A0A077Z5F3_TRITR Loading...

Tyrosine-protein kinase

AlphaFold DB , UniProt , Accession A0A077Z5F3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 530 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.8	Very low	32.5	Very low	250 Å²	250	137.3 Å²	137.3	100%	1.232	88%	0.876	S	S	*	*				0	106.9	0	-71.6	176.4	-176.3	0	0	106.7
2	G	34.7	Very low	32.5	Very low	71 Å²	71	137.8 Å²	137.8	73%	0.732	88%	0.876	S	S	*	*			trans	-77.9	146.6	171.1	0	0	0	0	0	110
3	N	34.6	Very low	32.2	Very low	166 Å²	166	135.9 Å²	135.9	89%	0.888	87%	0.869	S	S	*	*			trans	-166.7	120.2	132.6	-97.7	-8.3	0	0	0	109.5
4	C	29	Very low	31.9	Very low	122 Å²	122	133.1 Å²	133.1	82%	0.824	86%	0.864	S	S	*	*			trans	-61.1	139	163.6	-61.9	0	0	0	0	110
5	C	33.2	Very low	31.6	Very low	124 Å²	124	140.7 Å²	140.7	84%	0.838	87%	0.869	S	S	*	*			trans	-130.6	104.7	153.7	-87.1	0	0	0	0	107.7
6	E	30.5	Very low	31.5	Very low	193 Å²	193	146.8 Å²	146.8	90%	0.902	87%	0.87	S	S	*	*			trans	-59.8	135.9	160.9	-69.7	172.8	145.2	0	0	109.3
7	T	36.5	Very low	31.3	Very low	142 Å²	142	148.9 Å²	148.9	87%	0.871	87%	0.869	S	S	*	*			trans	-127.4	123.6	160.9	35.4	0	0	0	0	108.7
8	A	30.9	Very low	31.2	Very low	101 Å²	101	153.7 Å²	153.7	84%	0.835	87%	0.87	S	S	*	*			trans	-81.4	154.5	-170.8	0	0	0	0	0	113.1
9	A	28	Very low	31	Very low	102 Å²	102	153.1 Å²	153.1	84%	0.843	87%	0.865	S	S	*	*			trans	-17.7	135.5	165.9	0	0	0	0	0	118.8
10	S	30.8	Very low	30.9	Very low	120 Å²	120	151.2 Å²	151.2	84%	0.839	86%	0.861	S	S	*	*			trans	-133.4	123.1	144.6	59.2	0	0	0	0	109.9
11	S	27.7	Very low	30.6	Very low	119 Å²	119	153.5 Å²	153.5	83%	0.832	86%	0.862	S	S	*	*			trans	-80.1	132.2	178.6	50.9	0	0	0	0	111.1
12	V	31.9	Very low	29.9	Very low	144 Å²	144	145.7 Å²	145.7	87%	0.873	84%	0.837	S	S	*	*			trans	-129.3	123.1	160.4	-179.4	0	0	0	0	109.3
13	S	29.3	Very low	29.9	Very low	113 Å²	113	148.3 Å²	148.3	79%	0.79	84%	0.841	S	S	*	*			trans	-73.5	147.1	-169.6	56.2	0	0	0	0	114.6
14	A	27.7	Very low	29.6	Very low	96 Å²	96	148.3 Å²	148.3	79%	0.793	84%	0.84	S	S	*	*			trans	-50	138.5	172.2	0	0	0	0	0	115.7
15	R	28.1	Very low	29.5	Very low	248 Å²	248	150 Å²	150	94%	0.936	84%	0.839	S	S	*	*			trans	-115.3	113.5	153.5	-93.5	-176.7	173.3	-177.9	-1.1	108.9
16	R	28.7	Very low	29.2	Very low	238 Å²	238	152.3 Å²	152.3	90%	0.898	84%	0.843	S	S	*	*			trans	-78.1	114.4	168.5	-81	174.6	165.9	174	-5.3	108.8
17	E	29.4	Very low	29.1	Very low	182 Å²	182	149.6 Å²	149.6	85%	0.85	84%	0.84	S	S	*	*			trans	-90.5	120.2	165.9	-75.9	-176.7	167.4	0	0	109.7
18	R	28.2	Very low	28.5	Very low	235 Å²	235	151.8 Å²	151.8	89%	0.887	84%	0.84	S	S	*	*			trans	-87.3	112.7	176	-63.2	177.9	-154.3	-152.9	3	107.8	S20	R18-S20 PolarHBondContact O-N 3.04Å
19	N	27.6	Very low	28.6	Very low	143 Å²	143	156.8 Å²	156.8	77%	0.765	84%	0.843	S	S	*	*			trans	-88.7	95.2	165.2	-82.5	-17.3	0	0	0	109.2
20	S	29.4	Very low	28.9	Very low	114 Å²	114	157 Å²	157	80%	0.797	84%	0.836	S	S	*	*			trans	-80.7	111.5	166.7	64.1	0	0	0	0	109.2	R18	R18-S20 PolarHBondContact O-N 3.04Å
21	F	24.8	Very low	28.7	Very low	200 Å²	200	156.4 Å²	156.4	88%	0.877	83%	0.831	S	S	*	*			trans	-76.1	126.8	167.8	-79	-93	0	0	0	109.7
22	A	27.6	Very low	28.9	Very low	86 Å²	86	157.9 Å²	157.9	71%	0.711	84%	0.836	S	S	*	*			trans	-125.8	139	164.8	0	0	0	0	0	108.8
23	P	34.4	Very low	28.6	Very low	126 Å²	126	157 Å²	157	82%	0.818	84%	0.836	S	S	*	*			trans	-87.8	138.3	-160.1	33.9	-33.9	0	0	0	112.5
24	I	28.5	Very low	28.6	Very low	166 Å²	166	155 Å²	155	85%	0.851	83%	0.834	S	S	*	*			trans	-88.2	115.9	175.9	-63.9	175.1	0	0	0	109	L26	I24-L26 PolarHBondContact O-N 3.49Å
25	L	27.2	Very low	28.4	Very low	157 Å²	157	157 Å²	157	82%	0.822	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-61.3	122.8	172.6	-86.7	127.7	0	0	0	111.8	T27	L25-T27 PolarHBondContact O-N 3.31Å
26	L	26.8	Very low	28.5	Very low	174 Å²	174	151.7 Å²	151.7	91%	0.911	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-74.5	117.5	167.5	-78	161.2	0	0	0	109.8	I24	I24-L26 PolarHBondContact O-N 3.49Å
27	T	28.3	Very low	28.2	Very low	136 Å²	136	145.2 Å²	145.2	83%	0.834	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-97	132.9	171	44.2	0	0	0	0	110.4	L25	L25-T27 PolarHBondContact O-N 3.31Å
28	Q	23.7	Very low	28.1	Very low	187 Å²	187	147.9 Å²	147.9	87%	0.874	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-70.3	148.3	-177.3	-62.8	167.1	-15.8	0	0	112.5
29	K	31.7	Very low	28.1	Very low	206 Å²	206	141.8 Å²	141.8	90%	0.896	83%	0.825	S	S	*	*			trans	-160.2	158	143.8	-101.2	-169.1	-177.4	177.1	0	111.3
30	P	36.3	Very low	28.1	Very low	108 Å²	108	141.3 Å²	141.3	70%	0.701	83%	0.83	S	S	*	*			trans	-117.5	167.8	-139.1	41.3	-32.2	0	0	0	116.8
31	S	25	Very low	28	Very low	106 Å²	106	142.2 Å²	142.2	74%	0.741	83%	0.831	S	S	*	*			trans	61.7	112.8	144.3	64.2	0	0	0	0	120.3
32	T	31.7	Very low	28.1	Very low	150 Å²	150	137.5 Å²	137.5	92%	0.92	82%	0.823	S	S	*	*				-144.7	136.1	128	41.7	0	0	0	0	110
33	S	26.5	Very low	28	Very low	125 Å²	125	142 Å²	142	87%	0.874	83%	0.831	S	S	*	*			trans	-81.4	134.1	-175.5	48.2	0	0	0	0	112.3
34	G	28.5	Very low	27.5	Very low	73 Å²	73	143.7 Å²	143.7	75%	0.753	83%	0.832	S	S	*	*			trans	-162.6	96.6	168.1	0	0	0	0	0	110.3	V36	G34-V36 PolarHBondContact O-N 3.13Å
35	C	23.7	Very low	27.3	Very low	138 Å²	138	141.3 Å²	141.3	93%	0.932	83%	0.825	S	S	*	*			trans	-71.3	110.4	176.5	-69.5	0	0	0	0	110.4
36	V	29.7	Very low	27.1	Very low	136 Å²	136	137.1 Å²	137.1	82%	0.824	82%	0.819	S	S	*	*			trans	-136.3	122.4	156.7	-177.9	0	0	0	0	107.6	G34 R38	G34-V36 PolarHBondContact O-N 3.13Å; V36-R38 PolarHBondContact O-N 3.18Å
37	A	24.3	Very low	27.2	Very low	102 Å²	102	134.7 Å²	134.7	84%	0.843	81%	0.812	S	S	*	*			trans	-59	126.9	-177.8	0	0	0	0	0	111.4
38	R	27.3	Very low	26.8	Very low	237 Å²	237	137.8 Å²	137.8	89%	0.894	82%	0.817	S	S	*	*			trans	-117.3	147	167.2	-92.6	-175.2	166.6	-165.5	-4.3	110.1	V36	V36-R38 PolarHBondContact O-N 3.18Å
39	P	27	Very low	27	Very low	107 Å²	107	131.3 Å²	131.3	70%	0.695	80%	0.8	S	S	*	*			trans	-72.9	169.4	-175.6	-5.8	25.2	0	0	0	111.5	T41	P39-T41 PolarHBondContact O-N 2.86Å
40	P	28.3	Very low	26.8	Very low	134 Å²	134	127.3 Å²	127.3	87%	0.87	80%	0.795	S	S	*	*			trans	-67.2	109	-160.3	28.6	-33	0	0	0	111	S42	P40-S42 PolarHBondContact O-N 2.82Å
41	T	26.9	Very low	26.2	Very low	133 Å²	133	128.8 Å²	128.8	82%	0.816	80%	0.796	S	S	*	*			trans	-67.8	112	167.6	13.6	0	0	0	0	108.7	P39 M43	P39-T41 PolarHBondContact O-N 2.86Å; T41-M43 PolarHBondContact O-N 2.78Å
42	S	26.6	Very low	26.1	Very low	101 Å²	101	134.5 Å²	134.5	71%	0.706	80%	0.801	S	S	*	*			trans	-49.8	126.2	167.7	52.6	0	0	0	0	110.2	P40 I44	P40-S42 PolarHBondContact O-N 2.82Å; S42-I44 PolarHBondContact O-N 3.02Å
43	M	25.1	Very low	25.7	Very low	179 Å²	179	134.7 Å²	134.7	88%	0.882	79%	0.786	S	S	*	*			trans	-58.7	108.8	173.5	-72.8	-166.7	-109.3	0	0	109.7	T41 V45	T41-M43 PolarHBondContact O-N 2.78Å; M43-V45 VanDerWaalsContact C-N 3.34Å; M43-V45 PolarHBondContact O-N 2.95Å
44	I	23.9	Very low	25.7	Very low	163 Å²	163	134.1 Å²	134.1	84%	0.836	78%	0.78	S	S	*	*			trans	-72	94.4	166.5	-61.3	172.5	0	0	0	106.2	S42 G46	S42-I44 PolarHBondContact O-N 3.02Å; I44-G46 PolarHBondContact O-N 3.07Å
45	V	25.9	Very low	25.7	Very low	116 Å²	116	135.4 Å²	135.4	70%	0.703	78%	0.777	S	S	*	*			trans	-79.2	108.8	163.4	179.4	0	0	0	0	106	M43 V47	M43-V45 VanDerWaalsContact C-N 3.34Å; M43-V45 PolarHBondContact O-N 2.95Å; V45-V47 PolarHBondContact O-N 3.38Å
46	G	22.9	Very low	26.1	Very low	68 Å²	68	133 Å²	133	70%	0.701	76%	0.762	S	S	*	*			trans	-62.5	115.6	174.4	0	0	0	0	0	110.3	I44	I44-G46 PolarHBondContact O-N 3.07Å
47	V	27	Very low	25.9	Very low	124 Å²	124	131.9 Å²	131.9	75%	0.752	76%	0.759	S	S	*	*			trans	-110.7	97.4	164.1	-179	0	0	0	0	106.1	V45	V45-V47 PolarHBondContact O-N 3.38Å
48	E	21.7	Very low	26.3	Very low	201 Å²	201	132.1 Å²	132.1	94%	0.939	75%	0.75	S	S	*	*			trans	-73.1	121	165.5	-71.9	-176.8	152.1	0	0	108.7
49	G	27.2	Very low	26.4	Very low	50 Å²	50	128.9 Å²	128.9	52%	0.515	75%	0.75	S	S	.	*	S	Bend	trans	137.7	132.8	171.7	0	0	0	0	0	111.3	L51	G49-L51 PolarHBondContact O-N 3.16Å
50	P	27.3	Very low	26.5	Very low	122 Å²	122	126.8 Å²	126.8	79%	0.792	75%	0.748	S	S	*	*			trans	-59.8	129	-175.2	24.7	-31.7	0	0	0	109.3	R52	P50-R52 PolarHBondContact O-N 3.11Å
51	L	24	Very low	26.4	Very low	139 Å²	139	125 Å²	125	73%	0.728	74%	0.738	S	S	*	*			trans	-57.9	86.9	165.9	-76.9	164	0	0	0	107.1	G49 Y53	G49-L51 PolarHBondContact O-N 3.16Å; L51-Y53 PolarHBondContact O-N 2.81Å
52	R	23.1	Very low	26.5	Very low	226 Å²	226	124.8 Å²	124.8	85%	0.853	74%	0.736	S	S	*	*			trans	-56.4	113.8	156.9	-76.6	-176	175.7	-170.5	-1.6	104	P50 P54	P50-R52 PolarHBondContact O-N 3.11Å; R52-P54 VanDerWaalsContact O-N 3.16Å
53	Y	23.1	Very low	26.6	Very low	154 Å²	154	124.9 Å²	124.9	60%	0.604	73%	0.733	S	S	*	*			trans	-35	127.3	161.2	-79.8	-88.2	0	0	0	107	L51 S55	L51-Y53 PolarHBondContact O-N 2.81Å; Y53-S55 PolarHBondContact O-N 3.06Å
54	P	25.3	Very low	27.1	Very low	113 Å²	113	121.7 Å²	121.7	73%	0.734	72%	0.719	S	S	*	*			trans	-59.7	100.1	177	24.2	-29.7	0	0	0	105.2	R52 S56	R52-P54 VanDerWaalsContact O-N 3.16Å; P54-S56 VanDerWaalsContact C-N 3.3Å; P54-S56 PolarHBondContact O-N 3.45Å
55	S	30.2	Very low	27.8	Very low	101 Å²	101	119.1 Å²	119.1	71%	0.706	72%	0.722	S	S	*	*			trans	-42.5	109	155.8	41.7	0	0	0	0	103.2	Y53 C57	Y53-S55 PolarHBondContact O-N 3.06Å; S55-C57 PolarHBondContact O-N 3.32Å
56	S	31.8	Very low	28.6	Very low	86 Å²	86	116.7 Å²	116.7	60%	0.601	71%	0.71	S	S	*	*			trans	-40.6	117.2	176.7	47.2	0	0	0	0	106.3	P54 T58	P54-S56 VanDerWaalsContact C-N 3.3Å; P54-S56 PolarHBondContact O-N 3.45Å; S56-T58 VanDerWaalsContact C-N 3.28Å; S56-T58 PolarHBondContact O-N 3.05Å
57	C	25.6	Very low	29.8	Very low	113 Å²	113	116.4 Å²	116.4	76%	0.764	70%	0.696	S	S	*	*			trans	-57.6	91.1	-168.8	-63.1	0	0	0	0	109.5	S55	S55-C57 PolarHBondContact O-N 3.32Å
58	T	32.9	Very low	30.9	Very low	107 Å²	107	114 Å²	114	66%	0.656	68%	0.684	S	S	*	*			trans	-95.7	-10.6	171.8	49	0	0	0	0	111.6	S56 G60	S56-T58 VanDerWaalsContact C-N 3.28Å; S56-T58 PolarHBondContact O-N 3.05Å; T58-G60 VanDerWaalsContact C-N 3.35Å; T58-G60 PolarHBondContact O-N 3.06Å; T58-G60 VanDerWaalsContact O-N 3.12Å
59	N	28.9	Very low	32.3	Very low	169 Å²	169	109.8 Å²	109.8	90%	0.904	67%	0.666	S	S	*	*	S	Bend	trans	-85.8	80.1	165.5	-76.5	-11	0	0	0	110.3
60	G	28.1	Very low	34.1	Very low	63 Å²	63	111.4 Å²	111.4	65%	0.649	68%	0.683	S	S	*	*	S	Bend	trans	123	50	162.7	0	0	0	0	0	116	T58	T58-G60 VanDerWaalsContact C-N 3.35Å; T58-G60 PolarHBondContact O-N 3.06Å; T58-G60 VanDerWaalsContact O-N 3.12Å
61	C	26.5	Very low	36.5	Very low	96 Å²	96	108.5 Å²	108.5	65%	0.649	68%	0.675	S	S	*	*			trans	-156.2	49	158.1	-101.4	0	0	0	0	111.7	T63	C61-T63 PolarHBondContact O-N 3.24Å; C61-T63 VanDerWaalsContact O-N 3.13Å
62	V	28.7	Very low	39.6	Very low	129 Å²	129	106 Å²	106	78%	0.782	66%	0.66	S	S	*	*			trans	-84.7	63.9	160.9	-167	0	0	0	0	108.1
63	T	30.4	Very low	42.9	Very low	104 Å²	104	98.9 Å²	98.9	64%	0.638	64%	0.638	S	S	*	*			trans	-133.2	76.2	167.1	51.4	0	0	0	0	108.4	C61	C61-T63 PolarHBondContact O-N 3.24Å; C61-T63 VanDerWaalsContact O-N 3.13Å
64	N	34.4	Very low	46.4	Very low	112 Å²	112	91.8 Å²	91.8	60%	0.599	61%	0.611	S	S	*	*	S	Bend	trans	-175.2	114.4	141.1	-90.2	-19	0	0	0	106.7	S66	N64-S66 PolarHBondContact O-N 3.43Å
65	A	37.9	Very low	49.7	Very low	108 Å²	108	86.4 Å²	86.4	89%	0.893	58%	0.576	S	S	*	*			trans	-24.2	91.5	-177	0	0	0	0	0	115
66	S	43	Very low	52.9	Low	65 Å²	65	82.9 Å²	82.9	46%	0.455	55%	0.55	S	S	.	.			trans	-64.5	137.9	163.5	-39.5	0	0	0	0	107.8	N64 S68	N64-S66 PolarHBondContact O-N 3.43Å; S66-S68 PolarHBondContact O-N 3.34Å
67	P	49.6	Very low	55.8	Low	63 Å²	63	78.9 Å²	78.9	41%	0.409	52%	0.522	S	S	.	.			trans	-67.2	105.9	-178.6	23	-24.6	0	0	0	108.1	E130	P67-E130 HydrophobicContact CG-CB 4.05Å; P67-E130 HydrophobicContact CG-CG 3.76Å
68	S	48.2	Very low	58.9	Low	72 Å²	72	75 Å²	75	50%	0.503	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	111.1	177.5	69.7	0	0	0	0	108.2	S66 G70 G71 Q72	S66-S68 PolarHBondContact O-N 3.34Å; S68-G70 VanDerWaalsContact C-N 3.33Å; S68-G70 PolarHBondContact O-N 3.04Å; S68-G71 VanDerWaalsContact CB-CA 3.41Å; S68-G71 PolarHBondContact OG-N 3.41Å; S68-Q72 VanDerWaalsContact CA-O 3.29Å; S68-Q72 WeakPolarHBondContact CA-O 3.41Å
69	M	52.2	Low	61.5	Low	114 Å²	114	72.6 Å²	72.6	56%	0.562	48%	0.475	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.7	100.2	160.4	-83.5	-150.7	-90.2	0	0	106.4	G71 Q72	M69-G71 PolarHBondContact O-N 2.83Å; M69-Q72 WeakPolarHBondContact O-CB 3.27Å; M69-Q72 PolarHBondContact O-N 2.86Å
70	G	64.5	Low	64.3	Low	84 Å²	84	68 Å²	68	87%	0.866	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.7	30.3	179.7	0	0	0	0	0	115.3	S68	S68-G70 VanDerWaalsContact C-N 3.33Å; S68-G70 PolarHBondContact O-N 3.04Å
71	G	78.9	Confident	67.2	Low	61 Å²	61	65.3 Å²	65.3	63%	0.629	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.8	-1.5	-178.3	0	0	0	0	0	115.1	S68 M69	S68-G71 VanDerWaalsContact CB-CA 3.41Å; S68-G71 PolarHBondContact OG-N 3.41Å; M69-G71 PolarHBondContact O-N 2.83Å
72	Q	87.4	Confident	69.9	Low	85 Å²	85	66.8 Å²	66.8	40%	0.397	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	144.2	-178.1	-64	179.8	-26.6	0	0	112.8	S68 M69 I98	S68-Q72 VanDerWaalsContact CA-O 3.29Å; S68-Q72 WeakPolarHBondContact CA-O 3.41Å; M69-Q72 WeakPolarHBondContact O-CB 3.27Å; M69-Q72 PolarHBondContact O-N 2.86Å; Q72-I98 HydrophobicContact CB-CG2 3.94Å; Q72-I98 HydrophobicContact CG-CG2 4.24Å
73	I	93	Very high	72.3	Confident	77 Å²	77	61.3 Å²	61.3	40%	0.395	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	120.2	175.2	-63.2	173.2	0	0	0	108.8	I98 L99 L128	I73-I98 WeakPolarHBondContact O-CA 3.41Å; I73-L99 HydrophobicContact CB-CB 4.13Å; I73-L99 HydrophobicContact CD1-CD2 4.43Å; I73-L99 HydrophobicContact CG2-CB 4.06Å; I73-L99 HydrophobicContact CG2-CD2 4.07Å; I73-L99 PolarHBondContact O-N 2.86Å; I73-L128 HydrophobicContact CG2-CD2 3.2Å
74	V	96	Very high	74.2	Confident	6 Å²	6	61.6 Å²	61.6	4%	0.036	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	135	179.5	-170.7	0	0	0	0	110.6	L96 M97 L113 Q129	V74-L96 HydrophobicContact CG1-CB 4.41Å; V74-M97 CarbonylContact C-O 3.58Å; V74-M97 WeakPolarHBondContact CA-O 3.46Å; V74-L113 HydrophobicContact CG1-CD1 4.09Å; V74-Q129 HydrophobicContact CB-CB 4.17Å; V74-Q129 HydrophobicContact CG1-CB 4.2Å; V74-Q129 PolarHBondContact O-N 3.37Å
75	L	96.7	Very high	76.2	Confident	0 Å²	0	58 Å²	58	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	153.4	174.6	-60	171	0	0	0	110.1	L96 M97 L99 W108 V110 V126 A127 L128	L75-L96 WeakPolarHBondContact O-CA 3.43Å; L75-M97 HydrophobicContact CB-CB 4.38Å; L75-M97 PolarHBondContact N-O 3.26Å; L75-M97 PolarHBondContact O-N 3.27Å; L75-L99 HydrophobicContact CD1-CB 3.9Å; L75-L99 HydrophobicContact CD1-CD1 4.11Å; L75-L99 HydrophobicContact CD1-CG 4.5Å; L75-L99 HydrophobicContact CG-CB 4.13Å; L75-W108 HydrophobicContact CD1-CE3 4.11Å; L75-W108 HydrophobicContact CD2-CE3 4.33Å; L75-W108 HydrophobicContact CD2-CZ3 3.94Å; L75-V110 HydrophobicContact CD1-CG1 3.61Å; L75-V126 HydrophobicContact CB-CB 4.48Å; L75-V126 HydrophobicContact CD1-CG2 4.2Å; L75-A127 CarbonylContact C-O 3.5Å; L75-A127 WeakPolarHBondContact CA-O 3.48Å; L75-L128 HydrophobicContact CD2-CD2 3.77Å; L75-L128 HydrophobicContact CD2-CG 4.27Å
76	V	95.5	Very high	78.1	Confident	26 Å²	26	62.4 Å²	62.4	16%	0.158	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	135.6	169.4	60.1	0	0	0	0	110.1	L78 D95 L96 V126 A127	V76-L78 HydrophobicContact CG1-CD2 4.32Å; V76-L78 PolarHBondContact O-N 2.91Å; V76-D95 WeakPolarHBondContact CA-O 3.34Å; V76-L96 HydrophobicContact CB-CD2 3.89Å; V76-L96 HydrophobicContact CG2-CD2 4.03Å; V76-V126 WeakPolarHBondContact O-CA 2.94Å; V76-A127 PolarHBondContact N-O 3.11Å; V76-A127 PolarHBondContact O-N 3.16Å
77	A	94.2	Very high	80.1	Confident	2 Å²	2	61.1 Å²	61.1	2%	0.017	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	118.9	174.5	0	0	0	0	0	111	F91 K92 G94 D95 M97	A77-F91 HydrophobicContact CB-CD2 3.53Å; A77-F91 HydrophobicContact CB-CE2 3.8Å; A77-K92 VanDerWaalsContact CB-O 3.29Å; A77-K92 WeakPolarHBondContact CB-O 3.36Å; A77-G94 PolarHBondContact O-N 3.42Å; A77-D95 HydrophobicContact CB-CB 4.26Å; A77-D95 PolarHBondContact N-O 3.15Å; A77-M97 HydrophobicContact CB-CE 4.07Å
78	L	89.9	Confident	82	Confident	33 Å²	33	58.9 Å²	58.9	17%	0.173	35%	0.35	C	S	.	.	S	Bend	trans	-81.1	-24	176.8	-55	-175.4	0	0	0	112.3	V76 K93 Y125 A127	V76-L78 HydrophobicContact CG1-CD2 4.32Å; V76-L78 PolarHBondContact O-N 2.91Å; L78-K93 VanDerWaalsContact O-CD 3.32Å; L78-K93 WeakPolarHBondContact O-CD 3.48Å; L78-K93 WeakPolarHBondContact O-CE 3.3Å; L78-K93 WeakPolarHBondContact O-CG 3.23Å; L78-Y125 PolarHBondContact N-O 2.78Å; L78-A127 HydrophobicContact CD1-CB 3.96Å; L78-A127 HydrophobicContact CD2-CB 4.06Å; L78-A127 HydrophobicContact CG-CB 4.18Å
79	H	86.9	Confident	84	Confident	56 Å²	56	55.7 Å²	55.7	26%	0.259	33%	0.327	S	S	.	.	S	Bend	trans	-140.9	158.3	-177.8	-58.9	-80.4	0	0	0	110	F91 Y125 P239	H79-F91 WeakPolarHBondContact O-CD2 3.3Å; H79-F91 WeakPolarHBondContact O-CE2 3.09Å; H79-Y125 HydrophobicContact CB-CD1 3.67Å; H79-Y125 HydrophobicContact CB-CE1 3.97Å; H79-Y125 HydrophobicContact CB-CG 4.4Å; H79-P239 HydrophobicContact CB-CG 4.4Å; H79-P239 WeakPolarHBondContact CD2-CG 3.38Å; H79-P239 WeakPolarHBondContact CE1-CD 3.49Å; H79-P239 VanDerWaalsContact NE2-CD 3.28Å; H79-P239 WeakPolarHBondContact NE2-CD 3.2Å
80	S	89.3	Confident	85.9	Confident	71 Å²	71	53 Å²	53	50%	0.497	32%	0.32	S	S	.	.			trans	-77.4	144.4	168.9	-55.4	0	0	0	0	110.2	F91 K92 K93 Y125	S80-F91 CarbonylContact C-O 3.53Å; S80-F91 WeakPolarHBondContact CA-O 3.25Å; S80-K92 WeakPolarHBondContact OG-CA 3.29Å; S80-K93 PolarHBondContact OG-N 2.89Å; S80-Y125 WeakPolarHBondContact O-CE1 3.45Å
81	Y	87.1	Confident	87.2	Confident	8 Å²	8	49.4 Å²	49.4	3%	0.031	28%	0.28	C	S	.	.	B	Isolated β-bridge	trans	-137.1	125.3	176.6	178.1	-109.8	0	0	0	109.5	L89 S90 F91 W107 P122 Y125	Y81-L89 WeakPolarHBondContact CD1-O 3.28Å; Y81-S90 CarbonylContact O-C 3.45Å; Y81-S90 VanDerWaalsContact O-CA 3.29Å; Y81-S90 WeakPolarHBondContact O-CA 3.21Å; Y81-F91 VanDerWaalsContact CB-CE1 3.45Å; Y81-F91 HydrophobicContact CD1-CD1 4.13Å; Y81-F91 AromaticContact CD1-CE1 3.56Å; Y81-F91 HydrophobicContact CD1-CE1 3.56Å; Y81-F91 HydrophobicContact CD1-CZ 4.19Å; Y81-F91 AromaticContact CG-CE1 3.86Å; Y81-F91 HydrophobicContact CG-CE1 3.86Å; Y81-F91 HydrophobicContact CG-CZ 4.02Å; Y81-F91 PolarHBondContact N-O 2.8Å; Y81-F91 PolarHBondContact O-N 2.9Å; Y81-F91 VanDerWaalsContact O-O 3.1Å; Y81-W107 HydrophobicContact CE1-CZ3 4.48Å; Y81-W107 WeakPolarHBondContact OH-CH2 3.48Å; Y81-P122 HydrophobicContact CD1-CG 4.3Å; Y81-P122 HydrophobicContact CD2-CG 3.85Å; Y81-P122 HydrophobicContact CE1-CG 4.14Å; Y81-P122 HydrophobicContact CE2-CG 3.7Å; Y81-P122 HydrophobicContact CG-CG 4.17Å; Y81-Y125 HydrophobicContact CD2-CD1 4.4Å; Y81-Y125 HydrophobicContact CD2-CE1 4.18Å
82	E	84.4	Confident	87.9	Confident	126 Å²	126	53.6 Å²	53.6	59%	0.589	28%	0.281	S	S	*	.			trans	-106.6	109.3	173.6	-67.1	-173.8	178	0	0	108.7
83	S	78.4	Confident	88.2	Confident	14 Å²	14	55.2 Å²	55.2	10%	0.098	29%	0.287	C	S	.	.			trans	-83.8	143.9	171.3	178	0	0	0	0	111.1	E85 D88 S90	S83-E85 PolarHBondContact OG-N 2.65Å; S83-E85 VanDerWaalsContact OG-N 3.09Å; S83-E85 PolarHBondContact OG-O 2.81Å; S83-D88 WeakPolarHBondContact OG-CB 3.48Å; S83-D88 PolarHBondContact OG-O 3.34Å; S83-S90 WeakPolarHBondContact CB-OG 3.48Å; S83-S90 PolarHBondContact N-OG 3.05Å; S83-S90 PolarHBondContact O-OG 3.49Å
84	M	71.7	Confident	88.2	Confident	110 Å²	110	53.7 Å²	53.7	54%	0.542	29%	0.29	S	S	.	.			trans	-120.9	4.8	166.3	-58.5	-60.3	-57.2	0	0	112.1	K280	M84-K280 HydrophobicContact CE-CB 4.29Å
85	E	75.5	Confident	88.3	Confident	38 Å²	38	55.3 Å²	55.3	18%	0.178	30%	0.298	C	S	.	.	S	Bend	trans	-97.4	135.5	-177.9	-166.2	107.6	-130.6	0	0	109.5	S83 G87 D88 S245 R279	S83-E85 PolarHBondContact OG-N 2.65Å; S83-E85 VanDerWaalsContact OG-N 3.09Å; S83-E85 PolarHBondContact OG-O 2.81Å; E85-G87 PolarHBondContact O-N 3.49Å; E85-D88 HydrophobicContact CB-CB 4.09Å; E85-D88 PolarHBondContact O-N 3.46Å; E85-S245 WeakPolarHBondContact OE2-CB 3.29Å; E85-S245 PolarHBondContact OE2-OG 2.81Å; E85-R279 IonicContact OE1-CZ 2.74Å; E85-R279 IonicContact OE1-NH1 2.71Å; E85-R279 PolarHBondContact OE1-NH1 3.15Å; E85-R279 IonicContact OE1-NH2 3.78Å; E85-R279 PolarHBondContact OE1-NH2 2.79Å; E85-R279 IonicContact OE2-CZ 3.68Å; E85-R279 IonicContact OE2-NH1 2.87Å; E85-R279 PolarHBondContact OE2-NH1 3.07Å; E85-R279 IonicContact OE2-NH2 2.71Å
86	E	78.4	Confident	88.3	Confident	199 Å²	199	58 Å²	58	93%	0.93	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	127.1	174.6	-169.9	176.5	178.2	0	0	109.8
87	G	85	Confident	88.4	Confident	39 Å²	39	56.7 Å²	56.7	40%	0.402	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.5	-14	-177.4	0	0	0	0	0	114.9	E85 G119 Y120	E85-G87 PolarHBondContact O-N 3.49Å; G87-G119 CarbonylContact O-C 3.52Å; G87-G119 WeakPolarHBondContact O-CA 3.45Å; G87-Y120 WeakPolarHBondContact O-CD2 3.41Å; G87-Y120 PolarHBondContact O-N 2.92Å
88	D	88	Confident	88.5	Confident	16 Å²	16	57.2 Å²	57.2	9%	0.086	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-88.6	144.6	169	-76.9	13.6	0	0	0	109.6	S83 E85 Y120	S83-D88 WeakPolarHBondContact OG-CB 3.48Å; S83-D88 PolarHBondContact OG-O 3.34Å; E85-D88 HydrophobicContact CB-CB 4.09Å; E85-D88 PolarHBondContact O-N 3.46Å; D88-Y120 CarbonylContact C-O 3.54Å; D88-Y120 WeakPolarHBondContact CA-O 3.42Å
89	L	91.3	Very high	88.8	Confident	5 Å²	5	56.7 Å²	56.7	3%	0.026	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-103.5	126.6	-173.8	178.7	70.8	0	0	0	111.2	Y81 F91 V110 H112 Q117 Y120 V121	Y81-L89 WeakPolarHBondContact CD1-O 3.28Å; L89-F91 VanDerWaalsContact O-CD1 3.26Å; L89-F91 WeakPolarHBondContact O-CD1 3.45Å; L89-V110 HydrophobicContact CD2-CG2 3.71Å; L89-H112 HydrophobicContact CD1-CB 4.37Å; L89-H112 HydrophobicContact CD2-CB 3.89Å; L89-Q117 HydrophobicContact CD1-CB 3.83Å; L89-Y120 PolarHBondContact N-O 3.28Å; L89-V121 HydrophobicContact CB-CG1 3.96Å; L89-V121 HydrophobicContact CD2-CG1 4.09Å; L89-V121 HydrophobicContact CG-CG1 4.45Å
90	S	91.2	Very high	89.2	Confident	58 Å²	58	58.8 Å²	58.8	41%	0.406	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-81.4	142.6	169.4	-63.4	0	0	0	0	111.6	Y81 S83	Y81-S90 CarbonylContact O-C 3.45Å; Y81-S90 VanDerWaalsContact O-CA 3.29Å; Y81-S90 WeakPolarHBondContact O-CA 3.21Å; S83-S90 WeakPolarHBondContact CB-OG 3.48Å; S83-S90 PolarHBondContact N-OG 3.05Å; S83-S90 PolarHBondContact O-OG 3.49Å
91	F	93.1	Very high	89.4	Confident	8 Å²	8	58.4 Å²	58.4	4%	0.035	31%	0.306	C	S	.	.	B	Isolated β-bridge	trans	-156.7	163.8	-177.9	56.4	-94	0	0	0	113	A77 H79 S80 Y81 L89 D95 M97 V121 Y125 V126	A77-F91 HydrophobicContact CB-CD2 3.53Å; A77-F91 HydrophobicContact CB-CE2 3.8Å; H79-F91 WeakPolarHBondContact O-CD2 3.3Å; H79-F91 WeakPolarHBondContact O-CE2 3.09Å; S80-F91 CarbonylContact C-O 3.53Å; S80-F91 WeakPolarHBondContact CA-O 3.25Å; Y81-F91 VanDerWaalsContact CB-CE1 3.45Å; Y81-F91 HydrophobicContact CD1-CD1 4.13Å; Y81-F91 AromaticContact CD1-CE1 3.56Å; Y81-F91 HydrophobicContact CD1-CE1 3.56Å; Y81-F91 HydrophobicContact CD1-CZ 4.19Å; Y81-F91 AromaticContact CG-CE1 3.86Å; Y81-F91 HydrophobicContact CG-CE1 3.86Å; Y81-F91 HydrophobicContact CG-CZ 4.02Å; Y81-F91 PolarHBondContact N-O 2.8Å; Y81-F91 PolarHBondContact O-N 2.9Å; Y81-F91 VanDerWaalsContact O-O 3.1Å; L89-F91 VanDerWaalsContact O-CD1 3.26Å; L89-F91 WeakPolarHBondContact O-CD1 3.45Å; F91-D95 HydrophobicContact CB-CB 4.37Å; F91-M97 HydrophobicContact CB-CE 3.27Å; F91-M97 HydrophobicContact CD1-CE 3.67Å; F91-M97 HydrophobicContact CD2-CE 3.66Å; F91-M97 HydrophobicContact CE1-CE 4.36Å; F91-M97 HydrophobicContact CE2-CE 4.32Å; F91-M97 HydrophobicContact CG-CE 3.26Å; F91-V121 HydrophobicContact CD1-CB 4.46Å; F91-V121 HydrophobicContact CD1-CG1 3.75Å; F91-V121 HydrophobicContact CE1-CB 3.62Å; F91-V121 HydrophobicContact CE1-CG1 3.38Å; F91-V121 HydrophobicContact CZ-CB 4.2Å; F91-V121 HydrophobicContact CZ-CG1 4.34Å; F91-Y125 HydrophobicContact CE2-CD1 4.44Å; F91-Y125 HydrophobicContact CZ-CD1 4.36Å; F91-Y125 HydrophobicContact CZ-CG 4.46Å; F91-V126 HydrophobicContact CE2-CG1 4.45Å; F91-V126 HydrophobicContact CZ-CG1 4.3Å
92	K	93.8	Very high	89.7	Confident	149 Å²	149	62.1 Å²	62.1	65%	0.648	33%	0.327	S	S	*	.			trans	-107.8	153.5	176.5	-64.7	-178.3	-180	178.7	0	110.9	A77 S80 G94 D95	A77-K92 VanDerWaalsContact CB-O 3.29Å; A77-K92 WeakPolarHBondContact CB-O 3.36Å; S80-K92 WeakPolarHBondContact OG-CA 3.29Å; K92-G94 PolarHBondContact O-N 3.04Å; K92-D95 PolarHBondContact N-OD2 3.35Å; K92-D95 VanDerWaalsContact O-CB 3.24Å; K92-D95 WeakPolarHBondContact O-CB 3.5Å; K92-D95 VanDerWaalsContact O-CG 3.27Å; K92-D95 PolarHBondContact O-N 3.13Å
93	K	92.8	Very high	90	Very high	118 Å²	118	60.7 Å²	60.7	51%	0.513	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.1	131.1	170	178.2	176.3	-178	-174.9	0	109.7	L78 S80 E136	L78-K93 VanDerWaalsContact O-CD 3.32Å; L78-K93 WeakPolarHBondContact O-CD 3.48Å; L78-K93 WeakPolarHBondContact O-CE 3.3Å; L78-K93 WeakPolarHBondContact O-CG 3.23Å; S80-K93 PolarHBondContact OG-N 2.89Å; K93-E136 IonicContact NZ-OE1 2.71Å; K93-E136 PolarHBondContact NZ-OE1 3.45Å
94	G	93.7	Very high	90.4	Very high	46 Å²	46	61.9 Å²	61.9	47%	0.474	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.6	-11.7	-179.1	0	0	0	0	0	114.8	A77 K92	A77-G94 PolarHBondContact O-N 3.42Å; K92-G94 PolarHBondContact O-N 3.04Å
95	D	96.7	Very high	91	Very high	39 Å²	39	62 Å²	62	21%	0.209	34%	0.343	C	S	.	.			trans	-61.2	142.6	175.7	-75.4	-7.5	0	0	0	111.1	V76 A77 F91 K92 M97 H112	V76-D95 WeakPolarHBondContact CA-O 3.34Å; A77-D95 HydrophobicContact CB-CB 4.26Å; A77-D95 PolarHBondContact N-O 3.15Å; F91-D95 HydrophobicContact CB-CB 4.37Å; K92-D95 PolarHBondContact N-OD2 3.35Å; K92-D95 VanDerWaalsContact O-CB 3.24Å; K92-D95 WeakPolarHBondContact O-CB 3.5Å; K92-D95 VanDerWaalsContact O-CG 3.27Å; K92-D95 PolarHBondContact O-N 3.13Å; D95-M97 HydrophobicContact CB-CE 4.08Å; D95-H112 WeakPolarHBondContact CB-NE2 3.35Å; D95-H112 VanDerWaalsContact CG-NE2 3.32Å; D95-H112 IonicContact OD1-NE2 2.82Å; D95-H112 IonicContact OD2-CE1 2.8Å; D95-H112 IonicContact OD2-NE2 3.05Å; D95-H112 PolarHBondContact OD2-NE2 3.35Å
96	L	97.3	Very high	91.4	Very high	56 Å²	56	61.8 Å²	61.8	29%	0.293	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	141.5	178.5	-60	178	0	0	0	110.8	V74 L75 V76 H112 L113	V74-L96 HydrophobicContact CG1-CB 4.41Å; L75-L96 WeakPolarHBondContact O-CA 3.43Å; V76-L96 HydrophobicContact CB-CD2 3.89Å; V76-L96 HydrophobicContact CG2-CD2 4.03Å; L96-H112 PolarHBondContact O-CD2 3.12Å; L96-L113 HydrophobicContact CB-CB 4.42Å; L96-L113 HydrophobicContact CB-CD1 3.45Å; L96-L113 VanDerWaalsContact CB-CD1 3.45Å; L96-L113 WeakPolarHBondContact O-CB 3.25Å; L96-L113 PolarHBondContact O-N 2.99Å
97	M	96.8	Very high	92	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	149.1	-177.3	-58.8	156.6	-162.3	0	0	111.1	V74 L75 A77 F91 D95 V110 K111 V121 V126	V74-M97 CarbonylContact C-O 3.58Å; V74-M97 WeakPolarHBondContact CA-O 3.46Å; L75-M97 HydrophobicContact CB-CB 4.38Å; L75-M97 PolarHBondContact N-O 3.26Å; L75-M97 PolarHBondContact O-N 3.27Å; A77-M97 HydrophobicContact CB-CE 4.07Å; F91-M97 HydrophobicContact CB-CE 3.27Å; F91-M97 HydrophobicContact CD1-CE 3.67Å; F91-M97 HydrophobicContact CD2-CE 3.66Å; F91-M97 HydrophobicContact CE1-CE 4.36Å; F91-M97 HydrophobicContact CE2-CE 4.32Å; F91-M97 HydrophobicContact CG-CE 3.26Å; D95-M97 HydrophobicContact CB-CE 4.08Å; M97-V110 HydrophobicContact CB-CB 4.03Å; M97-V110 HydrophobicContact CB-CG2 4.04Å; M97-V110 HydrophobicContact CG-CG2 4.13Å; M97-V110 HydrophobicContact SD-CG2 3.8Å; M97-K111 CarbonylContact C-O 3.53Å; M97-K111 VanDerWaalsContact CA-O 3.22Å; M97-K111 WeakPolarHBondContact CA-O 3.48Å; M97-V121 HydrophobicContact SD-CG1 4.2Å; M97-V126 HydrophobicContact SD-CG1 4.21Å
98	I	97	Very high	92.4	Very high	13 Å²	13	52 Å²	52	7%	0.067	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	125.6	170.5	-67.3	154.8	0	0	0	108.5	Q72 I73 H100 V110 K111 L113	Q72-I98 HydrophobicContact CB-CG2 3.94Å; Q72-I98 HydrophobicContact CG-CG2 4.24Å; I73-I98 WeakPolarHBondContact O-CA 3.41Å; I98-H100 PolarHBondContact O-N 2.75Å; I98-V110 CarbonylContact O-C 3.48Å; I98-V110 WeakPolarHBondContact O-CA 3.39Å; I98-V110 WeakPolarHBondContact O-CB 3.27Å; I98-K111 HydrophobicContact CB-CB 4.48Å; I98-K111 PolarHBondContact N-O 3.07Å; I98-K111 PolarHBondContact O-N 3.01Å; I98-L113 HydrophobicContact CD1-CD2 3.65Å; I98-L113 HydrophobicContact CD1-CG 4.17Å; I98-L113 HydrophobicContact CG1-CD1 4.42Å; I98-L113 HydrophobicContact CG1-CD2 4.07Å; I98-L113 HydrophobicContact CG1-CG 4.17Å
99	L	96.5	Very high	92.8	Very high	21 Å²	21	54.9 Å²	54.9	11%	0.11	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	124.7	173.7	178.4	62.8	0	0	0	110.3	I73 L75 N102 W108 V110	I73-L99 HydrophobicContact CB-CB 4.13Å; I73-L99 HydrophobicContact CD1-CD2 4.43Å; I73-L99 HydrophobicContact CG2-CB 4.06Å; I73-L99 HydrophobicContact CG2-CD2 4.07Å; I73-L99 PolarHBondContact O-N 2.86Å; L75-L99 HydrophobicContact CD1-CB 3.9Å; L75-L99 HydrophobicContact CD1-CD1 4.11Å; L75-L99 HydrophobicContact CD1-CG 4.5Å; L75-L99 HydrophobicContact CG-CB 4.13Å; L99-N102 HydrophobicContact CD1-CB 4.15Å; L99-N102 HydrophobicContact CD2-CB 4.15Å; L99-W108 HydrophobicContact CD1-CB 3.93Å; L99-W108 HydrophobicContact CD1-CD2 4.13Å; L99-W108 HydrophobicContact CD1-CE3 3.94Å; L99-W108 HydrophobicContact CD1-CG 4.2Å; L99-W108 HydrophobicContact CD2-CE3 4.45Å; L99-W108 HydrophobicContact CD2-CZ3 4.44Å; L99-V110 HydrophobicContact CD1-CG1 4.19Å
100	H	95.4	Very high	93.1	Very high	100 Å²	100	54.6 Å²	54.6	46%	0.463	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	-39.2	176.4	-78.4	-58.2	0	0	0	113.1	I98 Y109 K111	I98-H100 PolarHBondContact O-N 2.75Å; H100-Y109 HydrophobicContact CB-CD1 3.85Å; H100-Y109 PolarHBondContact N-O 3.35Å; H100-K111 VanDerWaalsContact NE2-CB 3.31Å; H100-K111 WeakPolarHBondContact NE2-CB 3.24Å
101	D	93.7	Very high	93.3	Very high	63 Å²	63	54.5 Å²	54.5	34%	0.337	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	130.7	178.2	-174.8	6.7	0	0	0	111	S103 W108 Y109	D101-S103 VanDerWaalsContact CG-OG 3.32Å; D101-S103 WeakPolarHBondContact OD1-CB 3.49Å; D101-S103 PolarHBondContact OD1-N 3.36Å; D101-S103 PolarHBondContact OD1-OG 2.9Å; D101-S103 PolarHBondContact OD2-OG 2.98Å; D101-W108 CarbonylContact O-C 3.41Å; D101-W108 WeakPolarHBondContact O-CA 3.25Å; D101-Y109 PolarHBondContact N-O 2.92Å; D101-Y109 PolarHBondContact O-N 2.88Å
102	N	92.7	Very high	93.5	Very high	86 Å²	86	54.7 Å²	54.7	46%	0.46	29%	0.288	S	S	.	.			trans	-123.3	22.4	175.7	63.1	-4.4	0	0	0	113.1	L99 N104 W108	L99-N102 HydrophobicContact CD1-CB 4.15Å; L99-N102 HydrophobicContact CD2-CB 4.15Å; N102-N104 VanDerWaalsContact C-N 3.28Å; N102-N104 PolarHBondContact O-N 3.31Å; N102-W108 HydrophobicContact CB-CD2 3.96Å; N102-W108 HydrophobicContact CB-CG 4.08Å; N102-W108 HydrophobicContact CB-CZ2 4Å
103	S	90.3	Very high	93.5	Very high	97 Å²	97	50.1 Å²	50.1	68%	0.678	27%	0.27	S	S	*	.			trans	-66	-25.2	-178	61.8	0	0	0	0	114.3	D101	D101-S103 VanDerWaalsContact CG-OG 3.32Å; D101-S103 WeakPolarHBondContact OD1-CB 3.49Å; D101-S103 PolarHBondContact OD1-N 3.36Å; D101-S103 PolarHBondContact OD1-OG 2.9Å; D101-S103 PolarHBondContact OD2-OG 2.98Å
104	N	87.7	Confident	93.6	Very high	39 Å²	39	48.9 Å²	48.9	21%	0.209	28%	0.277	C	S	.	.	S	Bend	trans	-95.2	139	171.8	176.3	-55.9	0	0	0	110.1	N102 D106 W107 W108 Q249	N102-N104 VanDerWaalsContact C-N 3.28Å; N102-N104 PolarHBondContact O-N 3.31Å; N104-D106 VanDerWaalsContact C-N 3.35Å; N104-D106 PolarHBondContact O-N 2.91Å; N104-D106 WeakPolarHBondContact OD1-CA 3.13Å; N104-D106 PolarHBondContact OD1-N 3.45Å; N104-W107 WeakPolarHBondContact CB-O 3.26Å; N104-W107 PolarHBondContact OD1-N 2.88Å; N104-W108 PolarHBondContact O-NE1 2.86Å; N104-W108 VanDerWaalsContact O-NE1 3.12Å; N104-Q249 PolarHBondContact ND2-OE1 3Å
105	T	83.8	Confident	93.6	Very high	111 Å²	111	49.1 Å²	49.1	68%	0.681	27%	0.271	S	S	*	.	S	Bend	trans	-69	-30.7	-175.5	43.9	0	0	0	0	113.8
106	D	85.5	Confident	93.5	Very high	34 Å²	34	52.6 Å²	52.6	18%	0.182	29%	0.286	C	S	.	.	S	Bend	trans	-107.5	-25.2	-171	-62.5	-73.2	0	0	0	112.9	N104 P122 R123 S242 Q249	N104-D106 VanDerWaalsContact C-N 3.35Å; N104-D106 PolarHBondContact O-N 2.91Å; N104-D106 WeakPolarHBondContact OD1-CA 3.13Å; N104-D106 PolarHBondContact OD1-N 3.45Å; D106-P122 CarbonylContact O-C 3.58Å; D106-P122 WeakPolarHBondContact O-CA 3.31Å; D106-R123 PolarHBondContact O-N 3.2Å; D106-S242 WeakPolarHBondContact OD1-CB 3.36Å; D106-Q249 PolarHBondContact OD2-NE2 2.85Å
107	W	90	Very high	93.4	Very high	5 Å²	5	55.7 Å²	55.7	2%	0.019	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	121.1	-174	-64	89.6	0	0	0	111.2	Y81 N104 Y120 V121 P122 S245 R246	Y81-W107 HydrophobicContact CE1-CZ3 4.48Å; Y81-W107 WeakPolarHBondContact OH-CH2 3.48Å; N104-W107 WeakPolarHBondContact CB-O 3.26Å; N104-W107 PolarHBondContact OD1-N 2.88Å; W107-Y120 HydrophobicContact CB-CD1 4.48Å; W107-V121 WeakPolarHBondContact CA-O 3.4Å; W107-P122 HydrophobicContact CE3-CG 4.32Å; W107-P122 HydrophobicContact CH2-CG 3.88Å; W107-P122 HydrophobicContact CZ3-CB 4.36Å; W107-P122 HydrophobicContact CZ3-CG 3.67Å; W107-S245 VanDerWaalsContact CZ2-CA 3.5Å; W107-R246 HydrophobicContact CB-CG 4.4Å; W107-R246 HydrophobicContact CD2-CB 3.77Å; W107-R246 HydrophobicContact CE3-CB 4.2Å; W107-R246 HydrophobicContact CG-CB 3.88Å; W107-R246 HydrophobicContact CG-CG 4.14Å; W107-R246 VanDerWaalsContact CZ2-N 3.29Å
108	W	93.8	Very high	93.3	Very high	27 Å²	27	58.1 Å²	58.1	10%	0.102	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	141.1	178.9	-71.1	-2.7	0	0	0	110.5	L75 L99 D101 N102 N104 V110 Y120 V121 R123 V126	L75-W108 HydrophobicContact CD1-CE3 4.11Å; L75-W108 HydrophobicContact CD2-CE3 4.33Å; L75-W108 HydrophobicContact CD2-CZ3 3.94Å; L99-W108 HydrophobicContact CD1-CB 3.93Å; L99-W108 HydrophobicContact CD1-CD2 4.13Å; L99-W108 HydrophobicContact CD1-CE3 3.94Å; L99-W108 HydrophobicContact CD1-CG 4.2Å; L99-W108 HydrophobicContact CD2-CE3 4.45Å; L99-W108 HydrophobicContact CD2-CZ3 4.44Å; D101-W108 CarbonylContact O-C 3.41Å; D101-W108 WeakPolarHBondContact O-CA 3.25Å; N102-W108 HydrophobicContact CB-CD2 3.96Å; N102-W108 HydrophobicContact CB-CG 4.08Å; N102-W108 HydrophobicContact CB-CZ2 4Å; N104-W108 PolarHBondContact O-NE1 2.86Å; N104-W108 VanDerWaalsContact O-NE1 3.12Å; W108-V110 HydrophobicContact CB-CG1 4.37Å; W108-Y120 CarbonylContact O-C 3.59Å; W108-Y120 VanDerWaalsContact O-CA 3.26Å; W108-Y120 WeakPolarHBondContact O-CA 3.32Å; W108-V121 HydrophobicContact CB-CG2 4.45Å; W108-V121 PolarHBondContact N-O 3.03Å; W108-V121 PolarHBondContact O-N 2.78Å; W108-R123 HydrophobicContact CD2-CB 4.43Å; W108-R123 HydrophobicContact CD2-CG 4.5Å; W108-R123 VanDerWaalsContact CE2-CD 3.46Å; W108-R123 HydrophobicContact CZ2-CG 4.2Å; W108-R123 VanDerWaalsContact CZ3-CD 3.49Å; W108-V126 HydrophobicContact CE3-CG2 4.2Å
109	Y	96	Very high	93.2	Very high	77 Å²	77	57.6 Å²	57.6	30%	0.302	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	125.8	174.1	-165.3	-109.1	0	0	0	109.5	H100 D101 S118 Y120	H100-Y109 HydrophobicContact CB-CD1 3.85Å; H100-Y109 PolarHBondContact N-O 3.35Å; D101-Y109 PolarHBondContact N-O 2.92Å; D101-Y109 PolarHBondContact O-N 2.88Å; Y109-S118 VanDerWaalsContact OH-CB 3.28Å; Y109-S118 WeakPolarHBondContact OH-CB 3.38Å; Y109-Y120 AromaticContact CD2-CD1 3.96Å; Y109-Y120 HydrophobicContact CD2-CD1 3.96Å; Y109-Y120 AromaticContact CD2-CD2 3.87Å; Y109-Y120 HydrophobicContact CD2-CD2 3.87Å; Y109-Y120 AromaticContact CD2-CE1 3.84Å; Y109-Y120 HydrophobicContact CD2-CE1 3.84Å; Y109-Y120 AromaticContact CD2-CE2 3.72Å; Y109-Y120 HydrophobicContact CD2-CE2 3.72Å; Y109-Y120 AromaticContact CD2-CG 3.98Å; Y109-Y120 HydrophobicContact CD2-CG 3.98Å; Y109-Y120 AromaticContact CD2-CZ 3.71Å; Y109-Y120 HydrophobicContact CE2-CD2 4.33Å; Y109-Y120 HydrophobicContact CE2-CE2 4.11Å; Y109-Y120 HydrophobicContact CG-CD1 4.48Å; Y109-Y120 HydrophobicContact CG-CE1 4.24Å
110	V	96.6	Very high	93.1	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	165.7	-173.2	-52.3	0	0	0	0	110.8	L75 L89 M97 I98 L99 W108 S118 G119 V121	L75-V110 HydrophobicContact CD1-CG1 3.61Å; L89-V110 HydrophobicContact CD2-CG2 3.71Å; M97-V110 HydrophobicContact CB-CB 4.03Å; M97-V110 HydrophobicContact CB-CG2 4.04Å; M97-V110 HydrophobicContact CG-CG2 4.13Å; M97-V110 HydrophobicContact SD-CG2 3.8Å; I98-V110 CarbonylContact O-C 3.48Å; I98-V110 WeakPolarHBondContact O-CA 3.39Å; I98-V110 WeakPolarHBondContact O-CB 3.27Å; L99-V110 HydrophobicContact CD1-CG1 4.19Å; W108-V110 HydrophobicContact CB-CG1 4.37Å; V110-S118 CarbonylContact O-C 3.55Å; V110-S118 WeakPolarHBondContact O-CA 3.34Å; V110-S118 WeakPolarHBondContact O-CB 3.43Å; V110-G119 PolarHBondContact N-O 3.37Å; V110-G119 PolarHBondContact O-N 2.69Å; V110-V121 HydrophobicContact CB-CG2 4.43Å; V110-V121 HydrophobicContact CG1-CG2 3.67Å; V110-V121 HydrophobicContact CG2-CB 4.34Å; V110-V121 HydrophobicContact CG2-CG1 3.54Å; V110-V121 HydrophobicContact CG2-CG2 3.84Å
111	K	97.2	Very high	92.9	Very high	56 Å²	56	54.4 Å²	54.4	24%	0.243	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	123.4	168.9	-179.7	179.1	179.8	-169.8	0	109.9	M97 I98 H100 E116 S118	M97-K111 CarbonylContact C-O 3.53Å; M97-K111 VanDerWaalsContact CA-O 3.22Å; M97-K111 WeakPolarHBondContact CA-O 3.48Å; I98-K111 HydrophobicContact CB-CB 4.48Å; I98-K111 PolarHBondContact N-O 3.07Å; I98-K111 PolarHBondContact O-N 3.01Å; H100-K111 VanDerWaalsContact NE2-CB 3.31Å; H100-K111 WeakPolarHBondContact NE2-CB 3.24Å; K111-E116 WeakPolarHBondContact CE-O 3.39Å; K111-E116 WeakPolarHBondContact CE-OE2 3.5Å; K111-E116 IonicContact NZ-OE2 3.2Å; K111-E116 PolarHBondContact NZ-OE2 3.13Å; K111-S118 WeakPolarHBondContact CB-OG 3.43Å
112	H	96.5	Very high	92.7	Very high	12 Å²	12	51.7 Å²	51.7	6%	0.056	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	129	175.9	-167.8	-140.8	0	0	0	110.8	L89 D95 L96 S114 S115 E116 Q117	L89-H112 HydrophobicContact CD1-CB 4.37Å; L89-H112 HydrophobicContact CD2-CB 3.89Å; D95-H112 WeakPolarHBondContact CB-NE2 3.35Å; D95-H112 VanDerWaalsContact CG-NE2 3.32Å; D95-H112 IonicContact OD1-NE2 2.82Å; D95-H112 IonicContact OD2-CE1 2.8Å; D95-H112 IonicContact OD2-NE2 3.05Å; D95-H112 PolarHBondContact OD2-NE2 3.35Å; L96-H112 PolarHBondContact O-CD2 3.12Å; H112-S114 PolarHBondContact CE1-OG 3.06Å; H112-S114 PolarHBondContact ND1-OG 3.04Å; H112-S114 PolarHBondContact NE2-OG 3.37Å; H112-S115 WeakPolarHBondContact CB-OG 3.45Å; H112-S115 WeakPolarHBondContact ND1-CB 3.47Å; H112-S115 PolarHBondContact ND1-N 2.92Å; H112-S115 PolarHBondContact ND1-OG 3.03Å; H112-E116 WeakPolarHBondContact O-CA 3.41Å; H112-E116 PolarHBondContact O-N 3.45Å; H112-Q117 WeakPolarHBondContact CB-O 3.09Å; H112-Q117 PolarHBondContact N-O 2.83Å
113	L	94.5	Very high	92.6	Very high	52 Å²	52	50.1 Å²	50.1	27%	0.272	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-31.3	-175	-85	156.8	0	0	0	113.5	V74 L96 I98	V74-L113 HydrophobicContact CG1-CD1 4.09Å; L96-L113 HydrophobicContact CB-CB 4.42Å; L96-L113 HydrophobicContact CB-CD1 3.45Å; L96-L113 VanDerWaalsContact CB-CD1 3.45Å; L96-L113 WeakPolarHBondContact O-CB 3.25Å; L96-L113 PolarHBondContact O-N 2.99Å; I98-L113 HydrophobicContact CD1-CD2 3.65Å; I98-L113 HydrophobicContact CD1-CG 4.17Å; I98-L113 HydrophobicContact CG1-CD1 4.42Å; I98-L113 HydrophobicContact CG1-CD2 4.07Å; I98-L113 HydrophobicContact CG1-CG 4.17Å
