-CA 3.24Å; P127-K131 HydrophobicContact CG-CD 4.24Å
128	T	91.5	Very high	89.2	Confident	71 Å²	71	66.4 Å²	66.4	44%	0.436	34%	0.344	S	S	.	.	S	Bend	trans	-144.9	149.1	169.4	60.7	0	0	0	0	109.6	F111 G126 K130 K131 A132	F111-T128 VanDerWaalsContact CD2-CA 3.47Å; G126-T128 PolarHBondContact O-N 3.43Å; T128-K130 PolarHBondContact O-N 3.06Å; T128-K131 PolarHBondContact O-N 3.17Å; T128-K131 WeakPolarHBondContact OG1-CB 3.27Å; T128-K131 PolarHBondContact OG1-N 2.88Å; T128-K131 VanDerWaalsContact OG1-N 3.12Å; T128-A132 WeakPolarHBondContact O-CB 3.45Å; T128-A132 PolarHBondContact O-N 2.7Å
129	K	90.8	Very high	89.9	Confident	92 Å²	92	64.3 Å²	64.3	40%	0.4	33%	0.333	S	S	.	.	H	α-helix	trans	-52.4	-26.6	172.2	-60.8	-179.6	-176.9	-179	0	112.7	M99 F111 I113 K133	M99-K129 HydrophobicContact CE-CD 3.77Å; M99-K129 HydrophobicContact SD-CD 4.36Å; F111-K129 HydrophobicContact CB-CG 4.18Å; F111-K129 HydrophobicContact CD1-CD 4.06Å; F111-K129 HydrophobicContact CD1-CG 3.43Å; F111-K129 VanDerWaalsContact CD1-CG 3.43Å; F111-K129 HydrophobicContact CD2-CG 4.23Å; F111-K129 HydrophobicContact CE1-CD 4.11Å; F111-K129 HydrophobicContact CE1-CG 3.79Å; F111-K129 HydrophobicContact CG-CG 3.66Å; F111-K129 HydrophobicContact CZ-CG 4.32Å; I113-K129 HydrophobicContact CD1-CB 3.98Å; I113-K129 HydrophobicContact CD1-CG 4.42Å; I113-K129 WeakPolarHBondContact CD1-O 3.39Å; K129-K133 WeakPolarHBondContact O-CG 3.41Å; K129-K133 PolarHBondContact O-N 3.42Å
130	K	90.6	Very high	90.6	Very high	166 Å²	166	61.4 Å²	61.4	72%	0.722	30%	0.303	S	S	*	.	H	α-helix	trans	-74.5	-46	173.9	-173.4	178	178.2	-177.6	0	113	T128 M134	T128-K130 PolarHBondContact O-N 3.06Å; K130-M134 PolarHBondContact O-N 2.95Å
131	K	90	Very high	90.8	Very high	117 Å²	117	57.7 Å²	57.7	51%	0.509	28%	0.283	S	S	.	.	H	α-helix	trans	-71	-35.6	179.5	-172.6	163.8	174.1	-178.6	0	111.8	P127 T128 M134 R135	P127-K131 HydrophobicContact CG-CD 4.24Å; T128-K131 PolarHBondContact O-N 3.17Å; T128-K131 WeakPolarHBondContact OG1-CB 3.27Å; T128-K131 PolarHBondContact OG1-N 2.88Å; T128-K131 VanDerWaalsContact OG1-N 3.12Å; K131-M134 PolarHBondContact O-N 3.18Å; K131-R135 PolarHBondContact O-N 2.73Å
132	A	92.9	Very high	90.6	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-57.9	-54.1	170.2	0	0	0	0	0	112	F111 I113 G124 T128 M134 R135 A136	F111-A132 HydrophobicContact CB-CB 4.23Å; F111-A132 WeakPolarHBondContact O-CB 3.35Å; I113-A132 HydrophobicContact CB-CB 4.15Å; I113-A132 HydrophobicContact CD1-CB 3.89Å; I113-A132 HydrophobicContact CG1-CB 3.94Å; G124-A132 CarbonylContact O-C 3.51Å; G124-A132 WeakPolarHBondContact O-CA 3.45Å; G124-A132 VanDerWaalsContact O-CB 3.32Å; G124-A132 WeakPolarHBondContact O-CB 3.37Å; T128-A132 WeakPolarHBondContact O-CB 3.45Å; T128-A132 PolarHBondContact O-N 2.7Å; A132-M134 VanDerWaalsContact C-N 3.29Å; A132-M134 PolarHBondContact O-N 3.07Å; A132-R135 PolarHBondContact O-N 3.44Å; A132-A136 PolarHBondContact O-N 2.97Å
133	K	92.9	Very high	89.8	Confident	79 Å²	79	61.2 Å²	61.2	34%	0.343	30%	0.298	S	S	.	.	H	α-helix	trans	-54.1	-42.9	173.4	-80.3	-171.5	-178.9	-156.4	0	113	L85 Y97 I113 K129 A136 A137	L85-K133 HydrophobicContact CD2-CB 4.15Å; Y97-K133 HydrophobicContact CD1-CB 4.23Å; Y97-K133 HydrophobicContact CD1-CD 4.18Å; Y97-K133 HydrophobicContact CD1-CG 3.8Å; Y97-K133 HydrophobicContact CE1-CB 4.4Å; Y97-K133 HydrophobicContact CE1-CG 4.44Å; Y97-K133 HydrophobicContact CG-CD 4.19Å; Y97-K133 HydrophobicContact CG-CG 4.28Å; I113-K133 HydrophobicContact CB-CG 4.45Å; I113-K133 HydrophobicContact CD1-CG 3.83Å; I113-K133 HydrophobicContact CG2-CG 3.74Å; K129-K133 WeakPolarHBondContact O-CG 3.41Å; K129-K133 PolarHBondContact O-N 3.42Å; K133-A136 PolarHBondContact O-N 2.72Å; K133-A137 PolarHBondContact O-N 3.39Å
134	M	92.7	Very high	88.6	Confident	54 Å²	54	60.1 Å²	60.1	27%	0.266	29%	0.292	S	S	.	.	H	α-helix	trans	-64.3	-44	179.9	-159.8	174.2	78.3	0	0	112	L85 K130 K131 A132 A137 E138	L85-M134 HydrophobicContact CD1-CB 3.97Å; L85-M134 HydrophobicContact CD1-CG 4.16Å; L85-M134 HydrophobicContact CG-CB 4.4Å; L85-M134 HydrophobicContact CG-CG 4.4Å; K130-M134 PolarHBondContact O-N 2.95Å; K131-M134 PolarHBondContact O-N 3.18Å; A132-M134 VanDerWaalsContact C-N 3.29Å; A132-M134 PolarHBondContact O-N 3.07Å; M134-A137 PolarHBondContact O-N 2.81Å; M134-E138 VanDerWaalsContact O-CG 3.32Å; M134-E138 WeakPolarHBondContact O-CG 3.26Å; M134-E138 PolarHBondContact O-N 2.94Å
135	R	90.3	Very high	86.8	Confident	129 Å²	129	65.4 Å²	65.4	49%	0.487	32%	0.324	S	S	.	.	H	α-helix	trans	-66.6	-36.7	176.6	-166.7	176.1	-177.1	84.1	-10.8	112.7	T125 K131 A132 A137 E138 L139	T125-R135 WeakPolarHBondContact O-CD 3.43Å; K131-R135 PolarHBondContact O-N 2.73Å; A132-R135 PolarHBondContact O-N 3.44Å; R135-A137 VanDerWaalsContact C-N 3.33Å; R135-E138 PolarHBondContact O-N 3.06Å; R135-L139 WeakPolarHBondContact O-CG 3.23Å; R135-L139 PolarHBondContact O-N 3.21Å
136	A	93.3	Very high	84.7	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-62.5	-42.6	173.2	0	0	0	0	0	111	I113 V115 A132 K133 L139 A140	I113-A136 WeakPolarHBondContact O-CB 3.47Å; V115-A136 HydrophobicContact CG1-CB 4.16Å; A132-A136 PolarHBondContact O-N 2.97Å; K133-A136 PolarHBondContact O-N 2.72Å; A136-L139 PolarHBondContact O-N 3.37Å; A136-A140 PolarHBondContact O-N 3.19Å
137	A	91.3	Very high	82	Confident	0 Å²	0	75.1 Å²	75.1	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-68.2	-36.7	175.9	0	0	0	0	0	113.2	A84 L85 L88 K133 M134 R135 L139 L141	A84-A137 HydrophobicContact CB-CB 4.37Å; L85-A137 HydrophobicContact CD2-CB 3.77Å; L85-A137 HydrophobicContact CG-CB 4.15Å; L88-A137 HydrophobicContact CB-CB 4.36Å; L88-A137 HydrophobicContact CD2-CB 3.63Å; K133-A137 PolarHBondContact O-N 3.39Å; M134-A137 PolarHBondContact O-N 2.81Å; R135-A137 VanDerWaalsContact C-N 3.33Å; A137-L139 VanDerWaalsContact C-N 3.31Å; A137-L139 PolarHBondContact O-N 2.88Å; A137-L141 WeakPolarHBondContact O-CB 3.49Å; A137-L141 WeakPolarHBondContact O-CG 3.43Å; A137-L141 PolarHBondContact O-N 2.99Å
138	E	90.1	Very high	79.5	Confident	65 Å²	65	76.7 Å²	76.7	30%	0.304	37%	0.371	S	S	.	.	H	α-helix	trans	-61	-38.1	172.1	-73.1	161.7	-157.5	0	0	112.2	A84 M134 R135 K142	A84-E138 HydrophobicContact CB-CG 3.67Å; M134-E138 VanDerWaalsContact O-CG 3.32Å; M134-E138 WeakPolarHBondContact O-CG 3.26Å; M134-E138 PolarHBondContact O-N 2.94Å; R135-E138 PolarHBondContact O-N 3.06Å; E138-K142 VanDerWaalsContact O-CG 3.29Å; E138-K142 WeakPolarHBondContact O-CG 3.46Å; E138-K142 PolarHBondContact O-N 2.85Å; E138-K142 VanDerWaalsContact O-N 3.1Å
139	L	87.9	Confident	77.2	Confident	68 Å²	68	78.1 Å²	78.1	36%	0.356	38%	0.376	S	S	.	.	H	α-helix	trans	-72.3	-46.1	177.9	-70.8	166.3	0	0	0	111.8	F122 E123 R135 A136 A137 L141 K142 S143	F122-L139 HydrophobicContact CB-CB 4.39Å; F122-L139 HydrophobicContact CD1-CB 4.37Å; E123-L139 WeakPolarHBondContact O-CD1 3.28Å; R135-L139 WeakPolarHBondContact O-CG 3.23Å; R135-L139 PolarHBondContact O-N 3.21Å; A136-L139 PolarHBondContact O-N 3.37Å; A137-L139 VanDerWaalsContact C-N 3.31Å; A137-L139 PolarHBondContact O-N 2.88Å; L139-L141 VanDerWaalsContact C-N 3.31Å; L139-L141 PolarHBondContact O-N 2.76Å; L139-K142 PolarHBondContact O-N 3.35Å; L139-K142 VanDerWaalsContact O-N 3.17Å; L139-S143 PolarHBondContact O-N 2.73Å; L139-S143 VanDerWaalsContact O-N 3.12Å
140	A	88.1	Confident	75.4	Confident	0 Å²	0	76.2 Å²	76.2	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-59.9	-39.7	174	0	0	0	0	0	112.3	L88 V115 V117 F122 A136 S143 F144	L88-A140 HydrophobicContact CD1-CB 4.2Å; L88-A140 HydrophobicContact CD2-CB 3.76Å; V115-A140 HydrophobicContact CG1-CB 4.13Å; V117-A140 HydrophobicContact CG2-CB 4.04Å; F122-A140 HydrophobicContact CB-CB 4.11Å; F122-A140 HydrophobicContact CD2-CB 3.65Å; F122-A140 HydrophobicContact CE2-CB 4.23Å; F122-A140 HydrophobicContact CG-CB 3.83Å; A136-A140 PolarHBondContact O-N 3.19Å; A140-S143 PolarHBondContact O-N 2.9Å; A140-F144 WeakPolarHBondContact O-CD2 3.22Å; A140-F144 PolarHBondContact O-N 3.33Å
141	L	85.3	Confident	73.2	Confident	15 Å²	15	73.2 Å²	73.2	8%	0.079	37%	0.374	C	S	.	.	H	α-helix	trans	-66	-36.5	174.3	-77.4	175.1	0	0	0	113.3	A84 Q87 L88 L91 A137 L139 S143 F144 V145	A84-L141 HydrophobicContact CB-CD1 3.82Å; A84-L141 WeakPolarHBondContact O-CD1 3.38Å; Q87-L141 HydrophobicContact CB-CD1 3.99Å; Q87-L141 HydrophobicContact CG-CD1 4.09Å; Q87-L141 HydrophobicContact CG-CD2 4.01Å; L88-L141 HydrophobicContact CB-CD1 4.29Å; L88-L141 HydrophobicContact CB-CD2 4.09Å; L88-L141 HydrophobicContact CB-CG 4.02Å; L88-L141 HydrophobicContact CD1-CD2 4.09Å; L88-L141 HydrophobicContact CD1-CG 4.3Å; L91-L141 HydrophobicContact CD1-CD2 3.65Å; A137-L141 WeakPolarHBondContact O-CB 3.49Å; A137-L141 WeakPolarHBondContact O-CG 3.43Å; A137-L141 PolarHBondContact O-N 2.99Å; L139-L141 VanDerWaalsContact C-N 3.31Å; L139-L141 PolarHBondContact O-N 2.76Å; L141-S143 VanDerWaalsContact C-N 3.27Å; L141-S143 PolarHBondContact O-N 2.89Å; L141-F144 WeakPolarHBondContact O-CB 3.49Å; L141-F144 PolarHBondContact O-N 2.86Å; L141-F144 VanDerWaalsContact O-N 3.08Å; L141-V145 WeakPolarHBondContact O-CG2 3.37Å; L141-V145 PolarHBondContact O-N 3.06Å; L141-V145 VanDerWaalsContact O-N 3.16Å
142	K	81.5	Confident	71.2	Confident	134 Å²	134	73.5 Å²	73.5	58%	0.583	38%	0.378	S	S	*	.	H	α-helix	trans	-62	-38.1	173.4	-75.9	168	-179.5	-177.3	0	111.5	E138 L139 F144 V145 Q146	E138-K142 VanDerWaalsContact O-CG 3.29Å; E138-K142 WeakPolarHBondContact O-CG 3.46Å; E138-K142 PolarHBondContact O-N 2.85Å; E138-K142 VanDerWaalsContact O-N 3.1Å; L139-K142 PolarHBondContact O-N 3.35Å; L139-K142 VanDerWaalsContact O-N 3.17Å; K142-F144 VanDerWaalsContact C-N 3.26Å; K142-F144 PolarHBondContact O-N 3.1Å; K142-V145 PolarHBondContact O-N 3.31Å; K142-Q146 PolarHBondContact O-N 2.94Å; K142-Q146 VanDerWaalsContact O-N 3.08Å
143	S	74.9	Confident	69	Low	45 Å²	45	75.3 Å²	75.3	32%	0.315	39%	0.393	S	S	.	.	H	α-helix	trans	-70.4	-14.9	173.4	-168	0	0	0	0	114.7	F122 L139 A140 L141	F122-S143 VanDerWaalsContact CE1-CB 3.45Å; F122-S143 WeakPolarHBondContact CZ-OG 3.48Å; L139-S143 PolarHBondContact O-N 2.73Å; L139-S143 VanDerWaalsContact O-N 3.12Å; A140-S143 PolarHBondContact O-N 2.9Å; L141-S143 VanDerWaalsContact C-N 3.27Å; L141-S143 PolarHBondContact O-N 2.89Å
144	F	67.8	Low	67	Low	70 Å²	70	79.1 Å²	79.1	31%	0.307	41%	0.411	S	S	.	.	H	α-helix	trans	-87.3	-22.1	169.6	-87.3	-67.3	0	0	0	113.3	L88 L91 V117 A140 L141 K142	L88-F144 HydrophobicContact CD1-CD2 3.99Å; L88-F144 HydrophobicContact CD1-CE2 3.59Å; L91-F144 HydrophobicContact CD1-CD2 4.26Å; L91-F144 HydrophobicContact CD1-CG 4.37Å; V117-F144 HydrophobicContact CG1-CE2 3.59Å; V117-F144 HydrophobicContact CG1-CZ 3.57Å; A140-F144 WeakPolarHBondContact O-CD2 3.22Å; A140-F144 PolarHBondContact O-N 3.33Å; L141-F144 WeakPolarHBondContact O-CB 3.49Å; L141-F144 PolarHBondContact O-N 2.86Å; L141-F144 VanDerWaalsContact O-N 3.08Å; K142-F144 VanDerWaalsContact C-N 3.26Å; K142-F144 PolarHBondContact O-N 3.1Å
145	V	54.2	Low	65.2	Low	113 Å²	113	83.8 Å²	83.8	69%	0.685	44%	0.437	S	S	*	.	H	α-helix	trans	-95.9	-20.4	-176.5	175	0	0	0	0	111.7	L141 K142	L141-V145 WeakPolarHBondContact O-CG2 3.37Å; L141-V145 PolarHBondContact O-N 3.06Å; L141-V145 VanDerWaalsContact O-N 3.16Å; K142-V145 PolarHBondContact O-N 3.31Å
146	Q	48.8	Very low	63.2	Low	136 Å²	136	81.6 Å²	81.6	64%	0.636	45%	0.447	S	S	*	.	S	Bend	trans	-72.4	129.4	161.2	-70	177.4	-35.3	0	0	109.1	K142	K142-Q146 PolarHBondContact O-N 2.94Å; K142-Q146 VanDerWaalsContact O-N 3.08Å
147	F	35.9	Very low	60.8	Low	144 Å²	144	89.3 Å²	89.3	63%	0.632	49%	0.485	S	S	*	.			trans	76.1	85.2	-174	-48.3	-67.4	0	0	0	118.3	A150 A153	F147-A150 HydrophobicContact CB-CB 4.32Å; F147-A153 HydrophobicContact CE1-CB 4.05Å
148	P	39.8	Very low	58.1	Low	112 Å²	112	92.4 Å²	92.4	73%	0.727	52%	0.516	S	S	*	.	S	Bend		-63.1	144.7	114.4	31.3	-26.3	0	0	0	110.1
149	N	42.9	Very low	55.4	Low	102 Å²	102	96.1 Å²	96.1	55%	0.545	54%	0.538	S	S	.	.			trans	59.4	53.4	175.4	-65.4	13.3	0	0	0	117.7	P151 Q152	N149-P151 VanDerWaalsContact C-N 3.3Å; N149-Q152 HydrophobicContact CB-CB 4.01Å; N149-Q152 PolarHBondContact ND2-OE1 2.87Å; N149-Q152 PolarHBondContact O-N 3.04Å; N149-Q152 VanDerWaalsContact O-N 3.1Å
150	A	51.6	Low	52.8	Low	52 Å²	52	99.6 Å²	99.6	43%	0.43	56%	0.556	S	S	.	*	H	α-helix	trans	-51.5	-31.5	165.6	0	0	0	0	0	116.3	F147 Q152 H154	F147-A150 HydrophobicContact CB-CB 4.32Å; A150-Q152 VanDerWaalsContact C-N 3.34Å; A150-H154 PolarHBondContact O-ND1 3.4Å; A150-H154 VanDerWaalsContact O-ND1 3.11Å
151	P	46.1	Very low	50.1	Low	102 Å²	102	104.1 Å²	104.1	66%	0.662	59%	0.588	S	S	*	*	H	α-helix	trans	-69.3	-29.9	175.2	-20.9	34	0	0	0	113.7	N149	N149-P151 VanDerWaalsContact C-N 3.3Å
152	Q	47.8	Very low	47.5	Very low	123 Å²	123	111 Å²	111	58%	0.575	62%	0.624	S	S	*	*	H	α-helix	trans	-85	-28	-169.7	-157.7	169.6	13.4	0	0	112.4	N149 A150 L155 A156	N149-Q152 HydrophobicContact CB-CB 4.01Å; N149-Q152 PolarHBondContact ND2-OE1 2.87Å; N149-Q152 PolarHBondContact O-N 3.04Å; N149-Q152 VanDerWaalsContact O-N 3.1Å; A150-Q152 VanDerWaalsContact C-N 3.34Å; Q152-L155 PolarHBondContact O-N 3.48Å; Q152-A156 PolarHBondContact O-N 3.46Å
153	A	46	Very low	45.6	Very low	39 Å²	39	109.8 Å²	109.8	32%	0.322	63%	0.63	S	S	.	*	H	α-helix	trans	-67.7	-35.1	174.2	0	0	0	0	0	112.9	F147 L155 A156 M157	F147-A153 HydrophobicContact CE1-CB 4.05Å; A153-L155 VanDerWaalsContact C-N 3.32Å; A153-L155 PolarHBondContact O-N 3.23Å; A153-A156 PolarHBondContact O-N 3.44Å; A153-M157 PolarHBondContact O-N 2.76Å
154	H	51.4	Low	43.6	Very low	158 Å²	158	113.5 Å²	113.5	73%	0.731	66%	0.656	S	S	*	*	H	α-helix	trans	-67.7	-31.5	176.3	-77.1	93.3	0	0	0	112.7	A150 A156	A150-H154 PolarHBondContact O-ND1 3.4Å; A150-H154 VanDerWaalsContact O-ND1 3.11Å; H154-A156 VanDerWaalsContact C-N 3.29Å; H154-A156 PolarHBondContact O-N 3.31Å
155	L	54.2	Low	41.8	Very low	152 Å²	152	115 Å²	115	80%	0.796	68%	0.681	S	S	*	*	H	α-helix	trans	-74	-18.2	174.8	-68.5	169.6	0	0	0	113.3	Q152 A153	Q152-L155 PolarHBondContact O-N 3.48Å; A153-L155 VanDerWaalsContact C-N 3.32Å; A153-L155 PolarHBondContact O-N 3.23Å
156	A	47.5	Very low	40.7	Very low	84 Å²	84	116.5 Å²	116.5	69%	0.694	69%	0.685	S	S	*	*	H	α-helix	trans	-96.5	-15	-179.6	0	0	0	0	0	114	Q152 A153 H154	Q152-A156 PolarHBondContact O-N 3.46Å; A153-A156 PolarHBondContact O-N 3.44Å; H154-A156 VanDerWaalsContact C-N 3.29Å; H154-A156 PolarHBondContact O-N 3.31Å
157	M	44.3	Very low	39.7	Very low	162 Å²	162	118.4 Å²	118.4	80%	0.798	69%	0.692	S	S	*	*	S	Bend	trans	-108	51.5	179.6	-69.5	-72.6	-68.7	0	0	110.6	A153	A153-M157 PolarHBondContact O-N 2.76Å
158	G	33.3	Very low	39.5	Very low	65 Å²	65	115.6 Å²	115.6	67%	0.67	69%	0.687	S	S	*	*			trans	-65.5	150.2	-176.6	0	0	0	0	0	113.3
159	N	34.9	Very low	39.1	Very low	143 Å²	143	115.2 Å²	115.2	77%	0.765	69%	0.687	S	S	*	*			trans	-149.3	108.2	179.8	-131.4	15.6	0	0	0	113.4
160	I	33.4	Very low	38.4	Very low	141 Å²	141	117.1 Å²	117.1	72%	0.723	70%	0.697	S	S	*	*			trans	71.1	130.4	142.4	-51.9	160.9	0	0	0	119.8
161	S	30.6	Very low	37.5	Very low	95 Å²	95	123.2 Å²	123.2	66%	0.664	72%	0.717	S	S	*	*			trans	53	106.3	157.9	67.9	0	0	0	0	120.8
162	N	30.7	Very low	36.7	Very low	159 Å²	159	122.4 Å²	122.4	85%	0.85	72%	0.718	S	S	*	*				-154.3	154.7	94.9	-99.5	-20.4	0	0	0	111.2
163	P	41.3	Very low	35.9	Very low	109 Å²	109	123.3 Å²	123.3	71%	0.708	73%	0.727	S	S	*	*			trans	-96.6	173	-177.9	37.7	-35.2	0	0	0	114.1
164	S	33.5	Very low	35.1	Very low	123 Å²	123	131 Å²	131	86%	0.86	75%	0.754	S	S	*	*			trans	82.9	158.8	168.4	79.5	0	0	0	0	118.6
165	A	30.5	Very low	34.8	Very low	100 Å²	100	128.2 Å²	128.2	83%	0.826	75%	0.749	S	S	*	*			trans	72.6	82.6	178.4	0	0	0	0	0	118.4
166	D	30.7	Very low	33.7	Very low	145 Å²	145	127.5 Å²	127.5	78%	0.775	75%	0.746	S	S	*	*			trans	-73.9	141.2	145.8	152.6	47.8	0	0	0	109.9
167	F	28	Very low	32.9	Very low	176 Å²	176	128.9 Å²	128.9	77%	0.772	75%	0.746	S	S	*	*			trans	-167.6	86.5	147.6	-155.4	-105.4	0	0	0	116.1
168	T	30.7	Very low	32.4	Very low	86 Å²	86	128.7 Å²	128.7	53%	0.528	75%	0.748	S	S	.	*			trans	54.1	157.9	144.1	75.8	0	0	0	0	124.8
169	S	31.2	Very low	32.2	Very low	104 Å²	104	134.2 Å²	134.2	73%	0.727	75%	0.754	S	S	*	*			trans	84.8	157.7	149.8	78.1	0	0	0	0	121.4
170	D	29.8	Very low	32	Very low	141 Å²	141	135.2 Å²	135.2	75%	0.754	75%	0.751	S	S	*	*				-169.2	134.4	-56.3	-98.6	-39.1	0	0	0	112.5
171	Q	31	Very low	31.7	Very low	181 Å²	181	134.6 Å²	134.6	85%	0.846	75%	0.745	S	S	*	*			trans	53.3	172.2	148	-63.6	-152.5	18.8	0	0	124.6
172	A	30.9	Very low	31.7	Very low	85 Å²	85	138.3 Å²	138.3	70%	0.702	75%	0.75	S	S	*	*			trans	71.2	120.8	176.9	0	0	0	0	0	116.3
173	D	30.9	Very low	31.6	Very low	141 Å²	141	139.2 Å²	139.2	75%	0.754	75%	0.749	S	S	*	*			cis	70.7	114.2	33.3	-66.6	-44.2	0	0	0	116.8
174	F	27.6	Very low	30.9	Very low	202 Å²	202	138.8 Å²	138.8	89%	0.886	75%	0.754	S	S	*	*				162.9	158.3	128.6	-88.2	-59.7	0	0	0	110.2
175	P	46.8	Very low	30.5	Very low	98 Å²	98	138.4 Å²	138.4	64%	0.636	75%	0.752	S	S	*	*			trans	-140.4	-160	-131.8	37.5	-12.7	0	0	0	114.8
176	D	31	Very low	31.2	Very low	137 Å²	137	138.6 Å²	138.6	73%	0.733	75%	0.745	S	S	*	*			trans	83.7	128.9	140.6	-90.5	-28.1	0	0	0	123.6
177	T	29.8	Very low	30.8	Very low	113 Å²	113	137.6 Å²	137.6	69%	0.693	75%	0.748	S	S	*	*			trans	66.9	109.1	151.1	60.1	0	0	0	0	120.5
178	L	33.3	Very low	30.8	Very low	159 Å²	159	133.6 Å²	133.6	83%	0.832	74%	0.741	S	S	*	*				-159.8	107.3	111.2	-106.1	144	0	0	0	111.8
179	F	30.1	Very low	30.6	Very low	180 Å²	180	138.2 Å²	138.2	79%	0.789	76%	0.757	S	S	*	*			trans	29.8	106.8	154.9	-67.3	-103	0	0	0	118.5
180	K	29.8	Very low	30.3	Very low	165 Å²	165	136 Å²	136	72%	0.717	75%	0.751	S	S	*	*				52.3	122.2	81.2	-76.7	-161.4	170.8	-107.7	0	115.2
181	E	28.3	Very low	30.3	Very low	127 Å²	127	138 Å²	138	59%	0.593	76%	0.76	S	S	*	*			cis	83.5	115.1	43.5	-175.3	-154.6	-120.3	0	0	113.3
182	F	30.4	Very low	30	Very low	173 Å²	173	132.9 Å²	132.9	76%	0.759	75%	0.75	S	S	*	*				-165.6	165.4	117.3	-130.4	-96.9	0	0	0	115.5
183	E	28.2	Very low	29.9	Very low	178 Å²	178	136.8 Å²	136.8	83%	0.832	76%	0.758	S	S	*	*			trans	-94.7	-151	-177.2	-56.1	-169.9	124.6	0	0	113.7
184	A	27.4	Very low	29.5	Very low	100 Å²	100	136.1 Å²	136.1	83%	0.826	76%	0.763	S	S	*	*			trans	-117.6	-168.4	-154.7	0	0	0	0	0	116.3
185	S	23.3	Very low	29.5	Very low	115 Å²	115	131 Å²	131	80%	0.804	76%	0.757	S	S	*	*			trans	102.3	169.5	167.2	-129.6	0	0	0	0	116.3
186	P	45.6	Very low	29.3	Very low	104 Å²	104	131.6 Å²	131.6	68%	0.675	76%	0.762	S	S	*	*				-137.9	178.5	-98.7	43.2	-25.2	0	0	0	117.6
187	C	22	Very low	29	Very low	124 Å²	124	131.4 Å²	131.4	84%	0.838	77%	0.765	S	S	*	*			trans	67.2	148.1	170.1	-61.6	0	0	0	0	115.8
188	S	28.5	Very low	29	Very low	92 Å²	92	130.5 Å²	130.5	64%	0.643	76%	0.763	S	S	*	*			cis	-156.9	-158.9	-14.2	-76.2	0	0	0	0	107.1
189	E	26.6	Very low	28.7	Very low	184 Å²	184	131.6 Å²	131.6	86%	0.86	77%	0.765	S	S	*	*			cis	-160.1	-178.2	-2.6	-149.5	128	-82.2	0	0	110.7
190	G	25.4	Very low	29	Very low	58 Å²	58	128.2 Å²	128.2	60%	0.598	76%	0.763	S	S	*	*			trans	102.7	117.6	173	0	0	0	0	0	114
191	L	28.7	Very low	29.3	Very low	181 Å²	181	127.6 Å²	127.6	95%	0.948	77%	0.768	S	S	*	*				74.6	128.2	63.9	-68	177.7	0	0	0	113.6
192	A	25.8	Very low	29.6	Very low	75 Å²	75	128.3 Å²	128.3	62%	0.62	78%	0.775	S	S	*	*			cis	-164.6	165.8	-1.2	0	0	0	0	0	114.2
193	L	27.5	Very low	29.7	Very low	167 Å²	167	127.9 Å²	127.9	87%	0.874	78%	0.78	S	S	*	*			trans	64.2	141.5	159.3	-62.9	163.3	0	0	0	117.4
194	C	24.3	Very low	30.1	Very low	127 Å²	127	124.5 Å²	124.5	86%	0.858	78%	0.776	S	S	*	*			cis	-145.8	173.6	37.7	-85.9	0	0	0	0	114.6
195	A	27.5	Very low	30.7	Very low	94 Å²	94	123.3 Å²	123.3	78%	0.777	76%	0.761	S	S	*	*			trans	-153.2	176.8	168.3	0	0	0	0	0	108.4
196	P	41.3	Very low	31.3	Very low	111 Å²	111	123.4 Å²	123.4	72%	0.721	75%	0.749	S	S	*	*			cis	-129.5	177.6	-2.9	42.8	-28.3	0	0	0	114.2
197	T	24.5	Very low	31	Very low	132 Å²	132	125.5 Å²	125.5	81%	0.81	75%	0.754	S	S	*	*				176.1	153.1	123.8	35.8	0	0	0	0	112.1
198	S	29.8	Very low	32	Very low	94 Å²	94	126.1 Å²	126.1	66%	0.657	75%	0.748	S	S	*	*			trans	7.2	121.9	158.2	56.6	0	0	0	0	120.2
199	E	28.3	Very low	32.4	Very low	183 Å²	183	130.4 Å²	130.4	86%	0.855	75%	0.75	S	S	*	*				-174.7	147.7	97.4	-94.1	-59	93.4	0	0	110.5
200	S	35.3	Very low	32.9	Very low	109 Å²	109	128 Å²	128	76%	0.762	74%	0.739	S	S	*	*			trans	-123.2	71.2	-174.5	174.3	0	0	0	0	112.4
201	D	37.3	Very low	33.5	Very low	151 Å²	151	127.9 Å²	127.9	81%	0.807	74%	0.737	S	S	*	*			trans	-160.6	149.2	157.1	-115.9	-31.9	0	0	0	112.8
202	L	34.2	Very low	34.1	Very low	142 Å²	142	128.8 Å²	128.8	74%	0.743	73%	0.728	S	S	*	*			trans	139.3	-24.7	158.5	-80.1	165.9	0	0	0	116	S204 S205	L202-S204 PolarHBondContact O-N 3.08Å; L202-S205 PolarHBondContact O-N 3.01Å
203	L	32.1	Very low	34.7	Very low	165 Å²	165	131.3 Å²	131.3	86%	0.864	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.1	5.9	-170.1	-71.4	176.5	0	0	0	116.4
204	S	37	Very low	35.3	Very low	107 Å²	107	129.4 Å²	129.4	75%	0.748	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	-9.5	176.2	-62.4	0	0	0	0	114.6	L202	L202-S204 PolarHBondContact O-N 3.08Å
205	S	40.3	Very low	36	Very low	75 Å²	75	132.1 Å²	132.1	52%	0.524	71%	0.713	S	S	.	*	S	Bend	trans	-92.6	-37.2	-169.1	-162.3	0	0	0	0	114.8	L202 L207 L208	L202-S205 PolarHBondContact O-N 3.01Å; S205-L207 PolarHBondContact O-N 2.83Å; S205-L208 PolarHBondContact O-N 3.03Å
206	E	34.5	Very low	36.6	Very low	117 Å²	117	134.3 Å²	134.3	55%	0.547	71%	0.706	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.1	-36.7	-167.1	-70.1	-94.3	97.1	0	0	114	L208 R209 H210	E206-L208 PolarHBondContact O-N 3.39Å; E206-R209 PolarHBondContact O-N 2.99Å; E206-H210 PolarHBondContact O-N 2.91Å
207	L	40.2	Very low	36.4	Very low	148 Å²	148	133 Å²	133	78%	0.775	70%	0.697	S	S	*	*	H	α-helix	trans	-63.5	-25.1	179.3	-72.6	169.8	0	0	0	112.8	S205	S205-L207 PolarHBondContact O-N 2.83Å
208	L	42.5	Very low	37.1	Very low	136 Å²	136	132.1 Å²	132.1	71%	0.712	69%	0.686	S	S	*	*	H	α-helix	trans	-79.1	-17	176.5	-79.6	160.8	0	0	0	113.6	S205 E206	S205-L208 PolarHBondContact O-N 3.03Å; E206-L208 PolarHBondContact O-N 3.39Å
209	R	37.4	Very low	37.6	Very low	183 Å²	183	131.9 Å²	131.9	69%	0.691	68%	0.678	S	S	*	*	H	α-helix	trans	-81.5	-45.2	173.7	-81.2	-177.5	162.4	-178.7	-5.5	112.2	E206 G211 R212	E206-R209 PolarHBondContact O-N 2.99Å; R209-G211 VanDerWaalsContact C-N 3.28Å; R209-G211 PolarHBondContact O-N 2.98Å; R209-R212 PolarHBondContact O-N 3.03Å
210	H	36.8	Very low	38.2	Very low	134 Å²	134	128.2 Å²	128.2	62%	0.62	66%	0.663	S	S	*	*	H	α-helix	trans	-59.3	-36.2	-179.9	-85.1	89	0	0	0	113.3	E206 R212 L213	E206-H210 PolarHBondContact O-N 2.91Å; H210-R212 PolarHBondContact O-N 3.03Å; H210-R212 VanDerWaalsContact O-N 3.11Å; H210-L213 PolarHBondContact O-N 2.82Å
211	G	38.8	Very low	38.3	Very low	55 Å²	55	128.7 Å²	128.7	57%	0.567	66%	0.655	S	S	*	*	H	α-helix	trans	-63.8	-11.4	175	0	0	0	0	0	115.7	R209	R209-G211 VanDerWaalsContact C-N 3.28Å; R209-G211 PolarHBondContact O-N 2.98Å
212	R	41.4	Very low	38.6	Very low	199 Å²	199	125.2 Å²	125.2	75%	0.751	64%	0.639	S	S	*	*	H	α-helix	trans	-96.5	-29.2	176.2	-68.6	-167.2	180	-151.8	2.7	114.2	R209 H210	R209-R212 PolarHBondContact O-N 3.03Å; H210-R212 PolarHBondContact O-N 3.03Å; H210-R212 VanDerWaalsContact O-N 3.11Å
213	L	38	Very low	38.9	Very low	128 Å²	128	124.4 Å²	124.4	67%	0.67	63%	0.631	S	S	*	*	H	α-helix	trans	-68.8	-47.5	179.9	-112.1	74.5	0	0	0	112	H210 R215 H216 T217	H210-L213 PolarHBondContact O-N 2.82Å; L213-R215 PolarHBondContact O-N 2.87Å; L213-R215 VanDerWaalsContact O-N 3.09Å; L213-H216 PolarHBondContact O-N 3.44Å; L213-T217 PolarHBondContact O-N 3.02Å
214	L	40.2	Very low	39.2	Very low	127 Å²	127	119.4 Å²	119.4	67%	0.665	61%	0.614	S	S	*	*	H	α-helix	trans	-54.1	-32.1	177.9	-81.8	163.2	0	0	0	113.3	L218	L214-L218 PolarHBondContact O-N 3.25Å
215	R	39.5	Very low	39.4	Very low	185 Å²	185	122.1 Å²	122.1	70%	0.698	62%	0.615	S	S	*	*	H	α-helix	trans	-69.4	-37.1	177.6	-171.1	171.8	179.9	158.2	0.5	112.5	L213 D219	L213-R215 PolarHBondContact O-N 2.87Å; L213-R215 VanDerWaalsContact O-N 3.09Å; R215-D219 PolarHBondContact O-N 3.24Å
216	H	38.6	Very low	39.7	Very low	139 Å²	139	126.1 Å²	126.1	64%	0.644	63%	0.625	S	S	*	*	H	α-helix	trans	-70.3	-38.7	179.6	-118.8	-70.7	0	0	0	112.3	L213 L220	L213-H216 PolarHBondContact O-N 3.44Å; H216-L220 VanDerWaalsContact O-CG 3.31Å; H216-L220 WeakPolarHBondContact O-CG 3.28Å; H216-L220 PolarHBondContact O-N 2.83Å; H216-L220 VanDerWaalsContact O-N 3.16Å
217	T	37.5	Very low	40.1	Very low	85 Å²	85	131.5 Å²	131.5	52%	0.521	64%	0.64	S	S	.	*	H	α-helix	trans	-66.2	-40.3	177.9	-45.4	0	0	0	0	111.8	L213 L220 M221	L213-T217 PolarHBondContact O-N 3.02Å; T217-L220 PolarHBondContact O-N 3.44Å; T217-M221 WeakPolarHBondContact O-CG 3.39Å; T217-M221 PolarHBondContact O-N 2.82Å; T217-M221 VanDerWaalsContact O-N 3.1Å
218	L	39.9	Very low	39.9	Very low	112 Å²	112	131.9 Å²	131.9	59%	0.586	64%	0.642	S	S	*	*	H	α-helix	trans	-66.2	-45.8	176.5	-89.1	160.7	0	0	0	112.9	L214 L220 M221 V222	L214-L218 PolarHBondContact O-N 3.25Å; L218-L220 PolarHBondContact O-N 2.86Å; L218-M221 PolarHBondContact O-N 2.72Å; L218-V222 WeakPolarHBondContact O-CG2 3.27Å; L218-V222 PolarHBondContact O-N 2.79Å; L218-V222 VanDerWaalsContact O-N 3.17Å
219	D	40.8	Very low	39.9	Very low	89 Å²	89	129.9 Å²	129.9	48%	0.476	66%	0.655	S	S	.	*	H	α-helix	trans	-63	-30.1	177.2	-80.7	-34.1	0	0	0	112.2	R215 Q223	R215-D219 PolarHBondContact O-N 3.24Å; D219-Q223 WeakPolarHBondContact O-CG 3.38Å; D219-Q223 PolarHBondContact O-N 3.22Å
220	L	40.5	Very low	39.6	Very low	106 Å²	106	124.4 Å²	124.4	56%	0.555	66%	0.655	S	S	*	*	H	α-helix	trans	-72.2	-42.1	173.9	-74.7	168.6	0	0	0	112.9	H216 T217 L218 V222 Q223 A224	H216-L220 VanDerWaalsContact O-CG 3.31Å; H216-L220 WeakPolarHBondContact O-CG 3.28Å; H216-L220 PolarHBondContact O-N 2.83Å; H216-L220 VanDerWaalsContact O-N 3.16Å; T217-L220 PolarHBondContact O-N 3.44Å; L218-L220 PolarHBondContact O-N 2.86Å; L220-V222 VanDerWaalsContact C-N 3.34Å; L220-V222 PolarHBondContact O-N 3.27Å; L220-Q223 PolarHBondContact O-N 2.79Å; L220-A224 PolarHBondContact O-N 3.12Å
221	M	37.6	Very low	39.6	Very low	119 Å²	119	125.9 Å²	125.9	59%	0.586	67%	0.666	S	S	*	*	H	α-helix	trans	-62.6	-40.6	177.4	-72	180	72.4	0	0	112.2	T217 L218 Q223 A224 Q225	T217-M221 WeakPolarHBondContact O-CG 3.39Å; T217-M221 PolarHBondContact O-N 2.82Å; T217-M221 VanDerWaalsContact O-N 3.1Å; L218-M221 PolarHBondContact O-N 2.72Å; M221-Q223 VanDerWaalsContact C-N 3.28Å; M221-Q223 PolarHBondContact O-N 3.23Å; M221-A224 PolarHBondContact O-N 3.46Å; M221-Q225 PolarHBondContact O-N 2.83Å; M221-Q225 VanDerWaalsContact O-N 3.14Å
222	V	42.1	Very low	39.2	Very low	79 Å²	79	129.5 Å²	129.5	48%	0.479	68%	0.677	S	S	.	*	H	α-helix	trans	-64.2	-32.7	177.3	173.7	0	0	0	0	112.1	L218 L220	L218-V222 WeakPolarHBondContact O-CG2 3.27Å; L218-V222 PolarHBondContact O-N 2.79Å; L218-V222 VanDerWaalsContact O-N 3.17Å; L220-V222 VanDerWaalsContact C-N 3.34Å; L220-V222 PolarHBondContact O-N 3.27Å
223	Q	41.8	Very low	38.9	Very low	124 Å²	124	125.3 Å²	125.3	58%	0.579	68%	0.675	S	S	*	*	H	α-helix	trans	-78.5	-32.9	175.4	-69.7	179.2	39.2	0	0	112.8	D219 L220 M221 Q226	D219-Q223 WeakPolarHBondContact O-CG 3.38Å; D219-Q223 PolarHBondContact O-N 3.22Å; L220-Q223 PolarHBondContact O-N 2.79Å; M221-Q223 VanDerWaalsContact C-N 3.28Å; M221-Q223 PolarHBondContact O-N 3.23Å; Q223-Q226 PolarHBondContact O-N 3.25Å
224	A	36.9	Very low	38.6	Very low	60 Å²	60	127.6 Å²	127.6	50%	0.496	68%	0.683	S	S	.	*	H	α-helix	trans	-64.5	-43.3	175.9	0	0	0	0	0	112.2	L220 M221 Q226 R227	L220-A224 PolarHBondContact O-N 3.12Å; M221-A224 PolarHBondContact O-N 3.46Å; A224-Q226 PolarHBondContact O-N 2.78Å; A224-Q226 VanDerWaalsContact O-N 3.09Å; A224-R227 PolarHBondContact O-N 3.16Å; A224-R227 VanDerWaalsContact O-N 3.15Å
225	Q	42.2	Very low	38.6	Very low	165 Å²	165	126.9 Å²	126.9	77%	0.771	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	-11.8	176.7	-83.4	-174.4	-60.4	0	0	114.6	M221	M221-Q225 PolarHBondContact O-N 2.83Å; M221-Q225 VanDerWaalsContact O-N 3.14Å
226	Q	46.2	Very low	38.7	Very low	158 Å²	158	125.9 Å²	125.9	74%	0.738	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.6	6.1	177.3	-65.9	-178.5	6.5	0	0	113.7	Q223 A224	Q223-Q226 PolarHBondContact O-N 3.25Å; A224-Q226 PolarHBondContact O-N 2.78Å; A224-Q226 VanDerWaalsContact O-N 3.09Å
227	R	42.5	Very low	38.9	Very low	230 Å²	230	123.1 Å²	123.1	87%	0.868	69%	0.69	S	S	*	*	S	Bend	trans	-121.5	-1.3	-177.4	-73.9	-171.3	172.5	-172.8	-1.2	116.1	A224	A224-R227 PolarHBondContact O-N 3.16Å; A224-R227 VanDerWaalsContact O-N 3.15Å
228	L	36.5	Very low	39.7	Very low	156 Å²	156	124.6 Å²	124.6	82%	0.817	70%	0.701	S	S	*	*	S	Bend	trans	-115.7	118.3	170	-82.5	139.6	0	0	0	108.8	G230	L228-G230 PolarHBondContact O-N 2.9Å
229	G	42.8	Very low	41.4	Very low	94 Å²	94	124 Å²	124	97%	0.969	69%	0.694	S	S	*	*			trans	-72.4	113.9	-178.8	0	0	0	0	0	111.4
230	G	31.1	Very low	43.4	Very low	68 Å²	68	121.4 Å²	121.4	70%	0.701	68%	0.683	S	S	*	*			trans	-150.9	126.1	177.5	0	0	0	0	0	111.2	L228	L228-G230 PolarHBondContact O-N 2.9Å
231	I	35.9	Very low	45.6	Very low	166 Å²	166	116.8 Å²	116.8	85%	0.851	66%	0.659	S	S	*	*			trans	-14.6	123	176.2	-58.4	170.2	0	0	0	115.6	P233	I231-P233 WeakPolarHBondContact O-CD 3.28Å
232	V	30.9	Very low	48	Very low	130 Å²	130	113 Å²	113	79%	0.788	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-72.1	126.1	177.1	175.9	0	0	0	0	111.7
233	P	35.2	Very low	50	Low	111 Å²	111	111.4 Å²	111.4	72%	0.721	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-81.1	146	161.7	-8.8	27.5	0	0	0	111.4	I231	I231-P233 WeakPolarHBondContact O-CD 3.28Å
234	E	31.2	Very low	52.2	Low	177 Å²	177	107.4 Å²	107.4	83%	0.827	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-59.1	148.2	174.1	-86.9	-76	111.3	0	0	112.6	E236	E234-E236 PolarHBondContact O-N 3.3Å
235	P	41.4	Very low	54.6	Low	111 Å²	111	104.5 Å²	104.5	72%	0.721	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-75.7	116.2	-175.8	29.9	-34.1	0	0	0	112.7
236	E	41.7	Very low	56.8	Low	164 Å²	164	100 Å²	100	77%	0.766	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-56.3	143.9	171.8	-72.4	-158.6	153.9	0	0	112.6	E234	E234-E236 PolarHBondContact O-N 3.3Å
237	A	41.9	Very low	58.8	Low	81 Å²	81	97.3 Å²	97.3	67%	0.669	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-63.6	144.6	-179	0	0	0	0	0	112.3	K239	A237-K239 PolarHBondContact O-N 3.5Å
238	P	55.6	Low	60.8	Low	117 Å²	117	89.2 Å²	89.2	76%	0.76	54%	0.538	S	S	*	.			trans	-62.7	110.7	-175.8	24.8	-34.5	0	0	0	111.9	S240	P238-S240 PolarHBondContact O-N 2.96Å
239	K	74.9	Confident	63	Low	100 Å²	100	86 Å²	86	44%	0.435	52%	0.515	S	S	.	.			trans	-59.9	128.7	-179.3	-60.1	-170.5	-179.2	-169	0	111.4	A237 E247	A237-K239 PolarHBondContact O-N 3.5Å; K239-E247 WeakPolarHBondContact CD-OE1 3.42Å; K239-E247 WeakPolarHBondContact CD-OE2 3.47Å; K239-E247 IonicContact NZ-OE1 2.71Å; K239-E247 PolarHBondContact NZ-OE1 3.03Å; K239-E247 IonicContact NZ-OE2 2.88Å; K239-E247 PolarHBondContact NZ-OE2 3.3Å
240	S	83	Confident	65	Low	34 Å²	34	86.8 Å²	86.8	24%	0.238	50%	0.503	C	S	.	.			trans	-66.9	146.2	-178.5	-165.6	0	0	0	0	111.4	P238 V242 A243 L244 E310	P238-S240 PolarHBondContact O-N 2.96Å; S240-V242 PolarHBondContact O-N 3.32Å; S240-A243 WeakPolarHBondContact O-CA 3.34Å; S240-A243 WeakPolarHBondContact O-CB 3.12Å; S240-A243 PolarHBondContact O-N 3.36Å; S240-L244 PolarHBondContact O-N 2.87Å; S240-L244 VanDerWaalsContact O-N 3.12Å; S240-E310 WeakPolarHBondContact CA-OE1 3.09Å; S240-E310 VanDerWaalsContact CB-OE1 3.23Å; S240-E310 WeakPolarHBondContact CB-OE1 3.04Å; S240-E310 PolarHBondContact OG-OE1 3.28Å
241	P	86.1	Confident	67.4	Low	9 Å²	9	86.7 Å²	86.7	6%	0.058	50%	0.502	C	S	.	.	H	α-helix	trans	-54.6	-30.1	-174.7	-28.6	34.3	0	0	0	115.4	L245 T292 A295 Q296 L299 T307	P241-L245 WeakPolarHBondContact O-CB 3.35Å; P241-L245 PolarHBondContact O-N 2.77Å; P241-L245 VanDerWaalsContact O-N 3.15Å; P241-T292 HydrophobicContact CB-CG2 4.12Å; P241-T292 HydrophobicContact CG-CG2 3.87Å; P241-A295 HydrophobicContact CB-CB 4.41Å; P241-Q296 HydrophobicContact CB-CB 4.3Å; P241-L299 HydrophobicContact CB-CD1 4.02Å; P241-L299 WeakPolarHBondContact O-CD1 3.41Å; P241-T307 HydrophobicContact CB-CG2 4.33Å; P241-T307 HydrophobicContact CG-CG2 4.12Å; P241-T307 WeakPolarHBondContact CG-OG1 3.39Å
242	V	87.6	Confident	69.7	Low	40 Å²	40	80.1 Å²	80.1	24%	0.242	47%	0.469	C	S	.	.	H	α-helix	trans	-68.4	-37.2	175.8	-175.8	0	0	0	0	111.7	S240 N246 Y254 K291 A295	S240-V242 PolarHBondContact O-N 3.32Å; V242-N246 WeakPolarHBondContact O-CB 3.48Å; V242-N246 PolarHBondContact O-N 2.81Å; V242-Y254 HydrophobicContact CG1-CE2 4.26Å; V242-K291 HydrophobicContact CG2-CB 4.36Å; V242-A295 HydrophobicContact CB-CB 4.48Å; V242-A295 HydrophobicContact CG2-CB 4.05Å
243	A	85.6	Confident	72	Confident	44 Å²	44	79.3 Å²	79.3	36%	0.364	45%	0.451	S	S	.	.	H	α-helix	trans	-72.6	-49.6	178.3	0	0	0	0	0	110.4	S240 L245 N246 E247	S240-A243 WeakPolarHBondContact O-CA 3.34Å; S240-A243 WeakPolarHBondContact O-CB 3.12Å; S240-A243 PolarHBondContact O-N 3.36Å; A243-L245 VanDerWaalsContact C-N 3.31Å; A243-L245 PolarHBondContact O-N 3.17Å; A243-N246 CarbonylContact O-C 3.38Å; A243-N246 WeakPolarHBondContact O-CA 3.43Å; A243-N246 PolarHBondContact O-N 2.56Å; A243-E247 PolarHBondContact O-N 3.1Å
244	L	87.6	Confident	74.4	Confident	40 Å²	40	75.3 Å²	75.3	21%	0.209	42%	0.422	C	S	.	.	H	α-helix	trans	-58.8	-40.1	179.9	-176.3	60.7	0	0	0	112.6	S240 N246 E247 L248 L299 I305 T307	S240-L244 PolarHBondContact O-N 2.87Å; S240-L244 VanDerWaalsContact O-N 3.12Å; L244-N246 VanDerWaalsContact C-N 3.32Å; L244-N246 PolarHBondContact O-N 3.48Å; L244-E247 PolarHBondContact O-N 2.86Å; L244-L248 HydrophobicContact CG-CD1 4.45Å; L244-L248 WeakPolarHBondContact O-CG 3.47Å; L244-L248 PolarHBondContact O-N 3.21Å; L244-L248 VanDerWaalsContact O-N 3.09Å; L244-L299 HydrophobicContact CB-CD1 4.37Å; L244-L299 HydrophobicContact CD2-CD1 4.31Å; L244-L299 HydrophobicContact CG-CD1 4.48Å; L244-L299 HydrophobicContact CG-CD2 4.29Å; L244-I305 HydrophobicContact CD2-CG2 3.83Å; L244-T307 HydrophobicContact CD2-CG2 3.83Å
245	L	87.1	Confident	76.4	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	40%	0.396	C	S	.	.	H	α-helix	trans	-66.6	-33.6	174.6	-175.6	61.2	0	0	0	112.6	P241 A243 R249 L252 V275 A295 A298 L299 F303	P241-L245 WeakPolarHBondContact O-CB 3.35Å; P241-L245 PolarHBondContact O-N 2.77Å; P241-L245 VanDerWaalsContact O-N 3.15Å; A243-L245 VanDerWaalsContact C-N 3.31Å; A243-L245 PolarHBondContact O-N 3.17Å; L245-R249 PolarHBondContact O-N 3.41Å; L245-L252 HydrophobicContact CD1-CD1 4.17Å; L245-L252 HydrophobicContact CD2-CD1 4.06Å; L245-L252 HydrophobicContact CG-CD1 3.64Å; L245-V275 HydrophobicContact CD1-CG1 4.46Å; L245-V275 HydrophobicContact CD2-CG2 4.26Å; L245-A295 HydrophobicContact CB-CB 4.41Å; L245-A295 HydrophobicContact CD2-CB 3.84Å; L245-A298 HydrophobicContact CD1-CB 4.26Å; L245-A298 HydrophobicContact CD2-CB 3.78Å; L245-L299 HydrophobicContact CB-CD1 4.27Å; L245-L299 HydrophobicContact CB-CD2 4.02Å; L245-L299 HydrophobicContact CB-CG 3.97Å; L245-L299 HydrophobicContact CD1-CD2 3.94Å; L245-L299 HydrophobicContact CD1-CG 4.12Å; L245-F303 HydrophobicContact CD1-CE2 4.08Å
246	N	88.2	Confident	78.1	Confident	70 Å²	70	65.9 Å²	65.9	37%	0.374	38%	0.38	S	S	.	.	H	α-helix	trans	-79.4	-19.8	177.1	-168.6	87.2	0	0	0	112.9	V242 A243 L244 R249 P250	V242-N246 WeakPolarHBondContact O-CB 3.48Å; V242-N246 PolarHBondContact O-N 2.81Å; A243-N246 CarbonylContact O-C 3.38Å; A243-N246 WeakPolarHBondContact O-CA 3.43Å; A243-N246 PolarHBondContact O-N 2.56Å; L244-N246 VanDerWaalsContact C-N 3.32Å; L244-N246 PolarHBondContact O-N 3.48Å; N246-R249 WeakPolarHBondContact CA-O 3.4Å; N246-R249 CarbonylContact O-C 3.48Å; N246-P250 VanDerWaalsContact O-CA 3.3Å; N246-P250 WeakPolarHBondContact O-CA 3.46Å
247	E	88.3	Confident	79.2	Confident	101 Å²	101	62.6 Å²	62.6	47%	0.472	37%	0.367	S	S	.	.	H	α-helix	trans	-72.5	-45.9	166.9	-71	177.6	177.1	0	0	110.6	K239 A243 L244 R249	K239-E247 WeakPolarHBondContact CD-OE1 3.42Å; K239-E247 WeakPolarHBondContact CD-OE2 3.47Å; K239-E247 IonicContact NZ-OE1 2.71Å; K239-E247 PolarHBondContact NZ-OE1 3.03Å; K239-E247 IonicContact NZ-OE2 2.88Å; K239-E247 PolarHBondContact NZ-OE2 3.3Å; A243-E247 PolarHBondContact O-N 3.1Å; L244-E247 PolarHBondContact O-N 2.86Å; E247-R249 VanDerWaalsContact C-N 3.32Å; E247-R249 PolarHBondContact O-N 3.41Å
248	L	84.1	Confident	80.1	Confident	60 Å²	60	60.7 Å²	60.7	31%	0.314	35%	0.349	S	S	.	.	H	α-helix	trans	-70.8	-25.7	178.1	-66.4	169.5	0	0	0	113.8	L244 L299 F303 I305	L244-L248 HydrophobicContact CG-CD1 4.45Å; L244-L248 WeakPolarHBondContact O-CG 3.47Å; L244-L248 PolarHBondContact O-N 3.21Å; L244-L248 VanDerWaalsContact O-N 3.09Å; L248-L299 HydrophobicContact CD1-CD2 3.64Å; L248-F303 HydrophobicContact CB-CE1 4.41Å; L248-F303 HydrophobicContact CB-CZ 4.2Å; L248-F303 HydrophobicContact CD1-CD1 4.3Å; L248-F303 HydrophobicContact CD1-CD2 4.27Å; L248-F303 HydrophobicContact CD1-CE1 4.44Å; L248-F303 HydrophobicContact CD1-CE2 4.42Å; L248-F303 HydrophobicContact CD1-CG 4.22Å; L248-I305 HydrophobicContact CD1-CD1 3.61Å
249	R	83.6	Confident	80.2	Confident	90 Å²	90	58.9 Å²	58.9	34%	0.34	33%	0.33	S	S	.	.	S	Bend	trans	-145.7	90.2	177.4	-67.8	-64.6	-176.3	-95	1.3	109.6	L245 N246 E247 L252 V275 D276 F303	L245-R249 PolarHBondContact O-N 3.41Å; N246-R249 WeakPolarHBondContact CA-O 3.4Å; N246-R249 CarbonylContact O-C 3.48Å; E247-R249 VanDerWaalsContact C-N 3.32Å; E247-R249 PolarHBondContact O-N 3.41Å; R249-L252 HydrophobicContact CB-CD1 3.61Å; R249-L252 HydrophobicContact CB-CD2 4.41Å; R249-L252 HydrophobicContact CB-CG 3.88Å; R249-L252 VanDerWaalsContact O-CG 3.32Å; R249-L252 WeakPolarHBondContact O-CG 3.33Å; R249-V275 HydrophobicContact CG-CG1 3.98Å; R249-D276 IonicContact CZ-OD1 3.39Å; R249-D276 IonicContact CZ-OD2 2.98Å; R249-D276 IonicContact NE-OD1 2.94Å; R249-D276 PolarHBondContact NE-OD1 2.82Å; R249-D276 IonicContact NE-OD2 3.98Å; R249-D276 PolarHBondContact NE-OD2 2.97Å; R249-D276 VanDerWaalsContact NE-OD2 3.11Å; R249-D276 IonicContact NH2-OD1 2.81Å; R249-D276 IonicContact NH2-OD2 3.66Å; R249-D276 PolarHBondContact NH2-OD2 3.09Å; R249-F303 HydrophobicContact CG-CZ 4.3Å
250	P	84.7	Confident	79.1	Confident	109 Å²	109	63.5 Å²	63.5	71%	0.708	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	150.1	173.4	-25.9	36.1	0	0	0	112.8	N246	N246-P250 VanDerWaalsContact O-CA 3.3Å; N246-P250 WeakPolarHBondContact O-CA 3.46Å
251	G	80.3	Confident	77.4	Confident	66 Å²	66	64.7 Å²	64.7	68%	0.68	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.3	6.7	174.2	0	0	0	0	0	116.1	R253	G251-R253 PolarHBondContact O-N 3.41Å
252	L	85.2	Confident	75	Confident	29 Å²	29	72.7 Å²	72.7	15%	0.152	39%	0.393	C	S	.	.			trans	-66	122.3	-178.6	-75.8	178.2	0	0	0	113.7	L245 R249 V273 R274 V275	L245-L252 HydrophobicContact CD1-CD1 4.17Å; L245-L252 HydrophobicContact CD2-CD1 4.06Å; L245-L252 HydrophobicContact CG-CD1 3.64Å; R249-L252 HydrophobicContact CB-CD1 3.61Å; R249-L252 HydrophobicContact CB-CD2 4.41Å; R249-L252 HydrophobicContact CB-CG 3.88Å; R249-L252 VanDerWaalsContact O-CG 3.32Å; R249-L252 WeakPolarHBondContact O-CG 3.33Å; L252-V273 HydrophobicContact CB-CG2 4.16Å; L252-V273 HydrophobicContact CD1-CG2 4.44Å; L252-V273 HydrophobicContact CD2-CG2 4.34Å; L252-R274 WeakPolarHBondContact CD2-O 3.43Å; L252-V275 HydrophobicContact CD1-CG1 4.21Å; L252-V275 HydrophobicContact CD1-CG2 3.81Å; L252-V275 HydrophobicContact CD2-CB 4.32Å; L252-V275 HydrophobicContact CD2-CG1 4.29Å; L252-V275 HydrophobicContact CD2-CG2 3.89Å
253	R	78.4	Confident	73.4	Confident	112 Å²	112	74.3 Å²	74.3	42%	0.423	42%	0.418	S	S	.	.			trans	-101.1	135.3	179.5	-67.8	-174.3	139.3	-178.8	-4.6	112.4	W77 E79 G251	W77-R253 VanDerWaalsContact CB-NH1 3.29Å; W77-R253 HydrophobicContact CE3-CB 4.41Å; W77-R253 HydrophobicContact CH2-CB 3.69Å; W77-R253 HydrophobicContact CZ2-CB 4.46Å; W77-R253 HydrophobicContact CZ3-CB 3.67Å; W77-R253 HydrophobicContact CZ3-CG 4.33Å; E79-R253 IonicContact OE1-CZ 3.06Å; E79-R253 IonicContact OE1-NH2 2.74Å; E79-R253 PolarHBondContact OE1-NH2 2.87Å; G251-R253 PolarHBondContact O-N 3.41Å