114	S	93.6	Very high	92.5	Very high	93 Å²	93	48.6 Å²	48.6	65%	0.65	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-37.3	-176.4	67.7	0	0	0	0	113.5	H112	H112-S114 PolarHBondContact CE1-OG 3.06Å; H112-S114 PolarHBondContact ND1-OG 3.04Å; H112-S114 PolarHBondContact NE2-OG 3.37Å
115	S	94	Very high	92.6	Very high	50 Å²	50	47.7 Å²	47.7	35%	0.35	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93	-8.9	177.8	71.6	0	0	0	0	113.8	H112 Q117	H112-S115 WeakPolarHBondContact CB-OG 3.45Å; H112-S115 WeakPolarHBondContact ND1-CB 3.47Å; H112-S115 PolarHBondContact ND1-N 2.92Å; H112-S115 PolarHBondContact ND1-OG 3.03Å; S115-Q117 PolarHBondContact O-N 3.1Å
116	E	94.5	Very high	93.1	Very high	112 Å²	112	42.5 Å²	42.5	52%	0.523	22%	0.218	S	C	.	.			trans	59.4	8.1	-175.5	-65	-74.8	138.5	0	0	114.4	K111 H112	K111-E116 WeakPolarHBondContact CE-O 3.39Å; K111-E116 WeakPolarHBondContact CE-OE2 3.5Å; K111-E116 IonicContact NZ-OE2 3.2Å; K111-E116 PolarHBondContact NZ-OE2 3.13Å; H112-E116 WeakPolarHBondContact O-CA 3.41Å; H112-E116 PolarHBondContact O-N 3.45Å
117	Q	95.3	Very high	93.5	Very high	122 Å²	122	40.9 Å²	40.9	57%	0.57	21%	0.209	S	C	*	.			trans	-80	141.1	178.7	-67	177.8	-6.3	0	0	110.7	L89 H112 S115	L89-Q117 HydrophobicContact CD1-CB 3.83Å; H112-Q117 WeakPolarHBondContact CB-O 3.09Å; H112-Q117 PolarHBondContact N-O 2.83Å; S115-Q117 PolarHBondContact O-N 3.1Å
118	S	95.6	Very high	93.7	Very high	51 Å²	51	43.6 Å²	43.6	36%	0.357	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	145.9	174.2	-57.5	0	0	0	0	111.2	Y109 V110 K111	Y109-S118 VanDerWaalsContact OH-CB 3.28Å; Y109-S118 WeakPolarHBondContact OH-CB 3.38Å; V110-S118 CarbonylContact O-C 3.55Å; V110-S118 WeakPolarHBondContact O-CA 3.34Å; V110-S118 WeakPolarHBondContact O-CB 3.43Å; K111-S118 WeakPolarHBondContact CB-OG 3.43Å
119	G	95.1	Very high	93.5	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.01	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-178.9	177.2	176.1	0	0	0	0	0	112.2	G87 V110	G87-G119 CarbonylContact O-C 3.52Å; G87-G119 WeakPolarHBondContact O-CA 3.45Å; V110-G119 PolarHBondContact N-O 3.37Å; V110-G119 PolarHBondContact O-N 2.69Å
120	Y	92.7	Very high	93.1	Very high	55 Å²	55	46.2 Å²	46.2	22%	0.216	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	142.7	176.2	-65.4	-84.3	0	0	0	111.4	G87 D88 L89 W107 W108 Y109	G87-Y120 WeakPolarHBondContact O-CD2 3.41Å; G87-Y120 PolarHBondContact O-N 2.92Å; D88-Y120 CarbonylContact C-O 3.54Å; D88-Y120 WeakPolarHBondContact CA-O 3.42Å; L89-Y120 PolarHBondContact N-O 3.28Å; W107-Y120 HydrophobicContact CB-CD1 4.48Å; W108-Y120 CarbonylContact O-C 3.59Å; W108-Y120 VanDerWaalsContact O-CA 3.26Å; W108-Y120 WeakPolarHBondContact O-CA 3.32Å; Y109-Y120 AromaticContact CD2-CD1 3.96Å; Y109-Y120 HydrophobicContact CD2-CD1 3.96Å; Y109-Y120 AromaticContact CD2-CD2 3.87Å; Y109-Y120 HydrophobicContact CD2-CD2 3.87Å; Y109-Y120 AromaticContact CD2-CE1 3.84Å; Y109-Y120 HydrophobicContact CD2-CE1 3.84Å; Y109-Y120 AromaticContact CD2-CE2 3.72Å; Y109-Y120 HydrophobicContact CD2-CE2 3.72Å; Y109-Y120 AromaticContact CD2-CG 3.98Å; Y109-Y120 HydrophobicContact CD2-CG 3.98Å; Y109-Y120 AromaticContact CD2-CZ 3.71Å; Y109-Y120 HydrophobicContact CE2-CD2 4.33Å; Y109-Y120 HydrophobicContact CE2-CE2 4.11Å; Y109-Y120 HydrophobicContact CG-CD1 4.48Å; Y109-Y120 HydrophobicContact CG-CE1 4.24Å
121	V	92.1	Very high	92.8	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	148.5	175.3	-60.5	0	0	0	0	110.2	L89 F91 M97 W107 W108 V110 R123 V126	L89-V121 HydrophobicContact CB-CG1 3.96Å; L89-V121 HydrophobicContact CD2-CG1 4.09Å; L89-V121 HydrophobicContact CG-CG1 4.45Å; F91-V121 HydrophobicContact CD1-CB 4.46Å; F91-V121 HydrophobicContact CD1-CG1 3.75Å; F91-V121 HydrophobicContact CE1-CB 3.62Å; F91-V121 HydrophobicContact CE1-CG1 3.38Å; F91-V121 HydrophobicContact CZ-CB 4.2Å; F91-V121 HydrophobicContact CZ-CG1 4.34Å; M97-V121 HydrophobicContact SD-CG1 4.2Å; W107-V121 WeakPolarHBondContact CA-O 3.4Å; W108-V121 HydrophobicContact CB-CG2 4.45Å; W108-V121 PolarHBondContact N-O 3.03Å; W108-V121 PolarHBondContact O-N 2.78Å; V110-V121 HydrophobicContact CB-CG2 4.43Å; V110-V121 HydrophobicContact CG1-CG2 3.67Å; V110-V121 HydrophobicContact CG2-CB 4.34Å; V110-V121 HydrophobicContact CG2-CG1 3.54Å; V110-V121 HydrophobicContact CG2-CG2 3.84Å; V121-R123 PolarHBondContact O-N 2.64Å; V121-V126 HydrophobicContact CG2-CG1 4.14Å; V121-V126 HydrophobicContact CG2-CG2 4.25Å
122	P	90.2	Very high	92.5	Very high	5 Å²	5	46.1 Å²	46.1	3%	0.032	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	128.3	173.5	-15	26.8	0	0	0	110.6	Y81 D106 W107 T124 Y125	Y81-P122 HydrophobicContact CD1-CG 4.3Å; Y81-P122 HydrophobicContact CD2-CG 3.85Å; Y81-P122 HydrophobicContact CE1-CG 4.14Å; Y81-P122 HydrophobicContact CE2-CG 3.7Å; Y81-P122 HydrophobicContact CG-CG 4.17Å; D106-P122 CarbonylContact O-C 3.58Å; D106-P122 WeakPolarHBondContact O-CA 3.31Å; W107-P122 HydrophobicContact CE3-CG 4.32Å; W107-P122 HydrophobicContact CH2-CG 3.88Å; W107-P122 HydrophobicContact CZ3-CB 4.36Å; W107-P122 HydrophobicContact CZ3-CG 3.67Å; P122-T124 PolarHBondContact O-N 2.99Å; P122-Y125 HydrophobicContact CB-CD2 3.72Å; P122-Y125 HydrophobicContact CB-CE2 4.38Å; P122-Y125 HydrophobicContact CB-CG 4.19Å; P122-Y125 HydrophobicContact CG-CD2 4.13Å; P122-Y125 HydrophobicContact CG-CG 4.31Å; P122-Y125 WeakPolarHBondContact O-CB 3.2Å; P122-Y125 PolarHBondContact O-N 2.92Å
123	R	90.2	Very high	92.2	Very high	54 Å²	54	48.7 Å²	48.7	20%	0.204	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-55.5	-39	177.2	167.5	53.6	172.9	112.5	-3.8	112	D106 W108 V121 Y125 V126 E133	D106-R123 PolarHBondContact O-N 3.2Å; W108-R123 HydrophobicContact CD2-CB 4.43Å; W108-R123 HydrophobicContact CD2-CG 4.5Å; W108-R123 VanDerWaalsContact CE2-CD 3.46Å; W108-R123 HydrophobicContact CZ2-CG 4.2Å; W108-R123 VanDerWaalsContact CZ3-CD 3.49Å; V121-R123 PolarHBondContact O-N 2.64Å; R123-Y125 PolarHBondContact O-N 3.39Å; R123-Y125 VanDerWaalsContact O-N 3.1Å; R123-V126 PolarHBondContact NH1-O 3.41Å; R123-V126 VanDerWaalsContact NH1-O 3.14Å; R123-V126 PolarHBondContact O-N 2.98Å; R123-V126 VanDerWaalsContact O-O 3.06Å; R123-E133 IonicContact CZ-OE2 2.87Å; R123-E133 IonicContact NH1-OE2 3.44Å; R123-E133 PolarHBondContact NH1-OE2 3.11Å; R123-E133 IonicContact NH2-OE1 3.62Å; R123-E133 PolarHBondContact NH2-OE1 3.45Å; R123-E133 IonicContact NH2-OE2 3.52Å; R123-E133 PolarHBondContact NH2-OE2 3.44Å
124	T	87.1	Confident	92	Very high	64 Å²	64	47.4 Å²	47.4	39%	0.393	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-68.1	-9	-178.4	55.1	0	0	0	0	113.9	P122	P122-T124 PolarHBondContact O-N 2.99Å
125	Y	90.7	Very high	91.9	Very high	21 Å²	21	45.2 Å²	45.2	8%	0.082	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-100.7	-8.1	-178.7	-80	-121.7	0	0	0	113.3	L78 H79 S80 Y81 F91 P122 R123 P239 R241	L78-Y125 PolarHBondContact N-O 2.78Å; H79-Y125 HydrophobicContact CB-CD1 3.67Å; H79-Y125 HydrophobicContact CB-CE1 3.97Å; H79-Y125 HydrophobicContact CB-CG 4.4Å; S80-Y125 WeakPolarHBondContact O-CE1 3.45Å; Y81-Y125 HydrophobicContact CD2-CD1 4.4Å; Y81-Y125 HydrophobicContact CD2-CE1 4.18Å; F91-Y125 HydrophobicContact CE2-CD1 4.44Å; F91-Y125 HydrophobicContact CZ-CD1 4.36Å; F91-Y125 HydrophobicContact CZ-CG 4.46Å; P122-Y125 HydrophobicContact CB-CD2 3.72Å; P122-Y125 HydrophobicContact CB-CE2 4.38Å; P122-Y125 HydrophobicContact CB-CG 4.19Å; P122-Y125 HydrophobicContact CG-CD2 4.13Å; P122-Y125 HydrophobicContact CG-CG 4.31Å; P122-Y125 WeakPolarHBondContact O-CB 3.2Å; P122-Y125 PolarHBondContact O-N 2.92Å; R123-Y125 PolarHBondContact O-N 3.39Å; R123-Y125 VanDerWaalsContact O-N 3.1Å; Y125-P239 HydrophobicContact CD2-CB 4.21Å; Y125-P239 HydrophobicContact CD2-CG 4.05Å; Y125-P239 HydrophobicContact CE1-CG 4.39Å; Y125-P239 HydrophobicContact CE2-CB 3.99Å; Y125-P239 HydrophobicContact CE2-CG 3.76Å; Y125-P239 HydrophobicContact CG-CG 4.5Å; Y125-R241 HydrophobicContact CE2-CG 4.33Å
126	V	92.9	Very high	91.8	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.006	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	151.1	-174.5	-62.6	0	0	0	0	111.2	L75 V76 F91 M97 W108 V121 R123	L75-V126 HydrophobicContact CB-CB 4.48Å; L75-V126 HydrophobicContact CD1-CG2 4.2Å; V76-V126 WeakPolarHBondContact O-CA 2.94Å; F91-V126 HydrophobicContact CE2-CG1 4.45Å; F91-V126 HydrophobicContact CZ-CG1 4.3Å; M97-V126 HydrophobicContact SD-CG1 4.21Å; W108-V126 HydrophobicContact CE3-CG2 4.2Å; V121-V126 HydrophobicContact CG2-CG1 4.14Å; V121-V126 HydrophobicContact CG2-CG2 4.25Å; R123-V126 PolarHBondContact NH1-O 3.41Å; R123-V126 VanDerWaalsContact NH1-O 3.14Å; R123-V126 PolarHBondContact O-N 2.98Å; R123-V126 VanDerWaalsContact O-O 3.06Å
127	A	94	Very high	91.7	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	158.4	171.9	0	0	0	0	0	110.5	L75 V76 L78 Q129 E133	L75-A127 CarbonylContact C-O 3.5Å; L75-A127 WeakPolarHBondContact CA-O 3.48Å; V76-A127 PolarHBondContact N-O 3.11Å; V76-A127 PolarHBondContact O-N 3.16Å; L78-A127 HydrophobicContact CD1-CB 3.96Å; L78-A127 HydrophobicContact CD2-CB 4.06Å; L78-A127 HydrophobicContact CG-CB 4.18Å; A127-Q129 PolarHBondContact O-N 3Å; A127-E133 HydrophobicContact CB-CB 3.63Å
128	L	94	Very high	91.6	Very high	62 Å²	62	38.1 Å²	38.1	33%	0.325	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	133.1	169.9	-67.8	170	0	0	0	109.9	I73 L75 S131 S134	I73-L128 HydrophobicContact CG2-CD2 3.2Å; L75-L128 HydrophobicContact CD2-CD2 3.77Å; L75-L128 HydrophobicContact CD2-CG 4.27Å; L128-S131 VanDerWaalsContact O-CB 3.26Å; L128-S131 WeakPolarHBondContact O-CB 3.32Å; L128-S131 PolarHBondContact O-N 2.87Å; L128-S131 VanDerWaalsContact O-N 3.13Å; L128-S131 PolarHBondContact O-OG 2.84Å; L128-S134 WeakPolarHBondContact O-CB 3.19Å
129	Q	91.2	Very high	91.4	Very high	54 Å²	54	37.1 Å²	37.1	25%	0.252	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	140.4	175.7	-164.6	-175.3	7.9	0	0	109.9	V74 A127 S131	V74-Q129 HydrophobicContact CB-CB 4.17Å; V74-Q129 HydrophobicContact CG1-CB 4.2Å; V74-Q129 PolarHBondContact O-N 3.37Å; A127-Q129 PolarHBondContact O-N 3Å; Q129-S131 PolarHBondContact O-N 2.97Å; Q129-S131 VanDerWaalsContact O-N 3.1Å
130	E	86.5	Confident	91.1	Very high	105 Å²	105	37.9 Å²	37.9	49%	0.491	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.4	7.7	-175.5	-52.5	-58.4	133.9	0	0	114.9	P67 Q213	P67-E130 HydrophobicContact CG-CB 4.05Å; P67-E130 HydrophobicContact CG-CG 3.76Å; E130-Q213 PolarHBondContact O-NE2 3Å
131	S	91.5	Very high	90.8	Very high	19 Å²	19	39.8 Å²	39.8	13%	0.133	21%	0.209	C	C	.	.	S	Bend	trans	-83.4	157	172	74.3	0	0	0	0	111.5	L128 Q129 E133 S134 Q213	L128-S131 VanDerWaalsContact O-CB 3.26Å; L128-S131 WeakPolarHBondContact O-CB 3.32Å; L128-S131 PolarHBondContact O-N 2.87Å; L128-S131 VanDerWaalsContact O-N 3.13Å; L128-S131 PolarHBondContact O-OG 2.84Å; Q129-S131 PolarHBondContact O-N 2.97Å; Q129-S131 VanDerWaalsContact O-N 3.1Å; S131-E133 PolarHBondContact O-N 3.03Å; S131-E133 PolarHBondContact OG-N 2.8Å; S131-S134 WeakPolarHBondContact O-CB 3.34Å; S131-S134 PolarHBondContact O-N 3.36Å; S131-S134 PolarHBondContact O-OG 2.92Å; S131-S134 PolarHBondContact OG-N 2.97Å; S131-Q213 PolarHBondContact O-NE2 3.28Å
132	P	89.8	Confident	90.5	Very high	36 Å²	36	41 Å²	41	23%	0.234	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-54.6	-35.9	171	-26.5	35.9	0	0	0	112.7	S134 E135 W137 Y138 L212	P132-S134 PolarHBondContact O-N 2.95Å; P132-S134 VanDerWaalsContact O-N 3.14Å; P132-E135 VanDerWaalsContact O-CB 3.32Å; P132-E135 WeakPolarHBondContact O-CB 3.44Å; P132-E135 PolarHBondContact O-N 3.16Å; P132-W137 HydrophobicContact CB-CH2 4.39Å; P132-Y138 HydrophobicContact CB-CD2 3.73Å; P132-Y138 HydrophobicContact CB-CE2 3.9Å; P132-Y138 HydrophobicContact CB-CG 4.03Å; P132-Y138 WeakPolarHBondContact O-CB 3.19Å; P132-Y138 VanDerWaalsContact O-CG 3.3Å; P132-L212 HydrophobicContact CB-CD1 4.09Å; P132-L212 HydrophobicContact CG-CD1 3.86Å
133	E	90.1	Very high	90.2	Very high	65 Å²	65	42.1 Å²	42.1	30%	0.304	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-56.8	-31	177	-69.8	-177.6	-162.6	0	0	113	R123 A127 S131 E135 Y138 K236	R123-E133 IonicContact CZ-OE2 2.87Å; R123-E133 IonicContact NH1-OE2 3.44Å; R123-E133 PolarHBondContact NH1-OE2 3.11Å; R123-E133 IonicContact NH2-OE1 3.62Å; R123-E133 PolarHBondContact NH2-OE1 3.45Å; R123-E133 IonicContact NH2-OE2 3.52Å; R123-E133 PolarHBondContact NH2-OE2 3.44Å; A127-E133 HydrophobicContact CB-CB 3.63Å; S131-E133 PolarHBondContact O-N 3.03Å; S131-E133 PolarHBondContact OG-N 2.8Å; E133-E135 PolarHBondContact O-N 2.75Å; E133-Y138 HydrophobicContact CB-CD1 4.45Å; E133-Y138 HydrophobicContact CG-CD1 4.19Å; E133-Y138 HydrophobicContact CG-CE1 3.8Å; E133-K236 PolarHBondContact O-NZ 2.75Å
134	S	90.7	Very high	90.1	Very high	25 Å²	25	46.5 Å²	46.5	18%	0.175	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-71.9	-15.3	178.5	69.8	0	0	0	0	114.4	L128 S131 P132	L128-S134 WeakPolarHBondContact O-CB 3.19Å; S131-S134 WeakPolarHBondContact O-CB 3.34Å; S131-S134 PolarHBondContact O-N 3.36Å; S131-S134 PolarHBondContact O-OG 2.92Å; S131-S134 PolarHBondContact OG-N 2.97Å; P132-S134 PolarHBondContact O-N 2.95Å; P132-S134 VanDerWaalsContact O-N 3.14Å
135	E	92.5	Very high	89.8	Confident	47 Å²	47	44.9 Å²	44.9	22%	0.22	23%	0.228	C	C	.	.	S	Bend	trans	-91.4	137.4	-172.8	-62.8	-74.7	152.7	0	0	111.8	P132 E133 W137 Y138 Q213 K236	P132-E135 VanDerWaalsContact O-CB 3.32Å; P132-E135 WeakPolarHBondContact O-CB 3.44Å; P132-E135 PolarHBondContact O-N 3.16Å; E133-E135 PolarHBondContact O-N 2.75Å; E135-W137 HydrophobicContact CB-CD2 3.87Å; E135-W137 HydrophobicContact CB-CE3 4.41Å; E135-W137 HydrophobicContact CB-CG 4.31Å; E135-W137 HydrophobicContact CB-CH2 4.11Å; E135-W137 HydrophobicContact CB-CZ2 3.56Å; E135-W137 HydrophobicContact CG-CH2 4.1Å; E135-W137 HydrophobicContact CG-CZ2 3.44Å; E135-W137 VanDerWaalsContact CG-CZ2 3.44Å; E135-W137 PolarHBondContact O-N 3.22Å; E135-W137 PolarHBondContact OE2-NE1 2.62Å; E135-Y138 WeakPolarHBondContact O-CB 3.41Å; E135-Y138 PolarHBondContact O-N 3.47Å; E135-Y138 VanDerWaalsContact O-N 3.11Å; E135-Q213 HydrophobicContact CG-CG 3.89Å; E135-Q213 WeakPolarHBondContact OE1-CG 3.35Å; E135-K236 WeakPolarHBondContact O-CE 3.02Å; E135-K236 PolarHBondContact O-NZ 3.33Å
136	E	90.3	Very high	89.5	Confident	107 Å²	107	45.4 Å²	45.4	50%	0.5	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-28.7	-177.2	-67.1	-166.8	153.2	0	0	113.1	K93 Y138 P233 K236	K93-E136 IonicContact NZ-OE1 2.71Å; K93-E136 PolarHBondContact NZ-OE1 3.45Å; E136-Y138 VanDerWaalsContact C-N 3.3Å; E136-Y138 PolarHBondContact O-N 3Å; E136-P233 HydrophobicContact CB-CB 3.99Å; E136-P233 HydrophobicContact CB-CG 4.06Å; E136-K236 VanDerWaalsContact C-CE 3.46Å; E136-K236 WeakPolarHBondContact O-CE 3.31Å; E136-K236 WeakPolarHBondContact O-CG 3.46Å
137	W	93.7	Very high	89.3	Confident	10 Å²	10	45.4 Å²	45.4	4%	0.038	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-8	179.4	49.5	-100.2	0	0	0	113.8	P132 E135 A139 F161 L162 I163 L212 Q213 V216 P233	P132-W137 HydrophobicContact CB-CH2 4.39Å; E135-W137 HydrophobicContact CB-CD2 3.87Å; E135-W137 HydrophobicContact CB-CE3 4.41Å; E135-W137 HydrophobicContact CB-CG 4.31Å; E135-W137 HydrophobicContact CB-CH2 4.11Å; E135-W137 HydrophobicContact CB-CZ2 3.56Å; E135-W137 HydrophobicContact CG-CH2 4.1Å; E135-W137 HydrophobicContact CG-CZ2 3.44Å; E135-W137 VanDerWaalsContact CG-CZ2 3.44Å; E135-W137 PolarHBondContact O-N 3.22Å; E135-W137 PolarHBondContact OE2-NE1 2.62Å; W137-A139 PolarHBondContact O-N 3.14Å; W137-F161 HydrophobicContact CB-CD2 4.08Å; W137-F161 HydrophobicContact CB-CE2 3.39Å; W137-F161 HydrophobicContact CB-CZ 3.8Å; W137-F161 HydrophobicContact CD2-CE2 4.39Å; W137-F161 AromaticContact CG-CE2 3.68Å; W137-F161 HydrophobicContact CG-CE2 3.68Å; W137-F161 HydrophobicContact CG-CZ 4.04Å; W137-L162 CarbonylContact O-C 3.4Å; W137-L162 VanDerWaalsContact O-CA 3.32Å; W137-L162 WeakPolarHBondContact O-CA 3.49Å; W137-I163 HydrophobicContact CD2-CD1 4.39Å; W137-I163 HydrophobicContact CE3-CB 3.63Å; W137-I163 HydrophobicContact CE3-CD1 3.65Å; W137-I163 HydrophobicContact CE3-CG1 3.76Å; W137-I163 HydrophobicContact CH2-CD1 4.25Å; W137-I163 HydrophobicContact CZ3-CB 3.73Å; W137-I163 HydrophobicContact CZ3-CD1 3.58Å; W137-I163 HydrophobicContact CZ3-CG1 4.02Å; W137-I163 HydrophobicContact CZ3-CG2 4.2Å; W137-I163 PolarHBondContact O-N 3.45Å; W137-L212 HydrophobicContact CH2-CB 3.49Å; W137-L212 VanDerWaalsContact CH2-CB 3.49Å; W137-L212 HydrophobicContact CH2-CD1 4.23Å; W137-L212 HydrophobicContact CZ2-CB 4.27Å; W137-L212 HydrophobicContact CZ3-CB 4.26Å; W137-L212 HydrophobicContact CZ3-CD1 4.33Å; W137-Q213 HydrophobicContact CZ2-CG 4.23Å; W137-V216 HydrophobicContact CD2-CG2 3.98Å; W137-V216 HydrophobicContact CE3-CG2 4.4Å; W137-V216 HydrophobicContact CG-CG2 4.48Å; W137-V216 HydrophobicContact CH2-CG2 4.39Å; W137-V216 HydrophobicContact CZ2-CB 4.48Å; W137-V216 HydrophobicContact CZ2-CG2 3.92Å; W137-P233 HydrophobicContact CB-CB 3.93Å; W137-P233 HydrophobicContact CB-CG 4.13Å
138	Y	93.6	Very high	89.1	Confident	18 Å²	18	47.4 Å²	47.4	7%	0.071	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	111.5	-178.1	-174.3	-106.5	0	0	0	112.1	P132 E133 E135 E136 E165 F173 K236	P132-Y138 HydrophobicContact CB-CD2 3.73Å; P132-Y138 HydrophobicContact CB-CE2 3.9Å; P132-Y138 HydrophobicContact CB-CG 4.03Å; P132-Y138 WeakPolarHBondContact O-CB 3.19Å; P132-Y138 VanDerWaalsContact O-CG 3.3Å; E133-Y138 HydrophobicContact CB-CD1 4.45Å; E133-Y138 HydrophobicContact CG-CD1 4.19Å; E133-Y138 HydrophobicContact CG-CE1 3.8Å; E135-Y138 WeakPolarHBondContact O-CB 3.41Å; E135-Y138 PolarHBondContact O-N 3.47Å; E135-Y138 VanDerWaalsContact O-N 3.11Å; E136-Y138 VanDerWaalsContact C-N 3.3Å; E136-Y138 PolarHBondContact O-N 3Å; Y138-E165 WeakPolarHBondContact OH-CG 3.19Å; Y138-E165 PolarHBondContact OH-OE1 2.61Å; Y138-F173 HydrophobicContact CE2-CD1 4.09Å; Y138-F173 AromaticContact CE2-CE1 3.77Å; Y138-F173 HydrophobicContact CE2-CE1 3.77Å; Y138-K236 WeakPolarHBondContact O-CE 3.46Å; Y138-K236 PolarHBondContact O-NZ 3.29Å
139	A	90.3	Very high	88.6	Confident	31 Å²	31	46.7 Å²	46.7	26%	0.256	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	-2.2	-177	0	0	0	0	0	114.1	W137 I142 L162 I163 R164	W137-A139 PolarHBondContact O-N 3.14Å; A139-I142 HydrophobicContact CB-CD1 3.58Å; A139-I142 HydrophobicContact CB-CG1 3.84Å; A139-I142 WeakPolarHBondContact O-CG2 3.34Å; A139-L162 HydrophobicContact CB-CB 4.25Å; A139-L162 HydrophobicContact CB-CD1 3.9Å; A139-L162 HydrophobicContact CB-CD2 4.28Å; A139-L162 HydrophobicContact CB-CG 4.38Å; A139-I163 PolarHBondContact N-O 2.8Å; A139-R164 HydrophobicContact CB-CB 4.47Å
140	G	89.3	Confident	88.4	Confident	17 Å²	17	44.8 Å²	44.8	18%	0.175	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	69.4	-153.4	-175	0	0	0	0	0	112.9	I142 R164 E165	G140-I142 PolarHBondContact O-N 3.43Å; G140-I142 VanDerWaalsContact O-N 3.16Å; G140-R164 CarbonylContact O-C 3.58Å; G140-R164 WeakPolarHBondContact O-CA 3.39Å; G140-R164 VanDerWaalsContact O-CB 3.31Å; G140-R164 WeakPolarHBondContact O-CB 3.22Å; G140-E165 PolarHBondContact O-N 3.24Å
141	D	85.8	Confident	88.7	Confident	94 Å²	94	39.8 Å²	39.8	50%	0.503	21%	0.207	S	C	.	.	S	Bend	trans	-84.9	79.4	176.2	-175.6	22.6	0	0	0	110.9	E165 Q167	D141-E165 HydrophobicContact CB-CB 4.23Å; D141-Q167 WeakPolarHBondContact OD1-CG 2.91Å
142	I	85.7	Confident	88.5	Confident	27 Å²	27	41.7 Å²	41.7	14%	0.138	22%	0.215	C	C	.	.			trans	-104.7	145.3	171.1	59.6	163	0	0	0	111.6	A139 G140 L146 A147 L150 L162 R164	A139-I142 HydrophobicContact CB-CD1 3.58Å; A139-I142 HydrophobicContact CB-CG1 3.84Å; A139-I142 WeakPolarHBondContact O-CG2 3.34Å; G140-I142 PolarHBondContact O-N 3.43Å; G140-I142 VanDerWaalsContact O-N 3.16Å; I142-L146 HydrophobicContact CB-CD2 4.17Å; I142-L146 HydrophobicContact CG2-CD2 4.14Å; I142-A147 HydrophobicContact CD1-CB 3.8Å; I142-A147 HydrophobicContact CG1-CB 4.43Å; I142-L150 HydrophobicContact CD1-CD1 3.86Å; I142-L162 HydrophobicContact CD1-CD1 4.18Å; I142-L162 HydrophobicContact CD1-CD2 4.15Å; I142-R164 HydrophobicContact CG1-CB 3.81Å; I142-R164 WeakPolarHBondContact O-CD 3.41Å
143	P	84.6	Confident	88.2	Confident	28 Å²	28	41 Å²	41	18%	0.182	21%	0.208	C	C	.	.			trans	-56.2	151.6	171.1	-27.8	36	0	0	0	113.2	N145 L146 A147	P143-N145 WeakPolarHBondContact CB-OD1 3.17Å; P143-N145 PolarHBondContact O-N 2.89Å; P143-L146 HydrophobicContact CB-CB 4.38Å; P143-L146 PolarHBondContact O-N 3.02Å; P143-A147 PolarHBondContact O-N 2.75Å
144	R	87.3	Confident	87.8	Confident	145 Å²	145	43 Å²	43	55%	0.547	23%	0.228	S	C	.	.	H	α-helix	trans	-59.4	-44.6	-179.1	-178.6	178.1	176.9	177.5	-7.1	112.4	A147 V148 H190	R144-A147 WeakPolarHBondContact O-CB 3.38Å; R144-A147 PolarHBondContact O-N 3.23Å; R144-V148 WeakPolarHBondContact O-CG2 3.31Å; R144-V148 PolarHBondContact O-N 2.88Å; R144-H190 PolarHBondContact NE-CD2 3.1Å; R144-H190 PolarHBondContact NE-NE2 2.99Å; R144-H190 VanDerWaalsContact NE-NE2 3.16Å; R144-H190 PolarHBondContact NH2-CD2 3.35Å
145	N	82.4	Confident	87.5	Confident	30 Å²	30	48.5 Å²	48.5	16%	0.16	26%	0.255	C	S	.	.	H	α-helix	trans	-65.3	-39.8	-179.9	51.5	4.3	0	0	0	111.9	P143 A147 V148 K149 D515 D516	P143-N145 WeakPolarHBondContact CB-OD1 3.17Å; P143-N145 PolarHBondContact O-N 2.89Å; N145-A147 VanDerWaalsContact C-N 3.33Å; N145-A147 PolarHBondContact O-N 3.39Å; N145-V148 WeakPolarHBondContact O-CB 3.49Å; N145-V148 PolarHBondContact O-N 3.36Å; N145-K149 VanDerWaalsContact O-CG 3.28Å; N145-K149 WeakPolarHBondContact O-CG 3.47Å; N145-K149 PolarHBondContact O-N 3.43Å; N145-D515 PolarHBondContact ND2-OD1 2.87Å; N145-D515 PolarHBondContact ND2-OD2 2.81Å; N145-D516 PolarHBondContact ND2-OD1 3.17Å
146	L	83.5	Confident	87.4	Confident	33 Å²	33	47.1 Å²	47.1	17%	0.173	25%	0.249	C	C	.	.	H	α-helix	trans	-60.8	-43.5	170.6	-179	56.8	0	0	0	111.1	I142 P143 V148 K149 L150	I142-L146 HydrophobicContact CB-CD2 4.17Å; I142-L146 HydrophobicContact CG2-CD2 4.14Å; P143-L146 HydrophobicContact CB-CB 4.38Å; P143-L146 PolarHBondContact O-N 3.02Å; L146-V148 PolarHBondContact O-N 3.03Å; L146-K149 WeakPolarHBondContact O-CB 3.39Å; L146-K149 PolarHBondContact O-N 2.68Å; L146-L150 HydrophobicContact CD1-CD1 4.45Å; L146-L150 HydrophobicContact CD1-CG 4.22Å; L146-L150 HydrophobicContact CG-CD1 4.22Å; L146-L150 HydrophobicContact CG-CG 4.46Å; L146-L150 VanDerWaalsContact O-CG 3.28Å; L146-L150 WeakPolarHBondContact O-CG 3.22Å; L146-L150 PolarHBondContact O-N 2.85Å
147	A	89.1	Confident	87.5	Confident	0 Å²	0	45 Å²	45	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-59.7	-43.6	175.4	0	0	0	0	0	112.9	I142 P143 R144 N145 L150 V151 L162 T176	I142-A147 HydrophobicContact CD1-CB 3.8Å; I142-A147 HydrophobicContact CG1-CB 4.43Å; P143-A147 PolarHBondContact O-N 2.75Å; R144-A147 WeakPolarHBondContact O-CB 3.38Å; R144-A147 PolarHBondContact O-N 3.23Å; N145-A147 VanDerWaalsContact C-N 3.33Å; N145-A147 PolarHBondContact O-N 3.39Å; A147-L150 PolarHBondContact O-N 2.94Å; A147-V151 PolarHBondContact O-N 3.32Å; A147-V151 VanDerWaalsContact O-N 3.15Å; A147-L162 HydrophobicContact CB-CD1 3.84Å; A147-L162 HydrophobicContact CB-CD2 4.27Å; A147-T176 HydrophobicContact CB-CG2 4.2Å
148	V	89.2	Confident	87.5	Confident	43 Å²	43	48.9 Å²	48.9	26%	0.261	26%	0.263	S	S	.	.	H	α-helix	trans	-58.1	-50.3	173.7	171.1	0	0	0	0	110.3	R144 N145 L146 L150 V151 M152 V188 H190	R144-V148 WeakPolarHBondContact O-CG2 3.31Å; R144-V148 PolarHBondContact O-N 2.88Å; N145-V148 WeakPolarHBondContact O-CB 3.49Å; N145-V148 PolarHBondContact O-N 3.36Å; L146-V148 PolarHBondContact O-N 3.03Å; V148-L150 VanDerWaalsContact C-N 3.31Å; V148-L150 PolarHBondContact O-N 3.06Å; V148-V151 WeakPolarHBondContact O-CG2 3.39Å; V148-V151 PolarHBondContact O-N 2.87Å; V148-M152 HydrophobicContact CG1-CG 4.14Å; V148-M152 WeakPolarHBondContact O-CB 3.34Å; V148-M152 WeakPolarHBondContact O-CG 3.46Å; V148-M152 PolarHBondContact O-N 3.5Å; V148-V188 HydrophobicContact CG1-CB 4.47Å; V148-V188 HydrophobicContact CG1-CG2 4Å; V148-V188 HydrophobicContact CG2-CB 4.5Å; V148-V188 HydrophobicContact CG2-CG1 4.14Å; V148-H190 VanDerWaalsContact CG2-CE1 3.43Å; V148-H190 WeakPolarHBondContact CG2-CE1 3.41Å; V148-H190 WeakPolarHBondContact CG2-NE2 3.38Å
149	K	83.7	Confident	87.6	Confident	46 Å²	46	48 Å²	48	20%	0.2	26%	0.26	C	S	.	.	H	α-helix	trans	-56.6	-43.9	179.9	-72.9	169.4	-176.1	177.3	0	111.8	N145 L146 M152 D359 I395 D515	N145-K149 VanDerWaalsContact O-CG 3.28Å; N145-K149 WeakPolarHBondContact O-CG 3.47Å; N145-K149 PolarHBondContact O-N 3.43Å; L146-K149 WeakPolarHBondContact O-CB 3.39Å; L146-K149 PolarHBondContact O-N 2.68Å; K149-M152 PolarHBondContact O-N 2.79Å; K149-D359 VanDerWaalsContact CD-OD2 3.31Å; K149-D359 WeakPolarHBondContact CD-OD2 3.4Å; K149-D359 VanDerWaalsContact CE-OD2 3.3Å; K149-D359 WeakPolarHBondContact CE-OD2 3.43Å; K149-D359 IonicContact NZ-OD2 2.64Å; K149-D359 PolarHBondContact NZ-OD2 2.9Å; K149-I395 HydrophobicContact CB-CD1 3.75Å; K149-I395 HydrophobicContact CD-CD1 4.38Å; K149-I395 HydrophobicContact CG-CD1 4.27Å; K149-D515 IonicContact NZ-OD1 3.62Å; K149-D515 PolarHBondContact NZ-OD1 3.37Å
150	L	87.8	Confident	87.9	Confident	15 Å²	15	46.6 Å²	46.6	8%	0.079	25%	0.248	C	C	.	.	H	α-helix	trans	-64.1	-50	-179.8	-69.7	173.4	0	0	0	112.6	I142 L146 A147 V148 M152 L156 L162 I392 A393	I142-L150 HydrophobicContact CD1-CD1 3.86Å; L146-L150 HydrophobicContact CD1-CD1 4.45Å; L146-L150 HydrophobicContact CD1-CG 4.22Å; L146-L150 HydrophobicContact CG-CD1 4.22Å; L146-L150 HydrophobicContact CG-CG 4.46Å; L146-L150 VanDerWaalsContact O-CG 3.28Å; L146-L150 WeakPolarHBondContact O-CG 3.22Å; L146-L150 PolarHBondContact O-N 2.85Å; A147-L150 PolarHBondContact O-N 2.94Å; V148-L150 VanDerWaalsContact C-N 3.31Å; V148-L150 PolarHBondContact O-N 3.06Å; L150-M152 PolarHBondContact O-N 3.42Å; L150-L156 WeakPolarHBondContact O-CD1 3.38Å; L150-L162 HydrophobicContact CB-CD2 4.18Å; L150-L162 HydrophobicContact CD1-CD2 4.14Å; L150-I392 HydrophobicContact CD2-CG2 3.67Å; L150-A393 HydrophobicContact CD2-CB 3.83Å
151	V	91	Very high	88.3	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-73.3	-17.2	179.7	-55.5	0	0	0	0	112.5	A147 V148 N153 L162 T176 R178 V188 C234	A147-V151 PolarHBondContact O-N 3.32Å; A147-V151 VanDerWaalsContact O-N 3.15Å; V148-V151 WeakPolarHBondContact O-CG2 3.39Å; V148-V151 PolarHBondContact O-N 2.87Å; V151-N153 VanDerWaalsContact C-N 3.32Å; V151-N153 PolarHBondContact O-N 3.21Å; V151-L162 HydrophobicContact CG1-CD2 3.91Å; V151-L162 HydrophobicContact CG1-CG 4.05Å; V151-T176 HydrophobicContact CG1-CG2 4.29Å; V151-T176 HydrophobicContact CG2-CG2 3.94Å; V151-R178 HydrophobicContact CB-CB 4.21Å; V151-R178 HydrophobicContact CG2-CB 4.47Å; V151-R178 VanDerWaalsContact O-CD 3.22Å; V151-R178 WeakPolarHBondContact O-CD 3.13Å; V151-R178 WeakPolarHBondContact O-CG 3.48Å; V151-R178 PolarHBondContact O-NH1 2.74Å; V151-V188 HydrophobicContact CG2-CB 4.49Å; V151-V188 HydrophobicContact CG2-CG1 3.84Å; V151-V188 HydrophobicContact CG2-CG2 3.76Å; V151-C234 HydrophobicContact CG1-CB 4.23Å
152	M	88.2	Confident	88.8	Confident	59 Å²	59	41.7 Å²	41.7	29%	0.291	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-0.3	-179.1	-76.4	-65	-80.7	0	0	115.2	V148 K149 L150 P154 R178 P186 V188	V148-M152 HydrophobicContact CG1-CG 4.14Å; V148-M152 WeakPolarHBondContact O-CB 3.34Å; V148-M152 WeakPolarHBondContact O-CG 3.46Å; V148-M152 PolarHBondContact O-N 3.5Å; K149-M152 PolarHBondContact O-N 2.79Å; L150-M152 PolarHBondContact O-N 3.42Å; M152-P154 WeakPolarHBondContact O-CD 3.31Å; M152-P154 VanDerWaalsContact O-N 3.17Å; M152-R178 PolarHBondContact O-NH1 3.22Å; M152-P186 HydrophobicContact CE-CB 3.66Å; M152-P186 HydrophobicContact SD-CB 4.2Å; M152-V188 HydrophobicContact CE-CG2 4.5Å; M152-V188 HydrophobicContact CG-CG2 3.22Å; M152-V188 HydrophobicContact SD-CG2 3.31Å; M152-V188 WeakPolarHBondContact SD-CG2 3.18Å
153	N	83.6	Confident	89.3	Confident	20 Å²	20	40.4 Å²	40.4	11%	0.107	21%	0.211	C	C	.	.			trans	-50.8	123.3	174	179.7	-2.2	0	0	0	111.1	V151 D155 L156 R178 A393	V151-N153 VanDerWaalsContact C-N 3.32Å; V151-N153 PolarHBondContact O-N 3.21Å; N153-D155 PolarHBondContact O-N 2.64Å; N153-D155 VanDerWaalsContact O-N 3.12Å; N153-D155 PolarHBondContact OD1-N 3.03Å; N153-D155 VanDerWaalsContact OD1-N 3.12Å; N153-L156 HydrophobicContact CB-CD1 3.7Å; N153-L156 HydrophobicContact CB-CG 3.89Å; N153-L156 WeakPolarHBondContact O-CB 3.29Å; N153-L156 PolarHBondContact O-N 2.89Å; N153-R178 PolarHBondContact O-NH1 2.8Å; N153-R178 PolarHBondContact O-NH2 3.48Å; N153-A393 HydrophobicContact CB-CB 3.96Å; N153-A393 WeakPolarHBondContact CB-O 3.2Å; N153-A393 VanDerWaalsContact ND2-C 3.32Å; N153-A393 VanDerWaalsContact ND2-CA 3.31Å; N153-A393 WeakPolarHBondContact ND2-CA 3.47Å
154	P	81.7	Confident	89.8	Confident	109 Å²	109	39.9 Å²	39.9	71%	0.708	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-30.6	-179.8	-29.4	36.1	0	0	0	114.9	M152 L156	M152-P154 WeakPolarHBondContact O-CD 3.31Å; M152-P154 VanDerWaalsContact O-N 3.17Å; P154-L156 PolarHBondContact O-N 2.91Å
155	D	84.8	Confident	90	Very high	140 Å²	140	36.4 Å²	36.4	75%	0.749	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-6.3	-179	-58.9	-33.7	0	0	0	113.2	N153	N153-D155 PolarHBondContact O-N 2.64Å; N153-D155 VanDerWaalsContact O-N 3.12Å; N153-D155 PolarHBondContact OD1-N 3.03Å; N153-D155 VanDerWaalsContact OD1-N 3.12Å
156	L	89.1	Confident	90.3	Very high	18 Å²	18	37.5 Å²	37.5	9%	0.094	20%	0.197	C	C	.	.	S	Bend	trans	-93.6	137.5	-179	-60.6	175.7	0	0	0	111.9	L150 N153 P154 T160 R178 P235	L150-L156 WeakPolarHBondContact O-CD1 3.38Å; N153-L156 HydrophobicContact CB-CD1 3.7Å; N153-L156 HydrophobicContact CB-CG 3.89Å; N153-L156 WeakPolarHBondContact O-CB 3.29Å; N153-L156 PolarHBondContact O-N 2.89Å; P154-L156 PolarHBondContact O-N 2.91Å; L156-T160 HydrophobicContact CB-CG2 4.31Å; L156-T160 HydrophobicContact CD1-CG2 3.92Å; L156-T160 HydrophobicContact CD2-CG2 4.38Å; L156-T160 HydrophobicContact CG-CG2 4.43Å; L156-R178 WeakPolarHBondContact O-CD 3.41Å; L156-R178 PolarHBondContact O-NE 3.26Å; L156-R178 PolarHBondContact O-NH2 2.64Å; L156-P235 HydrophobicContact CD2-CG 4.37Å
157	P	92.3	Very high	90.2	Very high	63 Å²	63	41.1 Å²	41.1	41%	0.409	21%	0.213	S	C	.	.	P	Polyproline II helix	trans	-76.3	159.9	175.1	33.1	-36.2	0	0	0	112.3	T160 R178 Q232	P157-T160 WeakPolarHBondContact CD-OG1 3.37Å; P157-T160 WeakPolarHBondContact O-CB 3.49Å; P157-T160 PolarHBondContact O-N 3.42Å; P157-T160 PolarHBondContact O-OG1 3.38Å; P157-R178 WeakPolarHBondContact O-CD 3.41Å; P157-Q232 HydrophobicContact CG-CG 4.34Å
158	Q	94.6	Very high	89.7	Confident	91 Å²	91	48.1 Å²	48.1	43%	0.425	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	144.4	169.6	-172.2	-178.1	15.6	0	0	111	T160 D179 C228 T231	Q158-T160 VanDerWaalsContact C-N 3.27Å; Q158-T160 PolarHBondContact O-N 3.04Å; Q158-D179 PolarHBondContact NE2-OD1 3.41Å; Q158-C228 HydrophobicContact CG-CB 4.46Å; Q158-T231 WeakPolarHBondContact O-CG2 3.48Å; Q158-T231 PolarHBondContact O-OG1 3.12Å
159	G	96.1	Very high	89.4	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.7	-2.1	-176.6	0	0	0	0	0	114.1	F161 R178 K229 T231	G159-F161 WeakPolarHBondContact O-CD1 3.08Å; G159-F161 PolarHBondContact O-N 2.79Å; G159-R178 PolarHBondContact N-O 3.4Å; G159-K229 WeakPolarHBondContact CA-O 3.48Å; G159-T231 WeakPolarHBondContact CA-OG1 3.49Å; G159-T231 PolarHBondContact O-N 3.18Å; G159-T231 PolarHBondContact O-OG1 3.42Å
160	T	96.6	Very high	89.1	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	131.4	171.5	-60.2	0	0	0	0	109.4	L156 P157 Q158 R178 T231 Q232 C234	L156-T160 HydrophobicContact CB-CG2 4.31Å; L156-T160 HydrophobicContact CD1-CG2 3.92Å; L156-T160 HydrophobicContact CD2-CG2 4.38Å; L156-T160 HydrophobicContact CG-CG2 4.43Å; P157-T160 WeakPolarHBondContact CD-OG1 3.37Å; P157-T160 WeakPolarHBondContact O-CB 3.49Å; P157-T160 PolarHBondContact O-N 3.42Å; P157-T160 PolarHBondContact O-OG1 3.38Å; Q158-T160 VanDerWaalsContact C-N 3.27Å; Q158-T160 PolarHBondContact O-N 3.04Å; T160-R178 PolarHBondContact O-N 3.15Å; T160-T231 PolarHBondContact N-OG1 2.82Å; T160-Q232 VanDerWaalsContact CA-O 3.29Å; T160-Q232 WeakPolarHBondContact CA-O 3.1Å; T160-Q232 HydrophobicContact CG2-CG 4.2Å; T160-Q232 WeakPolarHBondContact OG1-CG 3.48Å; T160-Q232 PolarHBondContact OG1-NE2 3Å; T160-C234 HydrophobicContact CG2-CB 4.08Å
161	F	97	Very high	88.7	Confident	4 Å²	4	52.6 Å²	52.6	2%	0.018	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	160.7	-167.8	73.7	-79.2	0	0	0	113.9	W137 G159 L175 T176 I177 V216 L230 Q232 P233 C234	W137-F161 HydrophobicContact CB-CD2 4.08Å; W137-F161 HydrophobicContact CB-CE2 3.39Å; W137-F161 HydrophobicContact CB-CZ 3.8Å; W137-F161 HydrophobicContact CD2-CE2 4.39Å; W137-F161 AromaticContact CG-CE2 3.68Å; W137-F161 HydrophobicContact CG-CE2 3.68Å; W137-F161 HydrophobicContact CG-CZ 4.04Å; G159-F161 WeakPolarHBondContact O-CD1 3.08Å; G159-F161 PolarHBondContact O-N 2.79Å; F161-L175 HydrophobicContact CB-CD1 4.05Å; F161-L175 HydrophobicContact CD2-CD1 3.7Å; F161-L175 HydrophobicContact CG-CD1 4.26Å; F161-T176 CarbonylContact C-O 3.53Å; F161-T176 WeakPolarHBondContact CA-O 2.95Å; F161-T176 WeakPolarHBondContact CB-O 3Å; F161-I177 HydrophobicContact CB-CB 4.5Å; F161-I177 HydrophobicContact CB-CG1 4.14Å; F161-I177 HydrophobicContact CB-CG2 4.43Å; F161-V216 HydrophobicContact CE2-CG1 3.82Å; F161-V216 HydrophobicContact CE2-CG2 4.08Å; F161-V216 HydrophobicContact CZ-CG1 3.59Å; F161-L230 HydrophobicContact CB-CD2 3.88Å; F161-L230 HydrophobicContact CD1-CB 3.72Å; F161-L230 HydrophobicContact CD1-CD2 4.04Å; F161-L230 HydrophobicContact CD1-CG 4.29Å; F161-L230 HydrophobicContact CD2-CD1 4.07Å; F161-L230 HydrophobicContact CD2-CD2 4.16Å; F161-L230 HydrophobicContact CE1-CB 3.68Å; F161-L230 HydrophobicContact CE1-CD1 4.44Å; F161-L230 HydrophobicContact CE1-CG 4.47Å; F161-L230 HydrophobicContact CE2-CD1 3.95Å; F161-L230 HydrophobicContact CG-CB 4.27Å; F161-L230 HydrophobicContact CG-CD1 4.37Å; F161-L230 HydrophobicContact CG-CD2 3.76Å; F161-L230 HydrophobicContact CG-CG 4.34Å; F161-L230 HydrophobicContact CZ-CB 4.17Å; F161-L230 HydrophobicContact CZ-CD1 4.15Å; F161-Q232 WeakPolarHBondContact CD1-O 3.4Å; F161-Q232 VanDerWaalsContact CE1-C 3.41Å; F161-Q232 WeakPolarHBondContact CE1-O 3.43Å; F161-Q232 PolarHBondContact N-O 2.78Å; F161-P233 CarbonylContact O-C 3.46Å; F161-P233 WeakPolarHBondContact O-CA 3.36Å; F161-C234 WeakPolarHBondContact O-CB 3.26Å; F161-C234 PolarHBondContact O-N 2.82Å
162	L	96.3	Very high	88.7	Confident	4 Å²	4	54.3 Å²	54.3	2%	0.021	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	156.5	166.3	63.8	80.3	0	0	0	110.6	W137 A139 I142 A147 L150 V151 R164 T176 C234	W137-L162 CarbonylContact O-C 3.4Å; W137-L162 VanDerWaalsContact O-CA 3.32Å; W137-L162 WeakPolarHBondContact O-CA 3.49Å; A139-L162 HydrophobicContact CB-CB 4.25Å; A139-L162 HydrophobicContact CB-CD1 3.9Å; A139-L162 HydrophobicContact CB-CD2 4.28Å; A139-L162 HydrophobicContact CB-CG 4.38Å; I142-L162 HydrophobicContact CD1-CD1 4.18Å; I142-L162 HydrophobicContact CD1-CD2 4.15Å; A147-L162 HydrophobicContact CB-CD1 3.84Å; A147-L162 HydrophobicContact CB-CD2 4.27Å; L150-L162 HydrophobicContact CB-CD2 4.18Å; L150-L162 HydrophobicContact CD1-CD2 4.14Å; V151-L162 HydrophobicContact CG1-CD2 3.91Å; V151-L162 HydrophobicContact CG1-CG 4.05Å; L162-R164 HydrophobicContact CD1-CB 4.19Å; L162-R164 HydrophobicContact CD1-CG 4.4Å; L162-T176 PolarHBondContact N-O 3.28Å; L162-T176 PolarHBondContact O-N 3.44Å; L162-C234 HydrophobicContact CB-CB 4.05Å; L162-C234 HydrophobicContact CD2-CB 4.08Å
163	I	96.3	Very high	89	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	131.9	170.2	-61.1	-179.4	0	0	0	108.2	W137 A139 F173 A174 L175 I193 L212 V216	W137-I163 HydrophobicContact CD2-CD1 4.39Å; W137-I163 HydrophobicContact CE3-CB 3.63Å; W137-I163 HydrophobicContact CE3-CD1 3.65Å; W137-I163 HydrophobicContact CE3-CG1 3.76Å; W137-I163 HydrophobicContact CH2-CD1 4.25Å; W137-I163 HydrophobicContact CZ3-CB 3.73Å; W137-I163 HydrophobicContact CZ3-CD1 3.58Å; W137-I163 HydrophobicContact CZ3-CG1 4.02Å; W137-I163 HydrophobicContact CZ3-CG2 4.2Å; W137-I163 PolarHBondContact O-N 3.45Å; A139-I163 PolarHBondContact N-O 2.8Å; I163-F173 HydrophobicContact CG2-CB 3.75Å; I163-F173 HydrophobicContact CG2-CD1 4.14Å; I163-F173 HydrophobicContact CG2-CG 4.23Å; I163-A174 WeakPolarHBondContact CA-O 3.5Å; I163-L175 HydrophobicContact CD1-CD1 4.4Å; I163-L175 HydrophobicContact CG1-CB 4.38Å; I163-L175 HydrophobicContact CG1-CD1 3.83Å; I163-I193 HydrophobicContact CD1-CD1 3.75Å; I163-I193 HydrophobicContact CG1-CD1 4.11Å; I163-I193 HydrophobicContact CG2-CD1 3.99Å; I163-L212 HydrophobicContact CG2-CD1 4.46Å; I163-V216 HydrophobicContact CD1-CG2 3.56Å
164	R	94.5	Very high	89.6	Confident	18 Å²	18	51.6 Å²	51.6	7%	0.068	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	155.5	179.1	63.8	-175	-174.5	77.5	3	110.9	A139 G140 I142 L162 F173 A174	A139-R164 HydrophobicContact CB-CB 4.47Å; G140-R164 CarbonylContact O-C 3.58Å; G140-R164 WeakPolarHBondContact O-CA 3.39Å; G140-R164 VanDerWaalsContact O-CB 3.31Å; G140-R164 WeakPolarHBondContact O-CB 3.22Å; I142-R164 HydrophobicContact CG1-CB 3.81Å; I142-R164 WeakPolarHBondContact O-CD 3.41Å; L162-R164 HydrophobicContact CD1-CB 4.19Å; L162-R164 HydrophobicContact CD1-CG 4.4Å; R164-F173 CarbonylContact O-C 3.59Å; R164-F173 VanDerWaalsContact O-CA 3.24Å; R164-F173 WeakPolarHBondContact O-CA 3.2Å; R164-F173 WeakPolarHBondContact O-CB 3.45Å; R164-A174 HydrophobicContact CG-CB 4.06Å; R164-A174 PolarHBondContact N-O 2.95Å; R164-A174 PolarHBondContact O-N 3.24Å
165	E	92.9	Very high	90.3	Very high	71 Å²	71	46.4 Å²	46.4	33%	0.332	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	153.7	165.3	-72.4	-174	-168	0	0	110.6	Y138 G140 D141 F173	Y138-E165 WeakPolarHBondContact OH-CG 3.19Å; Y138-E165 PolarHBondContact OH-OE1 2.61Å; G140-E165 PolarHBondContact O-N 3.24Å; D141-E165 HydrophobicContact CB-CB 4.23Å; E165-F173 HydrophobicContact CG-CD1 3.84Å; E165-F173 HydrophobicContact CG-CE1 3.49Å; E165-F173 VanDerWaalsContact CG-CE1 3.49Å; E165-F173 HydrophobicContact CG-CZ 4.4Å
166	R	88.2	Confident	90.9	Very high	53 Å²	53	39.7 Å²	39.7	20%	0.2	21%	0.214	C	C	.	.			trans	-97.7	114.4	176.4	-65.2	-174	68.8	-125.3	-16.7	109.5	N168 D169 E172 A174 R192	R166-N168 PolarHBondContact O-N 3.19Å; R166-D169 HydrophobicContact CB-CB 4.2Å; R166-D169 IonicContact CZ-OD2 3.93Å; R166-D169 IonicContact NE-OD2 2.69Å; R166-D169 IonicContact NH1-OD1 3.34Å; R166-D169 PolarHBondContact NH1-OD1 3.25Å; R166-D169 IonicContact NH1-OD2 2.81Å; R166-D169 PolarHBondContact NH1-OD2 3.48Å; R166-D169 IonicContact NH2-OD2 2.97Å; R166-D169 PolarHBondContact NH2-OD2 2.86Å; R166-D169 CarbonylContact O-C 3.51Å; R166-D169 PolarHBondContact O-N 3.16Å; R166-E172 IonicContact CZ-OE2 3.71Å; R166-E172 PolarHBondContact N-O 2.93Å; R166-E172 IonicContact NH1-OE2 2.79Å; R166-E172 PolarHBondContact NH1-OE2 2.74Å; R166-A174 HydrophobicContact CG-CB 3.97Å; R166-R192 VanDerWaalsContact NH1-NE 3.1Å; R166-R192 VanDerWaalsContact NH1-NH2 3.18Å
167	Q	80.6	Confident	91.2	Very high	110 Å²	110	38.9 Å²	38.9	51%	0.514	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.3	-35.1	179.5	-66.4	176.8	-59.5	0	0	115	D141	D141-Q167 WeakPolarHBondContact OD1-CG 2.91Å