254	Y	85.3	Confident	71.3	Confident	28 Å²	28	84.8 Å²	84.8	11%	0.11	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	117.8	-177.8	-68.1	-107.9	0	0	0	110.9	V242 A272 V273 K291 A294 A295	V242-Y254 HydrophobicContact CG1-CE2 4.26Å; Y254-A272 CarbonylContact C-O 3.53Å; Y254-A272 VanDerWaalsContact CA-O 3.25Å; Y254-A272 WeakPolarHBondContact CA-O 3.33Å; Y254-V273 HydrophobicContact CD1-CB 3.72Å; Y254-V273 HydrophobicContact CD1-CG1 4.38Å; Y254-V273 HydrophobicContact CD1-CG2 4.24Å; Y254-V273 HydrophobicContact CD2-CG2 4.27Å; Y254-V273 HydrophobicContact CE1-CB 3.74Å; Y254-V273 HydrophobicContact CE1-CG1 4.01Å; Y254-V273 HydrophobicContact CE1-CG2 4.09Å; Y254-V273 HydrophobicContact CE2-CG2 4.11Å; Y254-V273 HydrophobicContact CG-CB 4.16Å; Y254-V273 HydrophobicContact CG-CG2 4.32Å; Y254-K291 HydrophobicContact CD1-CB 3.94Å; Y254-K291 HydrophobicContact CD1-CD 4.13Å; Y254-K291 HydrophobicContact CD1-CG 3.65Å; Y254-K291 HydrophobicContact CD2-CD 4.44Å; Y254-K291 HydrophobicContact CE1-CB 4.1Å; Y254-K291 HydrophobicContact CE1-CG 4.31Å; Y254-K291 HydrophobicContact CG-CD 3.96Å; Y254-K291 HydrophobicContact CG-CG 3.95Å; Y254-A294 HydrophobicContact CE1-CB 4.46Å; Y254-A295 HydrophobicContact CE1-CB 4.3Å; Y254-A295 WeakPolarHBondContact OH-CB 3.3Å
255	A	74.8	Confident	69.7	Low	35 Å²	35	93 Å²	93	29%	0.289	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	140.6	177.3	0	0	0	0	0	111.8	W77 L257 M271 A272	W77-A255 HydrophobicContact CH2-CB 4.31Å; A255-L257 HydrophobicContact CB-CD2 4.29Å; A255-M271 VanDerWaalsContact C-CE 3.48Å; A255-M271 CarbonylContact O-C 3.6Å; A255-M271 WeakPolarHBondContact O-CA 3.31Å; A255-M271 WeakPolarHBondContact O-CE 3.37Å; A255-A272 PolarHBondContact N-O 2.99Å; A255-A272 PolarHBondContact O-N 3.28Å
256	C	75.2	Confident	67.8	Low	55 Å²	55	98.2 Å²	98.2	37%	0.372	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	102.1	174.5	-172	0	0	0	0	109	V270 M271	C256-V270 CarbonylContact C-O 3.45Å; C256-M271 HydrophobicContact CB-CE 4.11Å; C256-M271 HydrophobicContact CB-SD 3.56Å; C256-M271 VanDerWaalsContact CB-SD 3.56Å
257	L	65.1	Low	66.3	Low	94 Å²	94	101.8 Å²	101.8	49%	0.492	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	-29.3	-172.8	-61.2	-171.7	0	0	0	113.5	A255 V270 A272 E281	A255-L257 HydrophobicContact CB-CD2 4.29Å; L257-V270 HydrophobicContact CB-CG1 4.31Å; L257-V270 PolarHBondContact N-O 3.07Å; L257-A272 HydrophobicContact CD1-CB 3.56Å; L257-A272 HydrophobicContact CD2-CB 4.32Å; L257-A272 HydrophobicContact CG-CB 3.79Å; L257-E281 HydrophobicContact CD1-CG 4.43Å; L257-E281 WeakPolarHBondContact CD1-OE1 3.44Å
258	S	61.6	Low	65.3	Low	42 Å²	42	99.5 Å²	99.5	29%	0.294	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	147.5	169.8	61.5	0	0	0	0	113.1	F269 V270	S258-F269 WeakPolarHBondContact O-CA 3.31Å; S258-V270 PolarHBondContact O-N 3.26Å; S258-V270 VanDerWaalsContact O-N 3.08Å; S258-V270 WeakPolarHBondContact OG-CG2 3.1Å
259	E	57.1	Low	64.5	Low	79 Å²	79	97.7 Å²	97.7	37%	0.369	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	99.4	167.4	173.7	162.1	179.5	0	0	107.2	R267 F269 K287	E259-R267 IonicContact OE1-NH1 2.67Å; E259-R267 PolarHBondContact OE1-NH1 3.3Å; E259-F269 HydrophobicContact CB-CD1 4.13Å; E259-F269 HydrophobicContact CB-CE1 4.32Å; E259-F269 HydrophobicContact CG-CD1 3.95Å; E259-F269 HydrophobicContact CG-CE1 3.65Å; E259-F269 WeakPolarHBondContact OE1-CE1 3.22Å; E259-F269 WeakPolarHBondContact OE2-CE1 3.36Å; E259-K287 WeakPolarHBondContact OE2-CE 3.48Å; E259-K287 IonicContact OE2-NZ 3.79Å; E259-K287 PolarHBondContact OE2-NZ 3.2Å
260	R	53.2	Low	63.8	Low	196 Å²	196	94.8 Å²	94.8	74%	0.74	50%	0.496	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.6	113.1	178.9	-70.5	-171.2	-179.2	-173.4	0.2	109.7	S268	R260-S268 PolarHBondContact N-O 2.85Å; R260-S268 VanDerWaalsContact N-O 3.15Å
261	A	45.4	Very low	63.5	Low	59 Å²	59	89.9 Å²	89.9	49%	0.488	46%	0.464	S	S	.	.			trans	-136.5	68.1	-174.3	0	0	0	0	0	112	R267	A261-R267 HydrophobicContact CB-CG 4.36Å
262	E	36.9	Very low	62.8	Low	177 Å²	177	87 Å²	87	83%	0.827	43%	0.434	S	S	*	.			trans	-126.4	126.4	175.5	-68.7	-177.2	144.1	0	0	111.8
263	G	53.2	Low	62.7	Low	74 Å²	74	85.8 Å²	85.8	76%	0.763	43%	0.427	S	S	*	.	S	Bend	trans	69.6	-166.3	171.6	0	0	0	0	0	116.2	R265	G263-R265 PolarHBondContact O-N 3.44Å
264	R	42.8	Very low	62.5	Low	264 Å²	264	88.5 Å²	88.5	100%	0.996	44%	0.437	S	S	*	.	S	Bend	trans	-74.5	53.3	-179.4	-62.1	-171.5	-176.9	-162.7	3	112.7
265	R	52.6	Low	62.3	Low	212 Å²	212	87.2 Å²	87.2	80%	0.8	43%	0.432	S	S	*	.	S	Bend	trans	-127.9	144.7	176.7	-69.2	-179.9	177.2	169.3	1.1	110.4	G263	G263-R265 PolarHBondContact O-N 3.44Å
266	P	48	Very low	62.3	Low	111 Å²	111	89.6 Å²	89.6	72%	0.721	44%	0.44	S	S	*	.			trans	-64.9	136.4	176.2	27.6	-34	0	0	0	110.4	S268	P266-S268 PolarHBondContact O-N 3.12Å
267	R	57.3	Low	61.7	Low	144 Å²	144	89.5 Å²	89.5	54%	0.543	45%	0.449	S	S	.	.			trans	-60	137.2	179.1	-63.2	-171.3	-171.8	-165.4	5.9	110.8	E259 A261 F269	E259-R267 IonicContact OE1-NH1 2.67Å; E259-R267 PolarHBondContact OE1-NH1 3.3Å; A261-R267 HydrophobicContact CB-CG 4.36Å; R267-F269 HydrophobicContact CB-CE2 3.92Å; R267-F269 HydrophobicContact CB-CZ 3.98Å
268	S	66.7	Low	61.5	Low	53 Å²	53	92.6 Å²	92.6	37%	0.371	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	137.2	172.7	-168.9	0	0	0	0	109.7	R260 P266	R260-S268 PolarHBondContact N-O 2.85Å; R260-S268 VanDerWaalsContact N-O 3.15Å; P266-S268 PolarHBondContact O-N 3.12Å
269	F	67.8	Low	61.5	Low	23 Å²	23	95.5 Å²	95.5	10%	0.101	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	135.4	-178.6	-53.3	-90.7	0	0	0	109.2	S258 E259 R267 C283 G284 R285 S286 K287 A290	S258-F269 WeakPolarHBondContact O-CA 3.31Å; E259-F269 HydrophobicContact CB-CD1 4.13Å; E259-F269 HydrophobicContact CB-CE1 4.32Å; E259-F269 HydrophobicContact CG-CD1 3.95Å; E259-F269 HydrophobicContact CG-CE1 3.65Å; E259-F269 WeakPolarHBondContact OE1-CE1 3.22Å; E259-F269 WeakPolarHBondContact OE2-CE1 3.36Å; R267-F269 HydrophobicContact CB-CE2 3.92Å; R267-F269 HydrophobicContact CB-CZ 3.98Å; F269-C283 WeakPolarHBondContact O-CA 3.48Å; F269-G284 WeakPolarHBondContact CD2-O 3.27Å; F269-G284 PolarHBondContact N-O 3.09Å; F269-G284 PolarHBondContact O-N 2.86Å; F269-R285 WeakPolarHBondContact CE2-O 3.44Å; F269-S286 VanDerWaalsContact CD2-CA 3.43Å; F269-K287 HydrophobicContact CB-CG 4.04Å; F269-K287 HydrophobicContact CD1-CD 4.01Å; F269-K287 HydrophobicContact CD1-CG 3.44Å; F269-K287 VanDerWaalsContact CD1-CG 3.44Å; F269-K287 HydrophobicContact CD2-CG 4.47Å; F269-K287 HydrophobicContact CE1-CD 4.24Å; F269-K287 HydrophobicContact CE1-CG 3.9Å; F269-K287 HydrophobicContact CG-CG 3.73Å; F269-A290 HydrophobicContact CB-CB 4.38Å; F269-A290 WeakPolarHBondContact O-CB 3.24Å
270	V	67.6	Low	62.1	Low	29 Å²	29	92.9 Å²	92.9	18%	0.176	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	123	168.8	-178	0	0	0	0	108.1	C256 L257 S258	C256-V270 CarbonylContact C-O 3.45Å; L257-V270 HydrophobicContact CB-CG1 4.31Å; L257-V270 PolarHBondContact N-O 3.07Å; S258-V270 PolarHBondContact O-N 3.26Å; S258-V270 VanDerWaalsContact O-N 3.08Å; S258-V270 WeakPolarHBondContact OG-CG2 3.1Å
271	M	79.8	Confident	62.8	Low	6 Å²	6	88.8 Å²	88.8	3%	0.03	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	137.4	175.1	-64.8	-65.7	-44.1	0	0	108.7	A255 C256 E281 G282 K287 A290 K291	A255-M271 VanDerWaalsContact C-CE 3.48Å; A255-M271 CarbonylContact O-C 3.6Å; A255-M271 WeakPolarHBondContact O-CA 3.31Å; A255-M271 WeakPolarHBondContact O-CE 3.37Å; C256-M271 HydrophobicContact CB-CE 4.11Å; C256-M271 HydrophobicContact CB-SD 3.56Å; C256-M271 VanDerWaalsContact CB-SD 3.56Å; M271-E281 CarbonylContact O-C 3.5Å; M271-E281 WeakPolarHBondContact O-CA 3.38Å; M271-G282 PolarHBondContact N-O 2.93Å; M271-G282 PolarHBondContact O-N 2.92Å; M271-K287 HydrophobicContact SD-CB 4.13Å; M271-K287 HydrophobicContact SD-CG 4.24Å; M271-A290 HydrophobicContact CB-CB 3.83Å; M271-A290 HydrophobicContact CG-CB 3.39Å; M271-K291 HydrophobicContact CB-CG 4.16Å; M271-K291 HydrophobicContact CE-CD 4.38Å; M271-K291 HydrophobicContact CE-CG 3.84Å; M271-K291 HydrophobicContact CG-CG 3.95Å; M271-K291 HydrophobicContact SD-CG 4.45Å
272	A	65.3	Low	63.9	Low	6 Å²	6	86.1 Å²	86.1	5%	0.05	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	147.3	175.1	0	0	0	0	0	111	Y254 A255 L257 I279 F280 E281	Y254-A272 CarbonylContact C-O 3.53Å; Y254-A272 VanDerWaalsContact CA-O 3.25Å; Y254-A272 WeakPolarHBondContact CA-O 3.33Å; A255-A272 PolarHBondContact N-O 2.99Å; A255-A272 PolarHBondContact O-N 3.28Å; L257-A272 HydrophobicContact CD1-CB 3.56Å; L257-A272 HydrophobicContact CD2-CB 4.32Å; L257-A272 HydrophobicContact CG-CB 3.79Å; A272-I279 HydrophobicContact CB-CG2 4.02Å; A272-F280 CarbonylContact C-O 3.57Å; A272-F280 VanDerWaalsContact CA-O 3.27Å; A272-F280 WeakPolarHBondContact CA-O 3.38Å; A272-E281 HydrophobicContact CB-CG 4.07Å
273	V	81.9	Confident	65.3	Low	2 Å²	2	81.6 Å²	81.6	1%	0.012	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	138.4	172.5	62.1	0	0	0	0	109.1	L252 Y254 V275 I279 F280 A294	L252-V273 HydrophobicContact CB-CG2 4.16Å; L252-V273 HydrophobicContact CD1-CG2 4.44Å; L252-V273 HydrophobicContact CD2-CG2 4.34Å; Y254-V273 HydrophobicContact CD1-CB 3.72Å; Y254-V273 HydrophobicContact CD1-CG1 4.38Å; Y254-V273 HydrophobicContact CD1-CG2 4.24Å; Y254-V273 HydrophobicContact CD2-CG2 4.27Å; Y254-V273 HydrophobicContact CE1-CB 3.74Å; Y254-V273 HydrophobicContact CE1-CG1 4.01Å; Y254-V273 HydrophobicContact CE1-CG2 4.09Å; Y254-V273 HydrophobicContact CE2-CG2 4.11Å; Y254-V273 HydrophobicContact CG-CB 4.16Å; Y254-V273 HydrophobicContact CG-CG2 4.32Å; V273-V275 HydrophobicContact CG1-CG2 4.09Å; V273-V275 HydrophobicContact CG2-CG2 3.9Å; V273-I279 WeakPolarHBondContact O-CA 3.22Å; V273-F280 HydrophobicContact CG1-CB 4.16Å; V273-F280 PolarHBondContact N-O 3.1Å; V273-F280 PolarHBondContact O-N 3.03Å; V273-A294 HydrophobicContact CG1-CB 4.21Å
274	R	75.9	Confident	66.1	Low	169 Å²	169	78.6 Å²	78.6	64%	0.638	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.4	118.7	173.7	-167.7	179.6	-147.3	166.8	8.9	109.2	L252 G277 R278 I279	L252-R274 WeakPolarHBondContact CD2-O 3.43Å; R274-G277 PolarHBondContact NE-O 3.2Å; R274-R278 CarbonylContact C-O 3.6Å; R274-R278 VanDerWaalsContact CA-O 3.24Å; R274-R278 WeakPolarHBondContact CA-O 3.32Å; R274-R278 WeakPolarHBondContact CG-O 3.35Å; R274-I279 HydrophobicContact CB-CG1 4.37Å; R274-I279 HydrophobicContact CG-CG1 4.08Å
275	V	80.4	Confident	67.1	Low	1 Å²	1	74.4 Å²	74.4	1%	0.006	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	129.9	179.9	-165.5	0	0	0	0	107.9	L245 R249 L252 V273 G277 R278 F280 A298 L302	L245-V275 HydrophobicContact CD1-CG1 4.46Å; L245-V275 HydrophobicContact CD2-CG2 4.26Å; R249-V275 HydrophobicContact CG-CG1 3.98Å; L252-V275 HydrophobicContact CD1-CG1 4.21Å; L252-V275 HydrophobicContact CD1-CG2 3.81Å; L252-V275 HydrophobicContact CD2-CB 4.32Å; L252-V275 HydrophobicContact CD2-CG1 4.29Å; L252-V275 HydrophobicContact CD2-CG2 3.89Å; V273-V275 HydrophobicContact CG1-CG2 4.09Å; V273-V275 HydrophobicContact CG2-CG2 3.9Å; V275-G277 VanDerWaalsContact C-N 3.28Å; V275-G277 PolarHBondContact O-N 2.87Å; V275-R278 PolarHBondContact N-O 2.88Å; V275-R278 PolarHBondContact O-N 2.89Å; V275-R278 VanDerWaalsContact O-O 3.12Å; V275-F280 HydrophobicContact CB-CD2 4.22Å; V275-F280 HydrophobicContact CB-CE2 4.06Å; V275-F280 HydrophobicContact CG2-CD2 4.17Å; V275-F280 HydrophobicContact CG2-CE2 4.49Å; V275-A298 HydrophobicContact CG2-CB 3.99Å; V275-L302 HydrophobicContact CB-CD1 3.69Å; V275-L302 HydrophobicContact CG1-CD1 3.46Å; V275-L302 VanDerWaalsContact CG1-CD1 3.46Å
276	D	75.6	Confident	68.4	Low	85 Å²	85	66.5 Å²	66.5	46%	0.455	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.2	51.8	177.3	-58.7	5.5	0	0	0	112.3	R249 R278 L302	R249-D276 IonicContact CZ-OD1 3.39Å; R249-D276 IonicContact CZ-OD2 2.98Å; R249-D276 IonicContact NE-OD1 2.94Å; R249-D276 PolarHBondContact NE-OD1 2.82Å; R249-D276 IonicContact NE-OD2 3.98Å; R249-D276 PolarHBondContact NE-OD2 2.97Å; R249-D276 VanDerWaalsContact NE-OD2 3.11Å; R249-D276 IonicContact NH2-OD1 2.81Å; R249-D276 IonicContact NH2-OD2 3.66Å; R249-D276 PolarHBondContact NH2-OD2 3.09Å; D276-R278 PolarHBondContact O-N 2.78Å; D276-L302 HydrophobicContact CB-CD1 4.23Å
277	G	62.4	Low	69.9	Low	54 Å²	54	65.3 Å²	65.3	56%	0.557	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.3	-34	-177.4	0	0	0	0	0	115.6	R274 V275	R274-G277 PolarHBondContact NE-O 3.2Å; V275-G277 VanDerWaalsContact C-N 3.28Å; V275-G277 PolarHBondContact O-N 2.87Å
278	R	58.9	Low	71.2	Confident	159 Å²	159	66 Å²	66	60%	0.6	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.9	156.2	-175.7	-59.9	-179.5	-175.9	-179.7	0.1	112.2	R274 V275 D276 F280	R274-R278 CarbonylContact C-O 3.6Å; R274-R278 VanDerWaalsContact CA-O 3.24Å; R274-R278 WeakPolarHBondContact CA-O 3.32Å; R274-R278 WeakPolarHBondContact CG-O 3.35Å; V275-R278 PolarHBondContact N-O 2.88Å; V275-R278 PolarHBondContact O-N 2.89Å; V275-R278 VanDerWaalsContact O-O 3.12Å; D276-R278 PolarHBondContact O-N 2.78Å; R278-F280 HydrophobicContact CB-CE2 3.67Å; R278-F280 HydrophobicContact CB-CZ 3.72Å
279	I	62.4	Low	71.8	Confident	103 Å²	103	67.4 Å²	67.4	53%	0.528	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	130.5	178.5	-59.3	175.6	0	0	0	109	A272 V273 R274	A272-I279 HydrophobicContact CB-CG2 4.02Å; V273-I279 WeakPolarHBondContact O-CA 3.22Å; R274-I279 HydrophobicContact CB-CG1 4.37Å; R274-I279 HydrophobicContact CG-CG1 4.08Å
280	F	69.5	Low	72.2	Confident	24 Å²	24	66.3 Å²	66.3	11%	0.105	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	129.4	-179.8	-58.9	-82.3	0	0	0	110.1	A272 V273 V275 R278 A298 A301 L302	A272-F280 CarbonylContact C-O 3.57Å; A272-F280 VanDerWaalsContact CA-O 3.27Å; A272-F280 WeakPolarHBondContact CA-O 3.38Å; V273-F280 HydrophobicContact CG1-CB 4.16Å; V273-F280 PolarHBondContact N-O 3.1Å; V273-F280 PolarHBondContact O-N 3.03Å; V275-F280 HydrophobicContact CB-CD2 4.22Å; V275-F280 HydrophobicContact CB-CE2 4.06Å; V275-F280 HydrophobicContact CG2-CD2 4.17Å; V275-F280 HydrophobicContact CG2-CE2 4.49Å; R278-F280 HydrophobicContact CB-CE2 3.67Å; R278-F280 HydrophobicContact CB-CZ 3.72Å; F280-A298 HydrophobicContact CB-CB 3.98Å; F280-A298 HydrophobicContact CD1-CB 4.23Å; F280-A298 HydrophobicContact CD2-CB 3.51Å; F280-A298 HydrophobicContact CE2-CB 4.03Å; F280-A298 HydrophobicContact CG-CB 3.62Å; F280-A301 HydrophobicContact CD1-CB 4.28Å; F280-A301 HydrophobicContact CE1-CB 3.51Å; F280-A301 HydrophobicContact CZ-CB 4.2Å; F280-L302 HydrophobicContact CE2-CD1 3.77Å; F280-L302 HydrophobicContact CE2-CG 4.1Å; F280-L302 HydrophobicContact CZ-CD1 4Å; F280-L302 HydrophobicContact CZ-CD2 4.03Å; F280-L302 HydrophobicContact CZ-CG 3.79Å
281	E	68.1	Low	73	Confident	110 Å²	110	68.6 Å²	68.6	51%	0.514	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	151.1	-177.5	-59.4	-162.8	175.9	0	0	112.8	L257 M271 A272	L257-E281 HydrophobicContact CD1-CG 4.43Å; L257-E281 WeakPolarHBondContact CD1-OE1 3.44Å; M271-E281 CarbonylContact O-C 3.5Å; M271-E281 WeakPolarHBondContact O-CA 3.38Å; A272-E281 HydrophobicContact CB-CG 4.07Å
282	G	67.9	Low	73.3	Confident	3 Å²	3	69.4 Å²	69.4	3%	0.031	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	132.5	173.5	0	0	0	0	0	110.9	M271 A290	M271-G282 PolarHBondContact N-O 2.93Å; M271-G282 PolarHBondContact O-N 2.92Å; G282-A290 WeakPolarHBondContact O-CB 3.36Å
283	C	66.9	Low	74	Confident	82 Å²	82	72.6 Å²	72.6	55%	0.554	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.8	147.2	176.6	62.9	0	0	0	0	111.4	F269	F269-C283 WeakPolarHBondContact O-CA 3.48Å
284	G	69.9	Low	73.9	Confident	10 Å²	10	72.5 Å²	72.5	10%	0.103	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.9	162.9	175.4	0	0	0	0	0	114.7	F269 S286	F269-G284 WeakPolarHBondContact CD2-O 3.27Å; F269-G284 PolarHBondContact N-O 3.09Å; F269-G284 PolarHBondContact O-N 2.86Å; G284-S286 PolarHBondContact O-N 2.81Å; G284-S286 VanDerWaalsContact O-N 3.09Å
285	R	63.9	Low	74.4	Confident	176 Å²	176	64.5 Å²	64.5	66%	0.664	32%	0.322	S	S	*	.	S	Bend	trans	-66.8	-1.6	175.9	66.9	178.9	176.6	-179.5	-1.6	114.9	F269 L289	F269-R285 WeakPolarHBondContact CE2-O 3.44Å; R285-L289 HydrophobicContact CG-CD2 4.06Å
286	S	79.4	Confident	74.5	Confident	46 Å²	46	66.7 Å²	66.7	32%	0.322	33%	0.332	S	S	.	.	S	Bend	trans	-151.7	153.2	172.5	72.1	0	0	0	0	110.1	F269 G284 K288 L289 A290	F269-S286 VanDerWaalsContact CD2-CA 3.43Å; G284-S286 PolarHBondContact O-N 2.81Å; G284-S286 VanDerWaalsContact O-N 3.09Å; S286-K288 PolarHBondContact O-N 2.96Å; S286-L289 PolarHBondContact O-N 3.15Å; S286-L289 VanDerWaalsContact O-N 3.16Å; S286-L289 PolarHBondContact OG-N 2.97Å; S286-A290 WeakPolarHBondContact O-CB 3.35Å; S286-A290 PolarHBondContact O-N 2.8Å
287	K	79.8	Confident	74.4	Confident	86 Å²	86	64.7 Å²	64.7	37%	0.374	32%	0.324	S	S	.	.	H	α-helix	trans	-57.8	-29.7	175.2	-62.4	-176	-176.2	177.7	0	112.1	E259 F269 M271 K291	E259-K287 WeakPolarHBondContact OE2-CE 3.48Å; E259-K287 IonicContact OE2-NZ 3.79Å; E259-K287 PolarHBondContact OE2-NZ 3.2Å; F269-K287 HydrophobicContact CB-CG 4.04Å; F269-K287 HydrophobicContact CD1-CD 4.01Å; F269-K287 HydrophobicContact CD1-CG 3.44Å; F269-K287 VanDerWaalsContact CD1-CG 3.44Å; F269-K287 HydrophobicContact CD2-CG 4.47Å; F269-K287 HydrophobicContact CE1-CD 4.24Å; F269-K287 HydrophobicContact CE1-CG 3.9Å; F269-K287 HydrophobicContact CG-CG 3.73Å; M271-K287 HydrophobicContact SD-CB 4.13Å; M271-K287 HydrophobicContact SD-CG 4.24Å; K287-K291 WeakPolarHBondContact O-CG 3.37Å; K287-K291 PolarHBondContact O-N 2.87Å; K287-K291 VanDerWaalsContact O-N 3.07Å
288	K	85	Confident	75.1	Confident	160 Å²	160	62.1 Å²	62.1	70%	0.696	30%	0.298	S	S	*	.	H	α-helix	trans	-64.9	-54.2	172.5	-174	178.4	179	-177.7	0	111.7	S286 A290 K291 T292	S286-K288 PolarHBondContact O-N 2.96Å; K288-A290 VanDerWaalsContact C-N 3.31Å; K288-A290 PolarHBondContact O-N 3.34Å; K288-K291 WeakPolarHBondContact O-CB 3.43Å; K288-K291 PolarHBondContact O-N 3.5Å; K288-T292 PolarHBondContact O-N 3.25Å; K288-T292 PolarHBondContact O-OG1 2.83Å
289	L	78.3	Confident	76.2	Confident	81 Å²	81	54.6 Å²	54.6	42%	0.424	27%	0.269	S	S	.	.	H	α-helix	trans	-62.4	-40.2	-177.7	-176.4	64.4	0	0	0	111.8	R285 S286 T292 Q293	R285-L289 HydrophobicContact CG-CD2 4.06Å; S286-L289 PolarHBondContact O-N 3.15Å; S286-L289 VanDerWaalsContact O-N 3.16Å; S286-L289 PolarHBondContact OG-N 2.97Å; L289-T292 PolarHBondContact O-N 3.33Å; L289-Q293 PolarHBondContact O-N 3.25Å
290	A	76.2	Confident	77.1	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-61.6	-42.7	175.1	0	0	0	0	0	112.3	F269 M271 G282 S286 K288 Q293 A294	F269-A290 HydrophobicContact CB-CB 4.38Å; F269-A290 WeakPolarHBondContact O-CB 3.24Å; M271-A290 HydrophobicContact CB-CB 3.83Å; M271-A290 HydrophobicContact CG-CB 3.39Å; G282-A290 WeakPolarHBondContact O-CB 3.36Å; S286-A290 WeakPolarHBondContact O-CB 3.35Å; S286-A290 PolarHBondContact O-N 2.8Å; K288-A290 VanDerWaalsContact C-N 3.31Å; K288-A290 PolarHBondContact O-N 3.34Å; A290-Q293 PolarHBondContact O-N 2.84Å; A290-A294 WeakPolarHBondContact O-CB 3.41Å; A290-A294 PolarHBondContact O-N 2.86Å
291	K	86	Confident	76.9	Confident	78 Å²	78	56 Å²	56	34%	0.339	28%	0.283	S	S	.	.	H	α-helix	trans	-60.7	-46.4	171.4	-76.4	-170.7	-177	-166.5	0	112	V242 Y254 M271 K287 K288 Q293 A294 A295	V242-K291 HydrophobicContact CG2-CB 4.36Å; Y254-K291 HydrophobicContact CD1-CB 3.94Å; Y254-K291 HydrophobicContact CD1-CD 4.13Å; Y254-K291 HydrophobicContact CD1-CG 3.65Å; Y254-K291 HydrophobicContact CD2-CD 4.44Å; Y254-K291 HydrophobicContact CE1-CB 4.1Å; Y254-K291 HydrophobicContact CE1-CG 4.31Å; Y254-K291 HydrophobicContact CG-CD 3.96Å; Y254-K291 HydrophobicContact CG-CG 3.95Å; M271-K291 HydrophobicContact CB-CG 4.16Å; M271-K291 HydrophobicContact CE-CD 4.38Å; M271-K291 HydrophobicContact CE-CG 3.84Å; M271-K291 HydrophobicContact CG-CG 3.95Å; M271-K291 HydrophobicContact SD-CG 4.45Å; K287-K291 WeakPolarHBondContact O-CG 3.37Å; K287-K291 PolarHBondContact O-N 2.87Å; K287-K291 VanDerWaalsContact O-N 3.07Å; K288-K291 WeakPolarHBondContact O-CB 3.43Å; K288-K291 PolarHBondContact O-N 3.5Å; K291-Q293 VanDerWaalsContact C-N 3.31Å; K291-Q293 PolarHBondContact O-N 3.13Å; K291-A294 PolarHBondContact O-N 2.87Å; K291-A295 WeakPolarHBondContact O-CB 3.44Å; K291-A295 PolarHBondContact O-N 3.39Å
292	T	85.6	Confident	77.3	Confident	22 Å²	22	53 Å²	53	14%	0.135	27%	0.271	C	S	.	.	H	α-helix	trans	-60.2	-41.2	178.9	-54.3	0	0	0	0	112	P241 K288 L289 A295 Q296	P241-T292 HydrophobicContact CB-CG2 4.12Å; P241-T292 HydrophobicContact CG-CG2 3.87Å; K288-T292 PolarHBondContact O-N 3.25Å; K288-T292 PolarHBondContact O-OG1 2.83Å; L289-T292 PolarHBondContact O-N 3.33Å; T292-A295 PolarHBondContact O-N 2.91Å; T292-Q296 WeakPolarHBondContact O-CB 3.38Å; T292-Q296 PolarHBondContact O-N 3.18Å
293	Q	80.1	Confident	77.8	Confident	74 Å²	74	55.7 Å²	55.7	35%	0.346	28%	0.282	S	S	.	.	H	α-helix	trans	-66.2	-43	176.2	-173.7	60.8	74.3	0	0	112.2	L289 A290 K291 A295 Q296 C297	L289-Q293 PolarHBondContact O-N 3.25Å; A290-Q293 PolarHBondContact O-N 2.84Å; K291-Q293 VanDerWaalsContact C-N 3.31Å; K291-Q293 PolarHBondContact O-N 3.13Å; Q293-A295 VanDerWaalsContact C-N 3.31Å; Q293-A295 PolarHBondContact O-N 3.28Å; Q293-Q296 PolarHBondContact O-N 2.87Å; Q293-C297 PolarHBondContact NE2-SG 2.84Å; Q293-C297 PolarHBondContact O-N 3.3Å; Q293-C297 PolarHBondContact O-SG 2.99Å
294	A	80.4	Confident	78.2	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-61.9	-41.5	176.8	0	0	0	0	0	111.4	Y254 V273 A290 K291 C297 A298	Y254-A294 HydrophobicContact CE1-CB 4.46Å; V273-A294 HydrophobicContact CG1-CB 4.21Å; A290-A294 WeakPolarHBondContact O-CB 3.41Å; A290-A294 PolarHBondContact O-N 2.86Å; K291-A294 PolarHBondContact O-N 2.87Å; A294-C297 PolarHBondContact O-N 2.92Å; A294-A298 PolarHBondContact O-N 2.9Å; A294-A298 VanDerWaalsContact O-N 3.1Å
295	A	85.7	Confident	78.5	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-63.9	-45.6	176.6	0	0	0	0	0	112.1	P241 V242 L245 Y254 K291 T292 Q293 C297 A298 L299	P241-A295 HydrophobicContact CB-CB 4.41Å; V242-A295 HydrophobicContact CB-CB 4.48Å; V242-A295 HydrophobicContact CG2-CB 4.05Å; L245-A295 HydrophobicContact CB-CB 4.41Å; L245-A295 HydrophobicContact CD2-CB 3.84Å; Y254-A295 HydrophobicContact CE1-CB 4.3Å; Y254-A295 WeakPolarHBondContact OH-CB 3.3Å; K291-A295 WeakPolarHBondContact O-CB 3.44Å; K291-A295 PolarHBondContact O-N 3.39Å; T292-A295 PolarHBondContact O-N 2.91Å; Q293-A295 VanDerWaalsContact C-N 3.31Å; Q293-A295 PolarHBondContact O-N 3.28Å; A295-C297 VanDerWaalsContact C-N 3.33Å; A295-C297 PolarHBondContact O-N 3.41Å; A295-A298 PolarHBondContact O-N 2.87Å; A295-L299 WeakPolarHBondContact O-CB 3.31Å; A295-L299 WeakPolarHBondContact O-CG 3.49Å; A295-L299 PolarHBondContact O-N 2.86Å
296	Q	83.3	Confident	78.6	Confident	47 Å²	47	58.6 Å²	58.6	22%	0.22	29%	0.289	C	S	.	.	H	α-helix	trans	-62.7	-38.7	177.2	-173.5	172.8	21.7	0	0	112.2	P241 T292 Q293 L299 Q300 T307	P241-Q296 HydrophobicContact CB-CB 4.3Å; T292-Q296 WeakPolarHBondContact O-CB 3.38Å; T292-Q296 PolarHBondContact O-N 3.18Å; Q293-Q296 PolarHBondContact O-N 2.87Å; Q296-L299 PolarHBondContact O-N 3.38Å; Q296-Q300 WeakPolarHBondContact O-CB 3.17Å; Q296-Q300 PolarHBondContact O-N 3.46Å; Q296-T307 PolarHBondContact NE2-O 2.9Å; Q296-T307 VanDerWaalsContact NE2-O 3.09Å; Q296-T307 PolarHBondContact NE2-OG1 2.98Å
297	C	72.1	Confident	77.5	Confident	44 Å²	44	57.3 Å²	57.3	30%	0.297	28%	0.279	S	S	.	.	H	α-helix	trans	-62.9	-42.3	174.3	-69	0	0	0	0	112	Q293 A294 A295 A301	Q293-C297 PolarHBondContact NE2-SG 2.84Å; Q293-C297 PolarHBondContact O-N 3.3Å; Q293-C297 PolarHBondContact O-SG 2.99Å; A294-C297 PolarHBondContact O-N 2.92Å; A295-C297 VanDerWaalsContact C-N 3.33Å; A295-C297 PolarHBondContact O-N 3.41Å; C297-A301 WeakPolarHBondContact O-CB 3.35Å; C297-A301 PolarHBondContact O-N 2.9Å
298	A	77.4	Confident	76	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-67.8	-42.9	175.9	0	0	0	0	0	112.4	L245 V275 F280 A294 A295 Q300 A301 L302	L245-A298 HydrophobicContact CD1-CB 4.26Å; L245-A298 HydrophobicContact CD2-CB 3.78Å; V275-A298 HydrophobicContact CG2-CB 3.99Å; F280-A298 HydrophobicContact CB-CB 3.98Å; F280-A298 HydrophobicContact CD1-CB 4.23Å; F280-A298 HydrophobicContact CD2-CB 3.51Å; F280-A298 HydrophobicContact CE2-CB 4.03Å; F280-A298 HydrophobicContact CG-CB 3.62Å; A294-A298 PolarHBondContact O-N 2.9Å; A294-A298 VanDerWaalsContact O-N 3.1Å; A295-A298 PolarHBondContact O-N 2.87Å; A298-Q300 PolarHBondContact O-N 2.82Å; A298-A301 PolarHBondContact O-N 3.35Å; A298-L302 WeakPolarHBondContact O-CB 3.07Å; A298-L302 PolarHBondContact O-N 3.28Å
299	L	83.2	Confident	74.1	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-57.6	-45.5	175.5	-78.1	171.6	0	0	0	112.2	P241 L244 L245 L248 A295 Q296 F303 D304 I305 T307	P241-L299 HydrophobicContact CB-CD1 4.02Å; P241-L299 WeakPolarHBondContact O-CD1 3.41Å; L244-L299 HydrophobicContact CB-CD1 4.37Å; L244-L299 HydrophobicContact CD2-CD1 4.31Å; L244-L299 HydrophobicContact CG-CD1 4.48Å; L244-L299 HydrophobicContact CG-CD2 4.29Å; L245-L299 HydrophobicContact CB-CD1 4.27Å; L245-L299 HydrophobicContact CB-CD2 4.02Å; L245-L299 HydrophobicContact CB-CG 3.97Å; L245-L299 HydrophobicContact CD1-CD2 3.94Å; L245-L299 HydrophobicContact CD1-CG 4.12Å; L248-L299 HydrophobicContact CD1-CD2 3.64Å; A295-L299 WeakPolarHBondContact O-CB 3.31Å; A295-L299 WeakPolarHBondContact O-CG 3.49Å; A295-L299 PolarHBondContact O-N 2.86Å; Q296-L299 PolarHBondContact O-N 3.38Å; L299-F303 HydrophobicContact CD2-CD2 4.34Å; L299-F303 CarbonylContact O-C 3.3Å; L299-F303 WeakPolarHBondContact O-CA 3.31Å; L299-F303 WeakPolarHBondContact O-CB 3.45Å; L299-F303 PolarHBondContact O-N 2.95Å; L299-D304 PolarHBondContact O-N 3.44Å; L299-I305 HydrophobicContact CB-CB 4.42Å; L299-I305 HydrophobicContact CD2-CD1 4.41Å; L299-I305 PolarHBondContact O-N 3.06Å; L299-T307 HydrophobicContact CD1-CG2 3.89Å
300	Q	79.7	Confident	72.1	Confident	100 Å²	100	55 Å²	55	47%	0.467	29%	0.289	S	S	.	.	H	α-helix	trans	-69	-40.5	177.2	-173	-178.1	-18.9	0	0	112	Q296 A298 D304	Q296-Q300 WeakPolarHBondContact O-CB 3.17Å; Q296-Q300 PolarHBondContact O-N 3.46Å; A298-Q300 PolarHBondContact O-N 2.82Å; Q300-D304 VanDerWaalsContact O-CA 3.31Å; Q300-D304 WeakPolarHBondContact O-CA 3.26Å; Q300-D304 PolarHBondContact O-N 3.34Å
301	A	65.8	Low	70.4	Confident	56 Å²	56	58.6 Å²	58.6	46%	0.463	33%	0.326	S	S	.	.	H	α-helix	trans	-83.1	-18.8	-172.9	0	0	0	0	0	115.2	F280 C297 A298	F280-A301 HydrophobicContact CD1-CB 4.28Å; F280-A301 HydrophobicContact CE1-CB 3.51Å; F280-A301 HydrophobicContact CZ-CB 4.2Å; C297-A301 WeakPolarHBondContact O-CB 3.35Å; C297-A301 PolarHBondContact O-N 2.9Å; A298-A301 PolarHBondContact O-N 3.35Å
302	L	77.7	Confident	68.2	Low	48 Å²	48	62.9 Å²	62.9	25%	0.251	34%	0.34	S	S	.	.	H	α-helix	trans	-111.7	-23.8	179.1	-64.4	178.9	0	0	0	113.7	V275 D276 F280 A298	V275-L302 HydrophobicContact CB-CD1 3.69Å; V275-L302 HydrophobicContact CG1-CD1 3.46Å; V275-L302 VanDerWaalsContact CG1-CD1 3.46Å; D276-L302 HydrophobicContact CB-CD1 4.23Å; F280-L302 HydrophobicContact CE2-CD1 3.77Å; F280-L302 HydrophobicContact CE2-CG 4.1Å; F280-L302 HydrophobicContact CZ-CD1 4Å; F280-L302 HydrophobicContact CZ-CD2 4.03Å; F280-L302 HydrophobicContact CZ-CG 3.79Å; A298-L302 WeakPolarHBondContact O-CB 3.07Å; A298-L302 PolarHBondContact O-N 3.28Å
303	F	78.3	Confident	65.6	Low	60 Å²	60	69.1 Å²	69.1	26%	0.263	38%	0.378	S	S	.	.	H	α-helix	trans	-132.1	-1	-173.1	-49.8	-89.4	0	0	0	113.9	L245 L248 R249 L299 I305	L245-F303 HydrophobicContact CD1-CE2 4.08Å; L248-F303 HydrophobicContact CB-CE1 4.41Å; L248-F303 HydrophobicContact CB-CZ 4.2Å; L248-F303 HydrophobicContact CD1-CD1 4.3Å; L248-F303 HydrophobicContact CD1-CD2 4.27Å; L248-F303 HydrophobicContact CD1-CE1 4.44Å; L248-F303 HydrophobicContact CD1-CE2 4.42Å; L248-F303 HydrophobicContact CD1-CG 4.22Å; R249-F303 HydrophobicContact CG-CZ 4.3Å; L299-F303 HydrophobicContact CD2-CD2 4.34Å; L299-F303 CarbonylContact O-C 3.3Å; L299-F303 WeakPolarHBondContact O-CA 3.31Å; L299-F303 WeakPolarHBondContact O-CB 3.45Å; L299-F303 PolarHBondContact O-N 2.95Å; F303-I305 HydrophobicContact CB-CB 4.46Å; F303-I305 HydrophobicContact CB-CD1 3.74Å; F303-I305 HydrophobicContact CB-CG1 3.76Å; F303-I305 HydrophobicContact CG-CD1 4.45Å; F303-I305 PolarHBondContact O-N 2.9Å
304	D	74.6	Confident	63.4	Low	97 Å²	97	69.3 Å²	69.3	52%	0.519	40%	0.401	S	S	.	.			trans	46.3	23.4	-166.5	-161.4	23.1	0	0	0	114.5	L299 Q300 R306	L299-D304 PolarHBondContact O-N 3.44Å; Q300-D304 VanDerWaalsContact O-CA 3.31Å; Q300-D304 WeakPolarHBondContact O-CA 3.26Å; Q300-D304 PolarHBondContact O-N 3.34Å; D304-R306 PolarHBondContact O-N 2.93Å; D304-R306 VanDerWaalsContact O-N 3.07Å; D304-R306 IonicContact OD1-CZ 3.22Å; D304-R306 IonicContact OD1-NE 3.52Å; D304-R306 PolarHBondContact OD1-NE 3.03Å; D304-R306 IonicContact OD1-NH2 2.72Å; D304-R306 PolarHBondContact OD1-NH2 2.76Å; D304-R306 IonicContact OD2-NH2 3.54Å
305	I	76.3	Confident	61.1	Low	56 Å²	56	75.8 Å²	75.8	29%	0.287	43%	0.434	S	S	.	.			trans	-77.5	103.6	179.9	-62.8	172.7	0	0	0	109.2	L244 L248 L299 F303 T307	L244-I305 HydrophobicContact CD2-CG2 3.83Å; L248-I305 HydrophobicContact CD1-CD1 3.61Å; L299-I305 HydrophobicContact CB-CB 4.42Å; L299-I305 HydrophobicContact CD2-CD1 4.41Å; L299-I305 PolarHBondContact O-N 3.06Å; F303-I305 HydrophobicContact CB-CB 4.46Å; F303-I305 HydrophobicContact CB-CD1 3.74Å; F303-I305 HydrophobicContact CB-CG1 3.76Å; F303-I305 HydrophobicContact CG-CD1 4.45Å; F303-I305 PolarHBondContact O-N 2.9Å; I305-T307 HydrophobicContact CG2-CG2 4.18Å; I305-T307 PolarHBondContact O-N 2.91Å
306	R	66.7	Low	58.2	Low	175 Å²	175	85.7 Å²	85.7	66%	0.66	48%	0.478	S	S	*	.			trans	-87.8	78	176.2	-61.6	-179.4	-166	-157.8	2.2	110.6	D304 A308	D304-R306 PolarHBondContact O-N 2.93Å; D304-R306 VanDerWaalsContact O-N 3.07Å; D304-R306 IonicContact OD1-CZ 3.22Å; D304-R306 IonicContact OD1-NE 3.52Å; D304-R306 PolarHBondContact OD1-NE 3.03Å; D304-R306 IonicContact OD1-NH2 2.72Å; D304-R306 PolarHBondContact OD1-NH2 2.76Å; D304-R306 IonicContact OD2-NH2 3.54Å; R306-A308 PolarHBondContact O-N 3.18Å; R306-A308 VanDerWaalsContact O-N 3.08Å
307	T	55.4	Low	55.6	Low	20 Å²	20	87.8 Å²	87.8	12%	0.123	50%	0.503	C	S	.	.	P	Polyproline II helix	trans	-53.2	117.2	167.5	55.7	0	0	0	0	109.4	P241 L244 Q296 L299 I305	P241-T307 HydrophobicContact CB-CG2 4.33Å; P241-T307 HydrophobicContact CG-CG2 4.12Å; P241-T307 WeakPolarHBondContact CG-OG1 3.39Å; L244-T307 HydrophobicContact CD2-CG2 3.83Å; Q296-T307 PolarHBondContact NE2-O 2.9Å; Q296-T307 VanDerWaalsContact NE2-O 3.09Å; Q296-T307 PolarHBondContact NE2-OG1 2.98Å; L299-T307 HydrophobicContact CD1-CG2 3.89Å; I305-T307 HydrophobicContact CG2-CG2 4.18Å; I305-T307 PolarHBondContact O-N 2.91Å
308	A	47.5	Very low	53.6	Low	71 Å²	71	90.5 Å²	90.5	59%	0.587	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-60.5	141.9	173.4	0	0	0	0	0	109.4	R306 E310	R306-A308 PolarHBondContact O-N 3.18Å; R306-A308 VanDerWaalsContact O-N 3.08Å; A308-E310 PolarHBondContact O-N 3.36Å
309	P	46.3	Very low	51.3	Low	81 Å²	81	102.5 Å²	102.5	53%	0.526	57%	0.567	S	S	.	*	P	Polyproline II helix	trans	-60.1	127.9	174.6	25.7	-33.5	0	0	0	109.3	G311	P309-G311 PolarHBondContact O-N 3.29Å; P309-G311 VanDerWaalsContact O-N 3.13Å
310	E	36.6	Very low	49	Very low	125 Å²	125	111.1 Å²	111.1	58%	0.584	61%	0.605	S	S	*	*	S	Bend	trans	-47.4	116.1	-177.3	-66.7	168.6	-167	0	0	110.3	S240 A308	S240-E310 WeakPolarHBondContact CA-OE1 3.09Å; S240-E310 VanDerWaalsContact CB-OE1 3.23Å; S240-E310 WeakPolarHBondContact CB-OE1 3.04Å; S240-E310 PolarHBondContact OG-OE1 3.28Å; A308-E310 PolarHBondContact O-N 3.36Å
311	G	39.3	Very low	46.9	Very low	76 Å²	76	111.2 Å²	111.2	78%	0.784	62%	0.617	S	S	*	*	S	Bend	trans	110.3	47.3	-174.3	0	0	0	0	0	116.3	P309	P309-G311 PolarHBondContact O-N 3.29Å; P309-G311 VanDerWaalsContact O-N 3.13Å
312	R	39.8	Very low	45.8	Very low	169 Å²	169	112.6 Å²	112.6	64%	0.638	62%	0.622	S	S	*	*			trans	-140.9	37.3	174.3	-73.5	-161.2	177	-168	0.9	116.6
313	T	32.2	Very low	44.6	Very low	152 Å²	152	113.9 Å²	113.9	93%	0.933	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	135.8	153.6	35.1	0	0	0	0	109
314	G	32.9	Very low	43.8	Very low	79 Å²	79	117.6 Å²	117.6	81%	0.814	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	97.4	10.6	173.3	0	0	0	0	0	118.6
315	L	32.4	Very low	43.8	Very low	135 Å²	135	113.3 Å²	113.3	71%	0.707	63%	0.628	S	S	*	*			trans	-129.8	110.1	167.4	-78.1	175.3	0	0	0	111.7	A317	L315-A317 PolarHBondContact O-N 3.39Å
316	K	25	Very low	44.1	Very low	209 Å²	209	114.4 Å²	114.4	91%	0.909	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-55.6	121.7	170.6	-72.2	-179.8	178.4	176	0	109.1	S318	K316-S318 PolarHBondContact O-N 2.85Å; K316-S318 VanDerWaalsContact O-N 3.14Å
317	A	27.8	Very low	44.9	Very low	90 Å²	90	109.3 Å²	109.3	74%	0.744	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-60.4	118.4	173.2	0	0	0	0	0	109.2	L315 R319	L315-A317 PolarHBondContact O-N 3.39Å; A317-R319 PolarHBondContact O-N 3.07Å; A317-R319 VanDerWaalsContact O-N 3.13Å
318	S	31.1	Very low	46.4	Very low	101 Å²	101	114.4 Å²	114.4	71%	0.706	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-59.7	119.3	174.7	-177.6	0	0	0	0	108.5	K316 K320	K316-S318 PolarHBondContact O-N 2.85Å; K316-S318 VanDerWaalsContact O-N 3.14Å; S318-K320 PolarHBondContact O-N 3.49Å
319	R	28.7	Very low	48.3	Very low	252 Å²	252	112 Å²	112	95%	0.951	63%	0.626	S	S	*	*	S	Bend	trans	-69.4	25.7	-176.6	-71.9	-177.6	169.5	174.7	-4.6	113.8	A317	A317-R319 PolarHBondContact O-N 3.07Å; A317-R319 VanDerWaalsContact O-N 3.13Å
320	K	33.8	Very low	50.4	Low	181 Å²	181	108.1 Å²	108.1	79%	0.787	60%	0.6	S	S	*	*			trans	-113	81.4	174.5	-65.4	-171.5	179.1	-176.9	0	108.8	S318 C322	S318-K320 PolarHBondContact O-N 3.49Å; K320-C322 PolarHBondContact O-N 3.27Å
321	S	35.7	Very low	53	Low	103 Å²	103	102.8 Å²	102.8	72%	0.72	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-55.9	129.1	162.3	-173.3	0	0	0	0	108.1
322	C	43.1	Very low	55.6	Low	84 Å²	84	101.2 Å²	101.2	57%	0.568	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-66.2	129.4	170.4	-63.4	0	0	0	0	108.1	K320 H324	K320-C322 PolarHBondContact O-N 3.27Å; C322-H324 PolarHBondContact O-N 2.88Å; C322-H324 VanDerWaalsContact O-N 3.15Å
323	P	52.3	Low	58.2	Low	75 Å²	75	93.1 Å²	93.1	49%	0.487	52%	0.522	S	S	.	.	P	Polyproline II helix	trans	-64.7	121.1	175.7	29.8	-35.1	0	0	0	108	L587	P323-L587 HydrophobicContact CB-CD2 3.55Å; P323-L587 HydrophobicContact CG-CD2 3.9Å; P323-L587 WeakPolarHBondContact O-CD2 3.44Å
324	H	62.7	Low	61.1	Low	138 Å²	138	86 Å²	86	64%	0.639	48%	0.479	S	S	*	.	B	Isolated β-bridge	trans	-104.5	146.8	-173.9	56.7	-83	0	0	0	109.8	C322	C322-H324 PolarHBondContact O-N 2.88Å; C322-H324 VanDerWaalsContact O-N 3.15Å
325	L	74.4	Confident	63.9	Low	8 Å²	8	86.3 Å²	86.3	4%	0.042	46%	0.459	C	S	.	.			trans	-76.1	138.8	172.3	-164.1	67.1	0	0	0	108.5	Q327 F329 A330 S551 L587	L325-Q327 PolarHBondContact O-N 2.88Å; L325-F329 HydrophobicContact CD1-CD1 3.76Å; L325-F329 HydrophobicContact CD1-CE1 3.96Å; L325-F329 HydrophobicContact CD1-CG 4.4Å; L325-F329 HydrophobicContact CD2-CD1 3.58Å; L325-F329 HydrophobicContact CD2-CE1 4.01Å; L325-F329 HydrophobicContact CG-CD1 3.72Å; L325-F329 HydrophobicContact CG-CE1 4.32Å; L325-F329 HydrophobicContact CG-CG 4.4Å; L325-A330 HydrophobicContact CD2-CB 4.05Å; L325-S551 WeakPolarHBondContact CD2-OG 3.45Å; L325-L587 HydrophobicContact CB-CB 4.07Å; L325-L587 HydrophobicContact CD1-CB 4.23Å; L325-L587 HydrophobicContact CD1-CD1 3.68Å
326	P	82.7	Confident	66.9	Low	79 Å²	79	82.2 Å²	82.2	51%	0.513	44%	0.437	S	S	.	.			trans	-51.6	139.5	171.2	-27	35.7	0	0	0	111.1	D328 F329 A330	P326-D328 PolarHBondContact O-N 3.03Å; P326-F329 HydrophobicContact CB-CB 4.22Å; P326-F329 PolarHBondContact O-N 2.9Å; P326-A330 PolarHBondContact O-N 2.86Å
327	Q	83.1	Confident	70.3	Confident	67 Å²	67	72.3 Å²	72.3	31%	0.313	39%	0.394	S	S	.	.	H	α-helix	trans	-66.2	-42.1	-169.7	-173.5	53.5	68.5	0	0	111.6	L325 F329 A330 D331 S589 G590 S592	L325-Q327 PolarHBondContact O-N 2.88Å; Q327-F329 VanDerWaalsContact C-N 3.33Å; Q327-F329 PolarHBondContact O-N 2.78Å; Q327-A330 WeakPolarHBondContact O-CB 3.47Å; Q327-A330 PolarHBondContact O-N 2.72Å; Q327-A330 VanDerWaalsContact O-N 3.09Å; Q327-D331 PolarHBondContact NE2-OD2 2.97Å; Q327-D331 PolarHBondContact O-N 3.02Å; Q327-S589 PolarHBondContact OE1-OG 2.91Å; Q327-G590 PolarHBondContact NE2-O 2.9Å; Q327-S592 VanDerWaalsContact NE2-N 3.19Å
328	D	85.8	Confident	73.3	Confident	128 Å²	128	69.8 Å²	69.8	68%	0.684	37%	0.365	S	S	*	.	H	α-helix	trans	-62.6	-41.7	179.4	-43.2	-69.2	0	0	0	111	P326 A330 D331 S332	P326-D328 PolarHBondContact O-N 3.03Å; D328-A330 PolarHBondContact O-N 3.47Å; D328-D331 PolarHBondContact O-N 3.38Å; D328-S332 WeakPolarHBondContact O-CB 3.36Å; D328-S332 PolarHBondContact O-N 2.89Å; D328-S332 PolarHBondContact O-OG 2.94Å; D328-S332 VanDerWaalsContact O-OG 3.04Å
329	F	89	Confident	76.2	Confident	20 Å²	20	70.9 Å²	70.9	9%	0.088	36%	0.359	C	S	.	.	H	α-helix	trans	-61	-44.4	172.7	-173.4	-70.8	0	0	0	111.4	L325 P326 Q327 D331 S332 I333 T364 L367 L369 H450	L325-F329 HydrophobicContact CD1-CD1 3.76Å; L325-F329 HydrophobicContact CD1-CE1 3.96Å; L325-F329 HydrophobicContact CD1-CG 4.4Å; L325-F329 HydrophobicContact CD2-CD1 3.58Å; L325-F329 HydrophobicContact CD2-CE1 4.01Å; L325-F329 HydrophobicContact CG-CD1 3.72Å; L325-F329 HydrophobicContact CG-CE1 4.32Å; L325-F329 HydrophobicContact CG-CG 4.4Å; P326-F329 HydrophobicContact CB-CB 4.22Å; P326-F329 PolarHBondContact O-N 2.9Å; Q327-F329 VanDerWaalsContact C-N 3.33Å; Q327-F329 PolarHBondContact O-N 2.78Å; F329-D331 VanDerWaalsContact C-N 3.3Å; F329-D331 PolarHBondContact O-N 2.88Å; F329-S332 PolarHBondContact O-N 3.08Å; F329-I333 HydrophobicContact CD1-CD1 4.44Å; F329-I333 HydrophobicContact CD1-CG1 3.7Å; F329-I333 HydrophobicContact CE1-CD1 3.77Å; F329-I333 HydrophobicContact CE1-CG1 3.46Å; F329-I333 VanDerWaalsContact CE1-CG1 3.46Å; F329-I333 HydrophobicContact CZ-CD1 4.15Å; F329-I333 HydrophobicContact CZ-CG1 4.29Å; F329-I333 VanDerWaalsContact O-CG1 3.24Å; F329-I333 WeakPolarHBondContact O-CG1 3.4Å; F329-I333 PolarHBondContact O-N 3.41Å; F329-T364 HydrophobicContact CZ-CG2 4.17Å; F329-L367 HydrophobicContact CE2-CB 4.41Å; F329-L367 WeakPolarHBondContact CE2-O 3.35Å; F329-L369 HydrophobicContact CB-CD1 4.22Å; F329-L369 HydrophobicContact CD1-CD2 4.43Å; F329-L369 HydrophobicContact CD2-CD1 3.77Å; F329-L369 HydrophobicContact CD2-CD2 3.61Å; F329-L369 HydrophobicContact CD2-CG 3.65Å; F329-L369 HydrophobicContact CE1-CD2 4.47Å; F329-L369 HydrophobicContact CE2-CD1 4.5Å; F329-L369 HydrophobicContact CE2-CD2 3.64Å; F329-L369 HydrophobicContact CE2-CG 3.89Å; F329-L369 HydrophobicContact CG-CD1 4.2Å; F329-L369 HydrophobicContact CG-CD2 4.03Å; F329-L369 HydrophobicContact CG-CG 4.37Å; F329-L369 HydrophobicContact CZ-CD2 4.09Å; F329-H450 AromaticContact CE1-CE1 3.87Å; F329-H450 AromaticContact CE1-ND1 3.71Å; F329-H450 AromaticContact CZ-CE1 3.67Å; F329-H450 AromaticContact CZ-ND1 3.95Å; F329-H450 AromaticContact CZ-NE2 3.85Å
330	A	90.3	Very high	79.3	Confident	0 Å²	0	62 Å²	62	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-60.4	-41.4	177.8	0	0	0	0	0	111.8	L325 P326 Q327 D328 F334 T553	L325-A330 HydrophobicContact CD2-CB 4.05Å; P326-A330 PolarHBondContact O-N 2.86Å; Q327-A330 WeakPolarHBondContact O-CB 3.47Å; Q327-A330 PolarHBondContact O-N 2.72Å; Q327-A330 VanDerWaalsContact O-N 3.09Å; D328-A330 PolarHBondContact O-N 3.47Å; A330-F334 PolarHBondContact O-N 3.15Å; A330-T553 HydrophobicContact CB-CG2 4.08Å; A330-T553 WeakPolarHBondContact O-CG2 3.49Å
331	D	90.4	Very high	82	Confident	12 Å²	12	53.9 Å²	53.9	6%	0.064	29%	0.292	C	S	.	.	H	α-helix	trans	-69.8	-43.1	175.9	-71	-52.2	0	0	0	111.9	Q327 D328 F329 I333 F334 H335 L591 S592	Q327-D331 PolarHBondContact NE2-OD2 2.97Å; Q327-D331 PolarHBondContact O-N 3.02Å; D328-D331 PolarHBondContact O-N 3.38Å; F329-D331 VanDerWaalsContact C-N 3.3Å; F329-D331 PolarHBondContact O-N 2.88Å; D331-I333 VanDerWaalsContact C-N 3.35Å; D331-I333 PolarHBondContact O-N 3.05Å; D331-F334 CarbonylContact O-C 3.57Å; D331-F334 WeakPolarHBondContact O-CA 3.43Å; D331-F334 VanDerWaalsContact O-CB 3.29Å; D331-F334 WeakPolarHBondContact O-CB 3.38Å; D331-F334 PolarHBondContact O-N 3.32Å; D331-H335 PolarHBondContact O-CD2 3.14Å; D331-H335 PolarHBondContact O-N 3.33Å; D331-L591 WeakPolarHBondContact OD1-CA 3.18Å; D331-L591 WeakPolarHBondContact OD1-CB 3.48Å; D331-L591 WeakPolarHBondContact OD1-CD2 3.33Å; D331-S592 VanDerWaalsContact CG-OG 3.25Å; D331-S592 PolarHBondContact OD1-N 2.86Å; D331-S592 PolarHBondContact OD1-OG 3.03Å; D331-S592 WeakPolarHBondContact OD2-CB 3.41Å; D331-S592 PolarHBondContact OD2-N 2.9Å; D331-S592 VanDerWaalsContact OD2-N 3.17Å; D331-S592 PolarHBondContact OD2-OG 3.16Å
332	S	93.4	Very high	84.6	Confident	43 Å²	43	54.9 Å²	54.9	30%	0.301	28%	0.28	S	S	.	.	H	α-helix	trans	-56.8	-43.5	174.5	-63	0	0	0	0	112.8	D328 F329 F334 H335 L336	D328-S332 WeakPolarHBondContact O-CB 3.36Å; D328-S332 PolarHBondContact O-N 2.89Å; D328-S332 PolarHBondContact O-OG 2.94Å; D328-S332 VanDerWaalsContact O-OG 3.04Å; F329-S332 PolarHBondContact O-N 3.08Å; S332-F334 VanDerWaalsContact C-N 3.26Å; S332-F334 PolarHBondContact O-N 3.2Å; S332-H335 PolarHBondContact O-N 2.79Å; S332-H335 VanDerWaalsContact O-N 3.15Å; S332-L336 WeakPolarHBondContact O-CG 3.4Å; S332-L336 PolarHBondContact O-N 3.33Å
333	I	94.6	Very high	86.9	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-59.4	-37.3	174.7	-67.8	-67.9	0	0	0	111.4	F329 D331 V337 V362 L369 H450	F329-I333 HydrophobicContact CD1-CD1 4.44Å; F329-I333 HydrophobicContact CD1-CG1 3.7Å; F329-I333 HydrophobicContact CE1-CD1 3.77Å; F329-I333 HydrophobicContact CE1-CG1 3.46Å; F329-I333 VanDerWaalsContact CE1-CG1 3.46Å; F329-I333 HydrophobicContact CZ-CD1 4.15Å; F329-I333 HydrophobicContact CZ-CG1 4.29Å; F329-I333 VanDerWaalsContact O-CG1 3.24Å; F329-I333 WeakPolarHBondContact O-CG1 3.4Å; F329-I333 PolarHBondContact O-N 3.41Å; D331-I333 VanDerWaalsContact C-N 3.35Å; D331-I333 PolarHBondContact O-N 3.05Å; I333-V337 WeakPolarHBondContact O-CG2 3.43Å; I333-V337 PolarHBondContact O-N 2.83Å; I333-V362 HydrophobicContact CD1-CB 3.79Å; I333-V362 HydrophobicContact CD1-CG1 3.73Å; I333-V362 HydrophobicContact CD1-CG2 4.12Å; I333-V362 HydrophobicContact CG2-CG2 4.03Å; I333-L369 HydrophobicContact CD1-CD2 4.28Å; I333-L369 HydrophobicContact CG1-CD2 4.48Å; I333-H450 HydrophobicContact CD1-CB 4Å; I333-H450 HydrophobicContact CG1-CB 4.46Å; I333-H450 HydrophobicContact CG2-CB 4.44Å
334	F	92.9	Very high	88.6	Confident	3 Å²	3	52 Å²	52	1%	0.013	26%	0.261	C	S	.	.	H	α-helix	trans	-68.9	-43.4	173.2	152.5	-105.2	0	0	0	112.8	A330 D331 S332 V337 R338 Y452 L591 F596	A330-F334 PolarHBondContact O-N 3.15Å; D331-F334 CarbonylContact O-C 3.57Å; D331-F334 WeakPolarHBondContact O-CA 3.43Å; D331-F334 VanDerWaalsContact O-CB 3.29Å; D331-F334 WeakPolarHBondContact O-CB 3.38Å; D331-F334 PolarHBondContact O-N 3.32Å; S332-F334 VanDerWaalsContact C-N 3.26Å; S332-F334 PolarHBondContact O-N 3.2Å; F334-V337 PolarHBondContact O-N 3.37Å; F334-R338 HydrophobicContact CD2-CB 4.4Å; F334-R338 HydrophobicContact CE2-CB 4.22Å; F334-R338 VanDerWaalsContact CE2-CD 3.43Å; F334-R338 HydrophobicContact CE2-CG 4.43Å; F334-R338 WeakPolarHBondContact O-CB 3.4Å; F334-R338 PolarHBondContact O-N 3.26Å; F334-Y452 HydrophobicContact CB-CD2 3.91Å; F334-Y452 HydrophobicContact CB-CE2 3.79Å; F334-Y452 HydrophobicContact CD2-CD2 4.35Å; F334-Y452 HydrophobicContact CD2-CE1 4.19Å; F334-Y452 AromaticContact CD2-CE2 3.54Å; F334-Y452 HydrophobicContact CD2-CE2 3.54Å; F334-Y452 AromaticContact CD2-CZ 3.42Å; F334-Y452 VanDerWaalsContact CD2-CZ 3.42Å; F334-Y452 VanDerWaalsContact CD2-OH 3.26Å; F334-Y452 WeakPolarHBondContact CD2-OH 3.38Å; F334-Y452 HydrophobicContact CE2-CE2 4.49Å; F334-Y452 WeakPolarHBondContact CE2-OH 3.39Å; F334-Y452 HydrophobicContact CG-CE2 4.08Å; F334-L591 HydrophobicContact CB-CD1 4.19Å; F334-L591 HydrophobicContact CB-CD2 3.43Å; F334-L591 VanDerWaalsContact CB-CD2 3.43Å; F334-L591 HydrophobicContact CB-CG 4.47Å; F334-L591 HydrophobicContact CD1-CD1 3.88Å; F334-L591 HydrophobicContact CD1-CD2 4.15Å; F334-L591 HydrophobicContact CD2-CD1 3.76Å; F334-L591 HydrophobicContact CE1-CD1 4.14Å; F334-L591 HydrophobicContact CE2-CD1 3.96Å; F334-L591 HydrophobicContact CG-CD1 3.66Å; F334-L591 HydrophobicContact CG-CD2 3.82Å; F334-L591 HydrophobicContact CG-CG 4.42Å; F334-L591 HydrophobicContact CZ-CD1 4.14Å; F334-F596 HydrophobicContact CD1-CD2 4.01Å; F334-F596 HydrophobicContact CD1-CE2 4.01Å; F334-F596 HydrophobicContact CD1-CG 4.45Å; F334-F596 HydrophobicContact CD1-CZ 4.49Å; F334-F596 HydrophobicContact CE1-CB 4.05Å; F334-F596 AromaticContact CE1-CD1 3.66Å; F334-F596 HydrophobicContact CE1-CD1 3.66Å; F334-F596 AromaticContact CE1-CD2 3.34Å; F334-F596 HydrophobicContact CE1-CD2 3.34Å; F334-F596 AromaticContact CE1-CE1 3.84Å; F334-F596 HydrophobicContact CE1-CE1 3.84Å; F334-F596 AromaticContact CE1-CE2 3.51Å; F334-F596 HydrophobicContact CE1-CE2 3.51Å; F334-F596 AromaticContact CE1-CG 3.41Å; F334-F596 HydrophobicContact CE1-CG 3.41Å; F334-F596 VanDerWaalsContact CE1-CG 3.41Å; F334-F596 AromaticContact CE1-CZ 3.76Å; F334-F596 HydrophobicContact CE1-CZ 3.76Å; F334-F596 HydrophobicContact CE2-CB 4.37Å; F334-F596 HydrophobicContact CZ-CB 3.59Å; F334-F596 AromaticContact CZ-CD1 3.78Å; F334-F596 HydrophobicContact CZ-CD1 3.78Å; F334-F596 AromaticContact CZ-CD2 3.84Å; F334-F596 HydrophobicContact CZ-CD2 3.84Å; F334-F596 HydrophobicContact CZ-CE1 4.38Å; F334-F596 HydrophobicContact CZ-CE2 4.41Å; F334-F596 AromaticContact CZ-CG 3.46Å; F334-F596 HydrophobicContact CZ-CG 3.46Å; F334-F596 VanDerWaalsContact CZ-CG 3.46Å
335	H	92.2	Very high	89.5	Confident	85 Å²	85	45.7 Å²	45.7	39%	0.394	23%	0.232	S	C	.	.	H	α-helix	trans	-58.9	-50.5	177.8	-83.6	-86.4	0	0	0	110.9	D331 S332 V337 R338 E339 F596	D331-H335 PolarHBondContact O-CD2 3.14Å; D331-H335 PolarHBondContact O-N 3.33Å; S332-H335 PolarHBondContact O-N 2.79Å; S332-H335 VanDerWaalsContact O-N 3.15Å; H335-V337 PolarHBondContact O-N 2.93Å; H335-R338 PolarHBondContact O-N 3.1Å; H335-E339 VanDerWaalsContact O-CB 3.24Å; H335-E339 WeakPolarHBondContact O-CB 3.42Å; H335-E339 PolarHBondContact O-N 3.04Å; H335-F596 AromaticContact NE2-CZ 3.59Å
336	L	95.9	Very high	89.1	Confident	49 Å²	49	48.6 Å²	48.6	26%	0.257	26%	0.264	S	S	.	.	H	α-helix	trans	-54.4	-49.1	176.5	-70.7	166.2	0	0	0	112.7	S332 K340 V362 A372 V374	S332-L336 WeakPolarHBondContact O-CG 3.4Å; S332-L336 PolarHBondContact O-N 3.33Å; L336-K340 WeakPolarHBondContact O-CB 3.16Å; L336-K340 PolarHBondContact O-N 3.12Å; L336-V362 HydrophobicContact CD1-CG1 4.21Å; L336-A372 HydrophobicContact CD1-CB 3.55Å; L336-V374 HydrophobicContact CB-CG2 4.07Å
337	V	95.4	Very high	88	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-67.6	-40.7	-179.7	172.2	0	0	0	0	111.8	I333 F334 H335 Y341 L358 V362 V374 L377 Y452	I333-V337 WeakPolarHBondContact O-CG2 3.43Å; I333-V337 PolarHBondContact O-N 2.83Å; F334-V337 PolarHBondContact O-N 3.37Å; H335-V337 PolarHBondContact O-N 2.93Å; V337-Y341 WeakPolarHBondContact O-CB 3.33Å; V337-Y341 PolarHBondContact O-N 3.32Å; V337-L358 HydrophobicContact CG1-CD1 4.35Å; V337-L358 HydrophobicContact CG1-CD2 4.36Å; V337-L358 HydrophobicContact CG1-CG 4.31Å; V337-V362 HydrophobicContact CG2-CG2 3.54Å; V337-V374 HydrophobicContact CG2-CG1 4.44Å; V337-V374 HydrophobicContact CG2-CG2 4.29Å; V337-L377 HydrophobicContact CG1-CD1 4.05Å; V337-L377 WeakPolarHBondContact O-CD1 3.47Å; V337-Y452 HydrophobicContact CB-CD1 4.34Å; V337-Y452 HydrophobicContact CG1-CD1 3.87Å
338	R	90.9	Very high	86.8	Confident	37 Å²	37	47.3 Å²	47.3	14%	0.14	28%	0.276	C	S	.	.	H	α-helix	trans	-69.9	-37.6	179.7	-178.7	171.1	175.6	-143.4	7	112.1	F334 H335 R342	F334-R338 HydrophobicContact CD2-CB 4.4Å; F334-R338 HydrophobicContact CE2-CB 4.22Å; F334-R338 VanDerWaalsContact CE2-CD 3.43Å; F334-R338 HydrophobicContact CE2-CG 4.43Å; F334-R338 WeakPolarHBondContact O-CB 3.4Å; F334-R338 PolarHBondContact O-N 3.26Å; H335-R338 PolarHBondContact O-N 3.1Å; R338-R342 WeakPolarHBondContact O-CG 3.44Å; R338-R342 PolarHBondContact O-N 2.91Å; R338-R342 VanDerWaalsContact O-N 3.08Å
339	E	91.9	Very high	85.6	Confident	125 Å²	125	44.6 Å²	44.6	58%	0.584	27%	0.267	S	S	*	.	H	α-helix	trans	-68	-48.1	174.5	-177.2	166.6	-164.9	0	0	111.5	H335 Y341 R342 S343	H335-E339 VanDerWaalsContact O-CB 3.24Å; H335-E339 WeakPolarHBondContact O-CB 3.42Å; H335-E339 PolarHBondContact O-N 3.04Å; E339-Y341 VanDerWaalsContact C-N 3.28Å; E339-Y341 PolarHBondContact O-N 3.28Å; E339-R342 WeakPolarHBondContact O-CB 3.45Å; E339-R342 PolarHBondContact O-N 3.47Å; E339-S343 PolarHBondContact O-N 2.81Å
340	K	94.4	Very high	84.2	Confident	65 Å²	65	48.6 Å²	48.6	28%	0.283	30%	0.295	S	S	.	.	H	α-helix	trans	-61.2	-36.9	176.2	-171.2	57.1	173.8	176.9	0	112.2	L336 S343 L344 V374 L377 W610	L336-K340 WeakPolarHBondContact O-CB 3.16Å; L336-K340 PolarHBondContact O-N 3.12Å; K340-S343 PolarHBondContact O-N 3.2Å; K340-L344 HydrophobicContact CD-CD1 4.4Å; K340-L344 HydrophobicContact CD-CG 4.4Å; K340-L344 HydrophobicContact CG-CD1 4.08Å; K340-L344 WeakPolarHBondContact O-CD1 3.49Å; K340-L344 VanDerWaalsContact O-CG 3.26Å; K340-L344 WeakPolarHBondContact O-CG 3.18Å; K340-L344 PolarHBondContact O-N 2.87Å; K340-V374 HydrophobicContact CB-CB 4.2Å; K340-V374 HydrophobicContact CB-CG1 4.34Å; K340-V374 HydrophobicContact CB-CG2 3.92Å; K340-V374 HydrophobicContact CG-CB 4.13Å; K340-V374 HydrophobicContact CG-CG1 4.22Å; K340-V374 HydrophobicContact CG-CG2 4.39Å; K340-L377 HydrophobicContact CB-CD1 4.14Å; K340-L377 HydrophobicContact CG-CD1 4.31Å; K340-W610 HydrophobicContact CD-CH2 4.49Å; K340-W610 VanDerWaalsContact CE-CZ2 3.43Å; K340-W610 HydrophobicContact CG-CH2 4.47Å; K340-W610 HydrophobicContact CG-CZ3 4.21Å
341	Y	91.9	Very high	82.6	Confident	10 Å²	10	51.9 Å²	51.9	4%	0.039	32%	0.322	C	S	.	.	H	α-helix	trans	-61.5	-46	171.7	175.4	-107.4	0	0	0	112.4	V337 E339 L344 V345 H352 A353 H355 L358 L377 T379 I608	V337-Y341 WeakPolarHBondContact O-CB 3.33Å; V337-Y341 PolarHBondContact O-N 3.32Å; E339-Y341 VanDerWaalsContact C-N 3.28Å; E339-Y341 PolarHBondContact O-N 3.28Å; Y341-L344 PolarHBondContact O-N 3.01Å; Y341-V345 HydrophobicContact CD2-CG2 3.86Å; Y341-V345 HydrophobicContact CE2-CB 4.34Å; Y341-V345 HydrophobicContact CE2-CG2 3.55Å; Y341-V345 WeakPolarHBondContact O-CB 3.42Å; Y341-V345 WeakPolarHBondContact O-CG2 3.44Å; Y341-V345 PolarHBondContact O-N 2.74Å; Y341-H352 PolarHBondContact OH-O 2.71Å; Y341-A353 PolarHBondContact OH-O 3.36Å; Y341-H355 AromaticContact CD1-CE1 3.81Å; Y341-H355 AromaticContact CD1-ND1 3.93Å; Y341-H355 AromaticContact CE1-CE1 3.35Å; Y341-H355 WeakPolarHBondContact CE1-CE1 3.47Å; Y341-H355 AromaticContact CE1-ND1 3.07Å; Y341-H355 WeakPolarHBondContact CE1-ND1 3.42Å; Y341-H355 AromaticContact CZ-CE1 3.88Å; Y341-H355 AromaticContact CZ-ND1 3.14Å; Y341-H355 PolarHBondContact OH-ND1 2.96Å; Y341-L358 HydrophobicContact CD1-CD2 4.43Å; Y341-L358 HydrophobicContact CD2-CD1 4.1Å; Y341-L358 HydrophobicContact CG-CD1 4.16Å; Y341-L358 HydrophobicContact CG-CD2 4.32Å; Y341-L377 HydrophobicContact CD2-CD2 3.82Å; Y341-L377 HydrophobicContact CG-CD2 4.45Å; Y341-T379 HydrophobicContact CD2-CG2 4.28Å; Y341-T379 HydrophobicContact CE2-CG2 3.67Å; Y341-I608 HydrophobicContact CE2-CD1 4.29Å
342	R	88.9	Confident	81.3	Confident	125 Å²	125	53.7 Å²	53.7	47%	0.472	33%	0.33	S	S	.	.	H	α-helix	trans	-61.6	-43.5	175.7	-72.7	171.9	-178.1	153	-12.5	112	R338 E339 L344 V345 G346	R338-R342 WeakPolarHBondContact O-CG 3.44Å; R338-R342 PolarHBondContact O-N 2.91Å; R338-R342 VanDerWaalsContact O-N 3.08Å; E339-R342 WeakPolarHBondContact O-CB 3.45Å; E339-R342 PolarHBondContact O-N 3.47Å; R342-L344 VanDerWaalsContact C-N 3.33Å; R342-L344 PolarHBondContact O-N 3.37Å; R342-V345 PolarHBondContact O-N 2.96Å; R342-G346 WeakPolarHBondContact O-CA 3.4Å; R342-G346 PolarHBondContact O-N 3.05Å
343	S	90.9	Very high	79.7	Confident	81 Å²	81	53.9 Å²	53.9	57%	0.566	33%	0.334	S	S	*	.	H	α-helix	trans	-56.5	-46.4	175.7	162.8	0	0	0	0	111.6	E339 K340	E339-S343 PolarHBondContact O-N 2.81Å; K340-S343 PolarHBondContact O-N 3.2Å
344	L	88.6	Confident	78.3	Confident	16 Å²	16	63 Å²	63	8%	0.084	37%	0.369	C	S	.	.	H	α-helix	trans	-72.6	-27.1	-179.1	-68.4	166.7	0	0	0	114.1	K340 Y341 R342 W610 P617	K340-L344 HydrophobicContact CD-CD1 4.4Å; K340-L344 HydrophobicContact CD-CG 4.4Å; K340-L344 HydrophobicContact CG-CD1 4.08Å; K340-L344 WeakPolarHBondContact O-CD1 3.49Å; K340-L344 VanDerWaalsContact O-CG 3.26Å; K340-L344 WeakPolarHBondContact O-CG 3.18Å; K340-L344 PolarHBondContact O-N 2.87Å; Y341-L344 PolarHBondContact O-N 3.01Å; R342-L344 VanDerWaalsContact C-N 3.33Å; R342-L344 PolarHBondContact O-N 3.37Å; L344-W610 HydrophobicContact CD1-CB 3.84Å; L344-W610 HydrophobicContact CD1-CD2 3.58Å; L344-W610 HydrophobicContact CD1-CE3 3.98Å; L344-W610 HydrophobicContact CD1-CG 3.5Å; L344-W610 VanDerWaalsContact CD1-CG 3.5Å; L344-W610 HydrophobicContact CD2-CD2 4.27Å; L344-W610 HydrophobicContact CD2-CG 4.03Å; L344-W610 HydrophobicContact CG-CG 4.43Å; L344-P617 HydrophobicContact CB-CG 4.44Å
345	V	81.8	Confident	77.4	Confident	6 Å²	6	64.2 Å²	64.2	4%	0.036	37%	0.374	C	S	.	.	H	α-helix	trans	-111.4	-7.8	-172	-173.8	0	0	0	0	113	Y341 R342 G347 C348 H352 A353 I608	Y341-V345 HydrophobicContact CD2-CG2 3.86Å; Y341-V345 HydrophobicContact CE2-CB 4.34Å; Y341-V345 HydrophobicContact CE2-CG2 3.55Å; Y341-V345 WeakPolarHBondContact O-CB 3.42Å; Y341-V345 WeakPolarHBondContact O-CG2 3.44Å; Y341-V345 PolarHBondContact O-N 2.74Å; R342-V345 PolarHBondContact O-N 2.96Å; V345-G347 VanDerWaalsContact C-N 3.26Å; V345-G347 PolarHBondContact O-N 3.33Å; V345-C348 HydrophobicContact CG1-CB 3.97Å; V345-C348 WeakPolarHBondContact O-CB 3.41Å; V345-C348 PolarHBondContact O-N 3Å; V345-H352 HydrophobicContact CG1-CB 3.97Å; V345-A353 HydrophobicContact CG1-CB 4.05Å; V345-I608 HydrophobicContact CG2-CD1 4.33Å
346	G	67	Low	76.8	Confident	69 Å²	69	63.5 Å²	63.5	71%	0.711	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-27.5	170.7	0	0	0	0	0	113.3	R342 C348	R342-G346 WeakPolarHBondContact O-CA 3.4Å; R342-G346 PolarHBondContact O-N 3.05Å; G346-C348 VanDerWaalsContact C-N 3.32Å
347	G	58.1	Low	76.5	Confident	78 Å²	78	61.2 Å²	61.2	80%	0.804	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	9.9	169	0	0	0	0	0	114.6	V345	V345-G347 VanDerWaalsContact C-N 3.26Å; V345-G347 PolarHBondContact O-N 3.33Å
348	C	58	Low	76.5	Confident	41 Å²	41	61.4 Å²	61.4	28%	0.277	36%	0.36	S	S	.	.	S	Bend	trans	-113.7	157.9	-179.2	-77.7	0	0	0	0	111.5	V345 G346 H352	V345-C348 HydrophobicContact CG1-CB 3.97Å; V345-C348 WeakPolarHBondContact O-CB 3.41Å; V345-C348 PolarHBondContact O-N 3Å; G346-C348 VanDerWaalsContact C-N 3.32Å; C348-H352 HydrophobicContact CB-CB 4.3Å
349	S	60.7	Low	76.8	Confident	72 Å²	72	59.7 Å²	59.7	50%	0.503	35%	0.353	S	S	.	.			trans	-49.5	138.5	171.8	171.2	0	0	0	0	112	A351 H352	S349-A351 PolarHBondContact O-N 2.84Å; S349-H352 PolarHBondContact O-N 2.81Å
350	P	59.8	Low	77.1	Confident	104 Å²	104	53.7 Å²	53.7	68%	0.675	33%	0.325	S	S	*	.	H	α-helix	trans	-60	-16.5	-176.1	22.7	-34.2	0	0	0	114.3	H352 A353	P350-H352 PolarHBondContact O-N 3.34Å; P350-A353 PolarHBondContact O-N 3.41Å
351	A	56.9	Low	77.3	Confident	68 Å²	68	50.6 Å²	50.6	56%	0.562	31%	0.312	S	S	*	.	H	α-helix	trans	-60.3	-29.8	169.5	0	0	0	0	0	113.3	S349	S349-A351 PolarHBondContact O-N 2.84Å
352	H	62.3	Low	77.6	Confident	50 Å²	50	50.1 Å²	50.1	23%	0.231	31%	0.31	C	S	.	.	H	α-helix	trans	-86.7	-18.6	179.2	-65.5	155.1	0	0	0	113.7	Y341 V345 C348 S349 P350 R354 I608	Y341-H352 PolarHBondContact OH-O 2.71Å; V345-H352 HydrophobicContact CG1-CB 3.97Å; C348-H352 HydrophobicContact CB-CB 4.3Å; S349-H352 PolarHBondContact O-N 2.81Å; P350-H352 PolarHBondContact O-N 3.34Å; H352-R354 VanDerWaalsContact C-N 3.34Å; H352-R354 PolarHBondContact O-N 2.73Å; H352-I608 HydrophobicContact CB-CD1 4.03Å
353	A	60.2	Low	78	Confident	47 Å²	47	44.5 Å²	44.5	39%	0.388	29%	0.289	S	S	.	.	H	α-helix	trans	-73.8	-20.9	-178.7	0	0	0	0	0	114.1	Y341 V345 P350	Y341-A353 PolarHBondContact OH-O 3.36Å; V345-A353 HydrophobicContact CG1-CB 4.05Å; P350-A353 PolarHBondContact O-N 3.41Å
354	R	65.1	Low	78.3	Confident	193 Å²	193	40.6 Å²	40.6	73%	0.728	26%	0.262	S	S	*	.			trans	-100	102	179.7	-67.2	-176	177	-176.2	-0.4	110.7	H352	H352-R354 VanDerWaalsContact C-N 3.34Å; H352-R354 PolarHBondContact O-N 2.73Å
355	H	73.9	Confident	78.5	Confident	27 Å²	27	43.3 Å²	43.3	13%	0.125	27%	0.271	C	S	.	.			trans	-106.6	152.5	175.4	59.3	-93.6	0	0	0	111.8	Y341 L358 T379 G601	Y341-H355 AromaticContact CD1-CE1 3.81Å; Y341-H355 AromaticContact CD1-ND1 3.93Å; Y341-H355 AromaticContact CE1-CE1 3.35Å; Y341-H355 WeakPolarHBondContact CE1-CE1 3.47Å; Y341-H355 AromaticContact CE1-ND1 3.07Å; Y341-H355 WeakPolarHBondContact CE1-ND1 3.42Å; Y341-H355 AromaticContact CZ-CE1 3.88Å; Y341-H355 AromaticContact CZ-ND1 3.14Å; Y341-H355 PolarHBondContact OH-ND1 2.96Å; H355-L358 VanDerWaalsContact CD2-CB 3.49Å; H355-L358 WeakPolarHBondContact CD2-CB 3.29Å; H355-L358 WeakPolarHBondContact NE2-CB 3.24Å; H355-T379 HydrophobicContact CB-CG2 3.76Å; H355-G601 PolarHBondContact O-N 2.83Å
356	K	81	Confident	78.8	Confident	70 Å²	70	48.4 Å²	48.4	30%	0.304	30%	0.298	S	S	.	.	S	Bend	trans	-91.8	-33.9	171.1	-165.7	176.7	-173.1	-167.1	0	113.1	T381 E495 G601 A603	K356-T381 HydrophobicContact CB-CG2 4.07Å; K356-T381 HydrophobicContact CG-CG2 4.43Å; K356-E495 WeakPolarHBondContact CD-OE2 3.48Å; K356-E495 WeakPolarHBondContact CE-OE2 3.49Å; K356-E495 IonicContact NZ-OE1 2.7Å; K356-E495 PolarHBondContact NZ-OE1 3.1Å; K356-E495 IonicContact NZ-OE2 2.71Å; K356-E495 PolarHBondContact NZ-OE2 3.47Å; K356-G601 WeakPolarHBondContact CB-O 3.14Å; K356-G601 WeakPolarHBondContact CG-O 3.28Å; K356-A603 HydrophobicContact CD-CB 3.77Å
357	S	89.5	Confident	79.7	Confident	2 Å²	2	48.7 Å²	48.7	1%	0.014	28%	0.282	C	S	.	.			trans	-131.8	136.9	171.2	-169.9	0	0	0	0	109.9	T379 G380 T381 S454	S357-T379 VanDerWaalsContact O-CA 3.25Å; S357-T379 WeakPolarHBondContact O-CA 3.46Å; S357-T379 VanDerWaalsContact O-CB 3.31Å; S357-T379 WeakPolarHBondContact O-CB 3.43Å; S357-G380 PolarHBondContact O-N 3.05Å; S357-T381 VanDerWaalsContact CB-CG2 3.46Å; S357-S454 WeakPolarHBondContact CA-OG 3.45Å
358	L	93.6	Very high	81.2	Confident	4 Å²	4	46.5 Å²	46.5	2%	0.021	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	135.2	174.4	164.5	67.1	0	0	0	107.4	V337 Y341 H355 L377 T379 Y452 S454	V337-L358 HydrophobicContact CG1-CD1 4.35Å; V337-L358 HydrophobicContact CG1-CD2 4.36Å; V337-L358 HydrophobicContact CG1-CG 4.31Å; Y341-L358 HydrophobicContact CD1-CD2 4.43Å; Y341-L358 HydrophobicContact CD2-CD1 4.1Å; Y341-L358 HydrophobicContact CG-CD1 4.16Å; Y341-L358 HydrophobicContact CG-CD2 4.32Å; H355-L358 VanDerWaalsContact CD2-CB 3.49Å; H355-L358 WeakPolarHBondContact CD2-CB 3.29Å; H355-L358 WeakPolarHBondContact NE2-CB 3.24Å; L358-L377 HydrophobicContact CD1-CD2 3.83Å; L358-L377 HydrophobicContact CD1-CG 4.09Å; L358-T379 HydrophobicContact CB-CG2 4.45Å; L358-T379 HydrophobicContact CD1-CG2 4.11Å; L358-Y452 HydrophobicContact CD2-CE1 4.38Å; L358-Y452 HydrophobicContact CG-CE1 4.37Å; L358-S454 PolarHBondContact N-OG 2.85Å; L358-S454 WeakPolarHBondContact O-CB 3.45Å; L358-S454 PolarHBondContact O-N 3.05Å
359	A	97.3	Very high	82.6	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	146.7	170.9	0	0	0	0	0	109.8	S378 A401 E402 A405 Y452	A359-S378 PolarHBondContact N-O 3.43Å; A359-S378 PolarHBondContact O-N 2.87Å; A359-S378 VanDerWaalsContact O-O 3.12Å; A359-A401 HydrophobicContact CB-CB 3.66Å; A359-E402 HydrophobicContact CB-CB 4.35Å; A359-A405 HydrophobicContact CB-CB 4.12Å; A359-Y452 WeakPolarHBondContact CA-O 3.41Å; A359-Y452 WeakPolarHBondContact CB-O 3.05Å
360	G	98.2	Very high	84	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	154.1	174.6	0	0	0	0	0	110.4	A376 M451 Y452	G360-A376 CarbonylContact C-O 3.59Å; G360-A376 VanDerWaalsContact CA-O 3.3Å; G360-A376 WeakPolarHBondContact CA-O 3.25Å; G360-M451 CarbonylContact O-C 3.49Å; G360-M451 WeakPolarHBondContact O-CA 3.5Å; G360-Y452 PolarHBondContact N-O 3.14Å; G360-Y452 PolarHBondContact O-N 2.99Å
361	I	98.8	Very high	85.3	Confident	0 Å²	0	54 Å²	54	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	120.4	172.8	-58.3	170.9	0	0	0	106.8	V375 A376 A405 L409 F449 H450 M451	I361-V375 HydrophobicContact CB-CG2 4.41Å; I361-V375 HydrophobicContact CG2-CG2 4.13Å; I361-V375 VanDerWaalsContact O-CG2 3.27Å; I361-V375 WeakPolarHBondContact O-CG2 3.19Å; I361-V375 PolarHBondContact O-N 2.71Å; I361-A376 HydrophobicContact CB-CB 4.34Å; I361-A376 PolarHBondContact N-O 3.18Å; I361-A376 PolarHBondContact O-N 2.81Å; I361-A405 HydrophobicContact CD1-CB 4.22Å; I361-A405 HydrophobicContact CG1-CB 4.34Å; I361-L409 HydrophobicContact CD1-CB 3.89Å; I361-L409 HydrophobicContact CD1-CD2 3.97Å; I361-L409 HydrophobicContact CD1-CG 4.46Å; I361-L409 HydrophobicContact CG2-CD1 4.33Å; I361-L409 HydrophobicContact CG2-CD2 4.39Å; I361-F449 HydrophobicContact CG2-CB 4.18Å; I361-F449 HydrophobicContact CG2-CD1 4.09Å; I361-H450 CarbonylContact C-O 3.55Å; I361-H450 WeakPolarHBondContact CA-O 3.17Å; I361-M451 HydrophobicContact CD1-CE 3.62Å; I361-M451 HydrophobicContact CG1-CB 4.4Å; I361-M451 HydrophobicContact CG1-CE 3.82Å; I361-M451 HydrophobicContact CG1-CG 4.37Å
362	V	98.6	Very high	87.1	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	137.6	177.3	-174.6	0	0	0	0	108.2	I333 L336 V337 A372 Q373 V374 F449 H450	I333-V362 HydrophobicContact CD1-CB 3.79Å; I333-V362 HydrophobicContact CD1-CG1 3.73Å; I333-V362 HydrophobicContact CD1-CG2 4.12Å; I333-V362 HydrophobicContact CG2-CG2 4.03Å; L336-V362 HydrophobicContact CD1-CG1 4.21Å; V337-V362 HydrophobicContact CG2-CG2 3.54Å; V362-A372 HydrophobicContact CG1-CB 3.93Å; V362-Q373 CarbonylContact C-O 3.56Å; V362-Q373 WeakPolarHBondContact CA-O 3.27Å; V362-V374 HydrophobicContact CG2-CG2 4.27Å; V362-F449 WeakPolarHBondContact O-CA 3.29Å; V362-H450 PolarHBondContact N-O 3.2Å; V362-H450 PolarHBondContact O-N 3.44Å
363	M	98.2	Very high	88.7	Confident	6 Å²	6	53.9 Å²	53.9	3%	0.03	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	135.2	169.6	-177.6	-174.8	73.9	0	0	108.7	A372 Q373 V375 F412 I432 V447 H448 F449	M363-A372 CarbonylContact O-C 3.24Å; M363-A372 WeakPolarHBondContact O-CA 3.2Å; M363-Q373 HydrophobicContact CE-CB 4.37Å; M363-Q373 PolarHBondContact N-O 3.07Å; M363-Q373 PolarHBondContact O-N 3.49Å; M363-V375 HydrophobicContact CB-CG1 3.54Å; M363-V375 HydrophobicContact CB-CG2 4.25Å; M363-V375 HydrophobicContact CE-CG1 4.37Å; M363-V375 HydrophobicContact CG-CG1 4.45Å; M363-V375 HydrophobicContact SD-CG1 4.16Å; M363-F412 HydrophobicContact SD-CE1 4.05Å; M363-F412 HydrophobicContact SD-CZ 4Å; M363-I432 HydrophobicContact SD-CG2 3.53Å; M363-I432 VanDerWaalsContact SD-CG2 3.53Å; M363-V447 HydrophobicContact CG-CG1 3.73Å; M363-V447 HydrophobicContact SD-CG1 3.96Å; M363-H448 CarbonylContact C-O 3.49Å; M363-H448 VanDerWaalsContact CA-O 3.32Å; M363-H448 WeakPolarHBondContact CA-O 3.44Å; M363-F449 HydrophobicContact CB-CD1 4.08Å; M363-F449 HydrophobicContact CB-CE1 3.88Å; M363-F449 HydrophobicContact CG-CD1 4.36Å; M363-F449 HydrophobicContact CG-CE1 3.9Å; M363-F449 HydrophobicContact SD-CE1 4.35Å
364	T	96.4	Very high	90.5	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	152.2	167.1	57	0	0	0	0	109.5	F329 A372 V447 H448 H450	F329-T364 HydrophobicContact CZ-CG2 4.17Å; T364-A372 HydrophobicContact CG2-CB 3.85Å; T364-V447 WeakPolarHBondContact O-CA 3.26Å; T364-H448 PolarHBondContact N-O 3.33Å; T364-H448 PolarHBondContact O-N 3.27Å; T364-H450 PolarHBondContact OG1-NE2 3.4Å; T364-H450 VanDerWaalsContact OG1-NE2 3.12Å
365	R	93.5	Very high	92.1	Very high	73 Å²	73	43.1 Å²	43.1	28%	0.275	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	134.6	160.6	-62.8	-173.4	-170.5	-114.2	8.9	108.1	L367 D368 E430 N446 V447	R365-L367 PolarHBondContact O-N 2.85Å; R365-D368 WeakPolarHBondContact O-CB 3.48Å; R365-D368 PolarHBondContact O-N 3.23Å; R365-E430 PolarHBondContact NH2-O 2.9Å; R365-N446 CarbonylContact C-O 3.57Å; R365-N446 WeakPolarHBondContact CA-O 3.41Å; R365-V447 HydrophobicContact CG-CG2 4.27Å
366	D	88.1	Confident	93.3	Very high	113 Å²	113	41.9 Å²	41.9	60%	0.604	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.8	24.3	176.2	-58.4	-74.7	0	0	0	114.9	D368 N446	D366-D368 PolarHBondContact O-N 3.24Å; D366-N446 VanDerWaalsContact CG-CB 3.43Å; D366-N446 PolarHBondContact N-O 3.07Å; D366-N446 WeakPolarHBondContact OD1-CB 3.35Å; D366-N446 VanDerWaalsContact OD2-CB 3.31Å; D366-N446 WeakPolarHBondContact OD2-CB 3.49Å; D366-N446 PolarHBondContact OD2-ND2 3.35Å
367	L	86.6	Confident	94.1	Very high	74 Å²	74	38.6 Å²	38.6	39%	0.387	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.5	19.7	-169.8	-55.3	174.5	0	0	0	114.1	F329 R365 H448 Q550	F329-L367 HydrophobicContact CE2-CB 4.41Å; F329-L367 WeakPolarHBondContact CE2-O 3.35Å; R365-L367 PolarHBondContact O-N 2.85Å; L367-H448 HydrophobicContact CD2-CB 3.89Å; L367-Q550 HydrophobicContact CD2-CG 4.3Å
368	D	88.1	Confident	94.4	Very high	33 Å²	33	38.5 Å²	38.5	18%	0.176	18%	0.18	C	C	.	.			trans	-79.1	124.4	175.2	-172.5	-3.1	0	0	0	111.1	R365 D366 R370 H371	R365-D368 WeakPolarHBondContact O-CB 3.48Å; R365-D368 PolarHBondContact O-N 3.23Å; D366-D368 PolarHBondContact O-N 3.24Å; D368-R370 VanDerWaalsContact C-N 3.35Å; D368-R370 VanDerWaalsContact OD1-CB 3.32Å; D368-R370 WeakPolarHBondContact OD1-CB 3.48Å; D368-R370 WeakPolarHBondContact OD1-CG 3.46Å; D368-R370 IonicContact OD1-CZ 3.29Å; D368-R370 PolarHBondContact OD1-N 2.81Å; D368-R370 IonicContact OD1-NE 3.58Å; D368-R370 PolarHBondContact OD1-NE 3.26Å; D368-R370 IonicContact OD1-NH2 3.96Å; D368-R370 IonicContact OD2-CZ 3.99Å; D368-R370 VanDerWaalsContact OD2-CZ 3.25Å; D368-R370 IonicContact OD2-NE 3.29Å; D368-R370 PolarHBondContact OD2-NE 3.11Å; D368-R370 IonicContact OD2-NH2 2.73Å; D368-R370 PolarHBondContact OD2-NH2 2.84Å; D368-H371 IonicContact OD2-CE1 2.8Å; D368-H371 PolarHBondContact OD2-CE1 2.97Å; D368-H371 IonicContact OD2-ND1 3.89Å; D368-H371 PolarHBondContact OD2-ND1 3.06Å
369	L	88.8	Confident	94.5	Very high	56 Å²	56	38.5 Å²	38.5	29%	0.293	18%	0.18	S	C	.	.	S	Bend	trans	-73.8	-24.3	177.8	-70	167.2	0	0	0	113	F329 I333 H371 A372	F329-L369 HydrophobicContact CB-CD1 4.22Å; F329-L369 HydrophobicContact CD1-CD2 4.43Å; F329-L369 HydrophobicContact CD2-CD1 3.77Å; F329-L369 HydrophobicContact CD2-CD2 3.61Å; F329-L369 HydrophobicContact CD2-CG 3.65Å; F329-L369 HydrophobicContact CE1-CD2 4.47Å; F329-L369 HydrophobicContact CE2-CD1 4.5Å; F329-L369 HydrophobicContact CE2-CD2 3.64Å; F329-L369 HydrophobicContact CE2-CG 3.89Å; F329-L369 HydrophobicContact CG-CD1 4.2Å; F329-L369 HydrophobicContact CG-CD2 4.03Å; F329-L369 HydrophobicContact CG-CG 4.37Å; F329-L369 HydrophobicContact CZ-CD2 4.09Å; I333-L369 HydrophobicContact CD1-CD2 4.28Å; I333-L369 HydrophobicContact CG1-CD2 4.48Å; L369-H371 PolarHBondContact O-N 3.24Å; L369-A372 WeakPolarHBondContact O-CB 3.36Å; L369-A372 PolarHBondContact O-N 3.34Å
370	R	88.3	Confident	94.3	Very high	206 Å²	206	38.8 Å²	38.8	78%	0.777	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-30.2	177.3	-59.2	172.7	-63.1	176.5	6.8	111.8	D368	D368-R370 VanDerWaalsContact C-N 3.35Å; D368-R370 VanDerWaalsContact OD1-CB 3.32Å; D368-R370 WeakPolarHBondContact OD1-CB 3.48Å; D368-R370 WeakPolarHBondContact OD1-CG 3.46Å; D368-R370 IonicContact OD1-CZ 3.29Å; D368-R370 PolarHBondContact OD1-N 2.81Å; D368-R370 IonicContact OD1-NE 3.58Å; D368-R370 PolarHBondContact OD1-NE 3.26Å; D368-R370 IonicContact OD1-NH2 3.96Å; D368-R370 IonicContact OD2-CZ 3.99Å; D368-R370 VanDerWaalsContact OD2-CZ 3.25Å; D368-R370 IonicContact OD2-NE 3.29Å; D368-R370 PolarHBondContact OD2-NE 3.11Å; D368-R370 IonicContact OD2-NH2 2.73Å; D368-R370 PolarHBondContact OD2-NH2 2.84Å
371	H	87.1	Confident	94	Very high	112 Å²	112	39.3 Å²	39.3	52%	0.519	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	14.8	179.1	-59.9	105.1	0	0	0	112.6	D368 L369	D368-H371 IonicContact OD2-CE1 2.8Å; D368-H371 PolarHBondContact OD2-CE1 2.97Å; D368-H371 IonicContact OD2-ND1 3.89Å; D368-H371 PolarHBondContact OD2-ND1 3.06Å; L369-H371 PolarHBondContact O-N 3.24Å
372	A	95.1	Very high	93.7	Very high	15 Å²	15	41.5 Å²	41.5	12%	0.124	20%	0.195	C	C	.	.			trans	-77.5	128.2	-177.7	0	0	0	0	0	112.4	L336 V362 M363 T364 L369	L336-A372 HydrophobicContact CD1-CB 3.55Å; V362-A372 HydrophobicContact CG1-CB 3.93Å; M363-A372 CarbonylContact O-C 3.24Å; M363-A372 WeakPolarHBondContact O-CA 3.2Å; T364-A372 HydrophobicContact CG2-CB 3.85Å; L369-A372 WeakPolarHBondContact O-CB 3.36Å; L369-A372 PolarHBondContact O-N 3.34Å
373	Q	96.7	Very high	93.4	Very high	100 Å²	100	42 Å²	42	47%	0.467	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	130.4	-177.9	-62.8	-176.9	-2.2	0	0	111.4	V362 M363 V375	V362-Q373 CarbonylContact C-O 3.56Å; V362-Q373 WeakPolarHBondContact CA-O 3.27Å; M363-Q373 HydrophobicContact CE-CB 4.37Å; M363-Q373 PolarHBondContact N-O 3.07Å; M363-Q373 PolarHBondContact O-N 3.49Å; Q373-V375 PolarHBondContact O-N 2.94Å
374	V	98.3	Very high	93.2	Very high	15 Å²	15	41.8 Å²	41.8	9%	0.091	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	109.3	170.6	-174.2	0	0	0	0	108.4	L336 V337 K340 V362 L377 W610	L336-V374 HydrophobicContact CB-CG2 4.07Å; V337-V374 HydrophobicContact CG2-CG1 4.44Å; V337-V374 HydrophobicContact CG2-CG2 4.29Å; K340-V374 HydrophobicContact CB-CB 4.2Å; K340-V374 HydrophobicContact CB-CG1 4.34Å; K340-V374 HydrophobicContact CB-CG2 3.92Å; K340-V374 HydrophobicContact CG-CB 4.13Å; K340-V374 HydrophobicContact CG-CG1 4.22Å; K340-V374 HydrophobicContact CG-CG2 4.39Å; V362-V374 HydrophobicContact CG2-CG2 4.27Å; V374-L377 HydrophobicContact CG1-CB 4.31Å; V374-L377 HydrophobicContact CG1-CD1 4.13Å; V374-W610 HydrophobicContact CG1-CZ3 4.23Å; V374-W610 WeakPolarHBondContact O-CH2 3.47Å; V374-W610 VanDerWaalsContact O-CZ3 3.27Å; V374-W610 WeakPolarHBondContact O-CZ3 3.42Å
375	V	98.4	Very high	93	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	-24	-176.9	-67.6	0	0	0	0	113.5	I361 M363 Q373 L409 F412 F449 T611 L612	I361-V375 HydrophobicContact CB-CG2 4.41Å; I361-V375 HydrophobicContact CG2-CG2 4.13Å; I361-V375 VanDerWaalsContact O-CG2 3.27Å; I361-V375 WeakPolarHBondContact O-CG2 3.19Å; I361-V375 PolarHBondContact O-N 2.71Å; M363-V375 HydrophobicContact CB-CG1 3.54Å; M363-V375 HydrophobicContact CB-CG2 4.25Å; M363-V375 HydrophobicContact CE-CG1 4.37Å; M363-V375 HydrophobicContact CG-CG1 4.45Å; M363-V375 HydrophobicContact SD-CG1 4.16Å; Q373-V375 PolarHBondContact O-N 2.94Å; V375-L409 HydrophobicContact CG2-CD1 3.89Å; V375-F412 HydrophobicContact CB-CD1 3.89Å; V375-F412 HydrophobicContact CB-CD2 4.29Å; V375-F412 HydrophobicContact CB-CE1 3.95Å; V375-F412 HydrophobicContact CB-CE2 4.37Å; V375-F412 HydrophobicContact CB-CG 4.05Å; V375-F412 HydrophobicContact CB-CZ 4.2Å; V375-F412 HydrophobicContact CG1-CD1 4.1Å; V375-F412 HydrophobicContact CG1-CD2 4.41Å; V375-F412 HydrophobicContact CG1-CE1 3.62Å; V375-F412 HydrophobicContact CG1-CE2 3.99Å; V375-F412 HydrophobicContact CG1-CG 4.46Å; V375-F412 HydrophobicContact CG1-CZ 3.57Å; V375-F412 HydrophobicContact CG2-CD1 4.27Å; V375-F412 HydrophobicContact CG2-CE1 4.43Å; V375-F449 HydrophobicContact CG2-CD1 4.19Å; V375-F449 HydrophobicContact CG2-CE1 4.01Å; V375-T611 WeakPolarHBondContact O-CA 3.39Å; V375-L612 HydrophobicContact CG1-CD2 4.13Å; V375-L612 PolarHBondContact O-N 3.45Å
376	A	98.5	Very high	92.8	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	143.8	176.8	0	0	0	0	0	111	G360 I361 A405 A408 L409 W610	G360-A376 CarbonylContact C-O 3.59Å; G360-A376 VanDerWaalsContact CA-O 3.3Å; G360-A376 WeakPolarHBondContact CA-O 3.25Å; I361-A376 HydrophobicContact CB-CB 4.34Å; I361-A376 PolarHBondContact N-O 3.18Å; I361-A376 PolarHBondContact O-N 2.81Å; A376-A405 WeakPolarHBondContact CB-O 3.2Å; A376-A408 HydrophobicContact CB-CB 3.71Å; A376-L409 HydrophobicContact CB-CB 4.23Å; A376-W610 WeakPolarHBondContact CA-O 3.49Å
377	L	97.6	Very high	92.9	Very high	2 Å²	2	39.9 Å²	39.9	1%	0.01	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	142.8	-177.6	-166.7	146.4	0	0	0	110.8	V337 K340 Y341 L358 V374 N609 W610	V337-L377 HydrophobicContact CG1-CD1 4.05Å; V337-L377 WeakPolarHBondContact O-CD1 3.47Å; K340-L377 HydrophobicContact CB-CD1 4.14Å; K340-L377 HydrophobicContact CG-CD1 4.31Å; Y341-L377 HydrophobicContact CD2-CD2 3.82Å; Y341-L377 HydrophobicContact CG-CD2 4.45Å; L358-L377 HydrophobicContact CD1-CD2 3.83Å; L358-L377 HydrophobicContact CD1-CG 4.09Å; V374-L377 HydrophobicContact CG1-CB 4.31Å; V374-L377 HydrophobicContact CG1-CD1 4.13Å; L377-N609 CarbonylContact O-C 3.34Å; L377-N609 WeakPolarHBondContact O-CA 3.38Å; L377-W610 HydrophobicContact CB-CE3 4.03Å; L377-W610 PolarHBondContact N-O 3.2Å; L377-W610 PolarHBondContact O-N 3.17Å
378	S	96.9	Very high	93.2	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.4	166.6	175.2	59	0	0	0	0	114.6	A359 A401 T404 A405 I608	A359-S378 PolarHBondContact N-O 3.43Å; A359-S378 PolarHBondContact O-N 2.87Å; A359-S378 VanDerWaalsContact O-O 3.12Å; S378-A401 PolarHBondContact OG-O 2.84Å; S378-T404 VanDerWaalsContact CB-OG1 3.26Å; S378-T404 WeakPolarHBondContact CB-OG1 3.41Å; S378-T404 PolarHBondContact OG-OG1 2.78Å; S378-T404 VanDerWaalsContact OG-OG1 3.06Å; S378-A405 WeakPolarHBondContact OG-CA 3.41Å; S378-A405 WeakPolarHBondContact OG-CB 3.44Å; S378-A405 PolarHBondContact OG-N 2.82Å; S378-I608 CarbonylContact C-O 3.57Å; S378-I608 WeakPolarHBondContact CA-O 3.23Å; S378-I608 WeakPolarHBondContact CB-O 3.45Å
379	T	95.3	Very high	93.4	Very high	4 Å²	4	40.6 Å²	40.6	3%	0.025	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	169.6	174.2	64.4	0	0	0	0	111.2	Y341 H355 S357 L358 S607 I608	Y341-T379 HydrophobicContact CD2-CG2 4.28Å; Y341-T379 HydrophobicContact CE2-CG2 3.67Å; H355-T379 HydrophobicContact CB-CG2 3.76Å; S357-T379 VanDerWaalsContact O-CA 3.25Å; S357-T379 WeakPolarHBondContact O-CA 3.46Å; S357-T379 VanDerWaalsContact O-CB 3.31Å; S357-T379 WeakPolarHBondContact O-CB 3.43Å; L358-T379 HydrophobicContact CB-CG2 4.45Å; L358-T379 HydrophobicContact CD1-CG2 4.11Å; T379-S607 WeakPolarHBondContact O-CA 3.49Å; T379-S607 WeakPolarHBondContact O-CB 3.39Å; T379-S607 PolarHBondContact O-OG 3.09Å; T379-I608 PolarHBondContact N-O 3.4Å; T379-I608 WeakPolarHBondContact OG1-CB 3.39Å; T379-I608 PolarHBondContact OG1-N 3.36Å
380	G	92.4	Very high	93.7	Very high	6 Å²	6	38.2 Å²	38.2	6%	0.062	18%	0.175	C	C	.	.			trans	126.8	158.8	168.7	0	0	0	0	0	114.4	S357 C399 H400 A401	S357-G380 PolarHBondContact O-N 3.05Å; G380-C399 CarbonylContact C-O 3.48Å; G380-C399 VanDerWaalsContact C-O 3.24Å; G380-C399 VanDerWaalsContact CA-O 3.29Å; G380-C399 WeakPolarHBondContact CA-O 3.25Å; G380-H400 WeakPolarHBondContact O-CA 3.48Å; G380-A401 PolarHBondContact O-N 3.02Å
381	T	91.9	Very high	94	Very high	10 Å²	10	31.6 Å²	31.6	6%	0.061	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	17.7	-170.9	57.8	0	0	0	0	114.1	K356 S357 H400	K356-T381 HydrophobicContact CB-CG2 4.07Å; K356-T381 HydrophobicContact CG-CG2 4.43Å; S357-T381 VanDerWaalsContact CB-CG2 3.46Å; T381-H400 VanDerWaalsContact C-CD2 3.47Å; T381-H400 PolarHBondContact O-NE2 2.78Å
382	K	92.6	Very high	94.4	Very high	46 Å²	46	29.8 Å²	29.8	20%	0.2	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	162.3	-174.1	-70.7	-166.2	175.3	-161	0	112.6	C399 H400 C605 T622	K382-C399 CarbonylContact O-C 3.58Å; K382-C399 VanDerWaalsContact O-C 3.28Å; K382-C399 VanDerWaalsContact O-CA 3.31Å; K382-C399 WeakPolarHBondContact O-CA 3.4Å; K382-C399 WeakPolarHBondContact O-CB 3.29Å; K382-C399 PolarHBondContact O-N 3.37Å; K382-H400 PolarHBondContact N-CD2 3Å; K382-C605 PolarHBondContact NZ-SG 2.83Å; K382-C605 VanDerWaalsContact NZ-SG 3.39Å; K382-T622 HydrophobicContact CB-CG2 4.12Å
383	C	93.3	Very high	94.4	Very high	12 Å²	12	29 Å²	29	8%	0.081	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	169.3	167.9	-83.7	0	0	0	0	111.2	N397 K490 T622	C383-N397 WeakPolarHBondContact CB-O 3.45Å; C383-K490 VanDerWaalsContact SG-CD 3.55Å; C383-T622 CarbonylContact C-O 3.55Å; C383-T622 VanDerWaalsContact O-O 3.06Å
384	I	93.6	Very high	94.4	Very high	1 Å²	1	27.1 Å²	27.1	1%	0.005	13%	0.132	C	C	.	.			trans	-64.5	155.4	167.3	-154.3	176.2	0	0	0	110.4	Y388 V395 N397 L518 T622 A623	I384-Y388 WeakPolarHBondContact CD1-O 3.41Å; I384-V395 HydrophobicContact CD1-CB 3.65Å; I384-V395 HydrophobicContact CD1-CG1 4.3Å; I384-V395 HydrophobicContact CD1-CG2 3.44Å; I384-V395 VanDerWaalsContact CD1-CG2 3.44Å; I384-N397 HydrophobicContact CG2-CB 4.17Å; I384-N397 PolarHBondContact N-O 3.42Å; I384-N397 VanDerWaalsContact N-O 3.07Å; I384-L518 HydrophobicContact CG2-CD2 3.26Å; I384-T622 VanDerWaalsContact CA-O 3.29Å; I384-T622 WeakPolarHBondContact CA-O 3.36Å; I384-T622 PolarHBondContact N-O 3.17Å; I384-A623 WeakPolarHBondContact CA-O 3.5Å; I384-A623 WeakPolarHBondContact CG1-O 3.33Å
385	N	91.4	Very high	94.4	Very high	29 Å²	29	26.4 Å²	26.4	16%	0.155	13%	0.128	C	C	.	.			trans	-80.5	157.7	167	-60	2.7	0	0	0	110.6	E387 Y388 E492 A623	N385-E387 HydrophobicContact CB-CG 3.98Å; N385-E387 VanDerWaalsContact CB-OE1 3.22Å; N385-E387 WeakPolarHBondContact CB-OE1 3.29Å; N385-E387 PolarHBondContact ND2-OE1 3.11Å; N385-E387 PolarHBondContact O-N 3.13Å; N385-Y388 HydrophobicContact CB-CD2 4.06Å; N385-Y388 PolarHBondContact O-N 3.17Å; N385-E492 WeakPolarHBondContact CA-OE1 3.27Å; N385-A623 PolarHBondContact N-O 3.07Å
386	G	89.3	Confident	94.3	Very high	2 Å²	2	26.5 Å²	26.5	2%	0.021	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	-56.6	-46.6	177.1	0	0	0	0	0	113.3	Y388 L389 E492 I512	G386-Y388 PolarHBondContact O-N 2.88Å; G386-Y388 VanDerWaalsContact O-N 3.1Å; G386-L389 WeakPolarHBondContact O-CB 3.44Å; G386-L389 VanDerWaalsContact O-CG 3.28Å; G386-L389 WeakPolarHBondContact O-CG 3.31Å; G386-L389 PolarHBondContact O-N 3.22Å; G386-L389 VanDerWaalsContact O-N 3.1Å; G386-E492 PolarHBondContact N-OE1 3.37Å; G386-I512 VanDerWaalsContact CA-CG2 3.46Å
387	E	90.1	Very high	94.2	Very high	115 Å²	115	27.5 Å²	27.5	54%	0.537	13%	0.134	S	C	.	.	G	3₁₀ helix	trans	-54.6	-27.1	179.6	73.6	-158.3	138.6	0	0	114.7	N385	N385-E387 HydrophobicContact CB-CG 3.98Å; N385-E387 VanDerWaalsContact CB-OE1 3.22Å; N385-E387 WeakPolarHBondContact CB-OE1 3.29Å; N385-E387 PolarHBondContact ND2-OE1 3.11Å; N385-E387 PolarHBondContact O-N 3.13Å
388	Y	92.8	Very high	94.2	Very high	104 Å²	104	27.8 Å²	27.8	41%	0.408	14%	0.135	S	C	.	.	G	3₁₀ helix	trans	-102.6	15.9	-177.3	-60.1	-56.9	0	0	0	113.4	I384 N385 G386 A623 T624	I384-Y388 WeakPolarHBondContact CD1-O 3.41Å; N385-Y388 HydrophobicContact CB-CD2 4.06Å; N385-Y388 PolarHBondContact O-N 3.17Å; G386-Y388 PolarHBondContact O-N 2.88Å; G386-Y388 VanDerWaalsContact O-N 3.1Å; Y388-A623 VanDerWaalsContact CD2-O 3.29Å; Y388-A623 WeakPolarHBondContact CD2-O 3.5Å; Y388-T624 HydrophobicContact CD1-CG2 4.18Å; Y388-T624 HydrophobicContact CD2-CG2 3.84Å; Y388-T624 HydrophobicContact CE1-CG2 4.18Å; Y388-T624 HydrophobicContact CE2-CG2 3.81Å; Y388-T624 HydrophobicContact CG-CG2 4.02Å
389	L	93.4	Very high	94.2	Very high	17 Å²	17	27.8 Å²	27.8	9%	0.089	14%	0.135	C	C	.	.			trans	-57	148.3	170.3	-77.6	174.2	0	0	0	111.4	G386 N397 W509 I512 L518 Q702	G386-L389 WeakPolarHBondContact O-CB 3.44Å; G386-L389 VanDerWaalsContact O-CG 3.28Å; G386-L389 WeakPolarHBondContact O-CG 3.31Å; G386-L389 PolarHBondContact O-N 3.22Å; G386-L389 VanDerWaalsContact O-N 3.1Å; L389-N397 WeakPolarHBondContact CD2-ND2 3.23Å; L389-W509 HydrophobicContact CB-CH2 3.58Å; L389-W509 HydrophobicContact CB-CZ2 4.46Å; L389-W509 HydrophobicContact CB-CZ3 3.7Å; L389-W509 HydrophobicContact CD1-CE3 4.29Å; L389-W509 HydrophobicContact CD1-CZ3 4.01Å; L389-W509 HydrophobicContact CG-CZ3 4.4Å; L389-I512 HydrophobicContact CD1-CB 4.33Å; L389-I512 HydrophobicContact CD1-CD1 4.3Å; L389-I512 HydrophobicContact CD1-CG2 3.67Å; L389-L518 HydrophobicContact CD1-CD1 3.81Å; L389-L518 HydrophobicContact CD2-CD1 3.95Å; L389-L518 HydrophobicContact CD2-CD2 4.03Å; L389-L518 HydrophobicContact CG-CD1 4.16Å; L389-L518 HydrophobicContact CG-CD2 4.34Å; L389-Q702 VanDerWaalsContact CD2-NE2 3.32Å
390	S	94.5	Very high	94.2	Very high	7 Å²	7	28 Å²	28	5%	0.049	14%	0.136	C	C	.	.			trans	-126.5	130.3	170.4	170.7	0	0	0	0	110.5	Q392 G393 Q394 Q702	S390-Q392 PolarHBondContact OG-N 3.24Å; S390-G393 PolarHBondContact OG-N 2.86Å; S390-Q394 PolarHBondContact OG-N 2.97Å; S390-Q702 WeakPolarHBondContact O-CG 3.49Å; S390-Q702 PolarHBondContact O-NE2 3.26Å
391	D	94.4	Very high	94.4	Very high	67 Å²	67	27.7 Å²	27.7	36%	0.358	13%	0.133	S	C	.	.	S	Bend	trans	-59.9	-55.1	163	60.2	-33.3	0	0	0	110.9	G393 W509 F705	D391-G393 PolarHBondContact O-N 2.99Å; D391-W509 HydrophobicContact CB-CH2 4.27Å; D391-W509 HydrophobicContact CB-CZ2 4.38Å; D391-F705 WeakPolarHBondContact O-CD1 3.47Å