168	N	79.8	Confident	91.4	Very high	147 Å²	147	36.9 Å²	36.9	79%	0.786	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.6	-2.6	-176.1	-61.6	-20.1	0	0	0	114.2	R166	R166-N168 PolarHBondContact O-N 3.19Å
169	D	81.7	Confident	91.3	Very high	44 Å²	44	33.5 Å²	33.5	24%	0.235	18%	0.179	C	C	.	.	S	Bend	trans	-139.1	80.4	-176	-61.3	-112.8	0	0	0	109.4	R166 G171 E172 R192	R166-D169 HydrophobicContact CB-CB 4.2Å; R166-D169 IonicContact CZ-OD2 3.93Å; R166-D169 IonicContact NE-OD2 2.69Å; R166-D169 IonicContact NH1-OD1 3.34Å; R166-D169 PolarHBondContact NH1-OD1 3.25Å; R166-D169 IonicContact NH1-OD2 2.81Å; R166-D169 PolarHBondContact NH1-OD2 3.48Å; R166-D169 IonicContact NH2-OD2 2.97Å; R166-D169 PolarHBondContact NH2-OD2 2.86Å; R166-D169 CarbonylContact O-C 3.51Å; R166-D169 PolarHBondContact O-N 3.16Å; D169-G171 PolarHBondContact O-N 2.83Å; D169-E172 HydrophobicContact CB-CB 4.09Å; D169-E172 HydrophobicContact CB-CG 4.2Å; D169-E172 WeakPolarHBondContact O-CB 3.38Å; D169-E172 PolarHBondContact O-N 2.97Å; D169-R192 IonicContact OD1-CZ 3.81Å; D169-R192 IonicContact OD1-NH2 2.91Å; D169-R192 PolarHBondContact OD1-NH2 3.02Å
170	P	77.1	Confident	90.9	Very high	125 Å²	125	41.5 Å²	41.5	81%	0.812	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.3	131.9	-177	-27	34.9	0	0	0	113	E172	P170-E172 VanDerWaalsContact C-N 3.28Å; P170-E172 PolarHBondContact O-N 3.35Å
171	G	80.8	Confident	90.4	Very high	29 Å²	29	43.9 Å²	43.9	30%	0.299	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.4	-1.9	-178.2	0	0	0	0	0	115.1	D169	D169-G171 PolarHBondContact O-N 2.83Å
172	E	89.5	Confident	89.7	Confident	35 Å²	35	53 Å²	53	16%	0.164	26%	0.264	C	S	.	.			trans	-99.7	153.6	166.5	-65.2	-164.9	178.5	0	0	112.5	R166 D169 P170 R192	R166-E172 IonicContact CZ-OE2 3.71Å; R166-E172 PolarHBondContact N-O 2.93Å; R166-E172 IonicContact NH1-OE2 2.79Å; R166-E172 PolarHBondContact NH1-OE2 2.74Å; D169-E172 HydrophobicContact CB-CB 4.09Å; D169-E172 HydrophobicContact CB-CG 4.2Å; D169-E172 WeakPolarHBondContact O-CB 3.38Å; D169-E172 PolarHBondContact O-N 2.97Å; P170-E172 VanDerWaalsContact C-N 3.28Å; P170-E172 PolarHBondContact O-N 3.35Å; E172-R192 IonicContact OE1-CZ 3.57Å; E172-R192 IonicContact OE1-NE 3.54Å; E172-R192 IonicContact OE1-NH2 2.78Å; E172-R192 PolarHBondContact OE1-NH2 3.25Å; E172-R192 IonicContact OE2-CZ 3.03Å; E172-R192 IonicContact OE2-NE 2.65Å; E172-R192 PolarHBondContact OE2-NE 2.71Å; E172-R192 IonicContact OE2-NH2 2.8Å; E172-R192 PolarHBondContact OE2-NH2 3.12Å
173	F	95.4	Very high	89	Confident	17 Å²	17	61.5 Å²	61.5	8%	0.075	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	160.8	-177.8	-56.3	-90.5	0	0	0	111.5	Y138 I163 R164 E165 I193 F201 L212	Y138-F173 HydrophobicContact CE2-CD1 4.09Å; Y138-F173 AromaticContact CE2-CE1 3.77Å; Y138-F173 HydrophobicContact CE2-CE1 3.77Å; I163-F173 HydrophobicContact CG2-CB 3.75Å; I163-F173 HydrophobicContact CG2-CD1 4.14Å; I163-F173 HydrophobicContact CG2-CG 4.23Å; R164-F173 CarbonylContact O-C 3.59Å; R164-F173 VanDerWaalsContact O-CA 3.24Å; R164-F173 WeakPolarHBondContact O-CA 3.2Å; R164-F173 WeakPolarHBondContact O-CB 3.45Å; E165-F173 HydrophobicContact CG-CD1 3.84Å; E165-F173 HydrophobicContact CG-CE1 3.49Å; E165-F173 VanDerWaalsContact CG-CE1 3.49Å; E165-F173 HydrophobicContact CG-CZ 4.4Å; F173-I193 HydrophobicContact CB-CB 4.05Å; F173-I193 HydrophobicContact CB-CD1 4.24Å; F173-I193 PolarHBondContact N-O 2.82Å; F173-I193 VanDerWaalsContact N-O 3.07Å; F173-I193 PolarHBondContact O-N 3.49Å; F173-F201 HydrophobicContact CD2-CD1 4.3Å; F173-F201 AromaticContact CD2-CE1 3.94Å; F173-F201 HydrophobicContact CD2-CE1 3.94Å; F173-F201 HydrophobicContact CE2-CD1 4.42Å; F173-F201 AromaticContact CE2-CE1 3.62Å; F173-F201 HydrophobicContact CE2-CE1 3.62Å; F173-F201 HydrophobicContact CE2-CZ 4.22Å; F173-L212 HydrophobicContact CD1-CD1 4.15Å; F173-L212 HydrophobicContact CD2-CD1 4.03Å; F173-L212 HydrophobicContact CD2-CD2 4.36Å; F173-L212 HydrophobicContact CE1-CD1 4.15Å; F173-L212 HydrophobicContact CE2-CD1 4.05Å; F173-L212 HydrophobicContact CG-CD1 4.08Å; F173-L212 HydrophobicContact CZ-CD1 4.11Å
174	A	95.8	Very high	88.3	Confident	5 Å²	5	69.5 Å²	69.5	4%	0.041	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	124.9	170.8	0	0	0	0	0	109.8	I163 R164 R166 Y191	I163-A174 WeakPolarHBondContact CA-O 3.5Å; R164-A174 HydrophobicContact CG-CB 4.06Å; R164-A174 PolarHBondContact N-O 2.95Å; R164-A174 PolarHBondContact O-N 3.24Å; R166-A174 HydrophobicContact CG-CB 3.97Å; A174-Y191 WeakPolarHBondContact CA-O 3.3Å
175	L	97.1	Very high	87.8	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	125.8	167.7	172.8	61.3	0	0	0	108.4	F161 I163 I177 H190 Y191 I193 I203 L226 L230	F161-L175 HydrophobicContact CB-CD1 4.05Å; F161-L175 HydrophobicContact CD2-CD1 3.7Å; F161-L175 HydrophobicContact CG-CD1 4.26Å; I163-L175 HydrophobicContact CD1-CD1 4.4Å; I163-L175 HydrophobicContact CG1-CB 4.38Å; I163-L175 HydrophobicContact CG1-CD1 3.83Å; L175-I177 HydrophobicContact CD1-CD1 4.39Å; L175-I177 HydrophobicContact CD1-CG1 3.94Å; L175-I177 HydrophobicContact CD2-CD1 3.77Å; L175-I177 HydrophobicContact CD2-CG1 4.18Å; L175-I177 HydrophobicContact CG-CD1 3.87Å; L175-I177 HydrophobicContact CG-CG1 3.7Å; L175-H190 CarbonylContact O-C 3.59Å; L175-H190 VanDerWaalsContact O-CA 3.25Å; L175-H190 WeakPolarHBondContact O-CA 3.2Å; L175-Y191 HydrophobicContact CD2-CD2 4.47Å; L175-Y191 PolarHBondContact N-O 2.61Å; L175-Y191 PolarHBondContact O-N 2.79Å; L175-I193 HydrophobicContact CB-CD1 3.78Å; L175-I193 HydrophobicContact CB-CG1 4.22Å; L175-I203 HydrophobicContact CD2-CD1 3.74Å; L175-L226 HydrophobicContact CD2-CD1 4.07Å; L175-L230 HydrophobicContact CD1-CD2 4.11Å; L175-L230 HydrophobicContact CD2-CD2 4.22Å
176	T	96.7	Very high	87.5	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	123.6	177.1	-58.2	0	0	0	0	108.4	A147 V151 F161 L162 V188 H190	A147-T176 HydrophobicContact CB-CG2 4.2Å; V151-T176 HydrophobicContact CG1-CG2 4.29Å; V151-T176 HydrophobicContact CG2-CG2 3.94Å; F161-T176 CarbonylContact C-O 3.53Å; F161-T176 WeakPolarHBondContact CA-O 2.95Å; F161-T176 WeakPolarHBondContact CB-O 3Å; L162-T176 PolarHBondContact N-O 3.28Å; L162-T176 PolarHBondContact O-N 3.44Å; T176-V188 HydrophobicContact CG2-CG1 3.48Å; T176-V188 VanDerWaalsContact CG2-CG1 3.48Å; T176-H190 VanDerWaalsContact CG2-CE1 3.45Å; T176-H190 WeakPolarHBondContact CG2-CE1 3.1Å; T176-H190 PolarHBondContact OG1-ND1 3Å
177	I	96.4	Very high	87.6	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	131	-171.6	-47	174.7	0	0	0	109.4	F161 L175 D179 V188 K189 Y191 L226 L230	F161-I177 HydrophobicContact CB-CB 4.5Å; F161-I177 HydrophobicContact CB-CG1 4.14Å; F161-I177 HydrophobicContact CB-CG2 4.43Å; L175-I177 HydrophobicContact CD1-CD1 4.39Å; L175-I177 HydrophobicContact CD1-CG1 3.94Å; L175-I177 HydrophobicContact CD2-CD1 3.77Å; L175-I177 HydrophobicContact CD2-CG1 4.18Å; L175-I177 HydrophobicContact CG-CD1 3.87Å; L175-I177 HydrophobicContact CG-CG1 3.7Å; I177-D179 PolarHBondContact O-N 3.29Å; I177-V188 WeakPolarHBondContact O-CA 3.28Å; I177-K189 PolarHBondContact N-O 3.14Å; I177-K189 PolarHBondContact O-N 3.03Å; I177-Y191 HydrophobicContact CD1-CD2 3.89Å; I177-Y191 HydrophobicContact CD1-CE2 3.78Å; I177-Y191 HydrophobicContact CG1-CD2 4.49Å; I177-L226 HydrophobicContact CD1-CD1 3.99Å; I177-L230 HydrophobicContact CD1-CD2 3.54Å; I177-L230 HydrophobicContact CG1-CD2 3.9Å; I177-L230 HydrophobicContact CG2-CD2 4.44Å
178	R	95	Very high	88.2	Confident	21 Å²	21	65.1 Å²	65.1	8%	0.079	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	121.9	167.1	-175.2	-173.4	179.1	81.6	-9.5	109.2	V151 M152 N153 L156 P157 G159 T160	V151-R178 HydrophobicContact CB-CB 4.21Å; V151-R178 HydrophobicContact CG2-CB 4.47Å; V151-R178 VanDerWaalsContact O-CD 3.22Å; V151-R178 WeakPolarHBondContact O-CD 3.13Å; V151-R178 WeakPolarHBondContact O-CG 3.48Å; V151-R178 PolarHBondContact O-NH1 2.74Å; M152-R178 PolarHBondContact O-NH1 3.22Å; N153-R178 PolarHBondContact O-NH1 2.8Å; N153-R178 PolarHBondContact O-NH2 3.48Å; L156-R178 WeakPolarHBondContact O-CD 3.41Å; L156-R178 PolarHBondContact O-NE 3.26Å; L156-R178 PolarHBondContact O-NH2 2.64Å; P157-R178 WeakPolarHBondContact O-CD 3.41Å; G159-R178 PolarHBondContact N-O 3.4Å; T160-R178 PolarHBondContact O-N 3.15Å
179	D	93.5	Very high	88.9	Confident	20 Å²	20	61.7 Å²	61.7	11%	0.107	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	179.7	175.9	-163	22	0	0	0	110.8	Q158 I177 D187 K189 C227	Q158-D179 PolarHBondContact NE2-OD1 3.41Å; I177-D179 PolarHBondContact O-N 3.29Å; D179-D187 CarbonylContact C-O 3.57Å; D179-D187 PolarHBondContact N-O 3.06Å; D179-D187 PolarHBondContact O-N 2.87Å; D179-D187 VanDerWaalsContact O-O 3.12Å; D179-K189 HydrophobicContact CB-CG 4.21Å; D179-C227 HydrophobicContact CB-CB 4.45Å; D179-C227 VanDerWaalsContact OD2-CB 3.3Å; D179-C227 WeakPolarHBondContact OD2-CB 3.47Å
180	R	87.6	Confident	89.5	Confident	168 Å²	168	61.9 Å²	61.9	63%	0.634	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.7	113	173	-166.6	176.3	-161.5	-118.1	1.5	109.7
181	D	86	Confident	90.3	Very high	51 Å²	51	58.1 Å²	58.1	27%	0.273	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	134.6	167	-172	-76.8	0	0	0	109.1	E183 K184 G185 D187	D181-E183 VanDerWaalsContact C-N 3.27Å; D181-E183 PolarHBondContact O-N 3.02Å; D181-E183 PolarHBondContact OD1-N 3.31Å; D181-K184 HydrophobicContact CB-CB 4.03Å; D181-K184 PolarHBondContact OD1-N 2.96Å; D181-G185 PolarHBondContact N-O 2.72Å; D181-G185 WeakPolarHBondContact O-CA 3.38Å; D181-G185 PolarHBondContact O-N 3.39Å; D181-D187 HydrophobicContact CB-CB 4.36Å
182	Q	82.4	Confident	90.9	Very high	195 Å²	195	61.1 Å²	61.1	91%	0.911	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-31.4	-175.5	-67.9	-175.7	4.4	0	0	112.5
183	E	82.6	Confident	91.2	Very high	182 Å²	182	59.4 Å²	59.4	85%	0.85	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	-42.5	-176.2	-61.8	-175.4	166.2	0	0	111.5	D181	D181-E183 VanDerWaalsContact C-N 3.27Å; D181-E183 PolarHBondContact O-N 3.02Å; D181-E183 PolarHBondContact OD1-N 3.31Å
184	K	80	Confident	91	Very high	168 Å²	168	63.9 Å²	63.9	73%	0.73	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-13.3	-173.1	-61.2	177.7	-178.8	174.8	0	113.8	D181	D181-K184 HydrophobicContact CB-CB 4.03Å; D181-K184 PolarHBondContact OD1-N 2.96Å
185	G	85.2	Confident	90.8	Very high	16 Å²	16	69.4 Å²	69.4	17%	0.165	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	88.6	-148.7	-178.5	0	0	0	0	0	113.1	D181 D187	D181-G185 PolarHBondContact N-O 2.72Å; D181-G185 WeakPolarHBondContact O-CA 3.38Å; D181-G185 PolarHBondContact O-N 3.39Å; G185-D187 PolarHBondContact O-N 2.81Å
186	P	86.3	Confident	90.3	Very high	74 Å²	74	71.1 Å²	71.1	48%	0.481	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.2	134.5	-178.3	-24.5	35.1	0	0	0	112.3	M152	M152-P186 HydrophobicContact CE-CB 3.66Å; M152-P186 HydrophobicContact SD-CB 4.2Å
187	D	90.8	Very high	89.7	Confident	51 Å²	51	81.1 Å²	81.1	27%	0.273	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	168.5	179.7	-168.9	21	0	0	0	110.5	D179 D181 G185 K189	D179-D187 CarbonylContact C-O 3.57Å; D179-D187 PolarHBondContact N-O 3.06Å; D179-D187 PolarHBondContact O-N 2.87Å; D179-D187 VanDerWaalsContact O-O 3.12Å; D181-D187 HydrophobicContact CB-CB 4.36Å; G185-D187 PolarHBondContact O-N 2.81Å; D187-K189 VanDerWaalsContact OD2-CE 3.25Å; D187-K189 WeakPolarHBondContact OD2-CE 3.45Å; D187-K189 IonicContact OD2-NZ 3.99Å; D187-K189 PolarHBondContact OD2-NZ 3.28Å
188	V	92.2	Very high	89.1	Confident	19 Å²	19	87.8 Å²	87.8	12%	0.115	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	128.6	174.7	-176.2	0	0	0	0	110.7	V148 V151 M152 T176 I177	V148-V188 HydrophobicContact CG1-CB 4.47Å; V148-V188 HydrophobicContact CG1-CG2 4Å; V148-V188 HydrophobicContact CG2-CB 4.5Å; V148-V188 HydrophobicContact CG2-CG1 4.14Å; V151-V188 HydrophobicContact CG2-CB 4.49Å; V151-V188 HydrophobicContact CG2-CG1 3.84Å; V151-V188 HydrophobicContact CG2-CG2 3.76Å; M152-V188 HydrophobicContact CE-CG2 4.5Å; M152-V188 HydrophobicContact CG-CG2 3.22Å; M152-V188 HydrophobicContact SD-CG2 3.31Å; M152-V188 WeakPolarHBondContact SD-CG2 3.18Å; T176-V188 HydrophobicContact CG2-CG1 3.48Å; T176-V188 VanDerWaalsContact CG2-CG1 3.48Å; I177-V188 WeakPolarHBondContact O-CA 3.28Å
189	K	93.9	Very high	88.6	Confident	75 Å²	75	87.7 Å²	87.7	33%	0.326	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	147.2	172.3	-57.8	-52.9	-170.1	-163.2	0	110.9	I177 D179 D187 Y191 C227	I177-K189 PolarHBondContact N-O 3.14Å; I177-K189 PolarHBondContact O-N 3.03Å; D179-K189 HydrophobicContact CB-CG 4.21Å; D187-K189 VanDerWaalsContact OD2-CE 3.25Å; D187-K189 WeakPolarHBondContact OD2-CE 3.45Å; D187-K189 IonicContact OD2-NZ 3.99Å; D187-K189 PolarHBondContact OD2-NZ 3.28Å; K189-Y191 HydrophobicContact CB-CE2 3.73Å; K189-C227 HydrophobicContact CB-CB 4.43Å; K189-C227 HydrophobicContact CG-CB 3.79Å
190	H	94.4	Very high	88.5	Confident	48 Å²	48	87 Å²	87	22%	0.222	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	135.7	176.3	-55.8	-91.1	0	0	0	110.7	R144 V148 L175 T176	R144-H190 PolarHBondContact NE-CD2 3.1Å; R144-H190 PolarHBondContact NE-NE2 2.99Å; R144-H190 VanDerWaalsContact NE-NE2 3.16Å; R144-H190 PolarHBondContact NH2-CD2 3.35Å; V148-H190 VanDerWaalsContact CG2-CE1 3.43Å; V148-H190 WeakPolarHBondContact CG2-CE1 3.41Å; V148-H190 WeakPolarHBondContact CG2-NE2 3.38Å; L175-H190 CarbonylContact O-C 3.59Å; L175-H190 VanDerWaalsContact O-CA 3.25Å; L175-H190 WeakPolarHBondContact O-CA 3.2Å; T176-H190 VanDerWaalsContact CG2-CE1 3.45Å; T176-H190 WeakPolarHBondContact CG2-CE1 3.1Å; T176-H190 PolarHBondContact OG1-ND1 3Å
191	Y	95.5	Very high	88.8	Confident	47 Å²	47	80.3 Å²	80.3	18%	0.184	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	129.3	177.6	-60.4	-90.2	0	0	0	109.6	A174 L175 I177 K189 I193 I203 L226 C227	A174-Y191 WeakPolarHBondContact CA-O 3.3Å; L175-Y191 HydrophobicContact CD2-CD2 4.47Å; L175-Y191 PolarHBondContact N-O 2.61Å; L175-Y191 PolarHBondContact O-N 2.79Å; I177-Y191 HydrophobicContact CD1-CD2 3.89Å; I177-Y191 HydrophobicContact CD1-CE2 3.78Å; I177-Y191 HydrophobicContact CG1-CD2 4.49Å; K189-Y191 HydrophobicContact CB-CE2 3.73Å; Y191-I193 PolarHBondContact O-N 3.37Å; Y191-I203 HydrophobicContact CD1-CG2 4.1Å; Y191-I203 HydrophobicContact CG-CG2 4.44Å; Y191-L226 HydrophobicContact CD1-CD2 3.53Å; Y191-L226 HydrophobicContact CD2-CD2 3.8Å; Y191-L226 HydrophobicContact CE1-CD2 3.55Å; Y191-L226 HydrophobicContact CE2-CB 4.47Å; Y191-L226 HydrophobicContact CE2-CD2 3.83Å; Y191-L226 HydrophobicContact CG-CD2 3.66Å; Y191-C227 PolarHBondContact OH-N 2.91Å
192	R	93.6	Very high	89.2	Confident	91 Å²	91	79.5 Å²	79.5	34%	0.343	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	118.6	175.4	-174.1	174.3	174.8	150.4	7.8	108.2	R166 D169 E172 R194	R166-R192 VanDerWaalsContact NH1-NE 3.1Å; R166-R192 VanDerWaalsContact NH1-NH2 3.18Å; D169-R192 IonicContact OD1-CZ 3.81Å; D169-R192 IonicContact OD1-NH2 2.91Å; D169-R192 PolarHBondContact OD1-NH2 3.02Å; E172-R192 IonicContact OE1-CZ 3.57Å; E172-R192 IonicContact OE1-NE 3.54Å; E172-R192 IonicContact OE1-NH2 2.78Å; E172-R192 PolarHBondContact OE1-NH2 3.25Å; E172-R192 IonicContact OE2-CZ 3.03Å; E172-R192 IonicContact OE2-NE 2.65Å; E172-R192 PolarHBondContact OE2-NE 2.71Å; E172-R192 IonicContact OE2-NH2 2.8Å; E172-R192 PolarHBondContact OE2-NH2 3.12Å; R192-R194 HydrophobicContact CG-CG 4.05Å
193	I	95.2	Very high	89.7	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	111.9	171.2	-59.3	162.7	0	0	0	107	I163 F173 L175 Y191 F201 I203 L212 L215	I163-I193 HydrophobicContact CD1-CD1 3.75Å; I163-I193 HydrophobicContact CG1-CD1 4.11Å; I163-I193 HydrophobicContact CG2-CD1 3.99Å; F173-I193 HydrophobicContact CB-CB 4.05Å; F173-I193 HydrophobicContact CB-CD1 4.24Å; F173-I193 PolarHBondContact N-O 2.82Å; F173-I193 VanDerWaalsContact N-O 3.07Å; F173-I193 PolarHBondContact O-N 3.49Å; L175-I193 HydrophobicContact CB-CD1 3.78Å; L175-I193 HydrophobicContact CB-CG1 4.22Å; Y191-I193 PolarHBondContact O-N 3.37Å; I193-F201 HydrophobicContact CG2-CB 3.89Å; I193-F201 HydrophobicContact CG2-CD1 4.17Å; I193-F201 HydrophobicContact CG2-CG 4.41Å; I193-I203 HydrophobicContact CG1-CD1 4.21Å; I193-I203 HydrophobicContact CG1-CG1 3.79Å; I193-L212 HydrophobicContact CD1-CD2 4.29Å; I193-L212 HydrophobicContact CG2-CD2 3.78Å; I193-L215 HydrophobicContact CD1-CD2 4.36Å; I193-L215 HydrophobicContact CG1-CD1 4.3Å; I193-L215 HydrophobicContact CG2-CD1 3.85Å
194	R	91.4	Very high	89.9	Confident	110 Å²	110	65.2 Å²	65.2	42%	0.415	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	150.6	-178.9	-63.1	-178.2	-176.1	-147.5	0.9	110.3	R192 F201 Y202	R192-R194 HydrophobicContact CG-CG 4.05Å; R194-F201 VanDerWaalsContact O-CA 3.3Å; R194-F201 WeakPolarHBondContact O-CA 3.31Å; R194-Y202 HydrophobicContact CB-CD1 4.2Å; R194-Y202 HydrophobicContact CB-CE1 3.63Å; R194-Y202 HydrophobicContact CB-CE2 4Å; R194-Y202 WeakPolarHBondContact CD-OH 3.4Å; R194-Y202 HydrophobicContact CG-CE2 4.43Å; R194-Y202 PolarHBondContact N-O 3.49Å; R194-Y202 PolarHBondContact O-N 2.81Å
195	R	90.3	Very high	90.2	Very high	121 Å²	121	61.9 Å²	61.9	46%	0.457	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	141.3	172.8	-162.4	175.3	-178.6	-156.6	-1.8	110.1	G200 F201	R195-G200 WeakPolarHBondContact CA-O 3.28Å; R195-F201 HydrophobicContact CB-CE1 4.41Å; R195-F201 HydrophobicContact CG-CD1 4.48Å; R195-F201 HydrophobicContact CG-CE1 4.08Å
196	L	87.3	Confident	90.4	Very high	36 Å²	36	71.9 Å²	71.9	19%	0.188	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-85.6	150.3	170.2	-65.3	163.8	0	0	0	110.4	N198 G199 G200 Y202 K208	L196-N198 VanDerWaalsContact CB-OD1 3.27Å; L196-N198 WeakPolarHBondContact CB-OD1 3.28Å; L196-N198 PolarHBondContact O-N 2.93Å; L196-G199 PolarHBondContact O-N 2.97Å; L196-G199 VanDerWaalsContact O-N 3.07Å; L196-G200 PolarHBondContact N-O 2.9Å; L196-Y202 HydrophobicContact CD1-CD1 4.38Å; L196-Y202 HydrophobicContact CD2-CD1 3.61Å; L196-Y202 HydrophobicContact CD2-CE1 3.42Å; L196-Y202 VanDerWaalsContact CD2-CE1 3.42Å; L196-Y202 HydrophobicContact CG-CD1 3.69Å; L196-Y202 HydrophobicContact CG-CE1 3.84Å; L196-K208 HydrophobicContact CD1-CB 4.17Å; L196-K208 HydrophobicContact CD1-CD 3.9Å; L196-K208 HydrophobicContact CD1-CG 4.12Å; L196-K208 HydrophobicContact CD2-CD 4.48Å
197	E	85.2	Confident	90.6	Very high	211 Å²	211	71.4 Å²	71.4	99%	0.986	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-36.5	177	-66.8	178.1	-180	0	0	112.5	G199	E197-G199 VanDerWaalsContact C-N 3.26Å; E197-G199 PolarHBondContact O-N 3.02Å
198	N	82.4	Confident	90.8	Very high	139 Å²	139	74.8 Å²	74.8	74%	0.743	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	12.6	179.1	67.3	-27.4	0	0	0	114	L196	L196-N198 VanDerWaalsContact CB-OD1 3.27Å; L196-N198 WeakPolarHBondContact CB-OD1 3.28Å; L196-N198 PolarHBondContact O-N 2.93Å
199	G	84.1	Confident	91	Very high	19 Å²	19	74.6 Å²	74.6	20%	0.196	34%	0.341	C	S	.	.	S	Bend	trans	83.4	150.6	-171.4	0	0	0	0	0	112.8	L196 E197	L196-G199 PolarHBondContact O-N 2.97Å; L196-G199 VanDerWaalsContact O-N 3.07Å; E197-G199 VanDerWaalsContact C-N 3.26Å; E197-G199 PolarHBondContact O-N 3.02Å
200	G	91.5	Very high	91	Very high	5 Å²	5	80.7 Å²	80.7	5%	0.052	36%	0.362	C	S	.	.			trans	106.1	173.9	-174.5	0	0	0	0	0	113.8	R195 L196 F209 R210	R195-G200 WeakPolarHBondContact CA-O 3.28Å; L196-G200 PolarHBondContact N-O 2.9Å; G200-F209 CarbonylContact C-O 3.42Å; G200-F209 WeakPolarHBondContact CA-O 3.32Å; G200-R210 WeakPolarHBondContact CA-O 3.49Å
201	F	94.8	Very high	91	Very high	28 Å²	28	80.9 Å²	80.9	12%	0.123	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	148.7	-166.8	-57.8	-78.3	0	0	0	111.6	F173 I193 R194 R195 F209 L212 L215	F173-F201 HydrophobicContact CD2-CD1 4.3Å; F173-F201 AromaticContact CD2-CE1 3.94Å; F173-F201 HydrophobicContact CD2-CE1 3.94Å; F173-F201 HydrophobicContact CE2-CD1 4.42Å; F173-F201 AromaticContact CE2-CE1 3.62Å; F173-F201 HydrophobicContact CE2-CE1 3.62Å; F173-F201 HydrophobicContact CE2-CZ 4.22Å; I193-F201 HydrophobicContact CG2-CB 3.89Å; I193-F201 HydrophobicContact CG2-CD1 4.17Å; I193-F201 HydrophobicContact CG2-CG 4.41Å; R194-F201 VanDerWaalsContact O-CA 3.3Å; R194-F201 WeakPolarHBondContact O-CA 3.31Å; R195-F201 HydrophobicContact CB-CE1 4.41Å; R195-F201 HydrophobicContact CG-CD1 4.48Å; R195-F201 HydrophobicContact CG-CE1 4.08Å; F201-F209 PolarHBondContact N-O 3.18Å; F201-F209 PolarHBondContact O-N 2.94Å; F201-L212 HydrophobicContact CB-CD2 4.04Å; F201-L212 HydrophobicContact CD1-CD2 3.83Å; F201-L212 HydrophobicContact CD1-CG 4.32Å; F201-L212 HydrophobicContact CD2-CD2 4.05Å; F201-L212 HydrophobicContact CD2-CG 4.01Å; F201-L212 HydrophobicContact CE1-CD2 4.32Å; F201-L212 HydrophobicContact CE1-CG 4.38Å; F201-L212 HydrophobicContact CE2-CG 4.06Å; F201-L212 HydrophobicContact CG-CD2 3.67Å; F201-L212 HydrophobicContact CG-CG 4.13Å; F201-L212 HydrophobicContact CZ-CG 4.24Å; F201-L215 HydrophobicContact CB-CD1 4.21Å
202	Y	94	Very high	91	Very high	34 Å²	34	78.7 Å²	78.7	13%	0.133	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	149.7	173.9	67.3	-81	0	0	0	111.6	R194 L196 T205 Q207	R194-Y202 HydrophobicContact CB-CD1 4.2Å; R194-Y202 HydrophobicContact CB-CE1 3.63Å; R194-Y202 HydrophobicContact CB-CE2 4Å; R194-Y202 WeakPolarHBondContact CD-OH 3.4Å; R194-Y202 HydrophobicContact CG-CE2 4.43Å; R194-Y202 PolarHBondContact N-O 3.49Å; R194-Y202 PolarHBondContact O-N 2.81Å; L196-Y202 HydrophobicContact CD1-CD1 4.38Å; L196-Y202 HydrophobicContact CD2-CD1 3.61Å; L196-Y202 HydrophobicContact CD2-CE1 3.42Å; L196-Y202 VanDerWaalsContact CD2-CE1 3.42Å; L196-Y202 HydrophobicContact CG-CD1 3.69Å; L196-Y202 HydrophobicContact CG-CE1 3.84Å; Y202-T205 HydrophobicContact CD2-CG2 4.18Å; Y202-T205 HydrophobicContact CE2-CG2 3.7Å; Y202-Q207 WeakPolarHBondContact CB-O 3.28Å
203	I	92.4	Very high	91.1	Very high	33 Å²	33	74.8 Å²	74.8	17%	0.169	34%	0.344	C	S	.	.	S	Bend	trans	-92.7	-43.2	164.4	-66.6	175.3	0	0	0	109.4	L175 Y191 I193 L215 Y219 L226	L175-I203 HydrophobicContact CD2-CD1 3.74Å; Y191-I203 HydrophobicContact CD1-CG2 4.1Å; Y191-I203 HydrophobicContact CG-CG2 4.44Å; I193-I203 HydrophobicContact CG1-CD1 4.21Å; I193-I203 HydrophobicContact CG1-CG1 3.79Å; I203-L215 HydrophobicContact CD1-CD2 4.35Å; I203-L215 HydrophobicContact CG1-CD1 4.32Å; I203-Y219 HydrophobicContact CD1-CD2 4.2Å; I203-Y219 HydrophobicContact CD1-CE2 3.71Å; I203-Y219 HydrophobicContact CG1-CE2 4.33Å; I203-L226 HydrophobicContact CD1-CD2 3.99Å; I203-L226 HydrophobicContact CG2-CD2 4.48Å
204	T	87.5	Confident	91.2	Very high	45 Å²	45	78.1 Å²	78.1	28%	0.276	36%	0.359	S	S	.	.	S	Bend	trans	-121.8	143.3	175	173.9	0	0	0	0	110.1	R206 Q207	T204-R206 HydrophobicContact CG2-CB 4.26Å; T204-R206 PolarHBondContact O-N 3.49Å; T204-R206 PolarHBondContact OG1-N 3.43Å; T204-Q207 HydrophobicContact CG2-CB 4.45Å; T204-Q207 PolarHBondContact O-N 3.41Å
205	T	85.8	Confident	91.4	Very high	98 Å²	98	72.9 Å²	72.9	60%	0.601	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-14.3	-179.4	52.2	0	0	0	0	113.5	Y202 K208	Y202-T205 HydrophobicContact CD2-CG2 4.18Å; Y202-T205 HydrophobicContact CE2-CG2 3.7Å; T205-K208 WeakPolarHBondContact O-CE 3.46Å
206	R	88.9	Confident	91.8	Very high	226 Å²	226	67.6 Å²	67.6	85%	0.853	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-30.8	176.7	-62.2	-177.4	-175.8	-179.2	0.5	113.3	T204	T204-R206 HydrophobicContact CG2-CB 4.26Å; T204-R206 PolarHBondContact O-N 3.49Å; T204-R206 PolarHBondContact OG1-N 3.43Å
207	Q	92.2	Very high	92.2	Very high	64 Å²	64	73 Å²	73	30%	0.299	34%	0.339	S	S	.	.	S	Bend	trans	-134.5	115.8	-175.2	-173.4	61.9	43.8	0	0	109.6	Y202 T204 F209 Y218	Y202-Q207 WeakPolarHBondContact CB-O 3.28Å; T204-Q207 HydrophobicContact CG2-CB 4.45Å; T204-Q207 PolarHBondContact O-N 3.41Å; Q207-F209 HydrophobicContact CB-CE2 4.45Å; Q207-F209 HydrophobicContact CB-CZ 4.38Å; Q207-F209 HydrophobicContact CG-CE1 3.87Å; Q207-F209 HydrophobicContact CG-CE2 3.74Å; Q207-F209 HydrophobicContact CG-CZ 3.27Å; Q207-Y218 HydrophobicContact CG-CD1 4.49Å; Q207-Y218 HydrophobicContact CG-CE1 4.11Å
208	K	94.4	Very high	92.9	Very high	122 Å²	122	66 Å²	66	53%	0.53	30%	0.304	S	S	.	.			trans	-117.7	144.2	-174.8	-60.6	171.5	-176.7	178.2	0	109.4	L196 T205	L196-K208 HydrophobicContact CD1-CB 4.17Å; L196-K208 HydrophobicContact CD1-CD 3.9Å; L196-K208 HydrophobicContact CD1-CG 4.12Å; L196-K208 HydrophobicContact CD2-CD 4.48Å; T205-K208 WeakPolarHBondContact O-CE 3.46Å
209	F	95.9	Very high	93.6	Very high	14 Å²	14	59.4 Å²	59.4	6%	0.061	27%	0.268	C	S	.	.	B	Isolated β-bridge	trans	-127.8	150.2	-176.9	-54	-81.1	0	0	0	109.8	G200 F201 Q207 E214 L215 Y218 Y219	G200-F209 CarbonylContact C-O 3.42Å; G200-F209 WeakPolarHBondContact CA-O 3.32Å; F201-F209 PolarHBondContact N-O 3.18Å; F201-F209 PolarHBondContact O-N 2.94Å; Q207-F209 HydrophobicContact CB-CE2 4.45Å; Q207-F209 HydrophobicContact CB-CZ 4.38Å; Q207-F209 HydrophobicContact CG-CE1 3.87Å; Q207-F209 HydrophobicContact CG-CE2 3.74Å; Q207-F209 HydrophobicContact CG-CZ 3.27Å; F209-E214 HydrophobicContact CB-CB 4.08Å; F209-E214 HydrophobicContact CD1-CB 4.14Å; F209-L215 HydrophobicContact CB-CB 4.03Å; F209-L215 HydrophobicContact CD1-CB 4.39Å; F209-L215 HydrophobicContact CD2-CB 3.57Å; F209-L215 HydrophobicContact CD2-CD1 3.82Å; F209-L215 HydrophobicContact CD2-CG 3.7Å; F209-L215 HydrophobicContact CE2-CB 4.05Å; F209-L215 HydrophobicContact CE2-CD1 4.2Å; F209-L215 HydrophobicContact CE2-CG 3.83Å; F209-L215 HydrophobicContact CG-CB 3.73Å; F209-L215 HydrophobicContact CG-CG 4.38Å; F209-Y218 VanDerWaalsContact CE1-CB 3.41Å; F209-Y218 HydrophobicContact CE1-CD1 4.04Å; F209-Y218 HydrophobicContact CE1-CD2 4.11Å; F209-Y218 AromaticContact CE1-CG 3.59Å; F209-Y218 HydrophobicContact CE1-CG 3.59Å; F209-Y218 AromaticContact CZ-CD1 3.53Å; F209-Y218 HydrophobicContact CZ-CD1 3.53Å; F209-Y218 HydrophobicContact CZ-CD2 4.37Å; F209-Y218 HydrophobicContact CZ-CE1 4.24Å; F209-Y218 AromaticContact CZ-CG 3.61Å; F209-Y218 HydrophobicContact CZ-CG 3.61Å; F209-Y219 AromaticContact CE2-CE2 3.89Å; F209-Y219 HydrophobicContact CE2-CE2 3.89Å; F209-Y219 HydrophobicContact CZ-CE2 4.15Å
210	R	94.4	Very high	94.2	Very high	203 Å²	203	60.8 Å²	60.8	77%	0.766	28%	0.275	S	S	*	.	S	Bend	trans	-78.4	-35.4	177.2	-63	176.3	173.6	166.3	-1.4	111.4	G200 E214	G200-R210 WeakPolarHBondContact CA-O 3.49Å; R210-E214 WeakPolarHBondContact CB-OE2 3.28Å; R210-E214 PolarHBondContact N-OE2 2.96Å
211	T	94	Very high	94.5	Very high	52 Å²	52	67.5 Å²	67.5	32%	0.319	31%	0.305	S	S	.	.	S	Bend	trans	-130.2	162.3	-178.2	70	0	0	0	0	111.3	Q213 E214 L215	T211-Q213 PolarHBondContact O-N 3.24Å; T211-Q213 PolarHBondContact OG1-OE1 2.79Å; T211-E214 PolarHBondContact O-N 3.12Å; T211-E214 WeakPolarHBondContact OG1-CG 3.36Å; T211-E214 PolarHBondContact OG1-N 3.48Å; T211-E214 VanDerWaalsContact OG1-N 3.15Å; T211-L215 PolarHBondContact O-N 3.37Å
212	L	95.3	Very high	94.5	Very high	1 Å²	1	68.6 Å²	68.6	1%	0.005	31%	0.314	C	S	.	.	H	α-helix	trans	-66.6	-30.9	173	-70.9	177.9	0	0	0	111.4	P132 W137 I163 F173 I193 F201 L215 V216	P132-L212 HydrophobicContact CB-CD1 4.09Å; P132-L212 HydrophobicContact CG-CD1 3.86Å; W137-L212 HydrophobicContact CH2-CB 3.49Å; W137-L212 VanDerWaalsContact CH2-CB 3.49Å; W137-L212 HydrophobicContact CH2-CD1 4.23Å; W137-L212 HydrophobicContact CZ2-CB 4.27Å; W137-L212 HydrophobicContact CZ3-CB 4.26Å; W137-L212 HydrophobicContact CZ3-CD1 4.33Å; I163-L212 HydrophobicContact CG2-CD1 4.46Å; F173-L212 HydrophobicContact CD1-CD1 4.15Å; F173-L212 HydrophobicContact CD2-CD1 4.03Å; F173-L212 HydrophobicContact CD2-CD2 4.36Å; F173-L212 HydrophobicContact CE1-CD1 4.15Å; F173-L212 HydrophobicContact CE2-CD1 4.05Å; F173-L212 HydrophobicContact CG-CD1 4.08Å; F173-L212 HydrophobicContact CZ-CD1 4.11Å; I193-L212 HydrophobicContact CD1-CD2 4.29Å; I193-L212 HydrophobicContact CG2-CD2 3.78Å; F201-L212 HydrophobicContact CB-CD2 4.04Å; F201-L212 HydrophobicContact CD1-CD2 3.83Å; F201-L212 HydrophobicContact CD1-CG 4.32Å; F201-L212 HydrophobicContact CD2-CD2 4.05Å; F201-L212 HydrophobicContact CD2-CG 4.01Å; F201-L212 HydrophobicContact CE1-CD2 4.32Å; F201-L212 HydrophobicContact CE1-CG 4.38Å; F201-L212 HydrophobicContact CE2-CG 4.06Å; F201-L212 HydrophobicContact CG-CD2 3.67Å; F201-L212 HydrophobicContact CG-CG 4.13Å; F201-L212 HydrophobicContact CZ-CG 4.24Å; L212-L215 WeakPolarHBondContact O-CB 3.36Å; L212-L215 PolarHBondContact O-N 3.35Å; L212-V216 WeakPolarHBondContact O-CG2 3.39Å; L212-V216 PolarHBondContact O-N 3.35Å
213	Q	96.1	Very high	94.5	Very high	9 Å²	9	68.2 Å²	68.2	4%	0.042	32%	0.318	C	S	.	.	H	α-helix	trans	-61.7	-44	175	-66.1	85.7	-16.9	0	0	111.8	E130 S131 E135 W137 T211 L215 V216 R217	E130-Q213 PolarHBondContact O-NE2 3Å; S131-Q213 PolarHBondContact O-NE2 3.28Å; E135-Q213 HydrophobicContact CG-CG 3.89Å; E135-Q213 WeakPolarHBondContact OE1-CG 3.35Å; W137-Q213 HydrophobicContact CZ2-CG 4.23Å; T211-Q213 PolarHBondContact O-N 3.24Å; T211-Q213 PolarHBondContact OG1-OE1 2.79Å; Q213-L215 VanDerWaalsContact C-N 3.34Å; Q213-V216 PolarHBondContact O-N 3.27Å; Q213-R217 WeakPolarHBondContact O-CB 3.16Å; Q213-R217 VanDerWaalsContact O-CG 3.27Å; Q213-R217 WeakPolarHBondContact O-CG 3.44Å; Q213-R217 PolarHBondContact O-N 3.16Å
214	E	96.5	Very high	94.5	Very high	70 Å²	70	70.1 Å²	70.1	33%	0.327	33%	0.329	S	S	.	.	H	α-helix	trans	-62	-42.4	174.7	-75.4	176.7	-174.9	0	0	111.6	F209 R210 T211 R217 Y218	F209-E214 HydrophobicContact CB-CB 4.08Å; F209-E214 HydrophobicContact CD1-CB 4.14Å; R210-E214 WeakPolarHBondContact CB-OE2 3.28Å; R210-E214 PolarHBondContact N-OE2 2.96Å; T211-E214 PolarHBondContact O-N 3.12Å; T211-E214 WeakPolarHBondContact OG1-CG 3.36Å; T211-E214 PolarHBondContact OG1-N 3.48Å; T211-E214 VanDerWaalsContact OG1-N 3.15Å; E214-R217 PolarHBondContact O-N 2.95Å; E214-Y218 WeakPolarHBondContact O-CB 3.29Å; E214-Y218 PolarHBondContact O-N 3.48Å
215	L	97.1	Very high	94.7	Very high	0 Å²	0	71.6 Å²	71.6	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-59.3	-48.2	175.7	-177.8	156	0	0	0	111.2	I193 F201 I203 F209 T211 L212 Q213 Y218 Y219	I193-L215 HydrophobicContact CD1-CD2 4.36Å; I193-L215 HydrophobicContact CG1-CD1 4.3Å; I193-L215 HydrophobicContact CG2-CD1 3.85Å; F201-L215 HydrophobicContact CB-CD1 4.21Å; I203-L215 HydrophobicContact CD1-CD2 4.35Å; I203-L215 HydrophobicContact CG1-CD1 4.32Å; F209-L215 HydrophobicContact CB-CB 4.03Å; F209-L215 HydrophobicContact CD1-CB 4.39Å; F209-L215 HydrophobicContact CD2-CB 3.57Å; F209-L215 HydrophobicContact CD2-CD1 3.82Å; F209-L215 HydrophobicContact CD2-CG 3.7Å; F209-L215 HydrophobicContact CE2-CB 4.05Å; F209-L215 HydrophobicContact CE2-CD1 4.2Å; F209-L215 HydrophobicContact CE2-CG 3.83Å; F209-L215 HydrophobicContact CG-CB 3.73Å; F209-L215 HydrophobicContact CG-CG 4.38Å; T211-L215 PolarHBondContact O-N 3.37Å; L212-L215 WeakPolarHBondContact O-CB 3.36Å; L212-L215 PolarHBondContact O-N 3.35Å; Q213-L215 VanDerWaalsContact C-N 3.34Å; L215-Y218 PolarHBondContact O-N 3.39Å; L215-Y219 HydrophobicContact CD2-CD2 3.74Å; L215-Y219 HydrophobicContact CD2-CE2 4.15Å; L215-Y219 HydrophobicContact CG-CD2 3.91Å; L215-Y219 HydrophobicContact CG-CE2 3.98Å; L215-Y219 VanDerWaalsContact O-CD2 3.28Å; L215-Y219 WeakPolarHBondContact O-CD2 3.24Å; L215-Y219 PolarHBondContact O-N 3.48Å
216	V	97.4	Very high	95.1	Very high	10 Å²	10	67.6 Å²	67.6	6%	0.061	33%	0.327	C	S	.	.	H	α-helix	trans	-64	-46.9	179.6	169.7	0	0	0	0	110.9	W137 F161 I163 L212 Q213 Y218 Y219 S220 L230	W137-V216 HydrophobicContact CD2-CG2 3.98Å; W137-V216 HydrophobicContact CE3-CG2 4.4Å; W137-V216 HydrophobicContact CG-CG2 4.48Å; W137-V216 HydrophobicContact CH2-CG2 4.39Å; W137-V216 HydrophobicContact CZ2-CB 4.48Å; W137-V216 HydrophobicContact CZ2-CG2 3.92Å; F161-V216 HydrophobicContact CE2-CG1 3.82Å; F161-V216 HydrophobicContact CE2-CG2 4.08Å; F161-V216 HydrophobicContact CZ-CG1 3.59Å; I163-V216 HydrophobicContact CD1-CG2 3.56Å; L212-V216 WeakPolarHBondContact O-CG2 3.39Å; L212-V216 PolarHBondContact O-N 3.35Å; Q213-V216 PolarHBondContact O-N 3.27Å; V216-Y218 VanDerWaalsContact C-N 3.31Å; V216-Y218 PolarHBondContact O-N 3.02Å; V216-Y219 PolarHBondContact O-N 2.93Å; V216-S220 WeakPolarHBondContact O-CB 3.5Å; V216-S220 PolarHBondContact O-N 3.23Å; V216-S220 PolarHBondContact O-OG 2.98Å; V216-L230 HydrophobicContact CB-CD1 4.48Å; V216-L230 HydrophobicContact CG1-CD1 4.2Å; V216-L230 HydrophobicContact CG2-CD1 4.43Å
217	R	97.3	Very high	95.3	Very high	151 Å²	151	58.8 Å²	58.8	57%	0.57	30%	0.3	S	S	*	.	H	α-helix	trans	-55.1	-46.7	177.3	-73.9	172.7	-166.8	163.8	6.1	111.6	Q213 E214 S220 E221	Q213-R217 WeakPolarHBondContact O-CB 3.16Å; Q213-R217 VanDerWaalsContact O-CG 3.27Å; Q213-R217 WeakPolarHBondContact O-CG 3.44Å; Q213-R217 PolarHBondContact O-N 3.16Å; E214-R217 PolarHBondContact O-N 2.95Å; R217-S220 PolarHBondContact O-N 3.45Å; R217-E221 PolarHBondContact O-N 3.42Å
218	Y	97.9	Very high	95.4	Very high	63 Å²	63	56.6 Å²	56.6	25%	0.247	29%	0.292	C	S	.	.	H	α-helix	trans	-60.7	-50.2	178	-179.7	-92.4	0	0	0	112.3	Q207 F209 E214 L215 V216 S220 E221 T222 D224	Q207-Y218 HydrophobicContact CG-CD1 4.49Å; Q207-Y218 HydrophobicContact CG-CE1 4.11Å; F209-Y218 VanDerWaalsContact CE1-CB 3.41Å; F209-Y218 HydrophobicContact CE1-CD1 4.04Å; F209-Y218 HydrophobicContact CE1-CD2 4.11Å; F209-Y218 AromaticContact CE1-CG 3.59Å; F209-Y218 HydrophobicContact CE1-CG 3.59Å; F209-Y218 AromaticContact CZ-CD1 3.53Å; F209-Y218 HydrophobicContact CZ-CD1 3.53Å; F209-Y218 HydrophobicContact CZ-CD2 4.37Å; F209-Y218 HydrophobicContact CZ-CE1 4.24Å; F209-Y218 AromaticContact CZ-CG 3.61Å; F209-Y218 HydrophobicContact CZ-CG 3.61Å; E214-Y218 WeakPolarHBondContact O-CB 3.29Å; E214-Y218 PolarHBondContact O-N 3.48Å; L215-Y218 PolarHBondContact O-N 3.39Å; V216-Y218 VanDerWaalsContact C-N 3.31Å; V216-Y218 PolarHBondContact O-N 3.02Å; Y218-S220 PolarHBondContact O-N 3.27Å; Y218-E221 PolarHBondContact O-N 3.16Å; Y218-T222 HydrophobicContact CD1-CG2 4.05Å; Y218-T222 HydrophobicContact CD2-CG2 4.5Å; Y218-T222 HydrophobicContact CE1-CG2 3.6Å; Y218-T222 HydrophobicContact CE2-CG2 4.09Å; Y218-T222 HydrophobicContact CG-CG2 4.49Å; Y218-T222 PolarHBondContact O-N 3.46Å; Y218-D224 HydrophobicContact CE1-CB 3.81Å; Y218-D224 PolarHBondContact OH-OD2 2.85Å; Y218-D224 VanDerWaalsContact OH-OD2 3.13Å
219	Y	98	Very high	95.5	Very high	1 Å²	1	56 Å²	56	0%	0.004	29%	0.289	C	S	.	.	H	α-helix	trans	-74.6	-12.4	-177.7	-74.5	-63.1	0	0	0	114.2	I203 F209 L215 V216 T222 A223 D224 L226 K229 L230	I203-Y219 HydrophobicContact CD1-CD2 4.2Å; I203-Y219 HydrophobicContact CD1-CE2 3.71Å; I203-Y219 HydrophobicContact CG1-CE2 4.33Å; F209-Y219 AromaticContact CE2-CE2 3.89Å; F209-Y219 HydrophobicContact CE2-CE2 3.89Å; F209-Y219 HydrophobicContact CZ-CE2 4.15Å; L215-Y219 HydrophobicContact CD2-CD2 3.74Å; L215-Y219 HydrophobicContact CD2-CE2 4.15Å; L215-Y219 HydrophobicContact CG-CD2 3.91Å; L215-Y219 HydrophobicContact CG-CE2 3.98Å; L215-Y219 VanDerWaalsContact O-CD2 3.28Å; L215-Y219 WeakPolarHBondContact O-CD2 3.24Å; L215-Y219 PolarHBondContact O-N 3.48Å; V216-Y219 PolarHBondContact O-N 2.93Å; Y219-T222 CarbonylContact C-O 3.35Å; Y219-T222 WeakPolarHBondContact CA-O 3.47Å; Y219-A223 WeakPolarHBondContact CD1-O 3.49Å; Y219-D224 HydrophobicContact CE1-CB 4.1Å; Y219-L226 HydrophobicContact CD1-CD1 3.3Å; Y219-L226 HydrophobicContact CD1-CG 3.61Å; Y219-L226 HydrophobicContact CD2-CD1 4.18Å; Y219-L226 HydrophobicContact CE1-CD1 3.88Å; Y219-L226 HydrophobicContact CE1-CD2 4.29Å; Y219-L226 HydrophobicContact CE1-CG 3.7Å; Y219-L226 HydrophobicContact CG-CD1 3.48Å; Y219-L226 VanDerWaalsContact CG-CD1 3.48Å; Y219-L226 HydrophobicContact CG-CG 4.26Å; Y219-K229 WeakPolarHBondContact O-CA 3.41Å; Y219-L230 PolarHBondContact O-N 2.95Å
220	S	97.4	Very high	95.6	Very high	48 Å²	48	55.5 Å²	55.5	34%	0.336	29%	0.287	S	S	.	.	H	α-helix	trans	-75.1	-31.9	166.1	-62.2	0	0	0	0	112.4	V216 R217 Y218 L230	V216-S220 WeakPolarHBondContact O-CB 3.5Å; V216-S220 PolarHBondContact O-N 3.23Å; V216-S220 PolarHBondContact O-OG 2.98Å; R217-S220 PolarHBondContact O-N 3.45Å; Y218-S220 PolarHBondContact O-N 3.27Å; S220-L230 WeakPolarHBondContact CA-O 3.38Å
221	E	97.2	Very high	95.7	Very high	145 Å²	145	49.8 Å²	49.8	68%	0.678	27%	0.274	S	S	*	.	H	α-helix	trans	-82.5	-34.9	178.8	-69.2	177.1	-174.3	0	0	112.4	R217 Y218 K229	R217-E221 PolarHBondContact O-N 3.42Å; Y218-E221 PolarHBondContact O-N 3.16Å; E221-K229 WeakPolarHBondContact O-CD 3.41Å; E221-K229 VanDerWaalsContact O-CE 3.23Å; E221-K229 WeakPolarHBondContact O-CE 3.49Å; E221-K229 PolarHBondContact O-NZ 3.36Å
222	T	95.7	Very high	95.8	Very high	52 Å²	52	50.8 Å²	50.8	32%	0.319	28%	0.276	S	S	.	.			trans	-142.8	148.3	-178.1	-176.4	0	0	0	0	112.2	Y218 Y219 D224	Y218-T222 HydrophobicContact CD1-CG2 4.05Å; Y218-T222 HydrophobicContact CD2-CG2 4.5Å; Y218-T222 HydrophobicContact CE1-CG2 3.6Å; Y218-T222 HydrophobicContact CE2-CG2 4.09Å; Y218-T222 HydrophobicContact CG-CG2 4.49Å; Y218-T222 PolarHBondContact O-N 3.46Å; Y219-T222 CarbonylContact C-O 3.35Å; Y219-T222 WeakPolarHBondContact CA-O 3.47Å; T222-D224 HydrophobicContact CG2-CB 3.98Å; T222-D224 PolarHBondContact OG1-N 3.29Å
223	A	93.2	Very high	95.7	Very high	26 Å²	26	52.8 Å²	52.8	22%	0.215	29%	0.289	C	S	.	.			trans	-75.9	-36.9	175.9	0	0	0	0	0	111.3	Y219 G225 L226 K229	Y219-A223 WeakPolarHBondContact CD1-O 3.49Å; A223-G225 VanDerWaalsContact C-N 3.3Å; A223-G225 PolarHBondContact O-N 2.85Å; A223-G225 VanDerWaalsContact O-N 3.11Å; A223-L226 WeakPolarHBondContact O-CB 3.26Å; A223-L226 VanDerWaalsContact O-CG 3.25Å; A223-L226 WeakPolarHBondContact O-CG 3.42Å; A223-L226 PolarHBondContact O-N 2.74Å; A223-K229 HydrophobicContact CB-CG 4.29Å
224	D	92.2	Very high	95.5	Very high	73 Å²	73	52.7 Å²	52.7	39%	0.39	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	35.9	55.2	179.5	-168.2	39.2	0	0	0	114.8	Y218 Y219 T222	Y218-D224 HydrophobicContact CE1-CB 3.81Å; Y218-D224 PolarHBondContact OH-OD2 2.85Å; Y218-D224 VanDerWaalsContact OH-OD2 3.13Å; Y219-D224 HydrophobicContact CE1-CB 4.1Å; T222-D224 HydrophobicContact CG2-CB 3.98Å; T222-D224 PolarHBondContact OG1-N 3.29Å
225	G	91.7	Very high	94.8	Very high	75 Å²	75	53 Å²	53	77%	0.773	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.1	-8.2	-179.8	0	0	0	0	0	115.8	A223	A223-G225 VanDerWaalsContact C-N 3.3Å; A223-G225 PolarHBondContact O-N 2.85Å; A223-G225 VanDerWaalsContact O-N 3.11Å
226	L	93.8	Very high	93.6	Very high	14 Å²	14	56.9 Å²	56.9	7%	0.073	31%	0.314	C	S	.	.	S	Bend	trans	-70.6	160.1	162.5	-55.8	-172.7	0	0	0	110.7	L175 I177 Y191 I203 Y219 A223 C228 L230	L175-L226 HydrophobicContact CD2-CD1 4.07Å; I177-L226 HydrophobicContact CD1-CD1 3.99Å; Y191-L226 HydrophobicContact CD1-CD2 3.53Å; Y191-L226 HydrophobicContact CD2-CD2 3.8Å; Y191-L226 HydrophobicContact CE1-CD2 3.55Å; Y191-L226 HydrophobicContact CE2-CB 4.47Å; Y191-L226 HydrophobicContact CE2-CD2 3.83Å; Y191-L226 HydrophobicContact CG-CD2 3.66Å; I203-L226 HydrophobicContact CD1-CD2 3.99Å; I203-L226 HydrophobicContact CG2-CD2 4.48Å; Y219-L226 HydrophobicContact CD1-CD1 3.3Å; Y219-L226 HydrophobicContact CD1-CG 3.61Å; Y219-L226 HydrophobicContact CD2-CD1 4.18Å; Y219-L226 HydrophobicContact CE1-CD1 3.88Å; Y219-L226 HydrophobicContact CE1-CD2 4.29Å; Y219-L226 HydrophobicContact CE1-CG 3.7Å; Y219-L226 HydrophobicContact CG-CD1 3.48Å; Y219-L226 VanDerWaalsContact CG-CD1 3.48Å; Y219-L226 HydrophobicContact CG-CG 4.26Å; A223-L226 WeakPolarHBondContact O-CB 3.26Å; A223-L226 VanDerWaalsContact O-CG 3.25Å; A223-L226 WeakPolarHBondContact O-CG 3.42Å; A223-L226 PolarHBondContact O-N 2.74Å; L226-C228 PolarHBondContact O-N 3.48Å; L226-L230 HydrophobicContact CD1-CD2 4.44Å