392	Q	95.3	Very high	94.6	Very high	73 Å²	73	27.2 Å²	27.2	34%	0.341	13%	0.13	S	C	.	.	S	Bend	trans	-66.7	10.1	179.5	-56.4	-50.2	-46.2	0	0	114.8	S390 Q394 H639	S390-Q392 PolarHBondContact OG-N 3.24Å; Q392-Q394 HydrophobicContact CB-CG 4.17Å; Q392-Q394 PolarHBondContact O-N 3.12Å; Q392-Q394 VanDerWaalsContact O-N 3.14Å; Q392-H639 PolarHBondContact O-ND1 3.4Å; Q392-H639 VanDerWaalsContact O-ND1 3.09Å
393	G	95.9	Very high	94.9	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.123	C	C	.	.	S	Bend	trans	68	12.6	173.7	0	0	0	0	0	115.6	S390 D391 V395 K638 H639	S390-G393 PolarHBondContact OG-N 2.86Å; D391-G393 PolarHBondContact O-N 2.99Å; G393-V395 VanDerWaalsContact C-N 3.31Å; G393-V395 PolarHBondContact O-N 2.9Å; G393-K638 WeakPolarHBondContact O-CA 3.42Å; G393-K638 WeakPolarHBondContact O-CB 3.41Å; G393-K638 PolarHBondContact O-N 2.86Å; G393-H639 PolarHBondContact O-N 2.59Å
394	Q	96.9	Very high	95.1	Very high	59 Å²	59	24.9 Å²	24.9	28%	0.276	12%	0.119	S	C	.	.			trans	-74.6	-13.3	-169.1	-69.3	-171.6	2.9	0	0	115	S390 Q392 P633 C637	S390-Q394 PolarHBondContact OG-N 2.97Å; Q392-Q394 HydrophobicContact CB-CG 4.17Å; Q392-Q394 PolarHBondContact O-N 3.12Å; Q392-Q394 VanDerWaalsContact O-N 3.14Å; Q394-P633 HydrophobicContact CB-CB 4.19Å; Q394-P633 HydrophobicContact CB-CG 3.99Å; Q394-P633 HydrophobicContact CG-CG 4.02Å; Q394-C637 WeakPolarHBondContact O-CB 3.4Å
395	V	97.3	Very high	95.4	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.006	12%	0.119	C	C	.	.	S	Bend	trans	-110.3	157.9	-172.4	-53.9	0	0	0	0	113.8	I384 G393 R626	I384-V395 HydrophobicContact CD1-CB 3.65Å; I384-V395 HydrophobicContact CD1-CG1 4.3Å; I384-V395 HydrophobicContact CD1-CG2 3.44Å; I384-V395 VanDerWaalsContact CD1-CG2 3.44Å; G393-V395 VanDerWaalsContact C-N 3.31Å; G393-V395 PolarHBondContact O-N 2.9Å; V395-R626 HydrophobicContact CG1-CG 4Å
396	V	97.7	Very high	95.7	Very high	2 Å²	2	25 Å²	25	1%	0.012	12%	0.117	C	C	.	.			trans	-101.4	95.6	176.8	-174.8	0	0	0	0	110.3	D398 T404 G625 I636 C637	V396-D398 PolarHBondContact O-N 2.78Å; V396-D398 VanDerWaalsContact O-N 3.12Å; V396-T404 HydrophobicContact CG1-CG2 4.35Å; V396-G625 PolarHBondContact N-O 3.38Å; V396-I636 HydrophobicContact CG1-CD1 4.39Å; V396-I636 HydrophobicContact CG2-CG1 4.07Å; V396-C637 HydrophobicContact CG2-CB 4.35Å
397	N	96.1	Very high	96.2	Very high	20 Å²	20	26.7 Å²	26.7	11%	0.107	12%	0.123	C	C	.	.	S	Bend	trans	-58.9	-27.2	-174.6	-55.4	82.1	0	0	0	115.8	C383 I384 L389 K638 Q702	C383-N397 WeakPolarHBondContact CB-O 3.45Å; I384-N397 HydrophobicContact CG2-CB 4.17Å; I384-N397 PolarHBondContact N-O 3.42Å; I384-N397 VanDerWaalsContact N-O 3.07Å; L389-N397 WeakPolarHBondContact CD2-ND2 3.23Å; N397-K638 PolarHBondContact OD1-NZ 2.77Å; N397-Q702 PolarHBondContact ND2-OE1 2.85Å; N397-Q702 PolarHBondContact OD1-OE1 3.38Å
398	D	96.9	Very high	96.6	Very high	9 Å²	9	21.2 Å²	21.2	5%	0.048	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	110.7	-172.6	-173.4	-10.8	0	0	0	109.2	V396 H400 V403 K490 T520 K526	V396-D398 PolarHBondContact O-N 2.78Å; V396-D398 VanDerWaalsContact O-N 3.12Å; D398-H400 WeakPolarHBondContact OD1-CB 3.35Å; D398-H400 IonicContact OD1-CD2 3.42Å; D398-H400 PolarHBondContact OD1-CD2 3.35Å; D398-H400 IonicContact OD1-CG 3.58Å; D398-H400 PolarHBondContact OD1-N 3.39Å; D398-H400 VanDerWaalsContact OD1-N 3.11Å; D398-V403 HydrophobicContact CB-CG1 4.12Å; D398-K490 IonicContact OD1-NZ 3.61Å; D398-K490 PolarHBondContact OD1-NZ 2.86Å; D398-K490 WeakPolarHBondContact OD2-CE 3.44Å; D398-K490 IonicContact OD2-NZ 3.56Å; D398-K490 PolarHBondContact OD2-NZ 3.24Å; D398-T520 HydrophobicContact CB-CG2 4.43Å; D398-K526 IonicContact OD2-NZ 2.95Å; D398-K526 PolarHBondContact OD2-NZ 3.33Å
399	C	96.4	Very high	96.9	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	28.9	-174.7	-71.7	0	0	0	0	111.4	G380 K382 T622	G380-C399 CarbonylContact C-O 3.48Å; G380-C399 VanDerWaalsContact C-O 3.24Å; G380-C399 VanDerWaalsContact CA-O 3.29Å; G380-C399 WeakPolarHBondContact CA-O 3.25Å; K382-C399 CarbonylContact O-C 3.58Å; K382-C399 VanDerWaalsContact O-C 3.28Å; K382-C399 VanDerWaalsContact O-CA 3.31Å; K382-C399 WeakPolarHBondContact O-CA 3.4Å; K382-C399 WeakPolarHBondContact O-CB 3.29Å; K382-C399 PolarHBondContact O-N 3.37Å; C399-T622 HydrophobicContact CB-CG2 3.59Å
400	H	96.2	Very high	97.1	Very high	7 Å²	7	16 Å²	16	3%	0.032	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	136.7	163.4	-79.5	-130.1	0	0	0	110.9	G380 T381 K382 D398 E402 V403 T404 C458 K490	G380-H400 WeakPolarHBondContact O-CA 3.48Å; T381-H400 VanDerWaalsContact C-CD2 3.47Å; T381-H400 PolarHBondContact O-NE2 2.78Å; K382-H400 PolarHBondContact N-CD2 3Å; D398-H400 WeakPolarHBondContact OD1-CB 3.35Å; D398-H400 IonicContact OD1-CD2 3.42Å; D398-H400 PolarHBondContact OD1-CD2 3.35Å; D398-H400 IonicContact OD1-CG 3.58Å; D398-H400 PolarHBondContact OD1-N 3.39Å; D398-H400 VanDerWaalsContact OD1-N 3.11Å; H400-E402 IonicContact ND1-OE1 3.03Å; H400-E402 PolarHBondContact O-N 2.86Å; H400-V403 HydrophobicContact CB-CG2 4.31Å; H400-V403 WeakPolarHBondContact O-CA 3.31Å; H400-V403 WeakPolarHBondContact O-CB 3.37Å; H400-V403 PolarHBondContact O-N 3.36Å; H400-T404 PolarHBondContact O-N 3.1Å; H400-T404 PolarHBondContact O-OG1 3.38Å; H400-T404 VanDerWaalsContact O-OG1 3.13Å; H400-C458 VanDerWaalsContact CE1-SG 3.55Å; H400-K490 PolarHBondContact CD2-NZ 3.08Å; H400-K490 PolarHBondContact CE1-NZ 3.03Å; H400-K490 PolarHBondContact ND1-NZ 3.42Å; H400-K490 PolarHBondContact NE2-NZ 3.22Å; H400-K490 VanDerWaalsContact NE2-NZ 3.17Å
401	A	96.3	Very high	97.3	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-47	-52.2	-178.2	0	0	0	0	0	113.2	A359 S378 G380 V403 T404 A405	A359-A401 HydrophobicContact CB-CB 3.66Å; S378-A401 PolarHBondContact OG-O 2.84Å; G380-A401 PolarHBondContact O-N 3.02Å; A401-V403 PolarHBondContact O-N 3.27Å; A401-V403 VanDerWaalsContact O-N 3.11Å; A401-T404 WeakPolarHBondContact CA-OG1 3.39Å; A401-T404 PolarHBondContact O-N 2.93Å; A401-T404 PolarHBondContact O-OG1 3.43Å; A401-A405 VanDerWaalsContact O-CB 3.23Å; A401-A405 WeakPolarHBondContact O-CB 3.29Å; A401-A405 PolarHBondContact O-N 2.99Å
402	E	96.8	Very high	97.5	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-63.4	-22.1	-178.5	62	-87.6	-150	0	0	113.6	A359 H400 M451 I453 C523 W530	A359-E402 HydrophobicContact CB-CB 4.35Å; H400-E402 IonicContact ND1-OE1 3.03Å; H400-E402 PolarHBondContact O-N 2.86Å; E402-M451 HydrophobicContact CB-SD 4.39Å; E402-I453 HydrophobicContact CB-CD1 3.88Å; E402-I453 HydrophobicContact CB-CG1 4.24Å; E402-I453 HydrophobicContact CB-CG2 4.29Å; E402-I453 HydrophobicContact CG-CD1 4.47Å; E402-C523 VanDerWaalsContact CD-SG 3.55Å; E402-C523 HydrophobicContact CG-CB 3.68Å; E402-C523 WeakPolarHBondContact OE1-CB 3.47Å; E402-C523 PolarHBondContact OE1-SG 2.72Å; E402-W530 VanDerWaalsContact O-CH2 3.3Å; E402-W530 WeakPolarHBondContact O-CH2 3.45Å
403	V	98.3	Very high	97.6	Very high	10 Å²	10	11.1 Å²	11.1	6%	0.061	5%	0.049	C	C	.	.	H	α-helix	trans	-88	-41.3	175.9	-178.5	0	0	0	0	111.7	D398 H400 A401 R406 R407 K526 W530	D398-V403 HydrophobicContact CB-CG1 4.12Å; H400-V403 HydrophobicContact CB-CG2 4.31Å; H400-V403 WeakPolarHBondContact O-CA 3.31Å; H400-V403 WeakPolarHBondContact O-CB 3.37Å; H400-V403 PolarHBondContact O-N 3.36Å; A401-V403 PolarHBondContact O-N 3.27Å; A401-V403 VanDerWaalsContact O-N 3.11Å; V403-R406 PolarHBondContact O-N 2.93Å; V403-R407 WeakPolarHBondContact O-CG 3.29Å; V403-R407 PolarHBondContact O-N 3.09Å; V403-K526 HydrophobicContact CG2-CD 3.98Å; V403-W530 HydrophobicContact CG2-CH2 4.23Å; V403-W530 HydrophobicContact CG2-CZ2 4.49Å
404	T	98.2	Very high	97.7	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-72.1	-35.6	177.9	45.6	0	0	0	0	111.9	S378 V396 H400 A401 R406 R407 A408 I636	S378-T404 VanDerWaalsContact CB-OG1 3.26Å; S378-T404 WeakPolarHBondContact CB-OG1 3.41Å; S378-T404 PolarHBondContact OG-OG1 2.78Å; S378-T404 VanDerWaalsContact OG-OG1 3.06Å; V396-T404 HydrophobicContact CG1-CG2 4.35Å; H400-T404 PolarHBondContact O-N 3.1Å; H400-T404 PolarHBondContact O-OG1 3.38Å; H400-T404 VanDerWaalsContact O-OG1 3.13Å; A401-T404 WeakPolarHBondContact CA-OG1 3.39Å; A401-T404 PolarHBondContact O-N 2.93Å; A401-T404 PolarHBondContact O-OG1 3.43Å; T404-R406 VanDerWaalsContact C-N 3.32Å; T404-R406 PolarHBondContact O-N 3.48Å; T404-R407 WeakPolarHBondContact O-CA 3.05Å; T404-R407 PolarHBondContact O-N 3.1Å; T404-A408 PolarHBondContact O-N 3.42Å; T404-I636 HydrophobicContact CG2-CD1 3.77Å
405	A	98.6	Very high	97.7	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-56.4	-42.7	172	0	0	0	0	0	112.1	A359 I361 A376 S378 A401 R407 A408 L409	A359-A405 HydrophobicContact CB-CB 4.12Å; I361-A405 HydrophobicContact CD1-CB 4.22Å; I361-A405 HydrophobicContact CG1-CB 4.34Å; A376-A405 WeakPolarHBondContact CB-O 3.2Å; S378-A405 WeakPolarHBondContact OG-CA 3.41Å; S378-A405 WeakPolarHBondContact OG-CB 3.44Å; S378-A405 PolarHBondContact OG-N 2.82Å; A401-A405 VanDerWaalsContact O-CB 3.23Å; A401-A405 WeakPolarHBondContact O-CB 3.29Å; A401-A405 PolarHBondContact O-N 2.99Å; A405-R407 VanDerWaalsContact C-N 3.33Å; A405-R407 PolarHBondContact O-N 2.89Å; A405-A408 PolarHBondContact O-N 3.46Å; A405-L409 PolarHBondContact O-N 3.47Å
406	R	98.8	Very high	97.7	Very high	31 Å²	31	11.9 Å²	11.9	12%	0.117	6%	0.058	C	C	.	.	H	α-helix	trans	-67.3	-32.2	174.6	-167.8	-164.2	65.9	99.6	13.3	112.4	V403 T404 L409 I410 W530 L535	V403-R406 PolarHBondContact O-N 2.93Å; T404-R406 VanDerWaalsContact C-N 3.32Å; T404-R406 PolarHBondContact O-N 3.48Å; R406-L409 PolarHBondContact O-N 3Å; R406-I410 WeakPolarHBondContact O-CG1 3.38Å; R406-I410 PolarHBondContact O-N 2.96Å; R406-W530 HydrophobicContact CB-CH2 4.34Å; R406-L535 HydrophobicContact CG-CB 4.26Å; R406-L535 HydrophobicContact CG-CD2 3.96Å; R406-L535 PolarHBondContact NH1-O 3.47Å
407	R	98.7	Very high	97.5	Very high	39 Å²	39	11.8 Å²	11.8	15%	0.147	6%	0.057	C	C	.	.	H	α-helix	trans	-72.3	-34	176.2	-62.4	-179.3	72.6	86.2	10.8	111.7	V403 T404 A405 I410 R411 I636 C637	V403-R407 WeakPolarHBondContact O-CG 3.29Å; V403-R407 PolarHBondContact O-N 3.09Å; T404-R407 WeakPolarHBondContact O-CA 3.05Å; T404-R407 PolarHBondContact O-N 3.1Å; A405-R407 VanDerWaalsContact C-N 3.33Å; A405-R407 PolarHBondContact O-N 2.89Å; R407-I410 PolarHBondContact O-N 3.47Å; R407-R411 PolarHBondContact O-N 2.77Å; R407-I636 HydrophobicContact CB-CB 3.97Å; R407-I636 HydrophobicContact CB-CD1 4.32Å; R407-I636 HydrophobicContact CB-CG2 4.21Å; R407-I636 PolarHBondContact NE-O 3.31Å; R407-I636 PolarHBondContact NH2-O 3.42Å; R407-C637 PolarHBondContact NH2-O 2.88Å
408	A	98.6	Very high	97.4	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-64.6	-45.1	166.6	0	0	0	0	0	111.6	A376 T404 A405 I410 R411 F412 T611	A376-A408 HydrophobicContact CB-CB 3.71Å; T404-A408 PolarHBondContact O-N 3.42Å; A405-A408 PolarHBondContact O-N 3.46Å; A408-I410 VanDerWaalsContact C-N 3.29Å; A408-I410 PolarHBondContact O-N 2.89Å; A408-R411 WeakPolarHBondContact O-CA 3.42Å; A408-R411 VanDerWaalsContact O-CB 3.31Å; A408-R411 WeakPolarHBondContact O-CB 3.45Å; A408-R411 PolarHBondContact O-N 3.34Å; A408-F412 PolarHBondContact O-N 3.01Å; A408-T611 WeakPolarHBondContact CB-OG1 3.3Å; A408-T611 VanDerWaalsContact O-CG2 3.23Å; A408-T611 WeakPolarHBondContact O-CG2 3.4Å
409	L	98.8	Very high	97.2	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-57	-40	172.9	179.9	70.6	0	0	0	112.1	I361 V375 A376 A405 R406 R411 F412 L413 F449 L535	I361-L409 HydrophobicContact CD1-CB 3.89Å; I361-L409 HydrophobicContact CD1-CD2 3.97Å; I361-L409 HydrophobicContact CD1-CG 4.46Å; I361-L409 HydrophobicContact CG2-CD1 4.33Å; I361-L409 HydrophobicContact CG2-CD2 4.39Å; V375-L409 HydrophobicContact CG2-CD1 3.89Å; A376-L409 HydrophobicContact CB-CB 4.23Å; A405-L409 PolarHBondContact O-N 3.47Å; R406-L409 PolarHBondContact O-N 3Å; L409-R411 VanDerWaalsContact C-N 3.26Å; L409-R411 PolarHBondContact O-N 2.87Å; L409-F412 HydrophobicContact CD1-CD1 4.05Å; L409-F412 CarbonylContact O-C 3.28Å; L409-F412 WeakPolarHBondContact O-CA 3.39Å; L409-F412 WeakPolarHBondContact O-CB 3.18Å; L409-F412 PolarHBondContact O-N 2.88Å; L409-L413 HydrophobicContact CD1-CG 4.45Å; L409-L413 HydrophobicContact CG-CD1 4.31Å; L409-L413 HydrophobicContact CG-CG 4.24Å; L409-L413 WeakPolarHBondContact O-CG 3.22Å; L409-L413 PolarHBondContact O-N 3.11Å; L409-F449 HydrophobicContact CD1-CD1 4.09Å; L409-F449 HydrophobicContact CD1-CE1 3.83Å; L409-F449 HydrophobicContact CD1-CZ 4.22Å; L409-L535 HydrophobicContact CD2-CB 4.14Å; L409-L535 HydrophobicContact CD2-CD1 3.68Å; L409-L535 HydrophobicContact CD2-CG 4.44Å
410	I	98.6	Very high	97	Very high	11 Å²	11	15.7 Å²	15.7	6%	0.056	8%	0.075	C	C	.	.	H	α-helix	trans	-60.2	-36	174.4	-73	166.1	0	0	0	111.6	R406 R407 A408 Y414 L540 L641	R406-I410 WeakPolarHBondContact O-CG1 3.38Å; R406-I410 PolarHBondContact O-N 2.96Å; R407-I410 PolarHBondContact O-N 3.47Å; A408-I410 VanDerWaalsContact C-N 3.29Å; A408-I410 PolarHBondContact O-N 2.89Å; I410-Y414 HydrophobicContact CG2-CD2 3.82Å; I410-Y414 HydrophobicContact CG2-CE2 3.51Å; I410-Y414 WeakPolarHBondContact O-CD2 3.45Å; I410-Y414 PolarHBondContact O-N 2.97Å; I410-L540 HydrophobicContact CB-CD1 4.46Å; I410-L540 HydrophobicContact CG1-CD1 4.36Å; I410-L540 HydrophobicContact CG2-CD1 3.94Å; I410-L641 HydrophobicContact CG2-CD1 4.09Å; I410-L641 HydrophobicContact CG2-CD2 4.1Å
411	R	98.3	Very high	96.7	Very high	38 Å²	38	16.6 Å²	16.6	14%	0.143	8%	0.08	C	C	.	.	H	α-helix	trans	-64.9	-40.3	171.1	-66.6	179.2	65.6	-121.7	5.1	111.9	R407 A408 L409 Y414 S415 T611 D614 R635 I636 L641 R644	R407-R411 PolarHBondContact O-N 2.77Å; A408-R411 WeakPolarHBondContact O-CA 3.42Å; A408-R411 VanDerWaalsContact O-CB 3.31Å; A408-R411 WeakPolarHBondContact O-CB 3.45Å; A408-R411 PolarHBondContact O-N 3.34Å; L409-R411 VanDerWaalsContact C-N 3.26Å; L409-R411 PolarHBondContact O-N 2.87Å; R411-Y414 PolarHBondContact O-N 2.62Å; R411-S415 PolarHBondContact O-N 3.44Å; R411-S415 PolarHBondContact O-OG 2.94Å; R411-S415 VanDerWaalsContact O-OG 3.05Å; R411-T611 HydrophobicContact CB-CG2 4.14Å; R411-T611 VanDerWaalsContact NH1-CB 3.35Å; R411-T611 PolarHBondContact NH1-OG1 2.98Å; R411-D614 IonicContact CZ-OD1 3.37Å; R411-D614 VanDerWaalsContact CZ-OD1 3.29Å; R411-D614 IonicContact CZ-OD2 2.73Å; R411-D614 IonicContact NH1-OD1 2.73Å; R411-D614 PolarHBondContact NH1-OD1 3.32Å; R411-D614 IonicContact NH1-OD2 2.71Å; R411-D614 PolarHBondContact NH1-OD2 3.3Å; R411-D614 IonicContact NH2-OD1 3.94Å; R411-D614 PolarHBondContact NH2-OD1 2.95Å; R411-D614 IonicContact NH2-OD2 3.13Å; R411-R635 WeakPolarHBondContact CD-O 3.31Å; R411-I636 HydrophobicContact CG-CG2 4.36Å; R411-L641 HydrophobicContact CG-CD2 3.59Å; R411-R644 PolarHBondContact O-NH1 3.17Å
412	F	98.5	Very high	96.3	Very high	6 Å²	6	18.8 Å²	18.8	3%	0.026	10%	0.095	C	C	.	.	H	α-helix	trans	-62.8	-47.7	175.4	178.7	-110.8	0	0	0	111.7	M363 V375 A408 L409 Y414 S415 Q416 I432 F449 T611 L612	M363-F412 HydrophobicContact SD-CE1 4.05Å; M363-F412 HydrophobicContact SD-CZ 4Å; V375-F412 HydrophobicContact CB-CD1 3.89Å; V375-F412 HydrophobicContact CB-CD2 4.29Å; V375-F412 HydrophobicContact CB-CE1 3.95Å; V375-F412 HydrophobicContact CB-CE2 4.37Å; V375-F412 HydrophobicContact CB-CG 4.05Å; V375-F412 HydrophobicContact CB-CZ 4.2Å; V375-F412 HydrophobicContact CG1-CD1 4.1Å; V375-F412 HydrophobicContact CG1-CD2 4.41Å; V375-F412 HydrophobicContact CG1-CE1 3.62Å; V375-F412 HydrophobicContact CG1-CE2 3.99Å; V375-F412 HydrophobicContact CG1-CG 4.46Å; V375-F412 HydrophobicContact CG1-CZ 3.57Å; V375-F412 HydrophobicContact CG2-CD1 4.27Å; V375-F412 HydrophobicContact CG2-CE1 4.43Å; A408-F412 PolarHBondContact O-N 3.01Å; L409-F412 HydrophobicContact CD1-CD1 4.05Å; L409-F412 CarbonylContact O-C 3.28Å; L409-F412 WeakPolarHBondContact O-CA 3.39Å; L409-F412 WeakPolarHBondContact O-CB 3.18Å; L409-F412 PolarHBondContact O-N 2.88Å; F412-Y414 VanDerWaalsContact C-N 3.33Å; F412-Y414 PolarHBondContact O-N 2.99Å; F412-S415 WeakPolarHBondContact O-CB 3.18Å; F412-S415 PolarHBondContact O-N 2.87Å; F412-Q416 HydrophobicContact CD1-CG 4.22Å; F412-Q416 HydrophobicContact CD2-CG 4.16Å; F412-Q416 HydrophobicContact CE1-CG 3.86Å; F412-Q416 HydrophobicContact CE2-CG 3.76Å; F412-Q416 HydrophobicContact CG-CG 4.37Å; F412-Q416 HydrophobicContact CZ-CG 3.6Å; F412-Q416 WeakPolarHBondContact O-CG 3.33Å; F412-Q416 PolarHBondContact O-N 2.85Å; F412-I432 HydrophobicContact CD1-CD1 4.46Å; F412-I432 HydrophobicContact CE1-CD1 3.87Å; F412-F449 HydrophobicContact CD1-CE1 4.47Å; F412-F449 HydrophobicContact CE1-CE1 4.17Å; F412-F449 HydrophobicContact CE1-CZ 4.29Å; F412-T611 HydrophobicContact CB-CG2 3.7Å; F412-L612 HydrophobicContact CD2-CB 4.24Å; F412-L612 HydrophobicContact CE2-CB 4.35Å; F412-L612 HydrophobicContact CE2-CD2 4.01Å
413	L	98.3	Very high	95.6	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-59.9	-40.6	176.6	-63.4	177.7	0	0	0	111.8	L409 Q416 L417 I432 F433 F449 Q536 L540 V547	L409-L413 HydrophobicContact CD1-CG 4.45Å; L409-L413 HydrophobicContact CG-CD1 4.31Å; L409-L413 HydrophobicContact CG-CG 4.24Å; L409-L413 WeakPolarHBondContact O-CG 3.22Å; L409-L413 PolarHBondContact O-N 3.11Å; L413-Q416 PolarHBondContact O-N 2.75Å; L413-L417 PolarHBondContact O-N 3.02Å; L413-I432 HydrophobicContact CD2-CD1 3.81Å; L413-F433 HydrophobicContact CB-CZ 4.39Å; L413-F433 HydrophobicContact CD2-CE2 4.43Å; L413-F433 HydrophobicContact CD2-CZ 3.99Å; L413-F433 WeakPolarHBondContact O-CE2 3.24Å; L413-F449 HydrophobicContact CD2-CE2 4.27Å; L413-F449 HydrophobicContact CD2-CZ 4.12Å; L413-Q536 HydrophobicContact CD1-CB 4.19Å; L413-L540 HydrophobicContact CB-CD1 3.83Å; L413-L540 HydrophobicContact CD1-CD1 4.06Å; L413-V547 HydrophobicContact CD1-CG2 4.49Å
414	Y	97.7	Very high	95	Very high	4 Å²	4	36.5 Å²	36.5	2%	0.016	17%	0.167	C	C	.	.	H	α-helix	trans	-62.5	-42.3	171.2	-77.5	-51.9	0	0	0	112.3	I410 R411 F412 Q416 L417 E418 L540 L641 R644 W645 L648	I410-Y414 HydrophobicContact CG2-CD2 3.82Å; I410-Y414 HydrophobicContact CG2-CE2 3.51Å; I410-Y414 WeakPolarHBondContact O-CD2 3.45Å; I410-Y414 PolarHBondContact O-N 2.97Å; R411-Y414 PolarHBondContact O-N 2.62Å; F412-Y414 VanDerWaalsContact C-N 3.33Å; F412-Y414 PolarHBondContact O-N 2.99Å; Y414-Q416 VanDerWaalsContact C-N 3.34Å; Y414-Q416 PolarHBondContact O-N 2.95Å; Y414-L417 PolarHBondContact O-N 2.96Å; Y414-E418 WeakPolarHBondContact O-CB 3.38Å; Y414-E418 VanDerWaalsContact O-CG 3.23Å; Y414-E418 WeakPolarHBondContact O-CG 3.2Å; Y414-E418 PolarHBondContact O-N 3.46Å; Y414-L540 HydrophobicContact CD1-CD2 3.51Å; Y414-L540 HydrophobicContact CD1-CG 4.07Å; Y414-L540 HydrophobicContact CE1-CD1 4.4Å; Y414-L540 HydrophobicContact CE1-CD2 3.36Å; Y414-L540 HydrophobicContact CE1-CG 3.57Å; Y414-L540 HydrophobicContact CE2-CG 4.4Å; Y414-L540 HydrophobicContact CG-CD2 4.31Å; Y414-L641 HydrophobicContact CD2-CD2 4.44Å; Y414-L641 HydrophobicContact CE2-CB 4.39Å; Y414-L641 HydrophobicContact CE2-CD2 4.34Å; Y414-R644 HydrophobicContact CD2-CB 4.32Å; Y414-R644 HydrophobicContact CG-CB 4.37Å; Y414-W645 HydrophobicContact CE1-CB 4.25Å; Y414-W645 WeakPolarHBondContact OH-CB 3.44Å; Y414-L648 HydrophobicContact CD1-CD1 3.51Å; Y414-L648 HydrophobicContact CE1-CD1 4.14Å; Y414-L648 HydrophobicContact CG-CD1 4.45Å
415	S	96.6	Very high	94	Very high	46 Å²	46	43 Å²	43	32%	0.322	20%	0.201	S	C	.	.	H	α-helix	trans	-64.1	-40.2	178.2	-58.9	0	0	0	0	112	R411 F412 E418 L419 R644	R411-S415 PolarHBondContact O-N 3.44Å; R411-S415 PolarHBondContact O-OG 2.94Å; R411-S415 VanDerWaalsContact O-OG 3.05Å; F412-S415 WeakPolarHBondContact O-CB 3.18Å; F412-S415 PolarHBondContact O-N 2.87Å; S415-E418 PolarHBondContact O-N 2.74Å; S415-L419 VanDerWaalsContact O-CB 3.3Å; S415-L419 WeakPolarHBondContact O-CB 3.14Å; S415-L419 PolarHBondContact O-N 3.1Å; S415-R644 PolarHBondContact OG-NH1 2.93Å; S415-R644 PolarHBondContact OG-NH2 2.93Å
416	Q	96.7	Very high	93.3	Very high	26 Å²	26	49.5 Å²	49.5	12%	0.121	23%	0.231	C	C	.	.	H	α-helix	trans	-69	-34.7	179	-71.9	-72.1	-57.7	0	0	112.8	F412 L413 Y414 F420 S431 I432 F433	F412-Q416 HydrophobicContact CD1-CG 4.22Å; F412-Q416 HydrophobicContact CD2-CG 4.16Å; F412-Q416 HydrophobicContact CE1-CG 3.86Å; F412-Q416 HydrophobicContact CE2-CG 3.76Å; F412-Q416 HydrophobicContact CG-CG 4.37Å; F412-Q416 HydrophobicContact CZ-CG 3.6Å; F412-Q416 WeakPolarHBondContact O-CG 3.33Å; F412-Q416 PolarHBondContact O-N 2.85Å; L413-Q416 PolarHBondContact O-N 2.75Å; Y414-Q416 VanDerWaalsContact C-N 3.34Å; Y414-Q416 PolarHBondContact O-N 2.95Å; Q416-F420 PolarHBondContact O-N 3.17Å; Q416-S431 PolarHBondContact O-OG 3.28Å; Q416-I432 HydrophobicContact CB-CD1 3.99Å; Q416-I432 HydrophobicContact CB-CG1 3.79Å; Q416-I432 HydrophobicContact CG-CD1 3.85Å; Q416-I432 HydrophobicContact CG-CG1 3.88Å; Q416-F433 HydrophobicContact CB-CD2 3.94Å; Q416-F433 HydrophobicContact CB-CE2 3.89Å
417	L	94.2	Very high	92.7	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-73.7	-36	172.1	-177.4	59.5	0	0	0	112	L413 Y414 L419 F420 L421 F433 Y441 F543 V544 L648	L413-L417 PolarHBondContact O-N 3.02Å; Y414-L417 PolarHBondContact O-N 2.96Å; L417-L419 VanDerWaalsContact C-N 3.32Å; L417-F420 PolarHBondContact O-N 2.94Å; L417-L421 HydrophobicContact CD1-CD1 4.09Å; L417-L421 HydrophobicContact CD1-CG 4.36Å; L417-L421 HydrophobicContact CG-CD1 4.08Å; L417-L421 WeakPolarHBondContact O-CB 3.43Å; L417-L421 VanDerWaalsContact O-CG 3.24Å; L417-L421 WeakPolarHBondContact O-CG 3.21Å; L417-L421 PolarHBondContact O-N 2.93Å; L417-L421 VanDerWaalsContact O-N 3.08Å; L417-F433 HydrophobicContact CB-CD2 4.24Å; L417-F433 HydrophobicContact CB-CE2 4.18Å; L417-Y441 HydrophobicContact CD1-CD1 4.29Å; L417-Y441 HydrophobicContact CD1-CD2 3.63Å; L417-Y441 HydrophobicContact CD1-CE2 3.96Å; L417-Y441 HydrophobicContact CD1-CG 3.84Å; L417-F543 HydrophobicContact CD2-CB 3.72Å; L417-F543 HydrophobicContact CD2-CD2 3.81Å; L417-F543 HydrophobicContact CD2-CG 4.06Å; L417-V544 HydrophobicContact CD2-CG1 4.12Å; L417-L648 HydrophobicContact CD2-CD1 4.25Å; L417-L648 HydrophobicContact CD2-CD2 4.49Å; L417-L648 HydrophobicContact CG-CD2 4.28Å
418	E	93.3	Very high	91.9	Very high	36 Å²	36	52.8 Å²	52.8	17%	0.168	25%	0.246	C	C	.	.	H	α-helix	trans	-64	-37.4	172.3	-73.4	170.6	171.7	0	0	112	Y414 S415 L421 S422 R644 R647 L648	Y414-E418 WeakPolarHBondContact O-CB 3.38Å; Y414-E418 VanDerWaalsContact O-CG 3.23Å; Y414-E418 WeakPolarHBondContact O-CG 3.2Å; Y414-E418 PolarHBondContact O-N 3.46Å; S415-E418 PolarHBondContact O-N 2.74Å; E418-L421 CarbonylContact O-C 3.6Å; E418-L421 PolarHBondContact O-N 3.36Å; E418-S422 PolarHBondContact O-N 2.89Å; E418-R644 VanDerWaalsContact CD-NH2 3.33Å; E418-R644 IonicContact OE1-CZ 3.47Å; E418-R644 IonicContact OE1-NE 2.92Å; E418-R644 PolarHBondContact OE1-NE 2.98Å; E418-R644 IonicContact OE1-NH2 3.65Å; E418-R644 IonicContact OE2-CZ 3.68Å; E418-R644 IonicContact OE2-NE 3.36Å; E418-R644 IonicContact OE2-NH2 2.68Å; E418-R644 PolarHBondContact OE2-NH2 3.26Å; E418-R647 IonicContact OE1-CZ 2.71Å; E418-R647 IonicContact OE1-NE 2.67Å; E418-R647 IonicContact OE1-NH2 3.24Å; E418-R647 PolarHBondContact OE1-NH2 2.56Å; E418-R647 IonicContact OE2-NH2 2.91Å; E418-R647 PolarHBondContact OE2-NH2 2.92Å; E418-L648 HydrophobicContact CG-CD1 4.05Å; E418-L648 HydrophobicContact CG-CD2 3.76Å; E418-L648 HydrophobicContact CG-CG 3.98Å
419	L	93.5	Very high	91.2	Very high	41 Å²	41	58.1 Å²	58.1	22%	0.215	27%	0.271	C	S	.	.	H	α-helix	trans	-66.2	-47.5	173.7	-170	73	0	0	0	111.6	S415 L417 L421 S422 D427 E430	S415-L419 VanDerWaalsContact O-CB 3.3Å; S415-L419 WeakPolarHBondContact O-CB 3.14Å; S415-L419 PolarHBondContact O-N 3.1Å; L417-L419 VanDerWaalsContact C-N 3.32Å; L419-L421 PolarHBondContact O-N 3.09Å; L419-S422 WeakPolarHBondContact O-CB 3.27Å; L419-S422 PolarHBondContact O-N 3.32Å; L419-D427 HydrophobicContact CD1-CB 3.66Å; L419-D427 HydrophobicContact CG-CB 3.9Å; L419-D427 WeakPolarHBondContact CG-O 3.26Å; L419-D427 WeakPolarHBondContact O-CB 3.45Å; L419-E430 HydrophobicContact CD2-CB 4.19Å
420	F	92.1	Very high	90.8	Very high	34 Å²	34	64.4 Å²	64.4	15%	0.149	30%	0.3	C	S	.	.	H	α-helix	trans	-58	-31.2	173.9	-170.8	-86.8	0	0	0	112.7	Q416 L417 S422 F433 R435 Y441	Q416-F420 PolarHBondContact O-N 3.17Å; L417-F420 PolarHBondContact O-N 2.94Å; F420-S422 VanDerWaalsContact C-N 3.33Å; F420-F433 HydrophobicContact CD2-CB 4.39Å; F420-F433 VanDerWaalsContact CD2-O 3.31Å; F420-F433 WeakPolarHBondContact CD2-O 3.2Å; F420-F433 WeakPolarHBondContact CE2-O 3.44Å; F420-R435 HydrophobicContact CE1-CB 4.49Å; F420-R435 HydrophobicContact CZ-CB 4.23Å; F420-Y441 AromaticContact CD1-CD1 3.96Å; F420-Y441 HydrophobicContact CD1-CD1 3.96Å; F420-Y441 AromaticContact CD1-CE1 3.74Å; F420-Y441 HydrophobicContact CD1-CE1 3.74Å; F420-Y441 AromaticContact CE1-CD1 3.87Å; F420-Y441 HydrophobicContact CE1-CD1 3.87Å; F420-Y441 AromaticContact CE1-CE1 3.57Å; F420-Y441 HydrophobicContact CE1-CE1 3.57Å
421	L	89.3	Confident	90.6	Very high	27 Å²	27	63.9 Å²	63.9	14%	0.141	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	15.7	178.5	-64	170.9	0	0	0	112.9	L417 E418 L419 L648 K651 L652	L417-L421 HydrophobicContact CD1-CD1 4.09Å; L417-L421 HydrophobicContact CD1-CG 4.36Å; L417-L421 HydrophobicContact CG-CD1 4.08Å; L417-L421 WeakPolarHBondContact O-CB 3.43Å; L417-L421 VanDerWaalsContact O-CG 3.24Å; L417-L421 WeakPolarHBondContact O-CG 3.21Å; L417-L421 PolarHBondContact O-N 2.93Å; L417-L421 VanDerWaalsContact O-N 3.08Å; E418-L421 CarbonylContact O-C 3.6Å; E418-L421 PolarHBondContact O-N 3.36Å; L419-L421 PolarHBondContact O-N 3.09Å; L421-L648 HydrophobicContact CD1-CD2 3.66Å; L421-K651 WeakPolarHBondContact O-CE 3.4Å; L421-K651 PolarHBondContact O-NZ 3.03Å; L421-L652 HydrophobicContact CD1-CD1 4.3Å; L421-L652 HydrophobicContact CD1-CD2 3.92Å; L421-L652 HydrophobicContact CD1-CG 4.19Å; L421-L652 HydrophobicContact CD2-CD2 3.98Å
422	S	88.9	Confident	90.5	Very high	46 Å²	46	62.1 Å²	62.1	32%	0.322	29%	0.291	S	S	.	.	S	Bend	trans	-63.9	171.1	173.5	-169.2	0	0	0	0	112.2	E418 L419 F420 R424 D427	E418-S422 PolarHBondContact O-N 2.89Å; L419-S422 WeakPolarHBondContact O-CB 3.27Å; L419-S422 PolarHBondContact O-N 3.32Å; F420-S422 VanDerWaalsContact C-N 3.33Å; S422-R424 PolarHBondContact OG-N 3.32Å; S422-D427 WeakPolarHBondContact CB-OD2 3.28Å; S422-D427 PolarHBondContact OG-OD2 2.71Å
423	K	82.7	Confident	90.3	Very high	215 Å²	215	61.8 Å²	61.8	94%	0.935	29%	0.29	S	S	*	.	S	Bend	trans	-87.6	-11.2	168.5	-72.4	-169.8	174.7	-172	0	112.8
424	R	85.4	Confident	90.1	Very high	167 Å²	167	63.6 Å²	63.6	63%	0.63	30%	0.301	S	S	*	.	S	Bend	trans	-90.1	139	-178.3	-67.5	179.8	174.9	-170.6	-4.5	110.8	S422 E426 D427	S422-R424 PolarHBondContact OG-N 3.32Å; R424-E426 PolarHBondContact O-N 3.13Å; R424-D427 HydrophobicContact CB-CB 4.37Å; R424-D427 WeakPolarHBondContact CB-OD1 3.32Å; R424-D427 WeakPolarHBondContact CD-OD1 3.44Å
425	L	77.2	Confident	89.8	Confident	135 Å²	135	70.7 Å²	70.7	71%	0.707	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	24.1	177.8	-153.8	114.8	0	0	0	112.8	W428	L425-W428 PolarHBondContact O-NE1 2.67Å
426	E	83.9	Confident	89.2	Confident	138 Å²	138	72.7 Å²	72.7	65%	0.645	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.3	-51.9	174.2	-67	161.7	176.4	0	0	108.3	R424 W428 E429 E430	R424-E426 PolarHBondContact O-N 3.13Å; E426-W428 PolarHBondContact O-N 3.14Å; E426-E429 WeakPolarHBondContact O-CB 3.28Å; E426-E429 PolarHBondContact O-N 3.18Å; E426-E430 PolarHBondContact O-N 2.94Å
427	D	85.1	Confident	88.4	Confident	29 Å²	29	78 Å²	78	16%	0.155	35%	0.354	C	S	.	.	H	α-helix	trans	-45.2	-38.5	172.9	-59.3	26.6	0	0	0	114.2	L419 S422 R424 E429 S431	L419-D427 HydrophobicContact CD1-CB 3.66Å; L419-D427 HydrophobicContact CG-CB 3.9Å; L419-D427 WeakPolarHBondContact CG-O 3.26Å; L419-D427 WeakPolarHBondContact O-CB 3.45Å; S422-D427 WeakPolarHBondContact CB-OD2 3.28Å; S422-D427 PolarHBondContact OG-OD2 2.71Å; R424-D427 HydrophobicContact CB-CB 4.37Å; R424-D427 WeakPolarHBondContact CB-OD1 3.32Å; R424-D427 WeakPolarHBondContact CD-OD1 3.44Å; D427-E429 VanDerWaalsContact C-N 3.31Å; D427-E429 PolarHBondContact O-N 3.17Å; D427-S431 PolarHBondContact O-N 2.76Å
428	W	82.2	Confident	87.2	Confident	109 Å²	109	85.9 Å²	85.9	41%	0.413	39%	0.391	S	S	.	.	H	α-helix	trans	-66.1	-30.6	178.8	83.5	-50	0	0	0	113.5	L425 E426 R444	L425-W428 PolarHBondContact O-NE1 2.67Å; E426-W428 PolarHBondContact O-N 3.14Å; W428-R444 PolarHBondContact O-NH2 2.84Å
429	E	84.4	Confident	86.1	Confident	112 Å²	112	87.8 Å²	87.8	52%	0.523	40%	0.4	S	S	.	.	H	α-helix	trans	-83.9	-37.6	-175.4	-104.7	168.5	-117.3	0	0	111.6	E426 D427 S431 R444	E426-E429 WeakPolarHBondContact O-CB 3.28Å; E426-E429 PolarHBondContact O-N 3.18Å; D427-E429 VanDerWaalsContact C-N 3.31Å; D427-E429 PolarHBondContact O-N 3.17Å; E429-S431 VanDerWaalsContact C-N 3.3Å; E429-S431 PolarHBondContact O-N 3.49Å; E429-R444 PolarHBondContact O-NH2 3.4Å
430	E	89.1	Confident	85.8	Confident	133 Å²	133	87.4 Å²	87.4	62%	0.621	40%	0.4	S	S	*	.	H	α-helix	trans	-62.2	-39.3	171	-64.8	-156.9	142.4	0	0	112	R365 L419 E426 I432	R365-E430 PolarHBondContact NH2-O 2.9Å; L419-E430 HydrophobicContact CD2-CB 4.19Å; E426-E430 PolarHBondContact O-N 2.94Å; E430-I432 PolarHBondContact O-N 2.81Å
431	S	94.7	Very high	85.8	Confident	0 Å²	0	86.2 Å²	86.2	0%	0	40%	0.395	C	S	.	.	S	Bend	trans	-58.2	134.4	-172.3	-176.6	0	0	0	0	113.3	Q416 D427 E429 F433 R444	Q416-S431 PolarHBondContact O-OG 3.28Å; D427-S431 PolarHBondContact O-N 2.76Å; E429-S431 VanDerWaalsContact C-N 3.3Å; E429-S431 PolarHBondContact O-N 3.49Å; S431-F433 PolarHBondContact O-N 3.47Å; S431-F433 VanDerWaalsContact O-N 3.1Å; S431-F433 PolarHBondContact OG-N 3.34Å; S431-R444 PolarHBondContact O-NE 3.45Å; S431-R444 PolarHBondContact O-NH2 3.37Å
432	I	96.2	Very high	86.1	Confident	0 Å²	0	88 Å²	88	0%	0	40%	0.4	C	S	.	.	S	Bend	trans	-63.5	-11	174.6	64.2	177.3	0	0	0	114.4	M363 F412 L413 Q416 E430 L443 R444 V447 F449	M363-I432 HydrophobicContact SD-CG2 3.53Å; M363-I432 VanDerWaalsContact SD-CG2 3.53Å; F412-I432 HydrophobicContact CD1-CD1 4.46Å; F412-I432 HydrophobicContact CE1-CD1 3.87Å; L413-I432 HydrophobicContact CD2-CD1 3.81Å; Q416-I432 HydrophobicContact CB-CD1 3.99Å; Q416-I432 HydrophobicContact CB-CG1 3.79Å; Q416-I432 HydrophobicContact CG-CD1 3.85Å; Q416-I432 HydrophobicContact CG-CG1 3.88Å; E430-I432 PolarHBondContact O-N 2.81Å; I432-L443 HydrophobicContact CB-CD1 3.92Å; I432-L443 HydrophobicContact CD1-CD1 3.77Å; I432-L443 HydrophobicContact CG1-CD1 3.92Å; I432-R444 WeakPolarHBondContact O-CG 3.33Å; I432-R444 PolarHBondContact O-N 3.23Å; I432-V447 HydrophobicContact CB-CG1 4.14Å; I432-V447 HydrophobicContact CB-CG2 4.16Å; I432-V447 HydrophobicContact CG2-CG1 3.94Å; I432-V447 HydrophobicContact CG2-CG2 4.07Å; I432-F449 HydrophobicContact CD1-CZ 3.86Å
433	F	95.6	Very high	86.4	Confident	0 Å²	0	87.5 Å²	87.5	0%	0	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	152	-179.7	-71.5	-70.1	0	0	0	112.1	L413 Q416 L417 F420 S431 R442 V544	L413-F433 HydrophobicContact CB-CZ 4.39Å; L413-F433 HydrophobicContact CD2-CE2 4.43Å; L413-F433 HydrophobicContact CD2-CZ 3.99Å; L413-F433 WeakPolarHBondContact O-CE2 3.24Å; Q416-F433 HydrophobicContact CB-CD2 3.94Å; Q416-F433 HydrophobicContact CB-CE2 3.89Å; L417-F433 HydrophobicContact CB-CD2 4.24Å; L417-F433 HydrophobicContact CB-CE2 4.18Å; F420-F433 HydrophobicContact CD2-CB 4.39Å; F420-F433 VanDerWaalsContact CD2-O 3.31Å; F420-F433 WeakPolarHBondContact CD2-O 3.2Å; F420-F433 WeakPolarHBondContact CE2-O 3.44Å; S431-F433 PolarHBondContact O-N 3.47Å; S431-F433 VanDerWaalsContact O-N 3.1Å; S431-F433 PolarHBondContact OG-N 3.34Å; F433-R442 WeakPolarHBondContact CA-O 3.48Å; F433-V544 HydrophobicContact CD1-CG1 4.27Å; F433-V544 HydrophobicContact CE1-CB 3.87Å; F433-V544 HydrophobicContact CE1-CG1 3.64Å; F433-V544 HydrophobicContact CE1-CG2 4.46Å; F433-V544 HydrophobicContact CZ-CB 4.34Å; F433-V544 HydrophobicContact CZ-CG1 3.81Å
434	V	93.8	Very high	87	Confident	38 Å²	38	80 Å²	80	23%	0.23	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	149.4	165.1	-75.4	0	0	0	0	109.4	H436 Y441 R442 R444	V434-H436 PolarHBondContact O-N 2.77Å; V434-Y441 CarbonylContact O-C 3.57Å; V434-Y441 WeakPolarHBondContact O-CA 3.48Å; V434-R442 HydrophobicContact CG2-CG 3.79Å; V434-R442 PolarHBondContact N-O 2.61Å; V434-R442 PolarHBondContact O-N 3.21Å; V434-R444 HydrophobicContact CG1-CG 3.68Å; V434-R444 HydrophobicContact CG2-CG 4.27Å
435	R	90.8	Very high	87.3	Confident	153 Å²	153	77.7 Å²	77.7	58%	0.577	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.1	127.8	176.2	-168.5	172.4	-179.1	166.8	-4.8	109.1	F420 K437 Y441	F420-R435 HydrophobicContact CE1-CB 4.49Å; F420-R435 HydrophobicContact CZ-CB 4.23Å; R435-K437 WeakPolarHBondContact CG-O 3.46Å; R435-Y441 HydrophobicContact CB-CD1 4.29Å; R435-Y441 HydrophobicContact CB-CE1 4.34Å; R435-Y441 HydrophobicContact CG-CE1 4.28Å
436	H	85	Confident	88.1	Confident	87 Å²	87	73.3 Å²	73.3	40%	0.403	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	-44.6	177.2	-175.5	-164.8	0	0	0	111.4	V434 C440 R442 E545	V434-H436 PolarHBondContact O-N 2.77Å; H436-C440 PolarHBondContact N-O 3.39Å; H436-R442 HydrophobicContact CB-CB 4.22Å; H436-R442 HydrophobicContact CB-CG 3.97Å; H436-E545 IonicContact CE1-OE1 3.78Å; H436-E545 PolarHBondContact CE1-OE1 2.87Å; H436-E545 IonicContact CG-OE1 3.52Å; H436-E545 IonicContact ND1-OE1 3.89Å; H436-E545 PolarHBondContact ND1-OE1 3.11Å; H436-E545 IonicContact ND1-OE2 2.87Å
437	K	79.4	Confident	88.7	Confident	137 Å²	137	67 Å²	67	60%	0.596	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.7	-177	176.5	-55.1	-171.8	178.3	-171.8	0	108.9	R435 Q439 C440	R435-K437 WeakPolarHBondContact CG-O 3.46Å; K437-Q439 PolarHBondContact O-N 2.73Å; K437-C440 HydrophobicContact CB-CB 4.06Å; K437-C440 PolarHBondContact N-O 2.75Å; K437-C440 VanDerWaalsContact N-O 3.13Å; K437-C440 PolarHBondContact O-N 2.61Å
438	E	68.5	Low	89.2	Confident	167 Å²	167	67.7 Å²	67.7	78%	0.78	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	125.9	169.5	-57	-156.5	125.8	0	0	110.4	C440	E438-C440 PolarHBondContact O-N 3.07Å
439	Q	70.7	Confident	90	Very high	75 Å²	75	62.5 Å²	62.5	35%	0.35	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.4	7.2	-176.9	-54.6	-174.8	3.2	0	0	116.6	K437 T656	K437-Q439 PolarHBondContact O-N 2.73Å; Q439-T656 PolarHBondContact NE2-OG1 2.71Å
440	C	86.8	Confident	90.7	Very high	34 Å²	34	57.2 Å²	57.2	23%	0.23	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	122.4	176.8	-169.5	0	0	0	0	111.2	H436 K437 E438 F543	H436-C440 PolarHBondContact N-O 3.39Å; K437-C440 HydrophobicContact CB-CB 4.06Å; K437-C440 PolarHBondContact N-O 2.75Å; K437-C440 VanDerWaalsContact N-O 3.13Å; K437-C440 PolarHBondContact O-N 2.61Å; E438-C440 PolarHBondContact O-N 3.07Å; C440-F543 WeakPolarHBondContact CA-O 3.44Å
441	Y	93.1	Very high	91.1	Very high	8 Å²	8	50.9 Å²	50.9	3%	0.031	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	139.8	-179.1	-51	-86.3	0	0	0	110.1	L417 F420 V434 R435 F543 V544 E545 L652	L417-Y441 HydrophobicContact CD1-CD1 4.29Å; L417-Y441 HydrophobicContact CD1-CD2 3.63Å; L417-Y441 HydrophobicContact CD1-CE2 3.96Å; L417-Y441 HydrophobicContact CD1-CG 3.84Å; F420-Y441 AromaticContact CD1-CD1 3.96Å; F420-Y441 HydrophobicContact CD1-CD1 3.96Å; F420-Y441 AromaticContact CD1-CE1 3.74Å; F420-Y441 HydrophobicContact CD1-CE1 3.74Å; F420-Y441 AromaticContact CE1-CD1 3.87Å; F420-Y441 HydrophobicContact CE1-CD1 3.87Å; F420-Y441 AromaticContact CE1-CE1 3.57Å; F420-Y441 HydrophobicContact CE1-CE1 3.57Å; V434-Y441 CarbonylContact O-C 3.57Å; V434-Y441 WeakPolarHBondContact O-CA 3.48Å; R435-Y441 HydrophobicContact CB-CD1 4.29Å; R435-Y441 HydrophobicContact CB-CE1 4.34Å; R435-Y441 HydrophobicContact CG-CE1 4.28Å; Y441-F543 HydrophobicContact CD2-CB 4.31Å; Y441-F543 WeakPolarHBondContact CD2-O 3.25Å; Y441-F543 PolarHBondContact N-O 3.23Å; Y441-V544 VanDerWaalsContact O-CA 3.24Å; Y441-V544 WeakPolarHBondContact O-CA 3.47Å; Y441-E545 PolarHBondContact O-N 3.41Å; Y441-L652 HydrophobicContact CE2-CD1 4.42Å
442	R	94.6	Very high	91.2	Very high	66 Å²	66	51.3 Å²	51.3	25%	0.249	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	156.2	173.6	71.6	-175.4	-167.5	87.3	-3	110.2	F433 V434 H436 D445 E545	F433-R442 WeakPolarHBondContact CA-O 3.48Å; V434-R442 HydrophobicContact CG2-CG 3.79Å; V434-R442 PolarHBondContact N-O 2.61Å; V434-R442 PolarHBondContact O-N 3.21Å; H436-R442 HydrophobicContact CB-CB 4.22Å; H436-R442 HydrophobicContact CB-CG 3.97Å; R442-D445 IonicContact CZ-OD1 3.11Å; R442-D445 IonicContact CZ-OD2 2.73Å; R442-D445 VanDerWaalsContact CZ-OD2 3.26Å; R442-D445 IonicContact NH1-OD1 2.7Å; R442-D445 PolarHBondContact NH1-OD1 3.45Å; R442-D445 IonicContact NH1-OD2 3.91Å; R442-D445 PolarHBondContact NH1-OD2 3.08Å; R442-D445 IonicContact NH2-OD1 3.13Å; R442-D445 IonicContact NH2-OD2 3.84Å; R442-D445 PolarHBondContact NH2-OD2 3.06Å; R442-E545 HydrophobicContact CB-CB 4.41Å; R442-E545 HydrophobicContact CB-CG 4.25Å; R442-E545 VanDerWaalsContact CB-OE2 3.29Å; R442-E545 WeakPolarHBondContact CB-OE2 3.33Å
443	L	95.6	Very high	91.1	Very high	35 Å²	35	51.3 Å²	51.3	18%	0.183	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	140.6	171.4	-166.5	67.5	0	0	0	108.8	I432 V447 F449 V547	I432-L443 HydrophobicContact CB-CD1 3.92Å; I432-L443 HydrophobicContact CD1-CD1 3.77Å; I432-L443 HydrophobicContact CG1-CD1 3.92Å; L443-V447 HydrophobicContact CD1-CB 4.1Å; L443-V447 HydrophobicContact CD1-CG1 3.89Å; L443-V447 HydrophobicContact CD2-CB 4.34Å; L443-V447 HydrophobicContact CD2-CG1 4.32Å; L443-V447 WeakPolarHBondContact CD2-O 3.44Å; L443-V447 HydrophobicContact CG-CB 4.01Å; L443-V447 HydrophobicContact CG-CG1 4.22Å; L443-F449 HydrophobicContact CD1-CE2 3.95Å; L443-F449 HydrophobicContact CD1-CZ 4.42Å; L443-F449 HydrophobicContact CD2-CD2 4.16Å; L443-F449 HydrophobicContact CD2-CE2 3.83Å; L443-V547 HydrophobicContact CD2-CG1 4.34Å
444	R	95.4	Very high	90.9	Very high	58 Å²	58	51.7 Å²	51.7	22%	0.219	24%	0.24	C	C	.	.			trans	-57.3	137.1	169.6	-73	178.5	-167.4	-124.5	0.8	109.4	W428 E429 S431 I432 V434 N446 V447	W428-R444 PolarHBondContact O-NH2 2.84Å; E429-R444 PolarHBondContact O-NH2 3.4Å; S431-R444 PolarHBondContact O-NE 3.45Å; S431-R444 PolarHBondContact O-NH2 3.37Å; I432-R444 WeakPolarHBondContact O-CG 3.33Å; I432-R444 PolarHBondContact O-N 3.23Å; V434-R444 HydrophobicContact CG1-CG 3.68Å; V434-R444 HydrophobicContact CG2-CG 4.27Å; R444-N446 PolarHBondContact O-N 3.31Å; R444-N446 VanDerWaalsContact O-N 3.09Å; R444-V447 HydrophobicContact CB-CG2 3.97Å; R444-V447 PolarHBondContact O-N 3.48Å
445	D	92.3	Very high	90.6	Very high	117 Å²	117	50.4 Å²	50.4	63%	0.626	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-25.3	-171.6	-61	-69.4	0	0	0	113.9	R442 H448	R442-D445 IonicContact CZ-OD1 3.11Å; R442-D445 IonicContact CZ-OD2 2.73Å; R442-D445 VanDerWaalsContact CZ-OD2 3.26Å; R442-D445 IonicContact NH1-OD1 2.7Å; R442-D445 PolarHBondContact NH1-OD1 3.45Å; R442-D445 IonicContact NH1-OD2 3.91Å; R442-D445 PolarHBondContact NH1-OD2 3.08Å; R442-D445 IonicContact NH2-OD1 3.13Å; R442-D445 IonicContact NH2-OD2 3.84Å; R442-D445 PolarHBondContact NH2-OD2 3.06Å; D445-H448 PolarHBondContact O-CE1 3.5Å; D445-H448 VanDerWaalsContact O-CE1 3.32Å
446	N	93.4	Very high	90.5	Very high	43 Å²	43	43.2 Å²	43.2	23%	0.23	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-14.5	175.7	68.4	-21.4	0	0	0	115	R365 D366 R444 H448	R365-N446 CarbonylContact C-O 3.57Å; R365-N446 WeakPolarHBondContact CA-O 3.41Å; D366-N446 VanDerWaalsContact CG-CB 3.43Å; D366-N446 PolarHBondContact N-O 3.07Å; D366-N446 WeakPolarHBondContact OD1-CB 3.35Å; D366-N446 VanDerWaalsContact OD2-CB 3.31Å; D366-N446 WeakPolarHBondContact OD2-CB 3.49Å; D366-N446 PolarHBondContact OD2-ND2 3.35Å; R444-N446 PolarHBondContact O-N 3.31Å; R444-N446 VanDerWaalsContact O-N 3.09Å; N446-H448 PolarHBondContact O-ND1 3.22Å
447	V	96.3	Very high	90.8	Very high	6 Å²	6	39 Å²	39	4%	0.036	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	119.6	-176.2	179	0	0	0	0	110.7	M363 T364 R365 I432 L443 R444 F449	M363-V447 HydrophobicContact CG-CG1 3.73Å; M363-V447 HydrophobicContact SD-CG1 3.96Å; T364-V447 WeakPolarHBondContact O-CA 3.26Å; R365-V447 HydrophobicContact CG-CG2 4.27Å; I432-V447 HydrophobicContact CB-CG1 4.14Å; I432-V447 HydrophobicContact CB-CG2 4.16Å; I432-V447 HydrophobicContact CG2-CG1 3.94Å; I432-V447 HydrophobicContact CG2-CG2 4.07Å; L443-V447 HydrophobicContact CD1-CB 4.1Å; L443-V447 HydrophobicContact CD1-CG1 3.89Å; L443-V447 HydrophobicContact CD2-CB 4.34Å; L443-V447 HydrophobicContact CD2-CG1 4.32Å; L443-V447 WeakPolarHBondContact CD2-O 3.44Å; L443-V447 HydrophobicContact CG-CB 4.01Å; L443-V447 HydrophobicContact CG-CG1 4.22Å; R444-V447 HydrophobicContact CB-CG2 3.97Å; R444-V447 PolarHBondContact O-N 3.48Å; V447-F449 HydrophobicContact CG1-CE2 4.44Å; V447-F449 HydrophobicContact CG1-CZ 4.26Å
448	H	96.4	Very high	91.4	Very high	43 Å²	43	32.6 Å²	32.6	20%	0.199	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	144.2	-176.9	-65.5	77.5	0	0	0	111.4	M363 T364 L367 D445 N446 H450 Q550	M363-H448 CarbonylContact C-O 3.49Å; M363-H448 VanDerWaalsContact CA-O 3.32Å; M363-H448 WeakPolarHBondContact CA-O 3.44Å; T364-H448 PolarHBondContact N-O 3.33Å; T364-H448 PolarHBondContact O-N 3.27Å; L367-H448 HydrophobicContact CD2-CB 3.89Å; D445-H448 PolarHBondContact O-CE1 3.5Å; D445-H448 VanDerWaalsContact O-CE1 3.32Å; N446-H448 PolarHBondContact O-ND1 3.22Å; H448-H450 WeakPolarHBondContact CB-NE2 3.5Å; H448-Q550 HydrophobicContact CB-CB 4.2Å; H448-Q550 HydrophobicContact CB-CG 4.43Å
449	F	98.4	Very high	92.4	Very high	1 Å²	1	24.8 Å²	24.8	0%	0.004	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	129.6	179.1	-67.5	-66.9	0	0	0	112.5	I361 V362 M363 V375 L409 F412 L413 I432 L443 V447 V547 L549 Q550	I361-F449 HydrophobicContact CG2-CB 4.18Å; I361-F449 HydrophobicContact CG2-CD1 4.09Å; V362-F449 WeakPolarHBondContact O-CA 3.29Å; M363-F449 HydrophobicContact CB-CD1 4.08Å; M363-F449 HydrophobicContact CB-CE1 3.88Å; M363-F449 HydrophobicContact CG-CD1 4.36Å; M363-F449 HydrophobicContact CG-CE1 3.9Å; M363-F449 HydrophobicContact SD-CE1 4.35Å; V375-F449 HydrophobicContact CG2-CD1 4.19Å; V375-F449 HydrophobicContact CG2-CE1 4.01Å; L409-F449 HydrophobicContact CD1-CD1 4.09Å; L409-F449 HydrophobicContact CD1-CE1 3.83Å; L409-F449 HydrophobicContact CD1-CZ 4.22Å; F412-F449 HydrophobicContact CD1-CE1 4.47Å; F412-F449 HydrophobicContact CE1-CE1 4.17Å; F412-F449 HydrophobicContact CE1-CZ 4.29Å; L413-F449 HydrophobicContact CD2-CE2 4.27Å; L413-F449 HydrophobicContact CD2-CZ 4.12Å; I432-F449 HydrophobicContact CD1-CZ 3.86Å; L443-F449 HydrophobicContact CD1-CE2 3.95Å; L443-F449 HydrophobicContact CD1-CZ 4.42Å; L443-F449 HydrophobicContact CD2-CD2 4.16Å; L443-F449 HydrophobicContact CD2-CE2 3.83Å; V447-F449 HydrophobicContact CG1-CE2 4.44Å; V447-F449 HydrophobicContact CG1-CZ 4.26Å; F449-V547 HydrophobicContact CD2-CG1 3.63Å; F449-V547 HydrophobicContact CE2-CG1 3.69Å; F449-L549 HydrophobicContact CB-CD2 4.23Å; F449-L549 CarbonylContact O-C 3.54Å; F449-L549 WeakPolarHBondContact O-CA 3.2Å; F449-Q550 PolarHBondContact O-N 3.07Å
450	H	97.9	Very high	93.2	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	122.7	-173.5	-57	-84.6	0	0	0	109.6	F329 I333 I361 V362 T364 H448 S551	F329-H450 AromaticContact CE1-CE1 3.87Å; F329-H450 AromaticContact CE1-ND1 3.71Å; F329-H450 AromaticContact CZ-CE1 3.67Å; F329-H450 AromaticContact CZ-ND1 3.95Å; F329-H450 AromaticContact CZ-NE2 3.85Å; I333-H450 HydrophobicContact CD1-CB 4Å; I333-H450 HydrophobicContact CG1-CB 4.46Å; I333-H450 HydrophobicContact CG2-CB 4.44Å; I361-H450 CarbonylContact C-O 3.55Å; I361-H450 WeakPolarHBondContact CA-O 3.17Å; V362-H450 PolarHBondContact N-O 3.2Å; V362-H450 PolarHBondContact O-N 3.44Å; T364-H450 PolarHBondContact OG1-NE2 3.4Å; T364-H450 VanDerWaalsContact OG1-NE2 3.12Å; H448-H450 WeakPolarHBondContact CB-NE2 3.5Å; H450-S551 PolarHBondContact ND1-OG 3.03Å
451	M	98	Very high	92.9	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	122	-179.6	-179.1	175.2	-81.8	0	0	111.4	G360 I361 E402 I453 W530 L549 S551 I552 T553	G360-M451 CarbonylContact O-C 3.49Å; G360-M451 WeakPolarHBondContact O-CA 3.5Å; I361-M451 HydrophobicContact CD1-CE 3.62Å; I361-M451 HydrophobicContact CG1-CB 4.4Å; I361-M451 HydrophobicContact CG1-CE 3.82Å; I361-M451 HydrophobicContact CG1-CG 4.37Å; E402-M451 HydrophobicContact CB-SD 4.39Å; M451-I453 HydrophobicContact CG-CD1 4.4Å; M451-I453 HydrophobicContact CG-CG1 3.86Å; M451-I453 HydrophobicContact SD-CD1 3.89Å; M451-I453 HydrophobicContact SD-CG1 3.96Å; M451-W530 HydrophobicContact CE-CZ3 4.24Å; M451-L549 HydrophobicContact CB-CD1 3.71Å; M451-L549 HydrophobicContact CB-CD2 3.9Å; M451-L549 HydrophobicContact CB-CG 4.45Å; M451-L549 HydrophobicContact CE-CD1 4.25Å; M451-L549 HydrophobicContact SD-CD1 4.12Å; M451-S551 PolarHBondContact N-O 2.99Å; M451-I552 CarbonylContact O-C 3.56Å; M451-I552 VanDerWaalsContact O-CA 3.26Å; M451-I552 WeakPolarHBondContact O-CA 3.41Å; M451-T553 PolarHBondContact O-N 3.07Å
452	Y	96.8	Very high	92.3	Very high	9 Å²	9	23.4 Å²	23.4	4%	0.035	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	138.4	161.7	174.9	-102.9	0	0	0	110.4	F334 V337 L358 A359 G360 S454 T553 L591	F334-Y452 HydrophobicContact CB-CD2 3.91Å; F334-Y452 HydrophobicContact CB-CE2 3.79Å; F334-Y452 HydrophobicContact CD2-CD2 4.35Å; F334-Y452 HydrophobicContact CD2-CE1 4.19Å; F334-Y452 AromaticContact CD2-CE2 3.54Å; F334-Y452 HydrophobicContact CD2-CE2 3.54Å; F334-Y452 AromaticContact CD2-CZ 3.42Å; F334-Y452 VanDerWaalsContact CD2-CZ 3.42Å; F334-Y452 VanDerWaalsContact CD2-OH 3.26Å; F334-Y452 WeakPolarHBondContact CD2-OH 3.38Å; F334-Y452 HydrophobicContact CE2-CE2 4.49Å; F334-Y452 WeakPolarHBondContact CE2-OH 3.39Å; F334-Y452 HydrophobicContact CG-CE2 4.08Å; V337-Y452 HydrophobicContact CB-CD1 4.34Å; V337-Y452 HydrophobicContact CG1-CD1 3.87Å; L358-Y452 HydrophobicContact CD2-CE1 4.38Å; L358-Y452 HydrophobicContact CG-CE1 4.37Å; A359-Y452 WeakPolarHBondContact CA-O 3.41Å; A359-Y452 WeakPolarHBondContact CB-O 3.05Å; G360-Y452 PolarHBondContact N-O 3.14Å; G360-Y452 PolarHBondContact O-N 2.99Å; Y452-S454 WeakPolarHBondContact OH-CA 3.3Å; Y452-T553 HydrophobicContact CD2-CG2 4.06Å; Y452-L591 HydrophobicContact CE2-CD1 4.19Å; Y452-L591 HydrophobicContact CE2-CD2 4.37Å
453	I	94.4	Very high	91.1	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	127.6	166.3	-40.4	175.5	0	0	0	108.4	E402 M451 T455 P457 I527 I552 T553 V554 G555	E402-I453 HydrophobicContact CB-CD1 3.88Å; E402-I453 HydrophobicContact CB-CG1 4.24Å; E402-I453 HydrophobicContact CB-CG2 4.29Å; E402-I453 HydrophobicContact CG-CD1 4.47Å; M451-I453 HydrophobicContact CG-CD1 4.4Å; M451-I453 HydrophobicContact CG-CG1 3.86Å; M451-I453 HydrophobicContact SD-CD1 3.89Å; M451-I453 HydrophobicContact SD-CG1 3.96Å; I453-T455 WeakPolarHBondContact CG2-O 3.42Å; I453-T455 PolarHBondContact O-N 3.42Å; I453-T455 VanDerWaalsContact O-N 3.1Å; I453-P457 HydrophobicContact CD1-CB 4.39Å; I453-P457 HydrophobicContact CD1-CG 4.47Å; I453-I527 HydrophobicContact CD1-CD1 3.94Å; I453-I552 HydrophobicContact CD1-CG2 4.11Å; I453-I552 HydrophobicContact CG1-CG2 4.36Å; I453-T553 PolarHBondContact N-O 3.33Å; I453-V554 WeakPolarHBondContact O-CA 3.41Å; I453-G555 PolarHBondContact O-N 3.45Å
454	S	91.3	Very high	89.4	Confident	8 Å²	8	23 Å²	23	6%	0.056	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	-15.8	-174.7	71.4	0	0	0	0	114.8	S357 L358 Y452 G555 S556	S357-S454 WeakPolarHBondContact CA-OG 3.45Å; L358-S454 PolarHBondContact N-OG 2.85Å; L358-S454 WeakPolarHBondContact O-CB 3.45Å; L358-S454 PolarHBondContact O-N 3.05Å; Y452-S454 WeakPolarHBondContact OH-CA 3.3Å; S454-G555 CarbonylContact O-C 3.56Å; S454-G555 WeakPolarHBondContact O-CA 3.26Å; S454-S556 PolarHBondContact O-N 2.94Å; S454-S556 PolarHBondContact O-OG 2.8Å
455	T	88	Confident	86.9	Confident	11 Å²	11	22 Å²	22	7%	0.067	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	152.1	176.8	-175	0	0	0	0	110.1	I453 S556	I453-T455 WeakPolarHBondContact CG2-O 3.42Å; I453-T455 PolarHBondContact O-N 3.42Å; I453-T455 VanDerWaalsContact O-N 3.1Å; T455-S556 WeakPolarHBondContact CA-O 3.37Å; T455-S556 VanDerWaalsContact CB-OG 3.25Å; T455-S556 WeakPolarHBondContact CB-OG 3.47Å; T455-S556 PolarHBondContact OG1-OG 3.23Å
456	S	87.7	Confident	84.5	Confident	2 Å²	2	20 Å²	20	1%	0.014	11%	0.108	C	C	.	.	P	Polyproline II helix	trans	-50.8	132.2	179.1	-171.1	0	0	0	0	111.4	G461 R462 S556	S456-G461 VanDerWaalsContact OG-C 3.32Å; S456-G461 PolarHBondContact OG-O 3.18Å; S456-R462 VanDerWaalsContact O-CZ 3.24Å; S456-R462 PolarHBondContact O-NE 3.18Å; S456-R462 PolarHBondContact O-NH2 2.75Å; S456-S556 PolarHBondContact N-O 3.44Å; S456-S556 VanDerWaalsContact N-O 3.08Å
457	P	92.3	Very high	81.8	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.125	C	C	.	.	P	Polyproline II helix	trans	-58.2	146.2	-172.4	23.6	-35.5	0	0	0	112	I453 C523 T524 I527 L563	I453-P457 HydrophobicContact CD1-CB 4.39Å; I453-P457 HydrophobicContact CD1-CG 4.47Å; P457-C523 HydrophobicContact CB-CB 3.85Å; P457-T524 PolarHBondContact O-OG1 2.78Å; P457-I527 HydrophobicContact CB-CD1 3.69Å; P457-I527 HydrophobicContact CG-CD1 3.73Å; P457-L563 HydrophobicContact CG-CD1 3.99Å; P457-L563 HydrophobicContact CG-CD2 4.47Å
458	C	91.8	Very high	79.1	Confident	2 Å²	2	28 Å²	28	1%	0.014	14%	0.138	C	C	.	.	S	Bend	trans	-64.8	153.5	-179.3	81.4	0	0	0	0	111.7	H400 K490 T497 C523 T524	H400-C458 VanDerWaalsContact CE1-SG 3.55Å; C458-K490 VanDerWaalsContact SG-CE 3.6Å; C458-T497 HydrophobicContact CB-CG2 4.11Å; C458-C523 PolarHBondContact O-N 3.44Å; C458-C523 VanDerWaalsContact O-N 3.11Å; C458-T524 PolarHBondContact O-N 3.22Å; C458-T524 PolarHBondContact O-OG1 3.32Å
459	G	90.1	Very high	76.5	Confident	2 Å²	2	31.4 Å²	31.4	2%	0.021	16%	0.156	C	C	.	.	S	Bend	trans	104.1	-155.6	-167.9	0	0	0	0	0	111.6	G461 R462 S522	G459-G461 VanDerWaalsContact C-N 3.26Å; G459-G461 PolarHBondContact O-N 2.91Å; G459-R462 PolarHBondContact O-N 3.38Å; G459-S522 WeakPolarHBondContact CA-OG 3.41Å
460	D	86.6	Confident	73.6	Confident	1 Å²	1	37 Å²	37	1%	0.005	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-64.3	-29.1	-169.4	-158.3	80.1	0	0	0	113.3	R462 L463 S485 T524 H562 V566	D460-R462 PolarHBondContact O-N 3.18Å; D460-R462 VanDerWaalsContact O-N 3.13Å; D460-L463 PolarHBondContact O-N 3Å; D460-L463 VanDerWaalsContact OD1-CD1 3.32Å; D460-L463 WeakPolarHBondContact OD1-CD1 3.49Å; D460-S485 PolarHBondContact OD1-N 2.85Å; D460-S485 VanDerWaalsContact OD1-N 3.12Å; D460-S485 WeakPolarHBondContact OD2-CA 3.47Å; D460-S485 PolarHBondContact OD2-N 3.38Å; D460-T524 PolarHBondContact N-OG1 2.86Å; D460-H562 PolarHBondContact O-NE2 3.44Å; D460-H562 IonicContact OD2-CE1 3.82Å; D460-H562 IonicContact OD2-NE2 3.72Å; D460-V566 HydrophobicContact CB-CG1 4.1Å; D460-V566 WeakPolarHBondContact OD2-CG2 3.42Å
461	G	81.5	Confident	70.6	Confident	3 Å²	3	39.8 Å²	39.8	3%	0.031	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-62.6	-17.8	174.6	0	0	0	0	0	114.6	S456 G459 T524	S456-G461 VanDerWaalsContact OG-C 3.32Å; S456-G461 PolarHBondContact OG-O 3.18Å; G459-G461 VanDerWaalsContact C-N 3.26Å; G459-G461 PolarHBondContact O-N 2.91Å; G461-T524 PolarHBondContact N-OG1 2.84Å; G461-T524 VanDerWaalsContact N-OG1 3.14Å
462	R	79.6	Confident	67.7	Low	84 Å²	84	41.6 Å²	41.6	32%	0.317	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-101.7	-8.9	174.6	-162.9	-178.8	-69.4	-174.5	-3.5	113.2	S456 G459 D460 N464 L557	S456-R462 VanDerWaalsContact O-CZ 3.24Å; S456-R462 PolarHBondContact O-NE 3.18Å; S456-R462 PolarHBondContact O-NH2 2.75Å; G459-R462 PolarHBondContact O-N 3.38Å; D460-R462 PolarHBondContact O-N 3.18Å; D460-R462 VanDerWaalsContact O-N 3.13Å; R462-N464 PolarHBondContact O-N 2.82Å; R462-L557 HydrophobicContact CG-CD1 3.8Å
463	L	69.8	Low	65.1	Low	72 Å²	72	48.3 Å²	48.3	38%	0.377	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-19.9	-175.6	-70.6	-172.8	0	0	0	114.9	D460 S465 R488	D460-L463 PolarHBondContact O-N 3Å; D460-L463 VanDerWaalsContact OD1-CD1 3.32Å; D460-L463 WeakPolarHBondContact OD1-CD1 3.49Å; L463-S465 PolarHBondContact O-N 2.82Å; L463-R488 VanDerWaalsContact CD1-CZ 3.47Å
464	N	59.8	Low	62.6	Low	20 Å²	20	57.3 Å²	57.3	11%	0.107	30%	0.298	C	S	.	.			trans	-65.2	96.2	-179	-174.4	102.9	0	0	0	110.4	R462 H559 H562	R462-N464 PolarHBondContact O-N 2.82Å; N464-H559 HydrophobicContact CB-CB 4.34Å; N464-H559 PolarHBondContact ND2-CD2 3.44Å; N464-H559 VanDerWaalsContact ND2-CD2 3.3Å; N464-H559 PolarHBondContact ND2-NE2 3.41Å; N464-H559 PolarHBondContact O-CD2 2.9Å; N464-H559 PolarHBondContact O-NE2 3.46Å; N464-H562 HydrophobicContact CB-CB 3.94Å
465	S	43.1	Very low	60	Low	37 Å²	37	59.5 Å²	59.5	26%	0.259	31%	0.313	S	S	.	.			trans	-51.3	130.3	165	174.3	0	0	0	0	109.4	L463 Y467 E468	L463-S465 PolarHBondContact O-N 2.82Å; S465-Y467 PolarHBondContact O-N 3.04Å; S465-Y467 WeakPolarHBondContact OG-CD2 3.2Å; S465-Y467 PolarHBondContact OG-N 3.08Å; S465-E468 WeakPolarHBondContact CB-OE1 3.29Å; S465-E468 PolarHBondContact O-N 3.32Å; S465-E468 VanDerWaalsContact O-N 3.12Å
466	P	42.2	Very low	57.6	Low	75 Å²	75	64.4 Å²	64.4	49%	0.487	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-15.7	173.8	-25.6	33.9	0	0	0	113.8
467	Y	36.8	Very low	55.4	Low	151 Å²	151	73.2 Å²	73.2	59%	0.592	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	-12.8	-174.7	-47.2	-71.1	0	0	0	113.8	S465 I469 T470	S465-Y467 PolarHBondContact O-N 3.04Å; S465-Y467 WeakPolarHBondContact OG-CD2 3.2Å; S465-Y467 PolarHBondContact OG-N 3.08Å; Y467-I469 PolarHBondContact O-N 2.98Å; Y467-T470 PolarHBondContact O-OG1 3.38Å
468	E	37.9	Very low	53.1	Low	68 Å²	68	79.4 Å²	79.4	32%	0.318	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-74.5	-6	-179.2	-92.7	177.1	-126.8	0	0	114.3	S465 T470 R484	S465-E468 WeakPolarHBondContact CB-OE1 3.29Å; S465-E468 PolarHBondContact O-N 3.32Å; S465-E468 VanDerWaalsContact O-N 3.12Å; E468-T470 VanDerWaalsContact C-N 3.28Å; E468-R484 IonicContact OE2-CZ 3.26Å; E468-R484 IonicContact OE2-NE 3.61Å; E468-R484 IonicContact OE2-NH2 2.71Å; E468-R484 PolarHBondContact OE2-NH2 3.05Å
469	I	41.8	Very low	50.7	Low	113 Å²	113	86.1 Å²	86.1	58%	0.579	44%	0.444	S	S	*	.	G	3₁₀ helix	trans	-75.9	-20.3	178.6	-60.8	172.6	0	0	0	111.5	Y467	Y467-I469 PolarHBondContact O-N 2.98Å
470	T	37.6	Very low	48.5	Very low	119 Å²	119	93.6 Å²	93.6	73%	0.73	48%	0.481	S	S	*	.	G	3₁₀ helix	trans	-109.8	7.7	-175.1	43.9	0	0	0	0	114.8	Y467 E468	Y467-T470 PolarHBondContact O-OG1 3.38Å; E468-T470 VanDerWaalsContact C-N 3.28Å
471	S	35.6	Very low	46.8	Very low	59 Å²	59	100.1 Å²	100.1	41%	0.413	51%	0.505	S	S	.	.	S	Bend	trans	-122.8	146.7	177	55.8	0	0	0	0	112
472	D	37.3	Very low	45.3	Very low	37 Å²	37	106.5 Å²	106.5	20%	0.198	53%	0.532	C	S	.	.			trans	79.4	56	165.3	-45.5	-24.3	0	0	0	118.1	S475 R481	D472-S475 WeakPolarHBondContact OD1-CB 3.48Å; D472-S475 PolarHBondContact OD1-OG 3.1Å; D472-R481 PolarHBondContact O-NH1 3.4Å
473	L	42.3	Very low	44.3	Very low	150 Å²	150	106.3 Å²	106.3	79%	0.785	53%	0.534	S	S	*	.	S	Bend	trans	-85.9	-28.9	135.8	-112.5	72.8	0	0	0	112.6
474	H	41.7	Very low	44.1	Very low	190 Å²	190	107.5 Å²	107.5	88%	0.88	53%	0.534	S	S	*	.	S	Bend	trans	-130.4	15.3	-171.2	-69.8	114.7	0	0	0	115.8
475	S	36.8	Very low	44.8	Very low	53 Å²	53	106.9 Å²	106.9	37%	0.371	53%	0.531	S	S	.	.			trans	-116.7	127.9	176.2	125.1	0	0	0	0	111.8	D472 R477	D472-S475 WeakPolarHBondContact OD1-CB 3.48Å; D472-S475 PolarHBondContact OD1-OG 3.1Å; S475-R477 PolarHBondContact O-N 3.5Å
476	S	37.2	Very low	46.8	Very low	115 Å²	115	106.1 Å²	106.1	80%	0.804	52%	0.523	S	S	*	.			trans	-81.1	60	-177.1	-164.8	0	0	0	0	112.2	H478	S476-H478 VanDerWaalsContact C-N 3.26Å; S476-H478 PolarHBondContact O-N 3.3Å
477	R	40.9	Very low	49.2	Very low	187 Å²	187	102.6 Å²	102.6	71%	0.706	50%	0.5	S	S	*	.			trans	-93.9	57.5	172.1	-71.8	-173.5	171.7	-147.4	-4.8	111	S475 L479	S475-R477 PolarHBondContact O-N 3.5Å; R477-L479 PolarHBondContact O-N 3Å
478	H	44.5	Very low	51.8	Low	129 Å²	129	96.4 Å²	96.4	60%	0.597	48%	0.476	S	S	*	.	H	α-helix	trans	-62.9	-17.7	-165.6	-146.2	-48.4	0	0	0	115.2	S476	S476-H478 VanDerWaalsContact C-N 3.26Å; S476-H478 PolarHBondContact O-N 3.3Å
479	L	42	Very low	54.4	Low	143 Å²	143	93.6 Å²	93.6	75%	0.749	46%	0.464	S	S	*	.	H	α-helix	trans	-73.7	-51.9	-177.8	-74.9	160.1	0	0	0	113.4	R477 R481 K482	R477-L479 PolarHBondContact O-N 3Å; L479-R481 PolarHBondContact O-N 3.2Å; L479-K482 PolarHBondContact O-N 2.94Å
480	M	43.5	Very low	56.9	Low	160 Å²	160	88.6 Å²	88.6	79%	0.788	44%	0.437	S	S	*	.	H	α-helix	trans	-67.6	-25.6	-177.8	-68.3	-61.6	-176.7	0	0	112.6	K482	M480-K482 VanDerWaalsContact C-N 3.32Å; M480-K482 PolarHBondContact O-N 2.93Å
481	R	50.4	Low	59.1	Low	137 Å²	137	85.9 Å²	85.9	52%	0.517	42%	0.418	S	S	.	.	H	α-helix	trans	-71.6	-23.7	177.7	-147.6	170.1	-176.3	129.3	-10.1	112.8	D472 L479 H483	D472-R481 PolarHBondContact O-NH1 3.4Å; L479-R481 PolarHBondContact O-N 3.2Å; R481-H483 PolarHBondContact O-N 2.94Å
482	K	51.6	Low	61.2	Low	137 Å²	137	85.1 Å²	85.1	60%	0.596	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-26.4	-178.1	-85	-174.8	173.7	-177	0	114.7	L479 M480 H486	L479-K482 PolarHBondContact O-N 2.94Å; M480-K482 VanDerWaalsContact C-N 3.32Å; M480-K482 PolarHBondContact O-N 2.93Å; K482-H486 PolarHBondContact O-CE1 2.79Å; K482-H486 PolarHBondContact O-NE2 2.84Å
483	H	56.9	Low	62.8	Low	80 Å²	80	87 Å²	87	37%	0.37	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.5	16	-170.7	-64.6	-50.2	0	0	0	115.6	R481 H486 P499	R481-H483 PolarHBondContact O-N 2.94Å; H483-H486 AromaticContact CE1-NE2 3.9Å; H483-H486 AromaticContact ND1-CD2 3.29Å; H483-H486 PolarHBondContact ND1-CD2 3.48Å; H483-H486 VanDerWaalsContact ND1-CD2 3.29Å; H483-H486 AromaticContact ND1-CE1 3.84Å; H483-H486 AromaticContact ND1-NE2 3.05Å; H483-H486 PolarHBondContact ND1-NE2 2.89Å; H483-P499 HydrophobicContact CB-CB 4.43Å
484	R	67.1	Low	64.5	Low	98 Å²	98	81.2 Å²	81.2	37%	0.37	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	147.9	169.1	-71.5	-179.2	172.6	164.8	-2.5	110.4	E468 H486	E468-R484 IonicContact OE2-CZ 3.26Å; E468-R484 IonicContact OE2-NE 3.61Å; E468-R484 IonicContact OE2-NH2 2.71Å; E468-R484 PolarHBondContact OE2-NH2 3.05Å; R484-H486 PolarHBondContact O-N 3.45Å; R484-H486 PolarHBondContact O-ND1 3.33Å
485	S	73.6	Confident	66.3	Low	6 Å²	6	74.7 Å²	74.7	4%	0.042	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.7	-5.7	179.5	-54.2	0	0	0	0	116.4	D460 Q569 R570	D460-S485 PolarHBondContact OD1-N 2.85Å; D460-S485 VanDerWaalsContact OD1-N 3.12Å; D460-S485 WeakPolarHBondContact OD2-CA 3.47Å; D460-S485 PolarHBondContact OD2-N 3.38Å; S485-Q569 PolarHBondContact OG-OE1 3.25Å; S485-R570 PolarHBondContact O-NE 3.44Å; S485-R570 PolarHBondContact O-NH2 3.35Å; S485-R570 VanDerWaalsContact O-NH2 3.15Å
486	H	86.3	Confident	68.5	Low	22 Å²	22	73.8 Å²	73.8	10%	0.102	37%	0.37	C	S	.	.			trans	-58.8	155.8	175.2	-78.9	42.6	0	0	0	111.9	K482 H483 R484 R570 L692	K482-H486 PolarHBondContact O-CE1 2.79Å; K482-H486 PolarHBondContact O-NE2 2.84Å; H483-H486 AromaticContact CE1-NE2 3.9Å; H483-H486 AromaticContact ND1-CD2 3.29Å; H483-H486 PolarHBondContact ND1-CD2 3.48Å; H483-H486 VanDerWaalsContact ND1-CD2 3.29Å; H483-H486 AromaticContact ND1-CE1 3.84Å; H483-H486 AromaticContact ND1-NE2 3.05Å; H483-H486 PolarHBondContact ND1-NE2 2.89Å; R484-H486 PolarHBondContact O-N 3.45Å; R484-H486 PolarHBondContact O-ND1 3.33Å; H486-R570 PolarHBondContact O-NH2 2.75Å; H486-L692 CarbonylContact C-O 3.35Å; H486-L692 WeakPolarHBondContact CA-O 3.45Å
487	L	90.9	Very high	71	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	34%	0.338	C	S	.	.			trans	-62.8	147.8	168.1	-62	-174.6	0	0	0	111.3	L500 M521 D525 L687 L692 G693 W695	L487-L500 HydrophobicContact CB-CD1 3.71Å; L487-L500 HydrophobicContact CD1-CD1 4.5Å; L487-L500 PolarHBondContact O-N 2.85Å; L487-L500 VanDerWaalsContact O-N 3.07Å; L487-M521 HydrophobicContact CB-CE 3.83Å; L487-M521 HydrophobicContact CD1-CE 3.84Å; L487-M521 HydrophobicContact CD2-CE 4.39Å; L487-M521 HydrophobicContact CG-CE 4.26Å; L487-D525 HydrophobicContact CD2-CB 4.11Å; L487-L687 HydrophobicContact CD1-CD1 4.14Å; L487-L687 HydrophobicContact CD2-CD1 4.08Å; L487-L687 HydrophobicContact CD2-CD2 4.14Å; L487-L692 PolarHBondContact N-O 3.11Å; L487-G693 WeakPolarHBondContact CD1-O 3.42Å; L487-W695 HydrophobicContact CD1-CB 4.22Å
488	R	91.8	Very high	73.2	Confident	22 Å²	22	63.5 Å²	63.5	8%	0.083	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	151.3	-176	-57.8	-171.8	70.4	88.4	-2.3	111.8	L463 T497 V498 S522 D525	L463-R488 VanDerWaalsContact CD1-CZ 3.47Å; R488-T497 PolarHBondContact NE-OG1 3.27Å; R488-T497 VanDerWaalsContact NE-OG1 3.07Å; R488-T497 PolarHBondContact NH2-O 3.33Å; R488-V498 CarbonylContact C-O 3.45Å; R488-V498 WeakPolarHBondContact CA-O 2.86Å; R488-V498 VanDerWaalsContact CB-O 3.31Å; R488-V498 WeakPolarHBondContact CB-O 3.47Å; R488-S522 WeakPolarHBondContact O-CB 3.16Å; R488-S522 PolarHBondContact O-N 3.22Å; R488-D525 PolarHBondContact N-OD2 2.97Å
489	T	92.9	Very high	75.1	Confident	9 Å²	9	59.7 Å²	59.7	6%	0.055	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	143.2	179.5	48.7	0	0	0	0	110.1	T497 V498 L500 I519 T520 M521	T489-T497 CarbonylContact O-C 3.58Å; T489-T497 WeakPolarHBondContact O-CA 3.5Å; T489-T497 VanDerWaalsContact O-CB 3.29Å; T489-T497 WeakPolarHBondContact O-CB 3.19Å; T489-V498 PolarHBondContact N-O 3.38Å; T489-V498 PolarHBondContact O-N 3.05Å; T489-V498 WeakPolarHBondContact OG1-CG2 3.48Å; T489-L500 HydrophobicContact CG2-CD1 3.79Å; T489-L500 HydrophobicContact CG2-CD2 3.96Å; T489-L500 HydrophobicContact CG2-CG 3.79Å; T489-I519 HydrophobicContact CG2-CG2 3.29Å; T489-T520 CarbonylContact C-O 3.56Å; T489-T520 WeakPolarHBondContact CA-O 3.32Å; T489-M521 HydrophobicContact CG2-SD 3.81Å
490	K	93.1	Very high	76.9	Confident	7 Å²	7	53.3 Å²	53.3	3%	0.03	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	139.6	174.8	-59.8	178.4	-179	-160.8	0	108.8	C383 D398 H400 C458 G496 T497 T520 M521 C523	C383-K490 VanDerWaalsContact SG-CD 3.55Å; D398-K490 IonicContact OD1-NZ 3.61Å; D398-K490 PolarHBondContact OD1-NZ 2.86Å; D398-K490 WeakPolarHBondContact OD2-CE 3.44Å; D398-K490 IonicContact OD2-NZ 3.56Å; D398-K490 PolarHBondContact OD2-NZ 3.24Å; H400-K490 PolarHBondContact CD2-NZ 3.08Å; H400-K490 PolarHBondContact CE1-NZ 3.03Å; H400-K490 PolarHBondContact ND1-NZ 3.42Å; H400-K490 PolarHBondContact NE2-NZ 3.22Å; H400-K490 VanDerWaalsContact NE2-NZ 3.17Å; C458-K490 VanDerWaalsContact SG-CE 3.6Å; K490-G496 WeakPolarHBondContact CA-O 3.4Å; K490-T497 HydrophobicContact CG-CG2 4.22Å; K490-T520 WeakPolarHBondContact CB-O 3.45Å; K490-T520 HydrophobicContact CD-CG2 4.32Å; K490-T520 WeakPolarHBondContact CG-O 3.14Å; K490-T520 PolarHBondContact N-O 3.27Å; K490-M521 WeakPolarHBondContact CE-O 3.28Å; K490-C523 PolarHBondContact NZ-SG 2.84Å
491	I	84.9	Confident	78.1	Confident	63 Å²	63	56 Å²	56	32%	0.323	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-78.6	132.2	171.5	-49.2	173	0	0	0	106.9	G494 G496 V498	I491-G494 PolarHBondContact O-N 2.94Å; I491-G496 PolarHBondContact N-O 2.82Å; I491-V498 HydrophobicContact CD1-CG1 4.04Å; I491-V498 HydrophobicContact CG1-CG1 4.03Å
492	E	79.2	Confident	78.2	Confident	42 Å²	42	54.6 Å²	54.6	20%	0.196	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	150.1	175.2	-171.7	170.1	175.8	0	0	111.3	N385 G386 G494 Q517 L518	N385-E492 WeakPolarHBondContact CA-OE1 3.27Å; G386-E492 PolarHBondContact N-OE1 3.37Å; E492-G494 PolarHBondContact O-N 2.86Å; E492-Q517 HydrophobicContact CB-CG 3.58Å; E492-Q517 WeakPolarHBondContact OE2-CA 3.45Å; E492-Q517 WeakPolarHBondContact OE2-CG 3.35Å; E492-L518 WeakPolarHBondContact OE2-CB 3.48Å; E492-L518 PolarHBondContact OE2-N 3.27Å
493	S	72.1	Confident	78.6	Confident	78 Å²	78	59.2 Å²	59.2	55%	0.545	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.3	-13.8	-170.1	-74.4	0	0	0	0	117
494	G	77.2	Confident	78.7	Confident	28 Å²	28	56.4 Å²	56.4	29%	0.289	29%	0.294	S	S	.	.	S	Bend	trans	-102.1	179.2	179.8	0	0	0	0	0	115.1	I491 E492	I491-G494 PolarHBondContact O-N 2.94Å; E492-G494 PolarHBondContact O-N 2.86Å
495	E	78.5	Confident	78.7	Confident	52 Å²	52	54.9 Å²	54.9	24%	0.243	30%	0.296	C	S	.	.	S	Bend	trans	-109.2	-6.7	175.4	-56.7	177.7	-129.3	0	0	113	K356 A603	K356-E495 WeakPolarHBondContact CD-OE2 3.48Å; K356-E495 WeakPolarHBondContact CE-OE2 3.49Å; K356-E495 IonicContact NZ-OE1 2.7Å; K356-E495 PolarHBondContact NZ-OE1 3.1Å; K356-E495 IonicContact NZ-OE2 2.71Å; K356-E495 PolarHBondContact NZ-OE2 3.47Å; E495-A603 WeakPolarHBondContact OE1-CB 3.27Å
496	G	83.3	Confident	79.1	Confident	35 Å²	35	60.8 Å²	60.8	36%	0.361	33%	0.332	S	S	.	.			trans	-80.6	176.7	-174.8	0	0	0	0	0	113.5	K490 I491	K490-G496 WeakPolarHBondContact CA-O 3.4Å; I491-G496 PolarHBondContact N-O 2.82Å
497	T	89.6	Confident	79.2	Confident	23 Å²	23	60.2 Å²	60.2	14%	0.141	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	143.3	171	64	0	0	0	0	111.9	C458 R488 T489 K490	C458-T497 HydrophobicContact CB-CG2 4.11Å; R488-T497 PolarHBondContact NE-OG1 3.27Å; R488-T497 VanDerWaalsContact NE-OG1 3.07Å; R488-T497 PolarHBondContact NH2-O 3.33Å; T489-T497 CarbonylContact O-C 3.58Å; T489-T497 WeakPolarHBondContact O-CA 3.5Å; T489-T497 VanDerWaalsContact O-CB 3.29Å; T489-T497 WeakPolarHBondContact O-CB 3.19Å; K490-T497 HydrophobicContact CG-CG2 4.22Å
498	V	88	Confident	79.2	Confident	62 Å²	62	63.2 Å²	63.2	38%	0.376	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	152.1	173.7	-67.6	0	0	0	0	110.6	R488 T489 I491	R488-V498 CarbonylContact C-O 3.45Å; R488-V498 WeakPolarHBondContact CA-O 2.86Å; R488-V498 VanDerWaalsContact CB-O 3.31Å; R488-V498 WeakPolarHBondContact CB-O 3.47Å; T489-V498 PolarHBondContact N-O 3.38Å; T489-V498 PolarHBondContact O-N 3.05Å; T489-V498 WeakPolarHBondContact OG1-CG2 3.48Å; I491-V498 HydrophobicContact CD1-CG1 4.04Å; I491-V498 HydrophobicContact CG1-CG1 4.03Å
499	P	84.8	Confident	79	Confident	49 Å²	49	64 Å²	64	32%	0.318	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	146.1	170.9	30.7	-32.6	0	0	0	110.4	H483	H483-P499 HydrophobicContact CB-CB 4.43Å
500	L	78.9	Confident	78.9	Confident	10 Å²	10	68.3 Å²	68.3	5%	0.052	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-72.3	138.4	170.3	-88.5	158.2	0	0	0	111.4	L487 T489 M521 V696	L487-L500 HydrophobicContact CB-CD1 3.71Å; L487-L500 HydrophobicContact CD1-CD1 4.5Å; L487-L500 PolarHBondContact O-N 2.85Å; L487-L500 VanDerWaalsContact O-N 3.07Å; T489-L500 HydrophobicContact CG2-CD1 3.79Å; T489-L500 HydrophobicContact CG2-CD2 3.96Å; T489-L500 HydrophobicContact CG2-CG 3.79Å; L500-M521 HydrophobicContact CD1-CE 3.65Å; L500-M521 HydrophobicContact CD1-SD 3.96Å; L500-V696 HydrophobicContact CD1-CG2 4.1Å; L500-V696 HydrophobicContact CD2-CG2 3.59Å
501	R	68.4	Low	78.7	Confident	217 Å²	217	69.4 Å²	69.4	82%	0.819	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-75.5	154.1	168.5	-64.2	-179.5	178.3	174.4	-0.6	109.5	R503 G504	R501-R503 VanDerWaalsContact C-N 3.29Å; R501-R503 CarbonylContact O-C 3.46Å; R501-R503 VanDerWaalsContact O-C 3.3Å; R501-R503 PolarHBondContact O-N 3.03Å; R501-R503 VanDerWaalsContact O-N 3.17Å; R501-G504 PolarHBondContact O-N 2.77Å
502	C	53.5	Low	78.9	Confident	106 Å²	106	66.6 Å²	66.6	72%	0.716	37%	0.368	S	S	*	.	S	Bend	trans	-61.3	-30	-165.9	-54.7	0	0	0	0	114.8
503	R	59.5	Low	79.2	Confident	234 Å²	234	68.5 Å²	68.5	88%	0.883	38%	0.379	S	S	*	.	S	Bend	trans	-94.5	107.9	158.8	-69.9	-170.9	179	-152.2	1.1	107.9	R501	R501-R503 VanDerWaalsContact C-N 3.29Å; R501-R503 CarbonylContact O-C 3.46Å; R501-R503 VanDerWaalsContact O-C 3.3Å; R501-R503 PolarHBondContact O-N 3.03Å; R501-R503 VanDerWaalsContact O-N 3.17Å
504	G	59.1	Low	79.9	Confident	22 Å²	22	72.5 Å²	72.5	23%	0.227	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-71.9	129.9	170.4	0	0	0	0	0	109.7	R501	R501-G504 PolarHBondContact O-N 2.77Å
505	P	67.6	Low	80.2	Confident	65 Å²	65	74.3 Å²	74.3	42%	0.422	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-65.5	145.5	179.6	27.7	-35.3	0	0	0	111.2	I519	P505-I519 HydrophobicContact CG-CD1 3.37Å
506	V	81	Confident	80.5	Confident	130 Å²	130	77.1 Å²	77.1	79%	0.788	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-75.8	129.8	162.9	179.2	0	0	0	0	106.8
507	Q	88.8	Confident	80.7	Confident	10 Å²	10	80 Å²	80	5%	0.047	43%	0.425	C	S	.	.			trans	-87	115.8	170.9	-82.8	171.9	109.3	0	0	108.5	I512 I519 V696 K697 P699	Q507-I512 HydrophobicContact CB-CD1 3.91Å; Q507-I512 HydrophobicContact CG-CD1 3.97Å; Q507-I519 HydrophobicContact CG-CB 4.41Å; Q507-I519 PolarHBondContact NE2-O 3.21Å; Q507-I519 PolarHBondContact OE1-O 2.93Å; Q507-I519 VanDerWaalsContact OE1-O 3.13Å; Q507-V696 HydrophobicContact CG-CG1 4.5Å; Q507-K697 PolarHBondContact NE2-O 3.05Å; Q507-P699 HydrophobicContact CB-CG 4.02Å; Q507-P699 WeakPolarHBondContact O-CA 3.37Å; Q507-P699 WeakPolarHBondContact O-CG 3.21Å
508	T	90	Very high	80.7	Confident	64 Å²	64	79.2 Å²	79.2	39%	0.393	42%	0.42	S	S	.	.			trans	-82.4	154.4	164.8	30	0	0	0	0	110.3	S511 I512	T508-S511 VanDerWaalsContact OG1-CB 3.25Å; T508-S511 WeakPolarHBondContact OG1-CB 3.5Å; T508-S511 PolarHBondContact OG1-OG 2.76Å; T508-I512 WeakPolarHBondContact O-CD1 3.42Å; T508-I512 WeakPolarHBondContact O-CG1 3.45Å
509	W	89.3	Confident	80.8	Confident	38 Å²	38	77.9 Å²	77.9	14%	0.144	41%	0.41	C	S	.	.	H	α-helix	trans	-71.3	-53.4	179.1	178.7	-98	0	0	0	111.4	L389 D391 S511 I512 L513 P699 E701 Q702	L389-W509 HydrophobicContact CB-CH2 3.58Å; L389-W509 HydrophobicContact CB-CZ2 4.46Å; L389-W509 HydrophobicContact CB-CZ3 3.7Å; L389-W509 HydrophobicContact CD1-CE3 4.29Å; L389-W509 HydrophobicContact CD1-CZ3 4.01Å; L389-W509 HydrophobicContact CG-CZ3 4.4Å; D391-W509 HydrophobicContact CB-CH2 4.27Å; D391-W509 HydrophobicContact CB-CZ2 4.38Å; W509-S511 PolarHBondContact O-N 3.13Å; W509-I512 PolarHBondContact O-N 2.95Å; W509-L513 HydrophobicContact CZ2-CD1 4.31Å; W509-L513 VanDerWaalsContact NE1-CD1 3.34Å; W509-L513 PolarHBondContact O-N 2.79Å; W509-P699 HydrophobicContact CB-CB 4.08Å; W509-P699 HydrophobicContact CE3-CB 4.34Å; W509-E701 HydrophobicContact CB-CG 4.19Å; W509-E701 HydrophobicContact CD2-CB 4.43Å; W509-E701 HydrophobicContact CE3-CB 4.38Å; W509-E701 HydrophobicContact CG-CG 4.46Å; W509-Q702 HydrophobicContact CZ3-CB 4.13Å
510	D	89.5	Confident	81.2	Confident	99 Å²	99	75.9 Å²	75.9	53%	0.529	40%	0.397	S	S	.	.	H	α-helix	trans	-64.4	-41.3	-172.5	-45.2	-55.6	0	0	0	112.3	I512 L513 Q514	D510-I512 VanDerWaalsContact C-N 3.27Å; D510-I512 PolarHBondContact O-N 3.34Å; D510-L513 CarbonylContact O-C 3.53Å; D510-L513 PolarHBondContact O-N 3.5Å; D510-L513 VanDerWaalsContact O-N 3.08Å; D510-Q514 WeakPolarHBondContact O-CB 3.43Å; D510-Q514 VanDerWaalsContact O-CG 3.27Å; D510-Q514 WeakPolarHBondContact O-CG 3.39Å; D510-Q514 PolarHBondContact O-N 3.45Å
511	S	89.1	Confident	82	Confident	30 Å²	30	75.7 Å²	75.7	21%	0.21	40%	0.396	C	S	.	.	H	α-helix	trans	-61.3	-35.4	179.1	-45	0	0	0	0	112.1	T508 W509 Q514 G515 E516	T508-S511 VanDerWaalsContact OG1-CB 3.25Å; T508-S511 WeakPolarHBondContact OG1-CB 3.5Å; T508-S511 PolarHBondContact OG1-OG 2.76Å; W509-S511 PolarHBondContact O-N 3.13Å; S511-Q514 CarbonylContact O-C 3.56Å; S511-Q514 PolarHBondContact O-N 2.73Å; S511-G515 PolarHBondContact O-N 2.86Å; S511-E516 WeakPolarHBondContact CB-OE2 3.25Å; S511-E516 VanDerWaalsContact O-CB 3.27Å; S511-E516 WeakPolarHBondContact O-CB 3.47Å; S511-E516 WeakPolarHBondContact O-CG 3.17Å; S511-E516 PolarHBondContact O-N 3.25Å
512	I	89.7	Confident	83.3	Confident	4 Å²	4	65.4 Å²	65.4	2%	0.021	36%	0.357	C	S	.	.	H	α-helix	trans	-70.7	-39.1	174.6	-66.6	166.9	0	0	0	111.2	G386 L389 Q507 T508 W509 D510 Q514 G515 E516 L518 P699	G386-I512 VanDerWaalsContact CA-CG2 3.46Å; L389-I512 HydrophobicContact CD1-CB 4.33Å; L389-I512 HydrophobicContact CD1-CD1 4.3Å; L389-I512 HydrophobicContact CD1-CG2 3.67Å; Q507-I512 HydrophobicContact CB-CD1 3.91Å; Q507-I512 HydrophobicContact CG-CD1 3.97Å; T508-I512 WeakPolarHBondContact O-CD1 3.42Å; T508-I512 WeakPolarHBondContact O-CG1 3.45Å; W509-I512 PolarHBondContact O-N 2.95Å; D510-I512 VanDerWaalsContact C-N 3.27Å; D510-I512 PolarHBondContact O-N 3.34Å; I512-Q514 VanDerWaalsContact C-N 3.25Å; I512-Q514 PolarHBondContact O-N 2.76Å; I512-G515 PolarHBondContact O-N 2.88Å; I512-E516 HydrophobicContact CG1-CB 4.48Å; I512-L518 HydrophobicContact CD1-CD1 3.85Å; I512-L518 HydrophobicContact CG2-CD1 4.07Å; I512-P699 HydrophobicContact CD1-CG 3.88Å
513	L	85.4	Confident	85.4	Confident	83 Å²	83	60.3 Å²	60.3	44%	0.435	32%	0.323	S	S	.	.	H	α-helix	trans	-67.8	-27.6	174.3	-64.8	-175.1	0	0	0	112.4	W509 D510 G515	W509-L513 HydrophobicContact CZ2-CD1 4.31Å; W509-L513 VanDerWaalsContact NE1-CD1 3.34Å; W509-L513 PolarHBondContact O-N 2.79Å; D510-L513 CarbonylContact O-C 3.53Å; D510-L513 PolarHBondContact O-N 3.5Å; D510-L513 VanDerWaalsContact O-N 3.08Å; L513-G515 PolarHBondContact O-N 2.79Å
514	Q	86.8	Confident	87	Confident	162 Å²	162	49.2 Å²	49.2	76%	0.757	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-0.8	170.6	-67.6	166	6.5	0	0	113.5	D510 S511 I512	D510-Q514 WeakPolarHBondContact O-CB 3.43Å; D510-Q514 VanDerWaalsContact O-CG 3.27Å; D510-Q514 WeakPolarHBondContact O-CG 3.39Å; D510-Q514 PolarHBondContact O-N 3.45Å; S511-Q514 CarbonylContact O-C 3.56Å; S511-Q514 PolarHBondContact O-N 2.73Å; I512-Q514 VanDerWaalsContact C-N 3.25Å; I512-Q514 PolarHBondContact O-N 2.76Å
515	G	83	Confident	88.8	Confident	66 Å²	66	48.1 Å²	48.1	68%	0.68	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	108.2	6.1	173.4	0	0	0	0	0	116.4	S511 I512 L513	S511-G515 PolarHBondContact O-N 2.86Å; I512-G515 PolarHBondContact O-N 2.88Å; L513-G515 PolarHBondContact O-N 2.79Å
516	E	86.3	Confident	90.2	Very high	111 Å²	111	46.4 Å²	46.4	52%	0.519	26%	0.256	S	S	.	.			trans	-64	139	169.4	-73.5	-158.9	150.1	0	0	112	S511 I512 L518	S511-E516 WeakPolarHBondContact CB-OE2 3.25Å; S511-E516 VanDerWaalsContact O-CB 3.27Å; S511-E516 WeakPolarHBondContact O-CB 3.47Å; S511-E516 WeakPolarHBondContact O-CG 3.17Å; S511-E516 PolarHBondContact O-N 3.25Å; I512-E516 HydrophobicContact CG1-CB 4.48Å; E516-L518 PolarHBondContact O-N 3.01Å
517	Q	85.5	Confident	90.9	Very high	96 Å²	96	40.3 Å²	40.3	45%	0.449	22%	0.219	S	C	.	.			trans	-64.3	133.3	-172.9	-170	172.4	68.2	0	0	113.2	E492 I519	E492-Q517 HydrophobicContact CB-CG 3.58Å; E492-Q517 WeakPolarHBondContact OE2-CA 3.45Å; E492-Q517 WeakPolarHBondContact OE2-CG 3.35Å; Q517-I519 WeakPolarHBondContact O-CG1 3.5Å; Q517-I519 PolarHBondContact O-N 3.11Å
518	L	89.4	Confident	91.2	Very high	5 Å²	5	39.9 Å²	39.9	3%	0.026	22%	0.217	C	C	.	.			trans	-75.5	77.2	-175.7	-173.2	63.6	0	0	0	113.9	I384 L389 E492 I512 E516 T520 K698	I384-L518 HydrophobicContact CG2-CD2 3.26Å; L389-L518 HydrophobicContact CD1-CD1 3.81Å; L389-L518 HydrophobicContact CD2-CD1 3.95Å; L389-L518 HydrophobicContact CD2-CD2 4.03Å; L389-L518 HydrophobicContact CG-CD1 4.16Å; L389-L518 HydrophobicContact CG-CD2 4.34Å; E492-L518 WeakPolarHBondContact OE2-CB 3.48Å; E492-L518 PolarHBondContact OE2-N 3.27Å; I512-L518 HydrophobicContact CD1-CD1 3.85Å; I512-L518 HydrophobicContact CG2-CD1 4.07Å; E516-L518 PolarHBondContact O-N 3.01Å; L518-T520 PolarHBondContact O-N 2.99Å; L518-T520 PolarHBondContact O-OG1 3.44Å; L518-T520 VanDerWaalsContact O-OG1 3.05Å; L518-K698 HydrophobicContact CD1-CD 3.99Å; L518-K698 PolarHBondContact O-NZ 2.73Å
519	I	90.9	Very high	91.6	Very high	34 Å²	34	39.1 Å²	39.1	17%	0.174	21%	0.207	C	C	.	.			trans	-57.3	109.4	-177.5	-60.3	173.9	0	0	0	112.7	T489 P505 Q507 Q517 V696 K698	T489-I519 HydrophobicContact CG2-CG2 3.29Å; P505-I519 HydrophobicContact CG-CD1 3.37Å; Q507-I519 HydrophobicContact CG-CB 4.41Å; Q507-I519 PolarHBondContact NE2-O 3.21Å; Q507-I519 PolarHBondContact OE1-O 2.93Å; Q507-I519 VanDerWaalsContact OE1-O 3.13Å; Q517-I519 WeakPolarHBondContact O-CG1 3.5Å; Q517-I519 PolarHBondContact O-N 3.11Å; I519-V696 HydrophobicContact CB-CG1 4.35Å; I519-V696 HydrophobicContact CG2-CB 4.2Å; I519-V696 HydrophobicContact CG2-CG1 3.86Å; I519-V696 HydrophobicContact CG2-CG2 4.22Å; I519-K698 VanDerWaalsContact C-NZ 3.34Å; I519-K698 PolarHBondContact O-NZ 2.88Å
520	T	94.2	Very high	92	Very high	8 Å²	8	38 Å²	38	5%	0.049	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	123.3	-176.7	-61.5	0	0	0	0	111.3	D398 T489 K490 L518 K526 K698	D398-T520 HydrophobicContact CB-CG2 4.43Å; T489-T520 CarbonylContact C-O 3.56Å; T489-T520 WeakPolarHBondContact CA-O 3.32Å; K490-T520 WeakPolarHBondContact CB-O 3.45Å; K490-T520 HydrophobicContact CD-CG2 4.32Å; K490-T520 WeakPolarHBondContact CG-O 3.14Å; K490-T520 PolarHBondContact N-O 3.27Å; L518-T520 PolarHBondContact O-N 2.99Å; L518-T520 PolarHBondContact O-OG1 3.44Å; L518-T520 VanDerWaalsContact O-OG1 3.05Å; T520-K526 VanDerWaalsContact CG2-NZ 3.34Å; T520-K698 WeakPolarHBondContact OG1-CE 3.5Å; T520-K698 PolarHBondContact OG1-NZ 2.91Å
521	M	95.8	Very high	92.3	Very high	6 Å²	6	33.3 Å²	33.3	3%	0.03	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.6	147.7	-176.9	-56.1	-56.6	-65.2	0	0	113.6	L487 T489 K490 L500 K526 W695 V696	L487-M521 HydrophobicContact CB-CE 3.83Å; L487-M521 HydrophobicContact CD1-CE 3.84Å; L487-M521 HydrophobicContact CD2-CE 4.39Å; L487-M521 HydrophobicContact CG-CE 4.26Å; T489-M521 HydrophobicContact CG2-SD 3.81Å; K490-M521 WeakPolarHBondContact CE-O 3.28Å; L500-M521 HydrophobicContact CD1-CE 3.65Å; L500-M521 HydrophobicContact CD1-SD 3.96Å; M521-K526 VanDerWaalsContact O-CE 3.29Å; M521-K526 WeakPolarHBondContact O-CE 3.26Å; M521-K526 PolarHBondContact O-NZ 3.38Å; M521-W695 HydrophobicContact CB-CH2 3.9Å; M521-W695 HydrophobicContact CB-CZ2 3.95Å; M521-W695 HydrophobicContact CB-CZ3 4.32Å; M521-W695 HydrophobicContact CE-CD2 4.2Å; M521-W695 HydrophobicContact CE-CE3 3.99Å; M521-W695 HydrophobicContact CE-CZ3 4.38Å; M521-W695 HydrophobicContact CG-CD2 3.98Å; M521-W695 HydrophobicContact CG-CE3 4.3Å; M521-W695 HydrophobicContact CG-CH2 3.98Å; M521-W695 HydrophobicContact CG-CZ2 3.63Å; M521-W695 HydrophobicContact CG-CZ3 4.29Å; M521-V696 HydrophobicContact SD-CB 3.79Å; M521-V696 HydrophobicContact SD-CG2 4.3Å; M521-V696 PolarHBondContact SD-N 2.87Å
522	S	95.5	Very high	92.6	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.168	C	C	.	.			trans	-68.8	163.6	-177.7	81	0	0	0	0	113.4	G459 R488 D525 K526	G459-S522 WeakPolarHBondContact CA-OG 3.41Å; R488-S522 WeakPolarHBondContact O-CB 3.16Å; R488-S522 PolarHBondContact O-N 3.22Å; S522-D525 WeakPolarHBondContact CB-OD2 3.41Å; S522-D525 PolarHBondContact N-OD2 3.49Å; S522-D525 PolarHBondContact O-N 3.08Å; S522-D525 PolarHBondContact OG-N 2.93Å; S522-D525 PolarHBondContact OG-OD1 3.3Å; S522-D525 PolarHBondContact OG-OD2 2.8Å; S522-K526 WeakPolarHBondContact O-CG 3.38Å; S522-K526 PolarHBondContact O-N 2.8Å; S522-K526 VanDerWaalsContact O-N 3.08Å
523	C	96.1	Very high	93	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-70	-35.1	-179.6	-65.9	0	0	0	0	112.7	E402 P457 C458 K490 D525 K526 I527	E402-C523 VanDerWaalsContact CD-SG 3.55Å; E402-C523 HydrophobicContact CG-CB 3.68Å; E402-C523 WeakPolarHBondContact OE1-CB 3.47Å; E402-C523 PolarHBondContact OE1-SG 2.72Å; P457-C523 HydrophobicContact CB-CB 3.85Å; C458-C523 PolarHBondContact O-N 3.44Å; C458-C523 VanDerWaalsContact O-N 3.11Å; K490-C523 PolarHBondContact NZ-SG 2.84Å; C523-D525 VanDerWaalsContact C-N 3.3Å; C523-D525 PolarHBondContact O-N 3.15Å; C523-K526 PolarHBondContact O-N 3.26Å; C523-I527 WeakPolarHBondContact O-CG1 3.48Å; C523-I527 PolarHBondContact O-N 2.89Å
524	T	94.8	Very high	93.6	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-58.2	-44.9	173.8	-53	0	0	0	0	110.6	P457 C458 D460 G461 I527 T528 L563 V566	P457-T524 PolarHBondContact O-OG1 2.78Å; C458-T524 PolarHBondContact O-N 3.22Å; C458-T524 PolarHBondContact O-OG1 3.32Å; D460-T524 PolarHBondContact N-OG1 2.86Å; G461-T524 PolarHBondContact N-OG1 2.84Å; G461-T524 VanDerWaalsContact N-OG1 3.14Å; T524-I527 PolarHBondContact O-N 3.48Å; T524-T528 PolarHBondContact O-N 3.34Å; T524-T528 PolarHBondContact O-OG1 3.15Å; T524-L563 HydrophobicContact CG2-CD1 4.3Å; T524-V566 HydrophobicContact CG2-CG1 3.85Å