227	C	93	Very high	92.1	Very high	42 Å²	42	61.1 Å²	61.1	28%	0.284	33%	0.329	S	S	.	.	S	Bend	trans	-61.8	-33.7	178.7	57	0	0	0	0	112.8	D179 K189 Y191	D179-C227 HydrophobicContact CB-CB 4.45Å; D179-C227 VanDerWaalsContact OD2-CB 3.3Å; D179-C227 WeakPolarHBondContact OD2-CB 3.47Å; K189-C227 HydrophobicContact CB-CB 4.43Å; K189-C227 HydrophobicContact CG-CB 3.79Å; Y191-C227 PolarHBondContact OH-N 2.91Å
228	C	94.7	Very high	90.3	Very high	18 Å²	18	56.8 Å²	56.8	12%	0.122	33%	0.325	C	S	.	.	S	Bend	trans	-158.3	172.2	174.7	54.7	0	0	0	0	110	Q158 L226	Q158-C228 HydrophobicContact CG-CB 4.46Å; L226-C228 PolarHBondContact O-N 3.48Å
229	K	97.2	Very high	88.7	Confident	109 Å²	109	55.2 Å²	55.2	47%	0.474	32%	0.323	S	S	.	.			trans	-69	150	172.5	-58.8	-172.7	-174.8	-166.8	0	110.3	G159 Y219 E221 A223 T231	G159-K229 WeakPolarHBondContact CA-O 3.48Å; Y219-K229 WeakPolarHBondContact O-CA 3.41Å; E221-K229 WeakPolarHBondContact O-CD 3.41Å; E221-K229 VanDerWaalsContact O-CE 3.23Å; E221-K229 WeakPolarHBondContact O-CE 3.49Å; E221-K229 PolarHBondContact O-NZ 3.36Å; A223-K229 HydrophobicContact CB-CG 4.29Å; K229-T231 PolarHBondContact O-N 3.34Å
230	L	98.1	Very high	87.1	Confident	4 Å²	4	59.1 Å²	59.1	2%	0.021	35%	0.347	C	S	.	.			trans	-70.2	121.6	169.1	-55.6	-175.9	0	0	0	109	F161 L175 I177 V216 Y219 S220 L226	F161-L230 HydrophobicContact CB-CD2 3.88Å; F161-L230 HydrophobicContact CD1-CB 3.72Å; F161-L230 HydrophobicContact CD1-CD2 4.04Å; F161-L230 HydrophobicContact CD1-CG 4.29Å; F161-L230 HydrophobicContact CD2-CD1 4.07Å; F161-L230 HydrophobicContact CD2-CD2 4.16Å; F161-L230 HydrophobicContact CE1-CB 3.68Å; F161-L230 HydrophobicContact CE1-CD1 4.44Å; F161-L230 HydrophobicContact CE1-CG 4.47Å; F161-L230 HydrophobicContact CE2-CD1 3.95Å; F161-L230 HydrophobicContact CG-CB 4.27Å; F161-L230 HydrophobicContact CG-CD1 4.37Å; F161-L230 HydrophobicContact CG-CD2 3.76Å; F161-L230 HydrophobicContact CG-CG 4.34Å; F161-L230 HydrophobicContact CZ-CB 4.17Å; F161-L230 HydrophobicContact CZ-CD1 4.15Å; L175-L230 HydrophobicContact CD1-CD2 4.11Å; L175-L230 HydrophobicContact CD2-CD2 4.22Å; I177-L230 HydrophobicContact CD1-CD2 3.54Å; I177-L230 HydrophobicContact CG1-CD2 3.9Å; I177-L230 HydrophobicContact CG2-CD2 4.44Å; V216-L230 HydrophobicContact CB-CD1 4.48Å; V216-L230 HydrophobicContact CG1-CD1 4.2Å; V216-L230 HydrophobicContact CG2-CD1 4.43Å; Y219-L230 PolarHBondContact O-N 2.95Å; S220-L230 WeakPolarHBondContact CA-O 3.38Å; L226-L230 HydrophobicContact CD1-CD2 4.44Å
231	T	96.3	Very high	85.9	Confident	82 Å²	82	59 Å²	59	50%	0.503	34%	0.339	S	S	.	.			trans	-101.6	-52.8	-176.2	54.9	0	0	0	0	111.6	Q158 G159 T160 K229	Q158-T231 WeakPolarHBondContact O-CG2 3.48Å; Q158-T231 PolarHBondContact O-OG1 3.12Å; G159-T231 WeakPolarHBondContact CA-OG1 3.49Å; G159-T231 PolarHBondContact O-N 3.18Å; G159-T231 PolarHBondContact O-OG1 3.42Å; T160-T231 PolarHBondContact N-OG1 2.82Å; K229-T231 PolarHBondContact O-N 3.34Å
232	Q	95.2	Very high	84.8	Confident	74 Å²	74	52.8 Å²	52.8	35%	0.346	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	149.2	-179.5	63.2	178.6	23.1	0	0	112.9	P157 T160 F161	P157-Q232 HydrophobicContact CG-CG 4.34Å; T160-Q232 VanDerWaalsContact CA-O 3.29Å; T160-Q232 WeakPolarHBondContact CA-O 3.1Å; T160-Q232 HydrophobicContact CG2-CG 4.2Å; T160-Q232 WeakPolarHBondContact OG1-CG 3.48Å; T160-Q232 PolarHBondContact OG1-NE2 3Å; F161-Q232 WeakPolarHBondContact CD1-O 3.4Å; F161-Q232 VanDerWaalsContact CE1-C 3.41Å; F161-Q232 WeakPolarHBondContact CE1-O 3.43Å; F161-Q232 PolarHBondContact N-O 2.78Å
233	P	94.7	Very high	84.1	Confident	43 Å²	43	50.7 Å²	50.7	28%	0.279	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.5	141	168.1	-25.2	35.7	0	0	0	112.1	E136 W137 F161	E136-P233 HydrophobicContact CB-CB 3.99Å; E136-P233 HydrophobicContact CB-CG 4.06Å; W137-P233 HydrophobicContact CB-CB 3.93Å; W137-P233 HydrophobicContact CB-CG 4.13Å; F161-P233 CarbonylContact O-C 3.46Å; F161-P233 WeakPolarHBondContact O-CA 3.36Å
234	C	90.9	Very high	83.6	Confident	6 Å²	6	49.7 Å²	49.7	4%	0.041	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-66.7	131.3	166.2	-172.7	0	0	0	0	108.8	V151 T160 F161 L162 K236	V151-C234 HydrophobicContact CG1-CB 4.23Å; T160-C234 HydrophobicContact CG2-CB 4.08Å; F161-C234 WeakPolarHBondContact O-CB 3.26Å; F161-C234 PolarHBondContact O-N 2.82Å; L162-C234 HydrophobicContact CB-CB 4.05Å; L162-C234 HydrophobicContact CD2-CB 4.08Å; C234-K236 PolarHBondContact O-N 3.45Å
235	P	82.4	Confident	83.1	Confident	77 Å²	77	46.4 Å²	46.4	50%	0.5	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-54	127.4	179.2	-27.2	34.6	0	0	0	112.3	L156	L156-P235 HydrophobicContact CD2-CG 4.37Å
236	K	72.4	Confident	82.6	Confident	81 Å²	81	46 Å²	46	35%	0.352	25%	0.247	S	C	.	.	P	Polyproline II helix	trans	-70.3	154.5	174.3	-67.6	-165.7	-173.9	-170.7	0	111.1	E133 E135 E136 Y138 C234	E133-K236 PolarHBondContact O-NZ 2.75Å; E135-K236 WeakPolarHBondContact O-CE 3.02Å; E135-K236 PolarHBondContact O-NZ 3.33Å; E136-K236 VanDerWaalsContact C-CE 3.46Å; E136-K236 WeakPolarHBondContact O-CE 3.31Å; E136-K236 WeakPolarHBondContact O-CG 3.46Å; Y138-K236 WeakPolarHBondContact O-CE 3.46Å; Y138-K236 PolarHBondContact O-NZ 3.29Å; C234-K236 PolarHBondContact O-N 3.45Å
237	R	64.2	Low	82.1	Confident	99 Å²	99	48.9 Å²	48.9	37%	0.374	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-62.1	136.5	162.9	-67.8	-171.4	170.1	-177.7	-5.7	108.5	I392	R237-I392 HydrophobicContact CB-CD1 4.24Å; R237-I392 HydrophobicContact CB-CG1 4.48Å; R237-I392 HydrophobicContact CG-CB 4.26Å; R237-I392 HydrophobicContact CG-CD1 3.6Å; R237-I392 HydrophobicContact CG-CG1 3.85Å; R237-I392 HydrophobicContact CG-CG2 3.75Å
238	A	60.7	Low	81.7	Confident	61 Å²	61	46.9 Å²	46.9	50%	0.504	25%	0.247	S	C	.	.	P	Polyproline II helix	trans	-56.4	137.7	164.7	0	0	0	0	0	108.3	V240	A238-V240 PolarHBondContact O-N 3.03Å
239	P	63.7	Low	81.1	Confident	29 Å²	29	48.8 Å²	48.8	19%	0.188	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-62	128.6	179.6	25.7	-35	0	0	0	108.7	H79 Y125	H79-P239 HydrophobicContact CB-CG 4.4Å; H79-P239 WeakPolarHBondContact CD2-CG 3.38Å; H79-P239 WeakPolarHBondContact CE1-CD 3.49Å; H79-P239 VanDerWaalsContact NE2-CD 3.28Å; H79-P239 WeakPolarHBondContact NE2-CD 3.2Å; Y125-P239 HydrophobicContact CD2-CB 4.21Å; Y125-P239 HydrophobicContact CD2-CG 4.05Å; Y125-P239 HydrophobicContact CE1-CG 4.39Å; Y125-P239 HydrophobicContact CE2-CB 3.99Å; Y125-P239 HydrophobicContact CE2-CG 3.76Å; Y125-P239 HydrophobicContact CG-CG 4.5Å
240	V	64.4	Low	80.3	Confident	84 Å²	84	49.9 Å²	49.9	51%	0.509	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-73.4	129	167.8	-176.8	0	0	0	0	106.5	A238 S242	A238-V240 PolarHBondContact O-N 3.03Å; V240-S242 PolarHBondContact O-N 3.23Å
241	R	72.5	Confident	79.8	Confident	45 Å²	45	54.2 Å²	54.2	17%	0.17	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-61	128.5	173.7	-70.3	-174.6	175.3	-153.3	1.5	109.2	Y125 D243 A283	Y125-R241 HydrophobicContact CE2-CG 4.33Å; R241-D243 VanDerWaalsContact C-N 3.29Å; R241-A283 VanDerWaalsContact NH1-CB 3.34Å
242	S	73.9	Confident	79.5	Confident	14 Å²	14	51.9 Å²	51.9	10%	0.098	26%	0.264	C	S	.	.	S	Bend	trans	-65.3	-36.7	174	47.8	0	0	0	0	110.9	D106 V240 K317	D106-S242 WeakPolarHBondContact OD1-CB 3.36Å; V240-S242 PolarHBondContact O-N 3.23Å; S242-K317 WeakPolarHBondContact O-CE 3.36Å; S242-K317 PolarHBondContact O-NZ 2.93Å
243	D	81.4	Confident	79.4	Confident	9 Å²	9	51.6 Å²	51.6	5%	0.048	26%	0.262	C	S	.	.			trans	-152.9	177.7	172	-141.2	-36.7	0	0	0	111.8	R241 T248 Q249 K308	R241-D243 VanDerWaalsContact C-N 3.29Å; D243-T248 PolarHBondContact OD1-OG1 3.5Å; D243-Q249 HydrophobicContact CB-CB 4.48Å; D243-Q249 WeakPolarHBondContact OD2-CA 3.29Å; D243-Q249 PolarHBondContact OD2-N 3.35Å; D243-K308 IonicContact OD1-NZ 2.61Å; D243-K308 PolarHBondContact OD1-NZ 3.39Å; D243-K308 IonicContact OD2-NZ 2.8Å; D243-K308 PolarHBondContact OD2-NZ 3.11Å
244	L	82.8	Confident	79.3	Confident	5 Å²	5	49.9 Å²	49.9	3%	0.026	25%	0.251	C	S	.	.	S	Bend	trans	-68.2	-36.5	173.8	-70.6	172	0	0	0	112.2	T248 F278 A283 V285 Y319 A320 V331	L244-T248 HydrophobicContact CB-CG2 4.34Å; L244-F278 HydrophobicContact CB-CD1 3.78Å; L244-F278 HydrophobicContact CB-CE1 3.98Å; L244-F278 HydrophobicContact CB-CG 4.25Å; L244-F278 HydrophobicContact CD1-CB 4.07Å; L244-F278 HydrophobicContact CD1-CD1 4.23Å; L244-F278 HydrophobicContact CD1-CD2 3.97Å; L244-F278 HydrophobicContact CD1-CE2 4.46Å; L244-F278 HydrophobicContact CD1-CG 3.83Å; L244-F278 HydrophobicContact CD2-CB 3.81Å; L244-F278 HydrophobicContact CD2-CD1 4.29Å; L244-F278 HydrophobicContact CD2-CG 4.18Å; L244-F278 HydrophobicContact CG-CB 4.42Å; L244-F278 HydrophobicContact CG-CD1 4.31Å; L244-F278 HydrophobicContact CG-CG 4.3Å; L244-A283 HydrophobicContact CD2-CB 3.9Å; L244-V285 HydrophobicContact CD1-CG1 4.47Å; L244-V285 HydrophobicContact CD2-CG1 3.73Å; L244-Y319 HydrophobicContact CD1-CD2 4.25Å; L244-Y319 HydrophobicContact CD1-CG 4.09Å; L244-Y319 HydrophobicContact CD2-CD2 3.74Å; L244-Y319 HydrophobicContact CD2-CE2 4.1Å; L244-Y319 HydrophobicContact CD2-CG 4.11Å; L244-Y319 HydrophobicContact CG-CD1 4.26Å; L244-Y319 HydrophobicContact CG-CD2 3.82Å; L244-Y319 HydrophobicContact CG-CG 3.66Å; L244-A320 HydrophobicContact CD1-CB 4.46Å; L244-V331 HydrophobicContact CD1-CG1 4.24Å
245	S	80.8	Confident	79.3	Confident	3 Å²	3	52.4 Å²	52.4	2%	0.021	27%	0.267	C	S	.	.			trans	-164.3	170.8	177.4	71.3	0	0	0	0	111.8	E85 W107 E247 T248 Q249	E85-S245 WeakPolarHBondContact OE2-CB 3.29Å; E85-S245 PolarHBondContact OE2-OG 2.81Å; W107-S245 VanDerWaalsContact CZ2-CA 3.5Å; S245-E247 VanDerWaalsContact C-N 3.26Å; S245-E247 PolarHBondContact O-N 3.05Å; S245-E247 PolarHBondContact OG-N 3.39Å; S245-T248 PolarHBondContact N-OG1 2.8Å; S245-T248 PolarHBondContact O-N 3.24Å; S245-T248 PolarHBondContact O-OG1 3.38Å; S245-T248 PolarHBondContact OG-N 2.81Å; S245-T248 PolarHBondContact OG-OG1 2.94Å; S245-T248 VanDerWaalsContact OG-OG1 3.09Å; S245-Q249 PolarHBondContact O-N 3.33Å
246	R	81.8	Confident	79.8	Confident	68 Å²	68	50.3 Å²	50.3	26%	0.257	25%	0.25	S	S	.	.	H	α-helix	trans	-60.1	-37.2	173.4	178.6	178.9	154.2	-88.4	0.4	112.4	W107 Q249	W107-R246 HydrophobicContact CB-CG 4.4Å; W107-R246 HydrophobicContact CD2-CB 3.77Å; W107-R246 HydrophobicContact CE3-CB 4.2Å; W107-R246 HydrophobicContact CG-CB 3.88Å; W107-R246 HydrophobicContact CG-CG 4.14Å; W107-R246 VanDerWaalsContact CZ2-N 3.29Å; R246-Q249 WeakPolarHBondContact O-CB 3.47Å; R246-Q249 PolarHBondContact O-N 3.3Å
247	E	82.4	Confident	80.7	Confident	73 Å²	73	50.1 Å²	50.1	34%	0.341	27%	0.271	S	S	.	.	H	α-helix	trans	-69	-44.9	-179.7	-175.5	60.8	-166.9	0	0	110.9	S245 Q249 K250 N251	S245-E247 VanDerWaalsContact C-N 3.26Å; S245-E247 PolarHBondContact O-N 3.05Å; S245-E247 PolarHBondContact OG-N 3.39Å; E247-Q249 PolarHBondContact O-N 2.83Å; E247-K250 PolarHBondContact O-N 2.78Å; E247-N251 PolarHBondContact O-N 2.86Å; E247-N251 PolarHBondContact OE1-ND2 3.42Å
248	T	85	Confident	82	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.006	26%	0.264	C	S	.	.	H	α-helix	trans	-65.8	-20.6	177.7	51.2	0	0	0	0	113.5	D243 L244 S245 K250 W252 I254 F278	D243-T248 PolarHBondContact OD1-OG1 3.5Å; L244-T248 HydrophobicContact CB-CG2 4.34Å; S245-T248 PolarHBondContact N-OG1 2.8Å; S245-T248 PolarHBondContact O-N 3.24Å; S245-T248 PolarHBondContact O-OG1 3.38Å; S245-T248 PolarHBondContact OG-N 2.81Å; S245-T248 PolarHBondContact OG-OG1 2.94Å; S245-T248 VanDerWaalsContact OG-OG1 3.09Å; T248-K250 VanDerWaalsContact C-N 3.29Å; T248-K250 PolarHBondContact O-N 2.79Å; T248-W252 WeakPolarHBondContact O-CA 3.47Å; T248-W252 WeakPolarHBondContact O-CB 3.07Å; T248-W252 PolarHBondContact O-N 3.12Å; T248-I254 HydrophobicContact CG2-CG2 3.74Å; T248-F278 HydrophobicContact CG2-CE1 4.47Å; T248-F278 HydrophobicContact CG2-CZ 3.92Å
249	Q	81.7	Confident	83.6	Confident	58 Å²	58	45.3 Å²	45.3	27%	0.271	24%	0.243	S	C	.	.	H	α-helix	trans	-62.9	-34.9	169.2	-165.4	-173.7	9.6	0	0	112.6	N104 D106 D243 S245 R246 E247	N104-Q249 PolarHBondContact ND2-OE1 3Å; D106-Q249 PolarHBondContact OD2-NE2 2.85Å; D243-Q249 HydrophobicContact CB-CB 4.48Å; D243-Q249 WeakPolarHBondContact OD2-CA 3.29Å; D243-Q249 PolarHBondContact OD2-N 3.35Å; S245-Q249 PolarHBondContact O-N 3.33Å; R246-Q249 WeakPolarHBondContact O-CB 3.47Å; R246-Q249 PolarHBondContact O-N 3.3Å; E247-Q249 PolarHBondContact O-N 2.83Å
250	K	81.6	Confident	85	Confident	132 Å²	132	48.1 Å²	48.1	57%	0.574	25%	0.253	S	S	*	.	H	α-helix	trans	-96.2	-48.4	179.3	-66.5	-176.6	-179.9	-178.7	0	111.9	E247 T248	E247-K250 PolarHBondContact O-N 2.78Å; T248-K250 VanDerWaalsContact C-N 3.29Å; T248-K250 PolarHBondContact O-N 2.79Å
251	N	87.2	Confident	86.4	Confident	95 Å²	95	47.9 Å²	47.9	51%	0.508	25%	0.246	S	C	.	.			trans	-113.6	79.8	-175.8	-69.1	-29	0	0	0	109.2	E247 E253	E247-N251 PolarHBondContact O-N 2.86Å; E247-N251 PolarHBondContact OE1-ND2 3.42Å; N251-E253 VanDerWaalsContact C-N 3.3Å; N251-E253 PolarHBondContact O-N 2.83Å
252	W	90.5	Very high	87.5	Confident	32 Å²	32	47.4 Å²	47.4	12%	0.121	26%	0.255	C	S	.	.			trans	-84.5	-0.1	-177.9	58.7	-80.9	0	0	0	113.4	T248 F301 A304 K308 L318 A320 V321	T248-W252 WeakPolarHBondContact O-CA 3.47Å; T248-W252 WeakPolarHBondContact O-CB 3.07Å; T248-W252 PolarHBondContact O-N 3.12Å; W252-F301 HydrophobicContact CH2-CD2 4.01Å; W252-F301 HydrophobicContact CH2-CE1 4.43Å; W252-F301 AromaticContact CH2-CE2 3.84Å; W252-F301 HydrophobicContact CH2-CE2 3.84Å; W252-F301 HydrophobicContact CH2-CG 4.39Å; W252-F301 HydrophobicContact CH2-CZ 4.06Å; W252-F301 HydrophobicContact CZ2-CD2 4.35Å; W252-F301 AromaticContact CZ2-CE1 3.98Å; W252-F301 HydrophobicContact CZ2-CE1 3.98Å; W252-F301 AromaticContact CZ2-CE2 3.77Å; W252-F301 HydrophobicContact CZ2-CE2 3.77Å; W252-F301 AromaticContact CZ2-CZ 3.56Å; W252-F301 HydrophobicContact CZ2-CZ 3.56Å; W252-A304 HydrophobicContact CH2-CB 3.66Å; W252-A304 HydrophobicContact CZ3-CB 3.48Å; W252-A304 VanDerWaalsContact CZ3-CB 3.48Å; W252-K308 HydrophobicContact CB-CD 4.34Å; W252-K308 HydrophobicContact CD2-CD 4.46Å; W252-K308 HydrophobicContact CD2-CG 4.23Å; W252-K308 HydrophobicContact CG-CD 4.24Å; W252-K308 HydrophobicContact CG-CG 4.22Å; W252-L318 HydrophobicContact CE3-CD2 4.41Å; W252-L318 HydrophobicContact CZ3-CD2 4.26Å; W252-A320 CarbonylContact O-C 3.45Å; W252-A320 WeakPolarHBondContact O-CA 3.47Å; W252-A320 VanDerWaalsContact O-CB 3.26Å; W252-A320 WeakPolarHBondContact O-CB 3.08Å; W252-V321 HydrophobicContact CE3-CB 4.25Å; W252-V321 HydrophobicContact CE3-CG1 3.95Å; W252-V321 HydrophobicContact CE3-CG2 3.57Å; W252-V321 HydrophobicContact CH2-CG2 4.26Å; W252-V321 HydrophobicContact CZ3-CB 4.03Å; W252-V321 HydrophobicContact CZ3-CG1 3.52Å; W252-V321 HydrophobicContact CZ3-CG2 3.35Å; W252-V321 PolarHBondContact O-N 3.17Å
253	E	92.8	Very high	88.5	Confident	68 Å²	68	51.8 Å²	51.8	32%	0.318	27%	0.274	S	S	.	.	B	Isolated β-bridge	trans	-87.1	102.5	164.6	-175.4	-172.8	-159.1	0	0	109.4	N251 V321 T323 K324	N251-E253 VanDerWaalsContact C-N 3.3Å; N251-E253 PolarHBondContact O-N 2.83Å; E253-V321 CarbonylContact C-O 3.58Å; E253-V321 WeakPolarHBondContact CA-O 3.32Å; E253-V321 HydrophobicContact CB-CG2 4.39Å; E253-T323 VanDerWaalsContact CG-OG1 3.29Å; E253-T323 WeakPolarHBondContact CG-OG1 3.33Å; E253-T323 PolarHBondContact OE1-OG1 3.04Å; E253-K324 VanDerWaalsContact OE1-CG 3.26Å; E253-K324 WeakPolarHBondContact OE1-CG 3.33Å; E253-K324 WeakPolarHBondContact OE2-CE 3.28Å
254	I	92	Very high	89.2	Confident	7 Å²	7	55 Å²	55	4%	0.036	29%	0.287	C	S	.	.			trans	-105.1	150.5	-176	66.2	175.2	0	0	0	112	T248 L259 F278 A320 V321 C322 V331	T248-I254 HydrophobicContact CG2-CG2 3.74Å; I254-L259 HydrophobicContact CD1-CD2 3.94Å; I254-L259 HydrophobicContact CD1-CG 4.19Å; I254-F278 HydrophobicContact CD1-CD2 4.02Å; I254-F278 HydrophobicContact CD1-CE2 3.77Å; I254-A320 HydrophobicContact CD1-CB 3.71Å; I254-A320 HydrophobicContact CG1-CB 3.89Å; I254-A320 HydrophobicContact CG2-CB 4.04Å; I254-V321 PolarHBondContact N-O 2.92Å; I254-C322 PolarHBondContact O-SG 3.4Å; I254-C322 VanDerWaalsContact O-SG 3.33Å; I254-V331 HydrophobicContact CD1-CG2 4.42Å
255	P	91.6	Very high	89.6	Confident	60 Å²	60	58.1 Å²	58.1	39%	0.39	30%	0.303	S	S	.	.			trans	-60.8	135.6	167.9	-17.4	29.6	0	0	0	111.1	G257 E258	P255-G257 PolarHBondContact O-N 3.37Å; P255-G257 VanDerWaalsContact O-N 3.16Å; P255-E258 HydrophobicContact CB-CG 4.29Å; P255-E258 WeakPolarHBondContact CD-OE1 3.38Å; P255-E258 HydrophobicContact CG-CG 4.31Å; P255-E258 WeakPolarHBondContact O-CB 3.47Å; P255-E258 PolarHBondContact O-N 3.42Å
256	K	91.7	Very high	89.9	Confident	33 Å²	33	59.3 Å²	59.3	14%	0.143	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-59.1	-29.9	178.2	-177.6	-179.6	-84.9	155.2	0	112.4	E258 L259 F261 C322 E325 P327	K256-E258 PolarHBondContact O-N 3.44Å; K256-E258 VanDerWaalsContact O-N 3.14Å; K256-L259 WeakPolarHBondContact O-CB 3.43Å; K256-L259 PolarHBondContact O-N 3.37Å; K256-F261 HydrophobicContact CG-CE2 4.17Å; K256-F261 HydrophobicContact CG-CZ 4.39Å; K256-C322 HydrophobicContact CB-CB 4.24Å; K256-E325 PolarHBondContact NZ-O 3.28Å; K256-E325 VanDerWaalsContact NZ-O 3.17Å; K256-P327 WeakPolarHBondContact CE-O 3.42Å; K256-P327 PolarHBondContact NZ-O 2.94Å
257	G	92.1	Very high	90	Very high	77 Å²	77	62.6 Å²	62.6	79%	0.794	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-62.3	-13.7	174.9	0	0	0	0	0	114.9	P255 L259	P255-G257 PolarHBondContact O-N 3.37Å; P255-G257 VanDerWaalsContact O-N 3.16Å; G257-L259 VanDerWaalsContact C-N 3.28Å
258	E	91.1	Very high	89.3	Confident	47 Å²	47	61.1 Å²	61.1	22%	0.22	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-80	-8.9	171.6	-62.1	-166.8	-163.3	0	0	113.1	P255 K256 F278 R279	P255-E258 HydrophobicContact CB-CG 4.29Å; P255-E258 WeakPolarHBondContact CD-OE1 3.38Å; P255-E258 HydrophobicContact CG-CG 4.31Å; P255-E258 WeakPolarHBondContact O-CB 3.47Å; P255-E258 PolarHBondContact O-N 3.42Å; K256-E258 PolarHBondContact O-N 3.44Å; K256-E258 VanDerWaalsContact O-N 3.14Å; E258-F278 HydrophobicContact CB-CD2 4.45Å; E258-F278 HydrophobicContact CB-CE2 3.98Å; E258-F278 VanDerWaalsContact OE2-CE2 3.3Å; E258-F278 WeakPolarHBondContact OE2-CE2 3.46Å; E258-F278 WeakPolarHBondContact OE2-CZ 3.37Å; E258-R279 HydrophobicContact CB-CG 4.12Å; E258-R279 VanDerWaalsContact O-CA 3.31Å; E258-R279 WeakPolarHBondContact O-CA 3.15Å; E258-R279 PolarHBondContact O-N 3.19Å; E258-R279 IonicContact OE1-NH2 3.38Å; E258-R279 IonicContact OE2-CZ 2.78Å; E258-R279 IonicContact OE2-NE 2.68Å; E258-R279 PolarHBondContact OE2-NE 3.33Å; E258-R279 IonicContact OE2-NH2 2.65Å; E258-R279 PolarHBondContact OE2-NH2 3.09Å
259	L	93.7	Very high	88.4	Confident	11 Å²	11	65.8 Å²	65.8	6%	0.058	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	130.3	178.5	-61.6	173.2	0	0	0	111.1	I254 K256 G257 F261 F278 V285 I287 V331	I254-L259 HydrophobicContact CD1-CD2 3.94Å; I254-L259 HydrophobicContact CD1-CG 4.19Å; K256-L259 WeakPolarHBondContact O-CB 3.43Å; K256-L259 PolarHBondContact O-N 3.37Å; G257-L259 VanDerWaalsContact C-N 3.28Å; L259-F261 HydrophobicContact CB-CD2 4.42Å; L259-F261 HydrophobicContact CB-CE2 3.97Å; L259-F278 HydrophobicContact CD2-CD2 4.29Å; L259-V285 HydrophobicContact CD2-CG2 4.46Å; L259-I287 HydrophobicContact CB-CD1 4.02Å; L259-I287 HydrophobicContact CD1-CD1 4.08Å; L259-I287 HydrophobicContact CD1-CG1 4.28Å; L259-I287 HydrophobicContact CD1-CG2 4.2Å; L259-I287 HydrophobicContact CD2-CD1 4.34Å; L259-I287 HydrophobicContact CG-CD1 4.39Å; L259-V331 HydrophobicContact CD1-CG2 3.65Å; L259-V331 HydrophobicContact CD2-CG1 4.11Å; L259-V331 HydrophobicContact CD2-CG2 3.99Å; L259-V331 HydrophobicContact CG-CG2 4.43Å
260	Q	94.2	Very high	87.7	Confident	88 Å²	88	66.3 Å²	66.3	41%	0.411	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	108	169.6	-63.7	-176.1	9.4	0	0	109.3	G276 K277 R279	Q260-G276 CarbonylContact O-C 3.55Å; Q260-G276 WeakPolarHBondContact O-CA 3.46Å; Q260-K277 HydrophobicContact CB-CB 4.37Å; Q260-K277 PolarHBondContact N-O 3.1Å; Q260-K277 PolarHBondContact O-N 3.27Å; Q260-R279 WeakPolarHBondContact CG-O 3.29Å; Q260-R279 PolarHBondContact NE2-O 2.86Å
261	F	94.1	Very high	87.5	Confident	80 Å²	80	60.4 Å²	60.4	35%	0.351	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	131.3	177.9	-71.2	-103.6	0	0	0	110.5	K256 L259 W274 I287 M289	K256-F261 HydrophobicContact CG-CE2 4.17Å; K256-F261 HydrophobicContact CG-CZ 4.39Å; L259-F261 HydrophobicContact CB-CD2 4.42Å; L259-F261 HydrophobicContact CB-CE2 3.97Å; F261-W274 HydrophobicContact CD1-CB 3.94Å; F261-W274 HydrophobicContact CD1-CD2 4.39Å; F261-W274 HydrophobicContact CD1-CG 4.08Å; F261-W274 HydrophobicContact CE1-CB 4.4Å; F261-I287 HydrophobicContact CD1-CD1 4.09Å; F261-I287 HydrophobicContact CE1-CB 4.26Å; F261-I287 HydrophobicContact CE1-CD1 3.99Å; F261-I287 HydrophobicContact CE1-CG2 3.72Å; F261-I287 HydrophobicContact CE2-CD1 4.4Å; F261-I287 HydrophobicContact CG-CD1 4.35Å; F261-I287 HydrophobicContact CZ-CD1 4.15Å; F261-I287 HydrophobicContact CZ-CG2 3.89Å; F261-M289 HydrophobicContact CE1-CG 4.27Å; F261-M289 HydrophobicContact CE1-SD 3.76Å; F261-M289 HydrophobicContact CZ-SD 4.29Å
262	G	94.9	Very high	87.6	Confident	35 Å²	35	58.4 Å²	58.4	36%	0.361	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	-129.9	171.4	0	0	0	0	0	111.4	W274 Y275	G262-W274 VanDerWaalsContact O-CE3 3.25Å; G262-W274 WeakPolarHBondContact O-CZ3 3.44Å; G262-Y275 WeakPolarHBondContact CA-O 3.39Å; G262-Y275 PolarHBondContact N-O 3.36Å
263	H	95.6	Very high	87.8	Confident	106 Å²	106	58.9 Å²	58.9	49%	0.491	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	154.9	-178.5	62.8	-84.3	0	0	0	112	Y275	H263-Y275 AromaticContact CE1-CD1 3.88Å; H263-Y275 AromaticContact CE1-CG 3.68Å; H263-Y275 AromaticContact ND1-CD1 3.87Å; H263-Y275 WeakPolarHBondContact O-CB 3.08Å; H263-Y275 PolarHBondContact O-N 2.83Å
264	K	95.5	Very high	87.9	Confident	77 Å²	77	58.6 Å²	58.6	34%	0.335	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	128	174.1	-174.4	170.7	172.6	177.5	0	110.1	G266 E272 W274	K264-G266 WeakPolarHBondContact CE-O 3.44Å; K264-E272 IonicContact NZ-OE1 2.76Å; K264-E272 PolarHBondContact NZ-OE1 3.2Å; K264-W274 HydrophobicContact CB-CD2 4.15Å; K264-W274 HydrophobicContact CB-CE3 4.14Å; K264-W274 HydrophobicContact CB-CH2 4.21Å; K264-W274 HydrophobicContact CB-CZ2 4.21Å; K264-W274 HydrophobicContact CB-CZ3 4.17Å; K264-W274 HydrophobicContact CD-CZ2 4.25Å; K264-W274 HydrophobicContact CG-CZ2 4.47Å
265	L	91.9	Very high	88.1	Confident	69 Å²	69	60.1 Å²	60.1	36%	0.361	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	-33.3	177.1	-67.6	172.2	0	0	0	111.9	V273 A286 Y334	L265-V273 HydrophobicContact CB-CB 4.41Å; L265-V273 HydrophobicContact CB-CG1 4.26Å; L265-V273 HydrophobicContact CD1-CG1 4.18Å; L265-V273 PolarHBondContact N-O 3.23Å; L265-A286 HydrophobicContact CD1-CB 4.31Å; L265-Y334 HydrophobicContact CD1-CD2 4.03Å; L265-Y334 HydrophobicContact CD1-CE2 3.88Å; L265-Y334 HydrophobicContact CD2-CE2 3.9Å
266	G	87.1	Confident	88.3	Confident	29 Å²	29	57.2 Å²	57.2	30%	0.299	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-175.6	171.9	-178.8	0	0	0	0	0	113.6	K264 V273	K264-G266 WeakPolarHBondContact CE-O 3.44Å; G266-V273 PolarHBondContact N-O 2.72Å; G266-V273 PolarHBondContact O-N 2.97Å
267	Q	83.1	Confident	88.4	Confident	137 Å²	137	58.4 Å²	58.4	64%	0.64	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.8	125.8	173.4	-172.4	168.6	6.5	0	0	109	E272	Q267-E272 HydrophobicContact CG-CG 4.25Å
268	G	68.8	Low	88.3	Confident	41 Å²	41	55 Å²	55	42%	0.423	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	-174.6	177.5	0	0	0	0	0	112	F270 G271	G268-F270 PolarHBondContact O-N 3.12Å; G268-G271 PolarHBondContact N-O 3.23Å; G268-G271 PolarHBondContact O-N 3.21Å
269	N	65.6	Low	88.1	Confident	99 Å²	99	55.4 Å²	55.4	53%	0.529	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-31.4	174.9	-69.4	-22.9	0	0	0	111.9	K291	N269-K291 VanDerWaalsContact O-CE 3.27Å; N269-K291 WeakPolarHBondContact O-CE 3.35Å; N269-K291 PolarHBondContact O-NZ 3.5Å
270	F	66.2	Low	87.2	Confident	69 Å²	69	63 Å²	63	30%	0.303	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-10.1	-174.4	-50	-57.1	0	0	0	114.4	G268 L290 K291 I409	G268-F270 PolarHBondContact O-N 3.12Å; F270-L290 HydrophobicContact CB-CD2 4.49Å; F270-L290 WeakPolarHBondContact O-CA 3.37Å; F270-K291 PolarHBondContact O-N 3.43Å; F270-K291 VanDerWaalsContact O-N 3.09Å; F270-I409 HydrophobicContact CD1-CD1 3.24Å; F270-I409 HydrophobicContact CE1-CD1 3.15Å; F270-I409 HydrophobicContact CE1-CG1 4.44Å; F270-I409 HydrophobicContact CE1-CG2 4.25Å; F270-I409 HydrophobicContact CG-CD1 4.18Å; F270-I409 HydrophobicContact CZ-CD1 4.03Å
271	G	78.1	Confident	86.4	Confident	9 Å²	9	59.3 Å²	59.3	9%	0.093	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	139.2	-147.1	-179.8	0	0	0	0	0	112.6	G268 M289	G268-G271 PolarHBondContact N-O 3.23Å; G268-G271 PolarHBondContact O-N 3.21Å; G271-M289 WeakPolarHBondContact CA-O 3.4Å
272	E	89.9	Confident	85.6	Confident	52 Å²	52	60.3 Å²	60.3	24%	0.243	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	142.4	-174.5	-57.6	-172.4	144.5	0	0	110.9	K264 Q267 W274 M289	K264-E272 IonicContact NZ-OE1 2.76Å; K264-E272 PolarHBondContact NZ-OE1 3.2Å; Q267-E272 HydrophobicContact CG-CG 4.25Å; E272-W274 WeakPolarHBondContact OE2-CZ2 3.46Å; E272-W274 PolarHBondContact OE2-NE1 3.19Å; E272-M289 HydrophobicContact CB-CE 4.15Å; E272-M289 PolarHBondContact N-O 3Å; E272-M289 PolarHBondContact O-N 3.48Å; E272-M289 WeakPolarHBondContact OE2-CE 3.45Å
273	V	92.9	Very high	85.1	Confident	42 Å²	42	58.9 Å²	58.9	26%	0.255	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	127.2	173.6	-171.6	0	0	0	0	108	L265 G266 A286 I287 K288	L265-V273 HydrophobicContact CB-CB 4.41Å; L265-V273 HydrophobicContact CB-CG1 4.26Å; L265-V273 HydrophobicContact CD1-CG1 4.18Å; L265-V273 PolarHBondContact N-O 3.23Å; G266-V273 PolarHBondContact N-O 2.72Å; G266-V273 PolarHBondContact O-N 2.97Å; V273-A286 HydrophobicContact CG1-CB 4.36Å; V273-I287 CarbonylContact C-O 3.57Å; V273-I287 WeakPolarHBondContact CA-O 3.4Å; V273-K288 HydrophobicContact CG2-CB 4.36Å; V273-K288 HydrophobicContact CG2-CG 4.17Å
274	W	96.2	Very high	84.9	Confident	63 Å²	63	58.9 Å²	58.9	24%	0.239	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	140.1	-177.9	-70	77.2	0	0	0	110.2	F261 G262 K264 E272 I287	F261-W274 HydrophobicContact CD1-CB 3.94Å; F261-W274 HydrophobicContact CD1-CD2 4.39Å; F261-W274 HydrophobicContact CD1-CG 4.08Å; F261-W274 HydrophobicContact CE1-CB 4.4Å; G262-W274 VanDerWaalsContact O-CE3 3.25Å; G262-W274 WeakPolarHBondContact O-CZ3 3.44Å; K264-W274 HydrophobicContact CB-CD2 4.15Å; K264-W274 HydrophobicContact CB-CE3 4.14Å; K264-W274 HydrophobicContact CB-CH2 4.21Å; K264-W274 HydrophobicContact CB-CZ2 4.21Å; K264-W274 HydrophobicContact CB-CZ3 4.17Å; K264-W274 HydrophobicContact CD-CZ2 4.25Å; K264-W274 HydrophobicContact CG-CZ2 4.47Å; E272-W274 WeakPolarHBondContact OE2-CZ2 3.46Å; E272-W274 PolarHBondContact OE2-NE1 3.19Å; W274-I287 HydrophobicContact CB-CB 4.42Å; W274-I287 PolarHBondContact N-O 2.91Å; W274-I287 PolarHBondContact O-N 3.41Å
275	Y	96.7	Very high	84.9	Confident	38 Å²	38	55.2 Å²	55.2	15%	0.149	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	142.7	162.3	170	-95	0	0	0	108	G262 H263 K284 Y334	G262-Y275 WeakPolarHBondContact CA-O 3.39Å; G262-Y275 PolarHBondContact N-O 3.36Å; H263-Y275 AromaticContact CE1-CD1 3.88Å; H263-Y275 AromaticContact CE1-CG 3.68Å; H263-Y275 AromaticContact ND1-CD1 3.87Å; H263-Y275 WeakPolarHBondContact O-CB 3.08Å; H263-Y275 PolarHBondContact O-N 2.83Å; Y275-K284 HydrophobicContact CE2-CB 3.97Å; Y275-K284 HydrophobicContact CE2-CD 4.13Å; Y275-K284 HydrophobicContact CE2-CG 4.05Å; Y275-K284 WeakPolarHBondContact OH-CG 3.45Å; Y275-Y334 HydrophobicContact CD2-CD1 4.12Å; Y275-Y334 AromaticContact CD2-CD2 3.94Å; Y275-Y334 HydrophobicContact CD2-CD2 3.94Å; Y275-Y334 HydrophobicContact CD2-CE1 4.03Å; Y275-Y334 AromaticContact CD2-CE2 3.88Å; Y275-Y334 HydrophobicContact CD2-CE2 3.88Å; Y275-Y334 HydrophobicContact CD2-CG 4.05Å; Y275-Y334 AromaticContact CD2-CZ 3.91Å; Y275-Y334 AromaticContact CE2-CD1 3.93Å; Y275-Y334 HydrophobicContact CE2-CD1 3.93Å; Y275-Y334 AromaticContact CE2-CE1 3.92Å; Y275-Y334 HydrophobicContact CE2-CE1 3.92Å; Y275-Y334 HydrophobicContact CE2-CG 4.24Å
276	G	95.4	Very high	85	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	-179.1	172	0	0	0	0	0	113.3	Q260 V285	Q260-G276 CarbonylContact O-C 3.55Å; Q260-G276 WeakPolarHBondContact O-CA 3.46Å; G276-V285 PolarHBondContact N-O 3.33Å; G276-V285 WeakPolarHBondContact O-CG2 3.38Å; G276-V285 PolarHBondContact O-N 2.82Å
277	K	93.3	Very high	85.4	Confident	58 Å²	58	50.9 Å²	50.9	25%	0.252	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	144.7	170	-67.2	-175.5	171.1	-159.3	0	109.9	Q260 S281 D282 A283	Q260-K277 HydrophobicContact CB-CB 4.37Å; Q260-K277 PolarHBondContact N-O 3.1Å; Q260-K277 PolarHBondContact O-N 3.27Å; K277-S281 WeakPolarHBondContact CD-O 3.49Å; K277-D282 IonicContact NZ-OD1 3.99Å; K277-D282 PolarHBondContact NZ-OD1 3.07Å; K277-A283 VanDerWaalsContact CA-O 3.29Å; K277-A283 WeakPolarHBondContact CA-O 3.37Å
278	F	90.4	Very high	85.8	Confident	6 Å²	6	45.3 Å²	45.3	3%	0.026	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	118.4	169.8	-179.7	-117.3	0	0	0	110	L244 T248 I254 E258 L259 S281 A283	L244-F278 HydrophobicContact CB-CD1 3.78Å; L244-F278 HydrophobicContact CB-CE1 3.98Å; L244-F278 HydrophobicContact CB-CG 4.25Å; L244-F278 HydrophobicContact CD1-CB 4.07Å; L244-F278 HydrophobicContact CD1-CD1 4.23Å; L244-F278 HydrophobicContact CD1-CD2 3.97Å; L244-F278 HydrophobicContact CD1-CE2 4.46Å; L244-F278 HydrophobicContact CD1-CG 3.83Å; L244-F278 HydrophobicContact CD2-CB 3.81Å; L244-F278 HydrophobicContact CD2-CD1 4.29Å; L244-F278 HydrophobicContact CD2-CG 4.18Å; L244-F278 HydrophobicContact CG-CB 4.42Å; L244-F278 HydrophobicContact CG-CD1 4.31Å; L244-F278 HydrophobicContact CG-CG 4.3Å; T248-F278 HydrophobicContact CG2-CE1 4.47Å; T248-F278 HydrophobicContact CG2-CZ 3.92Å; I254-F278 HydrophobicContact CD1-CD2 4.02Å; I254-F278 HydrophobicContact CD1-CE2 3.77Å; E258-F278 HydrophobicContact CB-CD2 4.45Å; E258-F278 HydrophobicContact CB-CE2 3.98Å; E258-F278 VanDerWaalsContact OE2-CE2 3.3Å; E258-F278 WeakPolarHBondContact OE2-CE2 3.46Å; E258-F278 WeakPolarHBondContact OE2-CZ 3.37Å; L259-F278 HydrophobicContact CD2-CD2 4.29Å; F278-S281 WeakPolarHBondContact O-CB 3.48Å; F278-S281 PolarHBondContact O-N 3.39Å; F278-S281 PolarHBondContact O-OG 2.97Å; F278-A283 HydrophobicContact CB-CB 4.2Å; F278-A283 PolarHBondContact N-O 2.69Å; F278-A283 VanDerWaalsContact N-O 3.07Å
279	R	85.9	Confident	86.8	Confident	55 Å²	55	45 Å²	45	21%	0.208	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.7	-147.2	-173	-58.2	176.5	-176.6	160.2	-2.1	110.3	E85 E258 Q260 S281	E85-R279 IonicContact OE1-CZ 2.74Å; E85-R279 IonicContact OE1-NH1 2.71Å; E85-R279 PolarHBondContact OE1-NH1 3.15Å; E85-R279 IonicContact OE1-NH2 3.78Å; E85-R279 PolarHBondContact OE1-NH2 2.79Å; E85-R279 IonicContact OE2-CZ 3.68Å; E85-R279 IonicContact OE2-NH1 2.87Å; E85-R279 PolarHBondContact OE2-NH1 3.07Å; E85-R279 IonicContact OE2-NH2 2.71Å; E258-R279 HydrophobicContact CB-CG 4.12Å; E258-R279 VanDerWaalsContact O-CA 3.31Å; E258-R279 WeakPolarHBondContact O-CA 3.15Å; E258-R279 PolarHBondContact O-N 3.19Å; E258-R279 IonicContact OE1-NH2 3.38Å; E258-R279 IonicContact OE2-CZ 2.78Å; E258-R279 IonicContact OE2-NE 2.68Å; E258-R279 PolarHBondContact OE2-NE 3.33Å; E258-R279 IonicContact OE2-NH2 2.65Å; E258-R279 PolarHBondContact OE2-NH2 3.09Å; Q260-R279 WeakPolarHBondContact CG-O 3.29Å; Q260-R279 PolarHBondContact NE2-O 2.86Å; R279-S281 PolarHBondContact O-N 3.36Å
280	K	74.9	Confident	87.6	Confident	171 Å²	171	40.6 Å²	40.6	74%	0.743	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.9	14.6	174.6	-68.2	179.5	179.6	-179.6	0	113.2	M84	M84-K280 HydrophobicContact CE-CB 4.29Å
281	S	78.1	Confident	88.2	Confident	9 Å²	9	42.6 Å²	42.6	6%	0.063	20%	0.198	C	C	.	.	S	Bend	trans	-83	167.8	-179.4	79.9	0	0	0	0	112	K277 F278 R279 A283	K277-S281 WeakPolarHBondContact CD-O 3.49Å; F278-S281 WeakPolarHBondContact O-CB 3.48Å; F278-S281 PolarHBondContact O-N 3.39Å; F278-S281 PolarHBondContact O-OG 2.97Å; R279-S281 PolarHBondContact O-N 3.36Å; S281-A283 PolarHBondContact O-N 3.28Å; S281-A283 WeakPolarHBondContact OG-CB 3.47Å; S281-A283 PolarHBondContact OG-N 3.27Å
282	D	76.9	Confident	88.1	Confident	101 Å²	101	45.9 Å²	45.9	54%	0.54	22%	0.223	S	C	.	.	S	Bend	trans	-81.4	11.5	171	-89.6	-20.6	0	0	0	114.5	K277 K284	K277-D282 IonicContact NZ-OD1 3.99Å; K277-D282 PolarHBondContact NZ-OD1 3.07Å; D282-K284 PolarHBondContact O-N 2.95Å
283	A	84.5	Confident	87.3	Confident	5 Å²	5	46.6 Å²	46.6	4%	0.041	25%	0.245	C	C	.	.			trans	-69.4	98.4	174.1	0	0	0	0	0	111	R241 L244 K277 F278 S281	R241-A283 VanDerWaalsContact NH1-CB 3.34Å; L244-A283 HydrophobicContact CD2-CB 3.9Å; K277-A283 VanDerWaalsContact CA-O 3.29Å; K277-A283 WeakPolarHBondContact CA-O 3.37Å; F278-A283 HydrophobicContact CB-CB 4.2Å; F278-A283 PolarHBondContact N-O 2.69Å; F278-A283 VanDerWaalsContact N-O 3.07Å; S281-A283 PolarHBondContact O-N 3.28Å; S281-A283 WeakPolarHBondContact OG-CB 3.47Å; S281-A283 PolarHBondContact OG-N 3.27Å
284	K	91.9	Very high	86.1	Confident	107 Å²	107	46.4 Å²	46.4	47%	0.465	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	132.5	176.6	-57.5	179.1	-174.3	167.3	0	110.3	Y275 D282 Y334	Y275-K284 HydrophobicContact CE2-CB 3.97Å; Y275-K284 HydrophobicContact CE2-CD 4.13Å; Y275-K284 HydrophobicContact CE2-CG 4.05Å; Y275-K284 WeakPolarHBondContact OH-CG 3.45Å; D282-K284 PolarHBondContact O-N 2.95Å; K284-Y334 HydrophobicContact CB-CD1 3.88Å; K284-Y334 HydrophobicContact CB-CG 4.25Å; K284-Y334 HydrophobicContact CD-CD1 4.05Å; K284-Y334 HydrophobicContact CD-CE1 4.43Å
285	V	94.8	Very high	85	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	154.4	-178.1	-63.9	0	0	0	0	111.9	L244 L259 G276 I287 Y319 V331 T332	L244-V285 HydrophobicContact CD1-CG1 4.47Å; L244-V285 HydrophobicContact CD2-CG1 3.73Å; L259-V285 HydrophobicContact CD2-CG2 4.46Å; G276-V285 PolarHBondContact N-O 3.33Å; G276-V285 WeakPolarHBondContact O-CG2 3.38Å; G276-V285 PolarHBondContact O-N 2.82Å; V285-I287 HydrophobicContact CG2-CD1 4.2Å; V285-I287 HydrophobicContact CG2-CG1 3.91Å; V285-Y319 HydrophobicContact CG1-CD2 4.03Å; V285-Y319 HydrophobicContact CG1-CE2 4.39Å; V285-V331 HydrophobicContact CB-CG1 3.67Å; V285-V331 HydrophobicContact CG1-CG1 3.75Å; V285-V331 HydrophobicContact CG2-CG1 3.93Å; V285-T332 WeakPolarHBondContact CA-O 3.45Å; V285-T332 WeakPolarHBondContact CB-O 3.32Å
286	A	95.3	Very high	84.1	Confident	7 Å²	7	45.9 Å²	45.9	6%	0.058	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	122.5	165.2	0	0	0	0	0	109.3	L265 V273 T332	L265-A286 HydrophobicContact CD1-CB 4.31Å; V273-A286 HydrophobicContact CG1-CB 4.36Å; A286-T332 PolarHBondContact N-O 2.77Å; A286-T332 PolarHBondContact O-N 2.99Å; A286-T332 PolarHBondContact O-OG1 3.22Å
287	I	94.5	Very high	83.2	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	104.2	-175.8	-53.6	164.5	0	0	0	108.1	L259 F261 V273 W274 V285 M289 C329 I330	L259-I287 HydrophobicContact CB-CD1 4.02Å; L259-I287 HydrophobicContact CD1-CD1 4.08Å; L259-I287 HydrophobicContact CD1-CG1 4.28Å; L259-I287 HydrophobicContact CD1-CG2 4.2Å; L259-I287 HydrophobicContact CD2-CD1 4.34Å; L259-I287 HydrophobicContact CG-CD1 4.39Å; F261-I287 HydrophobicContact CD1-CD1 4.09Å; F261-I287 HydrophobicContact CE1-CB 4.26Å; F261-I287 HydrophobicContact CE1-CD1 3.99Å; F261-I287 HydrophobicContact CE1-CG2 3.72Å; F261-I287 HydrophobicContact CE2-CD1 4.4Å; F261-I287 HydrophobicContact CG-CD1 4.35Å; F261-I287 HydrophobicContact CZ-CD1 4.15Å; F261-I287 HydrophobicContact CZ-CG2 3.89Å; V273-I287 CarbonylContact C-O 3.57Å; V273-I287 WeakPolarHBondContact CA-O 3.4Å; W274-I287 HydrophobicContact CB-CB 4.42Å; W274-I287 PolarHBondContact N-O 2.91Å; W274-I287 PolarHBondContact O-N 3.41Å; V285-I287 HydrophobicContact CG2-CD1 4.2Å; V285-I287 HydrophobicContact CG2-CG1 3.91Å; I287-M289 HydrophobicContact CG2-CG 4.39Å; I287-C329 HydrophobicContact CG2-CB 3.92Å; I287-I330 CarbonylContact C-O 3.5Å; I287-I330 WeakPolarHBondContact CA-O 2.89Å
288	K	91.3	Very high	82.7	Confident	20 Å²	20	52.7 Å²	52.7	9%	0.087	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	106.1	176	-175.9	174.5	-173.1	175.8	0	108.9	V273 C329 I330 D402 L405	V273-K288 HydrophobicContact CG2-CB 4.36Å; V273-K288 HydrophobicContact CG2-CG 4.17Å; K288-C329 CarbonylContact O-C 3.59Å; K288-C329 WeakPolarHBondContact O-CA 3.48Å; K288-C329 WeakPolarHBondContact O-CB 3.38Å; K288-I330 HydrophobicContact CB-CB 4.45Å; K288-I330 PolarHBondContact N-O 3.45Å; K288-I330 PolarHBondContact O-N 3.05Å; K288-D402 IonicContact NZ-OD1 2.81Å; K288-D402 PolarHBondContact NZ-OD1 3.16Å; K288-D402 IonicContact NZ-OD2 3.94Å; K288-D402 PolarHBondContact NZ-OD2 3.35Å; K288-L405 HydrophobicContact CD-CD1 4.33Å; K288-L405 VanDerWaalsContact NZ-CD1 3.29Å
289	M	89.4	Confident	81.9	Confident	33 Å²	33	53.3 Å²	53.3	16%	0.163	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	125.1	174.1	-59	-168	-54.2	0	0	109.4	F261 G271 E272 I287 P327 C329	F261-M289 HydrophobicContact CE1-CG 4.27Å; F261-M289 HydrophobicContact CE1-SD 3.76Å; F261-M289 HydrophobicContact CZ-SD 4.29Å; G271-M289 WeakPolarHBondContact CA-O 3.4Å; E272-M289 HydrophobicContact CB-CE 4.15Å; E272-M289 PolarHBondContact N-O 3Å; E272-M289 PolarHBondContact O-N 3.48Å; E272-M289 WeakPolarHBondContact OE2-CE 3.45Å; I287-M289 HydrophobicContact CG2-CG 4.39Å; M289-P327 HydrophobicContact SD-CG 4.32Å; M289-C329 HydrophobicContact CG-CB 4.13Å
290	L	82.4	Confident	81.7	Confident	8 Å²	8	50.8 Å²	50.8	4%	0.042	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	149.5	176.9	-66.5	173	0	0	0	110.7	F270 A292 M295 F300 P327 M328	F270-L290 HydrophobicContact CB-CD2 4.49Å; F270-L290 WeakPolarHBondContact O-CA 3.37Å; L290-A292 PolarHBondContact O-N 3.22Å; L290-M295 HydrophobicContact CD1-CG 4.39Å; L290-M295 HydrophobicContact CD1-SD 3.59Å; L290-M295 VanDerWaalsContact CD1-SD 3.59Å; L290-F300 HydrophobicContact CD1-CD2 3.26Å; L290-F300 HydrophobicContact CD1-CE2 3.25Å; L290-F300 HydrophobicContact CD1-CG 4.4Å; L290-F300 HydrophobicContact CD1-CZ 4.41Å; L290-F300 HydrophobicContact CG-CE2 4.37Å; L290-P327 WeakPolarHBondContact O-CB 3.47Å; L290-M328 PolarHBondContact N-O 2.99Å
291	K	79.2	Confident	82	Confident	111 Å²	111	46.4 Å²	46.4	48%	0.483	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-65.6	133.1	170.2	-71.7	177.1	178.8	169.3	0	109.4	N269 F270 G293 S294	N269-K291 VanDerWaalsContact O-CE 3.27Å; N269-K291 WeakPolarHBondContact O-CE 3.35Å; N269-K291 PolarHBondContact O-NZ 3.5Å; F270-K291 PolarHBondContact O-N 3.43Å; F270-K291 VanDerWaalsContact O-N 3.09Å; K291-G293 PolarHBondContact O-N 3.39Å; K291-S294 VanDerWaalsContact O-CB 3.25Å; K291-S294 WeakPolarHBondContact O-CB 3.46Å; K291-S294 PolarHBondContact O-N 3.23Å; K291-S294 PolarHBondContact O-OG 3.46Å
292	A	76.8	Confident	82	Confident	77 Å²	77	51 Å²	51	64%	0.636	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	132.3	175.3	0	0	0	0	0	110.4	L290 S294	L290-A292 PolarHBondContact O-N 3.22Å; A292-S294 VanDerWaalsContact C-N 3.28Å; A292-S294 PolarHBondContact O-N 3.22Å