525	D	95.5	Very high	94.1	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-68.7	-36.8	-180	-45.5	-26.4	0	0	0	111.2	L487 R488 S522 C523 T528 R529 R570 W695	L487-D525 HydrophobicContact CD2-CB 4.11Å; R488-D525 PolarHBondContact N-OD2 2.97Å; S522-D525 WeakPolarHBondContact CB-OD2 3.41Å; S522-D525 PolarHBondContact N-OD2 3.49Å; S522-D525 PolarHBondContact O-N 3.08Å; S522-D525 PolarHBondContact OG-N 2.93Å; S522-D525 PolarHBondContact OG-OD1 3.3Å; S522-D525 PolarHBondContact OG-OD2 2.8Å; C523-D525 VanDerWaalsContact C-N 3.3Å; C523-D525 PolarHBondContact O-N 3.15Å; D525-T528 WeakPolarHBondContact O-CB 3.37Å; D525-T528 PolarHBondContact O-N 2.79Å; D525-R529 WeakPolarHBondContact O-CB 3.48Å; D525-R529 PolarHBondContact O-N 3.32Å; D525-R570 IonicContact OD1-CZ 2.72Å; D525-R570 IonicContact OD1-NH1 3.95Å; D525-R570 PolarHBondContact OD1-NH1 3.23Å; D525-R570 IonicContact OD1-NH2 2.73Å; D525-R570 PolarHBondContact OD1-NH2 2.87Å; D525-W695 HydrophobicContact CB-CZ3 3.9Å
526	K	97.3	Very high	94.8	Very high	29 Å²	29	17.2 Å²	17.2	13%	0.126	8%	0.079	C	C	.	.	H	α-helix	trans	-66.2	-41.4	174.3	-75.6	166.1	172.7	156.2	0	112.3	D398 V403 T520 M521 S522 C523 R529 W530 W695	D398-K526 IonicContact OD2-NZ 2.95Å; D398-K526 PolarHBondContact OD2-NZ 3.33Å; V403-K526 HydrophobicContact CG2-CD 3.98Å; T520-K526 VanDerWaalsContact CG2-NZ 3.34Å; M521-K526 VanDerWaalsContact O-CE 3.29Å; M521-K526 WeakPolarHBondContact O-CE 3.26Å; M521-K526 PolarHBondContact O-NZ 3.38Å; S522-K526 WeakPolarHBondContact O-CG 3.38Å; S522-K526 PolarHBondContact O-N 2.8Å; S522-K526 VanDerWaalsContact O-N 3.08Å; C523-K526 PolarHBondContact O-N 3.26Å; K526-R529 WeakPolarHBondContact O-CB 3.44Å; K526-R529 PolarHBondContact O-N 2.88Å; K526-W530 HydrophobicContact CB-CH2 4.25Å; K526-W530 HydrophobicContact CB-CZ2 3.71Å; K526-W530 VanDerWaalsContact O-CD1 3.23Å; K526-W530 PolarHBondContact O-N 2.79Å; K526-W530 PolarHBondContact O-NE1 3.06Å; K526-W695 HydrophobicContact CG-CH2 3.95Å
527	I	96.9	Very high	95.3	Very high	2 Å²	2	12.3 Å²	12.3	1%	0.01	6%	0.058	C	C	.	.	H	α-helix	trans	-64.8	-42.4	173.6	-68.5	162.1	0	0	0	110.5	I453 P457 C523 T524 R529 W530 N531 I552 L567	I453-I527 HydrophobicContact CD1-CD1 3.94Å; P457-I527 HydrophobicContact CB-CD1 3.69Å; P457-I527 HydrophobicContact CG-CD1 3.73Å; C523-I527 WeakPolarHBondContact O-CG1 3.48Å; C523-I527 PolarHBondContact O-N 2.89Å; T524-I527 PolarHBondContact O-N 3.48Å; I527-R529 VanDerWaalsContact C-N 3.25Å; I527-R529 PolarHBondContact O-N 3.16Å; I527-W530 HydrophobicContact CB-CE3 4.31Å; I527-W530 HydrophobicContact CG1-CE3 3.75Å; I527-W530 HydrophobicContact CG1-CH2 4.35Å; I527-W530 HydrophobicContact CG1-CZ3 3.53Å; I527-W530 PolarHBondContact O-N 3.39Å; I527-W530 VanDerWaalsContact O-N 3.1Å; I527-N531 PolarHBondContact O-N 3.14Å; I527-N531 PolarHBondContact O-OD1 3.25Å; I527-I552 HydrophobicContact CG2-CD1 3.69Å; I527-L567 HydrophobicContact CB-CD2 4.44Å; I527-L567 HydrophobicContact CG2-CD1 4.18Å; I527-L567 HydrophobicContact CG2-CD2 3.92Å
528	T	95.3	Very high	95.9	Very high	0 Å²	0	8 Å²	8	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-56.2	-42.7	173	-44.1	0	0	0	0	110.9	T524 D525 W530 N531 L567 R570 W683	T524-T528 PolarHBondContact O-N 3.34Å; T524-T528 PolarHBondContact O-OG1 3.15Å; D525-T528 WeakPolarHBondContact O-CB 3.37Å; D525-T528 PolarHBondContact O-N 2.79Å; T528-W530 PolarHBondContact O-N 3.06Å; T528-N531 PolarHBondContact O-N 3.48Å; T528-L567 WeakPolarHBondContact OG1-CD2 3.41Å; T528-R570 HydrophobicContact CG2-CB 3.63Å; T528-R570 HydrophobicContact CG2-CG 4.46Å; T528-R570 PolarHBondContact OG1-NH1 2.75Å; T528-R570 VanDerWaalsContact OG1-NH1 3.16Å; T528-W683 HydrophobicContact CG2-CZ2 3.68Å
529	R	96.6	Very high	96.3	Very high	48 Å²	48	8.5 Å²	8.5	18%	0.181	4%	0.042	C	C	.	.	H	α-helix	trans	-63.1	-39.9	176.6	-172.3	173.7	166	176.4	-10.6	113	D525 K526 I527 I532 L533 Y676 W683 W695	D525-R529 WeakPolarHBondContact O-CB 3.48Å; D525-R529 PolarHBondContact O-N 3.32Å; K526-R529 WeakPolarHBondContact O-CB 3.44Å; K526-R529 PolarHBondContact O-N 2.88Å; I527-R529 VanDerWaalsContact C-N 3.25Å; I527-R529 PolarHBondContact O-N 3.16Å; R529-I532 PolarHBondContact O-N 2.7Å; R529-L533 HydrophobicContact CG-CD1 3.64Å; R529-L533 HydrophobicContact CG-CG 4.24Å; R529-L533 WeakPolarHBondContact O-CB 3.44Å; R529-L533 PolarHBondContact O-N 2.73Å; R529-Y676 PolarHBondContact NH2-OH 2.89Å; R529-W683 HydrophobicContact CB-CE3 4.24Å; R529-W683 HydrophobicContact CB-CH2 3.53Å; R529-W683 HydrophobicContact CB-CZ2 4.46Å; R529-W683 HydrophobicContact CB-CZ3 3.4Å; R529-W683 VanDerWaalsContact CB-CZ3 3.4Å; R529-W683 HydrophobicContact CG-CE3 4Å; R529-W683 HydrophobicContact CG-CH2 4.16Å; R529-W683 HydrophobicContact CG-CZ3 3.48Å; R529-W683 VanDerWaalsContact CG-CZ3 3.48Å; R529-W695 HydrophobicContact CB-CH2 4.37Å; R529-W695 HydrophobicContact CB-CZ3 4.36Å
530	W	97.8	Very high	96.5	Very high	14 Å²	14	6.9 Å²	6.9	5%	0.053	3%	0.033	C	C	.	.	H	α-helix	trans	-71.9	-31.2	179.3	-52.2	-28.5	0	0	0	112.1	E402 V403 R406 M451 K526 I527 T528 I532 G534 L535 Y548	E402-W530 VanDerWaalsContact O-CH2 3.3Å; E402-W530 WeakPolarHBondContact O-CH2 3.45Å; V403-W530 HydrophobicContact CG2-CH2 4.23Å; V403-W530 HydrophobicContact CG2-CZ2 4.49Å; R406-W530 HydrophobicContact CB-CH2 4.34Å; M451-W530 HydrophobicContact CE-CZ3 4.24Å; K526-W530 HydrophobicContact CB-CH2 4.25Å; K526-W530 HydrophobicContact CB-CZ2 3.71Å; K526-W530 VanDerWaalsContact O-CD1 3.23Å; K526-W530 PolarHBondContact O-N 2.79Å; K526-W530 PolarHBondContact O-NE1 3.06Å; I527-W530 HydrophobicContact CB-CE3 4.31Å; I527-W530 HydrophobicContact CG1-CE3 3.75Å; I527-W530 HydrophobicContact CG1-CH2 4.35Å; I527-W530 HydrophobicContact CG1-CZ3 3.53Å; I527-W530 PolarHBondContact O-N 3.39Å; I527-W530 VanDerWaalsContact O-N 3.1Å; T528-W530 PolarHBondContact O-N 3.06Å; W530-I532 PolarHBondContact O-N 3.47Å; W530-I532 VanDerWaalsContact O-N 3.17Å; W530-G534 CarbonylContact O-C 3.6Å; W530-G534 WeakPolarHBondContact O-CA 3.47Å; W530-G534 PolarHBondContact O-N 3.13Å; W530-L535 HydrophobicContact CB-CD2 3.96Å; W530-L535 HydrophobicContact CD2-CD2 4.33Å; W530-L535 HydrophobicContact CE3-CD2 4.16Å; W530-L535 HydrophobicContact CG-CD2 4.25Å; W530-Y548 WeakPolarHBondContact O-CD1 3.27Å
531	N	96.3	Very high	96.6	Very high	2 Å²	2	7.6 Å²	7.6	1%	0.011	4%	0.039	C	C	.	.	H	α-helix	trans	-63.5	-16.4	173.1	-73.1	4.6	0	0	0	113.5	I527 T528 Y548 S584 P586	I527-N531 PolarHBondContact O-N 3.14Å; I527-N531 PolarHBondContact O-OD1 3.25Å; T528-N531 PolarHBondContact O-N 3.48Å; N531-Y548 VanDerWaalsContact O-CE1 3.28Å; N531-Y548 WeakPolarHBondContact O-CE1 3.34Å; N531-S584 WeakPolarHBondContact O-CA 3.49Å; N531-S584 WeakPolarHBondContact O-CB 3.4Å; N531-S584 PolarHBondContact O-N 3.48Å; N531-P586 WeakPolarHBondContact ND2-CD 3.2Å
532	I	96.4	Very high	96.5	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-107.8	-51.7	178	-59.4	161.1	0	0	0	110.8	R529 W530 Y548 Q571 L574 L577 W683	R529-I532 PolarHBondContact O-N 2.7Å; W530-I532 PolarHBondContact O-N 3.47Å; W530-I532 VanDerWaalsContact O-N 3.17Å; I532-Y548 WeakPolarHBondContact O-CE1 3.46Å; I532-Y548 PolarHBondContact O-OH 3.22Å; I532-Q571 HydrophobicContact CD1-CG 4.11Å; I532-Q571 HydrophobicContact CG1-CG 4.18Å; I532-L574 HydrophobicContact CD1-CD2 3.82Å; I532-L574 HydrophobicContact CG1-CD2 3.96Å; I532-L574 HydrophobicContact CG2-CD2 3.83Å; I532-L577 HydrophobicContact CG2-CD1 4.12Å; I532-L577 HydrophobicContact CG2-CD2 4.14Å; I532-W683 HydrophobicContact CD1-CB 4.25Å; I532-W683 HydrophobicContact CD1-CD2 3.77Å; I532-W683 HydrophobicContact CD1-CG 3.47Å; I532-W683 VanDerWaalsContact CD1-CG 3.47Å; I532-W683 HydrophobicContact CD1-CZ2 4.43Å
533	L	97.3	Very high	96.4	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-91.7	-1.7	-172	-51.6	-179.4	0	0	0	114.2	R529 Q536 Y676 A679 K680	R529-L533 HydrophobicContact CG-CD1 3.64Å; R529-L533 HydrophobicContact CG-CG 4.24Å; R529-L533 WeakPolarHBondContact O-CB 3.44Å; R529-L533 PolarHBondContact O-N 2.73Å; L533-Q536 PolarHBondContact O-NE2 3.17Å; L533-Y676 HydrophobicContact CB-CD2 4.28Å; L533-Y676 HydrophobicContact CB-CE2 3.59Å; L533-Y676 HydrophobicContact CD1-CE1 4.28Å; L533-Y676 HydrophobicContact CD1-CE2 4.24Å; L533-Y676 HydrophobicContact CG-CE2 4.46Å; L533-Y676 WeakPolarHBondContact O-CE2 3.45Å; L533-A679 VanDerWaalsContact CD2-C 3.49Å; L533-A679 HydrophobicContact CD2-CB 3.55Å; L533-K680 HydrophobicContact CD1-CB 3.74Å; L533-K680 HydrophobicContact CD1-CG 4.03Å; L533-K680 HydrophobicContact CD2-CB 4.08Å
534	G	97.6	Very high	96.4	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	5%	0.053	C	C	.	.			trans	74	169.1	-171.1	0	0	0	0	0	114.2	W530 Q536 V547	W530-G534 CarbonylContact O-C 3.6Å; W530-G534 WeakPolarHBondContact O-CA 3.47Å; W530-G534 PolarHBondContact O-N 3.13Å; G534-Q536 VanDerWaalsContact C-OE1 3.24Å; G534-Q536 VanDerWaalsContact CA-OE1 3.23Å; G534-V547 CarbonylContact C-O 3.54Å; G534-V547 VanDerWaalsContact CA-O 3.24Å; G534-V547 WeakPolarHBondContact CA-O 3.13Å
535	L	98	Very high	96.4	Very high	2 Å²	2	12.9 Å²	12.9	1%	0.01	6%	0.064	C	C	.	.	S	Bend	trans	-77.6	-29.7	-178.3	-63.4	166	0	0	0	112.2	R406 L409 W530 V547 L549	R406-L535 HydrophobicContact CG-CB 4.26Å; R406-L535 HydrophobicContact CG-CD2 3.96Å; R406-L535 PolarHBondContact NH1-O 3.47Å; L409-L535 HydrophobicContact CD2-CB 4.14Å; L409-L535 HydrophobicContact CD2-CD1 3.68Å; L409-L535 HydrophobicContact CD2-CG 4.44Å; W530-L535 HydrophobicContact CB-CD2 3.96Å; W530-L535 HydrophobicContact CD2-CD2 4.33Å; W530-L535 HydrophobicContact CE3-CD2 4.16Å; W530-L535 HydrophobicContact CG-CD2 4.25Å; L535-V547 WeakPolarHBondContact CB-O 3.24Å; L535-V547 HydrophobicContact CD1-CG1 4.4Å; L535-V547 WeakPolarHBondContact CG-O 3.17Å; L535-V547 PolarHBondContact N-O 3.22Å; L535-L549 HydrophobicContact CD1-CD2 3.69Å; L535-L549 HydrophobicContact CD1-CG 3.85Å; L535-L549 HydrophobicContact CD2-CD1 4.37Å; L535-L549 HydrophobicContact CD2-CD2 4.37Å; L535-L549 HydrophobicContact CD2-CG 4.02Å; L535-L549 HydrophobicContact CG-CG 4.4Å
536	Q	97.7	Very high	96.5	Very high	5 Å²	5	13.7 Å²	13.7	2%	0.023	7%	0.068	C	C	.	.	S	Bend	trans	-66.4	-40.1	-172.7	81.8	-60.8	-24.3	0	0	112.7	L413 L533 G534 L540 V544 V547	L413-Q536 HydrophobicContact CD1-CB 4.19Å; L533-Q536 PolarHBondContact O-NE2 3.17Å; G534-Q536 VanDerWaalsContact C-OE1 3.24Å; G534-Q536 VanDerWaalsContact CA-OE1 3.23Å; Q536-L540 HydrophobicContact CB-CB 3.64Å; Q536-L540 HydrophobicContact CB-CD1 3.92Å; Q536-L540 HydrophobicContact CB-CG 4.43Å; Q536-L540 HydrophobicContact CG-CB 3.87Å; Q536-V544 HydrophobicContact CB-CG2 4.09Å; Q536-V544 HydrophobicContact CG-CG2 3.9Å; Q536-V547 VanDerWaalsContact OE1-N 3.12Å
537	G	97.4	Very high	96.5	Very high	7 Å²	7	12.5 Å²	12.5	7%	0.072	6%	0.064	C	C	.	.	H	α-helix	trans	76.8	173.5	-178.1	0	0	0	0	0	114.7	L539 L540 S541	G537-L539 VanDerWaalsContact C-N 3.35Å; G537-L539 PolarHBondContact O-N 3.42Å; G537-L540 PolarHBondContact O-N 3.38Å; G537-S541 PolarHBondContact O-N 3.09Å; G537-S541 VanDerWaalsContact O-N 3.07Å; G537-S541 PolarHBondContact O-OG 2.89Å
538	A	97.2	Very high	96.5	Very high	7 Å²	7	13.4 Å²	13.4	6%	0.058	7%	0.067	C	C	.	.	H	α-helix	trans	-49.7	-44.8	-169.3	0	0	0	0	0	115.4	S541 K670 A673 Y676	A538-S541 VanDerWaalsContact C-OG 3.29Å; A538-S541 VanDerWaalsContact CA-OG 3.27Å; A538-S541 WeakPolarHBondContact CA-OG 3.34Å; A538-S541 PolarHBondContact O-N 3.07Å; A538-S541 PolarHBondContact O-OG 2.88Å; A538-K670 HydrophobicContact CB-CB 4.1Å; A538-K670 HydrophobicContact CB-CG 4.07Å; A538-A673 HydrophobicContact CB-CB 4.36Å; A538-A673 VanDerWaalsContact O-CB 3.25Å; A538-A673 WeakPolarHBondContact O-CB 3.39Å; A538-Y676 HydrophobicContact CB-CD1 3.55Å; A538-Y676 HydrophobicContact CB-CE1 3.73Å; A538-Y676 HydrophobicContact CB-CG 4.05Å
539	L	97	Very high	96.6	Very high	15 Å²	15	13.6 Å²	13.6	8%	0.079	7%	0.068	C	C	.	.	H	α-helix	trans	-66.5	-51.2	-176.9	-72.7	-177.6	0	0	0	111.8	G537 S541 H542 F642 W645 Y666 A669 K670	G537-L539 VanDerWaalsContact C-N 3.35Å; G537-L539 PolarHBondContact O-N 3.42Å; L539-S541 VanDerWaalsContact C-N 3.26Å; L539-S541 PolarHBondContact O-N 2.64Å; L539-H542 PolarHBondContact O-CD2 3.25Å; L539-H542 PolarHBondContact O-N 2.95Å; L539-F642 HydrophobicContact CD1-CB 4.5Å; L539-F642 HydrophobicContact CD1-CD2 3.84Å; L539-F642 HydrophobicContact CD2-CD2 4.28Å; L539-F642 HydrophobicContact CD2-CE2 4.32Å; L539-W645 HydrophobicContact CB-CG 3.98Å; L539-W645 HydrophobicContact CD1-CB 4.28Å; L539-W645 HydrophobicContact CD1-CG 4.3Å; L539-W645 HydrophobicContact CD2-CD2 3.91Å; L539-W645 HydrophobicContact CD2-CE3 4.4Å; L539-W645 HydrophobicContact CD2-CG 4.1Å; L539-W645 HydrophobicContact CD2-CZ2 4.47Å; L539-W645 HydrophobicContact CG-CG 4.35Å; L539-W645 VanDerWaalsContact O-CD1 3.26Å; L539-W645 PolarHBondContact O-NE1 3.02Å; L539-Y666 HydrophobicContact CD1-CD2 4.13Å; L539-Y666 HydrophobicContact CD1-CE2 3.77Å; L539-A669 HydrophobicContact CD2-CB 3.87Å; L539-K670 HydrophobicContact CD2-CG 3.64Å; L539-K670 HydrophobicContact CG-CD 4.36Å; L539-K670 HydrophobicContact CG-CG 3.75Å
540	L	96.7	Very high	96.6	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-64.5	-30.2	176.9	-91.2	171.1	0	0	0	112.6	I410 L413 Y414 Q536 G537 H542 F543 V544	I410-L540 HydrophobicContact CB-CD1 4.46Å; I410-L540 HydrophobicContact CG1-CD1 4.36Å; I410-L540 HydrophobicContact CG2-CD1 3.94Å; L413-L540 HydrophobicContact CB-CD1 3.83Å; L413-L540 HydrophobicContact CD1-CD1 4.06Å; Y414-L540 HydrophobicContact CD1-CD2 3.51Å; Y414-L540 HydrophobicContact CD1-CG 4.07Å; Y414-L540 HydrophobicContact CE1-CD1 4.4Å; Y414-L540 HydrophobicContact CE1-CD2 3.36Å; Y414-L540 HydrophobicContact CE1-CG 3.57Å; Y414-L540 HydrophobicContact CE2-CG 4.4Å; Y414-L540 HydrophobicContact CG-CD2 4.31Å; Q536-L540 HydrophobicContact CB-CB 3.64Å; Q536-L540 HydrophobicContact CB-CD1 3.92Å; Q536-L540 HydrophobicContact CB-CG 4.43Å; Q536-L540 HydrophobicContact CG-CB 3.87Å; G537-L540 PolarHBondContact O-N 3.38Å; L540-H542 PolarHBondContact O-N 2.89Å; L540-F543 PolarHBondContact O-N 2.88Å; L540-V544 HydrophobicContact CB-CG2 4.11Å; L540-V544 HydrophobicContact CD2-CG1 4.48Å; L540-V544 HydrophobicContact CD2-CG2 4.48Å; L540-V544 PolarHBondContact O-N 3.35Å
541	S	96.3	Very high	96.4	Very high	23 Å²	23	13.8 Å²	13.8	16%	0.161	7%	0.072	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	5.9	177.5	56.9	0	0	0	0	115.8	G537 A538 L539 V544 Y581	G537-S541 PolarHBondContact O-N 3.09Å; G537-S541 VanDerWaalsContact O-N 3.07Å; G537-S541 PolarHBondContact O-OG 2.89Å; A538-S541 VanDerWaalsContact C-OG 3.29Å; A538-S541 VanDerWaalsContact CA-OG 3.27Å; A538-S541 WeakPolarHBondContact CA-OG 3.34Å; A538-S541 PolarHBondContact O-N 3.07Å; A538-S541 PolarHBondContact O-OG 2.88Å; L539-S541 VanDerWaalsContact C-N 3.26Å; L539-S541 PolarHBondContact O-N 2.64Å; S541-V544 WeakPolarHBondContact CA-O 3.39Å; S541-Y581 WeakPolarHBondContact CB-OH 3.27Å
542	H	93.8	Very high	96.4	Very high	55 Å²	55	13.7 Å²	13.7	26%	0.255	7%	0.071	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-29.6	159.4	-78.6	-89.1	0	0	0	112.5	L539 L540 W645 A669	L539-H542 PolarHBondContact O-CD2 3.25Å; L539-H542 PolarHBondContact O-N 2.95Å; L540-H542 PolarHBondContact O-N 2.89Å; H542-W645 AromaticContact CD2-CZ2 3.73Å; H542-W645 AromaticContact CD2-NE1 3.88Å; H542-W645 AromaticContact NE2-CZ2 3.91Å; H542-A669 PolarHBondContact NE2-O 3.5Å
543	F	93.3	Very high	96.2	Very high	10 Å²	10	13.7 Å²	13.7	4%	0.044	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.8	-36.5	-173.4	-42.5	-50	0	0	0	112.3	L417 C440 Y441 L540 W645 L648 Y649 L652	L417-F543 HydrophobicContact CD2-CB 3.72Å; L417-F543 HydrophobicContact CD2-CD2 3.81Å; L417-F543 HydrophobicContact CD2-CG 4.06Å; C440-F543 WeakPolarHBondContact CA-O 3.44Å; Y441-F543 HydrophobicContact CD2-CB 4.31Å; Y441-F543 WeakPolarHBondContact CD2-O 3.25Å; Y441-F543 PolarHBondContact N-O 3.23Å; L540-F543 PolarHBondContact O-N 2.88Å; F543-W645 AromaticContact CE2-CD1 3.47Å; F543-W645 VanDerWaalsContact CE2-CD1 3.47Å; F543-W645 HydrophobicContact CE2-CG 4.38Å; F543-W645 AromaticContact CE2-NE1 3.48Å; F543-W645 AromaticContact CZ-CD1 3.9Å; F543-W645 AromaticContact CZ-NE1 3.5Å; F543-L648 HydrophobicContact CE2-CB 3.92Å; F543-L648 HydrophobicContact CZ-CB 4.21Å; F543-Y649 HydrophobicContact CE1-CD2 4.12Å; F543-Y649 HydrophobicContact CZ-CD2 4.19Å; F543-L652 HydrophobicContact CD1-CD1 3.5Å; F543-L652 VanDerWaalsContact CD1-CD1 3.5Å; F543-L652 HydrophobicContact CE1-CD1 3.73Å; F543-L652 HydrophobicContact CG-CD1 4.02Å; F543-L652 HydrophobicContact CZ-CD1 4.41Å
544	V	94.9	Very high	95.8	Very high	6 Å²	6	13.8 Å²	13.8	4%	0.036	7%	0.072	C	C	.	.	B	Isolated β-bridge	trans	-118.8	143.3	-170.5	-44	0	0	0	0	113.4	L417 F433 Y441 Q536 L540 S541	L417-V544 HydrophobicContact CD2-CG1 4.12Å; F433-V544 HydrophobicContact CD1-CG1 4.27Å; F433-V544 HydrophobicContact CE1-CB 3.87Å; F433-V544 HydrophobicContact CE1-CG1 3.64Å; F433-V544 HydrophobicContact CE1-CG2 4.46Å; F433-V544 HydrophobicContact CZ-CB 4.34Å; F433-V544 HydrophobicContact CZ-CG1 3.81Å; Y441-V544 VanDerWaalsContact O-CA 3.24Å; Y441-V544 WeakPolarHBondContact O-CA 3.47Å; Q536-V544 HydrophobicContact CB-CG2 4.09Å; Q536-V544 HydrophobicContact CG-CG2 3.9Å; L540-V544 HydrophobicContact CB-CG2 4.11Å; L540-V544 HydrophobicContact CD2-CG1 4.48Å; L540-V544 HydrophobicContact CD2-CG2 4.48Å; L540-V544 PolarHBondContact O-N 3.35Å; S541-V544 WeakPolarHBondContact CA-O 3.39Å
545	E	95.6	Very high	95.2	Very high	46 Å²	46	14 Å²	14	22%	0.215	7%	0.074	C	C	.	.			trans	-63.6	158.3	171.7	-65.2	-168.9	156.6	0	0	112.2	H436 Y441 R442 V547 T580	H436-E545 IonicContact CE1-OE1 3.78Å; H436-E545 PolarHBondContact CE1-OE1 2.87Å; H436-E545 IonicContact CG-OE1 3.52Å; H436-E545 IonicContact ND1-OE1 3.89Å; H436-E545 PolarHBondContact ND1-OE1 3.11Å; H436-E545 IonicContact ND1-OE2 2.87Å; Y441-E545 PolarHBondContact O-N 3.41Å; R442-E545 HydrophobicContact CB-CB 4.41Å; R442-E545 HydrophobicContact CB-CG 4.25Å; R442-E545 VanDerWaalsContact CB-OE2 3.29Å; R442-E545 WeakPolarHBondContact CB-OE2 3.33Å; E545-V547 PolarHBondContact O-N 3.02Å; E545-V547 VanDerWaalsContact O-N 3.1Å; E545-T580 HydrophobicContact CG-CG2 4.48Å
546	P	96.9	Very high	94.1	Very high	16 Å²	16	14.3 Å²	14.3	10%	0.104	8%	0.076	C	C	.	.			trans	-61.6	114.5	-174.3	-26.6	38.4	0	0	0	113.5	Y548 T580 Y581	P546-Y548 HydrophobicContact CB-CD2 4.5Å; P546-Y548 HydrophobicContact CB-CE2 3.64Å; P546-Y548 WeakPolarHBondContact O-CD2 3.35Å; P546-Y548 VanDerWaalsContact O-CE2 3.28Å; P546-Y548 WeakPolarHBondContact O-CE2 3.46Å; P546-T580 WeakPolarHBondContact CD-O 3.49Å; P546-T580 WeakPolarHBondContact CG-O 3.44Å; P546-Y581 HydrophobicContact CB-CD1 4.24Å; P546-Y581 HydrophobicContact CB-CE1 4.17Å; P546-Y581 HydrophobicContact CG-CD1 3.74Å; P546-Y581 HydrophobicContact CG-CD2 3.82Å; P546-Y581 HydrophobicContact CG-CE1 3.58Å; P546-Y581 HydrophobicContact CG-CE2 3.64Å; P546-Y581 HydrophobicContact CG-CG 3.84Å
547	V	97.6	Very high	92.5	Very high	5 Å²	5	18 Å²	18	3%	0.03	10%	0.096	C	C	.	.			trans	-88.2	125.1	179.6	-179.3	0	0	0	0	109.3	L413 L443 F449 G534 L535 Q536 E545	L413-V547 HydrophobicContact CD1-CG2 4.49Å; L443-V547 HydrophobicContact CD2-CG1 4.34Å; F449-V547 HydrophobicContact CD2-CG1 3.63Å; F449-V547 HydrophobicContact CE2-CG1 3.69Å; G534-V547 CarbonylContact C-O 3.54Å; G534-V547 VanDerWaalsContact CA-O 3.24Å; G534-V547 WeakPolarHBondContact CA-O 3.13Å; L535-V547 WeakPolarHBondContact CB-O 3.24Å; L535-V547 HydrophobicContact CD1-CG1 4.4Å; L535-V547 WeakPolarHBondContact CG-O 3.17Å; L535-V547 PolarHBondContact N-O 3.22Å; Q536-V547 VanDerWaalsContact OE1-N 3.12Å; E545-V547 PolarHBondContact O-N 3.02Å; E545-V547 VanDerWaalsContact O-N 3.1Å
548	Y	97.8	Very high	90.8	Very high	21 Å²	21	20.8 Å²	20.8	8%	0.082	10%	0.104	C	C	.	.			trans	-113.9	163.3	-178.1	-63	-80.8	0	0	0	112.2	W530 N531 I532 P546 R582	W530-Y548 WeakPolarHBondContact O-CD1 3.27Å; N531-Y548 VanDerWaalsContact O-CE1 3.28Å; N531-Y548 WeakPolarHBondContact O-CE1 3.34Å; I532-Y548 WeakPolarHBondContact O-CE1 3.46Å; I532-Y548 PolarHBondContact O-OH 3.22Å; P546-Y548 HydrophobicContact CB-CD2 4.5Å; P546-Y548 HydrophobicContact CB-CE2 3.64Å; P546-Y548 WeakPolarHBondContact O-CD2 3.35Å; P546-Y548 VanDerWaalsContact O-CE2 3.28Å; P546-Y548 WeakPolarHBondContact O-CE2 3.46Å; Y548-R582 HydrophobicContact CD2-CG 4.29Å; Y548-R582 HydrophobicContact CE2-CG 3.67Å; Y548-R582 PolarHBondContact OH-N 3.24Å; Y548-R582 PolarHBondContact OH-O 2.96Å
549	L	97.1	Very high	89.2	Confident	4 Å²	4	22.9 Å²	22.9	2%	0.021	11%	0.113	C	C	.	.			trans	-78.1	138.5	164.8	-65.6	173.4	0	0	0	109.5	F449 M451 L535 I552 P586	F449-L549 HydrophobicContact CB-CD2 4.23Å; F449-L549 CarbonylContact O-C 3.54Å; F449-L549 WeakPolarHBondContact O-CA 3.2Å; M451-L549 HydrophobicContact CB-CD1 3.71Å; M451-L549 HydrophobicContact CB-CD2 3.9Å; M451-L549 HydrophobicContact CB-CG 4.45Å; M451-L549 HydrophobicContact CE-CD1 4.25Å; M451-L549 HydrophobicContact SD-CD1 4.12Å; L535-L549 HydrophobicContact CD1-CD2 3.69Å; L535-L549 HydrophobicContact CD1-CG 3.85Å; L535-L549 HydrophobicContact CD2-CD1 4.37Å; L535-L549 HydrophobicContact CD2-CD2 4.37Å; L535-L549 HydrophobicContact CD2-CG 4.02Å; L535-L549 HydrophobicContact CG-CG 4.4Å; L549-I552 HydrophobicContact CD1-CD1 4.09Å; L549-I552 HydrophobicContact CD1-CG1 3.88Å; L549-P586 HydrophobicContact CB-CB 4.26Å
550	Q	95.4	Very high	87.7	Confident	65 Å²	65	23.9 Å²	23.9	30%	0.304	12%	0.119	S	C	.	.	S	Bend	trans	-83.5	-35.2	168.7	-176.8	65.6	-2	0	0	111.2	L367 H448 F449 P586 L587	L367-Q550 HydrophobicContact CD2-CG 4.3Å; H448-Q550 HydrophobicContact CB-CB 4.2Å; H448-Q550 HydrophobicContact CB-CG 4.43Å; F449-Q550 PolarHBondContact O-N 3.07Å; Q550-P586 WeakPolarHBondContact O-CA 3.45Å; Q550-L587 WeakPolarHBondContact O-CG 3.46Å; Q550-L587 PolarHBondContact O-N 3.06Å
551	S	94.8	Very high	86.3	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	161.3	175.7	77.4	0	0	0	0	114.6	L325 H450 M451 L587	L325-S551 WeakPolarHBondContact CD2-OG 3.45Å; H450-S551 PolarHBondContact ND1-OG 3.03Å; M451-S551 PolarHBondContact N-O 2.99Å; S551-L587 CarbonylContact C-O 3.58Å; S551-L587 WeakPolarHBondContact CA-O 3.36Å; S551-L587 WeakPolarHBondContact CB-O 3.41Å
552	I	94.8	Very high	85.2	Confident	1 Å²	1	25.4 Å²	25.4	1%	0.005	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	117.4	169.1	-52	175.1	0	0	0	109.5	M451 I453 I527 L549 V554 P586 L587 L588 S589	M451-I552 CarbonylContact O-C 3.56Å; M451-I552 VanDerWaalsContact O-CA 3.26Å; M451-I552 WeakPolarHBondContact O-CA 3.41Å; I453-I552 HydrophobicContact CD1-CG2 4.11Å; I453-I552 HydrophobicContact CG1-CG2 4.36Å; I527-I552 HydrophobicContact CG2-CD1 3.69Å; L549-I552 HydrophobicContact CD1-CD1 4.09Å; L549-I552 HydrophobicContact CD1-CG1 3.88Å; I552-V554 HydrophobicContact CG2-CG2 4.26Å; I552-P586 HydrophobicContact CD1-CB 4.47Å; I552-P586 HydrophobicContact CD1-CG 3.85Å; I552-P586 HydrophobicContact CG1-CB 4.16Å; I552-P586 HydrophobicContact CG1-CG 4.09Å; I552-L587 PolarHBondContact N-O 3.03Å; I552-L588 HydrophobicContact CB-CD2 3.76Å; I552-L588 HydrophobicContact CD1-CD2 4.27Å; I552-L588 HydrophobicContact CG1-CD2 4.25Å; I552-S589 PolarHBondContact O-N 3.12Å
553	T	93	Very high	84.6	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	131	174.2	-59.9	0	0	0	0	110.5	A330 M451 Y452 I453 S589 L591	A330-T553 HydrophobicContact CB-CG2 4.08Å; A330-T553 WeakPolarHBondContact O-CG2 3.49Å; M451-T553 PolarHBondContact O-N 3.07Å; Y452-T553 HydrophobicContact CD2-CG2 4.06Å; I453-T553 PolarHBondContact N-O 3.33Å; T553-S589 WeakPolarHBondContact CA-O 3.44Å; T553-L591 HydrophobicContact CG2-CD2 3.49Å; T553-L591 VanDerWaalsContact CG2-CD2 3.49Å; T553-L591 HydrophobicContact CG2-CG 4.4Å
554	V	89.6	Confident	84	Confident	2 Å²	2	22.8 Å²	22.8	1%	0.012	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	117.3	-176	-176.2	0	0	0	0	112.2	I453 I552 S556 T560 L563 S589 G590	I453-V554 WeakPolarHBondContact O-CA 3.41Å; I552-V554 HydrophobicContact CG2-CG2 4.26Å; V554-S556 WeakPolarHBondContact CG1-O 3.4Å; V554-T560 HydrophobicContact CB-CG2 4.4Å; V554-L563 HydrophobicContact CG2-CD2 4.06Å; V554-S589 PolarHBondContact N-O 2.88Å; V554-G590 WeakPolarHBondContact O-CA 3.36Å
555	G	83.6	Confident	83.1	Confident	4 Å²	4	29.2 Å²	29.2	4%	0.041	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65	-63	-176.6	0	0	0	0	0	115.1	I453 S454 R558	I453-G555 PolarHBondContact O-N 3.45Å; S454-G555 CarbonylContact O-C 3.56Å; S454-G555 WeakPolarHBondContact O-CA 3.26Å; G555-R558 PolarHBondContact O-NE 2.99Å; G555-R558 PolarHBondContact O-NH2 3.07Å
556	S	76.4	Confident	82.5	Confident	8 Å²	8	27.1 Å²	27.1	6%	0.056	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	159.6	-179	84.7	0	0	0	0	113.1	S454 T455 S456 V554 Q600	S454-S556 PolarHBondContact O-N 2.94Å; S454-S556 PolarHBondContact O-OG 2.8Å; T455-S556 WeakPolarHBondContact CA-O 3.37Å; T455-S556 VanDerWaalsContact CB-OG 3.25Å; T455-S556 WeakPolarHBondContact CB-OG 3.47Å; T455-S556 PolarHBondContact OG1-OG 3.23Å; S456-S556 PolarHBondContact N-O 3.44Å; S456-S556 VanDerWaalsContact N-O 3.08Å; V554-S556 WeakPolarHBondContact CG1-O 3.4Å; S556-Q600 PolarHBondContact OG-NE2 3.1Å
557	L	63.9	Low	82	Confident	84 Å²	84	26.6 Å²	26.6	44%	0.44	13%	0.134	S	C	.	.	S	Bend	trans	59.5	55	-172.2	-53.2	175.3	0	0	0	111.7	R462 H559	R462-L557 HydrophobicContact CG-CD1 3.8Å; L557-H559 PolarHBondContact O-N 3.03Å
558	R	61.1	Low	81.2	Confident	64 Å²	64	28.4 Å²	28.4	24%	0.242	15%	0.145	C	C	.	.			trans	-70.8	39.5	-168	-58.6	-179	-172.6	159.5	3.2	115.6	G555 T560 L591 S592 N593	G555-R558 PolarHBondContact O-NE 2.99Å; G555-R558 PolarHBondContact O-NH2 3.07Å; R558-T560 PolarHBondContact O-N 3.44Å; R558-L591 PolarHBondContact NE-O 3.15Å; R558-L591 PolarHBondContact NH1-O 2.77Å; R558-S592 PolarHBondContact NH1-O 3.23Å; R558-N593 PolarHBondContact NH2-O 2.99Å
559	H	64.3	Low	80.4	Confident	52 Å²	52	31.3 Å²	31.3	24%	0.241	16%	0.159	C	C	.	.			trans	-79.3	54.5	169.1	-61.2	-54.8	0	0	0	110.8	N464 L557 G561 H562 L563	N464-H559 HydrophobicContact CB-CB 4.34Å; N464-H559 PolarHBondContact ND2-CD2 3.44Å; N464-H559 VanDerWaalsContact ND2-CD2 3.3Å; N464-H559 PolarHBondContact ND2-NE2 3.41Å; N464-H559 PolarHBondContact O-CD2 2.9Å; N464-H559 PolarHBondContact O-NE2 3.46Å; L557-H559 PolarHBondContact O-N 3.03Å; H559-G561 PolarHBondContact O-N 2.95Å; H559-H562 HydrophobicContact CB-CB 3.93Å; H559-H562 WeakPolarHBondContact O-CA 3.33Å; H559-H562 WeakPolarHBondContact O-CB 3.36Å; H559-H562 PolarHBondContact O-N 2.97Å; H559-L563 PolarHBondContact O-N 2.83Å
560	T	66	Low	79.8	Confident	35 Å²	35	31.4 Å²	31.4	22%	0.215	16%	0.159	C	C	.	.	H	α-helix	trans	-57.5	-37.1	178.6	51.1	0	0	0	0	111.6	V554 R558 H562 L563 G564 L588 S589	V554-T560 HydrophobicContact CB-CG2 4.4Å; R558-T560 PolarHBondContact O-N 3.44Å; T560-H562 VanDerWaalsContact C-N 3.29Å; T560-H562 PolarHBondContact O-N 2.99Å; T560-L563 PolarHBondContact O-N 3.36Å; T560-G564 PolarHBondContact O-N 2.71Å; T560-L588 WeakPolarHBondContact O-CD1 3.39Å; T560-S589 WeakPolarHBondContact CG2-O 3.33Å
561	G	66.5	Low	79.3	Confident	36 Å²	36	28.5 Å²	28.5	37%	0.371	15%	0.146	S	C	.	.	H	α-helix	trans	-66.3	-22.7	171.6	0	0	0	0	0	114.8	H559 R565	H559-G561 PolarHBondContact O-N 2.95Å; G561-R565 WeakPolarHBondContact O-CG 3.29Å; G561-R565 PolarHBondContact O-N 3.4Å; G561-R565 PolarHBondContact O-NH1 3.37Å
562	H	73.6	Confident	78.5	Confident	20 Å²	20	34.9 Å²	34.9	9%	0.093	18%	0.176	C	C	.	.	H	α-helix	trans	-79.2	-49.6	168.4	177.5	75.5	0	0	0	110.7	D460 N464 H559 T560 G564 R565 V566	D460-H562 PolarHBondContact O-NE2 3.44Å; D460-H562 IonicContact OD2-CE1 3.82Å; D460-H562 IonicContact OD2-NE2 3.72Å; N464-H562 HydrophobicContact CB-CB 3.94Å; H559-H562 HydrophobicContact CB-CB 3.93Å; H559-H562 WeakPolarHBondContact O-CA 3.33Å; H559-H562 WeakPolarHBondContact O-CB 3.36Å; H559-H562 PolarHBondContact O-N 2.97Å; T560-H562 VanDerWaalsContact C-N 3.29Å; T560-H562 PolarHBondContact O-N 2.99Å; H562-G564 PolarHBondContact O-N 2.97Å; H562-R565 PolarHBondContact ND1-NH2 2.91Å; H562-R565 PolarHBondContact O-N 3.08Å; H562-R565 VanDerWaalsContact O-N 3.08Å; H562-V566 WeakPolarHBondContact NE2-CG2 3.22Å; H562-V566 WeakPolarHBondContact O-CG2 3.31Å; H562-V566 PolarHBondContact O-N 3.38Å
563	L	81.3	Confident	78	Confident	2 Å²	2	43.6 Å²	43.6	1%	0.01	21%	0.209	C	C	.	.	H	α-helix	trans	-52.7	-44.1	175.5	-179.7	62.4	0	0	0	111.3	P457 T524 V554 H559 T560 V566 L567 L588	P457-L563 HydrophobicContact CG-CD1 3.99Å; P457-L563 HydrophobicContact CG-CD2 4.47Å; T524-L563 HydrophobicContact CG2-CD1 4.3Å; V554-L563 HydrophobicContact CG2-CD2 4.06Å; H559-L563 PolarHBondContact O-N 2.83Å; T560-L563 PolarHBondContact O-N 3.36Å; L563-V566 PolarHBondContact O-N 3.02Å; L563-L567 HydrophobicContact CD1-CD1 4.08Å; L563-L567 HydrophobicContact CD1-CG 4.14Å; L563-L567 HydrophobicContact CG-CD1 3.99Å; L563-L567 HydrophobicContact CG-CG 4.41Å; L563-L567 WeakPolarHBondContact O-CB 3.16Å; L563-L567 VanDerWaalsContact O-CG 3.26Å; L563-L567 WeakPolarHBondContact O-CG 3.28Å; L563-L567 PolarHBondContact O-N 2.91Å; L563-L588 HydrophobicContact CB-CD1 4.35Å; L563-L588 HydrophobicContact CD2-CD1 4.47Å; L563-L588 HydrophobicContact CG-CD1 4.23Å
564	G	79	Confident	77.7	Confident	8 Å²	8	43.9 Å²	43.9	8%	0.082	21%	0.21	C	C	.	.	H	α-helix	trans	-61.6	-46.8	175.3	0	0	0	0	0	113.4	T560 H562 V566 L567 T568 L588	T560-G564 PolarHBondContact O-N 2.71Å; H562-G564 PolarHBondContact O-N 2.97Å; G564-V566 VanDerWaalsContact C-N 3.33Å; G564-V566 PolarHBondContact O-N 3.34Å; G564-L567 PolarHBondContact O-N 3.03Å; G564-T568 WeakPolarHBondContact O-CB 3.08Å; G564-T568 PolarHBondContact O-N 2.81Å; G564-T568 PolarHBondContact O-OG1 3.47Å; G564-L588 VanDerWaalsContact N-CD1 3.33Å
565	R	76.3	Confident	77.6	Confident	141 Å²	141	45.3 Å²	45.3	53%	0.532	23%	0.225	S	C	.	.	H	α-helix	trans	-58	-45.3	173.6	-74.8	-174.2	-48.8	-97	6.2	111.7	G561 H562 T568 Q569	G561-R565 WeakPolarHBondContact O-CG 3.29Å; G561-R565 PolarHBondContact O-N 3.4Å; G561-R565 PolarHBondContact O-NH1 3.37Å; H562-R565 PolarHBondContact ND1-NH2 2.91Å; H562-R565 PolarHBondContact O-N 3.08Å; H562-R565 VanDerWaalsContact O-N 3.08Å; R565-T568 PolarHBondContact O-N 3.42Å; R565-Q569 WeakPolarHBondContact O-CB 3.49Å; R565-Q569 PolarHBondContact O-N 3.17Å
566	V	83.1	Confident	77.9	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.006	26%	0.257	C	S	.	.	H	α-helix	trans	-63.9	-46.4	179.5	174.5	0	0	0	0	111.4	D460 T524 H562 L563 G564 T568 R570	D460-V566 HydrophobicContact CB-CG1 4.1Å; D460-V566 WeakPolarHBondContact OD2-CG2 3.42Å; T524-V566 HydrophobicContact CG2-CG1 3.85Å; H562-V566 WeakPolarHBondContact NE2-CG2 3.22Å; H562-V566 WeakPolarHBondContact O-CG2 3.31Å; H562-V566 PolarHBondContact O-N 3.38Å; L563-V566 PolarHBondContact O-N 3.02Å; G564-V566 VanDerWaalsContact C-N 3.33Å; G564-V566 PolarHBondContact O-N 3.34Å; V566-T568 VanDerWaalsContact C-N 3.31Å; V566-T568 PolarHBondContact O-N 3.37Å; V566-R570 VanDerWaalsContact O-CD 3.28Å; V566-R570 WeakPolarHBondContact O-CD 3.49Å; V566-R570 VanDerWaalsContact O-CG 3.27Å; V566-R570 WeakPolarHBondContact O-CG 3.46Å; V566-R570 PolarHBondContact O-N 3.43Å
567	L	86.1	Confident	78.7	Confident	6 Å²	6	51.6 Å²	51.6	3%	0.031	26%	0.263	C	S	.	.	H	α-helix	trans	-66.2	-30.2	178.5	-69	178.4	0	0	0	112.9	I527 T528 L563 G564 Q571	I527-L567 HydrophobicContact CB-CD2 4.44Å; I527-L567 HydrophobicContact CG2-CD1 4.18Å; I527-L567 HydrophobicContact CG2-CD2 3.92Å; T528-L567 WeakPolarHBondContact OG1-CD2 3.41Å; L563-L567 HydrophobicContact CD1-CD1 4.08Å; L563-L567 HydrophobicContact CD1-CG 4.14Å; L563-L567 HydrophobicContact CG-CD1 3.99Å; L563-L567 HydrophobicContact CG-CG 4.41Å; L563-L567 WeakPolarHBondContact O-CB 3.16Å; L563-L567 VanDerWaalsContact O-CG 3.26Å; L563-L567 WeakPolarHBondContact O-CG 3.28Å; L563-L567 PolarHBondContact O-N 2.91Å; G564-L567 PolarHBondContact O-N 3.03Å; L567-Q571 WeakPolarHBondContact O-CG 3.31Å; L567-Q571 PolarHBondContact O-NE2 3.49Å
568	T	81.9	Confident	80.1	Confident	43 Å²	43	49 Å²	49	26%	0.264	25%	0.251	S	S	.	.	H	α-helix	trans	-82.6	-48.1	176.8	-66.2	0	0	0	0	112.3	G564 R565 V566 R570 Q571 E572	G564-T568 WeakPolarHBondContact O-CB 3.08Å; G564-T568 PolarHBondContact O-N 2.81Å; G564-T568 PolarHBondContact O-OG1 3.47Å; R565-T568 PolarHBondContact O-N 3.42Å; V566-T568 VanDerWaalsContact C-N 3.31Å; V566-T568 PolarHBondContact O-N 3.37Å; T568-R570 PolarHBondContact O-N 2.85Å; T568-Q571 WeakPolarHBondContact O-CA 3.46Å; T568-Q571 WeakPolarHBondContact O-CB 3.32Å; T568-Q571 PolarHBondContact O-N 3.19Å; T568-E572 HydrophobicContact CG2-CG 4.49Å; T568-E572 PolarHBondContact O-N 3.25Å
569	Q	80.8	Confident	81.3	Confident	82 Å²	82	51.2 Å²	51.2	38%	0.383	28%	0.283	S	S	.	.	H	α-helix	trans	-56.6	-38.7	-177	-172.3	-176	3.1	0	0	112.1	S485 R565 Q571 E572	S485-Q569 PolarHBondContact OG-OE1 3.25Å; R565-Q569 WeakPolarHBondContact O-CB 3.49Å; R565-Q569 PolarHBondContact O-N 3.17Å; Q569-Q571 PolarHBondContact O-N 2.98Å; Q569-Q571 VanDerWaalsContact O-N 3.13Å; Q569-E572 PolarHBondContact O-N 3.48Å
570	R	84.8	Confident	82.5	Confident	5 Å²	5	52 Å²	52	2%	0.019	29%	0.292	C	S	.	.	H	α-helix	trans	-71.5	1.3	176.1	-66.5	168.5	169.4	-164.3	-9.3	114.9	S485 H486 D525 T528 V566 T568 W683 L692	S485-R570 PolarHBondContact O-NE 3.44Å; S485-R570 PolarHBondContact O-NH2 3.35Å; S485-R570 VanDerWaalsContact O-NH2 3.15Å; H486-R570 PolarHBondContact O-NH2 2.75Å; D525-R570 IonicContact OD1-CZ 2.72Å; D525-R570 IonicContact OD1-NH1 3.95Å; D525-R570 PolarHBondContact OD1-NH1 3.23Å; D525-R570 IonicContact OD1-NH2 2.73Å; D525-R570 PolarHBondContact OD1-NH2 2.87Å; T528-R570 HydrophobicContact CG2-CB 3.63Å; T528-R570 HydrophobicContact CG2-CG 4.46Å; T528-R570 PolarHBondContact OG1-NH1 2.75Å; T528-R570 VanDerWaalsContact OG1-NH1 3.16Å; V566-R570 VanDerWaalsContact O-CD 3.28Å; V566-R570 WeakPolarHBondContact O-CD 3.49Å; V566-R570 VanDerWaalsContact O-CG 3.27Å; V566-R570 WeakPolarHBondContact O-CG 3.46Å; V566-R570 PolarHBondContact O-N 3.43Å; T568-R570 PolarHBondContact O-N 2.85Å; R570-W683 PolarHBondContact O-NE1 2.9Å; R570-L692 HydrophobicContact CG-CD1 3.97Å
571	Q	84.3	Confident	83.8	Confident	4 Å²	4	51.1 Å²	51.1	2%	0.019	29%	0.285	C	S	.	.	H	α-helix	trans	-118.9	-9.8	175.3	-61.9	-173.2	75	0	0	112.7	I532 L567 T568 Q569 R573 L574 S584	I532-Q571 HydrophobicContact CD1-CG 4.11Å; I532-Q571 HydrophobicContact CG1-CG 4.18Å; L567-Q571 WeakPolarHBondContact O-CG 3.31Å; L567-Q571 PolarHBondContact O-NE2 3.49Å; T568-Q571 WeakPolarHBondContact O-CA 3.46Å; T568-Q571 WeakPolarHBondContact O-CB 3.32Å; T568-Q571 PolarHBondContact O-N 3.19Å; Q569-Q571 PolarHBondContact O-N 2.98Å; Q569-Q571 VanDerWaalsContact O-N 3.13Å; Q571-R573 PolarHBondContact O-N 2.94Å; Q571-L574 WeakPolarHBondContact O-CB 3.43Å; Q571-L574 PolarHBondContact O-N 3.09Å; Q571-S584 PolarHBondContact NE2-O 2.8Å
572	E	79.1	Confident	85.1	Confident	135 Å²	135	57.3 Å²	57.3	63%	0.631	30%	0.297	S	S	*	.	H	α-helix	trans	-62.8	-41.5	-172.3	-77.6	171.4	-177.5	0	0	113.6	T568 Q569	T568-E572 HydrophobicContact CG2-CG 4.49Å; T568-E572 PolarHBondContact O-N 3.25Å; Q569-E572 PolarHBondContact O-N 3.48Å
573	R	84	Confident	85.9	Confident	184 Å²	184	62.3 Å²	62.3	69%	0.694	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	23.7	176.8	-56.1	-159.5	-168.3	164.9	-3.1	113.7	Q571 S686 T690	Q571-R573 PolarHBondContact O-N 2.94Å; R573-S686 PolarHBondContact O-OG 3.33Å; R573-T690 HydrophobicContact CB-CG2 3.74Å; R573-T690 HydrophobicContact CG-CG2 3.84Å
574	L	87.3	Confident	86.4	Confident	6 Å²	6	62.8 Å²	62.8	3%	0.031	32%	0.319	C	S	.	.			trans	-78.4	126	175.8	-177.2	58.7	0	0	0	109.7	I532 Q571 L577 R583 W683 S686	I532-L574 HydrophobicContact CD1-CD2 3.82Å; I532-L574 HydrophobicContact CG1-CD2 3.96Å; I532-L574 HydrophobicContact CG2-CD2 3.83Å; Q571-L574 WeakPolarHBondContact O-CB 3.43Å; Q571-L574 PolarHBondContact O-N 3.09Å; L574-L577 HydrophobicContact CD1-CD2 4.47Å; L574-L577 HydrophobicContact CD2-CD1 4.16Å; L574-L577 HydrophobicContact CD2-CD2 4.2Å; L574-L577 HydrophobicContact CD2-CG 4.41Å; L574-L577 HydrophobicContact CG-CD2 4.37Å; L574-R583 HydrophobicContact CD2-CG 4.22Å; L574-R583 PolarHBondContact O-NE 2.93Å; L574-R583 PolarHBondContact O-NH2 3.38Å; L574-W683 HydrophobicContact CD1-CB 4.09Å; L574-S686 PolarHBondContact N-OG 2.84Å
575	G	86.2	Confident	86.8	Confident	32 Å²	32	67.7 Å²	67.7	33%	0.33	34%	0.339	S	S	.	.			trans	-64.9	-171.2	178.9	0	0	0	0	0	114.9	L577 R583	G575-L577 PolarHBondContact O-N 3.3Å; G575-R583 PolarHBondContact O-NH2 3.13Å
576	P	90.6	Very high	87.4	Confident	109 Å²	109	61.5 Å²	61.5	71%	0.708	32%	0.317	S	S	*	.	P	Polyproline II helix	trans	-64.9	131.8	175.2	27.9	-34.2	0	0	0	110.8	Q682	P576-Q682 PolarHBondContact O-NE2 3.45Å; P576-Q682 PolarHBondContact O-OE1 3.18Å
577	L	93.1	Very high	87.8	Confident	34 Å²	34	63 Å²	63	18%	0.178	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-94.2	159.2	178.2	-68.9	172.6	0	0	0	111	I532 L574 G575 Y581 R583 A679	I532-L577 HydrophobicContact CG2-CD1 4.12Å; I532-L577 HydrophobicContact CG2-CD2 4.14Å; L574-L577 HydrophobicContact CD1-CD2 4.47Å; L574-L577 HydrophobicContact CD2-CD1 4.16Å; L574-L577 HydrophobicContact CD2-CD2 4.2Å; L574-L577 HydrophobicContact CD2-CG 4.41Å; L574-L577 HydrophobicContact CG-CD2 4.37Å; G575-L577 PolarHBondContact O-N 3.3Å; L577-Y581 WeakPolarHBondContact CB-O 3.44Å; L577-R583 HydrophobicContact CD1-CG 4.27Å; L577-A679 HydrophobicContact CD2-CB 4.04Å
578	P	92.7	Very high	87.8	Confident	29 Å²	29	63.9 Å²	63.9	19%	0.188	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-56.7	145.6	168.3	-22	33.7	0	0	0	111.2	T580 Y581 P675 I678 A679	P578-T580 VanDerWaalsContact C-N 3.26Å; P578-T580 PolarHBondContact O-N 3.12Å; P578-Y581 HydrophobicContact CB-CD2 4.22Å; P578-Y581 WeakPolarHBondContact O-CB 3.41Å; P578-Y581 PolarHBondContact O-N 2.91Å; P578-P675 HydrophobicContact CB-CB 4.31Å; P578-I678 HydrophobicContact CG-CB 4.25Å; P578-I678 HydrophobicContact CG-CG2 3.9Å; P578-A679 HydrophobicContact CG-CB 4.37Å
579	A	86.1	Confident	88	Confident	112 Å²	112	62.4 Å²	62.4	93%	0.926	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-30.1	-163.1	0	0	0	0	0	117.1
580	T	89.6	Confident	88.2	Confident	69 Å²	69	58.9 Å²	58.9	42%	0.423	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-7.2	177.6	52.5	0	0	0	0	114.3	E545 P546 P578	E545-T580 HydrophobicContact CG-CG2 4.48Å; P546-T580 WeakPolarHBondContact CD-O 3.49Å; P546-T580 WeakPolarHBondContact CG-O 3.44Å; P578-T580 VanDerWaalsContact C-N 3.26Å; P578-T580 PolarHBondContact O-N 3.12Å
581	Y	94.6	Very high	88.1	Confident	16 Å²	16	58.9 Å²	58.9	6%	0.063	31%	0.307	C	S	.	.			trans	-105.4	131.7	-176.6	-72.5	-101.9	0	0	0	111	S541 P546 L577 P578 P675 Y676 A679	S541-Y581 WeakPolarHBondContact CB-OH 3.27Å; P546-Y581 HydrophobicContact CB-CD1 4.24Å; P546-Y581 HydrophobicContact CB-CE1 4.17Å; P546-Y581 HydrophobicContact CG-CD1 3.74Å; P546-Y581 HydrophobicContact CG-CD2 3.82Å; P546-Y581 HydrophobicContact CG-CE1 3.58Å; P546-Y581 HydrophobicContact CG-CE2 3.64Å; P546-Y581 HydrophobicContact CG-CG 3.84Å; L577-Y581 WeakPolarHBondContact CB-O 3.44Å; P578-Y581 HydrophobicContact CB-CD2 4.22Å; P578-Y581 WeakPolarHBondContact O-CB 3.41Å; P578-Y581 PolarHBondContact O-N 2.91Å; Y581-P675 HydrophobicContact CE2-CB 3.93Å; Y581-Y676 HydrophobicContact CE1-CD2 4.18Å; Y581-Y676 WeakPolarHBondContact OH-CA 3.21Å; Y581-Y676 WeakPolarHBondContact OH-CB 3.25Å; Y581-A679 HydrophobicContact CD1-CB 3.96Å; Y581-A679 HydrophobicContact CE1-CB 4.4Å; Y581-A679 HydrophobicContact CG-CB 4.16Å
582	R	92.7	Very high	87.7	Confident	166 Å²	166	61.9 Å²	61.9	63%	0.626	33%	0.329	S	S	*	.			trans	-129.8	159.3	-178.9	65.3	-172.6	-174.8	-158.8	5.2	112.7	Y548 S584	Y548-R582 HydrophobicContact CD2-CG 4.29Å; Y548-R582 HydrophobicContact CE2-CG 3.67Å; Y548-R582 PolarHBondContact OH-N 3.24Å; Y548-R582 PolarHBondContact OH-O 2.96Å; R582-S584 PolarHBondContact O-N 2.78Å
583	R	90.9	Very high	87.1	Confident	124 Å²	124	58.3 Å²	58.3	47%	0.468	31%	0.314	S	S	.	.			trans	-77.5	91.1	171.5	-57	-171	-162.8	92.4	-1.1	109	L574 G575 L577	L574-R583 HydrophobicContact CD2-CG 4.22Å; L574-R583 PolarHBondContact O-NE 2.93Å; L574-R583 PolarHBondContact O-NH2 3.38Å; G575-R583 PolarHBondContact O-NH2 3.13Å; L577-R583 HydrophobicContact CD1-CG 4.27Å
584	S	90.9	Very high	85.8	Confident	13 Å²	13	54.7 Å²	54.7	9%	0.091	31%	0.307	C	S	.	.			trans	-74.1	138.9	178.6	-167.9	0	0	0	0	111.8	N531 Q571 R582	N531-S584 WeakPolarHBondContact O-CA 3.49Å; N531-S584 WeakPolarHBondContact O-CB 3.4Å; N531-S584 PolarHBondContact O-N 3.48Å; Q571-S584 PolarHBondContact NE2-O 2.8Å; R582-S584 PolarHBondContact O-N 2.78Å
585	Q	87.4	Confident	84.1	Confident	110 Å²	110	60.4 Å²	60.4	51%	0.514	33%	0.334	S	S	.	.			trans	-126.6	85.6	173.7	-65.8	-171.9	0.7	0	0	108