293	G	72	Confident	81.8	Confident	68 Å²	68	46.6 Å²	46.6	70%	0.701	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.3	7.9	-179	0	0	0	0	0	115.8	K291 M295	K291-G293 PolarHBondContact O-N 3.39Å; G293-M295 VanDerWaalsContact C-N 3.28Å; G293-M295 PolarHBondContact O-N 3.33Å
294	S	69.1	Low	81.8	Confident	37 Å²	37	46.5 Å²	46.5	26%	0.259	27%	0.268	S	S	.	.	S	Bend	trans	-72.9	-18.9	175.3	57.6	0	0	0	0	114.2	K291 A292	K291-S294 VanDerWaalsContact O-CB 3.25Å; K291-S294 WeakPolarHBondContact O-CB 3.46Å; K291-S294 PolarHBondContact O-N 3.23Å; K291-S294 PolarHBondContact O-OG 3.46Å; A292-S294 VanDerWaalsContact C-N 3.28Å; A292-S294 PolarHBondContact O-N 3.22Å
295	M	73.3	Confident	81.4	Confident	18 Å²	18	43.1 Å²	43.1	9%	0.089	26%	0.258	C	S	.	.	S	Bend	trans	-163.6	159.8	174.3	64.5	-161.9	-38.9	0	0	110.6	L290 G293 F300 M328 V408	L290-M295 HydrophobicContact CD1-CG 4.39Å; L290-M295 HydrophobicContact CD1-SD 3.59Å; L290-M295 VanDerWaalsContact CD1-SD 3.59Å; G293-M295 VanDerWaalsContact C-N 3.28Å; G293-M295 PolarHBondContact O-N 3.33Å; M295-F300 HydrophobicContact CE-CB 4.27Å; M295-F300 HydrophobicContact CG-CB 4.04Å; M295-F300 HydrophobicContact SD-CB 3.9Å; M295-F300 HydrophobicContact SD-CD2 3.69Å; M295-F300 HydrophobicContact SD-CG 4.29Å; M295-M328 HydrophobicContact CG-CE 4.34Å; M295-V408 HydrophobicContact CB-CG1 3.9Å; M295-V408 HydrophobicContact CE-CB 3.54Å; M295-V408 HydrophobicContact CE-CG1 3.48Å; M295-V408 VanDerWaalsContact CE-CG1 3.48Å; M295-V408 HydrophobicContact CE-CG2 3.95Å
296	S	76.1	Confident	80.8	Confident	72 Å²	72	46 Å²	46	50%	0.503	27%	0.273	S	S	.	.			trans	-72.2	150.5	173.4	76.4	0	0	0	0	111.3	Q298 A299 F300	S296-Q298 PolarHBondContact O-N 3.12Å; S296-A299 PolarHBondContact O-N 3.05Å; S296-A299 VanDerWaalsContact OG-CB 3.29Å; S296-A299 WeakPolarHBondContact OG-CB 3.5Å; S296-A299 PolarHBondContact OG-N 3.05Å; S296-A299 VanDerWaalsContact OG-N 3.15Å; S296-F300 WeakPolarHBondContact O-CB 3.37Å; S296-F300 PolarHBondContact O-N 3.33Å
297	C	78	Confident	80.3	Confident	64 Å²	64	46.2 Å²	46.2	43%	0.432	27%	0.273	S	S	.	.	H	α-helix	trans	-58.5	-37.3	177.1	-177.8	0	0	0	0	112.1	F301 M328	C297-F301 WeakPolarHBondContact O-CB 3.38Å; C297-F301 PolarHBondContact O-N 2.85Å; C297-M328 HydrophobicContact CB-SD 3.93Å
298	Q	81	Confident	79.9	Confident	138 Å²	138	48.2 Å²	48.2	65%	0.645	28%	0.281	S	S	*	.	H	α-helix	trans	-65.3	-48.6	176.7	-177.3	176.1	-14.3	0	0	112	S296 F300 F301 E302	S296-Q298 PolarHBondContact O-N 3.12Å; Q298-F300 VanDerWaalsContact C-N 3.29Å; Q298-F300 PolarHBondContact O-N 2.84Å; Q298-F301 PolarHBondContact O-N 3.45Å; Q298-F301 VanDerWaalsContact O-N 3.17Å; Q298-E302 HydrophobicContact CG-CG 4.5Å; Q298-E302 WeakPolarHBondContact CG-OE1 3.4Å; Q298-E302 PolarHBondContact NE2-OE1 3.47Å; Q298-E302 WeakPolarHBondContact O-CG 3Å; Q298-E302 PolarHBondContact O-N 3.12Å
299	A	75.5	Confident	79.6	Confident	19 Å²	19	54.1 Å²	54.1	16%	0.157	31%	0.309	C	S	.	.	H	α-helix	trans	-64	-38	179.7	0	0	0	0	0	111.5	S296 E303 V408	S296-A299 PolarHBondContact O-N 3.05Å; S296-A299 VanDerWaalsContact OG-CB 3.29Å; S296-A299 WeakPolarHBondContact OG-CB 3.5Å; S296-A299 PolarHBondContact OG-N 3.05Å; S296-A299 VanDerWaalsContact OG-N 3.15Å; A299-E303 WeakPolarHBondContact O-CB 3.42Å; A299-E303 PolarHBondContact O-N 3.26Å; A299-V408 HydrophobicContact CB-CB 4.49Å; A299-V408 HydrophobicContact CB-CG1 3.6Å; A299-V408 HydrophobicContact CB-CG2 4.01Å
300	F	81	Confident	79.5	Confident	2 Å²	2	52.9 Å²	52.9	1%	0.009	30%	0.304	C	S	.	.	H	α-helix	trans	-59.6	-47.9	171.9	174.7	-91.9	0	0	0	112.3	L290 M295 S296 Q298 E303 A304 V321 T323 M328 I330	L290-F300 HydrophobicContact CD1-CD2 3.26Å; L290-F300 HydrophobicContact CD1-CE2 3.25Å; L290-F300 HydrophobicContact CD1-CG 4.4Å; L290-F300 HydrophobicContact CD1-CZ 4.41Å; L290-F300 HydrophobicContact CG-CE2 4.37Å; M295-F300 HydrophobicContact CE-CB 4.27Å; M295-F300 HydrophobicContact CG-CB 4.04Å; M295-F300 HydrophobicContact SD-CB 3.9Å; M295-F300 HydrophobicContact SD-CD2 3.69Å; M295-F300 HydrophobicContact SD-CG 4.29Å; S296-F300 WeakPolarHBondContact O-CB 3.37Å; S296-F300 PolarHBondContact O-N 3.33Å; Q298-F300 VanDerWaalsContact C-N 3.29Å; Q298-F300 PolarHBondContact O-N 2.84Å; F300-E303 PolarHBondContact O-N 2.85Å; F300-A304 WeakPolarHBondContact O-CB 3.46Å; F300-A304 PolarHBondContact O-N 3.19Å; F300-V321 HydrophobicContact CE1-CB 3.68Å; F300-V321 HydrophobicContact CE1-CG1 3.65Å; F300-V321 HydrophobicContact CE1-CG2 4.18Å; F300-V321 HydrophobicContact CZ-CB 3.97Å; F300-V321 HydrophobicContact CZ-CG1 3.67Å; F300-T323 HydrophobicContact CD1-CG2 3.26Å; F300-T323 HydrophobicContact CE1-CG2 3.22Å; F300-T323 HydrophobicContact CG-CG2 4.47Å; F300-T323 HydrophobicContact CZ-CG2 4.39Å; F300-M328 HydrophobicContact CB-CE 4.32Å; F300-M328 HydrophobicContact CB-SD 4.45Å; F300-M328 HydrophobicContact CD1-SD 4.3Å; F300-M328 HydrophobicContact CG-SD 4.34Å; F300-I330 HydrophobicContact CE2-CD1 3.67Å; F300-I330 HydrophobicContact CE2-CG1 3.35Å; F300-I330 HydrophobicContact CZ-CD1 4.17Å; F300-I330 HydrophobicContact CZ-CG1 3.41Å; F300-I330 VanDerWaalsContact CZ-CG1 3.41Å
301	F	81.5	Confident	79.7	Confident	79 Å²	79	56.7 Å²	56.7	35%	0.346	32%	0.324	S	S	.	.	H	α-helix	trans	-67.2	-42.7	-177.7	-168.4	-89.7	0	0	0	112.2	W252 C297 Q298 E303 A304 S305	W252-F301 HydrophobicContact CH2-CD2 4.01Å; W252-F301 HydrophobicContact CH2-CE1 4.43Å; W252-F301 AromaticContact CH2-CE2 3.84Å; W252-F301 HydrophobicContact CH2-CE2 3.84Å; W252-F301 HydrophobicContact CH2-CG 4.39Å; W252-F301 HydrophobicContact CH2-CZ 4.06Å; W252-F301 HydrophobicContact CZ2-CD2 4.35Å; W252-F301 AromaticContact CZ2-CE1 3.98Å; W252-F301 HydrophobicContact CZ2-CE1 3.98Å; W252-F301 AromaticContact CZ2-CE2 3.77Å; W252-F301 HydrophobicContact CZ2-CE2 3.77Å; W252-F301 AromaticContact CZ2-CZ 3.56Å; W252-F301 HydrophobicContact CZ2-CZ 3.56Å; C297-F301 WeakPolarHBondContact O-CB 3.38Å; C297-F301 PolarHBondContact O-N 2.85Å; Q298-F301 PolarHBondContact O-N 3.45Å; Q298-F301 VanDerWaalsContact O-N 3.17Å; F301-E303 VanDerWaalsContact C-N 3.28Å; F301-E303 PolarHBondContact O-N 3.47Å; F301-A304 PolarHBondContact O-N 3.27Å; F301-S305 WeakPolarHBondContact O-CB 3.37Å; F301-S305 PolarHBondContact O-N 3.17Å
302	E	77.4	Confident	80.2	Confident	105 Å²	105	52.2 Å²	52.2	49%	0.491	31%	0.305	S	S	.	.	H	α-helix	trans	-57.5	-43.3	175.8	-75.3	175.5	-165.6	0	0	111	Q298 S305 I306	Q298-E302 HydrophobicContact CG-CG 4.5Å; Q298-E302 WeakPolarHBondContact CG-OE1 3.4Å; Q298-E302 PolarHBondContact NE2-OE1 3.47Å; Q298-E302 WeakPolarHBondContact O-CG 3Å; Q298-E302 PolarHBondContact O-N 3.12Å; E302-S305 WeakPolarHBondContact O-CB 3.48Å; E302-S305 PolarHBondContact O-N 3.42Å; E302-S305 PolarHBondContact O-OG 3.45Å; E302-I306 PolarHBondContact O-N 2.95Å
303	E	73.2	Confident	80.8	Confident	9 Å²	9	52 Å²	52	4%	0.042	30%	0.297	C	S	.	.	H	α-helix	trans	-74.6	-42.8	-178.3	-153.4	-156.8	104	0	0	113.1	A299 F300 F301 S305 I306 M307 L405 V408	A299-E303 WeakPolarHBondContact O-CB 3.42Å; A299-E303 PolarHBondContact O-N 3.26Å; F300-E303 PolarHBondContact O-N 2.85Å; F301-E303 VanDerWaalsContact C-N 3.28Å; F301-E303 PolarHBondContact O-N 3.47Å; E303-S305 PolarHBondContact O-N 2.78Å; E303-I306 WeakPolarHBondContact O-CB 3.32Å; E303-I306 PolarHBondContact O-N 2.92Å; E303-M307 PolarHBondContact O-N 2.92Å; E303-L405 WeakPolarHBondContact OE1-CA 3.48Å; E303-L405 WeakPolarHBondContact OE1-CD2 3.5Å; E303-L405 VanDerWaalsContact OE1-CG 3.31Å; E303-L405 WeakPolarHBondContact OE1-CG 3.25Å; E303-L405 PolarHBondContact OE1-N 3.43Å; E303-L405 VanDerWaalsContact OE2-CA 3.3Å; E303-L405 WeakPolarHBondContact OE2-CA 3.35Å; E303-V408 WeakPolarHBondContact OE2-CG2 3.46Å
304	A	83.7	Confident	81.9	Confident	3 Å²	3	49.3 Å²	49.3	3%	0.025	27%	0.266	C	S	.	.	H	α-helix	trans	-61.4	-30.3	172.8	0	0	0	0	0	111.2	W252 F300 F301 I306 M307 K308 L318 V321	W252-A304 HydrophobicContact CH2-CB 3.66Å; W252-A304 HydrophobicContact CZ3-CB 3.48Å; W252-A304 VanDerWaalsContact CZ3-CB 3.48Å; F300-A304 WeakPolarHBondContact O-CB 3.46Å; F300-A304 PolarHBondContact O-N 3.19Å; F301-A304 PolarHBondContact O-N 3.27Å; A304-I306 VanDerWaalsContact C-N 3.34Å; A304-I306 PolarHBondContact O-N 2.78Å; A304-M307 PolarHBondContact O-N 3.25Å; A304-K308 VanDerWaalsContact O-CB 3.29Å; A304-K308 WeakPolarHBondContact O-CB 3.34Å; A304-K308 PolarHBondContact O-N 2.96Å; A304-L318 HydrophobicContact CB-CD2 3.97Å; A304-L318 WeakPolarHBondContact O-CD2 3.46Å; A304-V321 HydrophobicContact CB-CG1 3.71Å
305	S	83.4	Confident	83.1	Confident	35 Å²	35	47.6 Å²	47.6	25%	0.245	26%	0.255	C	S	.	.	H	α-helix	trans	-66.6	-33	173.7	85.3	0	0	0	0	113.2	F301 E302 E303 Q309	F301-S305 WeakPolarHBondContact O-CB 3.37Å; F301-S305 PolarHBondContact O-N 3.17Å; E302-S305 WeakPolarHBondContact O-CB 3.48Å; E302-S305 PolarHBondContact O-N 3.42Å; E302-S305 PolarHBondContact O-OG 3.45Å; E303-S305 PolarHBondContact O-N 2.78Å; S305-Q309 WeakPolarHBondContact O-CG 3.5Å; S305-Q309 PolarHBondContact O-N 3.3Å; S305-Q309 PolarHBondContact O-NE2 3.47Å
306	I	81.9	Confident	84	Confident	61 Å²	61	47.1 Å²	47.1	31%	0.313	25%	0.252	S	S	.	.	H	α-helix	trans	-70.2	-47	173.2	-63.5	168.9	0	0	0	109.2	E302 E303 A304 K308 Q309 C310 M376	E302-I306 PolarHBondContact O-N 2.95Å; E303-I306 WeakPolarHBondContact O-CB 3.32Å; E303-I306 PolarHBondContact O-N 2.92Å; A304-I306 VanDerWaalsContact C-N 3.34Å; A304-I306 PolarHBondContact O-N 2.78Å; I306-K308 VanDerWaalsContact C-N 3.26Å; I306-K308 PolarHBondContact O-N 3.29Å; I306-Q309 WeakPolarHBondContact O-CB 3.35Å; I306-Q309 PolarHBondContact O-N 2.83Å; I306-Q309 VanDerWaalsContact O-N 3.13Å; I306-C310 PolarHBondContact O-N 3.43Å; I306-C310 PolarHBondContact O-SG 3.5Å; I306-M376 HydrophobicContact CG2-SD 3.68Å
307	M	85.4	Confident	84.8	Confident	12 Å²	12	44.8 Å²	44.8	6%	0.059	23%	0.233	C	C	.	.	H	α-helix	trans	-63.1	-33.9	178.7	-156.7	171.1	90.8	0	0	111.8	E303 A304 Q309 C310 L318 I330 T332 F403	E303-M307 PolarHBondContact O-N 2.92Å; A304-M307 PolarHBondContact O-N 3.25Å; M307-Q309 VanDerWaalsContact C-N 3.27Å; M307-Q309 PolarHBondContact O-N 2.84Å; M307-C310 WeakPolarHBondContact O-CB 3.39Å; M307-C310 PolarHBondContact O-N 3.12Å; M307-C310 VanDerWaalsContact O-N 3.12Å; M307-L318 HydrophobicContact CB-CB 4.47Å; M307-L318 HydrophobicContact CB-CD2 4.01Å; M307-L318 HydrophobicContact CE-CB 3.6Å; M307-L318 HydrophobicContact CE-CD1 3.76Å; M307-L318 HydrophobicContact CE-CD2 4.1Å; M307-L318 HydrophobicContact CE-CG 4.01Å; M307-L318 HydrophobicContact CG-CB 4.26Å; M307-I330 HydrophobicContact CE-CG2 3.89Å; M307-T332 HydrophobicContact CE-CG2 3.87Å; M307-F403 HydrophobicContact CG-CD2 4.24Å; M307-F403 HydrophobicContact CG-CE2 3.58Å; M307-F403 HydrophobicContact CG-CZ 3.8Å; M307-F403 HydrophobicContact SD-CE2 4.45Å; M307-F403 HydrophobicContact SD-CZ 4.42Å
308	K	86.6	Confident	85.4	Confident	42 Å²	42	41.9 Å²	41.9	18%	0.183	21%	0.213	C	C	.	.	H	α-helix	trans	-65.4	-29.3	176.6	-173.2	62.8	-178.4	-178.9	0	112.7	D243 W252 A304 I306 C310 L318 Y319	D243-K308 IonicContact OD1-NZ 2.61Å; D243-K308 PolarHBondContact OD1-NZ 3.39Å; D243-K308 IonicContact OD2-NZ 2.8Å; D243-K308 PolarHBondContact OD2-NZ 3.11Å; W252-K308 HydrophobicContact CB-CD 4.34Å; W252-K308 HydrophobicContact CD2-CD 4.46Å; W252-K308 HydrophobicContact CD2-CG 4.23Å; W252-K308 HydrophobicContact CG-CD 4.24Å; W252-K308 HydrophobicContact CG-CG 4.22Å; A304-K308 VanDerWaalsContact O-CB 3.29Å; A304-K308 WeakPolarHBondContact O-CB 3.34Å; A304-K308 PolarHBondContact O-N 2.96Å; I306-K308 VanDerWaalsContact C-N 3.26Å; I306-K308 PolarHBondContact O-N 3.29Å; K308-C310 VanDerWaalsContact C-N 3.28Å; K308-L318 HydrophobicContact CB-CD2 3.96Å; K308-L318 HydrophobicContact CD-CG 4.39Å; K308-L318 PolarHBondContact NZ-O 3.13Å; K308-Y319 PolarHBondContact NZ-O 3.17Å
309	Q	83.9	Confident	85.9	Confident	144 Å²	144	36 Å²	36	67%	0.673	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-12.5	176.2	-69.4	167.9	61.3	0	0	112.9	S305 I306 M307 D311	S305-Q309 WeakPolarHBondContact O-CG 3.5Å; S305-Q309 PolarHBondContact O-N 3.3Å; S305-Q309 PolarHBondContact O-NE2 3.47Å; I306-Q309 WeakPolarHBondContact O-CB 3.35Å; I306-Q309 PolarHBondContact O-N 2.83Å; I306-Q309 VanDerWaalsContact O-N 3.13Å; M307-Q309 VanDerWaalsContact C-N 3.27Å; M307-Q309 PolarHBondContact O-N 2.84Å; Q309-D311 PolarHBondContact O-N 3.28Å
310	C	87.8	Confident	86.7	Confident	7 Å²	7	35 Å²	35	5%	0.047	18%	0.178	C	C	.	.			trans	-84	110.9	178.9	-58.8	0	0	0	0	110	I306 M307 K308 L315 Y370 M376 F403	I306-C310 PolarHBondContact O-N 3.43Å; I306-C310 PolarHBondContact O-SG 3.5Å; M307-C310 WeakPolarHBondContact O-CB 3.39Å; M307-C310 PolarHBondContact O-N 3.12Å; M307-C310 VanDerWaalsContact O-N 3.12Å; K308-C310 VanDerWaalsContact C-N 3.28Å; C310-L315 HydrophobicContact CB-CD1 4.27Å; C310-Y370 HydrophobicContact CB-CE1 4.13Å; C310-M376 WeakPolarHBondContact SG-CE 3.4Å; C310-F403 HydrophobicContact CB-CE2 3.83Å; C310-F403 HydrophobicContact CB-CZ 4.27Å
311	D	86.6	Confident	87.3	Confident	88 Å²	88	35 Å²	35	47%	0.471	18%	0.177	S	C	.	.			trans	-124.3	101	173.6	-163.5	10.8	0	0	0	110.2	Q309 K317 Y370	Q309-D311 PolarHBondContact O-N 3.28Å; D311-K317 WeakPolarHBondContact OD1-CE 3.35Å; D311-K317 IonicContact OD1-NZ 3.37Å; D311-K317 PolarHBondContact OD1-NZ 3.08Å; D311-K317 IonicContact OD2-NZ 2.88Å; D311-K317 PolarHBondContact OD2-NZ 3.28Å; D311-Y370 PolarHBondContact N-OH 3.02Å
312	H	90.7	Very high	87.8	Confident	17 Å²	17	31.3 Å²	31.3	8%	0.079	16%	0.161	C	C	.	.			trans	-148.8	138.8	-177.1	-174.6	-93.9	0	0	0	110.7	N314 L315 N366 Y370	H312-N314 PolarHBondContact ND1-N 3.32Å; H312-N314 VanDerWaalsContact ND1-N 3.12Å; H312-N314 PolarHBondContact O-N 3.45Å; H312-L315 HydrophobicContact CB-CB 4.15Å; H312-L315 HydrophobicContact CB-CD1 3.91Å; H312-L315 HydrophobicContact CB-CG 3.88Å; H312-L315 PolarHBondContact O-N 3.19Å; H312-N366 PolarHBondContact CE1-ND2 3.02Å; H312-N366 VanDerWaalsContact CE1-ND2 3.33Å; H312-N366 PolarHBondContact CE1-O 3.33Å; H312-N366 PolarHBondContact NE2-ND2 3.28Å; H312-Y370 HydrophobicContact CB-CD1 4.32Å; H312-Y370 HydrophobicContact CB-CD2 3.96Å; H312-Y370 HydrophobicContact CB-CE2 4.27Å; H312-Y370 HydrophobicContact CB-CG 3.98Å; H312-Y370 AromaticContact CD2-CD2 3.68Å; H312-Y370 AromaticContact CD2-CG 3.96Å; H312-Y370 AromaticContact CG-CG 3.99Å
313	P	89.5	Confident	88.3	Confident	72 Å²	72	26.9 Å²	26.9	47%	0.468	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-22.1	-176.2	22.7	-36.2	0	0	0	114.8	K399	P313-K399 WeakPolarHBondContact O-CE 3.47Å
314	N	93.8	Very high	89	Confident	11 Å²	11	33.4 Å²	33.4	6%	0.059	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.3	17	178.6	-58.3	110.4	0	0	0	114.1	H312 Q363 N366 V398 K399 V400	H312-N314 PolarHBondContact ND1-N 3.32Å; H312-N314 VanDerWaalsContact ND1-N 3.12Å; H312-N314 PolarHBondContact O-N 3.45Å; N314-Q363 WeakPolarHBondContact CB-O 3.38Å; N314-Q363 WeakPolarHBondContact ND2-CB 3.44Å; N314-Q363 PolarHBondContact ND2-OE1 2.97Å; N314-N366 PolarHBondContact OD1-ND2 3.16Å; N314-V398 PolarHBondContact ND2-O 3.43Å; N314-K399 CarbonylContact O-C 3.48Å; N314-K399 VanDerWaalsContact O-CA 3.32Å; N314-K399 WeakPolarHBondContact O-CA 3.46Å; N314-V400 PolarHBondContact O-N 3.33Å
315	L	94.2	Very high	89.1	Confident	2 Å²	2	38.7 Å²	38.7	1%	0.01	19%	0.194	C	C	.	.	B	Isolated β-bridge	trans	-117.2	139.3	169.2	-63.3	-176	0	0	0	109.4	C310 H312 K317 Y370 L371 V400 F403	C310-L315 HydrophobicContact CB-CD1 4.27Å; H312-L315 HydrophobicContact CB-CB 4.15Å; H312-L315 HydrophobicContact CB-CD1 3.91Å; H312-L315 HydrophobicContact CB-CG 3.88Å; H312-L315 PolarHBondContact O-N 3.19Å; L315-K317 PolarHBondContact O-N 3.24Å; L315-Y370 HydrophobicContact CD1-CD1 3.49Å; L315-Y370 VanDerWaalsContact CD1-CD1 3.49Å; L315-Y370 HydrophobicContact CD1-CE1 3.99Å; L315-Y370 HydrophobicContact CD1-CG 4.24Å; L315-L371 HydrophobicContact CD1-CD2 3.66Å; L315-L371 HydrophobicContact CD1-CG 4.17Å; L315-L371 HydrophobicContact CD2-CD1 4.29Å; L315-L371 HydrophobicContact CD2-CD2 4.38Å; L315-L371 HydrophobicContact CD2-CG 4.18Å; L315-V400 HydrophobicContact CD2-CB 3.71Å; L315-V400 HydrophobicContact CD2-CG1 4.42Å; L315-V400 HydrophobicContact CD2-CG2 4.17Å; L315-F403 HydrophobicContact CB-CE1 3.9Å; L315-F403 HydrophobicContact CB-CZ 3.85Å; L315-F403 HydrophobicContact CD1-CE2 4.29Å; L315-F403 HydrophobicContact CD1-CZ 4.19Å; L315-F403 HydrophobicContact CD2-CD1 4.32Å; L315-F403 HydrophobicContact CD2-CE1 4.18Å; L315-F403 HydrophobicContact CG-CE1 4.46Å; L315-F403 HydrophobicContact CG-CZ 4.41Å
316	V	93.4	Very high	89.2	Confident	7 Å²	7	42.2 Å²	42.2	4%	0.042	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-65.2	123.2	175.2	170.3	0	0	0	0	109.4	T332 E333 M335 L387 K399 V400 A401	V316-T332 HydrophobicContact CG1-CG2 4.03Å; V316-E333 HydrophobicContact CG1-CG 4.07Å; V316-M335 HydrophobicContact CG2-CG 4.49Å; V316-L387 HydrophobicContact CG2-CB 4.42Å; V316-L387 HydrophobicContact CG2-CD1 3.95Å; V316-L387 HydrophobicContact CG2-CG 4.4Å; V316-K399 HydrophobicContact CG2-CB 3.72Å; V316-V400 WeakPolarHBondContact CG2-O 3.22Å; V316-V400 PolarHBondContact N-O 3.07Å; V316-A401 HydrophobicContact CB-CB 4.21Å; V316-A401 HydrophobicContact CG2-CB 3.66Å
317	K	91.8	Very high	89.5	Confident	24 Å²	24	41.8 Å²	41.8	10%	0.104	21%	0.208	C	C	.	.	P	Polyproline II helix	trans	-75.8	129.1	-177	-165.2	155.4	-161	163.8	0	111.7	S242 D311 L315 Y319 T332 E333	S242-K317 WeakPolarHBondContact O-CE 3.36Å; S242-K317 PolarHBondContact O-NZ 2.93Å; D311-K317 WeakPolarHBondContact OD1-CE 3.35Å; D311-K317 IonicContact OD1-NZ 3.37Å; D311-K317 PolarHBondContact OD1-NZ 3.08Å; D311-K317 IonicContact OD2-NZ 2.88Å; D311-K317 PolarHBondContact OD2-NZ 3.28Å; L315-K317 PolarHBondContact O-N 3.24Å; K317-Y319 HydrophobicContact CB-CE1 4.38Å; K317-Y319 HydrophobicContact CD-CE1 4.11Å; K317-Y319 HydrophobicContact CG-CD1 4.28Å; K317-Y319 HydrophobicContact CG-CE1 4.05Å; K317-T332 VanDerWaalsContact O-CA 3.25Å; K317-T332 WeakPolarHBondContact O-CA 3.41Å; K317-T332 WeakPolarHBondContact O-CB 3.49Å; K317-E333 HydrophobicContact CB-CG 4.37Å; K317-E333 WeakPolarHBondContact CB-OE1 3.33Å; K317-E333 PolarHBondContact N-OE1 3.08Å; K317-E333 PolarHBondContact O-N 2.94Å; K317-E333 VanDerWaalsContact O-N 3.09Å
318	L	91.8	Very high	89.6	Confident	2 Å²	2	41.4 Å²	41.4	1%	0.01	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	121.2	165.8	-179.7	56.2	0	0	0	109.9	W252 A304 M307 K308 A320 V321 I330 V331 T332	W252-L318 HydrophobicContact CE3-CD2 4.41Å; W252-L318 HydrophobicContact CZ3-CD2 4.26Å; A304-L318 HydrophobicContact CB-CD2 3.97Å; A304-L318 WeakPolarHBondContact O-CD2 3.46Å; M307-L318 HydrophobicContact CB-CB 4.47Å; M307-L318 HydrophobicContact CB-CD2 4.01Å; M307-L318 HydrophobicContact CE-CB 3.6Å; M307-L318 HydrophobicContact CE-CD1 3.76Å; M307-L318 HydrophobicContact CE-CD2 4.1Å; M307-L318 HydrophobicContact CE-CG 4.01Å; M307-L318 HydrophobicContact CG-CB 4.26Å; K308-L318 HydrophobicContact CB-CD2 3.96Å; K308-L318 HydrophobicContact CD-CG 4.39Å; K308-L318 PolarHBondContact NZ-O 3.13Å; L318-A320 WeakPolarHBondContact CD1-O 3.39Å; L318-V321 HydrophobicContact CD1-CG1 4.42Å; L318-I330 HydrophobicContact CD1-CG2 3.31Å; L318-V331 WeakPolarHBondContact CD1-O 3.48Å; L318-T332 HydrophobicContact CD1-CG2 4.34Å
319	Y	91.4	Very high	89.8	Confident	14 Å²	14	39.4 Å²	39.4	6%	0.055	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	-54.7	171.9	-66.6	-41.9	0	0	0	112	L244 V285 K308 K317 V331 E333	L244-Y319 HydrophobicContact CD1-CD2 4.25Å; L244-Y319 HydrophobicContact CD1-CG 4.09Å; L244-Y319 HydrophobicContact CD2-CD2 3.74Å; L244-Y319 HydrophobicContact CD2-CE2 4.1Å; L244-Y319 HydrophobicContact CD2-CG 4.11Å; L244-Y319 HydrophobicContact CG-CD1 4.26Å; L244-Y319 HydrophobicContact CG-CD2 3.82Å; L244-Y319 HydrophobicContact CG-CG 3.66Å; V285-Y319 HydrophobicContact CG1-CD2 4.03Å; V285-Y319 HydrophobicContact CG1-CE2 4.39Å; K308-Y319 PolarHBondContact NZ-O 3.17Å; K317-Y319 HydrophobicContact CB-CE1 4.38Å; K317-Y319 HydrophobicContact CD-CE1 4.11Å; K317-Y319 HydrophobicContact CG-CD1 4.28Å; K317-Y319 HydrophobicContact CG-CE1 4.05Å; Y319-V331 WeakPolarHBondContact CB-O 3.5Å; Y319-V331 PolarHBondContact N-O 3.37Å; Y319-E333 VanDerWaalsContact CE2-CA 3.44Å; Y319-E333 HydrophobicContact CE2-CB 3.74Å
320	A	92.9	Very high	90.2	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	170.6	-171.9	0	0	0	0	0	112.5	L244 W252 I254 L318 V331	L244-A320 HydrophobicContact CD1-CB 4.46Å; W252-A320 CarbonylContact O-C 3.45Å; W252-A320 WeakPolarHBondContact O-CA 3.47Å; W252-A320 VanDerWaalsContact O-CB 3.26Å; W252-A320 WeakPolarHBondContact O-CB 3.08Å; I254-A320 HydrophobicContact CD1-CB 3.71Å; I254-A320 HydrophobicContact CG1-CB 3.89Å; I254-A320 HydrophobicContact CG2-CB 4.04Å; L318-A320 WeakPolarHBondContact CD1-O 3.39Å; A320-V331 HydrophobicContact CB-CB 4.13Å; A320-V331 HydrophobicContact CB-CG2 4.38Å; A320-V331 PolarHBondContact N-O 3.23Å; A320-V331 VanDerWaalsContact N-O 3.13Å; A320-V331 WeakPolarHBondContact O-CA 3.45Å; A320-V331 WeakPolarHBondContact O-CB 3.2Å; A320-V331 PolarHBondContact O-N 2.9Å
321	V	92.6	Very high	90.5	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	156.3	168.4	-65.2	0	0	0	0	111.4	W252 E253 I254 F300 A304 L318 T323 C329 I330	W252-V321 HydrophobicContact CE3-CB 4.25Å; W252-V321 HydrophobicContact CE3-CG1 3.95Å; W252-V321 HydrophobicContact CE3-CG2 3.57Å; W252-V321 HydrophobicContact CH2-CG2 4.26Å; W252-V321 HydrophobicContact CZ3-CB 4.03Å; W252-V321 HydrophobicContact CZ3-CG1 3.52Å; W252-V321 HydrophobicContact CZ3-CG2 3.35Å; W252-V321 PolarHBondContact O-N 3.17Å; E253-V321 CarbonylContact C-O 3.58Å; E253-V321 WeakPolarHBondContact CA-O 3.32Å; E253-V321 HydrophobicContact CB-CG2 4.39Å; I254-V321 PolarHBondContact N-O 2.92Å; F300-V321 HydrophobicContact CE1-CB 3.68Å; F300-V321 HydrophobicContact CE1-CG1 3.65Å; F300-V321 HydrophobicContact CE1-CG2 4.18Å; F300-V321 HydrophobicContact CZ-CB 3.97Å; F300-V321 HydrophobicContact CZ-CG1 3.67Å; A304-V321 HydrophobicContact CB-CG1 3.71Å; L318-V321 HydrophobicContact CD1-CG1 4.42Å; V321-T323 HydrophobicContact CG2-CG2 4.24Å; V321-C329 CarbonylContact C-O 3.53Å; V321-C329 WeakPolarHBondContact CA-O 3.33Å; V321-I330 HydrophobicContact CG1-CG1 4.38Å
322	C	92.3	Very high	90.8	Very high	2 Å²	2	29.1 Å²	29.1	1%	0.014	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	104.5	169.3	-56	0	0	0	0	109.1	I254 K256 M328 C329	I254-C322 PolarHBondContact O-SG 3.4Å; I254-C322 VanDerWaalsContact O-SG 3.33Å; K256-C322 HydrophobicContact CB-CB 4.24Å; C322-M328 VanDerWaalsContact O-CA 3.29Å; C322-M328 WeakPolarHBondContact O-CA 3.13Å; C322-C329 VanDerWaalsContact CB-SG 3.52Å; C322-C329 PolarHBondContact N-O 3.44Å; C322-C329 PolarHBondContact O-N 3.13Å; C322-C329 VanDerWaalsContact SG-SG 3.68Å
323	T	88.8	Confident	90.9	Very high	13 Å²	13	29.1 Å²	29.1	8%	0.08	15%	0.147	C	C	.	.			trans	-113.8	-12.4	-175.5	33.9	0	0	0	0	114.3	E253 F300 V321 E325 M328	E253-T323 VanDerWaalsContact CG-OG1 3.29Å; E253-T323 WeakPolarHBondContact CG-OG1 3.33Å; E253-T323 PolarHBondContact OE1-OG1 3.04Å; F300-T323 HydrophobicContact CD1-CG2 3.26Å; F300-T323 HydrophobicContact CE1-CG2 3.22Å; F300-T323 HydrophobicContact CG-CG2 4.47Å; F300-T323 HydrophobicContact CZ-CG2 4.39Å; V321-T323 HydrophobicContact CG2-CG2 4.24Å; T323-E325 VanDerWaalsContact C-N 3.33Å; T323-E325 PolarHBondContact O-N 2.91Å; T323-M328 HydrophobicContact CG2-CG 4.5Å; T323-M328 HydrophobicContact CG2-SD 4.02Å
324	K	86.5	Confident	91.1	Very high	146 Å²	146	28.2 Å²	28.2	64%	0.635	14%	0.135	S	C	*	.	S	Bend	trans	-74.3	-21.2	-178.2	-60.9	-174.9	178.3	168.2	0	114.1	E253	E253-K324 VanDerWaalsContact OE1-CG 3.26Å; E253-K324 WeakPolarHBondContact OE1-CG 3.33Å; E253-K324 WeakPolarHBondContact OE2-CE 3.28Å
325	E	85.8	Confident	91.1	Very high	114 Å²	114	28.2 Å²	28.2	53%	0.533	13%	0.134	S	C	.	.	S	Bend	trans	-138.4	123.1	-175.4	-65.9	174	-163	0	0	111.3	K256 T323 P327	K256-E325 PolarHBondContact NZ-O 3.28Å; K256-E325 VanDerWaalsContact NZ-O 3.17Å; T323-E325 VanDerWaalsContact C-N 3.33Å; T323-E325 PolarHBondContact O-N 2.91Å; E325-P327 CarbonylContact O-C 3.57Å
326	E	86.2	Confident	91	Very high	109 Å²	109	31 Å²	31	51%	0.509	15%	0.152	S	C	.	.	S	Bend	trans	-68.5	145.6	173	-73	-77	-161.9	0	0	111.6	M328	E326-M328 PolarHBondContact OE2-N 3.38Å
327	P	87.3	Confident	91	Very high	51 Å²	51	33.8 Å²	33.8	33%	0.331	17%	0.166	S	C	.	.	S	Bend	cis	-70.1	132.7	-5.2	27.3	-33.8	0	0	0	112.2	K256 M289 L290 E325	K256-P327 WeakPolarHBondContact CE-O 3.42Å; K256-P327 PolarHBondContact NZ-O 2.94Å; M289-P327 HydrophobicContact SD-CG 4.32Å; L290-P327 WeakPolarHBondContact O-CB 3.47Å; E325-P327 CarbonylContact O-C 3.57Å
328	M	88.9	Confident	91.1	Very high	5 Å²	5	34.2 Å²	34.2	3%	0.025	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-57.6	148.7	174.4	-62.6	-174.4	-71.7	0	0	111.3	L290 M295 C297 F300 C322 T323 E326	L290-M328 PolarHBondContact N-O 2.99Å; M295-M328 HydrophobicContact CG-CE 4.34Å; C297-M328 HydrophobicContact CB-SD 3.93Å; F300-M328 HydrophobicContact CB-CE 4.32Å; F300-M328 HydrophobicContact CB-SD 4.45Å; F300-M328 HydrophobicContact CD1-SD 4.3Å; F300-M328 HydrophobicContact CG-SD 4.34Å; C322-M328 VanDerWaalsContact O-CA 3.29Å; C322-M328 WeakPolarHBondContact O-CA 3.13Å; T323-M328 HydrophobicContact CG2-CG 4.5Å; T323-M328 HydrophobicContact CG2-SD 4.02Å; E326-M328 PolarHBondContact OE2-N 3.38Å
329	C	90.9	Very high	91.3	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	156	176.3	70.8	0	0	0	0	115	I287 K288 M289 V321 C322	I287-C329 HydrophobicContact CG2-CB 3.92Å; K288-C329 CarbonylContact O-C 3.59Å; K288-C329 WeakPolarHBondContact O-CA 3.48Å; K288-C329 WeakPolarHBondContact O-CB 3.38Å; M289-C329 HydrophobicContact CG-CB 4.13Å; V321-C329 CarbonylContact C-O 3.53Å; V321-C329 WeakPolarHBondContact CA-O 3.33Å; C322-C329 VanDerWaalsContact CB-SG 3.52Å; C322-C329 PolarHBondContact N-O 3.44Å; C322-C329 PolarHBondContact O-N 3.13Å; C322-C329 VanDerWaalsContact SG-SG 3.68Å
330	I	91.2	Very high	91.6	Very high	5 Å²	5	34.7 Å²	34.7	3%	0.026	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	135.8	173.7	-58.7	179.8	0	0	0	108.5	I287 K288 F300 M307 L318 V321 T332 L405	I287-I330 CarbonylContact C-O 3.5Å; I287-I330 WeakPolarHBondContact CA-O 2.89Å; K288-I330 HydrophobicContact CB-CB 4.45Å; K288-I330 PolarHBondContact N-O 3.45Å; K288-I330 PolarHBondContact O-N 3.05Å; F300-I330 HydrophobicContact CE2-CD1 3.67Å; F300-I330 HydrophobicContact CE2-CG1 3.35Å; F300-I330 HydrophobicContact CZ-CD1 4.17Å; F300-I330 HydrophobicContact CZ-CG1 3.41Å; F300-I330 VanDerWaalsContact CZ-CG1 3.41Å; M307-I330 HydrophobicContact CE-CG2 3.89Å; L318-I330 HydrophobicContact CD1-CG2 3.31Å; V321-I330 HydrophobicContact CG1-CG1 4.38Å; I330-T332 HydrophobicContact CG2-CG2 3.83Å; I330-L405 HydrophobicContact CD1-CD1 4.13Å; I330-L405 HydrophobicContact CD1-CD2 3.81Å; I330-L405 HydrophobicContact CD1-CG 4.48Å
331	V	93.5	Very high	91.8	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	112.7	178.8	-172.1	0	0	0	0	109	L244 I254 L259 V285 L318 Y319 A320	L244-V331 HydrophobicContact CD1-CG1 4.24Å; I254-V331 HydrophobicContact CD1-CG2 4.42Å; L259-V331 HydrophobicContact CD1-CG2 3.65Å; L259-V331 HydrophobicContact CD2-CG1 4.11Å; L259-V331 HydrophobicContact CD2-CG2 3.99Å; L259-V331 HydrophobicContact CG-CG2 4.43Å; V285-V331 HydrophobicContact CB-CG1 3.67Å; V285-V331 HydrophobicContact CG1-CG1 3.75Å; V285-V331 HydrophobicContact CG2-CG1 3.93Å; L318-V331 WeakPolarHBondContact CD1-O 3.48Å; Y319-V331 WeakPolarHBondContact CB-O 3.5Å; Y319-V331 PolarHBondContact N-O 3.37Å; A320-V331 HydrophobicContact CB-CB 4.13Å; A320-V331 HydrophobicContact CB-CG2 4.38Å; A320-V331 PolarHBondContact N-O 3.23Å; A320-V331 VanDerWaalsContact N-O 3.13Å; A320-V331 WeakPolarHBondContact O-CA 3.45Å; A320-V331 WeakPolarHBondContact O-CB 3.2Å; A320-V331 PolarHBondContact O-N 2.9Å
332	T	93.5	Very high	91.9	Very high	18 Å²	18	40.8 Å²	40.8	11%	0.11	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	170	-178.3	55.3	0	0	0	0	111.4	V285 A286 M307 V316 K317 L318 I330	V285-T332 WeakPolarHBondContact CA-O 3.45Å; V285-T332 WeakPolarHBondContact CB-O 3.32Å; A286-T332 PolarHBondContact N-O 2.77Å; A286-T332 PolarHBondContact O-N 2.99Å; A286-T332 PolarHBondContact O-OG1 3.22Å; M307-T332 HydrophobicContact CE-CG2 3.87Å; V316-T332 HydrophobicContact CG1-CG2 4.03Å; K317-T332 VanDerWaalsContact O-CA 3.25Å; K317-T332 WeakPolarHBondContact O-CA 3.41Å; K317-T332 WeakPolarHBondContact O-CB 3.49Å; L318-T332 HydrophobicContact CD1-CG2 4.34Å; I330-T332 HydrophobicContact CG2-CG2 3.83Å
333	E	92.2	Very high	92.1	Very high	16 Å²	16	41.9 Å²	41.9	8%	0.075	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.3	141.1	168	69.2	-180	120.7	0	0	112.2	V316 K317 Y319 M335 K399	V316-E333 HydrophobicContact CG1-CG 4.07Å; K317-E333 HydrophobicContact CB-CG 4.37Å; K317-E333 WeakPolarHBondContact CB-OE1 3.33Å; K317-E333 PolarHBondContact N-OE1 3.08Å; K317-E333 PolarHBondContact O-N 2.94Å; K317-E333 VanDerWaalsContact O-N 3.09Å; Y319-E333 VanDerWaalsContact CE2-CA 3.44Å; Y319-E333 HydrophobicContact CE2-CB 3.74Å; E333-M335 HydrophobicContact CG-SD 4.45Å; E333-K399 WeakPolarHBondContact OE1-CD 3.49Å; E333-K399 IonicContact OE1-NZ 3.39Å; E333-K399 PolarHBondContact OE1-NZ 2.9Å; E333-K399 WeakPolarHBondContact OE2-CE 3.4Å; E333-K399 IonicContact OE2-NZ 2.89Å; E333-K399 PolarHBondContact OE2-NZ 3.12Å
334	Y	94.1	Very high	92.4	Very high	53 Å²	53	41.2 Å²	41.2	21%	0.208	21%	0.212	C	C	.	.			trans	-84.6	120	177	172.6	-117.4	0	0	0	111.4	L265 Y275 K284 V336	L265-Y334 HydrophobicContact CD1-CD2 4.03Å; L265-Y334 HydrophobicContact CD1-CE2 3.88Å; L265-Y334 HydrophobicContact CD2-CE2 3.9Å; Y275-Y334 HydrophobicContact CD2-CD1 4.12Å; Y275-Y334 AromaticContact CD2-CD2 3.94Å; Y275-Y334 HydrophobicContact CD2-CD2 3.94Å; Y275-Y334 HydrophobicContact CD2-CE1 4.03Å; Y275-Y334 AromaticContact CD2-CE2 3.88Å; Y275-Y334 HydrophobicContact CD2-CE2 3.88Å; Y275-Y334 HydrophobicContact CD2-CG 4.05Å; Y275-Y334 AromaticContact CD2-CZ 3.91Å; Y275-Y334 AromaticContact CE2-CD1 3.93Å; Y275-Y334 HydrophobicContact CE2-CD1 3.93Å; Y275-Y334 AromaticContact CE2-CE1 3.92Å; Y275-Y334 HydrophobicContact CE2-CE1 3.92Å; Y275-Y334 HydrophobicContact CE2-CG 4.24Å; K284-Y334 HydrophobicContact CB-CD1 3.88Å; K284-Y334 HydrophobicContact CB-CG 4.25Å; K284-Y334 HydrophobicContact CD-CD1 4.05Å; K284-Y334 HydrophobicContact CD-CE1 4.43Å; Y334-V336 HydrophobicContact CE1-CB 3.97Å; Y334-V336 HydrophobicContact CE1-CG2 4.05Å
335	M	93.9	Very high	92.9	Very high	11 Å²	11	38.8 Å²	38.8	5%	0.054	20%	0.199	C	C	.	.			trans	-98.4	104.5	176.6	-64.8	-67.3	-77.9	0	0	110.2	V316 E333 N337 G338 L387 V388 K399	V316-M335 HydrophobicContact CG2-CG 4.49Å; E333-M335 HydrophobicContact CG-SD 4.45Å; M335-N337 VanDerWaalsContact C-N 3.26Å; M335-N337 PolarHBondContact O-N 3.49Å; M335-N337 VanDerWaalsContact O-N 3.13Å; M335-G338 PolarHBondContact O-N 2.92Å; M335-G338 VanDerWaalsContact O-N 3.12Å; M335-L387 HydrophobicContact CB-CB 3.57Å; M335-L387 HydrophobicContact CB-CD1 4.02Å; M335-L387 HydrophobicContact CB-CG 4.38Å; M335-L387 HydrophobicContact CE-CB 4.17Å; M335-L387 VanDerWaalsContact CE-O 3.24Å; M335-L387 WeakPolarHBondContact CE-O 3.33Å; M335-L387 HydrophobicContact CG-CB 3.6Å; M335-L387 HydrophobicContact CG-CD1 3.91Å; M335-L387 HydrophobicContact CG-CG 4.43Å; M335-V388 CarbonylContact C-O 3.58Å; M335-K399 HydrophobicContact CE-CB 3.88Å; M335-K399 HydrophobicContact CE-CD 3.87Å; M335-K399 HydrophobicContact CE-CG 3.59Å; M335-K399 HydrophobicContact SD-CD 3.9Å; M335-K399 HydrophobicContact SD-CG 4.31Å
336	V	92.4	Very high	93.1	Very high	62 Å²	62	35.8 Å²	35.8	38%	0.376	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-28	-164.1	68.1	0	0	0	0	115.4	Y334 E390	Y334-V336 HydrophobicContact CE1-CB 3.97Å; Y334-V336 HydrophobicContact CE1-CG2 4.05Å; V336-E390 HydrophobicContact CG1-CG 3.88Å
337	N	93.5	Very high	93.1	Very high	65 Å²	65	33.5 Å²	33.5	35%	0.348	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.4	11	-176.7	-71.4	-57.1	0	0	0	113.4	M335 Y343 V388 G389	M335-N337 VanDerWaalsContact C-N 3.26Å; M335-N337 PolarHBondContact O-N 3.49Å; M335-N337 VanDerWaalsContact O-N 3.13Å; N337-Y343 HydrophobicContact CB-CD2 3.83Å; N337-Y343 HydrophobicContact CB-CE2 3.97Å; N337-V388 WeakPolarHBondContact CA-O 3.39Å; N337-V388 HydrophobicContact CB-CB 3.68Å; N337-V388 HydrophobicContact CB-CG1 3.76Å; N337-V388 WeakPolarHBondContact CB-O 3.39Å; N337-V388 PolarHBondContact N-O 3.19Å; N337-G389 PolarHBondContact ND2-O 2.86Å
338	G	94.4	Very high	93.1	Very high	32 Å²	32	37 Å²	37	33%	0.33	21%	0.211	S	C	.	.			trans	65.7	-148.4	174.9	0	0	0	0	0	112.9	M335 L387 V388	M335-G338 PolarHBondContact O-N 2.92Å; M335-G338 VanDerWaalsContact O-N 3.12Å; G338-L387 CarbonylContact O-C 3.45Å; G338-L387 VanDerWaalsContact O-CA 3.29Å; G338-L387 WeakPolarHBondContact O-CA 3.34Å; G338-V388 PolarHBondContact O-N 3.05Å
339	S	95.5	Very high	92.9	Very high	26 Å²	26	36.8 Å²	36.8	18%	0.182	21%	0.21	C	C	.	.	B	Isolated β-bridge	trans	-77.7	146.6	-178.2	70.3	0	0	0	0	112.5	L341 E342 Y343 R384 I386	S339-L341 PolarHBondContact O-N 3.14Å; S339-E342 PolarHBondContact O-N 3.44Å; S339-E342 PolarHBondContact OG-N 3.5Å; S339-Y343 WeakPolarHBondContact O-CB 3.35Å; S339-Y343 PolarHBondContact O-N 2.67Å; S339-R384 WeakPolarHBondContact CB-O 3.31Å; S339-I386 CarbonylContact C-O 3.51Å; S339-I386 VanDerWaalsContact CA-O 3.3Å; S339-I386 WeakPolarHBondContact CA-O 3.35Å
340	L	97	Very high	92.9	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-60.9	-34.5	177.5	179.9	61.8	0	0	0	111.5	Y343 L344 M360 I364 A383 I386 V388 V453	L340-Y343 HydrophobicContact CD1-CD1 4.42Å; L340-Y343 PolarHBondContact O-N 3.18Å; L340-L344 HydrophobicContact CD1-CD1 4.05Å; L340-L344 HydrophobicContact CD1-CD2 4.29Å; L340-L344 HydrophobicContact CD1-CG 3.83Å; L340-L344 HydrophobicContact CD2-CD1 4.49Å; L340-L344 HydrophobicContact CG-CD1 3.83Å; L340-L344 HydrophobicContact CG-CG 4.12Å; L340-L344 WeakPolarHBondContact O-CB 3.44Å; L340-L344 WeakPolarHBondContact O-CG 2.98Å; L340-L344 PolarHBondContact O-N 3.45Å; L340-M360 HydrophobicContact CD1-CE 4.28Å; L340-M360 HydrophobicContact CD1-SD 3.65Å; L340-I364 HydrophobicContact CD2-CD1 3.96Å; L340-A383 WeakPolarHBondContact CB-O 3.33Å; L340-A383 PolarHBondContact N-O 2.74Å; L340-I386 HydrophobicContact CB-CB 3.79Å; L340-I386 HydrophobicContact CB-CG2 3.99Å; L340-I386 HydrophobicContact CD2-CB 4.01Å; L340-I386 HydrophobicContact CD2-CG1 4.37Å; L340-I386 HydrophobicContact CD2-CG2 3.88Å; L340-I386 PolarHBondContact N-O 2.8Å; L340-V388 HydrophobicContact CB-CG2 3.9Å; L340-V388 HydrophobicContact CD1-CG2 3.84Å; L340-V453 HydrophobicContact CD2-CG2 3.99Å
341	L	96.9	Very high	92.8	Very high	22 Å²	22	49.7 Å²	49.7	12%	0.115	27%	0.272	C	S	.	.	H	α-helix	trans	-58.2	-50.8	176.5	-177.7	63.3	0	0	0	112.2	S339 R345 A383 R384	S339-L341 PolarHBondContact O-N 3.14Å; L341-R345 WeakPolarHBondContact O-CD 3.38Å; L341-R345 VanDerWaalsContact O-CG 3.29Å; L341-R345 WeakPolarHBondContact O-CG 3.4Å; L341-R345 PolarHBondContact O-N 2.94Å; L341-A383 HydrophobicContact CB-CB 4.06Å; L341-A383 HydrophobicContact CD1-CB 4.38Å; L341-A383 PolarHBondContact N-O 3.3Å; L341-A383 VanDerWaalsContact N-O 3.1Å; L341-R384 HydrophobicContact CD2-CB 4.17Å
342	E	95.9	Very high	92.7	Very high	107 Å²	107	50.5 Å²	50.5	50%	0.5	28%	0.277	S	S	.	.	H	α-helix	trans	-71.3	-37.8	178.8	-66.1	-54	129.3	0	0	111	S339 L344 R345 A346	S339-E342 PolarHBondContact O-N 3.44Å; S339-E342 PolarHBondContact OG-N 3.5Å; E342-L344 PolarHBondContact O-N 2.99Å; E342-R345 PolarHBondContact O-N 2.77Å; E342-R345 IonicContact OE1-NH1 3.66Å; E342-A346 WeakPolarHBondContact O-CB 3.2Å; E342-A346 PolarHBondContact O-N 2.86Å
343	Y	95.6	Very high	92.5	Very high	24 Å²	24	53.2 Å²	53.2	9%	0.094	29%	0.294	C	S	.	.	H	α-helix	trans	-57.1	-50.4	175.8	-170.8	-107.5	0	0	0	111.8	N337 S339 L340 R345 A346 G349 L352 M360 V388 K391 P396	N337-Y343 HydrophobicContact CB-CD2 3.83Å; N337-Y343 HydrophobicContact CB-CE2 3.97Å; S339-Y343 WeakPolarHBondContact O-CB 3.35Å; S339-Y343 PolarHBondContact O-N 2.67Å; L340-Y343 HydrophobicContact CD1-CD1 4.42Å; L340-Y343 PolarHBondContact O-N 3.18Å; Y343-R345 PolarHBondContact O-N 2.71Å; Y343-A346 PolarHBondContact O-N 2.99Å; Y343-G349 VanDerWaalsContact O-CA 3.29Å; Y343-G349 WeakPolarHBondContact O-CA 2.94Å; Y343-L352 HydrophobicContact CD1-CD1 4.43Å; Y343-L352 HydrophobicContact CE1-CD1 3.93Å; Y343-M360 HydrophobicContact CD1-CE 4.41Å; Y343-M360 HydrophobicContact CE1-CE 4.08Å; Y343-V388 HydrophobicContact CD1-CG1 4.09Å; Y343-V388 HydrophobicContact CD1-CG2 4.12Å; Y343-V388 HydrophobicContact CD2-CG1 4.34Å; Y343-V388 HydrophobicContact CE1-CG1 4.1Å; Y343-V388 HydrophobicContact CE2-CG1 4.39Å; Y343-V388 HydrophobicContact CG-CB 4.37Å; Y343-V388 HydrophobicContact CG-CG1 4.21Å; Y343-V388 HydrophobicContact CG-CG2 4.04Å; Y343-K391 WeakPolarHBondContact OH-CE 3.49Å; Y343-P396 HydrophobicContact CE1-CG 4.19Å
344	L	96.2	Very high	92.4	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-62.2	-30.5	178.9	-72.4	170	0	0	0	113.2	L340 E342 K350 L352 L357 V453 K456	L340-L344 HydrophobicContact CD1-CD1 4.05Å; L340-L344 HydrophobicContact CD1-CD2 4.29Å; L340-L344 HydrophobicContact CD1-CG 3.83Å; L340-L344 HydrophobicContact CD2-CD1 4.49Å; L340-L344 HydrophobicContact CG-CD1 3.83Å; L340-L344 HydrophobicContact CG-CG 4.12Å; L340-L344 WeakPolarHBondContact O-CB 3.44Å; L340-L344 WeakPolarHBondContact O-CG 2.98Å; L340-L344 PolarHBondContact O-N 3.45Å; E342-L344 PolarHBondContact O-N 2.99Å; L344-K350 WeakPolarHBondContact O-CG 3.43Å; L344-K350 PolarHBondContact O-N 2.88Å; L344-L352 HydrophobicContact CD2-CD1 4.29Å; L344-L357 HydrophobicContact CD2-CD2 3.75Å; L344-V453 HydrophobicContact CD1-CG2 4.36Å; L344-K456 HydrophobicContact CD2-CD 4.17Å
345	R	95.9	Very high	92.1	Very high	94 Å²	94	55.8 Å²	55.8	36%	0.355	32%	0.317	S	S	.	.	H	α-helix	trans	-87.1	-3.5	-177.8	-73.2	174.2	172	177.3	-1.8	114	L341 E342 Y343 K350 G457	L341-R345 WeakPolarHBondContact O-CD 3.38Å; L341-R345 VanDerWaalsContact O-CG 3.29Å; L341-R345 WeakPolarHBondContact O-CG 3.4Å; L341-R345 PolarHBondContact O-N 2.94Å; E342-R345 PolarHBondContact O-N 2.77Å; E342-R345 IonicContact OE1-NH1 3.66Å; Y343-R345 PolarHBondContact O-N 2.71Å; R345-K350 VanDerWaalsContact C-CE 3.42Å; R345-K350 WeakPolarHBondContact O-CE 3.29Å; R345-G457 PolarHBondContact NE-O 3.24Å; R345-G457 PolarHBondContact NH2-O 3.37Å
346	A	90.3	Very high	91.9	Very high	51 Å²	51	55.7 Å²	55.7	42%	0.421	32%	0.318	S	S	.	.	S	Bend	trans	-136.8	158.7	-174.3	0	0	0	0	0	112.9	E342 Y343 E348 G349 K350	E342-A346 WeakPolarHBondContact O-CB 3.2Å; E342-A346 PolarHBondContact O-N 2.86Å; Y343-A346 PolarHBondContact O-N 2.99Å; A346-E348 PolarHBondContact O-N 3.32Å; A346-G349 PolarHBondContact O-N 2.89Å; A346-K350 PolarHBondContact O-N 3.31Å
347	G	86.6	Confident	92	Very high	62 Å²	62	53 Å²	53	64%	0.639	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	43.5	-128	170.5	0	0	0	0	0	114.9	G349	G347-G349 VanDerWaalsContact C-N 3.3Å; G347-G349 PolarHBondContact O-N 3.37Å
348	E	85.7	Confident	92	Very high	124 Å²	124	50 Å²	50	58%	0.579	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-67.9	-25.7	-179	-60	-179.8	168.9	0	0	113.5	A346 K350 L351 L352 K391	A346-E348 PolarHBondContact O-N 3.32Å; E348-K350 VanDerWaalsContact C-N 3.27Å; E348-K350 PolarHBondContact O-N 2.95Å; E348-L351 PolarHBondContact O-N 3.41Å; E348-L352 PolarHBondContact O-N 2.71Å; E348-K391 IonicContact OE2-NZ 3.66Å; E348-K391 PolarHBondContact OE2-NZ 2.99Å