586	P	90.5	Very high	82.6	Confident	11 Å²	11	61 Å²	61	7%	0.071	33%	0.327	C	S	.	.			trans	-63.5	141.8	-179.5	25.6	-33.6	0	0	0	110.9	N531 L549 Q550 I552 L588	N531-P586 WeakPolarHBondContact ND2-CD 3.2Å; L549-P586 HydrophobicContact CB-CB 4.26Å; Q550-P586 WeakPolarHBondContact O-CA 3.45Å; I552-P586 HydrophobicContact CD1-CB 4.47Å; I552-P586 HydrophobicContact CD1-CG 3.85Å; I552-P586 HydrophobicContact CG1-CB 4.16Å; I552-P586 HydrophobicContact CG1-CG 4.09Å; P586-L588 PolarHBondContact O-N 3.18Å
587	L	89.9	Confident	80.8	Confident	34 Å²	34	59.3 Å²	59.3	18%	0.178	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.5	126.3	174.2	-55.4	175	0	0	0	109.3	P323 L325 Q550 S551 I552	P323-L587 HydrophobicContact CB-CD2 3.55Å; P323-L587 HydrophobicContact CG-CD2 3.9Å; P323-L587 WeakPolarHBondContact O-CD2 3.44Å; L325-L587 HydrophobicContact CB-CB 4.07Å; L325-L587 HydrophobicContact CD1-CB 4.23Å; L325-L587 HydrophobicContact CD1-CD1 3.68Å; Q550-L587 WeakPolarHBondContact O-CG 3.46Å; Q550-L587 PolarHBondContact O-N 3.06Å; S551-L587 CarbonylContact C-O 3.58Å; S551-L587 WeakPolarHBondContact CA-O 3.36Å; S551-L587 WeakPolarHBondContact CB-O 3.41Å; I552-L587 PolarHBondContact N-O 3.03Å
588	L	87.2	Confident	78.6	Confident	24 Å²	24	65.3 Å²	65.3	13%	0.126	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	135.3	179.9	-58.1	-173.6	0	0	0	110.5	I552 T560 L563 G564 P586	I552-L588 HydrophobicContact CB-CD2 3.76Å; I552-L588 HydrophobicContact CD1-CD2 4.27Å; I552-L588 HydrophobicContact CG1-CD2 4.25Å; T560-L588 WeakPolarHBondContact O-CD1 3.39Å; L563-L588 HydrophobicContact CB-CD1 4.35Å; L563-L588 HydrophobicContact CD2-CD1 4.47Å; L563-L588 HydrophobicContact CG-CD1 4.23Å; G564-L588 VanDerWaalsContact N-CD1 3.33Å; P586-L588 PolarHBondContact O-N 3.18Å
589	S	86.5	Confident	76.7	Confident	11 Å²	11	69.3 Å²	69.3	8%	0.077	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	162	169.2	-163.4	0	0	0	0	112.9	Q327 I552 T553 V554 T560	Q327-S589 PolarHBondContact OE1-OG 2.91Å; I552-S589 PolarHBondContact O-N 3.12Å; T553-S589 WeakPolarHBondContact CA-O 3.44Å; V554-S589 PolarHBondContact N-O 2.88Å; T560-S589 WeakPolarHBondContact CG2-O 3.33Å
590	G	84.4	Confident	75.5	Confident	8 Å²	8	68 Å²	68	8%	0.082	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	-173	167.1	0	0	0	0	0	111	Q327 V554	Q327-G590 PolarHBondContact NE2-O 2.9Å; V554-G590 WeakPolarHBondContact O-CA 3.36Å
591	L	82.2	Confident	74.1	Confident	6 Å²	6	65.6 Å²	65.6	3%	0.031	32%	0.317	C	S	.	.			trans	-91.6	160.4	159	-56.6	-179.4	0	0	0	109.7	D331 F334 Y452 T553 R558 F596	D331-L591 WeakPolarHBondContact OD1-CA 3.18Å; D331-L591 WeakPolarHBondContact OD1-CB 3.48Å; D331-L591 WeakPolarHBondContact OD1-CD2 3.33Å; F334-L591 HydrophobicContact CB-CD1 4.19Å; F334-L591 HydrophobicContact CB-CD2 3.43Å; F334-L591 VanDerWaalsContact CB-CD2 3.43Å; F334-L591 HydrophobicContact CB-CG 4.47Å; F334-L591 HydrophobicContact CD1-CD1 3.88Å; F334-L591 HydrophobicContact CD1-CD2 4.15Å; F334-L591 HydrophobicContact CD2-CD1 3.76Å; F334-L591 HydrophobicContact CE1-CD1 4.14Å; F334-L591 HydrophobicContact CE2-CD1 3.96Å; F334-L591 HydrophobicContact CG-CD1 3.66Å; F334-L591 HydrophobicContact CG-CD2 3.82Å; F334-L591 HydrophobicContact CG-CG 4.42Å; F334-L591 HydrophobicContact CZ-CD1 4.14Å; Y452-L591 HydrophobicContact CE2-CD1 4.19Å; Y452-L591 HydrophobicContact CE2-CD2 4.37Å; T553-L591 HydrophobicContact CG2-CD2 3.49Å; T553-L591 VanDerWaalsContact CG2-CD2 3.49Å; T553-L591 HydrophobicContact CG2-CG 4.4Å; R558-L591 PolarHBondContact NE-O 3.15Å; R558-L591 PolarHBondContact NH1-O 2.77Å; L591-F596 HydrophobicContact CB-CD2 4.18Å; L591-F596 HydrophobicContact CD1-CB 4.14Å; L591-F596 HydrophobicContact CD1-CD2 3.84Å; L591-F596 HydrophobicContact CD1-CG 4.43Å
592	S	75	Confident	72.9	Confident	67 Å²	67	74 Å²	74	47%	0.469	35%	0.354	S	S	.	.	S	Bend	trans	-72.9	-76	171.4	52.6	0	0	0	0	110.5	Q327 D331 R558	Q327-S592 VanDerWaalsContact NE2-N 3.19Å; D331-S592 VanDerWaalsContact CG-OG 3.25Å; D331-S592 PolarHBondContact OD1-N 2.86Å; D331-S592 PolarHBondContact OD1-OG 3.03Å; D331-S592 WeakPolarHBondContact OD2-CB 3.41Å; D331-S592 PolarHBondContact OD2-N 2.9Å; D331-S592 VanDerWaalsContact OD2-N 3.17Å; D331-S592 PolarHBondContact OD2-OG 3.16Å; R558-S592 PolarHBondContact NH1-O 3.23Å
593	N	66.5	Low	71.7	Confident	60 Å²	60	67.8 Å²	67.8	32%	0.321	34%	0.338	S	S	.	.			trans	-65.7	135.3	-174.3	-170.9	-9.5	0	0	0	112.4	R558 E595 F596	R558-N593 PolarHBondContact NH2-O 2.99Å; N593-E595 PolarHBondContact ND2-OE2 3Å; N593-E595 WeakPolarHBondContact OD1-CB 3.32Å; N593-E595 VanDerWaalsContact OD1-CG 3.31Å; N593-E595 WeakPolarHBondContact OD1-CG 3.5Å; N593-E595 PolarHBondContact OD1-N 3.3Å; N593-E595 PolarHBondContact OD1-OE2 2.66Å; N593-F596 HydrophobicContact CB-CD2 4.04Å; N593-F596 HydrophobicContact CB-CE1 4.48Å; N593-F596 HydrophobicContact CB-CE2 3.78Å; N593-F596 HydrophobicContact CB-CZ 4.02Å; N593-F596 WeakPolarHBondContact O-CD2 3.46Å
594	I	58.5	Low	71.2	Confident	108 Å²	108	64.2 Å²	64.2	55%	0.554	33%	0.33	S	S	*	.	S	Bend	trans	-78.5	-26.2	178.3	-64.7	173.2	0	0	0	111.9	F596 Q597	I594-F596 PolarHBondContact O-N 2.94Å; I594-F596 VanDerWaalsContact O-N 3.11Å; I594-Q597 VanDerWaalsContact O-CB 3.32Å; I594-Q597 WeakPolarHBondContact O-CB 3.49Å; I594-Q597 VanDerWaalsContact O-CG 3.27Å; I594-Q597 WeakPolarHBondContact O-CG 3.5Å; I594-Q597 PolarHBondContact O-N 2.97Å
595	E	51	Low	70.9	Confident	125 Å²	125	66.1 Å²	66.1	58%	0.584	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-59.8	-26.1	-177.5	-64.4	175.9	134.4	0	0	113.4	N593 Q597 Q598	N593-E595 PolarHBondContact ND2-OE2 3Å; N593-E595 WeakPolarHBondContact OD1-CB 3.32Å; N593-E595 VanDerWaalsContact OD1-CG 3.31Å; N593-E595 WeakPolarHBondContact OD1-CG 3.5Å; N593-E595 PolarHBondContact OD1-N 3.3Å; N593-E595 PolarHBondContact OD1-OE2 2.66Å; E595-Q597 PolarHBondContact O-N 3.29Å; E595-Q598 WeakPolarHBondContact O-CG 3.39Å; E595-Q598 PolarHBondContact O-N 3.42Å
596	F	53.8	Low	71	Confident	45 Å²	45	61.6 Å²	61.6	20%	0.197	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-56	-14.1	171.7	-60	-27.7	0	0	0	114.2	F334 H335 L591 N593 I594	F334-F596 HydrophobicContact CD1-CD2 4.01Å; F334-F596 HydrophobicContact CD1-CE2 4.01Å; F334-F596 HydrophobicContact CD1-CG 4.45Å; F334-F596 HydrophobicContact CD1-CZ 4.49Å; F334-F596 HydrophobicContact CE1-CB 4.05Å; F334-F596 AromaticContact CE1-CD1 3.66Å; F334-F596 HydrophobicContact CE1-CD1 3.66Å; F334-F596 AromaticContact CE1-CD2 3.34Å; F334-F596 HydrophobicContact CE1-CD2 3.34Å; F334-F596 AromaticContact CE1-CE1 3.84Å; F334-F596 HydrophobicContact CE1-CE1 3.84Å; F334-F596 AromaticContact CE1-CE2 3.51Å; F334-F596 HydrophobicContact CE1-CE2 3.51Å; F334-F596 AromaticContact CE1-CG 3.41Å; F334-F596 HydrophobicContact CE1-CG 3.41Å; F334-F596 VanDerWaalsContact CE1-CG 3.41Å; F334-F596 AromaticContact CE1-CZ 3.76Å; F334-F596 HydrophobicContact CE1-CZ 3.76Å; F334-F596 HydrophobicContact CE2-CB 4.37Å; F334-F596 HydrophobicContact CZ-CB 3.59Å; F334-F596 AromaticContact CZ-CD1 3.78Å; F334-F596 HydrophobicContact CZ-CD1 3.78Å; F334-F596 AromaticContact CZ-CD2 3.84Å; F334-F596 HydrophobicContact CZ-CD2 3.84Å; F334-F596 HydrophobicContact CZ-CE1 4.38Å; F334-F596 HydrophobicContact CZ-CE2 4.41Å; F334-F596 AromaticContact CZ-CG 3.46Å; F334-F596 HydrophobicContact CZ-CG 3.46Å; F334-F596 VanDerWaalsContact CZ-CG 3.46Å; H335-F596 AromaticContact NE2-CZ 3.59Å; L591-F596 HydrophobicContact CB-CD2 4.18Å; L591-F596 HydrophobicContact CD1-CB 4.14Å; L591-F596 HydrophobicContact CD1-CD2 3.84Å; L591-F596 HydrophobicContact CD1-CG 4.43Å; N593-F596 HydrophobicContact CB-CD2 4.04Å; N593-F596 HydrophobicContact CB-CE1 4.48Å; N593-F596 HydrophobicContact CB-CE2 3.78Å; N593-F596 HydrophobicContact CB-CZ 4.02Å; N593-F596 WeakPolarHBondContact O-CD2 3.46Å; I594-F596 PolarHBondContact O-N 2.94Å; I594-F596 VanDerWaalsContact O-N 3.11Å
597	Q	52.3	Low	71.2	Confident	73 Å²	73	61 Å²	61	34%	0.341	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-77	-20.1	174.5	-62.5	-177.9	12.6	0	0	114.5	I594 E595 Q599	I594-Q597 VanDerWaalsContact O-CB 3.32Å; I594-Q597 WeakPolarHBondContact O-CB 3.49Å; I594-Q597 VanDerWaalsContact O-CG 3.27Å; I594-Q597 WeakPolarHBondContact O-CG 3.5Å; I594-Q597 PolarHBondContact O-N 2.97Å; E595-Q597 PolarHBondContact O-N 3.29Å; Q597-Q599 PolarHBondContact O-N 2.89Å
598	Q	48.4	Very low	71.4	Confident	161 Å²	161	59.9 Å²	59.9	75%	0.752	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-3.2	-166.2	-64.2	-171.4	22.4	0	0	115.6	E595	E595-Q598 WeakPolarHBondContact O-CG 3.39Å; E595-Q598 PolarHBondContact O-N 3.42Å
599	Q	52.8	Low	71.9	Confident	112 Å²	112	58.7 Å²	58.7	52%	0.523	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	14.8	-173.1	-62.4	-169.4	-34.6	0	0	114.8	Q597 G601	Q597-Q599 PolarHBondContact O-N 2.89Å; Q599-G601 PolarHBondContact O-N 2.85Å
600	Q	59.6	Low	72.4	Confident	86 Å²	86	58.5 Å²	58.5	40%	0.402	30%	0.304	S	S	.	.			trans	-75.9	117.2	177.4	-63.8	-171.6	0.4	0	0	111.9	S556	S556-Q600 PolarHBondContact OG-NE2 3.1Å
601	G	62	Low	73.1	Confident	18 Å²	18	58.2 Å²	58.2	19%	0.186	30%	0.301	C	S	.	.			trans	-78.8	175.7	175.8	0	0	0	0	0	114.4	H355 K356 Q599	H355-G601 PolarHBondContact O-N 2.83Å; K356-G601 WeakPolarHBondContact CB-O 3.14Å; K356-G601 WeakPolarHBondContact CG-O 3.28Å; Q599-G601 PolarHBondContact O-N 2.85Å
602	K	68.1	Low	73.8	Confident	192 Å²	192	61 Å²	61	84%	0.835	32%	0.315	S	S	*	.	P	Polyproline II helix	trans	-60.3	152.5	164.4	-68.4	-175.4	178.9	-179.2	0	109.6	T604	K602-T604 PolarHBondContact O-N 2.79Å
603	A	68.6	Low	74.7	Confident	36 Å²	36	61.4 Å²	61.4	30%	0.298	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-68	128	173.7	0	0	0	0	0	110.2	K356 E495	K356-A603 HydrophobicContact CD-CB 3.77Å; E495-A603 WeakPolarHBondContact OE1-CB 3.27Å
604	T	78.8	Confident	76.1	Confident	49 Å²	49	59.6 Å²	59.6	30%	0.301	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-101	155.8	176.2	52.4	0	0	0	0	110.2	K602 V606	K602-T604 PolarHBondContact O-N 2.79Å; T604-V606 PolarHBondContact O-N 3.39Å
605	C	85.4	Confident	77.7	Confident	52 Å²	52	59 Å²	59	35%	0.351	33%	0.332	S	S	.	.	S	Bend	trans	-82	48.9	167.1	-62.8	0	0	0	0	110.4	K382 N621 T622 R628	K382-C605 PolarHBondContact NZ-SG 2.83Å; K382-C605 VanDerWaalsContact NZ-SG 3.39Å; C605-N621 PolarHBondContact O-OD1 3.07Å; C605-T622 VanDerWaalsContact CA-OG1 3.29Å; C605-T622 WeakPolarHBondContact CA-OG1 3.41Å; C605-T622 PolarHBondContact O-N 2.98Å; C605-R628 PolarHBondContact O-NH2 3.22Å
606	V	90.4	Very high	79.6	Confident	15 Å²	15	59.1 Å²	59.1	9%	0.091	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	136	-171.2	-172.8	0	0	0	0	110.5	T604 I608 V619 V620 T622	T604-V606 PolarHBondContact O-N 3.39Å; V606-I608 HydrophobicContact CG1-CG1 4.35Å; V606-V619 HydrophobicContact CG1-CG1 3.42Å; V606-V619 VanDerWaalsContact CG1-CG1 3.42Å; V606-V620 WeakPolarHBondContact CA-O 3.37Å; V606-T622 VanDerWaalsContact C-CG2 3.49Å
607	S	93.9	Very high	81.5	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	115.5	166.8	148.7	0	0	0	0	108.6	T379 V620	T379-S607 WeakPolarHBondContact O-CA 3.49Å; T379-S607 WeakPolarHBondContact O-CB 3.39Å; T379-S607 PolarHBondContact O-OG 3.09Å; S607-V620 PolarHBondContact N-O 3.17Å; S607-V620 WeakPolarHBondContact O-CB 3.32Å; S607-V620 PolarHBondContact O-N 3.5Å
608	I	94.8	Very high	83.5	Confident	9 Å²	9	55.1 Å²	55.1	5%	0.046	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	140.6	171.4	-55.1	173.3	0	0	0	107.8	Y341 V345 H352 S378 T379 V606 P617 E618	Y341-I608 HydrophobicContact CE2-CD1 4.29Å; V345-I608 HydrophobicContact CG2-CD1 4.33Å; H352-I608 HydrophobicContact CB-CD1 4.03Å; S378-I608 CarbonylContact C-O 3.57Å; S378-I608 WeakPolarHBondContact CA-O 3.23Å; S378-I608 WeakPolarHBondContact CB-O 3.45Å; T379-I608 PolarHBondContact N-O 3.4Å; T379-I608 WeakPolarHBondContact OG1-CB 3.39Å; T379-I608 PolarHBondContact OG1-N 3.36Å; V606-I608 HydrophobicContact CG1-CG1 4.35Å; I608-P617 HydrophobicContact CG2-CB 3.67Å; I608-E618 CarbonylContact C-O 3.56Å; I608-E618 WeakPolarHBondContact CA-O 3.32Å
609	N	96.6	Very high	85.7	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	145.1	168.8	75.2	89.4	0	0	0	112.6	L377 E618 R635 I636	L377-N609 CarbonylContact O-C 3.34Å; L377-N609 WeakPolarHBondContact O-CA 3.38Å; N609-E618 PolarHBondContact N-O 3.25Å; N609-E618 PolarHBondContact ND2-O 3.02Å; N609-E618 PolarHBondContact ND2-OE1 2.95Å; N609-E618 PolarHBondContact O-N 3.33Å; N609-R635 PolarHBondContact O-NH2 3.1Å; N609-R635 PolarHBondContact OD1-NE 3.49Å; N609-R635 VanDerWaalsContact OD1-NE 3.17Å; N609-I636 HydrophobicContact CB-CD1 4.12Å
610	W	97.9	Very high	87.8	Confident	7 Å²	7	43.3 Å²	43.3	3%	0.027	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	146.6	176.8	176.2	88.1	0	0	0	110.4	K340 L344 V374 A376 L377 L612 D614 P617	K340-W610 HydrophobicContact CD-CH2 4.49Å; K340-W610 VanDerWaalsContact CE-CZ2 3.43Å; K340-W610 HydrophobicContact CG-CH2 4.47Å; K340-W610 HydrophobicContact CG-CZ3 4.21Å; L344-W610 HydrophobicContact CD1-CB 3.84Å; L344-W610 HydrophobicContact CD1-CD2 3.58Å; L344-W610 HydrophobicContact CD1-CE3 3.98Å; L344-W610 HydrophobicContact CD1-CG 3.5Å; L344-W610 VanDerWaalsContact CD1-CG 3.5Å; L344-W610 HydrophobicContact CD2-CD2 4.27Å; L344-W610 HydrophobicContact CD2-CG 4.03Å; L344-W610 HydrophobicContact CG-CG 4.43Å; V374-W610 HydrophobicContact CG1-CZ3 4.23Å; V374-W610 WeakPolarHBondContact O-CH2 3.47Å; V374-W610 VanDerWaalsContact O-CZ3 3.27Å; V374-W610 WeakPolarHBondContact O-CZ3 3.42Å; A376-W610 WeakPolarHBondContact CA-O 3.49Å; L377-W610 HydrophobicContact CB-CE3 4.03Å; L377-W610 PolarHBondContact N-O 3.2Å; L377-W610 PolarHBondContact O-N 3.17Å; W610-L612 HydrophobicContact CH2-CB 3.97Å; W610-L612 HydrophobicContact CH2-CD1 3.95Å; W610-L612 HydrophobicContact CZ2-CD1 4.29Å; W610-D614 PolarHBondContact NE1-O 3.47Å; W610-P617 HydrophobicContact CB-CB 4.4Å
611	T	98.4	Very high	89.4	Confident	2 Å²	2	41 Å²	41	1%	0.012	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	147.1	176.8	-42.6	0	0	0	0	108.5	V375 A408 R411 F412 G613 D614	V375-T611 WeakPolarHBondContact O-CA 3.39Å; A408-T611 WeakPolarHBondContact CB-OG1 3.3Å; A408-T611 VanDerWaalsContact O-CG2 3.23Å; A408-T611 WeakPolarHBondContact O-CG2 3.4Å; R411-T611 HydrophobicContact CB-CG2 4.14Å; R411-T611 VanDerWaalsContact NH1-CB 3.35Å; R411-T611 PolarHBondContact NH1-OG1 2.98Å; F412-T611 HydrophobicContact CB-CG2 3.7Å; T611-G613 PolarHBondContact O-N 3.09Å; T611-D614 WeakPolarHBondContact CA-OD2 3.46Å; T611-D614 VanDerWaalsContact CB-OD2 3.22Å; T611-D614 WeakPolarHBondContact CB-OD2 3.4Å; T611-D614 PolarHBondContact N-OD2 3.15Å; T611-D614 VanDerWaalsContact O-CB 3.28Å; T611-D614 WeakPolarHBondContact O-CB 3.45Å; T611-D614 PolarHBondContact O-N 3.33Å; T611-D614 PolarHBondContact OG1-OD2 3.17Å
612	L	97.5	Very high	90.9	Very high	63 Å²	63	40.2 Å²	40.2	33%	0.33	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	129.6	172.8	-176.4	61.8	0	0	0	110.3	V375 F412 W610	V375-L612 HydrophobicContact CG1-CD2 4.13Å; V375-L612 PolarHBondContact O-N 3.45Å; F412-L612 HydrophobicContact CD2-CB 4.24Å; F412-L612 HydrophobicContact CE2-CB 4.35Å; F412-L612 HydrophobicContact CE2-CD2 4.01Å; W610-L612 HydrophobicContact CH2-CB 3.97Å; W610-L612 HydrophobicContact CH2-CD1 3.95Å; W610-L612 HydrophobicContact CZ2-CD1 4.29Å
613	G	93.6	Very high	92.1	Very high	76 Å²	76	32.1 Å²	32.1	78%	0.784	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	97.1	-15.2	-168.3	0	0	0	0	0	115.1	T611	T611-G613 PolarHBondContact O-N 3.09Å
614	D	95.7	Very high	93.3	Very high	23 Å²	23	31.8 Å²	31.8	12%	0.123	21%	0.208	C	C	.	.			trans	-77.4	125.3	170.2	-65.6	-43	0	0	0	110.5	R411 W610 T611 Q616 R635	R411-D614 IonicContact CZ-OD1 3.37Å; R411-D614 VanDerWaalsContact CZ-OD1 3.29Å; R411-D614 IonicContact CZ-OD2 2.73Å; R411-D614 IonicContact NH1-OD1 2.73Å; R411-D614 PolarHBondContact NH1-OD1 3.32Å; R411-D614 IonicContact NH1-OD2 2.71Å; R411-D614 PolarHBondContact NH1-OD2 3.3Å; R411-D614 IonicContact NH2-OD1 3.94Å; R411-D614 PolarHBondContact NH2-OD1 2.95Å; R411-D614 IonicContact NH2-OD2 3.13Å; W610-D614 PolarHBondContact NE1-O 3.47Å; T611-D614 WeakPolarHBondContact CA-OD2 3.46Å; T611-D614 VanDerWaalsContact CB-OD2 3.22Å; T611-D614 WeakPolarHBondContact CB-OD2 3.4Å; T611-D614 PolarHBondContact N-OD2 3.15Å; T611-D614 VanDerWaalsContact O-CB 3.28Å; T611-D614 WeakPolarHBondContact O-CB 3.45Å; T611-D614 PolarHBondContact O-N 3.33Å; T611-D614 PolarHBondContact OG1-OD2 3.17Å; D614-Q616 VanDerWaalsContact C-N 3.3Å; D614-Q616 PolarHBondContact O-N 2.73Å; D614-R635 IonicContact OD1-CZ 2.89Å; D614-R635 IonicContact OD1-NE 3.95Å; D614-R635 IonicContact OD1-NH1 3.62Å; D614-R635 PolarHBondContact OD1-NH1 2.99Å; D614-R635 IonicContact OD2-CZ 3.55Å; D614-R635 IonicContact OD2-NE 3.34Å; D614-R635 IonicContact OD2-NH1 3.62Å; D614-R635 PolarHBondContact OD2-NH1 3.29Å; D614-R635 IonicContact OD2-NH2 3.51Å; D614-R635 PolarHBondContact OD2-NH2 3.42Å
615	A	91.8	Very high	94.1	Very high	95 Å²	95	29.5 Å²	29.5	79%	0.785	19%	0.193	S	C	*	.	S	Bend	trans	-64.3	-32.1	175.2	0	0	0	0	0	113.5
616	Q	91.1	Very high	94.7	Very high	127 Å²	127	30.2 Å²	30.2	59%	0.593	19%	0.189	S	C	*	.	S	Bend	trans	-140.6	153.4	-178	-68.8	-62.2	-13.8	0	0	112.3	D614 R635	D614-Q616 VanDerWaalsContact C-N 3.3Å; D614-Q616 PolarHBondContact O-N 2.73Å; Q616-R635 PolarHBondContact O-NH1 3.08Å; Q616-R635 VanDerWaalsContact O-NH1 3.13Å; Q616-R635 PolarHBondContact O-NH2 3.41Å
617	P	93.4	Very high	95	Very high	18 Å²	18	33.4 Å²	33.4	12%	0.117	20%	0.199	C	C	.	.			trans	-70.8	142.9	173	31.1	-33.6	0	0	0	111.4	L344 I608 W610	L344-P617 HydrophobicContact CB-CG 4.44Å; I608-P617 HydrophobicContact CG2-CB 3.67Å; W610-P617 HydrophobicContact CB-CB 4.4Å
618	E	95.1	Very high	94.9	Very high	17 Å²	17	39 Å²	39	8%	0.079	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	136.1	175.2	178.4	-166.1	77.8	0	0	109.2	I608 N609 V620 R627 S634 R635	I608-E618 CarbonylContact C-O 3.56Å; I608-E618 WeakPolarHBondContact CA-O 3.32Å; N609-E618 PolarHBondContact N-O 3.25Å; N609-E618 PolarHBondContact ND2-O 3.02Å; N609-E618 PolarHBondContact ND2-OE1 2.95Å; N609-E618 PolarHBondContact O-N 3.33Å; E618-V620 HydrophobicContact CG-CG2 4.38Å; E618-V620 WeakPolarHBondContact OE1-CG2 3.46Å; E618-R627 HydrophobicContact CG-CG 3.85Å; E618-S634 WeakPolarHBondContact OE1-CB 3.41Å; E618-S634 PolarHBondContact OE1-OG 3.04Å; E618-S634 WeakPolarHBondContact OE2-CA 3.41Å; E618-R635 WeakPolarHBondContact OE2-CG 3.31Å; E618-R635 PolarHBondContact OE2-N 3.05Å
619	V	94.8	Very high	94.6	Very high	25 Å²	25	43.9 Å²	43.9	15%	0.152	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	114.5	-178.1	-172.1	0	0	0	0	109.6	V606 R628	V606-V619 HydrophobicContact CG1-CG1 3.42Å; V606-V619 VanDerWaalsContact CG1-CG1 3.42Å; V619-R628 HydrophobicContact CB-CB 4.46Å; V619-R628 HydrophobicContact CG1-CB 4.04Å; V619-R628 HydrophobicContact CG1-CG 4.47Å; V619-R628 WeakPolarHBondContact O-CB 3.43Å; V619-R628 PolarHBondContact O-N 3.44Å
620	V	95.5	Very high	94.5	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	133.4	-178.5	179.1	0	0	0	0	109.7	V606 S607 E618 T622 R626	V606-V620 WeakPolarHBondContact CA-O 3.37Å; S607-V620 PolarHBondContact N-O 3.17Å; S607-V620 WeakPolarHBondContact O-CB 3.32Å; S607-V620 PolarHBondContact O-N 3.5Å; E618-V620 HydrophobicContact CG-CG2 4.38Å; E618-V620 WeakPolarHBondContact OE1-CG2 3.46Å; V620-T622 PolarHBondContact O-N 3.28Å; V620-R626 WeakPolarHBondContact CA-O 3.38Å; V620-R626 WeakPolarHBondContact CG1-O 3.4Å
621	N	94.8	Very high	94.3	Very high	38 Å²	38	48.2 Å²	48.2	20%	0.203	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	120.4	167.6	179.5	-3	0	0	0	108.5	C605 A623 G625 R626 R628	C605-N621 PolarHBondContact O-OD1 3.07Å; N621-A623 VanDerWaalsContact C-N 3.28Å; N621-A623 PolarHBondContact O-N 2.8Å; N621-A623 PolarHBondContact OD1-N 3.2Å; N621-A623 VanDerWaalsContact OD1-N 3.15Å; N621-G625 WeakPolarHBondContact O-CA 3.39Å; N621-G625 PolarHBondContact O-N 3.13Å; N621-R626 PolarHBondContact N-O 3.09Å; N621-R628 HydrophobicContact CB-CB 4.45Å
622	T	93.2	Very high	94.2	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.006	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-29.5	-174.2	58.7	0	0	0	0	113.1	K382 C383 I384 C399 C605 V606 V620	K382-T622 HydrophobicContact CB-CG2 4.12Å; C383-T622 CarbonylContact C-O 3.55Å; C383-T622 VanDerWaalsContact O-O 3.06Å; I384-T622 VanDerWaalsContact CA-O 3.29Å; I384-T622 WeakPolarHBondContact CA-O 3.36Å; I384-T622 PolarHBondContact N-O 3.17Å; C399-T622 HydrophobicContact CB-CG2 3.59Å; C605-T622 VanDerWaalsContact CA-OG1 3.29Å; C605-T622 WeakPolarHBondContact CA-OG1 3.41Å; C605-T622 PolarHBondContact O-N 2.98Å; V606-T622 VanDerWaalsContact C-CG2 3.49Å; V620-T622 PolarHBondContact O-N 3.28Å
623	A	92.4	Very high	94.2	Very high	22 Å²	22	50.3 Å²	50.3	18%	0.182	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-41.6	-176.4	0	0	0	0	0	112.2	I384 N385 Y388 N621	I384-A623 WeakPolarHBondContact CA-O 3.5Å; I384-A623 WeakPolarHBondContact CG1-O 3.33Å; N385-A623 PolarHBondContact N-O 3.07Å; Y388-A623 VanDerWaalsContact CD2-O 3.29Å; Y388-A623 WeakPolarHBondContact CD2-O 3.5Å; N621-A623 VanDerWaalsContact C-N 3.28Å; N621-A623 PolarHBondContact O-N 2.8Å; N621-A623 PolarHBondContact OD1-N 3.2Å; N621-A623 VanDerWaalsContact OD1-N 3.15Å
624	T	94.9	Very high	94.4	Very high	29 Å²	29	46.8 Å²	46.8	18%	0.178	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96	-11.7	-179.3	63.1	0	0	0	0	113.9	Y388 R626	Y388-T624 HydrophobicContact CD1-CG2 4.18Å; Y388-T624 HydrophobicContact CD2-CG2 3.84Å; Y388-T624 HydrophobicContact CE1-CG2 4.18Å; Y388-T624 HydrophobicContact CE2-CG2 3.81Å; Y388-T624 HydrophobicContact CG-CG2 4.02Å; T624-R626 PolarHBondContact O-N 2.95Å; T624-R626 VanDerWaalsContact O-N 3.1Å
625	G	95.9	Very high	94.5	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	27%	0.268	C	S	.	.	S	Bend	trans	63.3	13.6	-177.2	0	0	0	0	0	114.7	V396 N621	V396-G625 PolarHBondContact N-O 3.38Å; N621-G625 WeakPolarHBondContact O-CA 3.39Å; N621-G625 PolarHBondContact O-N 3.13Å
626	R	97.1	Very high	94.8	Very high	68 Å²	68	43.7 Å²	43.7	26%	0.257	23%	0.23	S	C	.	.	S	Bend	trans	-111.1	167	-178.9	-71.6	172	174.1	-86.3	-0.7	111	V395 V620 N621 T624 G631	V395-R626 HydrophobicContact CG1-CG 4Å; V620-R626 WeakPolarHBondContact CA-O 3.38Å; V620-R626 WeakPolarHBondContact CG1-O 3.4Å; N621-R626 PolarHBondContact N-O 3.09Å; T624-R626 PolarHBondContact O-N 2.95Å; T624-R626 VanDerWaalsContact O-N 3.1Å; R626-G631 WeakPolarHBondContact CD-O 3.47Å
627	R	96.2	Very high	95.1	Very high	81 Å²	81	37.7 Å²	37.7	31%	0.306	20%	0.202	S	C	.	.	B	Isolated β-bridge	trans	-58.2	137.2	174.7	-88.4	179.8	61.3	-174.3	3	111.4	E618 D629 S630 G631 T632	E618-R627 HydrophobicContact CG-CG 3.85Å; R627-D629 WeakPolarHBondContact CB-OD1 3.5Å; R627-D629 IonicContact CZ-OD1 2.61Å; R627-D629 IonicContact CZ-OD2 2.76Å; R627-D629 IonicContact NE-OD1 2.61Å; R627-D629 PolarHBondContact NE-OD1 3.16Å; R627-D629 IonicContact NE-OD2 3.34Å; R627-D629 IonicContact NH2-OD1 3.68Å; R627-D629 PolarHBondContact NH2-OD1 3.2Å; R627-D629 IonicContact NH2-OD2 2.81Å; R627-D629 PolarHBondContact NH2-OD2 3.28Å; R627-S630 VanDerWaalsContact CZ-OG 3.31Å; R627-S630 PolarHBondContact NE-OG 3.01Å; R627-G631 VanDerWaalsContact O-CA 3.31Å; R627-G631 WeakPolarHBondContact O-CA 3.39Å; R627-G631 PolarHBondContact O-N 3.16Å; R627-G631 VanDerWaalsContact O-N 3.07Å; R627-T632 WeakPolarHBondContact CB-O 3.49Å; R627-T632 PolarHBondContact N-O 2.67Å
628	R	92	Very high	95.3	Very high	118 Å²	118	37.5 Å²	37.5	45%	0.445	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-31.4	-176.7	168.5	169.6	-77.7	-90.6	-0.5	113.1	C605 V619 N621	C605-R628 PolarHBondContact O-NH2 3.22Å; V619-R628 HydrophobicContact CB-CB 4.46Å; V619-R628 HydrophobicContact CG1-CB 4.04Å; V619-R628 HydrophobicContact CG1-CG 4.47Å; V619-R628 WeakPolarHBondContact O-CB 3.43Å; V619-R628 PolarHBondContact O-N 3.44Å; N621-R628 HydrophobicContact CB-CB 4.45Å
629	D	89.5	Confident	95.5	Very high	112 Å²	112	38.5 Å²	38.5	60%	0.599	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-39.4	-176.9	54.9	-18.3	0	0	0	112.7	R627	R627-D629 WeakPolarHBondContact CB-OD1 3.5Å; R627-D629 IonicContact CZ-OD1 2.61Å; R627-D629 IonicContact CZ-OD2 2.76Å; R627-D629 IonicContact NE-OD1 2.61Å; R627-D629 PolarHBondContact NE-OD1 3.16Å; R627-D629 IonicContact NE-OD2 3.34Å; R627-D629 IonicContact NH2-OD1 3.68Å; R627-D629 PolarHBondContact NH2-OD1 3.2Å; R627-D629 IonicContact NH2-OD2 2.81Å; R627-D629 PolarHBondContact NH2-OD2 3.28Å
630	S	92.8	Very high	95.6	Very high	56 Å²	56	38.8 Å²	38.8	39%	0.392	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-123.8	-6.5	-168.8	58.3	0	0	0	0	115.4	R627 T632	R627-S630 VanDerWaalsContact CZ-OG 3.31Å; R627-S630 PolarHBondContact NE-OG 3.01Å; S630-T632 PolarHBondContact O-N 3.33Å; S630-T632 PolarHBondContact OG-N 2.64Å; S630-T632 PolarHBondContact OG-OG1 3.18Å
631	G	94.4	Very high	95.7	Very high	41 Å²	41	39.4 Å²	39.4	42%	0.423	21%	0.212	S	C	.	.			trans	65.9	-4.5	-170.9	0	0	0	0	0	115.2	R626 R627	R626-G631 WeakPolarHBondContact CD-O 3.47Å; R627-G631 VanDerWaalsContact O-CA 3.31Å; R627-G631 WeakPolarHBondContact O-CA 3.39Å; R627-G631 PolarHBondContact O-N 3.16Å; R627-G631 VanDerWaalsContact O-N 3.07Å
632	T	96.6	Very high	95.8	Very high	58 Å²	58	37.7 Å²	37.7	36%	0.356	20%	0.203	S	C	.	.	P	Polyproline II helix	trans	-71	161.6	-176	57.6	0	0	0	0	112.3	R627 S630 S634	R627-T632 WeakPolarHBondContact CB-O 3.49Å; R627-T632 PolarHBondContact N-O 2.67Å; S630-T632 PolarHBondContact O-N 3.33Å; S630-T632 PolarHBondContact OG-N 2.64Å; S630-T632 PolarHBondContact OG-OG1 3.18Å; T632-S634 PolarHBondContact O-N 3.32Å
633	P	97.6	Very high	96	Very high	52 Å²	52	40.8 Å²	40.8	34%	0.338	22%	0.222	S	C	.	.	P	Polyproline II helix	trans	-55.8	136.5	174.5	-25.2	35.6	0	0	0	111.7	Q394	Q394-P633 HydrophobicContact CB-CB 4.19Å; Q394-P633 HydrophobicContact CB-CG 3.99Å; Q394-P633 HydrophobicContact CG-CG 4.02Å
634	S	98	Very high	96.1	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.007	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-69.6	146.5	176.8	160.4	0	0	0	0	111.5	E618 T632 I636 C637	E618-S634 WeakPolarHBondContact OE1-CB 3.41Å; E618-S634 PolarHBondContact OE1-OG 3.04Å; E618-S634 WeakPolarHBondContact OE2-CA 3.41Å; T632-S634 PolarHBondContact O-N 3.32Å; S634-I636 PolarHBondContact O-N 3.16Å; S634-I636 WeakPolarHBondContact OG-CG1 3.45Å; S634-I636 PolarHBondContact OG-N 3.39Å; S634-I636 VanDerWaalsContact OG-N 3.1Å; S634-C637 WeakPolarHBondContact O-CB 2.75Å; S634-C637 PolarHBondContact O-N 3.17Å; S634-C637 PolarHBondContact O-SG 2.85Å
635	R	97.4	Very high	96.2	Very high	54 Å²	54	40.5 Å²	40.5	20%	0.204	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-17.3	172.6	72.4	-162	179.2	-177	-6.2	113.8	R411 N609 D614 Q616 E618	R411-R635 WeakPolarHBondContact CD-O 3.31Å; N609-R635 PolarHBondContact O-NH2 3.1Å; N609-R635 PolarHBondContact OD1-NE 3.49Å; N609-R635 VanDerWaalsContact OD1-NE 3.17Å; D614-R635 IonicContact OD1-CZ 2.89Å; D614-R635 IonicContact OD1-NE 3.95Å; D614-R635 IonicContact OD1-NH1 3.62Å; D614-R635 PolarHBondContact OD1-NH1 2.99Å; D614-R635 IonicContact OD2-CZ 3.55Å; D614-R635 IonicContact OD2-NE 3.34Å; D614-R635 IonicContact OD2-NH1 3.62Å; D614-R635 PolarHBondContact OD2-NH1 3.29Å; D614-R635 IonicContact OD2-NH2 3.51Å; D614-R635 PolarHBondContact OD2-NH2 3.42Å; Q616-R635 PolarHBondContact O-NH1 3.08Å; Q616-R635 VanDerWaalsContact O-NH1 3.13Å; Q616-R635 PolarHBondContact O-NH2 3.41Å; E618-R635 WeakPolarHBondContact OE2-CG 3.31Å; E618-R635 PolarHBondContact OE2-N 3.05Å
636	I	98	Very high	96	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.5	14.4	172.9	61.2	160.5	0	0	0	114.1	V396 T404 R407 R411 N609 S634	V396-I636 HydrophobicContact CG1-CD1 4.39Å; V396-I636 HydrophobicContact CG2-CG1 4.07Å; T404-I636 HydrophobicContact CG2-CD1 3.77Å; R407-I636 HydrophobicContact CB-CB 3.97Å; R407-I636 HydrophobicContact CB-CD1 4.32Å; R407-I636 HydrophobicContact CB-CG2 4.21Å; R407-I636 PolarHBondContact NE-O 3.31Å; R407-I636 PolarHBondContact NH2-O 3.42Å; R411-I636 HydrophobicContact CG-CG2 4.36Å; N609-I636 HydrophobicContact CB-CD1 4.12Å; S634-I636 PolarHBondContact O-N 3.16Å; S634-I636 WeakPolarHBondContact OG-CG1 3.45Å; S634-I636 PolarHBondContact OG-N 3.39Å; S634-I636 VanDerWaalsContact OG-N 3.1Å
637	C	98.1	Very high	95.8	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.229	C	C	.	.	S	Bend	trans	-65.8	-178.5	172.1	73.5	0	0	0	0	112.7	Q394 V396 R407 S634 A640 L641	Q394-C637 WeakPolarHBondContact O-CB 3.4Å; V396-C637 HydrophobicContact CG2-CB 4.35Å; R407-C637 PolarHBondContact NH2-O 2.88Å; S634-C637 WeakPolarHBondContact O-CB 2.75Å; S634-C637 PolarHBondContact O-N 3.17Å; S634-C637 PolarHBondContact O-SG 2.85Å; C637-A640 PolarHBondContact SG-N 3.12Å; C637-L641 WeakPolarHBondContact O-CG 3.45Å
638	K	98.2	Very high	95.5	Very high	14 Å²	14	41 Å²	41	6%	0.061	22%	0.216	C	C	.	.	H	α-helix	trans	-72.6	-44.8	175.1	-54.6	-167.6	-119.1	-75.6	0	110.8	G393 N397 L641 F642 Y666 Q702 F705	G393-K638 WeakPolarHBondContact O-CA 3.42Å; G393-K638 WeakPolarHBondContact O-CB 3.41Å; G393-K638 PolarHBondContact O-N 2.86Å; N397-K638 PolarHBondContact OD1-NZ 2.77Å; K638-L641 PolarHBondContact O-N 3.14Å; K638-F642 PolarHBondContact O-N 3.13Å; K638-Y666 HydrophobicContact CB-CE2 4.2Å; K638-Y666 HydrophobicContact CD-CE1 3.75Å; K638-Q702 WeakPolarHBondContact CE-O 3.49Å; K638-F705 HydrophobicContact CB-CE1 4.3Å; K638-F705 HydrophobicContact CB-CZ 3.95Å; K638-F705 HydrophobicContact CD-CE1 4.47Å
639	H	97.4	Very high	95.4	Very high	38 Å²	38	37.9 Å²	37.9	18%	0.176	20%	0.204	C	C	.	.	H	α-helix	trans	-54.6	-58.3	-177.1	-162.5	106	0	0	0	111.5	Q392 G393 L641 F642 T643 F705 L707	Q392-H639 PolarHBondContact O-ND1 3.4Å; Q392-H639 VanDerWaalsContact O-ND1 3.09Å; G393-H639 PolarHBondContact O-N 2.59Å; H639-L641 VanDerWaalsContact C-N 3.3Å; H639-L641 PolarHBondContact O-N 3.2Å; H639-F642 CarbonylContact O-C 3.52Å; H639-F642 WeakPolarHBondContact O-CA 3.47Å; H639-F642 WeakPolarHBondContact O-CB 3.43Å; H639-F642 PolarHBondContact O-N 3.46Å; H639-T643 PolarHBondContact O-N 3.48Å; H639-T643 PolarHBondContact O-OG1 3.19Å; H639-F705 HydrophobicContact CB-CE2 4.39Å; H639-F705 AromaticContact ND1-CE2 3.98Å; H639-L707 WeakPolarHBondContact NE2-CD2 3.23Å
640	A	97.3	Very high	95.3	Very high	31 Å²	31	38 Å²	38	26%	0.256	20%	0.196	S	C	.	.	H	α-helix	trans	-58.1	-35	-179.4	0	0	0	0	0	114.5	C637 R644	C637-A640 PolarHBondContact SG-N 3.12Å; A640-R644 PolarHBondContact O-N 3.24Å
641	L	97.8	Very high	95	Very high	13 Å²	13	40 Å²	40	7%	0.068	20%	0.198	C	C	.	.	H	α-helix	trans	-74	-27.7	174.8	-65.5	-176.2	0	0	0	112.5	I410 R411 Y414 C637 K638 H639 W645	I410-L641 HydrophobicContact CG2-CD1 4.09Å; I410-L641 HydrophobicContact CG2-CD2 4.1Å; R411-L641 HydrophobicContact CG-CD2 3.59Å; Y414-L641 HydrophobicContact CD2-CD2 4.44Å; Y414-L641 HydrophobicContact CE2-CB 4.39Å; Y414-L641 HydrophobicContact CE2-CD2 4.34Å; C637-L641 WeakPolarHBondContact O-CG 3.45Å; K638-L641 PolarHBondContact O-N 3.14Å; H639-L641 VanDerWaalsContact C-N 3.3Å; H639-L641 PolarHBondContact O-N 3.2Å; L641-W645 PolarHBondContact O-N 3.25Å
642	F	97.6	Very high	94.4	Very high	3 Å²	3	38.1 Å²	38.1	1%	0.013	18%	0.178	C	C	.	.	H	α-helix	trans	-78.7	-35.8	174.6	-170.8	-138	0	0	0	111.9	L539 K638 H639 R644 W645 N646 P664 Y666 A669 F705 L707	L539-F642 HydrophobicContact CD1-CB 4.5Å; L539-F642 HydrophobicContact CD1-CD2 3.84Å; L539-F642 HydrophobicContact CD2-CD2 4.28Å; L539-F642 HydrophobicContact CD2-CE2 4.32Å; K638-F642 PolarHBondContact O-N 3.13Å; H639-F642 CarbonylContact O-C 3.52Å; H639-F642 WeakPolarHBondContact O-CA 3.47Å; H639-F642 WeakPolarHBondContact O-CB 3.43Å; H639-F642 PolarHBondContact O-N 3.46Å; F642-R644 VanDerWaalsContact C-N 3.34Å; F642-R644 PolarHBondContact O-N 3.27Å; F642-W645 HydrophobicContact CD2-CB 4.34Å; F642-W645 HydrophobicContact CD2-CD2 4.39Å; F642-W645 AromaticContact CD2-CE3 3.8Å; F642-W645 HydrophobicContact CD2-CE3 3.8Å; F642-W645 HydrophobicContact CE2-CD2 4.31Å; F642-W645 AromaticContact CE2-CE3 3.41Å; F642-W645 HydrophobicContact CE2-CE3 3.41Å; F642-W645 VanDerWaalsContact CE2-CE3 3.41Å; F642-W645 AromaticContact CE2-CZ3 3.75Å; F642-W645 HydrophobicContact CE2-CZ3 3.75Å; F642-W645 HydrophobicContact CZ-CE3 4.45Å; F642-W645 WeakPolarHBondContact O-CB 3.12Å; F642-W645 PolarHBondContact O-N 3.24Å; F642-W645 VanDerWaalsContact O-N 3.16Å; F642-N646 WeakPolarHBondContact O-CB 3.48Å; F642-N646 PolarHBondContact O-N 3.39Å; F642-P664 WeakPolarHBondContact CZ-O 3.41Å; F642-Y666 HydrophobicContact CB-CD2 3.8Å; F642-Y666 HydrophobicContact CB-CE2 4.26Å; F642-Y666 HydrophobicContact CD1-CD2 4.02Å; F642-Y666 HydrophobicContact CD1-CG 4.48Å; F642-Y666 AromaticContact CD2-CD2 3.9Å; F642-Y666 HydrophobicContact CD2-CD2 3.9Å; F642-Y666 HydrophobicContact CE2-CD2 4.47Å; F642-Y666 AromaticContact CG-CD2 3.66Å; F642-Y666 HydrophobicContact CG-CD2 3.66Å; F642-A669 HydrophobicContact CE2-CB 3.69Å; F642-A669 HydrophobicContact CZ-CB 4.08Å; F642-F705 AromaticContact CD1-CE2 3.95Å; F642-F705 HydrophobicContact CD1-CE2 3.95Å; F642-F705 HydrophobicContact CD1-CZ 4.49Å; F642-L707 HydrophobicContact CB-CD2 4.48Å; F642-L707 HydrophobicContact CD1-CD1 3.71Å; F642-L707 HydrophobicContact CD1-CD2 3.84Å; F642-L707 HydrophobicContact CD1-CG 3.55Å; F642-L707 HydrophobicContact CE1-CD1 3.99Å; F642-L707 HydrophobicContact CE1-CG 3.85Å; F642-L707 HydrophobicContact CG-CD1 4.16Å; F642-L707 HydrophobicContact CG-CD2 4.5Å; F642-L707 HydrophobicContact CG-CG 4.4Å
643	T	96.1	Very high	93.5	Very high	66 Å²	66	38.9 Å²	38.9	41%	0.405	18%	0.177	S	C	.	.	H	α-helix	trans	-55.7	-47.2	172.4	-42.6	0	0	0	0	111.3	H639 N646 R647	H639-T643 PolarHBondContact O-N 3.48Å; H639-T643 PolarHBondContact O-OG1 3.19Å; T643-N646 PolarHBondContact O-N 3.14Å; T643-R647 PolarHBondContact O-N 2.63Å
644	R	95.6	Very high	91.8	Very high	44 Å²	44	40.9 Å²	40.9	17%	0.166	19%	0.192	C	C	.	.	H	α-helix	trans	-66.5	-39.4	175.4	-67.9	-172.6	74.9	-174.2	11	112.9	R411 Y414 S415 E418 A640 F642 R647 L648	R411-R644 PolarHBondContact O-NH1 3.17Å; Y414-R644 HydrophobicContact CD2-CB 4.32Å; Y414-R644 HydrophobicContact CG-CB 4.37Å; S415-R644 PolarHBondContact OG-NH1 2.93Å; S415-R644 PolarHBondContact OG-NH2 2.93Å; E418-R644 VanDerWaalsContact CD-NH2 3.33Å; E418-R644 IonicContact OE1-CZ 3.47Å; E418-R644 IonicContact OE1-NE 2.92Å; E418-R644 PolarHBondContact OE1-NE 2.98Å; E418-R644 IonicContact OE1-NH2 3.65Å; E418-R644 IonicContact OE2-CZ 3.68Å; E418-R644 IonicContact OE2-NE 3.36Å; E418-R644 IonicContact OE2-NH2 2.68Å; E418-R644 PolarHBondContact OE2-NH2 3.26Å; A640-R644 PolarHBondContact O-N 3.24Å; F642-R644 VanDerWaalsContact C-N 3.34Å; F642-R644 PolarHBondContact O-N 3.27Å; R644-R647 PolarHBondContact O-N 2.75Å; R644-L648 PolarHBondContact O-N 2.95Å; R644-L648 VanDerWaalsContact O-N 3.12Å
645	W	96.1	Very high	90	Very high	1 Å²	1	47 Å²	47	0%	0.004	22%	0.224	C	C	.	.	H	α-helix	trans	-59	-48.1	173.5	-176.7	81.2	0	0	0	111.9	Y414 L539 H542 F543 L641 F642 R647 L648 Y649 P664 A669	Y414-W645 HydrophobicContact CE1-CB 4.25Å; Y414-W645 WeakPolarHBondContact OH-CB 3.44Å; L539-W645 HydrophobicContact CB-CG 3.98Å; L539-W645 HydrophobicContact CD1-CB 4.28Å; L539-W645 HydrophobicContact CD1-CG 4.3Å; L539-W645 HydrophobicContact CD2-CD2 3.91Å; L539-W645 HydrophobicContact CD2-CE3 4.4Å; L539-W645 HydrophobicContact CD2-CG 4.1Å; L539-W645 HydrophobicContact CD2-CZ2 4.47Å; L539-W645 HydrophobicContact CG-CG 4.35Å; L539-W645 VanDerWaalsContact O-CD1 3.26Å; L539-W645 PolarHBondContact O-NE1 3.02Å; H542-W645 AromaticContact CD2-CZ2 3.73Å; H542-W645 AromaticContact CD2-NE1 3.88Å; H542-W645 AromaticContact NE2-CZ2 3.91Å; F543-W645 AromaticContact CE2-CD1 3.47Å; F543-W645 VanDerWaalsContact CE2-CD1 3.47Å; F543-W645 HydrophobicContact CE2-CG 4.38Å; F543-W645 AromaticContact CE2-NE1 3.48Å; F543-W645 AromaticContact CZ-CD1 3.9Å; F543-W645 AromaticContact CZ-NE1 3.5Å; L641-W645 PolarHBondContact O-N 3.25Å; F642-W645 HydrophobicContact CD2-CB 4.34Å; F642-W645 HydrophobicContact CD2-CD2 4.39Å; F642-W645 AromaticContact CD2-CE3 3.8Å; F642-W645 HydrophobicContact CD2-CE3 3.8Å; F642-W645 HydrophobicContact CE2-CD2 4.31Å; F642-W645 AromaticContact CE2-CE3 3.41Å; F642-W645 HydrophobicContact CE2-CE3 3.41Å; F642-W645 VanDerWaalsContact CE2-CE3 3.41Å; F642-W645 AromaticContact CE2-CZ3 3.75Å; F642-W645 HydrophobicContact CE2-CZ3 3.75Å; F642-W645 HydrophobicContact CZ-CE3 4.45Å; F642-W645 WeakPolarHBondContact O-CB 3.12Å; F642-W645 PolarHBondContact O-N 3.24Å; F642-W645 VanDerWaalsContact O-N 3.16Å; W645-R647 VanDerWaalsContact C-N 3.34Å; W645-R647 PolarHBondContact O-N 2.81Å; W645-L648 PolarHBondContact O-N 3.29Å; W645-Y649 HydrophobicContact CE3-CG 4.43Å; W645-Y649 AromaticContact CH2-CD1 3.62Å; W645-Y649 HydrophobicContact CH2-CD1 3.62Å; W645-Y649 AromaticContact CH2-CD2 3.54Å; W645-Y649 HydrophobicContact CH2-CD2 3.54Å; W645-Y649 AromaticContact CH2-CE1 3.89Å; W645-Y649 HydrophobicContact CH2-CE1 3.89Å; W645-Y649 AromaticContact CH2-CE2 3.83Å; W645-Y649 HydrophobicContact CH2-CE2 3.83Å; W645-Y649 AromaticContact CH2-CG 3.44Å; W645-Y649 HydrophobicContact CH2-CG 3.44Å; W645-Y649 VanDerWaalsContact CH2-CG 3.44Å; W645-Y649 AromaticContact CH2-CZ 3.99Å; W645-Y649 HydrophobicContact CZ2-CD1 4.41Å; W645-Y649 AromaticContact CZ2-CD2 3.51Å; W645-Y649 HydrophobicContact CZ2-CD2 3.51Å; W645-Y649 AromaticContact CZ2-CE2 3.95Å; W645-Y649 HydrophobicContact CZ2-CE2 3.95Å; W645-Y649 AromaticContact CZ2-CG 3.78Å; W645-Y649 HydrophobicContact CZ2-CG 3.78Å; W645-Y649 AromaticContact CZ3-CD1 3.81Å; W645-Y649 HydrophobicContact CZ3-CD1 3.81Å; W645-Y649 HydrophobicContact CZ3-CD2 4.35Å; W645-Y649 HydrophobicContact CZ3-CE1 4.37Å; W645-Y649 AromaticContact CZ3-CG 3.8Å; W645-Y649 HydrophobicContact CZ3-CG 3.8Å; W645-Y649 VanDerWaalsContact O-CB 3.27Å; W645-Y649 WeakPolarHBondContact O-CB 3.43Å; W645-Y649 PolarHBondContact O-N 3.46Å; W645-P664 HydrophobicContact CH2-CG 4.35Å; W645-P664 HydrophobicContact CZ3-CG 4.19Å; W645-A669 HydrophobicContact CE3-CB 4.43Å; W645-A669 HydrophobicContact CH2-CB 3.76Å; W645-A669 HydrophobicContact CZ2-CB 4.39Å; W645-A669 HydrophobicContact CZ3-CB 3.79Å
646	N	93.4	Very high	88	Confident	8 Å²	8	48 Å²	48	4%	0.043	24%	0.236	C	C	.	.	H	α-helix	trans	-64.3	-39.2	-178.5	-165.1	18.7	0	0	0	111.3	F642 T643 L648 Y649 R650 Q663 L707	F642-N646 WeakPolarHBondContact O-CB 3.48Å; F642-N646 PolarHBondContact O-N 3.39Å; T643-N646 PolarHBondContact O-N 3.14Å; N646-L648 PolarHBondContact O-N 3.04Å; N646-Y649 PolarHBondContact O-N 3.09Å; N646-R650 PolarHBondContact ND2-NH2 2.71Å; N646-R650 WeakPolarHBondContact O-CG 3.43Å; N646-R650 PolarHBondContact O-N 3.3Å; N646-Q663 PolarHBondContact ND2-OE1 3.01Å; N646-Q663 VanDerWaalsContact ND2-OE1 3.07Å; N646-L707 HydrophobicContact CB-CD1 3.54Å; N646-L707 WeakPolarHBondContact ND2-CD1 3.35Å
647	R	91.8	Very high	85.7	Confident	148 Å²	148	55.3 Å²	55.3	56%	0.558	27%	0.274	S	S	*	.	H	α-helix	trans	-57.8	-46.6	173.2	-173	171.3	76.3	155.8	-0.6	112.3	E418 T643 R644 W645 K651	E418-R647 IonicContact OE1-CZ 2.71Å; E418-R647 IonicContact OE1-NE 2.67Å; E418-R647 IonicContact OE1-NH2 3.24Å; E418-R647 PolarHBondContact OE1-NH2 2.56Å; E418-R647 IonicContact OE2-NH2 2.91Å; E418-R647 PolarHBondContact OE2-NH2 2.92Å; T643-R647 PolarHBondContact O-N 2.63Å; R644-R647 PolarHBondContact O-N 2.75Å; W645-R647 VanDerWaalsContact C-N 3.34Å; W645-R647 PolarHBondContact O-N 2.81Å; R647-K651 WeakPolarHBondContact O-CB 3.4Å; R647-K651 PolarHBondContact O-N 3.09Å; R647-K651 VanDerWaalsContact O-N 3.17Å
648	L	90.8	Very high	83.4	Confident	3 Å²	3	63.4 Å²	63.4	2%	0.016	32%	0.316	C	S	.	.	H	α-helix	trans	-68.2	-41.7	175.6	-80.1	163.9	0	0	0	112.4	Y414 L417 E418 L421 F543 R644 W645 N646 K651 L652	Y414-L648 HydrophobicContact CD1-CD1 3.51Å; Y414-L648 HydrophobicContact CE1-CD1 4.14Å; Y414-L648 HydrophobicContact CG-CD1 4.45Å; L417-L648 HydrophobicContact CD2-CD1 4.25Å; L417-L648 HydrophobicContact CD2-CD2 4.49Å; L417-L648 HydrophobicContact CG-CD2 4.28Å; E418-L648 HydrophobicContact CG-CD1 4.05Å; E418-L648 HydrophobicContact CG-CD2 3.76Å; E418-L648 HydrophobicContact CG-CG 3.98Å; L421-L648 HydrophobicContact CD1-CD2 3.66Å; F543-L648 HydrophobicContact CE2-CB 3.92Å; F543-L648 HydrophobicContact CZ-CB 4.21Å; R644-L648 PolarHBondContact O-N 2.95Å; R644-L648 VanDerWaalsContact O-N 3.12Å; W645-L648 PolarHBondContact O-N 3.29Å; N646-L648 PolarHBondContact O-N 3.04Å; L648-K651 PolarHBondContact O-N 3.15Å; L648-L652 WeakPolarHBondContact O-CB 3.3Å; L648-L652 WeakPolarHBondContact O-CG 3.48Å; L648-L652 PolarHBondContact O-N 3.4Å