349	G	86.1	Confident	91.8	Very high	0 Å²	0	49 Å²	49	0%	0	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-63.6	-33.3	-179.3	0	0	0	0	0	112.9	Y343 A346 G347 L351 L352	Y343-G349 VanDerWaalsContact O-CA 3.29Å; Y343-G349 WeakPolarHBondContact O-CA 2.94Å; A346-G349 PolarHBondContact O-N 2.89Å; G347-G349 VanDerWaalsContact C-N 3.3Å; G347-G349 PolarHBondContact O-N 3.37Å; G349-L351 PolarHBondContact O-N 2.74Å; G349-L352 WeakPolarHBondContact O-CG 3.33Å; G349-L352 PolarHBondContact O-N 2.8Å
350	K	89.6	Confident	91.8	Very high	129 Å²	129	47.7 Å²	47.7	56%	0.561	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-59.6	-34.8	171.7	-70.2	-169.6	-176.6	-176.6	0	112.6	L344 R345 A346 E348	L344-K350 WeakPolarHBondContact O-CG 3.43Å; L344-K350 PolarHBondContact O-N 2.88Å; R345-K350 VanDerWaalsContact C-CE 3.42Å; R345-K350 WeakPolarHBondContact O-CE 3.29Å; A346-K350 PolarHBondContact O-N 3.31Å; E348-K350 VanDerWaalsContact C-N 3.27Å; E348-K350 PolarHBondContact O-N 2.95Å
351	L	90.5	Very high	91.8	Very high	148 Å²	148	47.7 Å²	47.7	78%	0.775	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-93	1.7	-173.4	-58.4	179.7	0	0	0	113.1	E348 G349	E348-L351 PolarHBondContact O-N 3.41Å; G349-L351 PolarHBondContact O-N 2.74Å
352	L	90.1	Very high	91.8	Very high	17 Å²	17	46.8 Å²	46.8	9%	0.089	26%	0.259	C	S	.	.			trans	-58.1	129.7	179.2	-71.8	172.5	0	0	0	111	Y343 L344 E348 G349 A356 L357 M360 P396 K456	Y343-L352 HydrophobicContact CD1-CD1 4.43Å; Y343-L352 HydrophobicContact CE1-CD1 3.93Å; L344-L352 HydrophobicContact CD2-CD1 4.29Å; E348-L352 PolarHBondContact O-N 2.71Å; G349-L352 WeakPolarHBondContact O-CG 3.33Å; G349-L352 PolarHBondContact O-N 2.8Å; L352-A356 HydrophobicContact CB-CB 4.24Å; L352-A356 HydrophobicContact CD2-CB 3.93Å; L352-L357 HydrophobicContact CB-CD2 4.12Å; L352-L357 HydrophobicContact CD1-CD2 4.17Å; L352-M360 HydrophobicContact CD1-CE 3.48Å; L352-M360 VanDerWaalsContact CD1-CE 3.48Å; L352-M360 HydrophobicContact CD1-SD 4.11Å; L352-P396 HydrophobicContact CD2-CG 4.48Å; L352-K456 PolarHBondContact O-NZ 3.12Å
353	P	90	Very high	91.8	Very high	74 Å²	74	42.4 Å²	42.4	48%	0.481	24%	0.238	S	C	.	.			trans	-68.3	163.2	174.2	30.4	-35.5	0	0	0	110.7	S355 A356 L357	P353-S355 PolarHBondContact O-N 3Å; P353-S355 VanDerWaalsContact O-N 3.16Å; P353-A356 HydrophobicContact CG-CB 4.14Å; P353-A356 PolarHBondContact O-N 3.19Å; P353-A356 VanDerWaalsContact O-N 3.07Å; P353-L357 PolarHBondContact O-N 3.23Å
354	L	91.2	Very high	91.9	Very high	60 Å²	60	41.2 Å²	41.2	31%	0.314	23%	0.234	S	C	.	.	H	α-helix	trans	-52.7	-37.4	176.2	177.3	64.3	0	0	0	112.2	A356 L357 V358 I454 P486 F518	L354-A356 VanDerWaalsContact C-N 3.33Å; L354-A356 PolarHBondContact O-N 3.2Å; L354-L357 WeakPolarHBondContact O-CB 3.45Å; L354-L357 PolarHBondContact O-N 3.3Å; L354-L357 VanDerWaalsContact O-N 3.17Å; L354-V358 HydrophobicContact CD1-CG2 4.05Å; L354-V358 HydrophobicContact CG-CG2 4.2Å; L354-V358 WeakPolarHBondContact O-CB 3.48Å; L354-V358 WeakPolarHBondContact O-CG2 3.46Å; L354-V358 PolarHBondContact O-N 3.45Å; L354-I454 HydrophobicContact CD1-CD1 3.71Å; L354-P486 HydrophobicContact CD1-CG 4.04Å; L354-P486 HydrophobicContact CD2-CG 3.54Å; L354-P486 HydrophobicContact CG-CG 4.43Å; L354-F518 HydrophobicContact CG-CZ 4.33Å
355	S	87.5	Confident	92	Very high	63 Å²	63	41.2 Å²	41.2	44%	0.441	23%	0.234	S	C	.	.	H	α-helix	trans	-60.2	-40.4	178.8	52.5	0	0	0	0	113.5	P353 D359	P353-S355 PolarHBondContact O-N 3Å; P353-S355 VanDerWaalsContact O-N 3.16Å; S355-D359 WeakPolarHBondContact O-CB 3.04Å; S355-D359 PolarHBondContact O-N 3.26Å; S355-D359 VanDerWaalsContact O-N 3.09Å
356	A	89.1	Confident	92.1	Very high	9 Å²	9	38.3 Å²	38.3	7%	0.074	23%	0.225	C	C	.	.	H	α-helix	trans	-70.7	-35.8	176	0	0	0	0	0	111.9	L352 P353 L354 D359 M360	L352-A356 HydrophobicContact CB-CB 4.24Å; L352-A356 HydrophobicContact CD2-CB 3.93Å; P353-A356 HydrophobicContact CG-CB 4.14Å; P353-A356 PolarHBondContact O-N 3.19Å; P353-A356 VanDerWaalsContact O-N 3.07Å; L354-A356 VanDerWaalsContact C-N 3.33Å; L354-A356 PolarHBondContact O-N 3.2Å; A356-D359 PolarHBondContact O-N 2.81Å; A356-M360 WeakPolarHBondContact O-CG 3.47Å; A356-M360 PolarHBondContact O-N 3.38Å
357	L	94.2	Very high	92.4	Very high	5 Å²	5	35.9 Å²	35.9	3%	0.026	21%	0.205	C	C	.	.	H	α-helix	trans	-65	-46.9	175.9	-63.9	-171.8	0	0	0	112	L344 L352 P353 L354 D359 M360 C361 V453 I454 K456	L344-L357 HydrophobicContact CD2-CD2 3.75Å; L352-L357 HydrophobicContact CB-CD2 4.12Å; L352-L357 HydrophobicContact CD1-CD2 4.17Å; P353-L357 PolarHBondContact O-N 3.23Å; L354-L357 WeakPolarHBondContact O-CB 3.45Å; L354-L357 PolarHBondContact O-N 3.3Å; L354-L357 VanDerWaalsContact O-N 3.17Å; L357-D359 VanDerWaalsContact C-N 3.28Å; L357-D359 PolarHBondContact O-N 3.34Å; L357-M360 WeakPolarHBondContact O-CB 3.33Å; L357-M360 PolarHBondContact O-N 3.09Å; L357-C361 PolarHBondContact O-N 2.68Å; L357-C361 PolarHBondContact O-SG 3.42Å; L357-V453 HydrophobicContact CB-CG1 3.89Å; L357-V453 HydrophobicContact CD1-CG1 4.47Å; L357-V453 HydrophobicContact CD2-CG1 3.87Å; L357-V453 HydrophobicContact CG-CG1 4.3Å; L357-I454 HydrophobicContact CD1-CD1 4.04Å; L357-K456 HydrophobicContact CD1-CD 4.27Å; L357-K456 HydrophobicContact CD2-CD 4.42Å
358	V	93.5	Very high	92.9	Very high	2 Å²	2	33 Å²	33	1%	0.012	18%	0.175	C	C	.	.	H	α-helix	trans	-58.8	-41.9	176.1	162.5	0	0	0	0	110.8	L354 C361 A362 F514 Y517 F518	L354-V358 HydrophobicContact CD1-CG2 4.05Å; L354-V358 HydrophobicContact CG-CG2 4.2Å; L354-V358 WeakPolarHBondContact O-CB 3.48Å; L354-V358 WeakPolarHBondContact O-CG2 3.46Å; L354-V358 PolarHBondContact O-N 3.45Å; V358-C361 WeakPolarHBondContact O-CB 3.25Å; V358-C361 PolarHBondContact O-N 3.2Å; V358-A362 PolarHBondContact O-N 3.48Å; V358-F514 HydrophobicContact CG1-CD1 4.21Å; V358-F514 VanDerWaalsContact CG1-O 3.29Å; V358-F514 WeakPolarHBondContact CG1-O 3.32Å; V358-Y517 HydrophobicContact CG1-CD1 3.93Å; V358-Y517 HydrophobicContact CG1-CG 3.78Å; V358-Y517 HydrophobicContact CG2-CD1 3.87Å; V358-Y517 HydrophobicContact CG2-CE1 4.07Å; V358-Y517 HydrophobicContact CG2-CG 4.25Å; V358-F518 HydrophobicContact CB-CE2 3.94Å; V358-F518 HydrophobicContact CB-CZ 4.37Å; V358-F518 HydrophobicContact CG1-CD2 4.39Å; V358-F518 HydrophobicContact CG1-CE2 3.78Å; V358-F518 HydrophobicContact CG2-CE2 4.22Å; V358-F518 HydrophobicContact CG2-CZ 4.18Å
359	D	91.3	Very high	93.5	Very high	11 Å²	11	27.9 Å²	27.9	6%	0.059	15%	0.154	C	C	.	.	H	α-helix	trans	-64.6	-41.7	176.7	-171	-92.5	0	0	0	112.6	K149 S355 A356 L357 C361 A362 Q363 I395	K149-D359 VanDerWaalsContact CD-OD2 3.31Å; K149-D359 WeakPolarHBondContact CD-OD2 3.4Å; K149-D359 VanDerWaalsContact CE-OD2 3.3Å; K149-D359 WeakPolarHBondContact CE-OD2 3.43Å; K149-D359 IonicContact NZ-OD2 2.64Å; K149-D359 PolarHBondContact NZ-OD2 2.9Å; S355-D359 WeakPolarHBondContact O-CB 3.04Å; S355-D359 PolarHBondContact O-N 3.26Å; S355-D359 VanDerWaalsContact O-N 3.09Å; A356-D359 PolarHBondContact O-N 2.81Å; L357-D359 VanDerWaalsContact C-N 3.28Å; L357-D359 PolarHBondContact O-N 3.34Å; D359-C361 VanDerWaalsContact C-N 3.3Å; D359-C361 PolarHBondContact O-N 3.39Å; D359-A362 WeakPolarHBondContact O-CB 3.47Å; D359-A362 PolarHBondContact O-N 3.09Å; D359-Q363 WeakPolarHBondContact O-CG 3.39Å; D359-Q363 PolarHBondContact O-N 3.39Å; D359-Q363 PolarHBondContact OD1-NE2 2.81Å; D359-I395 HydrophobicContact CB-CG2 4.36Å; D359-I395 WeakPolarHBondContact OD1-CG2 3.39Å
360	M	94.7	Very high	93.9	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-59.5	-41.7	172.5	-69.4	173.6	174.8	0	0	111.8	L340 Y343 L352 A356 L357 A362 Q363 I364 P396 V398	L340-M360 HydrophobicContact CD1-CE 4.28Å; L340-M360 HydrophobicContact CD1-SD 3.65Å; Y343-M360 HydrophobicContact CD1-CE 4.41Å; Y343-M360 HydrophobicContact CE1-CE 4.08Å; L352-M360 HydrophobicContact CD1-CE 3.48Å; L352-M360 VanDerWaalsContact CD1-CE 3.48Å; L352-M360 HydrophobicContact CD1-SD 4.11Å; A356-M360 WeakPolarHBondContact O-CG 3.47Å; A356-M360 PolarHBondContact O-N 3.38Å; L357-M360 WeakPolarHBondContact O-CB 3.33Å; L357-M360 PolarHBondContact O-N 3.09Å; M360-A362 VanDerWaalsContact C-N 3.34Å; M360-A362 PolarHBondContact O-N 2.94Å; M360-Q363 PolarHBondContact O-N 2.71Å; M360-I364 WeakPolarHBondContact O-CD1 3.44Å; M360-I364 WeakPolarHBondContact O-CG1 3.46Å; M360-I364 PolarHBondContact O-N 2.78Å; M360-P396 HydrophobicContact CE-CB 3.7Å; M360-P396 HydrophobicContact CE-CG 3.46Å; M360-P396 VanDerWaalsContact CE-CG 3.46Å; M360-V398 HydrophobicContact CB-CG1 4.43Å; M360-V398 HydrophobicContact CB-CG2 4.17Å; M360-V398 HydrophobicContact CE-CG1 4.39Å; M360-V398 HydrophobicContact CG-CG1 3.88Å; M360-V398 HydrophobicContact CG-CG2 4.34Å; M360-V398 HydrophobicContact SD-CG1 4.4Å
361	C	97.8	Very high	94.2	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-59.6	-44.3	175.5	-64.6	0	0	0	0	111.5	L357 V358 D359 I364 A365 Y446 L450 F514	L357-C361 PolarHBondContact O-N 2.68Å; L357-C361 PolarHBondContact O-SG 3.42Å; V358-C361 WeakPolarHBondContact O-CB 3.25Å; V358-C361 PolarHBondContact O-N 3.2Å; D359-C361 VanDerWaalsContact C-N 3.3Å; D359-C361 PolarHBondContact O-N 3.39Å; C361-I364 PolarHBondContact O-N 3.38Å; C361-A365 WeakPolarHBondContact O-CB 3.3Å; C361-A365 PolarHBondContact O-N 2.94Å; C361-Y446 PolarHBondContact O-OH 3.47Å; C361-L450 HydrophobicContact CB-CD2 3.72Å; C361-L450 WeakPolarHBondContact SG-CD2 3.43Å; C361-F514 HydrophobicContact CB-CB 4.38Å; C361-F514 HydrophobicContact CB-CD1 3.78Å; C361-F514 HydrophobicContact CB-CD2 3.98Å; C361-F514 HydrophobicContact CB-CE1 4.01Å; C361-F514 HydrophobicContact CB-CE2 4.22Å; C361-F514 HydrophobicContact CB-CG 3.78Å; C361-F514 HydrophobicContact CB-CZ 4.23Å
362	A	95.9	Very high	94.4	Very high	2 Å²	2	17.5 Å²	17.5	2%	0.017	10%	0.103	C	C	.	.	H	α-helix	trans	-61.4	-49.5	175.7	0	0	0	0	0	111.6	V358 D359 M360 I364 A365 N366 Y511 F514 D515	V358-A362 PolarHBondContact O-N 3.48Å; D359-A362 WeakPolarHBondContact O-CB 3.47Å; D359-A362 PolarHBondContact O-N 3.09Å; M360-A362 VanDerWaalsContact C-N 3.34Å; M360-A362 PolarHBondContact O-N 2.94Å; A362-I364 VanDerWaalsContact C-N 3.32Å; A362-I364 PolarHBondContact O-N 2.83Å; A362-A365 PolarHBondContact O-N 3.23Å; A362-N366 WeakPolarHBondContact O-CB 3.38Å; A362-N366 PolarHBondContact O-N 3.43Å; A362-Y511 HydrophobicContact CB-CD2 4.33Å; A362-Y511 WeakPolarHBondContact O-CD2 3.27Å; A362-F514 HydrophobicContact CB-CB 3.72Å; A362-D515 HydrophobicContact CB-CB 4.24Å
363	Q	95.5	Very high	94.6	Very high	15 Å²	15	22 Å²	22	7%	0.07	12%	0.123	C	C	.	.	H	α-helix	trans	-56.4	-43.8	178.1	-76.2	-172.5	64.3	0	0	112.4	N314 D359 M360 N366 G367 P396 V398	N314-Q363 WeakPolarHBondContact CB-O 3.38Å; N314-Q363 WeakPolarHBondContact ND2-CB 3.44Å; N314-Q363 PolarHBondContact ND2-OE1 2.97Å; D359-Q363 WeakPolarHBondContact O-CG 3.39Å; D359-Q363 PolarHBondContact O-N 3.39Å; D359-Q363 PolarHBondContact OD1-NE2 2.81Å; M360-Q363 PolarHBondContact O-N 2.71Å; Q363-N366 WeakPolarHBondContact O-CB 3.26Å; Q363-N366 PolarHBondContact O-N 3.4Å; Q363-G367 PolarHBondContact O-N 3.39Å; Q363-G367 VanDerWaalsContact O-N 3.15Å; Q363-P396 PolarHBondContact NE2-O 3.18Å; Q363-V398 HydrophobicContact CB-CG2 3.44Å; Q363-V398 VanDerWaalsContact CB-CG2 3.44Å; Q363-V398 HydrophobicContact CG-CG2 4.29Å
364	I	98.3	Very high	94.6	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-66.3	-45.2	177.8	-64.3	160.4	0	0	0	110.8	L340 M360 C361 A362 N366 G367 M368 L381 I386 V398 V400 Y446 L449	L340-I364 HydrophobicContact CD2-CD1 3.96Å; M360-I364 WeakPolarHBondContact O-CD1 3.44Å; M360-I364 WeakPolarHBondContact O-CG1 3.46Å; M360-I364 PolarHBondContact O-N 2.78Å; C361-I364 PolarHBondContact O-N 3.38Å; A362-I364 VanDerWaalsContact C-N 3.32Å; A362-I364 PolarHBondContact O-N 2.83Å; I364-N366 VanDerWaalsContact C-N 3.27Å; I364-N366 PolarHBondContact O-N 3.43Å; I364-G367 PolarHBondContact O-N 3.49Å; I364-M368 WeakPolarHBondContact O-CG 3.42Å; I364-M368 PolarHBondContact O-N 2.76Å; I364-L381 HydrophobicContact CG2-CD1 4.43Å; I364-I386 HydrophobicContact CD1-CD1 4.31Å; I364-I386 HydrophobicContact CD1-CG1 3.94Å; I364-I386 HydrophobicContact CD1-CG2 3.96Å; I364-I386 HydrophobicContact CG1-CD1 4.1Å; I364-I386 HydrophobicContact CG1-CG1 4.23Å; I364-I386 HydrophobicContact CG1-CG2 3.98Å; I364-I386 HydrophobicContact CG2-CD1 3.93Å; I364-V398 HydrophobicContact CD1-CG2 4.35Å; I364-V398 HydrophobicContact CG1-CG2 3.83Å; I364-V400 HydrophobicContact CG2-CG2 4.15Å; I364-Y446 HydrophobicContact CB-CE2 4.15Å; I364-Y446 HydrophobicContact CG2-CD2 3.99Å; I364-Y446 HydrophobicContact CG2-CE2 3.78Å; I364-L449 HydrophobicContact CD1-CD1 4.42Å; I364-L449 HydrophobicContact CD1-CD2 3.72Å; I364-L449 HydrophobicContact CG2-CD1 4.16Å
365	A	98.6	Very high	94.5	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-60.7	-38	176.5	0	0	0	0	0	111.8	C361 A362 M368 A369 Y446 L510	C361-A365 WeakPolarHBondContact O-CB 3.3Å; C361-A365 PolarHBondContact O-N 2.94Å; A362-A365 PolarHBondContact O-N 3.23Å; A365-M368 CarbonylContact O-C 3.47Å; A365-M368 PolarHBondContact O-N 3.13Å; A365-A369 WeakPolarHBondContact O-CB 3.46Å; A365-A369 PolarHBondContact O-N 3.22Å; A365-Y446 HydrophobicContact CB-CE2 4.15Å; A365-L510 HydrophobicContact CB-CB 4.17Å
366	N	97	Very high	94.6	Very high	32 Å²	32	28 Å²	28	17%	0.171	13%	0.128	C	C	.	.	H	α-helix	trans	-60.9	-45.7	175.5	-165.8	33.4	0	0	0	111.6	H312 N314 A362 Q363 I364 M368 A369 Y370 Y511	H312-N366 PolarHBondContact CE1-ND2 3.02Å; H312-N366 VanDerWaalsContact CE1-ND2 3.33Å; H312-N366 PolarHBondContact CE1-O 3.33Å; H312-N366 PolarHBondContact NE2-ND2 3.28Å; N314-N366 PolarHBondContact OD1-ND2 3.16Å; A362-N366 WeakPolarHBondContact O-CB 3.38Å; A362-N366 PolarHBondContact O-N 3.43Å; Q363-N366 WeakPolarHBondContact O-CB 3.26Å; Q363-N366 PolarHBondContact O-N 3.4Å; I364-N366 VanDerWaalsContact C-N 3.27Å; I364-N366 PolarHBondContact O-N 3.43Å; N366-M368 VanDerWaalsContact C-N 3.34Å; N366-M368 PolarHBondContact O-N 3Å; N366-A369 PolarHBondContact O-N 3.5Å; N366-Y370 PolarHBondContact O-N 3.46Å; N366-Y511 HydrophobicContact CB-CD2 3.61Å; N366-Y511 HydrophobicContact CB-CE2 3.75Å; N366-Y511 HydrophobicContact CB-CG 4.18Å
367	G	96.5	Very high	94.7	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-60.6	-41.7	174	0	0	0	0	0	112.9	Q363 I364 Y370 L371	Q363-G367 PolarHBondContact O-N 3.39Å; Q363-G367 VanDerWaalsContact O-N 3.15Å; I364-G367 PolarHBondContact O-N 3.49Å; G367-Y370 WeakPolarHBondContact O-CB 3.24Å; G367-Y370 PolarHBondContact O-N 2.61Å; G367-L371 PolarHBondContact O-N 3.44Å
368	M	98	Very high	94.5	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.005	13%	0.129	C	C	.	.	H	α-helix	trans	-73.3	-29	178.2	-69.2	-59.1	-54.6	0	0	113.5	I364 A365 N366 Y370 L371 E372 H378 L381 V400 D442 F507	I364-M368 WeakPolarHBondContact O-CG 3.42Å; I364-M368 PolarHBondContact O-N 2.76Å; A365-M368 CarbonylContact O-C 3.47Å; A365-M368 PolarHBondContact O-N 3.13Å; N366-M368 VanDerWaalsContact C-N 3.34Å; N366-M368 PolarHBondContact O-N 3Å; M368-Y370 VanDerWaalsContact C-N 3.33Å; M368-L371 HydrophobicContact CE-CD1 4.17Å; M368-L371 PolarHBondContact O-N 2.72Å; M368-L371 HydrophobicContact SD-CD1 3.78Å; M368-E372 WeakPolarHBondContact O-CB 3.49Å; M368-E372 PolarHBondContact O-N 3Å; M368-H378 HydrophobicContact CE-CB 3.99Å; M368-H378 HydrophobicContact SD-CB 4.38Å; M368-L381 HydrophobicContact CE-CD2 4.13Å; M368-L381 HydrophobicContact CG-CD1 4.33Å; M368-L381 HydrophobicContact CG-CD2 3.94Å; M368-L381 HydrophobicContact SD-CD1 3.93Å; M368-L381 HydrophobicContact SD-CD2 3.97Å; M368-V400 HydrophobicContact CG-CG2 4.4Å; M368-V400 HydrophobicContact SD-CG1 4.15Å; M368-V400 HydrophobicContact SD-CG2 4.41Å; M368-D442 HydrophobicContact CE-CB 3.8Å; M368-F507 HydrophobicContact CB-CB 4.19Å; M368-F507 HydrophobicContact CB-CD1 3.31Å; M368-F507 HydrophobicContact CB-CD2 3.74Å; M368-F507 HydrophobicContact CB-CE1 3.39Å; M368-F507 HydrophobicContact CB-CE2 3.83Å; M368-F507 HydrophobicContact CB-CG 3.48Å; M368-F507 VanDerWaalsContact CB-CG 3.48Å; M368-F507 HydrophobicContact CB-CZ 3.66Å; M368-F507 HydrophobicContact CE-CD2 4.47Å; M368-F507 HydrophobicContact CE-CE1 4.49Å; M368-F507 HydrophobicContact CE-CE2 3.67Å; M368-F507 HydrophobicContact CE-CZ 3.69Å; M368-F507 HydrophobicContact CG-CD1 4.15Å; M368-F507 HydrophobicContact CG-CE1 3.75Å; M368-F507 HydrophobicContact CG-CE2 4.43Å; M368-F507 HydrophobicContact CG-CZ 3.9Å
369	A	97.7	Very high	94.4	Very high	17 Å²	17	31.1 Å²	31.1	14%	0.14	14%	0.139	C	C	.	.	H	α-helix	trans	-63.5	-41.2	173.2	0	0	0	0	0	110.7	A365 N366 L371 E372 E373 F507	A365-A369 WeakPolarHBondContact O-CB 3.46Å; A365-A369 PolarHBondContact O-N 3.22Å; N366-A369 PolarHBondContact O-N 3.5Å; A369-L371 PolarHBondContact O-N 3.33Å; A369-E372 WeakPolarHBondContact O-CB 3.31Å; A369-E372 PolarHBondContact O-N 3.34Å; A369-E373 PolarHBondContact O-N 3.25Å; A369-F507 HydrophobicContact CB-CB 3.88Å
370	Y	95.8	Very high	94.3	Very high	19 Å²	19	32 Å²	32	8%	0.075	14%	0.144	C	C	.	.	H	α-helix	trans	-58.6	-46.1	170.7	-179.4	-82.9	0	0	0	111.6	C310 D311 H312 L315 N366 G367 M368 E372 E373 H374 M376	C310-Y370 HydrophobicContact CB-CE1 4.13Å; D311-Y370 PolarHBondContact N-OH 3.02Å; H312-Y370 HydrophobicContact CB-CD1 4.32Å; H312-Y370 HydrophobicContact CB-CD2 3.96Å; H312-Y370 HydrophobicContact CB-CE2 4.27Å; H312-Y370 HydrophobicContact CB-CG 3.98Å; H312-Y370 AromaticContact CD2-CD2 3.68Å; H312-Y370 AromaticContact CD2-CG 3.96Å; H312-Y370 AromaticContact CG-CG 3.99Å; L315-Y370 HydrophobicContact CD1-CD1 3.49Å; L315-Y370 VanDerWaalsContact CD1-CD1 3.49Å; L315-Y370 HydrophobicContact CD1-CE1 3.99Å; L315-Y370 HydrophobicContact CD1-CG 4.24Å; N366-Y370 PolarHBondContact O-N 3.46Å; G367-Y370 WeakPolarHBondContact O-CB 3.24Å; G367-Y370 PolarHBondContact O-N 2.61Å; M368-Y370 VanDerWaalsContact C-N 3.33Å; Y370-E372 VanDerWaalsContact C-N 3.34Å; Y370-E372 PolarHBondContact O-N 2.58Å; Y370-E373 PolarHBondContact O-N 2.7Å; Y370-H374 AromaticContact CD1-ND1 3.82Å; Y370-H374 AromaticContact CD2-CE1 3.78Å; Y370-H374 AromaticContact CE1-CE1 3.79Å; Y370-H374 AromaticContact CE1-ND1 3.69Å; Y370-H374 AromaticContact CE2-CE1 3.37Å; Y370-H374 WeakPolarHBondContact CE2-CE1 3.29Å; Y370-H374 AromaticContact CE2-ND1 3.98Å; Y370-H374 AromaticContact CZ-CE1 3.37Å; Y370-H374 AromaticContact CZ-ND1 3.78Å; Y370-H374 AromaticContact CZ-NE2 3.71Å; Y370-H374 PolarHBondContact O-N 2.7Å; Y370-H374 VanDerWaalsContact O-N 3.17Å; Y370-H374 PolarHBondContact O-ND1 3.18Å; Y370-M376 HydrophobicContact CD1-CE 4.45Å; Y370-M376 HydrophobicContact CE1-CE 4.16Å
371	L	94.2	Very high	94.4	Very high	0 Å²	0	32 Å²	32	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-63.1	-40.1	177.4	-63.2	-174.6	0	0	0	112	L315 G367 M368 A369 H374 R375 M376 F403	L315-L371 HydrophobicContact CD1-CD2 3.66Å; L315-L371 HydrophobicContact CD1-CG 4.17Å; L315-L371 HydrophobicContact CD2-CD1 4.29Å; L315-L371 HydrophobicContact CD2-CD2 4.38Å; L315-L371 HydrophobicContact CD2-CG 4.18Å; G367-L371 PolarHBondContact O-N 3.44Å; M368-L371 HydrophobicContact CE-CD1 4.17Å; M368-L371 PolarHBondContact O-N 2.72Å; M368-L371 HydrophobicContact SD-CD1 3.78Å; A369-L371 PolarHBondContact O-N 3.33Å; L371-H374 CarbonylContact O-C 3.57Å; L371-H374 PolarHBondContact O-N 3.18Å; L371-R375 PolarHBondContact O-N 3.39Å; L371-R375 VanDerWaalsContact O-N 3.11Å; L371-M376 HydrophobicContact CB-CB 4.15Å; L371-M376 HydrophobicContact CD2-CB 4.21Å; L371-M376 HydrophobicContact CD2-CE 3.32Å; L371-M376 HydrophobicContact CD2-SD 4.1Å; L371-M376 PolarHBondContact O-N 3.28Å; L371-F403 HydrophobicContact CD1-CB 3.89Å; L371-F403 HydrophobicContact CD1-CD2 4.47Å; L371-F403 HydrophobicContact CD1-CG 4.21Å; L371-F403 HydrophobicContact CD2-CD2 3.91Å; L371-F403 HydrophobicContact CD2-CE2 4.34Å; L371-F403 HydrophobicContact CD2-CG 4.43Å
372	E	94.6	Very high	94.3	Very high	40 Å²	40	32 Å²	32	19%	0.187	14%	0.144	C	C	.	.	H	α-helix	trans	-60	-48.3	176	174.6	166.4	-123.3	0	0	111.8	M368 A369 Y370 H374 R375 V439 T506 F507	M368-E372 WeakPolarHBondContact O-CB 3.49Å; M368-E372 PolarHBondContact O-N 3Å; A369-E372 WeakPolarHBondContact O-CB 3.31Å; A369-E372 PolarHBondContact O-N 3.34Å; Y370-E372 VanDerWaalsContact C-N 3.34Å; Y370-E372 PolarHBondContact O-N 2.58Å; E372-H374 PolarHBondContact O-N 3.41Å; E372-R375 PolarHBondContact O-N 2.99Å; E372-V439 HydrophobicContact CB-CG1 3.76Å; E372-V439 HydrophobicContact CG-CG1 3.75Å; E372-V439 WeakPolarHBondContact OE1-CG1 3.43Å; E372-T506 WeakPolarHBondContact OE2-CB 3.2Å; E372-F507 HydrophobicContact CB-CD2 4.31Å; E372-F507 PolarHBondContact OE2-N 3.42Å
373	E	94.3	Very high	94.4	Very high	111 Å²	111	32 Å²	32	52%	0.519	14%	0.143	S	C	.	.	H	α-helix	trans	-57.7	-38.9	177.1	-173.9	-177.6	179.9	0	0	111.7	A369 Y370 R375	A369-E373 PolarHBondContact O-N 3.25Å; Y370-E373 PolarHBondContact O-N 2.7Å; E373-R375 VanDerWaalsContact C-N 3.26Å; E373-R375 PolarHBondContact O-N 2.84Å
374	H	90.9	Very high	94.3	Very high	87 Å²	87	34.6 Å²	34.6	40%	0.403	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	8.4	178.6	-66.3	76.3	0	0	0	113.4	Y370 L371 E372 M376	Y370-H374 AromaticContact CD1-ND1 3.82Å; Y370-H374 AromaticContact CD2-CE1 3.78Å; Y370-H374 AromaticContact CE1-CE1 3.79Å; Y370-H374 AromaticContact CE1-ND1 3.69Å; Y370-H374 AromaticContact CE2-CE1 3.37Å; Y370-H374 WeakPolarHBondContact CE2-CE1 3.29Å; Y370-H374 AromaticContact CE2-ND1 3.98Å; Y370-H374 AromaticContact CZ-CE1 3.37Å; Y370-H374 AromaticContact CZ-ND1 3.78Å; Y370-H374 AromaticContact CZ-NE2 3.71Å; Y370-H374 PolarHBondContact O-N 2.7Å; Y370-H374 VanDerWaalsContact O-N 3.17Å; Y370-H374 PolarHBondContact O-ND1 3.18Å; L371-H374 CarbonylContact O-C 3.57Å; L371-H374 PolarHBondContact O-N 3.18Å; E372-H374 PolarHBondContact O-N 3.41Å; H374-M376 HydrophobicContact CB-CE 3.46Å; H374-M376 VanDerWaalsContact CB-CE 3.46Å; H374-M376 HydrophobicContact CB-CG 4.28Å; H374-M376 PolarHBondContact O-N 3.35Å
375	R	89.2	Confident	94.1	Very high	214 Å²	214	35.3 Å²	35.3	81%	0.808	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.3	34.1	179.3	-52	178.7	-177	-172.2	-0.2	112.9	L371 E372 E373	L371-R375 PolarHBondContact O-N 3.39Å; L371-R375 VanDerWaalsContact O-N 3.11Å; E372-R375 PolarHBondContact O-N 2.99Å; E373-R375 VanDerWaalsContact C-N 3.26Å; E373-R375 PolarHBondContact O-N 2.84Å
376	M	89.6	Confident	94.1	Very high	23 Å²	23	35.3 Å²	35.3	11%	0.113	16%	0.156	C	C	.	.			trans	-95	138.8	175.7	-67.7	-171.8	-78.8	0	0	110.3	I306 C310 Y370 L371 H374	I306-M376 HydrophobicContact CG2-SD 3.68Å; C310-M376 WeakPolarHBondContact SG-CE 3.4Å; Y370-M376 HydrophobicContact CD1-CE 4.45Å; Y370-M376 HydrophobicContact CE1-CE 4.16Å; L371-M376 HydrophobicContact CB-CB 4.15Å; L371-M376 HydrophobicContact CD2-CB 4.21Å; L371-M376 HydrophobicContact CD2-CE 3.32Å; L371-M376 HydrophobicContact CD2-SD 4.1Å; L371-M376 PolarHBondContact O-N 3.28Å; H374-M376 HydrophobicContact CB-CE 3.46Å; H374-M376 VanDerWaalsContact CB-CE 3.46Å; H374-M376 HydrophobicContact CB-CG 4.28Å; H374-M376 PolarHBondContact O-N 3.35Å
377	V	90	Very high	94.1	Very high	21 Å²	21	35.6 Å²	35.6	13%	0.127	16%	0.158	C	C	.	.			trans	-114.1	124.3	177.7	-173.3	0	0	0	0	107.2	R379 F437 T438 V439 D442	V377-R379 HydrophobicContact CB-CG 4.36Å; V377-R379 HydrophobicContact CG1-CG 3.72Å; V377-F437 HydrophobicContact CG1-CB 4.28Å; V377-T438 WeakPolarHBondContact CG1-O 3.26Å; V377-V439 HydrophobicContact CG2-CG2 4.27Å; V377-D442 WeakPolarHBondContact CA-OD2 3.4Å; V377-D442 WeakPolarHBondContact CG1-OD2 3.35Å
378	H	91.5	Very high	94	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	16%	0.158	C	C	.	.			trans	-75.3	-44.4	-178.1	-173.5	-35.8	0	0	0	112.2	M368 D380 V400 A401 D442	M368-H378 HydrophobicContact CE-CB 3.99Å; M368-H378 HydrophobicContact SD-CB 4.38Å; H378-D380 PolarHBondContact CE1-O 2.85Å; H378-D380 PolarHBondContact ND1-N 3.17Å; H378-D380 PolarHBondContact O-N 3.19Å; H378-D380 VanDerWaalsContact O-N 3.11Å; H378-V400 WeakPolarHBondContact CD2-CG1 3.34Å; H378-V400 VanDerWaalsContact NE2-CG1 3.34Å; H378-V400 WeakPolarHBondContact NE2-CG1 3.38Å; H378-A401 PolarHBondContact CE1-O 3.34Å; H378-A401 PolarHBondContact NE2-O 3.05Å; H378-A401 VanDerWaalsContact NE2-O 3.11Å; H378-D442 PolarHBondContact N-OD2 3.32Å
379	R	90.8	Very high	93.8	Very high	60 Å²	60	35.8 Å²	35.8	23%	0.226	16%	0.16	C	C	.	.	S	Bend	trans	67.8	-9.2	-180	-48.7	-177.5	176.1	-178.5	0.8	117.4	V377 A406 F437 D442	V377-R379 HydrophobicContact CB-CG 4.36Å; V377-R379 HydrophobicContact CG1-CG 3.72Å; R379-A406 HydrophobicContact CB-CB 3.75Å; R379-A406 HydrophobicContact CG-CB 4.31Å; R379-F437 HydrophobicContact CB-CD1 3.95Å; R379-F437 HydrophobicContact CB-CE1 4.23Å; R379-F437 HydrophobicContact CG-CB 4.11Å; R379-F437 HydrophobicContact CG-CD1 3.83Å; R379-F437 HydrophobicContact CG-CG 4.08Å; R379-D442 WeakPolarHBondContact CA-OD1 3.34Å; R379-D442 PolarHBondContact N-OD1 2.9Å
380	D	90.1	Very high	93.2	Very high	31 Å²	31	41 Å²	41	17%	0.166	18%	0.182	C	C	.	.			trans	-141.2	38	-179.9	-164.4	26.6	0	0	0	111.9	H378 A382 R384 N385 P423	H378-D380 PolarHBondContact CE1-O 2.85Å; H378-D380 PolarHBondContact ND1-N 3.17Å; H378-D380 PolarHBondContact O-N 3.19Å; H378-D380 VanDerWaalsContact O-N 3.11Å; D380-A382 PolarHBondContact O-N 3.41Å; D380-R384 IonicContact OD1-CZ 2.78Å; D380-R384 IonicContact OD1-NE 2.58Å; D380-R384 IonicContact OD1-NH2 3.25Å; D380-R384 PolarHBondContact OD1-NH2 3.19Å; D380-R384 IonicContact OD2-NH2 3.74Å; D380-N385 PolarHBondContact O-ND2 3.34Å; D380-N385 PolarHBondContact OD2-ND2 3.31Å; D380-P423 WeakPolarHBondContact OD1-CG 3.46Å
381	L	95.6	Very high	92.5	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	19%	0.194	C	C	.	.			trans	-70.4	116.8	179.7	-176	65	0	0	0	110.6	I364 M368 I386 V400 S445 Y446 L449 F507	I364-L381 HydrophobicContact CG2-CD1 4.43Å; M368-L381 HydrophobicContact CE-CD2 4.13Å; M368-L381 HydrophobicContact CG-CD1 4.33Å; M368-L381 HydrophobicContact CG-CD2 3.94Å; M368-L381 HydrophobicContact SD-CD1 3.93Å; M368-L381 HydrophobicContact SD-CD2 3.97Å; L381-I386 HydrophobicContact CD1-CD1 3.95Å; L381-V400 HydrophobicContact CD1-CG1 4.17Å; L381-S445 WeakPolarHBondContact O-CB 3.41Å; L381-Y446 HydrophobicContact CD2-CD2 4.21Å; L381-Y446 HydrophobicContact CD2-CG 4.48Å; L381-L449 HydrophobicContact CD1-CD1 3.97Å; L381-L449 HydrophobicContact CG-CD1 3.99Å; L381-F507 HydrophobicContact CD2-CE1 4.46Å; L381-F507 HydrophobicContact CD2-CZ 4.21Å
382	A	96.2	Very high	91.2	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	20%	0.201	C	C	.	.	S	Bend	trans	-161.6	161.5	-179.6	0	0	0	0	0	110.4	D380 R384 N385 I386 W426	D380-A382 PolarHBondContact O-N 3.41Å; A382-R384 HydrophobicContact CB-CG 3.93Å; A382-R384 VanDerWaalsContact CB-NH1 3.31Å; A382-R384 PolarHBondContact O-N 2.79Å; A382-N385 PolarHBondContact O-N 3.03Å; A382-I386 PolarHBondContact O-N 3.35Å; A382-W426 VanDerWaalsContact CB-CD1 3.49Å; A382-W426 HydrophobicContact CB-CD2 4.45Å; A382-W426 HydrophobicContact CB-CG 4.1Å
383	A	97.4	Very high	89.8	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-58.5	-25.3	-179.8	0	0	0	0	0	113.9	L340 L341 N385 I386 E452	L340-A383 WeakPolarHBondContact CB-O 3.33Å; L340-A383 PolarHBondContact N-O 2.74Å; L341-A383 HydrophobicContact CB-CB 4.06Å; L341-A383 HydrophobicContact CD1-CB 4.38Å; L341-A383 PolarHBondContact N-O 3.3Å; L341-A383 VanDerWaalsContact N-O 3.1Å; A383-N385 VanDerWaalsContact C-N 3.28Å; A383-N385 PolarHBondContact O-N 3.46Å; A383-I386 PolarHBondContact O-N 3.15Å; A383-E452 HydrophobicContact CB-CB 3.95Å; A383-E452 HydrophobicContact CB-CG 4.45Å; A383-E452 WeakPolarHBondContact CB-OE2 3.49Å; A383-E452 PolarHBondContact N-OE2 2.83Å
384	R	94.6	Very high	88.5	Confident	70 Å²	70	40.9 Å²	40.9	26%	0.264	20%	0.196	S	C	.	.	G	3₁₀ helix	trans	-66.8	-25.9	173.7	62	173.8	174.6	-76.8	-5.3	113.9	S339 L341 D380 A382 P423	S339-R384 WeakPolarHBondContact CB-O 3.31Å; L341-R384 HydrophobicContact CD2-CB 4.17Å; D380-R384 IonicContact OD1-CZ 2.78Å; D380-R384 IonicContact OD1-NE 2.58Å; D380-R384 IonicContact OD1-NH2 3.25Å; D380-R384 PolarHBondContact OD1-NH2 3.19Å; D380-R384 IonicContact OD2-NH2 3.74Å; A382-R384 HydrophobicContact CB-CG 3.93Å; A382-R384 VanDerWaalsContact CB-NH1 3.31Å; A382-R384 PolarHBondContact O-N 2.79Å; R384-P423 VanDerWaalsContact NH2-CB 3.26Å
385	N	94.4	Very high	87.6	Confident	15 Å²	15	38.2 Å²	38.2	8%	0.08	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-104.2	9.7	-178.2	-67.8	-14	0	0	0	112.1	D380 A382 A383 A401	D380-N385 PolarHBondContact O-ND2 3.34Å; D380-N385 PolarHBondContact OD2-ND2 3.31Å; A382-N385 PolarHBondContact O-N 3.03Å; A383-N385 VanDerWaalsContact C-N 3.28Å; A383-N385 PolarHBondContact O-N 3.46Å; N385-A401 WeakPolarHBondContact O-CB 3.44Å; N385-A401 PolarHBondContact O-N 3.24Å
386	I	97.6	Very high	87.5	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	128.8	165	-53.1	-53.2	0	0	0	107.5	S339 L340 I364 L381 A382 A383 V398 K399 V400 L449	S339-I386 CarbonylContact C-O 3.51Å; S339-I386 VanDerWaalsContact CA-O 3.3Å; S339-I386 WeakPolarHBondContact CA-O 3.35Å; L340-I386 HydrophobicContact CB-CB 3.79Å; L340-I386 HydrophobicContact CB-CG2 3.99Å; L340-I386 HydrophobicContact CD2-CB 4.01Å; L340-I386 HydrophobicContact CD2-CG1 4.37Å; L340-I386 HydrophobicContact CD2-CG2 3.88Å; L340-I386 PolarHBondContact N-O 2.8Å; I364-I386 HydrophobicContact CD1-CD1 4.31Å; I364-I386 HydrophobicContact CD1-CG1 3.94Å; I364-I386 HydrophobicContact CD1-CG2 3.96Å; I364-I386 HydrophobicContact CG1-CD1 4.1Å; I364-I386 HydrophobicContact CG1-CG1 4.23Å; I364-I386 HydrophobicContact CG1-CG2 3.98Å; I364-I386 HydrophobicContact CG2-CD1 3.93Å; L381-I386 HydrophobicContact CD1-CD1 3.95Å; A382-I386 PolarHBondContact O-N 3.35Å; A383-I386 PolarHBondContact O-N 3.15Å; I386-V398 HydrophobicContact CG2-CB 3.8Å; I386-V398 HydrophobicContact CG2-CG1 4.39Å; I386-V398 HydrophobicContact CG2-CG2 4.47Å; I386-K399 WeakPolarHBondContact CA-O 3.37Å; I386-V400 HydrophobicContact CD1-CB 4.24Å; I386-V400 HydrophobicContact CD1-CG1 4.32Å; I386-V400 HydrophobicContact CD1-CG2 3.9Å; I386-L449 HydrophobicContact CD1-CD1 4Å; I386-L449 HydrophobicContact CG1-CD1 3.73Å
387	L	96.8	Very high	87.5	Confident	38 Å²	38	27.8 Å²	27.8	20%	0.199	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	144.8	176.5	-61	-175.3	0	0	0	111.2	V316 M335 G338 V398 K399 A401	V316-L387 HydrophobicContact CG2-CB 4.42Å; V316-L387 HydrophobicContact CG2-CD1 3.95Å; V316-L387 HydrophobicContact CG2-CG 4.4Å; M335-L387 HydrophobicContact CB-CB 3.57Å; M335-L387 HydrophobicContact CB-CD1 4.02Å; M335-L387 HydrophobicContact CB-CG 4.38Å; M335-L387 HydrophobicContact CE-CB 4.17Å; M335-L387 VanDerWaalsContact CE-O 3.24Å; M335-L387 WeakPolarHBondContact CE-O 3.33Å; M335-L387 HydrophobicContact CG-CB 3.6Å; M335-L387 HydrophobicContact CG-CD1 3.91Å; M335-L387 HydrophobicContact CG-CG 4.43Å; G338-L387 CarbonylContact O-C 3.45Å; G338-L387 VanDerWaalsContact O-CA 3.29Å; G338-L387 WeakPolarHBondContact O-CA 3.34Å; L387-V398 WeakPolarHBondContact O-CA 3.29Å; L387-K399 PolarHBondContact N-O 3.48Å; L387-K399 PolarHBondContact O-N 2.95Å; L387-A401 HydrophobicContact CD1-CB 3.91Å; L387-A401 HydrophobicContact CG-CB 3.82Å
388	V	95.6	Very high	87.8	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	122.8	-176.8	-171.3	0	0	0	0	109.4	M335 N337 G338 L340 Y343 P396 V398	M335-V388 CarbonylContact C-O 3.58Å; N337-V388 WeakPolarHBondContact CA-O 3.39Å; N337-V388 HydrophobicContact CB-CB 3.68Å; N337-V388 HydrophobicContact CB-CG1 3.76Å; N337-V388 WeakPolarHBondContact CB-O 3.39Å; N337-V388 PolarHBondContact N-O 3.19Å; G338-V388 PolarHBondContact O-N 3.05Å; L340-V388 HydrophobicContact CB-CG2 3.9Å; L340-V388 HydrophobicContact CD1-CG2 3.84Å; Y343-V388 HydrophobicContact CD1-CG1 4.09Å; Y343-V388 HydrophobicContact CD1-CG2 4.12Å; Y343-V388 HydrophobicContact CD2-CG1 4.34Å; Y343-V388 HydrophobicContact CE1-CG1 4.1Å; Y343-V388 HydrophobicContact CE2-CG1 4.39Å; Y343-V388 HydrophobicContact CG-CB 4.37Å; Y343-V388 HydrophobicContact CG-CG1 4.21Å; Y343-V388 HydrophobicContact CG-CG2 4.04Å; V388-P396 HydrophobicContact CG1-CB 3.75Å; V388-V398 HydrophobicContact CG1-CG1 4.45Å; V388-V398 HydrophobicContact CG2-CG1 4.16Å
389	G	92.1	Very high	88	Confident	6 Å²	6	27.4 Å²	27.4	6%	0.062	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	-159.1	179.7	0	0	0	0	0	111.6	N337 T397	N337-G389 PolarHBondContact ND2-O 2.86Å; G389-T397 PolarHBondContact N-O 3.39Å
390	E	86.2	Confident	88.3	Confident	125 Å²	125	24.5 Å²	24.5	58%	0.584	13%	0.132	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-67.3	155.8	175.3	-65.9	-178.3	-179.3	0	0	111.9	V336 T397	V336-E390 HydrophobicContact CG1-CG 3.88Å; E390-T397 PolarHBondContact O-N 2.76Å; E390-T397 VanDerWaalsContact O-N 3.08Å
391	K	80.1	Confident	88.4	Confident	78 Å²	78	23.3 Å²	23.3	34%	0.339	13%	0.126	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	127.5	171.2	-69.1	-178.7	177.9	179.3	0	109.4	Y343 E348 I395 P396	Y343-K391 WeakPolarHBondContact OH-CE 3.49Å; E348-K391 IonicContact OE2-NZ 3.66Å; E348-K391 PolarHBondContact OE2-NZ 2.99Å; K391-I395 WeakPolarHBondContact CA-O 3.33Å; K391-P396 HydrophobicContact CG-CB 4.29Å; K391-P396 HydrophobicContact CG-CG 3.98Å
392	I	67.8	Low	87.8	Confident	29 Å²	29	25.8 Å²	25.8	15%	0.149	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	124.2	167.6	-66.7	128.5	0	0	0	107.2	L150 R237 G394 I395 T397	L150-I392 HydrophobicContact CD2-CG2 3.67Å; R237-I392 HydrophobicContact CB-CD1 4.24Å; R237-I392 HydrophobicContact CB-CG1 4.48Å; R237-I392 HydrophobicContact CG-CB 4.26Å; R237-I392 HydrophobicContact CG-CD1 3.6Å; R237-I392 HydrophobicContact CG-CG1 3.85Å; R237-I392 HydrophobicContact CG-CG2 3.75Å; I392-G394 PolarHBondContact O-N 2.85Å; I392-I395 PolarHBondContact N-O 3.04Å; I392-I395 PolarHBondContact O-N 3.06Å; I392-T397 WeakPolarHBondContact CD1-OG1 3.48Å
393	A	64.1	Low	86.9	Confident	20 Å²	20	26 Å²	26	17%	0.165	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.4	38.5	179.5	0	0	0	0	0	112.9	L150 N153 I395	L150-A393 HydrophobicContact CD2-CB 3.83Å; N153-A393 HydrophobicContact CB-CB 3.96Å; N153-A393 WeakPolarHBondContact CB-O 3.2Å; N153-A393 VanDerWaalsContact ND2-C 3.32Å; N153-A393 VanDerWaalsContact ND2-CA 3.31Å; N153-A393 WeakPolarHBondContact ND2-CA 3.47Å; A393-I395 VanDerWaalsContact C-N 3.28Å; A393-I395 PolarHBondContact O-N 2.82Å
394	G	68.3	Low	85.4	Confident	42 Å²	42	26.9 Å²	26.9	43%	0.433	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.8	-10	-178.3	0	0	0	0	0	115.5	I392	I392-G394 PolarHBondContact O-N 2.85Å
395	I	71.2	Confident	83.7	Confident	31 Å²	31	24.1 Å²	24.1	16%	0.159	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	121	-176.3	-58.4	175.8	0	0	0	109.9	K149 D359 K391 I392 A393	K149-I395 HydrophobicContact CB-CD1 3.75Å; K149-I395 HydrophobicContact CD-CD1 4.38Å; K149-I395 HydrophobicContact CG-CD1 4.27Å; D359-I395 HydrophobicContact CB-CG2 4.36Å; D359-I395 WeakPolarHBondContact OD1-CG2 3.39Å; K391-I395 WeakPolarHBondContact CA-O 3.33Å; I392-I395 PolarHBondContact N-O 3.04Å; I392-I395 PolarHBondContact O-N 3.06Å; A393-I395 VanDerWaalsContact C-N 3.28Å; A393-I395 PolarHBondContact O-N 2.82Å
396	P	86.6	Confident	81.5	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	133.5	174.9	-17.6	31.3	0	0	0	111.4	Y343 L352 M360 Q363 V388 K391	Y343-P396 HydrophobicContact CE1-CG 4.19Å; L352-P396 HydrophobicContact CD2-CG 4.48Å; M360-P396 HydrophobicContact CE-CB 3.7Å; M360-P396 HydrophobicContact CE-CG 3.46Å; M360-P396 VanDerWaalsContact CE-CG 3.46Å; Q363-P396 PolarHBondContact NE2-O 3.18Å; V388-P396 HydrophobicContact CG1-CB 3.75Å; K391-P396 HydrophobicContact CG-CB 4.29Å; K391-P396 HydrophobicContact CG-CG 3.98Å
397	T	90.4	Very high	79.4	Confident	18 Å²	18	28.5 Å²	28.5	11%	0.11	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	132.4	167.2	-57.6	0	0	0	0	109	G389 E390 I392 K399	G389-T397 PolarHBondContact N-O 3.39Å; E390-T397 PolarHBondContact O-N 2.76Å; E390-T397 VanDerWaalsContact O-N 3.08Å; I392-T397 WeakPolarHBondContact CD1-OG1 3.48Å; T397-K399 HydrophobicContact CG2-CG 4.45Å
398	V	95.7	Very high	77	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	142.5	174.4	-62.2	0	0	0	0	110.9	N314 M360 Q363 I364 I386 L387 V388	N314-V398 PolarHBondContact ND2-O 3.43Å; M360-V398 HydrophobicContact CB-CG1 4.43Å; M360-V398 HydrophobicContact CB-CG2 4.17Å; M360-V398 HydrophobicContact CE-CG1 4.39Å; M360-V398 HydrophobicContact CG-CG1 3.88Å; M360-V398 HydrophobicContact CG-CG2 4.34Å; M360-V398 HydrophobicContact SD-CG1 4.4Å; Q363-V398 HydrophobicContact CB-CG2 3.44Å; Q363-V398 VanDerWaalsContact CB-CG2 3.44Å; Q363-V398 HydrophobicContact CG-CG2 4.29Å; I364-V398 HydrophobicContact CD1-CG2 4.35Å; I364-V398 HydrophobicContact CG1-CG2 3.83Å; I386-V398 HydrophobicContact CG2-CB 3.8Å; I386-V398 HydrophobicContact CG2-CG1 4.39Å; I386-V398 HydrophobicContact CG2-CG2 4.47Å; L387-V398 WeakPolarHBondContact O-CA 3.29Å; V388-V398 HydrophobicContact CG1-CG1 4.45Å; V388-V398 HydrophobicContact CG2-CG1 4.16Å
399	K	96.7	Very high	74.7	Confident	12 Å²	12	30.8 Å²	30.8	5%	0.052	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	139	-179.1	-57.4	-171	176.4	-158.4	0	111.1	P313 N314 V316 E333 M335 I386 L387 T397	P313-K399 WeakPolarHBondContact O-CE 3.47Å; N314-K399 CarbonylContact O-C 3.48Å; N314-K399 VanDerWaalsContact O-CA 3.32Å; N314-K399 WeakPolarHBondContact O-CA 3.46Å; V316-K399 HydrophobicContact CG2-CB 3.72Å; E333-K399 WeakPolarHBondContact OE1-CD 3.49Å; E333-K399 IonicContact OE1-NZ 3.39Å; E333-K399 PolarHBondContact OE1-NZ 2.9Å; E333-K399 WeakPolarHBondContact OE2-CE 3.4Å; E333-K399 IonicContact OE2-NZ 2.89Å; E333-K399 PolarHBondContact OE2-NZ 3.12Å; M335-K399 HydrophobicContact CE-CB 3.88Å; M335-K399 HydrophobicContact CE-CD 3.87Å; M335-K399 HydrophobicContact CE-CG 3.59Å; M335-K399 HydrophobicContact SD-CD 3.9Å; M335-K399 HydrophobicContact SD-CG 4.31Å; I386-K399 WeakPolarHBondContact CA-O 3.37Å; L387-K399 PolarHBondContact N-O 3.48Å; L387-K399 PolarHBondContact O-N 2.95Å; T397-K399 HydrophobicContact CG2-CG 4.45Å
400	V	96.6	Very high	72.4	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	129.8	172.4	-174.7	0	0	0	0	108.6	N314 L315 V316 I364 M368 H378 L381 I386 F403	N314-V400 PolarHBondContact O-N 3.33Å; L315-V400 HydrophobicContact CD2-CB 3.71Å; L315-V400 HydrophobicContact CD2-CG1 4.42Å; L315-V400 HydrophobicContact CD2-CG2 4.17Å; V316-V400 WeakPolarHBondContact CG2-O 3.22Å; V316-V400 PolarHBondContact N-O 3.07Å; I364-V400 HydrophobicContact CG2-CG2 4.15Å; M368-V400 HydrophobicContact CG-CG2 4.4Å; M368-V400 HydrophobicContact SD-CG1 4.15Å; M368-V400 HydrophobicContact SD-CG2 4.41Å; H378-V400 WeakPolarHBondContact CD2-CG1 3.34Å; H378-V400 VanDerWaalsContact NE2-CG1 3.34Å; H378-V400 WeakPolarHBondContact NE2-CG1 3.38Å; L381-V400 HydrophobicContact CD1-CG1 4.17Å; I386-V400 HydrophobicContact CD1-CB 4.24Å; I386-V400 HydrophobicContact CD1-CG1 4.32Å; I386-V400 HydrophobicContact CD1-CG2 3.9Å; V400-F403 HydrophobicContact CG1-CD1 4.4Å; V400-F403 WeakPolarHBondContact O-CD1 3.46Å; V400-F403 WeakPolarHBondContact O-CE1 3.49Å
401	A	92.6	Very high	70.3	Confident	6 Å²	6	34.5 Å²	34.5	5%	0.05	19%	0.192	C	C	.	.			trans	-118.4	169.3	179.6	0	0	0	0	0	110.7	V316 H378 N385 L387 F403	V316-A401 HydrophobicContact CB-CB 4.21Å; V316-A401 HydrophobicContact CG2-CB 3.66Å; H378-A401 PolarHBondContact CE1-O 3.34Å; H378-A401 PolarHBondContact NE2-O 3.05Å; H378-A401 VanDerWaalsContact NE2-O 3.11Å; N385-A401 WeakPolarHBondContact O-CB 3.44Å; N385-A401 PolarHBondContact O-N 3.24Å; L387-A401 HydrophobicContact CD1-CB 3.91Å; L387-A401 HydrophobicContact CG-CB 3.82Å; A401-F403 PolarHBondContact O-N 3.39Å; A401-F403 VanDerWaalsContact O-N 3.07Å
402	D	83.5	Confident	68.2	Low	52 Å²	52	36.7 Å²	36.7	28%	0.278	21%	0.208	S	C	.	.	S	Bend	trans	56.4	25.5	174.9	-71.7	-11	0	0	0	114.5	K288	K288-D402 IonicContact NZ-OD1 2.81Å; K288-D402 PolarHBondContact NZ-OD1 3.16Å; K288-D402 IonicContact NZ-OD2 3.94Å; K288-D402 PolarHBondContact NZ-OD2 3.35Å
403	F	77.7	Confident	66.7	Low	5 Å²	5	42.2 Å²	42.2	2%	0.022	23%	0.233	C	C	.	.			trans	-77.4	137.9	168.6	58.7	-85.3	0	0	0	109.5	M307 C310 L315 L371 V400 A401	M307-F403 HydrophobicContact CG-CD2 4.24Å; M307-F403 HydrophobicContact CG-CE2 3.58Å; M307-F403 HydrophobicContact CG-CZ 3.8Å; M307-F403 HydrophobicContact SD-CE2 4.45Å; M307-F403 HydrophobicContact SD-CZ 4.42Å; C310-F403 HydrophobicContact CB-CE2 3.83Å; C310-F403 HydrophobicContact CB-CZ 4.27Å; L315-F403 HydrophobicContact CB-CE1 3.9Å; L315-F403 HydrophobicContact CB-CZ 3.85Å; L315-F403 HydrophobicContact CD1-CE2 4.29Å; L315-F403 HydrophobicContact CD1-CZ 4.19Å; L315-F403 HydrophobicContact CD2-CD1 4.32Å; L315-F403 HydrophobicContact CD2-CE1 4.18Å; L315-F403 HydrophobicContact CG-CE1 4.46Å; L315-F403 HydrophobicContact CG-CZ 4.41Å; L371-F403 HydrophobicContact CD1-CB 3.89Å; L371-F403 HydrophobicContact CD1-CD2 4.47Å; L371-F403 HydrophobicContact CD1-CG 4.21Å; L371-F403 HydrophobicContact CD2-CD2 3.91Å; L371-F403 HydrophobicContact CD2-CE2 4.34Å; L371-F403 HydrophobicContact CD2-CG 4.43Å; V400-F403 HydrophobicContact CG1-CD1 4.4Å; V400-F403 WeakPolarHBondContact O-CD1 3.46Å; V400-F403 WeakPolarHBondContact O-CE1 3.49Å; A401-F403 PolarHBondContact O-N 3.39Å; A401-F403 VanDerWaalsContact O-N 3.07Å
404	G	64.9	Low	65.4	Low	18 Å²	18	50 Å²	50	19%	0.186	26%	0.259	C	S	.	.	S	Bend	trans	101.5	-48.4	-174.5	0	0	0	0	0	113.6	A406 R407	G404-A406 PolarHBondContact O-N 2.78Å; G404-R407 PolarHBondContact O-N 3.3Å
405	L	59.6	Low	63.9	Low	12 Å²	12	51.3 Å²	51.3	6%	0.063	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-19.7	-165.6	-71.5	169.2	0	0	0	114.9	K288 E303 I330 R407	K288-L405 HydrophobicContact CD-CD1 4.33Å; K288-L405 VanDerWaalsContact NZ-CD1 3.29Å; E303-L405 WeakPolarHBondContact OE1-CA 3.48Å; E303-L405 WeakPolarHBondContact OE1-CD2 3.5Å; E303-L405 VanDerWaalsContact OE1-CG 3.31Å; E303-L405 WeakPolarHBondContact OE1-CG 3.25Å; E303-L405 PolarHBondContact OE1-N 3.43Å; E303-L405 VanDerWaalsContact OE2-CA 3.3Å; E303-L405 WeakPolarHBondContact OE2-CA 3.35Å; I330-L405 HydrophobicContact CD1-CD1 4.13Å; I330-L405 HydrophobicContact CD1-CD2 3.81Å; I330-L405 HydrophobicContact CD1-CG 4.48Å; L405-R407 VanDerWaalsContact C-N 3.3Å; L405-R407 PolarHBondContact O-N 3.31Å
406	A	48	Very low	62.3	Low	21 Å²	21	53.7 Å²	53.7	17%	0.174	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-15.5	178.6	0	0	0	0	0	113.8	R379 G404	R379-A406 HydrophobicContact CB-CB 3.75Å; R379-A406 HydrophobicContact CG-CB 4.31Å; G404-A406 PolarHBondContact O-N 2.78Å
407	R	53.5	Low	59.9	Low	85 Å²	85	65.1 Å²	65.1	32%	0.321	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-44.9	-179	-79.4	-173.5	-177.4	161.9	-0.9	112.3	G404 L405	G404-R407 PolarHBondContact O-N 3.3Å; L405-R407 VanDerWaalsContact C-N 3.3Å; L405-R407 PolarHBondContact O-N 3.31Å
408	V	46.8	Very low	57.3	Low	26 Å²	26	68.7 Å²	68.7	16%	0.158	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-35.5	-171.4	177.5	0	0	0	0	112.9	M295 A299 E303 Q410 D411	M295-V408 HydrophobicContact CB-CG1 3.9Å; M295-V408 HydrophobicContact CE-CB 3.54Å; M295-V408 HydrophobicContact CE-CG1 3.48Å; M295-V408 VanDerWaalsContact CE-CG1 3.48Å; M295-V408 HydrophobicContact CE-CG2 3.95Å; A299-V408 HydrophobicContact CB-CB 4.49Å; A299-V408 HydrophobicContact CB-CG1 3.6Å; A299-V408 HydrophobicContact CB-CG2 4.01Å; E303-V408 WeakPolarHBondContact OE2-CG2 3.46Å; V408-Q410 PolarHBondContact O-N 3Å; V408-D411 PolarHBondContact O-N 2.86Å; V408-D411 VanDerWaalsContact O-N 3.16Å
409	I	46.7	Very low	54.7	Low	60 Å²	60	72.1 Å²	72.1	31%	0.308	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-12.1	-177	-56.5	178.9	0	0	0	111.8	F270	F270-I409 HydrophobicContact CD1-CD1 3.24Å; F270-I409 HydrophobicContact CE1-CD1 3.15Å; F270-I409 HydrophobicContact CE1-CG1 4.44Å; F270-I409 HydrophobicContact CE1-CG2 4.25Å; F270-I409 HydrophobicContact CG-CD1 4.18Å; F270-I409 HydrophobicContact CZ-CD1 4.03Å
410	Q	44.2	Very low	52.3	Low	69 Å²	69	75.6 Å²	75.6	32%	0.322	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-15.8	178.8	-72.7	-176.8	-15.5	0	0	115	V408 D412	V408-Q410 PolarHBondContact O-N 3Å; Q410-D412 PolarHBondContact O-N 3.07Å
411	D	41	Very low	50.6	Low	141 Å²	141	84.2 Å²	84.2	75%	0.754	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-24.3	174.9	-77.5	-20	0	0	0	111	V408 E413	V408-D411 PolarHBondContact O-N 2.86Å; V408-D411 VanDerWaalsContact O-N 3.16Å; D411-E413 PolarHBondContact O-N 3.18Å
412	D	37.4	Very low	49.8	Very low	123 Å²	123	87 Å²	87	66%	0.658	46%	0.46	S	S	*	.	S	Bend	trans	-78.4	76.7	163.8	-73.8	-20.9	0	0	0	110	Q410	Q410-D412 PolarHBondContact O-N 3.07Å
413	E	35.9	Very low	50	Low	145 Å²	145	85.8 Å²	85.8	68%	0.678	46%	0.456	S	S	*	.			trans	42.5	108.7	159.1	-66.9	-177.1	164	0	0	116.6	D411 N415	D411-E413 PolarHBondContact O-N 3.18Å; E413-N415 PolarHBondContact O-N 3.34Å; E413-N415 PolarHBondContact OE2-ND2 2.87Å
414	Y	37.2	Very low	50.7	Low	183 Å²	183	86.9 Å²	86.9	72%	0.718	46%	0.461	S	S	*	.			trans	-53.2	89.3	155.5	-179.7	-99.2	0	0	0	110.2	A416	Y414-A416 HydrophobicContact CE1-CB 4.19Å
415	N	35.4	Very low	52.2	Low	70 Å²	70	87.1 Å²	87.1	37%	0.374	46%	0.457	S	S	.	.			trans	-108	93.5	163.7	-83.5	-44.3	0	0	0	105.2	E413 R417 T418	E413-N415 PolarHBondContact O-N 3.34Å; E413-N415 PolarHBondContact OE2-ND2 2.87Å; N415-R417 PolarHBondContact O-N 3.44Å; N415-T418 HydrophobicContact CB-CG2 3.79Å; N415-T418 WeakPolarHBondContact CB-OG1 3.2Å; N415-T418 PolarHBondContact O-N 2.71Å; N415-T418 PolarHBondContact O-OG1 2.83Å
416	A	37.4	Very low	53.9	Low	82 Å²	82	88.3 Å²	88.3	68%	0.678	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	-9.8	164.5	0	0	0	0	0	112.6	Y414	Y414-A416 HydrophobicContact CE1-CB 4.19Å
417	R	36.3	Very low	56.2	Low	240 Å²	240	87.9 Å²	87.9	91%	0.906	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-24.9	171.5	-63.9	-174.5	177.3	-165.5	-0.3	114.8	N415 G419	N415-R417 PolarHBondContact O-N 3.44Å; R417-G419 PolarHBondContact O-N 2.93Å
418	T	36.5	Very low	58.2	Low	93 Å²	93	83.9 Å²	83.9	57%	0.571	44%	0.442	S	S	*	.	S	Bend	trans	-95.6	45.5	-173	51.8	0	0	0	0	113.2	N415 A420	N415-T418 HydrophobicContact CB-CG2 3.79Å; N415-T418 WeakPolarHBondContact CB-OG1 3.2Å; N415-T418 PolarHBondContact O-N 2.71Å; N415-T418 PolarHBondContact O-OG1 2.83Å; T418-A420 PolarHBondContact O-N 2.62Å
419	G	40.3	Very low	60.4	Low	72 Å²	72	83.8 Å²	83.8	74%	0.742	44%	0.441	S	S	*	.			trans	55.1	3	154.4	0	0	0	0	0	119.5	R417 K421	R417-G419 PolarHBondContact O-N 2.93Å; G419-K421 PolarHBondContact O-N 3.24Å; G419-K421 VanDerWaalsContact O-N 3.17Å
420	A	46.4	Very low	62.7	Low	84 Å²	84	82 Å²	82	69%	0.694	43%	0.432	S	S	*	.			trans	-66.1	118	175.4	0	0	0	0	0	106.5	T418 F422	T418-A420 PolarHBondContact O-N 2.62Å; A420-F422 PolarHBondContact O-N 2.95Å
421	K	61.7	Low	65	Low	181 Å²	181	78.9 Å²	78.9	79%	0.787	42%	0.418	S	S	*	.			trans	-67.4	79.2	-179.2	-75.2	-177.3	177.9	177.8	0	109.6	G419	G419-K421 PolarHBondContact O-N 3.24Å; G419-K421 VanDerWaalsContact O-N 3.17Å
422	F	74.9	Confident	67.3	Low	64 Å²	64	72.8 Å²	72.8	28%	0.281	39%	0.387	S	S	.	.			trans	-66.8	133.4	175.3	-172.3	-98.3	0	0	0	109.3	A420 I424 T427 F437	A420-F422 PolarHBondContact O-N 2.95Å; F422-I424 HydrophobicContact CD1-CD1 3.43Å; F422-I424 VanDerWaalsContact CD1-CD1 3.43Å; F422-I424 HydrophobicContact CD1-CG1 3.93Å; F422-I424 HydrophobicContact CE1-CD1 3.87Å; F422-I424 PolarHBondContact O-N 2.8Å; F422-T427 HydrophobicContact CE1-CG2 3.71Å; F422-T427 VanDerWaalsContact CE1-OG1 3.28Å; F422-T427 WeakPolarHBondContact CE1-OG1 3.44Å; F422-T427 HydrophobicContact CZ-CG2 3.72Å; F422-F437 AromaticContact CE2-CZ 3.89Å; F422-F437 HydrophobicContact CE2-CZ 3.89Å; F422-F437 HydrophobicContact CZ-CE1 4.25Å; F422-F437 AromaticContact CZ-CZ 3.73Å; F422-F437 HydrophobicContact CZ-CZ 3.73Å
423	P	88.5	Confident	69.8	Low	27 Å²	27	69.9 Å²	69.9	18%	0.175	37%	0.371	C	S	.	.			trans	-80.9	58.4	-169.7	35	-38.3	0	0	0	112.5	D380 R384 K425 W426 T427	D380-P423 WeakPolarHBondContact OD1-CG 3.46Å; R384-P423 VanDerWaalsContact NH2-CB 3.26Å; P423-K425 PolarHBondContact O-N 3.11Å; P423-W426 HydrophobicContact CB-CE3 3.9Å; P423-W426 PolarHBondContact O-N 3.46Å; P423-T427 PolarHBondContact O-N 3.09Å; P423-T427 PolarHBondContact O-OG1 2.73Å
424	I	92.2	Very high	72.3	Confident	28 Å²	28	70.9 Å²	70.9	14%	0.144	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-44.2	-40.4	-172.9	-66.9	-70.7	0	0	0	113.9	F422 W426 T427 N466 I470	F422-I424 HydrophobicContact CD1-CD1 3.43Å; F422-I424 VanDerWaalsContact CD1-CD1 3.43Å; F422-I424 HydrophobicContact CD1-CG1 3.93Å; F422-I424 HydrophobicContact CE1-CD1 3.87Å; F422-I424 PolarHBondContact O-N 2.8Å; I424-W426 PolarHBondContact O-N 3.22Å; I424-T427 PolarHBondContact O-N 2.91Å; I424-N466 HydrophobicContact CB-CB 3.98Å; I424-N466 HydrophobicContact CG1-CB 4.1Å; I424-N466 HydrophobicContact CG2-CB 3.93Å; I424-I470 HydrophobicContact CD1-CD1 4.06Å; I424-I470 HydrophobicContact CG2-CD1 3.97Å; I424-I470 HydrophobicContact CG2-CG1 3.7Å
425	K	95.9	Very high	74.6	Confident	23 Å²	23	64.3 Å²	64.3	10%	0.1	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-17.3	-177.7	-64.2	-171.2	168.3	-158.6	0	114.7	P423 T459 P460 Y461 M464 V469	P423-K425 PolarHBondContact O-N 3.11Å; K425-T459 HydrophobicContact CD-CG2 4.43Å; K425-P460 HydrophobicContact CB-CB 4.4Å; K425-P460 VanDerWaalsContact CD-O 3.3Å; K425-P460 WeakPolarHBondContact CD-O 3.49Å; K425-P460 PolarHBondContact NZ-O 2.66Å; K425-Y461 HydrophobicContact CB-CD2 4.09Å; K425-Y461 HydrophobicContact CG-CD2 4.26Å; K425-Y461 PolarHBondContact NZ-O 3.26Å; K425-Y461 WeakPolarHBondContact O-CE2 3.01Å; K425-M464 VanDerWaalsContact CE-O 3.27Å; K425-M464 WeakPolarHBondContact CE-O 3.3Å; K425-M464 PolarHBondContact NZ-O 3.49Å; K425-V469 HydrophobicContact CG-CG2 4.32Å
426	W	96.5	Very high	77.2	Confident	38 Å²	38	64.4 Å²	64.4	14%	0.144	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.8	-16.5	176.6	-66.2	-99.3	0	0	0	112.3	A382 P423 I424 S445 I448 E452 P460	A382-W426 VanDerWaalsContact CB-CD1 3.49Å; A382-W426 HydrophobicContact CB-CD2 4.45Å; A382-W426 HydrophobicContact CB-CG 4.1Å; P423-W426 HydrophobicContact CB-CE3 3.9Å; P423-W426 PolarHBondContact O-N 3.46Å; I424-W426 PolarHBondContact O-N 3.22Å; W426-S445 WeakPolarHBondContact O-CA 3.4Å; W426-S445 WeakPolarHBondContact O-CB 3.49Å; W426-S445 PolarHBondContact O-OG 3.33Å; W426-I448 VanDerWaalsContact CD1-CG2 3.43Å; W426-I448 HydrophobicContact CD2-CG2 4.48Å; W426-I448 HydrophobicContact CG-CG2 3.94Å; W426-E452 WeakPolarHBondContact CZ2-OE1 3.48Å; W426-E452 PolarHBondContact NE1-OE1 3.11Å; W426-E452 PolarHBondContact NE1-OE2 3.07Å; W426-P460 HydrophobicContact CZ2-CG 3.99Å
427	T	94.8	Very high	79.7	Confident	12 Å²	12	62.2 Å²	62.2	7%	0.074	34%	0.336	C	S	.	.	S	Bend	trans	-80.6	135.1	-174.1	-51.1	0	0	0	0	111.2	F422 P423 I424 A431 A432 F437 W444	F422-T427 HydrophobicContact CE1-CG2 3.71Å; F422-T427 VanDerWaalsContact CE1-OG1 3.28Å; F422-T427 WeakPolarHBondContact CE1-OG1 3.44Å; F422-T427 HydrophobicContact CZ-CG2 3.72Å; P423-T427 PolarHBondContact O-N 3.09Å; P423-T427 PolarHBondContact O-OG1 2.73Å; I424-T427 PolarHBondContact O-N 2.91Å; T427-A431 HydrophobicContact CG2-CB 3.53Å; T427-A432 HydrophobicContact CG2-CB 3.93Å; T427-F437 HydrophobicContact CG2-CE1 4.38Å; T427-W444 PolarHBondContact O-NE1 3.06Å
428	A	95.6	Very high	82.4	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.008	31%	0.308	C	S	.	.			trans	-61.7	149.6	172.5	0	0	0	0	0	111.8	E430 A431 A432 W444	A428-E430 VanDerWaalsContact C-N 3.3Å; A428-E430 VanDerWaalsContact CB-CD 3.48Å; A428-E430 WeakPolarHBondContact CB-OE1 3.48Å; A428-E430 WeakPolarHBondContact CB-OE2 3.43Å; A428-E430 PolarHBondContact O-N 2.87Å; A428-A431 HydrophobicContact CB-CB 4.36Å; A428-A431 PolarHBondContact O-N 2.68Å; A428-A432 PolarHBondContact O-N 3.05Å; A428-W444 HydrophobicContact CB-CB 3.68Å; A428-W444 HydrophobicContact CB-CD2 4.1Å; A428-W444 HydrophobicContact CB-CG 3.68Å
429	P	94.4	Very high	85.2	Confident	24 Å²	24	50 Å²	50	16%	0.156	29%	0.289	C	S	.	.	H	α-helix	trans	-57.7	-41.3	-176.8	21.9	-32.6	0	0	0	112.4	A431 A432 L433 W444 V473	P429-A431 VanDerWaalsContact C-N 3.29Å; P429-A431 PolarHBondContact O-N 3.23Å; P429-A432 PolarHBondContact O-N 3.45Å; P429-L433 VanDerWaalsContact O-CB 3.3Å; P429-L433 WeakPolarHBondContact O-CB 3.42Å; P429-L433 WeakPolarHBondContact O-CG 3.44Å; P429-L433 PolarHBondContact O-N 3.25Å; P429-W444 HydrophobicContact CG-CE3 4.45Å; P429-W444 HydrophobicContact CG-CH2 4.15Å; P429-W444 HydrophobicContact CG-CZ3 4Å; P429-V473 HydrophobicContact CB-CG1 4.28Å; P429-V473 HydrophobicContact CG-CG1 4.38Å
430	E	93.9	Very high	88	Confident	23 Å²	23	48.8 Å²	48.8	11%	0.107	26%	0.262	C	S	.	.	H	α-helix	trans	-65.8	-31.1	178	71.7	-77.2	-178.1	0	0	113.3	A428 Y434 G435 T436 P501 R504	A428-E430 VanDerWaalsContact C-N 3.3Å; A428-E430 VanDerWaalsContact CB-CD 3.48Å; A428-E430 WeakPolarHBondContact CB-OE1 3.48Å; A428-E430 WeakPolarHBondContact CB-OE2 3.43Å; A428-E430 PolarHBondContact O-N 2.87Å; E430-Y434 HydrophobicContact CB-CD2 4.39Å; E430-Y434 WeakPolarHBondContact O-CB 3.47Å; E430-Y434 PolarHBondContact O-N 3.13Å; E430-Y434 VanDerWaalsContact O-N 3.12Å; E430-G435 PolarHBondContact O-N 2.8Å; E430-T436 PolarHBondContact O-N 2.79Å; E430-P501 HydrophobicContact CG-CG 4.11Å; E430-R504 IonicContact OE1-CZ 2.74Å; E430-R504 IonicContact OE1-NH1 2.92Å; E430-R504 PolarHBondContact OE1-NH1 2.69Å; E430-R504 IonicContact OE1-NH2 3.73Å; E430-R504 PolarHBondContact OE1-NH2 2.97Å; E430-R504 IonicContact OE2-CZ 2.85Å; E430-R504 IonicContact OE2-NH1 3.96Å; E430-R504 IonicContact OE2-NH2 3.33Å; E430-R504 PolarHBondContact OE2-NH2 3.47Å
431	A	92.4	Very high	90.4	Very high	3 Å²	3	44.9 Å²	44.9	3%	0.025	23%	0.23	C	C	.	.	H	α-helix	trans	-78.8	-36.7	176.5	0	0	0	0	0	111.7	T427 A428 P429 G435 T436 F437	T427-A431 HydrophobicContact CG2-CB 3.53Å; A428-A431 HydrophobicContact CB-CB 4.36Å; A428-A431 PolarHBondContact O-N 2.68Å; P429-A431 VanDerWaalsContact C-N 3.29Å; P429-A431 PolarHBondContact O-N 3.23Å; A431-G435 VanDerWaalsContact O-CA 3.23Å; A431-G435 WeakPolarHBondContact O-CA 3.35Å; A431-G435 PolarHBondContact O-N 2.82Å; A431-G435 VanDerWaalsContact O-N 3.12Å; A431-T436 WeakPolarHBondContact CA-O 3.42Å; A431-T436 WeakPolarHBondContact CB-O 3.49Å; A431-F437 HydrophobicContact CB-CD1 3.85Å; A431-F437 HydrophobicContact CB-CE1 3.82Å; A431-F437 HydrophobicContact CB-CG 4.31Å; A431-F437 HydrophobicContact CB-CZ 4.23Å
432	A	90	Very high	92.1	Very high	13 Å²	13	36.3 Å²	36.3	11%	0.107	19%	0.193	C	C	.	.	H	α-helix	trans	-74	-39	178.9	0	0	0	0	0	112.8	T427 A428 P429	T427-A432 HydrophobicContact CG2-CB 3.93Å; A428-A432 PolarHBondContact O-N 3.05Å; P429-A432 PolarHBondContact O-N 3.45Å
433	L	89.1	Confident	93.2	Very high	62 Å²	62	33.2 Å²	33.2	33%	0.325	18%	0.18	S	C	.	.	H	α-helix	trans	-86.5	-40.6	-176.3	-66.3	172.2	0	0	0	112.7	P429 I470 E474	P429-L433 VanDerWaalsContact O-CB 3.3Å; P429-L433 WeakPolarHBondContact O-CB 3.42Å; P429-L433 WeakPolarHBondContact O-CG 3.44Å; P429-L433 PolarHBondContact O-N 3.25Å; L433-I470 HydrophobicContact CD2-CG2 3.66Å; L433-I470 HydrophobicContact CG-CG2 4.38Å; L433-E474 HydrophobicContact CD1-CG 4.26Å
434	Y	88.4	Confident	93.7	Very high	165 Å²	165	32.1 Å²	32.1	65%	0.647	17%	0.172	S	C	*	.	H	α-helix	trans	-119.7	3.9	-170.1	-44.9	-61.2	0	0	0	113.5	E430 T436	E430-Y434 HydrophobicContact CB-CD2 4.39Å; E430-Y434 WeakPolarHBondContact O-CB 3.47Å; E430-Y434 PolarHBondContact O-N 3.13Å; E430-Y434 VanDerWaalsContact O-N 3.12Å; Y434-T436 PolarHBondContact O-N 3.26Å; Y434-T436 VanDerWaalsContact O-N 3.17Å
435	G	86.7	Confident	94	Very high	46 Å²	46	31.1 Å²	31.1	47%	0.474	17%	0.167	S	C	.	.			trans	64.2	17.6	-177.2	0	0	0	0	0	113.9	E430 A431 F437	E430-G435 PolarHBondContact O-N 2.8Å; A431-G435 VanDerWaalsContact O-CA 3.23Å; A431-G435 WeakPolarHBondContact O-CA 3.35Å; A431-G435 PolarHBondContact O-N 2.82Å; A431-G435 VanDerWaalsContact O-N 3.12Å; G435-F437 VanDerWaalsContact O-CD2 3.24Å; G435-F437 WeakPolarHBondContact O-CD2 3.07Å; G435-F437 PolarHBondContact O-N 3.34Å
436	T	89.5	Confident	94.1	Very high	71 Å²	71	30 Å²	30	44%	0.436	16%	0.163	S	C	.	.			trans	-85.7	95.3	-176.7	-60.7	0	0	0	0	110.7	E430 A431 Y434 T438	E430-T436 PolarHBondContact O-N 2.79Å; A431-T436 WeakPolarHBondContact CA-O 3.42Å; A431-T436 WeakPolarHBondContact CB-O 3.49Å; Y434-T436 PolarHBondContact O-N 3.26Å; Y434-T436 VanDerWaalsContact O-N 3.17Å; T436-T438 HydrophobicContact CG2-CG2 4.27Å
437	F	89.9	Confident	94.2	Very high	37 Å²	37	28.2 Å²	28.2	16%	0.162	16%	0.156	C	C	.	.			trans	-95.7	125.1	177.4	-65.5	-88.2	0	0	0	111.9	V377 R379 F422 T427 A431 G435	V377-F437 HydrophobicContact CG1-CB 4.28Å; R379-F437 HydrophobicContact CB-CD1 3.95Å; R379-F437 HydrophobicContact CB-CE1 4.23Å; R379-F437 HydrophobicContact CG-CB 4.11Å; R379-F437 HydrophobicContact CG-CD1 3.83Å; R379-F437 HydrophobicContact CG-CG 4.08Å; F422-F437 AromaticContact CE2-CZ 3.89Å; F422-F437 HydrophobicContact CE2-CZ 3.89Å; F422-F437 HydrophobicContact CZ-CE1 4.25Å; F422-F437 AromaticContact CZ-CZ 3.73Å; F422-F437 HydrophobicContact CZ-CZ 3.73Å; T427-F437 HydrophobicContact CG2-CE1 4.38Å; A431-F437 HydrophobicContact CB-CD1 3.85Å; A431-F437 HydrophobicContact CB-CE1 3.82Å; A431-F437 HydrophobicContact CB-CG 4.31Å; A431-F437 HydrophobicContact CB-CZ 4.23Å; G435-F437 VanDerWaalsContact O-CD2 3.24Å; G435-F437 WeakPolarHBondContact O-CD2 3.07Å; G435-F437 PolarHBondContact O-N 3.34Å
438	T	93.7	Very high	94.4	Very high	52 Å²	52	27.6 Å²	27.6	32%	0.319	15%	0.152	S	C	.	.			trans	-140.6	170.5	177.4	67.6	0	0	0	0	110.3	V377 T436 K440 S441 D442	V377-T438 WeakPolarHBondContact CG1-O 3.26Å; T436-T438 HydrophobicContact CG2-CG2 4.27Å; T438-K440 PolarHBondContact O-N 3.47Å; T438-K440 PolarHBondContact OG1-N 3.4Å; T438-S441 PolarHBondContact N-OG 2.81Å; T438-S441 WeakPolarHBondContact O-CA 3.3Å; T438-S441 WeakPolarHBondContact O-CB 3.47Å; T438-S441 PolarHBondContact O-N 3.18Å; T438-S441 PolarHBondContact O-OG 2.89Å; T438-S441 PolarHBondContact OG1-N 3.38Å; T438-D442 PolarHBondContact O-N 2.93Å
439	V	95.2	Very high	94.5	Very high	25 Å²	25	27.6 Å²	27.6	15%	0.152	15%	0.152	C	C	.	.	H	α-helix	trans	-55.4	-34.9	170.4	-179.8	0	0	0	0	111.1	E372 V377 S441 D442 V443 F507	E372-V439 HydrophobicContact CB-CG1 3.76Å; E372-V439 HydrophobicContact CG-CG1 3.75Å; E372-V439 WeakPolarHBondContact OE1-CG1 3.43Å; V377-V439 HydrophobicContact CG2-CG2 4.27Å; V439-S441 VanDerWaalsContact C-N 3.3Å; V439-S441 PolarHBondContact O-N 2.87Å; V439-D442 CarbonylContact O-C 3.48Å; V439-D442 WeakPolarHBondContact O-CA 3.15Å; V439-D442 WeakPolarHBondContact O-CB 3.39Å; V439-D442 PolarHBondContact O-N 2.94Å; V439-V443 PolarHBondContact O-N 3.38Å; V439-F507 HydrophobicContact CG1-CD2 3.9Å; V439-F507 HydrophobicContact CG1-CE2 3.92Å
440	K	98	Very high	94.7	Very high	45 Å²	45	26.4 Å²	26.4	20%	0.196	14%	0.144	C	C	.	.	H	α-helix	trans	-68.1	-27.4	176.4	-62.8	-61.1	-172.2	171.1	0	113.4	T438 D442 V443 W444 P501 R504 P505	T438-K440 PolarHBondContact O-N 3.47Å; T438-K440 PolarHBondContact OG1-N 3.4Å; K440-D442 VanDerWaalsContact C-N 3.35Å; K440-V443 HydrophobicContact CD-CG2 4.41Å; K440-V443 PolarHBondContact O-N 3.44Å; K440-W444 PolarHBondContact O-N 3.43Å; K440-P501 HydrophobicContact CB-CB 3.82Å; K440-P501 VanDerWaalsContact CD-O 3.31Å; K440-P501 WeakPolarHBondContact CD-O 3.44Å; K440-P501 HydrophobicContact CG-CB 4.43Å; K440-P501 WeakPolarHBondContact CG-O 3.41Å; K440-R504 HydrophobicContact CD-CB 4.37Å; K440-R504 PolarHBondContact NZ-O 3.07Å; K440-R504 PolarHBondContact O-NH1 3.17Å; K440-P505 PolarHBondContact NZ-O 3.28Å
441	S	96.4	Very high	95	Very high	3 Å²	3	26 Å²	26	2%	0.021	14%	0.142	C	C	.	.	H	α-helix	trans	-70.5	-31.5	168.8	70.8	0	0	0	0	111.9	T438 V439 W444 S445	T438-S441 PolarHBondContact N-OG 2.81Å; T438-S441 WeakPolarHBondContact O-CA 3.3Å; T438-S441 WeakPolarHBondContact O-CB 3.47Å; T438-S441 PolarHBondContact O-N 3.18Å; T438-S441 PolarHBondContact O-OG 2.89Å; T438-S441 PolarHBondContact OG1-N 3.38Å; V439-S441 VanDerWaalsContact C-N 3.3Å; V439-S441 PolarHBondContact O-N 2.87Å; S441-W444 WeakPolarHBondContact O-CB 3.44Å; S441-W444 PolarHBondContact O-N 2.66Å; S441-S445 PolarHBondContact O-N 3.5Å; S441-S445 PolarHBondContact O-OG 3.16Å
442	D	97.3	Very high	95.2	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-70.7	-32.5	171	-66.7	-34.7	0	0	0	112.1	M368 V377 H378 R379 T438 V439 K440 W444 S445 Y446 F507	M368-D442 HydrophobicContact CE-CB 3.8Å; V377-D442 WeakPolarHBondContact CA-OD2 3.4Å; V377-D442 WeakPolarHBondContact CG1-OD2 3.35Å; H378-D442 PolarHBondContact N-OD2 3.32Å; R379-D442 WeakPolarHBondContact CA-OD1 3.34Å; R379-D442 PolarHBondContact N-OD1 2.9Å; T438-D442 PolarHBondContact O-N 2.93Å; V439-D442 CarbonylContact O-C 3.48Å; V439-D442 WeakPolarHBondContact O-CA 3.15Å; V439-D442 WeakPolarHBondContact O-CB 3.39Å; V439-D442 PolarHBondContact O-N 2.94Å; K440-D442 VanDerWaalsContact C-N 3.35Å; D442-W444 VanDerWaalsContact C-N 3.28Å; D442-W444 PolarHBondContact O-N 3.24Å; D442-S445 CarbonylContact O-C 3.58Å; D442-S445 WeakPolarHBondContact O-CB 3.44Å; D442-S445 PolarHBondContact O-N 2.73Å; D442-S445 VanDerWaalsContact O-N 3.16Å; D442-Y446 WeakPolarHBondContact O-CB 3.43Å; D442-Y446 PolarHBondContact O-N 2.86Å; D442-F507 HydrophobicContact CB-CE2 4.05Å; D442-F507 HydrophobicContact CB-CZ 4.08Å
443	V	98.7	Very high	95.6	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-60.2	-40.1	173.2	174	0	0	0	0	110.8	V439 K440 Y446 G447 T496 R504 P505 F507 L510	V439-V443 PolarHBondContact O-N 3.38Å; K440-V443 HydrophobicContact CD-CG2 4.41Å; K440-V443 PolarHBondContact O-N 3.44Å; V443-Y446 WeakPolarHBondContact O-CB 3.3Å; V443-Y446 PolarHBondContact O-N 3.37Å; V443-G447 PolarHBondContact O-N 3.04Å; V443-T496 HydrophobicContact CG1-CG2 3.87Å; V443-T496 WeakPolarHBondContact O-CB 3.3Å; V443-R504 HydrophobicContact CG1-CB 3.93Å; V443-P505 HydrophobicContact CG1-CG 4.27Å; V443-F507 HydrophobicContact CG2-CD2 3.96Å; V443-F507 HydrophobicContact CG2-CE1 4.49Å; V443-F507 HydrophobicContact CG2-CE2 3.61Å; V443-F507 HydrophobicContact CG2-CZ 3.91Å; V443-L510 HydrophobicContact CG1-CD1 4.14Å
444	W	98.6	Very high	96	Very high	3 Å²	3	23.3 Å²	23.3	1%	0.011	13%	0.125	C	C	.	.	H	α-helix	trans	-60	-49.1	171.9	176.6	-74.6	0	0	0	111.8	T427 A428 P429 K440 S441 D442 Y446 G447 I448 V473 T496 W497	T427-W444 PolarHBondContact O-NE1 3.06Å; A428-W444 HydrophobicContact CB-CB 3.68Å; A428-W444 HydrophobicContact CB-CD2 4.1Å; A428-W444 HydrophobicContact CB-CG 3.68Å; P429-W444 HydrophobicContact CG-CE3 4.45Å; P429-W444 HydrophobicContact CG-CH2 4.15Å; P429-W444 HydrophobicContact CG-CZ3 4Å; K440-W444 PolarHBondContact O-N 3.43Å; S441-W444 WeakPolarHBondContact O-CB 3.44Å; S441-W444 PolarHBondContact O-N 2.66Å; D442-W444 VanDerWaalsContact C-N 3.28Å; D442-W444 PolarHBondContact O-N 3.24Å; W444-Y446 PolarHBondContact O-N 3.32Å; W444-G447 WeakPolarHBondContact O-CA 3.34Å; W444-G447 PolarHBondContact O-N 3.26Å; W444-I448 PolarHBondContact O-N 3.19Å; W444-I448 VanDerWaalsContact O-N 3.15Å; W444-V473 HydrophobicContact CH2-CG1 3.47Å; W444-V473 VanDerWaalsContact CH2-CG1 3.47Å; W444-V473 HydrophobicContact CZ2-CG1 3.65Å; W444-V473 HydrophobicContact CZ2-CG2 4.42Å; W444-T496 WeakPolarHBondContact CA-O 3.37Å; W444-W497 AromaticContact CD2-CD1 3.91Å; W444-W497 HydrophobicContact CE3-CB 4.19Å; W444-W497 HydrophobicContact CH2-CB 4.16Å; W444-W497 HydrophobicContact CZ3-CB 3.94Å; W444-W497 VanDerWaalsContact CZ3-O 3.31Å; W444-W497 WeakPolarHBondContact CZ3-O 3.46Å; W444-W497 PolarHBondContact O-NE1 2.77Å
445	S	98.4	Very high	96.4	Very high	7 Å²	7	16.3 Å²	16.3	5%	0.049	10%	0.1	C	C	.	.	H	α-helix	trans	-60	-36.4	177.6	-57	0	0	0	0	112	L381 W426 S441 D442 I448 L449	L381-S445 WeakPolarHBondContact O-CB 3.41Å; W426-S445 WeakPolarHBondContact O-CA 3.4Å; W426-S445 WeakPolarHBondContact O-CB 3.49Å; W426-S445 PolarHBondContact O-OG 3.33Å; S441-S445 PolarHBondContact O-N 3.5Å; S441-S445 PolarHBondContact O-OG 3.16Å; D442-S445 CarbonylContact O-C 3.58Å; D442-S445 WeakPolarHBondContact O-CB 3.44Å; D442-S445 PolarHBondContact O-N 2.73Å; D442-S445 VanDerWaalsContact O-N 3.16Å; S445-I448 WeakPolarHBondContact O-CB 3.29Å; S445-I448 PolarHBondContact O-N 2.99Å; S445-L449 PolarHBondContact O-N 3.3Å
446	Y	98.8	Very high	96.8	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-61.6	-42.4	172.2	-178.7	-102.1	0	0	0	111.6	C361 I364 A365 L381 D442 V443 W444 I448 L449 L450 T496 F507 L510 F514	C361-Y446 PolarHBondContact O-OH 3.47Å; I364-Y446 HydrophobicContact CB-CE2 4.15Å; I364-Y446 HydrophobicContact CG2-CD2 3.99Å; I364-Y446 HydrophobicContact CG2-CE2 3.78Å; A365-Y446 HydrophobicContact CB-CE2 4.15Å; L381-Y446 HydrophobicContact CD2-CD2 4.21Å; L381-Y446 HydrophobicContact CD2-CG 4.48Å; D442-Y446 WeakPolarHBondContact O-CB 3.43Å; D442-Y446 PolarHBondContact O-N 2.86Å; V443-Y446 WeakPolarHBondContact O-CB 3.3Å; V443-Y446 PolarHBondContact O-N 3.37Å; W444-Y446 PolarHBondContact O-N 3.32Å; Y446-I448 VanDerWaalsContact C-N 3.29Å; Y446-I448 PolarHBondContact O-N 3.1Å; Y446-L449 CarbonylContact O-C 3.59Å; Y446-L449 WeakPolarHBondContact O-CA 3.37Å; Y446-L449 VanDerWaalsContact O-CB 3.3Å; Y446-L449 WeakPolarHBondContact O-CB 3.31Å; Y446-L449 PolarHBondContact O-N 3.38Å; Y446-L450 HydrophobicContact CD1-CD1 4.04Å; Y446-L450 HydrophobicContact CD1-CD2 4.4Å; Y446-L450 HydrophobicContact CD1-CG 4.03Å; Y446-L450 HydrophobicContact CE1-CD1 3.71Å; Y446-L450 HydrophobicContact CE1-CD2 3.7Å; Y446-L450 HydrophobicContact CE1-CG 3.75Å; Y446-L450 HydrophobicContact CE2-CD2 4.24Å; Y446-L450 WeakPolarHBondContact O-CG 3.33Å; Y446-L450 PolarHBondContact O-N 3.13Å; Y446-T496 HydrophobicContact CD1-CG2 4.49Å; Y446-F507 HydrophobicContact CD1-CE1 4.32Å; Y446-F507 HydrophobicContact CD2-CE1 4Å; Y446-F507 AromaticContact CG-CE1 3.76Å; Y446-F507 HydrophobicContact CG-CE1 3.76Å; Y446-L510 HydrophobicContact CD1-CD1 3.71Å; Y446-L510 HydrophobicContact CE1-CB 4.2Å; Y446-L510 HydrophobicContact CE1-CD1 3.89Å; Y446-L510 HydrophobicContact CE1-CD2 4.2Å; Y446-L510 HydrophobicContact CE1-CG 4.33Å; Y446-F514 HydrophobicContact CE1-CE2 4.03Å; Y446-F514 WeakPolarHBondContact OH-CD2 3.45Å; Y446-F514 WeakPolarHBondContact OH-CE2 3.35Å
447	G	98.8	Very high	97.1	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-54.9	-43.5	171.7	0	0	0	0	0	113.5	V443 W444 L450 Y451 T496 W497	V443-G447 PolarHBondContact O-N 3.04Å; W444-G447 WeakPolarHBondContact O-CA 3.34Å; W444-G447 PolarHBondContact O-N 3.26Å; G447-L450 WeakPolarHBondContact O-CB 3.36Å; G447-L450 PolarHBondContact O-N 3.27Å; G447-Y451 PolarHBondContact O-N 3.33Å; G447-Y451 VanDerWaalsContact O-N 3.17Å; G447-T496 WeakPolarHBondContact CA-OG1 3.4Å; G447-W497 VanDerWaalsContact C-NE1 3.34Å; G447-W497 VanDerWaalsContact O-CZ2 3.26Å; G447-W497 WeakPolarHBondContact O-CZ2 3.28Å
448	I	98.7	Very high	97.4	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-66	-39.4	174.8	-56.4	-63.8	0	0	0	111	W426 W444 S445 Y446 L450 Y451 E452 P460 Y461 M479 W497	W426-I448 VanDerWaalsContact CD1-CG2 3.43Å; W426-I448 HydrophobicContact CD2-CG2 4.48Å; W426-I448 HydrophobicContact CG-CG2 3.94Å; W444-I448 PolarHBondContact O-N 3.19Å; W444-I448 VanDerWaalsContact O-N 3.15Å; S445-I448 WeakPolarHBondContact O-CB 3.29Å; S445-I448 PolarHBondContact O-N 2.99Å; Y446-I448 VanDerWaalsContact C-N 3.29Å; Y446-I448 PolarHBondContact O-N 3.1Å; I448-L450 VanDerWaalsContact C-N 3.34Å; I448-L450 PolarHBondContact O-N 2.91Å; I448-Y451 VanDerWaalsContact O-CB 3.31Å; I448-Y451 WeakPolarHBondContact O-CB 3.49Å; I448-Y451 PolarHBondContact O-N 3.11Å; I448-E452 PolarHBondContact O-N 3.01Å; I448-P460 HydrophobicContact CG2-CB 3.76Å; I448-P460 HydrophobicContact CG2-CG 3.42Å; I448-P460 VanDerWaalsContact CG2-CG 3.42Å; I448-Y461 HydrophobicContact CD1-CE2 3.74Å; I448-Y461 WeakPolarHBondContact CD1-OH 3.32Å; I448-M479 HydrophobicContact CD1-CE 3.54Å; I448-W497 HydrophobicContact CD1-CZ2 3.78Å
449	L	98.7	Very high	97.5	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-61	-42.1	173.5	-176.6	160.4	0	0	0	111.3	I364 L381 I386 S445 Y446 Y451 E452 V453	I364-L449 HydrophobicContact CD1-CD1 4.42Å; I364-L449 HydrophobicContact CD1-CD2 3.72Å; I364-L449 HydrophobicContact CG2-CD1 4.16Å; L381-L449 HydrophobicContact CD1-CD1 3.97Å; L381-L449 HydrophobicContact CG-CD1 3.99Å; I386-L449 HydrophobicContact CD1-CD1 4Å; I386-L449 HydrophobicContact CG1-CD1 3.73Å; S445-L449 PolarHBondContact O-N 3.3Å; Y446-L449 CarbonylContact O-C 3.59Å; Y446-L449 WeakPolarHBondContact O-CA 3.37Å; Y446-L449 VanDerWaalsContact O-CB 3.3Å; Y446-L449 WeakPolarHBondContact O-CB 3.31Å; Y446-L449 PolarHBondContact O-N 3.38Å; L449-Y451 VanDerWaalsContact C-N 3.25Å; L449-Y451 PolarHBondContact O-N 2.86Å; L449-E452 CarbonylContact O-C 3.47Å; L449-E452 WeakPolarHBondContact O-CA 3.46Å; L449-E452 WeakPolarHBondContact O-CB 3.21Å; L449-E452 PolarHBondContact O-N 2.93Å; L449-V453 HydrophobicContact CD2-CG2 3.7Å; L449-V453 WeakPolarHBondContact O-CG2 3.46Å; L449-V453 PolarHBondContact O-N 3.27Å
450	L	98.7	Very high	97.6	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-58.7	-40.4	175.5	-64.6	179.3	0	0	0	111.1	C361 Y446 G447 I448 V453 I454 M489 V492 M493 F514	C361-L450 HydrophobicContact CB-CD2 3.72Å; C361-L450 WeakPolarHBondContact SG-CD2 3.43Å; Y446-L450 HydrophobicContact CD1-CD1 4.04Å; Y446-L450 HydrophobicContact CD1-CD2 4.4Å; Y446-L450 HydrophobicContact CD1-CG 4.03Å; Y446-L450 HydrophobicContact CE1-CD1 3.71Å; Y446-L450 HydrophobicContact CE1-CD2 3.7Å; Y446-L450 HydrophobicContact CE1-CG 3.75Å; Y446-L450 HydrophobicContact CE2-CD2 4.24Å; Y446-L450 WeakPolarHBondContact O-CG 3.33Å; Y446-L450 PolarHBondContact O-N 3.13Å; G447-L450 WeakPolarHBondContact O-CB 3.36Å; G447-L450 PolarHBondContact O-N 3.27Å; I448-L450 VanDerWaalsContact C-N 3.34Å; I448-L450 PolarHBondContact O-N 2.91Å; L450-V453 PolarHBondContact O-N 3.23Å; L450-I454 PolarHBondContact O-N 2.88Å; L450-M489 HydrophobicContact CB-CE 4.09Å; L450-M489 HydrophobicContact CD2-CE 4.16Å; L450-V492 HydrophobicContact CD1-CG1 4.18Å; L450-M493 HydrophobicContact CB-CE 3.76Å; L450-M493 HydrophobicContact CB-CG 4.08Å; L450-M493 HydrophobicContact CD1-CG 4.15Å; L450-F514 HydrophobicContact CD1-CE2 3.85Å; L450-F514 HydrophobicContact CD1-CZ 3.7Å; L450-F514 HydrophobicContact CD2-CE1 4.44Å; L450-F514 HydrophobicContact CD2-CE2 3.76Å; L450-F514 HydrophobicContact CD2-CZ 3.63Å; L450-F514 HydrophobicContact CG-CE2 4.45Å; L450-F514 HydrophobicContact CG-CZ 4.3Å
451	Y	98.5	Very high	97.5	Very high	14 Å²	14	14.6 Å²	14.6	6%	0.055	8%	0.075	C	C	.	.	H	α-helix	trans	-60.2	-47	172.1	176.1	-80.5	0	0	0	111.1	G447 I448 L449 V453 T455 Q458 P460 M479 P482	G447-Y451 PolarHBondContact O-N 3.33Å; G447-Y451 VanDerWaalsContact O-N 3.17Å; I448-Y451 VanDerWaalsContact O-CB 3.31Å; I448-Y451 WeakPolarHBondContact O-CB 3.49Å; I448-Y451 PolarHBondContact O-N 3.11Å; L449-Y451 VanDerWaalsContact C-N 3.25Å; L449-Y451 PolarHBondContact O-N 2.86Å; Y451-V453 VanDerWaalsContact C-N 3.32Å; Y451-V453 PolarHBondContact O-N 3.44Å; Y451-T455 HydrophobicContact CD1-CG2 4.24Å; Y451-T455 HydrophobicContact CD2-CG2 4.34Å; Y451-T455 HydrophobicContact CE1-CG2 3.92Å; Y451-T455 HydrophobicContact CE2-CG2 4.06Å; Y451-T455 HydrophobicContact CG-CG2 4.42Å; Y451-T455 WeakPolarHBondContact O-CB 3.4Å; Y451-T455 VanDerWaalsContact O-CG2 3.3Å; Y451-T455 WeakPolarHBondContact O-CG2 3.3Å; Y451-T455 PolarHBondContact O-N 3.05Å; Y451-T455 PolarHBondContact O-OG1 2.76Å; Y451-Q458 HydrophobicContact CE1-CB 4.38Å; Y451-P460 HydrophobicContact CD1-CB 4.46Å; Y451-P460 HydrophobicContact CD1-CG 4.41Å; Y451-M479 HydrophobicContact CD1-CE 4.33Å; Y451-M479 HydrophobicContact CD1-SD 4.34Å; Y451-M479 HydrophobicContact CD2-CB 4.49Å; Y451-M479 HydrophobicContact CD2-CE 3.89Å; Y451-M479 HydrophobicContact CD2-SD 3.87Å; Y451-M479 HydrophobicContact CE1-SD 4.25Å; Y451-M479 HydrophobicContact CE2-CB 4.39Å; Y451-M479 HydrophobicContact CE2-CE 4.38Å; Y451-M479 HydrophobicContact CE2-SD 3.72Å; Y451-M479 HydrophobicContact CG-CE 3.87Å; Y451-M479 HydrophobicContact CG-SD 4.18Å; Y451-P482 HydrophobicContact CD2-CG 3.65Å; Y451-P482 HydrophobicContact CE2-CG 3.72Å
452	E	98.3	Very high	97.4	Very high	3 Å²	3	18.3 Å²	18.3	1%	0.014	10%	0.099	C	C	.	.	H	α-helix	trans	-58.2	-44.4	175.8	-66.3	-177.2	106.5	0	0	111.2	A383 W426 I448 L449 T455 K456 G457 P460	A383-E452 HydrophobicContact CB-CB 3.95Å; A383-E452 HydrophobicContact CB-CG 4.45Å; A383-E452 WeakPolarHBondContact CB-OE2 3.49Å; A383-E452 PolarHBondContact N-OE2 2.83Å; W426-E452 WeakPolarHBondContact CZ2-OE1 3.48Å; W426-E452 PolarHBondContact NE1-OE1 3.11Å; W426-E452 PolarHBondContact NE1-OE2 3.07Å; I448-E452 PolarHBondContact O-N 3.01Å; L449-E452 CarbonylContact O-C 3.47Å; L449-E452 WeakPolarHBondContact O-CA 3.46Å; L449-E452 WeakPolarHBondContact O-CB 3.21Å; L449-E452 PolarHBondContact O-N 2.93Å; E452-T455 PolarHBondContact O-OG1 3.41Å; E452-K456 PolarHBondContact O-N 3.44Å; E452-K456 VanDerWaalsContact O-N 3.16Å; E452-G457 WeakPolarHBondContact O-CA 3.24Å; E452-G457 PolarHBondContact O-N 3.49Å; E452-P460 HydrophobicContact CG-CG 4.01Å
453	V	97.7	Very high	97.3	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-63.3	-51.5	-179	174.1	0	0	0	0	111.6	L340 L344 L357 L449 L450 Y451 T455 K456	L340-V453 HydrophobicContact CD2-CG2 3.99Å; L344-V453 HydrophobicContact CD1-CG2 4.36Å; L357-V453 HydrophobicContact CB-CG1 3.89Å; L357-V453 HydrophobicContact CD1-CG1 4.47Å; L357-V453 HydrophobicContact CD2-CG1 3.87Å; L357-V453 HydrophobicContact CG-CG1 4.3Å; L449-V453 HydrophobicContact CD2-CG2 3.7Å; L449-V453 WeakPolarHBondContact O-CG2 3.46Å; L449-V453 PolarHBondContact O-N 3.27Å; L450-V453 PolarHBondContact O-N 3.23Å; Y451-V453 VanDerWaalsContact C-N 3.32Å; Y451-V453 PolarHBondContact O-N 3.44Å; V453-T455 VanDerWaalsContact C-N 3.3Å; V453-T455 PolarHBondContact O-N 2.96Å; V453-K456 PolarHBondContact O-N 3.4Å
454	I	97	Very high	97.1	Very high	19 Å²	19	23.6 Å²	23.6	10%	0.097	15%	0.146	C	C	.	.	H	α-helix	trans	-69.1	-30.6	-175.8	-161.5	59.1	0	0	0	112.4	L354 L357 L450 K456 P482 C485 M489 M493	L354-I454 HydrophobicContact CD1-CD1 3.71Å; L357-I454 HydrophobicContact CD1-CD1 4.04Å; L450-I454 PolarHBondContact O-N 2.88Å; I454-K456 VanDerWaalsContact C-N 3.29Å; I454-P482 HydrophobicContact CG2-CB 4.09Å; I454-P482 HydrophobicContact CG2-CG 3.86Å; I454-C485 HydrophobicContact CG1-CB 3.79Å; I454-C485 HydrophobicContact CG2-CB 4.37Å; I454-M489 HydrophobicContact CB-CE 4.11Å; I454-M489 HydrophobicContact CB-SD 4.36Å; I454-M489 HydrophobicContact CD1-SD 4.04Å; I454-M489 HydrophobicContact CG1-SD 4.25Å; I454-M493 HydrophobicContact CB-CE 4.43Å; I454-M493 HydrophobicContact CG2-CE 3.76Å
455	T	96.5	Very high	96.8	Very high	18 Å²	18	30.4 Å²	30.4	11%	0.11	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	3.4	177.8	61.6	0	0	0	0	113.6	Y451 E452 V453 G457 Q458 P482	Y451-T455 HydrophobicContact CD1-CG2 4.24Å; Y451-T455 HydrophobicContact CD2-CG2 4.34Å; Y451-T455 HydrophobicContact CE1-CG2 3.92Å; Y451-T455 HydrophobicContact CE2-CG2 4.06Å; Y451-T455 HydrophobicContact CG-CG2 4.42Å; Y451-T455 WeakPolarHBondContact O-CB 3.4Å; Y451-T455 VanDerWaalsContact O-CG2 3.3Å; Y451-T455 WeakPolarHBondContact O-CG2 3.3Å; Y451-T455 PolarHBondContact O-N 3.05Å; Y451-T455 PolarHBondContact O-OG1 2.76Å; E452-T455 PolarHBondContact O-OG1 3.41Å; V453-T455 VanDerWaalsContact C-N 3.3Å; V453-T455 PolarHBondContact O-N 2.96Å; T455-G457 VanDerWaalsContact C-N 3.34Å; T455-G457 PolarHBondContact O-N 3.36Å; T455-Q458 HydrophobicContact CG2-CB 4.48Å; T455-Q458 WeakPolarHBondContact OG1-CB 3.38Å; T455-Q458 PolarHBondContact OG1-N 3.46Å; T455-P482 HydrophobicContact CG2-CB 3.7Å; T455-P482 HydrophobicContact CG2-CG 3.96Å
456	K	95.9	Very high	96.4	Very high	52 Å²	52	33.5 Å²	33.5	23%	0.226	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	60	42.5	-177.8	-50.2	-62.6	-166.7	166.3	0	113.1	L344 L352 L357 E452 V453 I454	L344-K456 HydrophobicContact CD2-CD 4.17Å; L352-K456 PolarHBondContact O-NZ 3.12Å; L357-K456 HydrophobicContact CD1-CD 4.27Å; L357-K456 HydrophobicContact CD2-CD 4.42Å; E452-K456 PolarHBondContact O-N 3.44Å; E452-K456 VanDerWaalsContact O-N 3.16Å; V453-K456 PolarHBondContact O-N 3.4Å; I454-K456 VanDerWaalsContact C-N 3.29Å
457	G	95.9	Very high	96	Very high	2 Å²	2	42.4 Å²	42.4	2%	0.021	23%	0.228	C	C	.	.	S	Bend	trans	83.8	29	175.2	0	0	0	0	0	113.9	R345 E452 T455	R345-G457 PolarHBondContact NE-O 3.24Å; R345-G457 PolarHBondContact NH2-O 3.37Å; E452-G457 WeakPolarHBondContact O-CA 3.24Å; E452-G457 PolarHBondContact O-N 3.49Å; T455-G457 VanDerWaalsContact C-N 3.34Å; T455-G457 PolarHBondContact O-N 3.36Å
458	Q	95.7	Very high	95.8	Very high	110 Å²	110	46 Å²	46	51%	0.514	24%	0.244	S	C	.	.	P	Polyproline II helix	trans	-66.2	148.7	169.6	-70.5	179.6	7.1	0	0	110.6	Y451 T455 P460	Y451-Q458 HydrophobicContact CE1-CB 4.38Å; T455-Q458 HydrophobicContact CG2-CB 4.48Å; T455-Q458 WeakPolarHBondContact OG1-CB 3.38Å; T455-Q458 PolarHBondContact OG1-N 3.46Å; Q458-P460 WeakPolarHBondContact O-CD 3.33Å
459	T	95	Very high	95.6	Very high	73 Å²	73	46.1 Å²	46.1	45%	0.448	25%	0.245	S	C	.	.	P	Polyproline II helix	trans	-65.1	127.6	173.7	-58.6	0	0	0	0	109.9	K425	K425-T459 HydrophobicContact CD-CG2 4.43Å
460	P	97.4	Very high	95.2	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.257	C	S	.	.	S	Bend	trans	-58.5	152.6	174.2	-24.5	34.3	0	0	0	112	K425 W426 I448 Y451 E452 Q458 M479	K425-P460 HydrophobicContact CB-CB 4.4Å; K425-P460 VanDerWaalsContact CD-O 3.3Å; K425-P460 WeakPolarHBondContact CD-O 3.49Å; K425-P460 PolarHBondContact NZ-O 2.66Å; W426-P460 HydrophobicContact CZ2-CG 3.99Å; I448-P460 HydrophobicContact CG2-CB 3.76Å; I448-P460 HydrophobicContact CG2-CG 3.42Å; I448-P460 VanDerWaalsContact CG2-CG 3.42Å; Y451-P460 HydrophobicContact CD1-CB 4.46Å; Y451-P460 HydrophobicContact CD1-CG 4.41Å; E452-P460 HydrophobicContact CG-CG 4.01Å; Q458-P460 WeakPolarHBondContact O-CD 3.33Å; P460-M479 HydrophobicContact CB-CE 4.23Å; P460-M479 HydrophobicContact CB-SD 4.24Å