649	Y	89.7	Confident	81.1	Confident	53 Å²	53	66 Å²	66	21%	0.208	34%	0.34	C	S	.	.	H	α-helix	trans	-60.4	-47.6	179.7	-173.6	-116.5	0	0	0	111.4	F543 W645 N646 L652 K653	F543-Y649 HydrophobicContact CE1-CD2 4.12Å; F543-Y649 HydrophobicContact CZ-CD2 4.19Å; W645-Y649 HydrophobicContact CE3-CG 4.43Å; W645-Y649 AromaticContact CH2-CD1 3.62Å; W645-Y649 HydrophobicContact CH2-CD1 3.62Å; W645-Y649 AromaticContact CH2-CD2 3.54Å; W645-Y649 HydrophobicContact CH2-CD2 3.54Å; W645-Y649 AromaticContact CH2-CE1 3.89Å; W645-Y649 HydrophobicContact CH2-CE1 3.89Å; W645-Y649 AromaticContact CH2-CE2 3.83Å; W645-Y649 HydrophobicContact CH2-CE2 3.83Å; W645-Y649 AromaticContact CH2-CG 3.44Å; W645-Y649 HydrophobicContact CH2-CG 3.44Å; W645-Y649 VanDerWaalsContact CH2-CG 3.44Å; W645-Y649 AromaticContact CH2-CZ 3.99Å; W645-Y649 HydrophobicContact CZ2-CD1 4.41Å; W645-Y649 AromaticContact CZ2-CD2 3.51Å; W645-Y649 HydrophobicContact CZ2-CD2 3.51Å; W645-Y649 AromaticContact CZ2-CE2 3.95Å; W645-Y649 HydrophobicContact CZ2-CE2 3.95Å; W645-Y649 AromaticContact CZ2-CG 3.78Å; W645-Y649 HydrophobicContact CZ2-CG 3.78Å; W645-Y649 AromaticContact CZ3-CD1 3.81Å; W645-Y649 HydrophobicContact CZ3-CD1 3.81Å; W645-Y649 HydrophobicContact CZ3-CD2 4.35Å; W645-Y649 HydrophobicContact CZ3-CE1 4.37Å; W645-Y649 AromaticContact CZ3-CG 3.8Å; W645-Y649 HydrophobicContact CZ3-CG 3.8Å; W645-Y649 VanDerWaalsContact O-CB 3.27Å; W645-Y649 WeakPolarHBondContact O-CB 3.43Å; W645-Y649 PolarHBondContact O-N 3.46Å; N646-Y649 PolarHBondContact O-N 3.09Å; Y649-L652 PolarHBondContact O-N 2.82Å; Y649-K653 HydrophobicContact CD1-CD 4.28Å; Y649-K653 HydrophobicContact CE1-CD 3.75Å; Y649-K653 HydrophobicContact CE2-CD 4.45Å; Y649-K653 VanDerWaalsContact O-CB 3.28Å; Y649-K653 WeakPolarHBondContact O-CB 3.35Å; Y649-K653 PolarHBondContact O-N 3.43Å; Y649-K653 VanDerWaalsContact OH-CE 3.28Å; Y649-K653 WeakPolarHBondContact OH-CE 3.32Å; Y649-K653 PolarHBondContact OH-NZ 3.16Å
650	R	87.4	Confident	79.1	Confident	114 Å²	114	70.2 Å²	70.2	43%	0.43	37%	0.369	S	S	.	.	H	α-helix	trans	-60.4	-48.4	172.9	-68.3	-179.8	-168.5	153.8	-4.3	111.6	N646 L652 K653 S654 Q663	N646-R650 PolarHBondContact ND2-NH2 2.71Å; N646-R650 WeakPolarHBondContact O-CG 3.43Å; N646-R650 PolarHBondContact O-N 3.3Å; R650-L652 VanDerWaalsContact C-N 3.31Å; R650-L652 PolarHBondContact O-N 2.91Å; R650-K653 PolarHBondContact O-N 3.03Å; R650-S654 PolarHBondContact O-N 2.96Å; R650-S654 PolarHBondContact O-OG 3.39Å; R650-Q663 VanDerWaalsContact NH2-CD 3.28Å
651	K	85.8	Confident	77.3	Confident	97 Å²	97	76.3 Å²	76.3	42%	0.422	40%	0.397	S	S	.	.	H	α-helix	trans	-61.5	-34	-179.1	-178.1	175	177	178.8	0	113.6	L421 R647 L648 S654	L421-K651 WeakPolarHBondContact O-CE 3.4Å; L421-K651 PolarHBondContact O-NZ 3.03Å; R647-K651 WeakPolarHBondContact O-CB 3.4Å; R647-K651 PolarHBondContact O-N 3.09Å; R647-K651 VanDerWaalsContact O-N 3.17Å; L648-K651 PolarHBondContact O-N 3.15Å; K651-S654 PolarHBondContact O-OG 2.89Å
652	L	82.1	Confident	76.1	Confident	3 Å²	3	84.6 Å²	84.6	2%	0.016	43%	0.427	C	S	.	.	H	α-helix	trans	-81.6	-38.9	174.9	-70.1	170.7	0	0	0	111.7	L421 Y441 F543 L648 Y649 R650 S654 L655	L421-L652 HydrophobicContact CD1-CD1 4.3Å; L421-L652 HydrophobicContact CD1-CD2 3.92Å; L421-L652 HydrophobicContact CD1-CG 4.19Å; L421-L652 HydrophobicContact CD2-CD2 3.98Å; Y441-L652 HydrophobicContact CE2-CD1 4.42Å; F543-L652 HydrophobicContact CD1-CD1 3.5Å; F543-L652 VanDerWaalsContact CD1-CD1 3.5Å; F543-L652 HydrophobicContact CE1-CD1 3.73Å; F543-L652 HydrophobicContact CG-CD1 4.02Å; F543-L652 HydrophobicContact CZ-CD1 4.41Å; L648-L652 WeakPolarHBondContact O-CB 3.3Å; L648-L652 WeakPolarHBondContact O-CG 3.48Å; L648-L652 PolarHBondContact O-N 3.4Å; Y649-L652 PolarHBondContact O-N 2.82Å; R650-L652 VanDerWaalsContact C-N 3.31Å; R650-L652 PolarHBondContact O-N 2.91Å; L652-S654 VanDerWaalsContact C-N 3.35Å; L652-S654 PolarHBondContact O-N 3.4Å; L652-L655 HydrophobicContact CD2-CD1 4.46Å; L652-L655 WeakPolarHBondContact O-CB 3.42Å; L652-L655 PolarHBondContact O-N 3.18Å
653	K	76.9	Confident	75.2	Confident	73 Å²	73	86.9 Å²	86.9	32%	0.317	44%	0.438	S	S	.	.	H	α-helix	trans	-62	-36.1	173.7	-95.9	-169.7	153.7	-171.2	0	113.5	Y649 R650 L655 T656	Y649-K653 HydrophobicContact CD1-CD 4.28Å; Y649-K653 HydrophobicContact CE1-CD 3.75Å; Y649-K653 HydrophobicContact CE2-CD 4.45Å; Y649-K653 VanDerWaalsContact O-CB 3.28Å; Y649-K653 WeakPolarHBondContact O-CB 3.35Å; Y649-K653 PolarHBondContact O-N 3.43Å; Y649-K653 VanDerWaalsContact OH-CE 3.28Å; Y649-K653 WeakPolarHBondContact OH-CE 3.32Å; Y649-K653 PolarHBondContact OH-NZ 3.16Å; R650-K653 PolarHBondContact O-N 3.03Å; K653-L655 PolarHBondContact O-N 3.39Å; K653-T656 CarbonylContact O-C 3.46Å; K653-T656 PolarHBondContact O-N 2.86Å
654	S	62	Low	74.8	Confident	94 Å²	94	85 Å²	85	66%	0.657	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-9.2	177.6	52.2	0	0	0	0	113.8	R650 K651 L652 T656	R650-S654 PolarHBondContact O-N 2.96Å; R650-S654 PolarHBondContact O-OG 3.39Å; K651-S654 PolarHBondContact O-OG 2.89Å; L652-S654 VanDerWaalsContact C-N 3.35Å; L652-S654 PolarHBondContact O-N 3.4Å; S654-T656 VanDerWaalsContact C-N 3.34Å
655	L	59.7	Low	74.7	Confident	129 Å²	129	85.6 Å²	85.6	68%	0.675	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	6.2	170.5	-54	173.3	0	0	0	112.4	L652 K653	L652-L655 HydrophobicContact CD2-CD1 4.46Å; L652-L655 WeakPolarHBondContact O-CB 3.42Å; L652-L655 PolarHBondContact O-N 3.18Å; K653-L655 PolarHBondContact O-N 3.39Å
656	T	55.4	Low	74.7	Confident	75 Å²	75	86.6 Å²	86.6	46%	0.46	44%	0.436	S	S	.	.	S	Bend	trans	-134.9	104.2	179.5	-52.9	0	0	0	0	109.3	Q439 K653 S654	Q439-T656 PolarHBondContact NE2-OG1 2.71Å; K653-T656 CarbonylContact O-C 3.46Å; K653-T656 PolarHBondContact O-N 2.86Å; S654-T656 VanDerWaalsContact C-N 3.34Å
657	I	51.3	Low	74.9	Confident	155 Å²	155	87 Å²	87	80%	0.795	44%	0.442	S	S	*	.	S	Bend	trans	-63.3	142.4	179.8	-52.5	176	0	0	0	109
658	L	50	Low	75	Confident	169 Å²	169	83.3 Å²	83.3	89%	0.885	43%	0.431	S	S	*	.			trans	72.1	86	-177.4	-59.1	137.2	0	0	0	116.4
659	A	49.2	Very low	75.2	Confident	70 Å²	70	83.3 Å²	83.3	58%	0.579	43%	0.431	S	S	*	.			trans	-151.1	146.5	155.4	0	0	0	0	0	111.2
660	T	54.7	Low	75.6	Confident	126 Å²	126	82.1 Å²	82.1	77%	0.773	43%	0.427	S	S	*	.			trans	-66.5	146.5	-179.8	30.2	0	0	0	0	113.6	R662	T660-R662 VanDerWaalsContact C-N 3.28Å; T660-R662 PolarHBondContact O-N 3.3Å
661	D	60.7	Low	76	Confident	158 Å²	158	81.7 Å²	81.7	85%	0.845	43%	0.431	S	S	*	.			trans	-78.7	-0.9	-170.9	-164.7	38.6	0	0	0	114.9	Q663	D661-Q663 PolarHBondContact O-N 3.34Å; D661-Q663 VanDerWaalsContact O-N 3.1Å
662	R	72.6	Confident	76.4	Confident	188 Å²	188	79.7 Å²	79.7	71%	0.709	43%	0.433	S	S	*	.	P	Polyproline II helix	trans	-65.7	116.3	178.8	179.6	172.2	164	174.1	-8.4	110.7	T660 E668	T660-R662 VanDerWaalsContact C-N 3.28Å; T660-R662 PolarHBondContact O-N 3.3Å; R662-E668 IonicContact NH2-OE1 3.07Å; R662-E668 PolarHBondContact NH2-OE1 3.37Å
663	Q	78.4	Confident	77	Confident	50 Å²	50	79.8 Å²	79.8	23%	0.234	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-70.2	132.3	173.5	-56.3	-169.2	51	0	0	110.5	N646 R650 D661	N646-Q663 PolarHBondContact ND2-OE1 3.01Å; N646-Q663 VanDerWaalsContact ND2-OE1 3.07Å; R650-Q663 VanDerWaalsContact NH2-CD 3.28Å; D661-Q663 PolarHBondContact O-N 3.34Å; D661-Q663 VanDerWaalsContact O-N 3.1Å
664	P	88.1	Confident	77.9	Confident	26 Å²	26	85.6 Å²	85.6	17%	0.169	45%	0.454	C	S	.	.	P	Polyproline II helix	trans	-77.2	146.4	177.3	31.4	-34.7	0	0	0	111.5	F642 W645 E668 A669	F642-P664 WeakPolarHBondContact CZ-O 3.41Å; W645-P664 HydrophobicContact CH2-CG 4.35Å; W645-P664 HydrophobicContact CZ3-CG 4.19Å; P664-E668 WeakPolarHBondContact CA-OE2 3.48Å; P664-E668 HydrophobicContact CB-CB 4.11Å; P664-A669 HydrophobicContact CB-CB 4.16Å; P664-A669 HydrophobicContact CG-CB 4.02Å
665	M	93.3	Very high	79.4	Confident	58 Å²	58	84 Å²	84	29%	0.286	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-63.5	157.3	165	-66.7	-173.9	-80.3	0	0	111.1	G667 E668 A669 L706	M665-G667 PolarHBondContact O-N 3.16Å; M665-E668 HydrophobicContact CB-CB 4.4Å; M665-E668 HydrophobicContact CB-CG 4.08Å; M665-E668 HydrophobicContact CE-CG 4.02Å; M665-E668 VanDerWaalsContact CE-OE1 3.31Å; M665-E668 WeakPolarHBondContact CE-OE1 3.32Å; M665-E668 PolarHBondContact N-OE2 3.08Å; M665-E668 PolarHBondContact O-N 3.19Å; M665-E668 VanDerWaalsContact O-N 3.08Å; M665-A669 WeakPolarHBondContact O-CB 3.37Å; M665-A669 PolarHBondContact O-N 3.08Å; M665-L706 HydrophobicContact CB-CD2 4.44Å; M665-L706 HydrophobicContact CG-CD2 3.72Å; M665-L706 HydrophobicContact CG-CG 3.99Å
666	Y	96.5	Very high	81.2	Confident	22 Å²	22	78.5 Å²	78.5	9%	0.086	41%	0.412	C	S	.	.	H	α-helix	trans	-54.5	-38.9	178.8	174.4	-98.2	0	0	0	113.1	L539 K638 F642 K670 E703 F705	L539-Y666 HydrophobicContact CD1-CD2 4.13Å; L539-Y666 HydrophobicContact CD1-CE2 3.77Å; K638-Y666 HydrophobicContact CB-CE2 4.2Å; K638-Y666 HydrophobicContact CD-CE1 3.75Å; F642-Y666 HydrophobicContact CB-CD2 3.8Å; F642-Y666 HydrophobicContact CB-CE2 4.26Å; F642-Y666 HydrophobicContact CD1-CD2 4.02Å; F642-Y666 HydrophobicContact CD1-CG 4.48Å; F642-Y666 AromaticContact CD2-CD2 3.9Å; F642-Y666 HydrophobicContact CD2-CD2 3.9Å; F642-Y666 HydrophobicContact CE2-CD2 4.47Å; F642-Y666 AromaticContact CG-CD2 3.66Å; F642-Y666 HydrophobicContact CG-CD2 3.66Å; Y666-K670 HydrophobicContact CD1-CD 3.91Å; Y666-K670 HydrophobicContact CD2-CD 4.24Å; Y666-K670 HydrophobicContact CE1-CD 3.46Å; Y666-K670 VanDerWaalsContact CE1-CD 3.46Å; Y666-K670 HydrophobicContact CE2-CD 3.83Å; Y666-K670 HydrophobicContact CG-CD 4.3Å; Y666-K670 VanDerWaalsContact CZ-CD 3.41Å; Y666-K670 WeakPolarHBondContact O-CB 3.39Å; Y666-K670 WeakPolarHBondContact O-CD 3.36Å; Y666-K670 VanDerWaalsContact O-CG 3.23Å; Y666-K670 WeakPolarHBondContact O-CG 3.29Å; Y666-K670 PolarHBondContact O-N 3.12Å; Y666-E703 HydrophobicContact CD1-CB 3.82Å; Y666-E703 HydrophobicContact CD1-CG 4.12Å; Y666-E703 HydrophobicContact CE1-CB 4.2Å; Y666-E703 HydrophobicContact CE1-CG 3.97Å; Y666-F705 HydrophobicContact CD1-CD1 4.34Å; Y666-F705 AromaticContact CD1-CE1 3.5Å; Y666-F705 HydrophobicContact CD1-CE1 3.5Å; Y666-F705 AromaticContact CD1-CZ 3.93Å; Y666-F705 HydrophobicContact CD1-CZ 3.93Å; Y666-F705 HydrophobicContact CD2-CE1 4.11Å; Y666-F705 HydrophobicContact CD2-CE2 4.45Å; Y666-F705 AromaticContact CD2-CZ 3.64Å; Y666-F705 HydrophobicContact CD2-CZ 3.64Å; Y666-F705 HydrophobicContact CE1-CE1 4.14Å; Y666-F705 HydrophobicContact CE2-CZ 4.25Å; Y666-F705 HydrophobicContact CG-CD1 4.32Å; Y666-F705 AromaticContact CG-CE1 3.46Å; Y666-F705 HydrophobicContact CG-CE1 3.46Å; Y666-F705 VanDerWaalsContact CG-CE1 3.46Å; Y666-F705 HydrophobicContact CG-CE2 4.3Å; Y666-F705 AromaticContact CG-CZ 3.44Å; Y666-F705 HydrophobicContact CG-CZ 3.44Å; Y666-F705 VanDerWaalsContact CG-CZ 3.44Å; Y666-F705 PolarHBondContact N-O 2.96Å
667	G	95.8	Very high	83.2	Confident	16 Å²	16	75.3 Å²	75.3	17%	0.165	39%	0.392	C	S	.	.	H	α-helix	trans	-65.4	-48.4	173.8	0	0	0	0	0	113.1	M665 K670 M671 E703	M665-G667 PolarHBondContact O-N 3.16Å; G667-K670 PolarHBondContact O-N 3.18Å; G667-M671 WeakPolarHBondContact O-CG 3.47Å; G667-M671 PolarHBondContact O-N 3.43Å; G667-E703 WeakPolarHBondContact CA-O 3.25Å; G667-E703 PolarHBondContact N-O 2.85Å
668	E	95	Very high	85.4	Confident	71 Å²	71	71.5 Å²	71.5	33%	0.332	37%	0.373	S	S	.	.	H	α-helix	trans	-60.1	-50.9	178	-65.5	174.4	149.6	0	0	111.1	R662 P664 M665 K670 M671 A672	R662-E668 IonicContact NH2-OE1 3.07Å; R662-E668 PolarHBondContact NH2-OE1 3.37Å; P664-E668 WeakPolarHBondContact CA-OE2 3.48Å; P664-E668 HydrophobicContact CB-CB 4.11Å; M665-E668 HydrophobicContact CB-CB 4.4Å; M665-E668 HydrophobicContact CB-CG 4.08Å; M665-E668 HydrophobicContact CE-CG 4.02Å; M665-E668 VanDerWaalsContact CE-OE1 3.31Å; M665-E668 WeakPolarHBondContact CE-OE1 3.32Å; M665-E668 PolarHBondContact N-OE2 3.08Å; M665-E668 PolarHBondContact O-N 3.19Å; M665-E668 VanDerWaalsContact O-N 3.08Å; E668-K670 PolarHBondContact O-N 3.17Å; E668-M671 PolarHBondContact O-N 3.27Å; E668-A672 PolarHBondContact O-N 2.93Å
669	A	95.3	Very high	87.6	Confident	2 Å²	2	63.5 Å²	63.5	2%	0.017	33%	0.33	C	S	.	.	H	α-helix	trans	-55.7	-38.1	176.7	0	0	0	0	0	111.8	L539 H542 F642 W645 P664 M665	L539-A669 HydrophobicContact CD2-CB 3.87Å; H542-A669 PolarHBondContact NE2-O 3.5Å; F642-A669 HydrophobicContact CE2-CB 3.69Å; F642-A669 HydrophobicContact CZ-CB 4.08Å; W645-A669 HydrophobicContact CE3-CB 4.43Å; W645-A669 HydrophobicContact CH2-CB 3.76Å; W645-A669 HydrophobicContact CZ2-CB 4.39Å; W645-A669 HydrophobicContact CZ3-CB 3.79Å; P664-A669 HydrophobicContact CB-CB 4.16Å; P664-A669 HydrophobicContact CG-CB 4.02Å; M665-A669 WeakPolarHBondContact O-CB 3.37Å; M665-A669 PolarHBondContact O-N 3.08Å
670	K	96.8	Very high	89.9	Confident	28 Å²	28	61.9 Å²	61.9	12%	0.122	31%	0.311	C	S	.	.	H	α-helix	trans	-72.1	-38.7	174.5	-74.5	173	56.9	-106.4	0	112.7	A538 L539 Y666 G667 E668 A672 A673 Q677 E703	A538-K670 HydrophobicContact CB-CB 4.1Å; A538-K670 HydrophobicContact CB-CG 4.07Å; L539-K670 HydrophobicContact CD2-CG 3.64Å; L539-K670 HydrophobicContact CG-CD 4.36Å; L539-K670 HydrophobicContact CG-CG 3.75Å; Y666-K670 HydrophobicContact CD1-CD 3.91Å; Y666-K670 HydrophobicContact CD2-CD 4.24Å; Y666-K670 HydrophobicContact CE1-CD 3.46Å; Y666-K670 VanDerWaalsContact CE1-CD 3.46Å; Y666-K670 HydrophobicContact CE2-CD 3.83Å; Y666-K670 HydrophobicContact CG-CD 4.3Å; Y666-K670 VanDerWaalsContact CZ-CD 3.41Å; Y666-K670 WeakPolarHBondContact O-CB 3.39Å; Y666-K670 WeakPolarHBondContact O-CD 3.36Å; Y666-K670 VanDerWaalsContact O-CG 3.23Å; Y666-K670 WeakPolarHBondContact O-CG 3.29Å; Y666-K670 PolarHBondContact O-N 3.12Å; G667-K670 PolarHBondContact O-N 3.18Å; E668-K670 PolarHBondContact O-N 3.17Å; K670-A672 VanDerWaalsContact C-N 3.35Å; K670-A673 PolarHBondContact O-N 3.37Å; K670-Q677 PolarHBondContact O-NE2 3.42Å; K670-E703 IonicContact NZ-OE1 3.94Å; K670-E703 PolarHBondContact NZ-OE1 3.1Å; K670-E703 IonicContact NZ-OE2 3.25Å; K670-E703 PolarHBondContact NZ-OE2 3.4Å
671	M	96.1	Very high	91.8	Very high	105 Å²	105	61.3 Å²	61.3	52%	0.517	30%	0.299	S	S	.	.	H	α-helix	trans	-71.1	-29.8	179.4	-72.6	-56.1	-61.7	0	0	112.9	G667 E668 A673 Q677	G667-M671 WeakPolarHBondContact O-CG 3.47Å; G667-M671 PolarHBondContact O-N 3.43Å; E668-M671 PolarHBondContact O-N 3.27Å; M671-A673 PolarHBondContact O-N 3.02Å; M671-Q677 HydrophobicContact CE-CG 4.3Å; M671-Q677 HydrophobicContact SD-CG 4.11Å
672	A	94.9	Very high	93.4	Very high	56 Å²	56	56.6 Å²	56.6	46%	0.463	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-21.9	174.3	0	0	0	0	0	114	E668 K670 R674	E668-A672 PolarHBondContact O-N 2.93Å; K670-A672 VanDerWaalsContact C-N 3.35Å; A672-R674 PolarHBondContact O-N 2.91Å
673	A	94.8	Very high	94.5	Very high	4 Å²	4	47.6 Å²	47.6	3%	0.033	24%	0.238	C	C	.	.			trans	-73.4	64.8	173.4	0	0	0	0	0	112.1	A538 K670 M671 Y676 Q677	A538-A673 HydrophobicContact CB-CB 4.36Å; A538-A673 VanDerWaalsContact O-CB 3.25Å; A538-A673 WeakPolarHBondContact O-CB 3.39Å; K670-A673 PolarHBondContact O-N 3.37Å; M671-A673 PolarHBondContact O-N 3.02Å; A673-Y676 WeakPolarHBondContact O-CB 3.32Å; A673-Y676 PolarHBondContact O-N 3.07Å; A673-Y676 VanDerWaalsContact O-N 3.09Å; A673-Q677 PolarHBondContact O-N 3.25Å; A673-Q677 VanDerWaalsContact O-N 3.13Å
674	R	95	Very high	95.2	Very high	195 Å²	195	46.6 Å²	46.6	74%	0.736	23%	0.233	S	C	*	.	H	α-helix	trans	-50.4	-47.9	-169.1	-62.6	-173.8	-178	-159.1	1.3	114.2	A672 Y676 Q677 I678	A672-R674 PolarHBondContact O-N 2.91Å; R674-Y676 VanDerWaalsContact C-N 3.35Å; R674-Y676 PolarHBondContact O-N 3.37Å; R674-Q677 PolarHBondContact O-N 3.01Å; R674-Q677 VanDerWaalsContact O-N 3.14Å; R674-I678 WeakPolarHBondContact O-CG1 3.42Å; R674-I678 PolarHBondContact O-N 3.19Å
675	P	94.9	Very high	95.4	Very high	62 Å²	62	51.3 Å²	51.3	40%	0.403	25%	0.251	S	S	.	.	H	α-helix	trans	-61.2	-40.1	-180	-23.9	35.6	0	0	0	113.3	P578 Y581 Q677 I678 A679	P578-P675 HydrophobicContact CB-CB 4.31Å; Y581-P675 HydrophobicContact CE2-CB 3.93Å; P675-Q677 VanDerWaalsContact C-N 3.34Å; P675-Q677 PolarHBondContact O-N 3.48Å; P675-I678 PolarHBondContact O-N 3.32Å; P675-A679 WeakPolarHBondContact O-CB 3.4Å; P675-A679 PolarHBondContact O-N 2.96Å
676	Y	97.1	Very high	95.4	Very high	13 Å²	13	48.9 Å²	48.9	5%	0.051	24%	0.239	C	C	.	.	H	α-helix	trans	-63.1	-41.3	175.8	-177.2	-85.5	0	0	0	111.6	R529 L533 A538 Y581 A673 R674 K680	R529-Y676 PolarHBondContact NH2-OH 2.89Å; L533-Y676 HydrophobicContact CB-CD2 4.28Å; L533-Y676 HydrophobicContact CB-CE2 3.59Å; L533-Y676 HydrophobicContact CD1-CE1 4.28Å; L533-Y676 HydrophobicContact CD1-CE2 4.24Å; L533-Y676 HydrophobicContact CG-CE2 4.46Å; L533-Y676 WeakPolarHBondContact O-CE2 3.45Å; A538-Y676 HydrophobicContact CB-CD1 3.55Å; A538-Y676 HydrophobicContact CB-CE1 3.73Å; A538-Y676 HydrophobicContact CB-CG 4.05Å; Y581-Y676 HydrophobicContact CE1-CD2 4.18Å; Y581-Y676 WeakPolarHBondContact OH-CA 3.21Å; Y581-Y676 WeakPolarHBondContact OH-CB 3.25Å; A673-Y676 WeakPolarHBondContact O-CB 3.32Å; A673-Y676 PolarHBondContact O-N 3.07Å; A673-Y676 VanDerWaalsContact O-N 3.09Å; R674-Y676 VanDerWaalsContact C-N 3.35Å; R674-Y676 PolarHBondContact O-N 3.37Å; Y676-K680 HydrophobicContact CE1-CD 4.12Å; Y676-K680 WeakPolarHBondContact O-CB 3.33Å; Y676-K680 PolarHBondContact O-N 3.28Å
677	Q	97.3	Very high	95	Very high	8 Å²	8	47.9 Å²	47.9	4%	0.037	24%	0.235	C	C	.	.	H	α-helix	trans	-70.4	-38.9	-180	-60.1	-61.1	-16.9	0	0	112.1	K670 M671 A673 R674 P675 K680 Q681	K670-Q677 PolarHBondContact O-NE2 3.42Å; M671-Q677 HydrophobicContact CE-CG 4.3Å; M671-Q677 HydrophobicContact SD-CG 4.11Å; A673-Q677 PolarHBondContact O-N 3.25Å; A673-Q677 VanDerWaalsContact O-N 3.13Å; R674-Q677 PolarHBondContact O-N 3.01Å; R674-Q677 VanDerWaalsContact O-N 3.14Å; P675-Q677 VanDerWaalsContact C-N 3.34Å; P675-Q677 PolarHBondContact O-N 3.48Å; Q677-K680 PolarHBondContact O-N 3.32Å; Q677-Q681 WeakPolarHBondContact O-CB 3.4Å; Q677-Q681 VanDerWaalsContact O-CG 3.26Å; Q677-Q681 WeakPolarHBondContact O-CG 3.48Å; Q677-Q681 PolarHBondContact O-N 2.95Å
678	I	96.7	Very high	94.7	Very high	75 Å²	75	53 Å²	53	39%	0.385	26%	0.255	S	S	.	.	H	α-helix	trans	-60.4	-54.9	174.2	-69.6	159.2	0	0	0	110.2	P578 R674 P675 K680 Q681 Q682	P578-I678 HydrophobicContact CG-CB 4.25Å; P578-I678 HydrophobicContact CG-CG2 3.9Å; R674-I678 WeakPolarHBondContact O-CG1 3.42Å; R674-I678 PolarHBondContact O-N 3.19Å; P675-I678 PolarHBondContact O-N 3.32Å; I678-K680 PolarHBondContact O-N 2.94Å; I678-Q681 PolarHBondContact O-N 3.26Å; I678-Q681 VanDerWaalsContact O-N 3.09Å; I678-Q682 HydrophobicContact CG2-CG 4.35Å; I678-Q682 WeakPolarHBondContact O-CG 3.48Å; I678-Q682 PolarHBondContact O-N 2.98Å
679	A	96.9	Very high	94.5	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-56.9	-38.5	178.4	0	0	0	0	0	112.4	L533 L577 P578 Y581 P675 W683	L533-A679 VanDerWaalsContact CD2-C 3.49Å; L533-A679 HydrophobicContact CD2-CB 3.55Å; L577-A679 HydrophobicContact CD2-CB 4.04Å; P578-A679 HydrophobicContact CG-CB 4.37Å; Y581-A679 HydrophobicContact CD1-CB 3.96Å; Y581-A679 HydrophobicContact CE1-CB 4.4Å; Y581-A679 HydrophobicContact CG-CB 4.16Å; P675-A679 WeakPolarHBondContact O-CB 3.4Å; P675-A679 PolarHBondContact O-N 2.96Å; A679-W683 PolarHBondContact O-N 3.06Å
680	K	96.6	Very high	94.1	Very high	37 Å²	37	57.1 Å²	57.1	16%	0.161	28%	0.277	C	S	.	.	H	α-helix	trans	-66.8	-42.8	176.2	176.5	-171.1	136.2	-154.4	0	112.5	L533 Y676 Q677 I678 F684	L533-K680 HydrophobicContact CD1-CB 3.74Å; L533-K680 HydrophobicContact CD1-CG 4.03Å; L533-K680 HydrophobicContact CD2-CB 4.08Å; Y676-K680 HydrophobicContact CE1-CD 4.12Å; Y676-K680 WeakPolarHBondContact O-CB 3.33Å; Y676-K680 PolarHBondContact O-N 3.28Å; Q677-K680 PolarHBondContact O-N 3.32Å; I678-K680 PolarHBondContact O-N 2.94Å; K680-F684 HydrophobicContact CD-CE2 4.33Å; K680-F684 HydrophobicContact CD-CZ 4.36Å; K680-F684 HydrophobicContact CG-CD2 4.37Å; K680-F684 HydrophobicContact CG-CE1 4.24Å; K680-F684 HydrophobicContact CG-CE2 3.9Å; K680-F684 HydrophobicContact CG-CZ 3.84Å; K680-F684 WeakPolarHBondContact O-CD1 3.38Å; K680-F684 VanDerWaalsContact O-CG 3.28Å; K680-F684 WeakPolarHBondContact O-CG 3.4Å; K680-F684 PolarHBondContact O-N 2.87Å
681	Q	95.3	Very high	93.5	Very high	113 Å²	113	58 Å²	58	53%	0.528	29%	0.294	S	S	.	.	H	α-helix	trans	-66.5	-45.9	177.2	-76.3	168.8	-14.2	0	0	111	Q677 I678 W683 F684 K685	Q677-Q681 WeakPolarHBondContact O-CB 3.4Å; Q677-Q681 VanDerWaalsContact O-CG 3.26Å; Q677-Q681 WeakPolarHBondContact O-CG 3.48Å; Q677-Q681 PolarHBondContact O-N 2.95Å; I678-Q681 PolarHBondContact O-N 3.26Å; I678-Q681 VanDerWaalsContact O-N 3.09Å; Q681-W683 VanDerWaalsContact C-N 3.31Å; Q681-W683 PolarHBondContact O-N 3.02Å; Q681-F684 PolarHBondContact O-N 3.05Å; Q681-K685 WeakPolarHBondContact O-CB 3.14Å; Q681-K685 PolarHBondContact O-N 3.12Å
682	Q	94.9	Very high	93.1	Very high	59 Å²	59	53.6 Å²	53.6	28%	0.276	27%	0.273	S	S	.	.	H	α-helix	trans	-56.9	-42.8	175.2	-70.2	173.7	-40	0	0	111.9	P576 I678 S686	P576-Q682 PolarHBondContact O-NE2 3.45Å; P576-Q682 PolarHBondContact O-OE1 3.18Å; I678-Q682 HydrophobicContact CG2-CG 4.35Å; I678-Q682 WeakPolarHBondContact O-CG 3.48Å; I678-Q682 PolarHBondContact O-N 2.98Å; Q682-S686 WeakPolarHBondContact O-CB 3.33Å; Q682-S686 PolarHBondContact O-N 3.44Å
683	W	93.8	Very high	92.8	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-68.6	-43.4	176.2	-177.1	52.6	0	0	0	113.5	T528 R529 I532 R570 L574 A679 Q681 K685 S686 L687 W695	T528-W683 HydrophobicContact CG2-CZ2 3.68Å; R529-W683 HydrophobicContact CB-CE3 4.24Å; R529-W683 HydrophobicContact CB-CH2 3.53Å; R529-W683 HydrophobicContact CB-CZ2 4.46Å; R529-W683 HydrophobicContact CB-CZ3 3.4Å; R529-W683 VanDerWaalsContact CB-CZ3 3.4Å; R529-W683 HydrophobicContact CG-CE3 4Å; R529-W683 HydrophobicContact CG-CH2 4.16Å; R529-W683 HydrophobicContact CG-CZ3 3.48Å; R529-W683 VanDerWaalsContact CG-CZ3 3.48Å; I532-W683 HydrophobicContact CD1-CB 4.25Å; I532-W683 HydrophobicContact CD1-CD2 3.77Å; I532-W683 HydrophobicContact CD1-CG 3.47Å; I532-W683 VanDerWaalsContact CD1-CG 3.47Å; I532-W683 HydrophobicContact CD1-CZ2 4.43Å; R570-W683 PolarHBondContact O-NE1 2.9Å; L574-W683 HydrophobicContact CD1-CB 4.09Å; A679-W683 PolarHBondContact O-N 3.06Å; Q681-W683 VanDerWaalsContact C-N 3.31Å; Q681-W683 PolarHBondContact O-N 3.02Å; W683-K685 VanDerWaalsContact C-N 3.3Å; W683-K685 PolarHBondContact O-N 3.04Å; W683-S686 PolarHBondContact O-N 2.91Å; W683-L687 HydrophobicContact CD2-CD1 3.78Å; W683-L687 HydrophobicContact CD2-CG 4.41Å; W683-L687 VanDerWaalsContact CE2-CD1 3.49Å; W683-L687 HydrophobicContact CE3-CD1 4.07Å; W683-L687 HydrophobicContact CG-CD1 4.4Å; W683-L687 HydrophobicContact CH2-CD1 3.88Å; W683-L687 HydrophobicContact CZ2-CD1 3.59Å; W683-L687 HydrophobicContact CZ2-CD2 4.32Å; W683-L687 HydrophobicContact CZ2-CG 4.31Å; W683-L687 HydrophobicContact CZ3-CD1 4.08Å; W683-L687 WeakPolarHBondContact O-CG 3.37Å; W683-L687 PolarHBondContact O-N 2.95Å; W683-W695 AromaticContact CH2-CE3 3.73Å; W683-W695 HydrophobicContact CH2-CE3 3.73Å; W683-W695 AromaticContact CH2-CZ3 3.61Å; W683-W695 HydrophobicContact CH2-CZ3 3.61Å; W683-W695 HydrophobicContact CZ3-CD2 4.39Å; W683-W695 AromaticContact CZ3-CE3 3.57Å; W683-W695 HydrophobicContact CZ3-CE3 3.57Å; W683-W695 AromaticContact CZ3-CZ3 3.68Å; W683-W695 HydrophobicContact CZ3-CZ3 3.68Å
684	F	93.4	Very high	92.6	Very high	29 Å²	29	53.2 Å²	53.2	13%	0.127	27%	0.266	C	S	.	.	H	α-helix	trans	-60.9	-40.4	175.6	-70.5	-5.5	0	0	0	111.9	K680 Q681 Q688 W695	K680-F684 HydrophobicContact CD-CE2 4.33Å; K680-F684 HydrophobicContact CD-CZ 4.36Å; K680-F684 HydrophobicContact CG-CD2 4.37Å; K680-F684 HydrophobicContact CG-CE1 4.24Å; K680-F684 HydrophobicContact CG-CE2 3.9Å; K680-F684 HydrophobicContact CG-CZ 3.84Å; K680-F684 WeakPolarHBondContact O-CD1 3.38Å; K680-F684 VanDerWaalsContact O-CG 3.28Å; K680-F684 WeakPolarHBondContact O-CG 3.4Å; K680-F684 PolarHBondContact O-N 2.87Å; Q681-F684 PolarHBondContact O-N 3.05Å; F684-Q688 PolarHBondContact O-N 2.79Å; F684-W695 HydrophobicContact CD1-CB 3.71Å; F684-W695 HydrophobicContact CD1-CD2 4.44Å; F684-W695 AromaticContact CD1-CG 3.96Å; F684-W695 HydrophobicContact CD1-CG 3.96Å; F684-W695 HydrophobicContact CD2-CB 4.47Å; F684-W695 HydrophobicContact CE1-CB 3.64Å; F684-W695 AromaticContact CE1-CD1 3.74Å; F684-W695 AromaticContact CE1-CD2 3.59Å; F684-W695 HydrophobicContact CE1-CD2 3.59Å; F684-W695 HydrophobicContact CE1-CE3 4.11Å; F684-W695 AromaticContact CE1-CG 3.33Å; F684-W695 HydrophobicContact CE1-CG 3.33Å; F684-W695 HydrophobicContact CE2-CB 4.4Å; F684-W695 AromaticContact CE2-CD1 3.95Å; F684-W695 HydrophobicContact CE2-CG 4.21Å; F684-W695 HydrophobicContact CG-CB 4.14Å; F684-W695 HydrophobicContact CZ-CB 4Å; F684-W695 AromaticContact CZ-CD1 3.35Å; F684-W695 AromaticContact CZ-CD2 3.95Å; F684-W695 HydrophobicContact CZ-CD2 3.95Å; F684-W695 AromaticContact CZ-CG 3.48Å; F684-W695 HydrophobicContact CZ-CG 3.48Å; F684-W695 VanDerWaalsContact CZ-CG 3.48Å; F684-W695 AromaticContact CZ-NE1 3.82Å
685	K	92.7	Very high	92.5	Very high	125 Å²	125	45 Å²	45	54%	0.543	24%	0.235	S	C	.	.	H	α-helix	trans	-61.7	-50.4	174	177.4	173.1	171.5	175.2	0	111.1	Q681 W683 L687 Q688 E689	Q681-K685 WeakPolarHBondContact O-CB 3.14Å; Q681-K685 PolarHBondContact O-N 3.12Å; W683-K685 VanDerWaalsContact C-N 3.3Å; W683-K685 PolarHBondContact O-N 3.04Å; K685-L687 VanDerWaalsContact C-N 3.32Å; K685-L687 PolarHBondContact O-N 3.08Å; K685-Q688 WeakPolarHBondContact O-CB 3.16Å; K685-Q688 PolarHBondContact O-N 3.29Å; K685-E689 VanDerWaalsContact CE-CD 3.41Å; K685-E689 WeakPolarHBondContact CE-OE1 3.36Å; K685-E689 HydrophobicContact CG-CG 4.24Å; K685-E689 WeakPolarHBondContact CG-OE2 3.27Å; K685-E689 IonicContact NZ-OE1 3.62Å; K685-E689 WeakPolarHBondContact O-CG 3.42Å; K685-E689 PolarHBondContact O-N 3.42Å
686	S	92.6	Very high	92.3	Very high	6 Å²	6	42.6 Å²	42.6	4%	0.042	22%	0.219	C	C	.	.	H	α-helix	trans	-57.9	-38.9	178.2	-176.4	0	0	0	0	113.4	R573 L574 Q682 W683 T690	R573-S686 PolarHBondContact O-OG 3.33Å; L574-S686 PolarHBondContact N-OG 2.84Å; Q682-S686 WeakPolarHBondContact O-CB 3.33Å; Q682-S686 PolarHBondContact O-N 3.44Å; W683-S686 PolarHBondContact O-N 2.91Å; S686-T690 WeakPolarHBondContact O-CB 3.3Å; S686-T690 WeakPolarHBondContact O-CG2 3.4Å; S686-T690 PolarHBondContact O-N 3.1Å; S686-T690 PolarHBondContact O-OG1 2.71Å
687	L	90.1	Very high	92.1	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-64.9	-36.5	174.4	-73.1	168.5	0	0	0	113.3	L487 W683 K685 T690 L692	L487-L687 HydrophobicContact CD1-CD1 4.14Å; L487-L687 HydrophobicContact CD2-CD1 4.08Å; L487-L687 HydrophobicContact CD2-CD2 4.14Å; W683-L687 HydrophobicContact CD2-CD1 3.78Å; W683-L687 HydrophobicContact CD2-CG 4.41Å; W683-L687 VanDerWaalsContact CE2-CD1 3.49Å; W683-L687 HydrophobicContact CE3-CD1 4.07Å; W683-L687 HydrophobicContact CG-CD1 4.4Å; W683-L687 HydrophobicContact CH2-CD1 3.88Å; W683-L687 HydrophobicContact CZ2-CD1 3.59Å; W683-L687 HydrophobicContact CZ2-CD2 4.32Å; W683-L687 HydrophobicContact CZ2-CG 4.31Å; W683-L687 HydrophobicContact CZ3-CD1 4.08Å; W683-L687 WeakPolarHBondContact O-CG 3.37Å; W683-L687 PolarHBondContact O-N 2.95Å; K685-L687 VanDerWaalsContact C-N 3.32Å; K685-L687 PolarHBondContact O-N 3.08Å; L687-T690 WeakPolarHBondContact CA-OG1 3.33Å; L687-T690 PolarHBondContact O-OG1 2.9Å; L687-L692 HydrophobicContact CD2-CB 4.29Å; L687-L692 HydrophobicContact CD2-CD1 4.23Å; L687-L692 PolarHBondContact O-N 2.89Å
688	Q	89.3	Confident	91.8	Very high	123 Å²	123	51 Å²	51	58%	0.575	26%	0.256	S	S	*	.	H	α-helix	trans	-73.2	-44.5	177	-171	174.3	-9.2	0	0	111	F684 K685 T690 G691	F684-Q688 PolarHBondContact O-N 2.79Å; K685-Q688 WeakPolarHBondContact O-CB 3.16Å; K685-Q688 PolarHBondContact O-N 3.29Å; Q688-T690 VanDerWaalsContact C-N 3.28Å; Q688-T690 PolarHBondContact O-N 3.49Å; Q688-G691 PolarHBondContact O-N 3.23Å
689	E	89.3	Confident	91.6	Very high	120 Å²	120	47.5 Å²	47.5	56%	0.561	24%	0.238	S	C	*	.	H	α-helix	trans	-67.6	-24.6	177.5	-68.8	173.7	143.6	0	0	113.5	K685 G691	K685-E689 VanDerWaalsContact CE-CD 3.41Å; K685-E689 WeakPolarHBondContact CE-OE1 3.36Å; K685-E689 HydrophobicContact CG-CG 4.24Å; K685-E689 WeakPolarHBondContact CG-OE2 3.27Å; K685-E689 IonicContact NZ-OE1 3.62Å; K685-E689 WeakPolarHBondContact O-CG 3.42Å; K685-E689 PolarHBondContact O-N 3.42Å; E689-G691 VanDerWaalsContact C-N 3.32Å
690	T	86.9	Confident	91.4	Very high	40 Å²	40	51.1 Å²	51.1	25%	0.245	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-1.9	171.7	46.2	0	0	0	0	113.6	R573 S686 L687 Q688 L692	R573-T690 HydrophobicContact CB-CG2 3.74Å; R573-T690 HydrophobicContact CG-CG2 3.84Å; S686-T690 WeakPolarHBondContact O-CB 3.3Å; S686-T690 WeakPolarHBondContact O-CG2 3.4Å; S686-T690 PolarHBondContact O-N 3.1Å; S686-T690 PolarHBondContact O-OG1 2.71Å; L687-T690 WeakPolarHBondContact CA-OG1 3.33Å; L687-T690 PolarHBondContact O-OG1 2.9Å; Q688-T690 VanDerWaalsContact C-N 3.28Å; Q688-T690 PolarHBondContact O-N 3.49Å; T690-L692 PolarHBondContact O-N 3.49Å; T690-L692 WeakPolarHBondContact OG1-CG 3.45Å
691	G	85.9	Confident	91.3	Very high	47 Å²	47	52.4 Å²	52.4	49%	0.485	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.2	13.9	-177.2	0	0	0	0	0	114.2	Q688 E689 G693	Q688-G691 PolarHBondContact O-N 3.23Å; E689-G691 VanDerWaalsContact C-N 3.32Å; G691-G693 PolarHBondContact O-N 3.11Å
692	L	87.1	Confident	91.2	Very high	13 Å²	13	47.1 Å²	47.1	7%	0.068	24%	0.243	C	C	.	.	S	Bend	trans	-80.2	-4.3	-179.4	-60.2	179.1	0	0	0	113	H486 L487 R570 L687 T690	H486-L692 CarbonylContact C-O 3.35Å; H486-L692 WeakPolarHBondContact CA-O 3.45Å; L487-L692 PolarHBondContact N-O 3.11Å; R570-L692 HydrophobicContact CG-CD1 3.97Å; L687-L692 HydrophobicContact CD2-CB 4.29Å; L687-L692 HydrophobicContact CD2-CD1 4.23Å; L687-L692 PolarHBondContact O-N 2.89Å; T690-L692 PolarHBondContact O-N 3.49Å; T690-L692 WeakPolarHBondContact OG1-CG 3.45Å
693	G	88	Confident	91.1	Very high	8 Å²	8	47.7 Å²	47.7	8%	0.082	25%	0.245	C	C	.	.			trans	103.7	160.3	173.9	0	0	0	0	0	113.9	L487 G691	L487-G693 WeakPolarHBondContact CD1-O 3.42Å; G691-G693 PolarHBondContact O-N 3.11Å
694	T	90.8	Very high	91.1	Very high	44 Å²	44	53.3 Å²	53.3	27%	0.27	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-82.4	132.5	-177.4	-52.1	0	0	0	0	111.4	V696	T694-V696 PolarHBondContact O-N 2.82Å
695	W	92.6	Very high	91.2	Very high	23 Å²	23	52.1 Å²	52.1	9%	0.087	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-67.4	116.8	175.2	179.4	-73.2	0	0	0	111.1	L487 M521 D525 K526 R529 W683 F684	L487-W695 HydrophobicContact CD1-CB 4.22Å; M521-W695 HydrophobicContact CB-CH2 3.9Å; M521-W695 HydrophobicContact CB-CZ2 3.95Å; M521-W695 HydrophobicContact CB-CZ3 4.32Å; M521-W695 HydrophobicContact CE-CD2 4.2Å; M521-W695 HydrophobicContact CE-CE3 3.99Å; M521-W695 HydrophobicContact CE-CZ3 4.38Å; M521-W695 HydrophobicContact CG-CD2 3.98Å; M521-W695 HydrophobicContact CG-CE3 4.3Å; M521-W695 HydrophobicContact CG-CH2 3.98Å; M521-W695 HydrophobicContact CG-CZ2 3.63Å; M521-W695 HydrophobicContact CG-CZ3 4.29Å; D525-W695 HydrophobicContact CB-CZ3 3.9Å; K526-W695 HydrophobicContact CG-CH2 3.95Å; R529-W695 HydrophobicContact CB-CH2 4.37Å; R529-W695 HydrophobicContact CB-CZ3 4.36Å; W683-W695 AromaticContact CH2-CE3 3.73Å; W683-W695 HydrophobicContact CH2-CE3 3.73Å; W683-W695 AromaticContact CH2-CZ3 3.61Å; W683-W695 HydrophobicContact CH2-CZ3 3.61Å; W683-W695 HydrophobicContact CZ3-CD2 4.39Å; W683-W695 AromaticContact CZ3-CE3 3.57Å; W683-W695 HydrophobicContact CZ3-CE3 3.57Å; W683-W695 AromaticContact CZ3-CZ3 3.68Å; W683-W695 HydrophobicContact CZ3-CZ3 3.68Å; F684-W695 HydrophobicContact CD1-CB 3.71Å; F684-W695 HydrophobicContact CD1-CD2 4.44Å; F684-W695 AromaticContact CD1-CG 3.96Å; F684-W695 HydrophobicContact CD1-CG 3.96Å; F684-W695 HydrophobicContact CD2-CB 4.47Å; F684-W695 HydrophobicContact CE1-CB 3.64Å; F684-W695 AromaticContact CE1-CD1 3.74Å; F684-W695 AromaticContact CE1-CD2 3.59Å; F684-W695 HydrophobicContact CE1-CD2 3.59Å; F684-W695 HydrophobicContact CE1-CE3 4.11Å; F684-W695 AromaticContact CE1-CG 3.33Å; F684-W695 HydrophobicContact CE1-CG 3.33Å; F684-W695 HydrophobicContact CE2-CB 4.4Å; F684-W695 AromaticContact CE2-CD1 3.95Å; F684-W695 HydrophobicContact CE2-CG 4.21Å; F684-W695 HydrophobicContact CG-CB 4.14Å; F684-W695 HydrophobicContact CZ-CB 4Å; F684-W695 AromaticContact CZ-CD1 3.35Å; F684-W695 AromaticContact CZ-CD2 3.95Å; F684-W695 HydrophobicContact CZ-CD2 3.95Å; F684-W695 AromaticContact CZ-CG 3.48Å; F684-W695 HydrophobicContact CZ-CG 3.48Å; F684-W695 VanDerWaalsContact CZ-CG 3.48Å; F684-W695 AromaticContact CZ-NE1 3.82Å
696	V	92.1	Very high	91.2	Very high	10 Å²	10	50.5 Å²	50.5	6%	0.061	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-75	127.2	177.8	-178.9	0	0	0	0	111	L500 Q507 I519 M521 T694	L500-V696 HydrophobicContact CD1-CG2 4.1Å; L500-V696 HydrophobicContact CD2-CG2 3.59Å; Q507-V696 HydrophobicContact CG-CG1 4.5Å; I519-V696 HydrophobicContact CB-CG1 4.35Å; I519-V696 HydrophobicContact CG2-CB 4.2Å; I519-V696 HydrophobicContact CG2-CG1 3.86Å; I519-V696 HydrophobicContact CG2-CG2 4.22Å; M521-V696 HydrophobicContact SD-CB 3.79Å; M521-V696 HydrophobicContact SD-CG2 4.3Å; M521-V696 PolarHBondContact SD-N 2.87Å; T694-V696 PolarHBondContact O-N 2.82Å
697	K	91.6	Very high	91.1	Very high	145 Å²	145	51.1 Å²	51.1	63%	0.63	27%	0.266	S	S	*	.	P	Polyproline II helix	trans	-91.9	160.8	172.9	-58.4	171.8	-168.5	164.1	0	109.7	Q507	Q507-K697 PolarHBondContact NE2-O 3.05Å
698	K	91.9	Very high	90.4	Very high	54 Å²	54	55.9 Å²	55.9	24%	0.235	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-79.4	163.3	163.8	-74.5	-65.6	171.5	-151.9	0	110.3	L518 I519 T520	L518-K698 HydrophobicContact CD1-CD 3.99Å; L518-K698 PolarHBondContact O-NZ 2.73Å; I519-K698 VanDerWaalsContact C-NZ 3.34Å; I519-K698 PolarHBondContact O-NZ 2.88Å; T520-K698 WeakPolarHBondContact OG1-CE 3.5Å; T520-K698 PolarHBondContact OG1-NZ 2.91Å
699	P	92.5	Very high	88.8	Confident	1 Å²	1	59.4 Å²	59.4	1%	0.006	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-52.9	141.4	172.1	-21.1	30.8	0	0	0	111.1	Q507 W509 I512 E701	Q507-P699 HydrophobicContact CB-CG 4.02Å; Q507-P699 WeakPolarHBondContact O-CA 3.37Å; Q507-P699 WeakPolarHBondContact O-CG 3.21Å; W509-P699 HydrophobicContact CB-CB 4.08Å; W509-P699 HydrophobicContact CE3-CB 4.34Å; I512-P699 HydrophobicContact CD1-CG 3.88Å; P699-E701 VanDerWaalsContact C-N 3.29Å; P699-E701 WeakPolarHBondContact CA-OE2 3.42Å; P699-E701 WeakPolarHBondContact CB-OE2 3.45Å; P699-E701 PolarHBondContact O-N 3.18Å
700	P	91.8	Very high	88.8	Confident	75 Å²	75	56.4 Å²	56.4	49%	0.487	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-67.6	-24.5	-173.8	27.6	-34.8	0	0	0	114.2	Q702 E703 Q704	P700-Q702 PolarHBondContact O-N 2.95Å; P700-E703 WeakPolarHBondContact O-CA 3.22Å; P700-E703 PolarHBondContact O-N 2.85Å; P700-Q704 PolarHBondContact O-N 3.4Å
701	E	94	Very high	88.9	Confident	64 Å²	64	57.2 Å²	57.2	30%	0.299	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-57.2	-37.4	-179.8	-54.7	70.7	-151.5	0	0	110.7	W509 P699 E703 Q704	W509-E701 HydrophobicContact CB-CG 4.19Å; W509-E701 HydrophobicContact CD2-CB 4.43Å; W509-E701 HydrophobicContact CE3-CB 4.38Å; W509-E701 HydrophobicContact CG-CG 4.46Å; P699-E701 VanDerWaalsContact C-N 3.29Å; P699-E701 WeakPolarHBondContact CA-OE2 3.42Å; P699-E701 WeakPolarHBondContact CB-OE2 3.45Å; P699-E701 PolarHBondContact O-N 3.18Å; E701-E703 PolarHBondContact O-N 2.89Å; E701-Q704 PolarHBondContact O-N 2.9Å
702	Q	93.8	Very high	89.1	Confident	3 Å²	3	57.8 Å²	57.8	1%	0.014	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-65.8	-2	173.9	174.9	157.4	109.1	0	0	114.5	L389 S390 N397 W509 K638 P700	L389-Q702 VanDerWaalsContact CD2-NE2 3.32Å; S390-Q702 WeakPolarHBondContact O-CG 3.49Å; S390-Q702 PolarHBondContact O-NE2 3.26Å; N397-Q702 PolarHBondContact ND2-OE1 2.85Å; N397-Q702 PolarHBondContact OD1-OE1 3.38Å; W509-Q702 HydrophobicContact CZ3-CB 4.13Å; K638-Q702 WeakPolarHBondContact CE-O 3.49Å; P700-Q702 PolarHBondContact O-N 2.95Å
703	E	93.4	Very high	89.2	Confident	71 Å²	71	60.4 Å²	60.4	33%	0.332	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-119.9	1.9	169.6	-50.8	-155.8	135.3	0	0	113.3	Y666 G667 K670 P700 E701 F705	Y666-E703 HydrophobicContact CD1-CB 3.82Å; Y666-E703 HydrophobicContact CD1-CG 4.12Å; Y666-E703 HydrophobicContact CE1-CB 4.2Å; Y666-E703 HydrophobicContact CE1-CG 3.97Å; G667-E703 WeakPolarHBondContact CA-O 3.25Å; G667-E703 PolarHBondContact N-O 2.85Å; K670-E703 IonicContact NZ-OE1 3.94Å; K670-E703 PolarHBondContact NZ-OE1 3.1Å; K670-E703 IonicContact NZ-OE2 3.25Å; K670-E703 PolarHBondContact NZ-OE2 3.4Å; P700-E703 WeakPolarHBondContact O-CA 3.22Å; P700-E703 PolarHBondContact O-N 2.85Å; E701-E703 PolarHBondContact O-N 2.89Å; E703-F705 PolarHBondContact O-N 2.51Å
704	Q	94.1	Very high	89.3	Confident	118 Å²	118	63.7 Å²	63.7	55%	0.551	33%	0.33	S	S	*	.			trans	-96.3	51.4	179.8	-68.2	170.2	-11.8	0	0	112	P700 E701	P700-Q704 PolarHBondContact O-N 3.4Å; E701-Q704 PolarHBondContact O-N 2.9Å
705	F	95.2	Very high	89.2	Confident	3 Å²	3	65 Å²	65	1%	0.013	33%	0.334	C	S	.	.			trans	-121.8	149.2	175.3	70.6	-86.8	0	0	0	112.5	D391 K638 H639 F642 Y666 E703	D391-F705 WeakPolarHBondContact O-CD1 3.47Å; K638-F705 HydrophobicContact CB-CE1 4.3Å; K638-F705 HydrophobicContact CB-CZ 3.95Å; K638-F705 HydrophobicContact CD-CE1 4.47Å; H639-F705 HydrophobicContact CB-CE2 4.39Å; H639-F705 AromaticContact ND1-CE2 3.98Å; F642-F705 AromaticContact CD1-CE2 3.95Å; F642-F705 HydrophobicContact CD1-CE2 3.95Å; F642-F705 HydrophobicContact CD1-CZ 4.49Å; Y666-F705 HydrophobicContact CD1-CD1 4.34Å; Y666-F705 AromaticContact CD1-CE1 3.5Å; Y666-F705 HydrophobicContact CD1-CE1 3.5Å; Y666-F705 AromaticContact CD1-CZ 3.93Å; Y666-F705 HydrophobicContact CD1-CZ 3.93Å; Y666-F705 HydrophobicContact CD2-CE1 4.11Å; Y666-F705 HydrophobicContact CD2-CE2 4.45Å; Y666-F705 AromaticContact CD2-CZ 3.64Å; Y666-F705 HydrophobicContact CD2-CZ 3.64Å; Y666-F705 HydrophobicContact CE1-CE1 4.14Å; Y666-F705 HydrophobicContact CE2-CZ 4.25Å; Y666-F705 HydrophobicContact CG-CD1 4.32Å; Y666-F705 AromaticContact CG-CE1 3.46Å; Y666-F705 HydrophobicContact CG-CE1 3.46Å; Y666-F705 VanDerWaalsContact CG-CE1 3.46Å; Y666-F705 HydrophobicContact CG-CE2 4.3Å; Y666-F705 AromaticContact CG-CZ 3.44Å; Y666-F705 HydrophobicContact CG-CZ 3.44Å; Y666-F705 VanDerWaalsContact CG-CZ 3.44Å; Y666-F705 PolarHBondContact N-O 2.96Å; E703-F705 PolarHBondContact O-N 2.51Å
706	L	93.4	Very high	88.9	Confident	92 Å²	92	68 Å²	68	48%	0.482	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-97.2	169.1	169.4	-71.5	168.5	0	0	0	110	M665	M665-L706 HydrophobicContact CB-CD2 4.44Å; M665-L706 HydrophobicContact CG-CD2 3.72Å; M665-L706 HydrophobicContact CG-CG 3.99Å
707	L	90.4	Very high	88.7	Confident	19 Å²	19	72.5 Å²	72.5	10%	0.099	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-90.5	136.7	162.6	-65.4	166.1	0	0	0	107.6	H639 F642 N646	H639-L707 WeakPolarHBondContact NE2-CD2 3.23Å; F642-L707 HydrophobicContact CB-CD2 4.48Å; F642-L707 HydrophobicContact CD1-CD1 3.71Å; F642-L707 HydrophobicContact CD1-CD2 3.84Å; F642-L707 HydrophobicContact CD1-CG 3.55Å; F642-L707 HydrophobicContact CE1-CD1 3.99Å; F642-L707 HydrophobicContact CE1-CG 3.85Å; F642-L707 HydrophobicContact CG-CD1 4.16Å; F642-L707 HydrophobicContact CG-CD2 4.5Å; F642-L707 HydrophobicContact CG-CG 4.4Å; N646-L707 HydrophobicContact CB-CD1 3.54Å; N646-L707 WeakPolarHBondContact ND2-CD1 3.35Å
708	S	75.2	Confident	88.4	Confident	100 Å²	100	66.4 Å²	66.4	70%	0.699	35%	0.352	S	S	*	.	P	Polyproline II helix	trans	-57.1	140	160	51	0	0	0	0	108.7
709	I	55.3	Low	88.1	Confident	197 Å²	197	67.5 Å²	67.5	100%	1.01	36%	0.363	S	S	*	.			trans	-67.3	0	-178.5	-62.3	-177.1	0	0	0	110.1

Retrieved 709 of 709 residues in 1120 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).