461	Y	97	Very high	95	Very high	2 Å²	2	53 Å²	53	1%	0.008	28%	0.278	C	S	.	.	S	Bend	trans	48	62.9	-178.2	-53.7	-83.5	0	0	0	111.6	K425 I448 G463 M464 V469 V473 Y477 M479	K425-Y461 HydrophobicContact CB-CD2 4.09Å; K425-Y461 HydrophobicContact CG-CD2 4.26Å; K425-Y461 PolarHBondContact NZ-O 3.26Å; K425-Y461 WeakPolarHBondContact O-CE2 3.01Å; I448-Y461 HydrophobicContact CD1-CE2 3.74Å; I448-Y461 WeakPolarHBondContact CD1-OH 3.32Å; Y461-G463 PolarHBondContact O-N 2.73Å; Y461-M464 HydrophobicContact CD1-SD 4.27Å; Y461-M464 PolarHBondContact O-N 2.8Å; Y461-V469 HydrophobicContact CD1-CG1 4.14Å; Y461-V469 HydrophobicContact CD1-CG2 4.38Å; Y461-V469 HydrophobicContact CD2-CG1 3.75Å; Y461-V469 HydrophobicContact CD2-CG2 4.2Å; Y461-V469 HydrophobicContact CE1-CG1 4.26Å; Y461-V469 HydrophobicContact CE2-CG1 3.87Å; Y461-V469 HydrophobicContact CG-CG1 3.89Å; Y461-V469 HydrophobicContact CG-CG2 3.81Å; Y461-V473 HydrophobicContact CE1-CG2 3.9Å; Y461-Y477 HydrophobicContact CD1-CE1 4.02Å; Y461-Y477 HydrophobicContact CE1-CD1 4.43Å; Y461-Y477 HydrophobicContact CE1-CE1 4.17Å; Y461-M479 HydrophobicContact CD1-CG 3.62Å; Y461-M479 HydrophobicContact CD1-SD 4.03Å; Y461-M479 HydrophobicContact CD2-CE 4.41Å; Y461-M479 HydrophobicContact CD2-SD 4.21Å; Y461-M479 HydrophobicContact CE1-CE 4.33Å; Y461-M479 HydrophobicContact CE1-CG 3.6Å; Y461-M479 HydrophobicContact CE1-SD 4.19Å; Y461-M479 HydrophobicContact CE2-CE 4.03Å; Y461-M479 HydrophobicContact CE2-SD 4.36Å; Y461-M479 HydrophobicContact CG-CG 4.23Å; Y461-M479 HydrophobicContact CG-SD 4.03Å; Y461-M479 PolarHBondContact N-SD 3.33Å
462	P	94.3	Very high	94.9	Very high	81 Å²	81	55.8 Å²	55.8	53%	0.526	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	135.2	-174.3	25.6	-34.5	0	0	0	110.7	M464	P462-M464 PolarHBondContact O-N 3.24Å
463	G	94	Very high	94.9	Very high	82 Å²	82	56.1 Å²	56.1	85%	0.845	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.2	-16.1	-178.6	0	0	0	0	0	115.6	Y461	Y461-G463 PolarHBondContact O-N 2.73Å
464	M	94.7	Very high	94.6	Very high	29 Å²	29	61.7 Å²	61.7	14%	0.143	32%	0.32	C	S	.	.			trans	-91.2	139.2	-178.9	-61	176.7	179.3	0	0	112.3	K425 Y461 P462 E468 V469 Y477	K425-M464 VanDerWaalsContact CE-O 3.27Å; K425-M464 WeakPolarHBondContact CE-O 3.3Å; K425-M464 PolarHBondContact NZ-O 3.49Å; Y461-M464 HydrophobicContact CD1-SD 4.27Å; Y461-M464 PolarHBondContact O-N 2.8Å; P462-M464 PolarHBondContact O-N 3.24Å; M464-E468 WeakPolarHBondContact CA-OE2 3.38Å; M464-E468 HydrophobicContact CB-CB 4.48Å; M464-E468 HydrophobicContact CB-CG 4.32Å; M464-E468 HydrophobicContact CG-CG 4.28Å; M464-V469 HydrophobicContact CB-CG2 3.64Å; M464-V469 HydrophobicContact SD-CG2 4.41Å; M464-Y477 HydrophobicContact CE-CE1 3.87Å; M464-Y477 HydrophobicContact SD-CE1 4.27Å
465	Q	92.2	Very high	94.6	Very high	146 Å²	146	65 Å²	65	68%	0.682	35%	0.345	S	S	*	.			trans	-83	159.4	170.8	-63.4	-72.2	36.8	0	0	111.3	R467 E468 V469	Q465-R467 VanDerWaalsContact C-N 3.27Å; Q465-R467 PolarHBondContact O-N 2.93Å; Q465-R467 VanDerWaalsContact O-N 3.14Å; Q465-E468 PolarHBondContact N-OE2 2.9Å; Q465-E468 WeakPolarHBondContact O-CB 3.49Å; Q465-E468 PolarHBondContact O-N 2.91Å; Q465-V469 WeakPolarHBondContact O-CG2 3.46Å; Q465-V469 PolarHBondContact O-N 3.37Å
466	N	91.3	Very high	94.5	Very high	72 Å²	72	66.6 Å²	66.6	39%	0.385	37%	0.365	S	S	.	.	H	α-helix	trans	-52.1	-42	-175.9	-74.3	1.6	0	0	0	113.9	I424 V469 I470	I424-N466 HydrophobicContact CB-CB 3.98Å; I424-N466 HydrophobicContact CG1-CB 4.1Å; I424-N466 HydrophobicContact CG2-CB 3.93Å; N466-V469 PolarHBondContact O-N 3.31Å; N466-I470 WeakPolarHBondContact O-CG1 3.31Å; N466-I470 PolarHBondContact O-N 3.04Å
467	R	90.1	Very high	94.6	Very high	187 Å²	187	67.5 Å²	67.5	71%	0.706	37%	0.368	S	S	*	.	H	α-helix	trans	-63.1	-46.2	177.8	178.6	177.8	171.7	164.3	1	112.2	Q465 V469 I470 E471	Q465-R467 VanDerWaalsContact C-N 3.27Å; Q465-R467 PolarHBondContact O-N 2.93Å; Q465-R467 VanDerWaalsContact O-N 3.14Å; R467-V469 VanDerWaalsContact C-N 3.31Å; R467-V469 PolarHBondContact O-N 2.89Å; R467-I470 PolarHBondContact O-N 2.87Å; R467-E471 WeakPolarHBondContact CG-OE1 3.23Å; R467-E471 IonicContact CZ-OE1 3.4Å; R467-E471 IonicContact NE-OE1 3.57Å; R467-E471 PolarHBondContact NE-OE1 3.25Å; R467-E471 IonicContact NH2-OE1 2.7Å; R467-E471 PolarHBondContact NH2-OE1 2.88Å; R467-E471 WeakPolarHBondContact O-CG 3.4Å; R467-E471 PolarHBondContact O-N 2.71Å; R467-E471 VanDerWaalsContact O-N 3.15Å
468	E	94.3	Very high	94.7	Very high	75 Å²	75	69.6 Å²	69.6	35%	0.35	38%	0.375	S	S	.	.	H	α-helix	trans	-63.5	-38.3	178.7	-177.5	-177	-174.3	0	0	111.4	M464 Q465 I470 E471 Q472	M464-E468 WeakPolarHBondContact CA-OE2 3.38Å; M464-E468 HydrophobicContact CB-CB 4.48Å; M464-E468 HydrophobicContact CB-CG 4.32Å; M464-E468 HydrophobicContact CG-CG 4.28Å; Q465-E468 PolarHBondContact N-OE2 2.9Å; Q465-E468 WeakPolarHBondContact O-CB 3.49Å; Q465-E468 PolarHBondContact O-N 2.91Å; E468-I470 VanDerWaalsContact C-N 3.35Å; E468-I470 PolarHBondContact O-N 2.9Å; E468-E471 PolarHBondContact O-N 2.9Å; E468-Q472 HydrophobicContact CG-CG 4.08Å; E468-Q472 VanDerWaalsContact O-CB 3.31Å; E468-Q472 WeakPolarHBondContact O-CB 3.24Å; E468-Q472 WeakPolarHBondContact O-CG 3.31Å; E468-Q472 PolarHBondContact O-N 3.28Å
469	V	94.3	Very high	94.8	Very high	4 Å²	4	64.4 Å²	64.4	2%	0.024	35%	0.351	C	S	.	.	H	α-helix	trans	-59.2	-45.9	176.2	174	0	0	0	0	111.3	K425 Y461 M464 Q465 N466 R467 V473	K425-V469 HydrophobicContact CG-CG2 4.32Å; Y461-V469 HydrophobicContact CD1-CG1 4.14Å; Y461-V469 HydrophobicContact CD1-CG2 4.38Å; Y461-V469 HydrophobicContact CD2-CG1 3.75Å; Y461-V469 HydrophobicContact CD2-CG2 4.2Å; Y461-V469 HydrophobicContact CE1-CG1 4.26Å; Y461-V469 HydrophobicContact CE2-CG1 3.87Å; Y461-V469 HydrophobicContact CG-CG1 3.89Å; Y461-V469 HydrophobicContact CG-CG2 3.81Å; M464-V469 HydrophobicContact CB-CG2 3.64Å; M464-V469 HydrophobicContact SD-CG2 4.41Å; Q465-V469 WeakPolarHBondContact O-CG2 3.46Å; Q465-V469 PolarHBondContact O-N 3.37Å; N466-V469 PolarHBondContact O-N 3.31Å; R467-V469 VanDerWaalsContact C-N 3.31Å; R467-V469 PolarHBondContact O-N 2.89Å; V469-V473 HydrophobicContact CG1-CG2 4.21Å; V469-V473 VanDerWaalsContact O-CB 3.24Å; V469-V473 WeakPolarHBondContact O-CB 2.89Å; V469-V473 WeakPolarHBondContact O-CG2 3.3Å; V469-V473 PolarHBondContact O-N 3.12Å
470	I	91.2	Very high	94.9	Very high	48 Å²	48	65 Å²	65	25%	0.246	36%	0.356	C	S	.	.	H	α-helix	trans	-60.5	-52.5	178	-61.3	166.6	0	0	0	110	I424 L433 N466 R467 E468 Q472 V473 E474	I424-I470 HydrophobicContact CD1-CD1 4.06Å; I424-I470 HydrophobicContact CG2-CD1 3.97Å; I424-I470 HydrophobicContact CG2-CG1 3.7Å; L433-I470 HydrophobicContact CD2-CG2 3.66Å; L433-I470 HydrophobicContact CG-CG2 4.38Å; N466-I470 WeakPolarHBondContact O-CG1 3.31Å; N466-I470 PolarHBondContact O-N 3.04Å; R467-I470 PolarHBondContact O-N 2.87Å; E468-I470 VanDerWaalsContact C-N 3.35Å; E468-I470 PolarHBondContact O-N 2.9Å; I470-Q472 PolarHBondContact O-N 2.99Å; I470-V473 PolarHBondContact O-N 3.12Å; I470-E474 WeakPolarHBondContact O-CB 3.19Å; I470-E474 PolarHBondContact O-N 3.17Å
471	E	94.1	Very high	94.9	Very high	95 Å²	95	70.9 Å²	70.9	44%	0.444	38%	0.378	S	S	.	.	H	α-helix	trans	-59.1	-44.6	-178	-68.9	170.8	-178.2	0	0	111.8	R467 E468 S475	R467-E471 WeakPolarHBondContact CG-OE1 3.23Å; R467-E471 IonicContact CZ-OE1 3.4Å; R467-E471 IonicContact NE-OE1 3.57Å; R467-E471 PolarHBondContact NE-OE1 3.25Å; R467-E471 IonicContact NH2-OE1 2.7Å; R467-E471 PolarHBondContact NH2-OE1 2.88Å; R467-E471 WeakPolarHBondContact O-CG 3.4Å; R467-E471 PolarHBondContact O-N 2.71Å; R467-E471 VanDerWaalsContact O-N 3.15Å; E468-E471 PolarHBondContact O-N 2.9Å; E471-S475 PolarHBondContact O-N 3.01Å; E471-S475 VanDerWaalsContact O-N 3.13Å
472	Q	96.8	Very high	94.9	Very high	73 Å²	73	71.4 Å²	71.4	34%	0.341	38%	0.382	S	S	.	.	H	α-helix	trans	-67.7	-47.4	179.4	-70.4	-68.7	-18.6	0	0	111.6	E468 I470 E474 S475 G476 Y477	E468-Q472 HydrophobicContact CG-CG 4.08Å; E468-Q472 VanDerWaalsContact O-CB 3.31Å; E468-Q472 WeakPolarHBondContact O-CB 3.24Å; E468-Q472 WeakPolarHBondContact O-CG 3.31Å; E468-Q472 PolarHBondContact O-N 3.28Å; I470-Q472 PolarHBondContact O-N 2.99Å; Q472-E474 VanDerWaalsContact C-N 3.3Å; Q472-E474 PolarHBondContact O-N 2.73Å; Q472-S475 PolarHBondContact O-N 3.49Å; Q472-S475 VanDerWaalsContact O-N 3.11Å; Q472-S475 PolarHBondContact O-OG 3.47Å; Q472-G476 PolarHBondContact O-N 2.77Å; Q472-Y477 HydrophobicContact CB-CD1 4.14Å; Q472-Y477 HydrophobicContact CB-CG 4.23Å; Q472-Y477 WeakPolarHBondContact O-CB 3.33Å; Q472-Y477 PolarHBondContact O-N 2.88Å
473	V	96.5	Very high	94.9	Very high	10 Å²	10	78 Å²	78	6%	0.061	40%	0.396	C	S	.	.	H	α-helix	trans	-60.8	-40.8	-179.6	164.3	0	0	0	0	111.5	P429 W444 Y461 V469 I470 S475 G476 R478	P429-V473 HydrophobicContact CB-CG1 4.28Å; P429-V473 HydrophobicContact CG-CG1 4.38Å; W444-V473 HydrophobicContact CH2-CG1 3.47Å; W444-V473 VanDerWaalsContact CH2-CG1 3.47Å; W444-V473 HydrophobicContact CZ2-CG1 3.65Å; W444-V473 HydrophobicContact CZ2-CG2 4.42Å; Y461-V473 HydrophobicContact CE1-CG2 3.9Å; V469-V473 HydrophobicContact CG1-CG2 4.21Å; V469-V473 VanDerWaalsContact O-CB 3.24Å; V469-V473 WeakPolarHBondContact O-CB 2.89Å; V469-V473 WeakPolarHBondContact O-CG2 3.3Å; V469-V473 PolarHBondContact O-N 3.12Å; I470-V473 PolarHBondContact O-N 3.12Å; V473-S475 VanDerWaalsContact C-N 3.3Å; V473-S475 PolarHBondContact O-N 3.25Å; V473-G476 PolarHBondContact O-N 3.04Å; V473-G476 VanDerWaalsContact O-N 3.11Å; V473-R478 PolarHBondContact O-NH1 3.14Å
474	E	93.2	Very high	94.6	Very high	117 Å²	117	80.3 Å²	80.3	55%	0.547	39%	0.389	S	S	.	.	H	α-helix	trans	-66.1	-33.6	177	-151.7	-176.8	-176.7	0	0	111.8	L433 I470 Q472 G476	L433-E474 HydrophobicContact CD1-CG 4.26Å; I470-E474 WeakPolarHBondContact O-CB 3.19Å; I470-E474 PolarHBondContact O-N 3.17Å; Q472-E474 VanDerWaalsContact C-N 3.3Å; Q472-E474 PolarHBondContact O-N 2.73Å; E474-G476 PolarHBondContact O-N 2.94Å
475	S	95.6	Very high	94.7	Very high	88 Å²	88	79 Å²	79	62%	0.615	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-1.5	173.3	79.5	0	0	0	0	114.6	E471 Q472 V473	E471-S475 PolarHBondContact O-N 3.01Å; E471-S475 VanDerWaalsContact O-N 3.13Å; Q472-S475 PolarHBondContact O-N 3.49Å; Q472-S475 VanDerWaalsContact O-N 3.11Å; Q472-S475 PolarHBondContact O-OG 3.47Å; V473-S475 VanDerWaalsContact C-N 3.3Å; V473-S475 PolarHBondContact O-N 3.25Å
476	G	96	Very high	94.9	Very high	52 Å²	52	73.4 Å²	73.4	54%	0.536	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.5	2.1	178.6	0	0	0	0	0	114.9	Q472 V473 E474	Q472-G476 PolarHBondContact O-N 2.77Å; V473-G476 PolarHBondContact O-N 3.04Å; V473-G476 VanDerWaalsContact O-N 3.11Å; E474-G476 PolarHBondContact O-N 2.94Å
477	Y	97.6	Very high	95.1	Very high	72 Å²	72	74.7 Å²	74.7	28%	0.282	36%	0.363	S	S	.	.			trans	-63.7	138.8	175.2	174.5	-96	0	0	0	111.3	Y461 M464 Q472 M479 P480	Y461-Y477 HydrophobicContact CD1-CE1 4.02Å; Y461-Y477 HydrophobicContact CE1-CD1 4.43Å; Y461-Y477 HydrophobicContact CE1-CE1 4.17Å; M464-Y477 HydrophobicContact CE-CE1 3.87Å; M464-Y477 HydrophobicContact SD-CE1 4.27Å; Q472-Y477 HydrophobicContact CB-CD1 4.14Å; Q472-Y477 HydrophobicContact CB-CG 4.23Å; Q472-Y477 WeakPolarHBondContact O-CB 3.33Å; Q472-Y477 PolarHBondContact O-N 2.88Å; Y477-M479 HydrophobicContact CE1-CG 4.5Å; Y477-P480 WeakPolarHBondContact OH-CD 3.43Å
478	R	97.6	Very high	95.4	Very high	46 Å²	46	67.1 Å²	67.1	17%	0.174	34%	0.341	C	S	.	.			trans	-132.5	148.3	169.7	-62.1	-61.5	-179.6	-92.5	2.4	109.1	V473 L494 W497	V473-R478 PolarHBondContact O-NH1 3.14Å; R478-L494 HydrophobicContact CB-CD2 4.03Å; R478-L494 HydrophobicContact CG-CD2 4.41Å; R478-W497 HydrophobicContact CB-CE3 4.32Å; R478-W497 VanDerWaalsContact CZ-O 3.28Å; R478-W497 PolarHBondContact NE-O 2.97Å; R478-W497 PolarHBondContact NH2-O 2.98Å
479	M	97.4	Very high	95.5	Very high	1 Å²	1	63.6 Å²	63.6	1%	0.005	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-57.6	139	180	-72.6	-175.2	-73.9	0	0	110.8	I448 Y451 P460 Y461 Y477 Y490 W497	I448-M479 HydrophobicContact CD1-CE 3.54Å; Y451-M479 HydrophobicContact CD1-CE 4.33Å; Y451-M479 HydrophobicContact CD1-SD 4.34Å; Y451-M479 HydrophobicContact CD2-CB 4.49Å; Y451-M479 HydrophobicContact CD2-CE 3.89Å; Y451-M479 HydrophobicContact CD2-SD 3.87Å; Y451-M479 HydrophobicContact CE1-SD 4.25Å; Y451-M479 HydrophobicContact CE2-CB 4.39Å; Y451-M479 HydrophobicContact CE2-CE 4.38Å; Y451-M479 HydrophobicContact CE2-SD 3.72Å; Y451-M479 HydrophobicContact CG-CE 3.87Å; Y451-M479 HydrophobicContact CG-SD 4.18Å; P460-M479 HydrophobicContact CB-CE 4.23Å; P460-M479 HydrophobicContact CB-SD 4.24Å; Y461-M479 HydrophobicContact CD1-CG 3.62Å; Y461-M479 HydrophobicContact CD1-SD 4.03Å; Y461-M479 HydrophobicContact CD2-CE 4.41Å; Y461-M479 HydrophobicContact CD2-SD 4.21Å; Y461-M479 HydrophobicContact CE1-CE 4.33Å; Y461-M479 HydrophobicContact CE1-CG 3.6Å; Y461-M479 HydrophobicContact CE1-SD 4.19Å; Y461-M479 HydrophobicContact CE2-CE 4.03Å; Y461-M479 HydrophobicContact CE2-SD 4.36Å; Y461-M479 HydrophobicContact CG-CG 4.23Å; Y461-M479 HydrophobicContact CG-SD 4.03Å; Y461-M479 PolarHBondContact N-SD 3.33Å; Y477-M479 HydrophobicContact CE1-CG 4.5Å; M479-Y490 WeakPolarHBondContact O-CE2 3.45Å; M479-Y490 PolarHBondContact O-OH 2.68Å; M479-W497 HydrophobicContact CB-CH2 4.27Å; M479-W497 HydrophobicContact CB-CZ3 4.22Å; M479-W497 HydrophobicContact CE-CH2 3.67Å; M479-W497 HydrophobicContact CE-CZ2 3.68Å
480	P	97.4	Very high	95.7	Very high	85 Å²	85	65 Å²	65	55%	0.552	33%	0.329	S	S	*	.	P	Polyproline II helix	trans	-66.4	158.8	176.3	29	-35.6	0	0	0	110.9	Y477 P482	Y477-P480 WeakPolarHBondContact OH-CD 3.43Å; P480-P482 WeakPolarHBondContact O-CD 3.43Å
481	R	98.2	Very high	96.1	Very high	124 Å²	124	67 Å²	67	47%	0.468	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-55.4	121.6	175.8	-173.7	169.6	66.6	87.4	2.7	110.1	C485 Y490	R481-C485 WeakPolarHBondContact CD-O 3.43Å; R481-C485 HydrophobicContact CG-CB 4.03Å; R481-C485 PolarHBondContact NH1-O 2.96Å; R481-Y490 VanDerWaalsContact CA-CE2 3.45Å; R481-Y490 HydrophobicContact CB-CD1 3.66Å; R481-Y490 HydrophobicContact CB-CD2 3.83Å; R481-Y490 HydrophobicContact CB-CE1 3.79Å; R481-Y490 HydrophobicContact CB-CE2 3.97Å; R481-Y490 HydrophobicContact CB-CG 3.67Å; R481-Y490 HydrophobicContact CG-CD1 3.98Å; R481-Y490 HydrophobicContact CG-CD2 4.05Å; R481-Y490 HydrophobicContact CG-CG 3.65Å; R481-Y490 VanDerWaalsContact N-CZ 3.32Å; R481-Y490 PolarHBondContact N-OH 3.16Å
482	P	96.5	Very high	96.3	Very high	13 Å²	13	62.6 Å²	62.6	8%	0.084	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-61.3	155.8	176.8	-23.3	33.8	0	0	0	112.2	Y451 I454 T455 P480 D484 C485	Y451-P482 HydrophobicContact CD2-CG 3.65Å; Y451-P482 HydrophobicContact CE2-CG 3.72Å; I454-P482 HydrophobicContact CG2-CB 4.09Å; I454-P482 HydrophobicContact CG2-CG 3.86Å; T455-P482 HydrophobicContact CG2-CB 3.7Å; T455-P482 HydrophobicContact CG2-CG 3.96Å; P480-P482 WeakPolarHBondContact O-CD 3.43Å; P482-D484 PolarHBondContact O-N 3.17Å; P482-C485 HydrophobicContact CB-CB 3.99Å; P482-C485 HydrophobicContact CG-CB 4.25Å; P482-C485 VanDerWaalsContact O-CB 3.25Å; P482-C485 WeakPolarHBondContact O-CB 3.39Å; P482-C485 PolarHBondContact O-N 2.94Å
483	R	92.9	Very high	96.3	Very high	219 Å²	219	59.1 Å²	59.1	83%	0.826	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	137.4	172.1	-170.3	-174.4	170	165	1.5	109.5	C485	R483-C485 PolarHBondContact O-N 3.41Å
484	D	88.9	Confident	96.4	Very high	130 Å²	130	61.9 Å²	61.9	70%	0.695	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.5	4.8	-179.7	-46.7	-43.3	0	0	0	115.4	P482 P486	P482-D484 PolarHBondContact O-N 3.17Å; D484-P486 WeakPolarHBondContact O-CD 3.26Å
485	C	96.4	Very high	96.7	Very high	1 Å²	1	59.9 Å²	59.9	1%	0.007	31%	0.305	C	S	.	.			trans	-74	122.1	172.4	-179.1	0	0	0	0	110.2	I454 R481 P482 R483	I454-C485 HydrophobicContact CG1-CB 3.79Å; I454-C485 HydrophobicContact CG2-CB 4.37Å; R481-C485 WeakPolarHBondContact CD-O 3.43Å; R481-C485 HydrophobicContact CG-CB 4.03Å; R481-C485 PolarHBondContact NH1-O 2.96Å; P482-C485 HydrophobicContact CB-CB 3.99Å; P482-C485 HydrophobicContact CG-CB 4.25Å; P482-C485 VanDerWaalsContact O-CB 3.25Å; P482-C485 WeakPolarHBondContact O-CB 3.39Å; P482-C485 PolarHBondContact O-N 2.94Å; R483-C485 PolarHBondContact O-N 3.41Å
486	P	96.3	Very high	96.9	Very high	30 Å²	30	55.7 Å²	55.7	20%	0.195	28%	0.276	C	S	.	.			trans	-59.9	147.4	175.2	-23.7	33.8	0	0	0	112.8	L354 D484 A488 M489 Y490 Y517	L354-P486 HydrophobicContact CD1-CG 4.04Å; L354-P486 HydrophobicContact CD2-CG 3.54Å; L354-P486 HydrophobicContact CG-CG 4.43Å; D484-P486 WeakPolarHBondContact O-CD 3.26Å; P486-A488 PolarHBondContact O-N 2.55Å; P486-M489 HydrophobicContact CB-CB 4.48Å; P486-M489 PolarHBondContact O-N 3.18Å; P486-Y490 PolarHBondContact O-N 2.74Å; P486-Y490 VanDerWaalsContact O-N 3.13Å; P486-Y517 WeakPolarHBondContact CB-OH 3.29Å; P486-Y517 WeakPolarHBondContact CG-OH 3.4Å
487	Q	96.4	Very high	97	Very high	98 Å²	98	53.3 Å²	53.3	46%	0.458	25%	0.251	S	S	.	.	H	α-helix	trans	-57.5	-47.1	-177.6	-178.4	58.9	31.3	0	0	112.7	M489 Y490 E491	Q487-M489 VanDerWaalsContact C-N 3.28Å; Q487-M489 PolarHBondContact O-N 3.15Å; Q487-Y490 WeakPolarHBondContact O-CB 2.7Å; Q487-Y490 PolarHBondContact O-N 3.26Å; Q487-Y490 VanDerWaalsContact O-N 3.08Å; Q487-E491 WeakPolarHBondContact CG-OE1 3.31Å; Q487-E491 PolarHBondContact NE2-OE1 3.11Å; Q487-E491 WeakPolarHBondContact O-CG 3.21Å; Q487-E491 PolarHBondContact O-N 3.31Å
488	A	95.5	Very high	97	Very high	29 Å²	29	52.4 Å²	52.4	24%	0.24	25%	0.251	C	S	.	.	H	α-helix	trans	-60.1	-36.2	179.6	0	0	0	0	0	113	P486 E491 V492 F513 Y517	P486-A488 PolarHBondContact O-N 2.55Å; A488-E491 PolarHBondContact O-N 3.18Å; A488-V492 PolarHBondContact O-N 3.36Å; A488-F513 HydrophobicContact CB-CZ 4.2Å; A488-Y517 HydrophobicContact CB-CE2 4.3Å
489	M	97.2	Very high	96.9	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-69.9	-38.1	176.8	-175.4	176.2	-177.7	0	0	111.1	L450 I454 P486 Q487 V492 M493 F514 Y517	L450-M489 HydrophobicContact CB-CE 4.09Å; L450-M489 HydrophobicContact CD2-CE 4.16Å; I454-M489 HydrophobicContact CB-CE 4.11Å; I454-M489 HydrophobicContact CB-SD 4.36Å; I454-M489 HydrophobicContact CD1-SD 4.04Å; I454-M489 HydrophobicContact CG1-SD 4.25Å; P486-M489 HydrophobicContact CB-CB 4.48Å; P486-M489 PolarHBondContact O-N 3.18Å; Q487-M489 VanDerWaalsContact C-N 3.28Å; Q487-M489 PolarHBondContact O-N 3.15Å; M489-V492 PolarHBondContact O-N 3.02Å; M489-M493 HydrophobicContact CE-CE 3.93Å; M489-M493 HydrophobicContact CG-CE 4.14Å; M489-M493 WeakPolarHBondContact O-CG 3.29Å; M489-M493 PolarHBondContact O-N 3.13Å; M489-M493 HydrophobicContact SD-CE 4.45Å; M489-F514 HydrophobicContact CE-CE1 4.16Å; M489-F514 HydrophobicContact CE-CZ 4.36Å; M489-F514 HydrophobicContact CG-CE1 3.95Å; M489-F514 HydrophobicContact CG-CZ 4.14Å; M489-F514 HydrophobicContact SD-CE1 4.3Å; M489-Y517 HydrophobicContact CB-CE2 4.47Å
490	Y	98.4	Very high	96.9	Very high	33 Å²	33	59.2 Å²	59.2	13%	0.129	29%	0.292	C	S	.	.	H	α-helix	trans	-67.1	-37.8	175.7	-177.3	-119.6	0	0	0	112.8	M479 R481 P486 Q487 V492 M493 L494	M479-Y490 WeakPolarHBondContact O-CE2 3.45Å; M479-Y490 PolarHBondContact O-OH 2.68Å; R481-Y490 VanDerWaalsContact CA-CE2 3.45Å; R481-Y490 HydrophobicContact CB-CD1 3.66Å; R481-Y490 HydrophobicContact CB-CD2 3.83Å; R481-Y490 HydrophobicContact CB-CE1 3.79Å; R481-Y490 HydrophobicContact CB-CE2 3.97Å; R481-Y490 HydrophobicContact CB-CG 3.67Å; R481-Y490 HydrophobicContact CG-CD1 3.98Å; R481-Y490 HydrophobicContact CG-CD2 4.05Å; R481-Y490 HydrophobicContact CG-CG 3.65Å; R481-Y490 VanDerWaalsContact N-CZ 3.32Å; R481-Y490 PolarHBondContact N-OH 3.16Å; P486-Y490 PolarHBondContact O-N 2.74Å; P486-Y490 VanDerWaalsContact O-N 3.13Å; Q487-Y490 WeakPolarHBondContact O-CB 2.7Å; Q487-Y490 PolarHBondContact O-N 3.26Å; Q487-Y490 VanDerWaalsContact O-N 3.08Å; Y490-V492 VanDerWaalsContact C-N 3.3Å; Y490-V492 PolarHBondContact O-N 2.81Å; Y490-M493 HydrophobicContact CD2-CB 4.5Å; Y490-M493 HydrophobicContact CD2-SD 4.25Å; Y490-M493 WeakPolarHBondContact O-CB 3.29Å; Y490-M493 PolarHBondContact O-N 3.47Å; Y490-M493 VanDerWaalsContact O-N 3.13Å; Y490-L494 HydrophobicContact CD1-CD1 4.09Å; Y490-L494 HydrophobicContact CD1-CG 4.49Å; Y490-L494 HydrophobicContact CE1-CD1 3.66Å; Y490-L494 HydrophobicContact CE1-CD2 4.47Å; Y490-L494 HydrophobicContact CE1-CG 4.11Å; Y490-L494 HydrophobicContact CE2-CD2 4.34Å; Y490-L494 HydrophobicContact CE2-CG 4.31Å; Y490-L494 WeakPolarHBondContact O-CG 3.45Å; Y490-L494 PolarHBondContact O-N 3Å
491	E	98.2	Very high	96.9	Very high	92 Å²	92	56.8 Å²	56.8	43%	0.43	28%	0.276	S	S	.	.	H	α-helix	trans	-60.3	-41	173.8	-74.1	168.7	-171.8	0	0	111.6	Q487 A488 L494 Q495	Q487-E491 WeakPolarHBondContact CG-OE1 3.31Å; Q487-E491 PolarHBondContact NE2-OE1 3.11Å; Q487-E491 WeakPolarHBondContact O-CG 3.21Å; Q487-E491 PolarHBondContact O-N 3.31Å; A488-E491 PolarHBondContact O-N 3.18Å; E491-L494 PolarHBondContact O-N 3.36Å; E491-Q495 WeakPolarHBondContact O-CG 3.47Å; E491-Q495 PolarHBondContact O-N 3.38Å
492	V	98.2	Very high	96.9	Very high	2 Å²	2	57.1 Å²	57.1	1%	0.012	28%	0.283	C	S	.	.	H	α-helix	trans	-63.9	-41.5	172.1	168.5	0	0	0	0	112	L450 A488 M489 Y490 L494 Q495 T496 L510 F513 F514	L450-V492 HydrophobicContact CD1-CG1 4.18Å; A488-V492 PolarHBondContact O-N 3.36Å; M489-V492 PolarHBondContact O-N 3.02Å; Y490-V492 VanDerWaalsContact C-N 3.3Å; Y490-V492 PolarHBondContact O-N 2.81Å; V492-L494 VanDerWaalsContact C-N 3.3Å; V492-L494 PolarHBondContact O-N 2.95Å; V492-Q495 WeakPolarHBondContact O-CB 3.37Å; V492-Q495 PolarHBondContact O-N 3.26Å; V492-T496 HydrophobicContact CG1-CG2 4.45Å; V492-T496 WeakPolarHBondContact O-CG2 3.42Å; V492-T496 PolarHBondContact O-N 2.86Å; V492-T496 PolarHBondContact O-OG1 2.65Å; V492-L510 HydrophobicContact CG1-CD2 3.43Å; V492-L510 VanDerWaalsContact CG1-CD2 3.43Å; V492-F513 HydrophobicContact CB-CE1 4.2Å; V492-F513 HydrophobicContact CB-CZ 4.41Å; V492-F513 HydrophobicContact CG2-CD1 3.78Å; V492-F513 HydrophobicContact CG2-CD2 3.91Å; V492-F513 HydrophobicContact CG2-CE1 3.49Å; V492-F513 VanDerWaalsContact CG2-CE1 3.49Å; V492-F513 HydrophobicContact CG2-CE2 3.62Å; V492-F513 HydrophobicContact CG2-CG 3.98Å; V492-F513 HydrophobicContact CG2-CZ 3.41Å; V492-F513 VanDerWaalsContact CG2-CZ 3.41Å; V492-F514 HydrophobicContact CG1-CE2 4.15Å; V492-F514 HydrophobicContact CG1-CZ 4.32Å
493	M	98.6	Very high	97	Very high	0 Å²	0	61 Å²	61	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-57.3	-45	173.7	-66.3	178.8	-171.7	0	0	111.4	L450 I454 M489 Y490 Q495 T496 W497	L450-M493 HydrophobicContact CB-CE 3.76Å; L450-M493 HydrophobicContact CB-CG 4.08Å; L450-M493 HydrophobicContact CD1-CG 4.15Å; I454-M493 HydrophobicContact CB-CE 4.43Å; I454-M493 HydrophobicContact CG2-CE 3.76Å; M489-M493 HydrophobicContact CE-CE 3.93Å; M489-M493 HydrophobicContact CG-CE 4.14Å; M489-M493 WeakPolarHBondContact O-CG 3.29Å; M489-M493 PolarHBondContact O-N 3.13Å; M489-M493 HydrophobicContact SD-CE 4.45Å; Y490-M493 HydrophobicContact CD2-CB 4.5Å; Y490-M493 HydrophobicContact CD2-SD 4.25Å; Y490-M493 WeakPolarHBondContact O-CB 3.29Å; Y490-M493 PolarHBondContact O-N 3.47Å; Y490-M493 VanDerWaalsContact O-N 3.13Å; M493-Q495 VanDerWaalsContact C-N 3.34Å; M493-Q495 PolarHBondContact O-N 2.93Å; M493-T496 WeakPolarHBondContact CA-OG1 3.2Å; M493-T496 PolarHBondContact O-N 2.85Å; M493-T496 PolarHBondContact O-OG1 2.84Å; M493-W497 HydrophobicContact CB-CE3 4.22Å; M493-W497 HydrophobicContact CB-CH2 3.83Å; M493-W497 HydrophobicContact CB-CZ2 4.18Å; M493-W497 HydrophobicContact CB-CZ3 3.86Å; M493-W497 HydrophobicContact CG-CH2 4.31Å; M493-W497 VanDerWaalsContact O-CD2 3.28Å; M493-W497 VanDerWaalsContact O-CG 3.32Å; M493-W497 PolarHBondContact O-N 2.77Å; M493-W497 HydrophobicContact SD-CH2 3.99Å
494	L	98.6	Very high	97.2	Very high	67 Å²	67	50.8 Å²	50.8	35%	0.351	26%	0.264	S	S	.	.	H	α-helix	trans	-61.6	-41.1	177	-69.2	176	0	0	0	112.2	R478 Y490 E491 V492 T496 W497 D498	R478-L494 HydrophobicContact CB-CD2 4.03Å; R478-L494 HydrophobicContact CG-CD2 4.41Å; Y490-L494 HydrophobicContact CD1-CD1 4.09Å; Y490-L494 HydrophobicContact CD1-CG 4.49Å; Y490-L494 HydrophobicContact CE1-CD1 3.66Å; Y490-L494 HydrophobicContact CE1-CD2 4.47Å; Y490-L494 HydrophobicContact CE1-CG 4.11Å; Y490-L494 HydrophobicContact CE2-CD2 4.34Å; Y490-L494 HydrophobicContact CE2-CG 4.31Å; Y490-L494 WeakPolarHBondContact O-CG 3.45Å; Y490-L494 PolarHBondContact O-N 3Å; E491-L494 PolarHBondContact O-N 3.36Å; V492-L494 VanDerWaalsContact C-N 3.3Å; V492-L494 PolarHBondContact O-N 2.95Å; L494-T496 VanDerWaalsContact C-N 3.35Å; L494-T496 PolarHBondContact O-N 3.18Å; L494-W497 HydrophobicContact CD2-CE3 4.43Å; L494-W497 CarbonylContact O-C 3.55Å; L494-W497 PolarHBondContact O-N 3.4Å; L494-W497 VanDerWaalsContact O-N 3.14Å; L494-D498 PolarHBondContact O-N 3.3Å
495	Q	98.6	Very high	97.7	Very high	76 Å²	76	45.5 Å²	45.5	36%	0.355	24%	0.237	S	C	.	.	H	α-helix	trans	-61.8	-41.1	174.2	-69.2	169.8	13.6	0	0	112	E491 V492 M493 W497 D498 P505	E491-Q495 WeakPolarHBondContact O-CG 3.47Å; E491-Q495 PolarHBondContact O-N 3.38Å; V492-Q495 WeakPolarHBondContact O-CB 3.37Å; V492-Q495 PolarHBondContact O-N 3.26Å; M493-Q495 VanDerWaalsContact C-N 3.34Å; M493-Q495 PolarHBondContact O-N 2.93Å; Q495-W497 PolarHBondContact O-N 3.19Å; Q495-D498 PolarHBondContact O-N 3.23Å; Q495-P505 HydrophobicContact CB-CG 4.5Å
496	T	98.8	Very high	97.8	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-67.8	-23.6	175.8	62	0	0	0	0	113.3	V443 W444 Y446 G447 V492 M493 L494 R504 P505 L510	V443-T496 HydrophobicContact CG1-CG2 3.87Å; V443-T496 WeakPolarHBondContact O-CB 3.3Å; W444-T496 WeakPolarHBondContact CA-O 3.37Å; Y446-T496 HydrophobicContact CD1-CG2 4.49Å; G447-T496 WeakPolarHBondContact CA-OG1 3.4Å; V492-T496 HydrophobicContact CG1-CG2 4.45Å; V492-T496 WeakPolarHBondContact O-CG2 3.42Å; V492-T496 PolarHBondContact O-N 2.86Å; V492-T496 PolarHBondContact O-OG1 2.65Å; M493-T496 WeakPolarHBondContact CA-OG1 3.2Å; M493-T496 PolarHBondContact O-N 2.85Å; M493-T496 PolarHBondContact O-OG1 2.84Å; L494-T496 VanDerWaalsContact C-N 3.35Å; L494-T496 PolarHBondContact O-N 3.18Å; T496-R504 WeakPolarHBondContact O-CD 3.29Å; T496-P505 HydrophobicContact CG2-CG 4.16Å; T496-L510 HydrophobicContact CG2-CD1 4.23Å; T496-L510 HydrophobicContact CG2-CD2 4.01Å
497	W	98.5	Very high	97.9	Very high	2 Å²	2	46.6 Å²	46.6	1%	0.008	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99	22.4	177.3	-55.5	-34	0	0	0	113.4	W444 G447 I448 R478 M479 M493 L494 Q495 S499	W444-W497 AromaticContact CD2-CD1 3.91Å; W444-W497 HydrophobicContact CE3-CB 4.19Å; W444-W497 HydrophobicContact CH2-CB 4.16Å; W444-W497 HydrophobicContact CZ3-CB 3.94Å; W444-W497 VanDerWaalsContact CZ3-O 3.31Å; W444-W497 WeakPolarHBondContact CZ3-O 3.46Å; W444-W497 PolarHBondContact O-NE1 2.77Å; G447-W497 VanDerWaalsContact C-NE1 3.34Å; G447-W497 VanDerWaalsContact O-CZ2 3.26Å; G447-W497 WeakPolarHBondContact O-CZ2 3.28Å; I448-W497 HydrophobicContact CD1-CZ2 3.78Å; R478-W497 HydrophobicContact CB-CE3 4.32Å; R478-W497 VanDerWaalsContact CZ-O 3.28Å; R478-W497 PolarHBondContact NE-O 2.97Å; R478-W497 PolarHBondContact NH2-O 2.98Å; M479-W497 HydrophobicContact CB-CH2 4.27Å; M479-W497 HydrophobicContact CB-CZ3 4.22Å; M479-W497 HydrophobicContact CE-CH2 3.67Å; M479-W497 HydrophobicContact CE-CZ2 3.68Å; M493-W497 HydrophobicContact CB-CE3 4.22Å; M493-W497 HydrophobicContact CB-CH2 3.83Å; M493-W497 HydrophobicContact CB-CZ2 4.18Å; M493-W497 HydrophobicContact CB-CZ3 3.86Å; M493-W497 HydrophobicContact CG-CH2 4.31Å; M493-W497 VanDerWaalsContact O-CD2 3.28Å; M493-W497 VanDerWaalsContact O-CG 3.32Å; M493-W497 PolarHBondContact O-N 2.77Å; M493-W497 HydrophobicContact SD-CH2 3.99Å; L494-W497 HydrophobicContact CD2-CE3 4.43Å; L494-W497 CarbonylContact O-C 3.55Å; L494-W497 PolarHBondContact O-N 3.4Å; L494-W497 VanDerWaalsContact O-N 3.14Å; Q495-W497 PolarHBondContact O-N 3.19Å; W497-S499 PolarHBondContact O-N 2.82Å
498	D	98.4	Very high	98	Very high	53 Å²	53	47.7 Å²	47.7	28%	0.283	25%	0.248	S	C	.	.			trans	-58.8	138.3	172.1	-156.9	-61.1	0	0	0	110.3	L494 Q495 K500 D503 R504	L494-D498 PolarHBondContact O-N 3.3Å; Q495-D498 PolarHBondContact O-N 3.23Å; D498-K500 PolarHBondContact O-N 2.85Å; D498-K500 PolarHBondContact OD1-N 2.86Å; D498-D503 HydrophobicContact CB-CB 4.36Å; D498-R504 HydrophobicContact CB-CG 4.03Å; D498-R504 PolarHBondContact O-NE 2.91Å; D498-R504 PolarHBondContact O-NH2 2.79Å; D498-R504 VanDerWaalsContact O-NH2 3.12Å
499	S	96.2	Very high	98.1	Very high	78 Å²	78	51.6 Å²	51.6	55%	0.545	26%	0.257	S	S	.	.	S	Bend	trans	-56.7	-32.5	173.7	57.3	0	0	0	0	112.9	W497	W497-S499 PolarHBondContact O-N 2.82Å
500	K	96.9	Very high	98.1	Very high	111 Å²	111	51.6 Å²	51.6	48%	0.483	26%	0.257	S	S	.	.	S	Bend	trans	-96	116	179	-69.7	174.1	178.5	179.1	0	110	D498 E502 D503	D498-K500 PolarHBondContact O-N 2.85Å; D498-K500 PolarHBondContact OD1-N 2.86Å; K500-E502 HydrophobicContact CB-CG 4.4Å; K500-E502 PolarHBondContact O-N 2.9Å; K500-D503 HydrophobicContact CB-CB 4.21Å; K500-D503 WeakPolarHBondContact CB-OD2 3.15Å; K500-D503 WeakPolarHBondContact CD-OD2 3.21Å; K500-D503 PolarHBondContact O-N 3.36Å; K500-D503 VanDerWaalsContact O-N 3.12Å
501	P	97.8	Very high	98.1	Very high	34 Å²	34	52 Å²	52	22%	0.221	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-55.4	-35.1	-179.1	-26.9	35.5	0	0	0	114.1	E430 K440 D503 R504	E430-P501 HydrophobicContact CG-CG 4.11Å; K440-P501 HydrophobicContact CB-CB 3.82Å; K440-P501 VanDerWaalsContact CD-O 3.31Å; K440-P501 WeakPolarHBondContact CD-O 3.44Å; K440-P501 HydrophobicContact CG-CB 4.43Å; K440-P501 WeakPolarHBondContact CG-O 3.41Å; P501-D503 VanDerWaalsContact C-N 3.31Å; P501-D503 PolarHBondContact O-N 2.98Å; P501-R504 WeakPolarHBondContact O-CB 3.45Å; P501-R504 PolarHBondContact O-N 3.16Å
502	E	97.2	Very high	97.8	Very high	132 Å²	132	51.8 Å²	51.8	62%	0.617	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-67.5	-25.8	179.8	61.3	-89.3	-152.4	0	0	114.3	K500	K500-E502 HydrophobicContact CB-CG 4.4Å; K500-E502 PolarHBondContact O-N 2.9Å
503	D	98.3	Very high	97.6	Very high	94 Å²	94	53.5 Å²	53.5	50%	0.503	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-86.6	-11.2	-179.8	-70	-31.1	0	0	0	112.2	D498 K500 P501	D498-D503 HydrophobicContact CB-CB 4.36Å; K500-D503 HydrophobicContact CB-CB 4.21Å; K500-D503 WeakPolarHBondContact CB-OD2 3.15Å; K500-D503 WeakPolarHBondContact CD-OD2 3.21Å; K500-D503 PolarHBondContact O-N 3.36Å; K500-D503 VanDerWaalsContact O-N 3.12Å; P501-D503 VanDerWaalsContact C-N 3.31Å; P501-D503 PolarHBondContact O-N 2.98Å
504	R	98.6	Very high	97.5	Very high	4 Å²	4	53.6 Å²	53.6	2%	0.015	27%	0.266	C	S	.	.	S	Bend	trans	-70.3	148.1	174.2	-56.7	175.9	-167.7	151.6	8.4	110.1	E430 K440 V443 T496 D498 P501	E430-R504 IonicContact OE1-CZ 2.74Å; E430-R504 IonicContact OE1-NH1 2.92Å; E430-R504 PolarHBondContact OE1-NH1 2.69Å; E430-R504 IonicContact OE1-NH2 3.73Å; E430-R504 PolarHBondContact OE1-NH2 2.97Å; E430-R504 IonicContact OE2-CZ 2.85Å; E430-R504 IonicContact OE2-NH1 3.96Å; E430-R504 IonicContact OE2-NH2 3.33Å; E430-R504 PolarHBondContact OE2-NH2 3.47Å; K440-R504 HydrophobicContact CD-CB 4.37Å; K440-R504 PolarHBondContact NZ-O 3.07Å; K440-R504 PolarHBondContact O-NH1 3.17Å; V443-R504 HydrophobicContact CG1-CB 3.93Å; T496-R504 WeakPolarHBondContact O-CD 3.29Å; D498-R504 HydrophobicContact CB-CG 4.03Å; D498-R504 PolarHBondContact O-NE 2.91Å; D498-R504 PolarHBondContact O-NH2 2.79Å; D498-R504 VanDerWaalsContact O-NH2 3.12Å; P501-R504 WeakPolarHBondContact O-CB 3.45Å; P501-R504 PolarHBondContact O-N 3.16Å
505	P	98.5	Very high	97	Very high	19 Å²	19	51.2 Å²	51.2	12%	0.123	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-66.4	169.5	179.9	26.6	-34.2	0	0	0	113.3	K440 V443 Q495 T496 Y509 L510	K440-P505 PolarHBondContact NZ-O 3.28Å; V443-P505 HydrophobicContact CG1-CG 4.27Å; Q495-P505 HydrophobicContact CB-CG 4.5Å; T496-P505 HydrophobicContact CG2-CG 4.16Å; P505-Y509 HydrophobicContact CB-CD1 3.54Å; P505-Y509 HydrophobicContact CB-CE1 4.16Å; P505-Y509 HydrophobicContact CB-CG 4.29Å; P505-Y509 HydrophobicContact CG-CD1 4.46Å; P505-L510 HydrophobicContact CB-CD2 4.39Å; P505-L510 HydrophobicContact CB-CG 4.21Å; P505-L510 HydrophobicContact CG-CD1 4.13Å; P505-L510 HydrophobicContact CG-CD2 3.77Å; P505-L510 HydrophobicContact CG-CG 3.92Å
506	T	98.5	Very high	96.5	Very high	54 Å²	54	50.8 Å²	50.8	33%	0.331	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-83.8	160.6	166.6	58.7	0	0	0	0	110.2	E372 E508 Y509 L510	E372-T506 WeakPolarHBondContact OE2-CB 3.2Å; T506-E508 VanDerWaalsContact C-N 3.29Å; T506-Y509 PolarHBondContact O-N 2.98Å; T506-Y509 WeakPolarHBondContact OG1-CB 3.45Å; T506-Y509 PolarHBondContact OG1-N 3.18Å; T506-L510 WeakPolarHBondContact O-CG 3.35Å; T506-L510 PolarHBondContact O-N 3.44Å; T506-L510 VanDerWaalsContact O-N 3.1Å
507	F	98.6	Very high	95.9	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-68.4	-31.5	174.4	-81.8	-69.1	0	0	0	112.3	M368 A369 E372 L381 V439 D442 V443 Y446 Y509 L510 Y511	M368-F507 HydrophobicContact CB-CB 4.19Å; M368-F507 HydrophobicContact CB-CD1 3.31Å; M368-F507 HydrophobicContact CB-CD2 3.74Å; M368-F507 HydrophobicContact CB-CE1 3.39Å; M368-F507 HydrophobicContact CB-CE2 3.83Å; M368-F507 HydrophobicContact CB-CG 3.48Å; M368-F507 VanDerWaalsContact CB-CG 3.48Å; M368-F507 HydrophobicContact CB-CZ 3.66Å; M368-F507 HydrophobicContact CE-CD2 4.47Å; M368-F507 HydrophobicContact CE-CE1 4.49Å; M368-F507 HydrophobicContact CE-CE2 3.67Å; M368-F507 HydrophobicContact CE-CZ 3.69Å; M368-F507 HydrophobicContact CG-CD1 4.15Å; M368-F507 HydrophobicContact CG-CE1 3.75Å; M368-F507 HydrophobicContact CG-CE2 4.43Å; M368-F507 HydrophobicContact CG-CZ 3.9Å; A369-F507 HydrophobicContact CB-CB 3.88Å; E372-F507 HydrophobicContact CB-CD2 4.31Å; E372-F507 PolarHBondContact OE2-N 3.42Å; L381-F507 HydrophobicContact CD2-CE1 4.46Å; L381-F507 HydrophobicContact CD2-CZ 4.21Å; V439-F507 HydrophobicContact CG1-CD2 3.9Å; V439-F507 HydrophobicContact CG1-CE2 3.92Å; D442-F507 HydrophobicContact CB-CE2 4.05Å; D442-F507 HydrophobicContact CB-CZ 4.08Å; V443-F507 HydrophobicContact CG2-CD2 3.96Å; V443-F507 HydrophobicContact CG2-CE1 4.49Å; V443-F507 HydrophobicContact CG2-CE2 3.61Å; V443-F507 HydrophobicContact CG2-CZ 3.91Å; Y446-F507 HydrophobicContact CD1-CE1 4.32Å; Y446-F507 HydrophobicContact CD2-CE1 4Å; Y446-F507 AromaticContact CG-CE1 3.76Å; Y446-F507 HydrophobicContact CG-CE1 3.76Å; F507-Y509 PolarHBondContact O-N 3.35Å; F507-L510 HydrophobicContact CD1-CD1 3.98Å; F507-L510 HydrophobicContact CE1-CD1 4.31Å; F507-L510 PolarHBondContact O-N 2.96Å; F507-Y511 WeakPolarHBondContact O-CB 3.45Å; F507-Y511 PolarHBondContact O-N 3.45Å
508	E	97.4	Very high	95	Very high	121 Å²	121	55.3 Å²	55.3	57%	0.565	27%	0.273	S	S	*	.	H	α-helix	trans	-57.6	-47.1	171.4	-176.1	-178.1	-166	0	0	111.5	T506 Y511 H512	T506-E508 VanDerWaalsContact C-N 3.29Å; E508-Y511 PolarHBondContact O-N 3.4Å; E508-H512 PolarHBondContact O-CD2 3.4Å; E508-H512 PolarHBondContact O-N 3.45Å; E508-H512 VanDerWaalsContact O-N 3.12Å
509	Y	97.7	Very high	93.8	Very high	111 Å²	111	57.9 Å²	57.9	44%	0.435	29%	0.291	S	S	.	.	H	α-helix	trans	-62	-45.7	175.5	172.7	-91.1	0	0	0	111.8	P505 T506 F507 Y511 H512 F513	P505-Y509 HydrophobicContact CB-CD1 3.54Å; P505-Y509 HydrophobicContact CB-CE1 4.16Å; P505-Y509 HydrophobicContact CB-CG 4.29Å; P505-Y509 HydrophobicContact CG-CD1 4.46Å; T506-Y509 PolarHBondContact O-N 2.98Å; T506-Y509 WeakPolarHBondContact OG1-CB 3.45Å; T506-Y509 PolarHBondContact OG1-N 3.18Å; F507-Y509 PolarHBondContact O-N 3.35Å; Y509-Y511 VanDerWaalsContact C-N 3.31Å; Y509-Y511 PolarHBondContact O-N 2.87Å; Y509-H512 PolarHBondContact O-N 3.03Å; Y509-F513 WeakPolarHBondContact O-CB 3.43Å; Y509-F513 PolarHBondContact O-N 3.15Å
510	L	98.5	Very high	92.1	Very high	0 Å²	0	58 Å²	58	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-61.5	-39.9	179.2	-70.3	167.7	0	0	0	111.8	A365 V443 Y446 V492 T496 P505 T506 F507 F513 F514	A365-L510 HydrophobicContact CB-CB 4.17Å; V443-L510 HydrophobicContact CG1-CD1 4.14Å; Y446-L510 HydrophobicContact CD1-CD1 3.71Å; Y446-L510 HydrophobicContact CE1-CB 4.2Å; Y446-L510 HydrophobicContact CE1-CD1 3.89Å; Y446-L510 HydrophobicContact CE1-CD2 4.2Å; Y446-L510 HydrophobicContact CE1-CG 4.33Å; V492-L510 HydrophobicContact CG1-CD2 3.43Å; V492-L510 VanDerWaalsContact CG1-CD2 3.43Å; T496-L510 HydrophobicContact CG2-CD1 4.23Å; T496-L510 HydrophobicContact CG2-CD2 4.01Å; P505-L510 HydrophobicContact CB-CD2 4.39Å; P505-L510 HydrophobicContact CB-CG 4.21Å; P505-L510 HydrophobicContact CG-CD1 4.13Å; P505-L510 HydrophobicContact CG-CD2 3.77Å; P505-L510 HydrophobicContact CG-CG 3.92Å; T506-L510 WeakPolarHBondContact O-CG 3.35Å; T506-L510 PolarHBondContact O-N 3.44Å; T506-L510 VanDerWaalsContact O-N 3.1Å; F507-L510 HydrophobicContact CD1-CD1 3.98Å; F507-L510 HydrophobicContact CE1-CD1 4.31Å; F507-L510 PolarHBondContact O-N 2.96Å; L510-F513 PolarHBondContact O-N 2.88Å; L510-F514 VanDerWaalsContact O-CD2 3.28Å; L510-F514 WeakPolarHBondContact O-CD2 3.46Å; L510-F514 PolarHBondContact O-N 2.72Å; L510-F514 VanDerWaalsContact O-N 3.12Å
511	Y	96.9	Very high	90	Very high	41 Å²	41	56.7 Å²	56.7	16%	0.161	29%	0.293	C	S	.	.	H	α-helix	trans	-58.9	-55.3	174.9	167.2	-118.8	0	0	0	111	A362 N366 F507 E508 Y509 F513 F514 D515	A362-Y511 HydrophobicContact CB-CD2 4.33Å; A362-Y511 WeakPolarHBondContact O-CD2 3.27Å; N366-Y511 HydrophobicContact CB-CD2 3.61Å; N366-Y511 HydrophobicContact CB-CE2 3.75Å; N366-Y511 HydrophobicContact CB-CG 4.18Å; F507-Y511 WeakPolarHBondContact O-CB 3.45Å; F507-Y511 PolarHBondContact O-N 3.45Å; E508-Y511 PolarHBondContact O-N 3.4Å; Y509-Y511 VanDerWaalsContact C-N 3.31Å; Y509-Y511 PolarHBondContact O-N 2.87Å; Y511-F513 VanDerWaalsContact C-N 3.31Å; Y511-F513 PolarHBondContact O-N 2.92Å; Y511-F514 PolarHBondContact O-N 3.17Å; Y511-D515 HydrophobicContact CD2-CB 4.37Å; Y511-D515 HydrophobicContact CE2-CB 4.05Å; Y511-D515 VanDerWaalsContact O-CB 3.28Å; Y511-D515 WeakPolarHBondContact O-CB 3.35Å; Y511-D515 PolarHBondContact O-N 3.27Å; Y511-D515 PolarHBondContact OH-OD2 2.93Å
512	H	92.5	Very high	87.5	Confident	88 Å²	88	61.1 Å²	61.1	41%	0.407	31%	0.31	S	S	.	.	H	α-helix	trans	-61.1	-39.2	180	-74.1	-59.8	0	0	0	112.7	E508 Y509 F514 D515 D516	E508-H512 PolarHBondContact O-CD2 3.4Å; E508-H512 PolarHBondContact O-N 3.45Å; E508-H512 VanDerWaalsContact O-N 3.12Å; Y509-H512 PolarHBondContact O-N 3.03Å; H512-F514 PolarHBondContact O-N 3.14Å; H512-D515 PolarHBondContact O-N 2.87Å; H512-D516 WeakPolarHBondContact O-CB 3.5Å; H512-D516 PolarHBondContact O-N 2.81Å
513	F	95.3	Very high	84.5	Confident	39 Å²	39	60.6 Å²	60.6	17%	0.171	32%	0.319	C	S	.	.	H	α-helix	trans	-57	-49	175.2	174.7	-89.2	0	0	0	112.2	A488 V492 Y509 L510 Y511 Y517	A488-F513 HydrophobicContact CB-CZ 4.2Å; V492-F513 HydrophobicContact CB-CE1 4.2Å; V492-F513 HydrophobicContact CB-CZ 4.41Å; V492-F513 HydrophobicContact CG2-CD1 3.78Å; V492-F513 HydrophobicContact CG2-CD2 3.91Å; V492-F513 HydrophobicContact CG2-CE1 3.49Å; V492-F513 VanDerWaalsContact CG2-CE1 3.49Å; V492-F513 HydrophobicContact CG2-CE2 3.62Å; V492-F513 HydrophobicContact CG2-CG 3.98Å; V492-F513 HydrophobicContact CG2-CZ 3.41Å; V492-F513 VanDerWaalsContact CG2-CZ 3.41Å; Y509-F513 WeakPolarHBondContact O-CB 3.43Å; Y509-F513 PolarHBondContact O-N 3.15Å; L510-F513 PolarHBondContact O-N 2.88Å; Y511-F513 VanDerWaalsContact C-N 3.31Å; Y511-F513 PolarHBondContact O-N 2.92Å; F513-Y517 HydrophobicContact CD1-CD2 4.39Å; F513-Y517 AromaticContact CE1-CD2 3.68Å; F513-Y517 HydrophobicContact CE1-CD2 3.68Å; F513-Y517 AromaticContact CE1-CE2 3.86Å; F513-Y517 HydrophobicContact CE1-CE2 3.86Å; F513-Y517 AromaticContact CZ-CD2 3.93Å; F513-Y517 HydrophobicContact CZ-CD2 3.93Å; F513-Y517 AromaticContact CZ-CE2 3.87Å; F513-Y517 HydrophobicContact CZ-CE2 3.87Å; F513-Y517 WeakPolarHBondContact O-CA 3.48Å; F513-Y517 PolarHBondContact O-N 2.8Å; F513-Y517 VanDerWaalsContact O-N 3.16Å
514	F	94.6	Very high	81.6	Confident	1 Å²	1	61.7 Å²	61.7	0%	0.004	33%	0.333	C	S	.	.	H	α-helix	trans	-77.1	-31.1	-178.7	-78	-68.6	0	0	0	112.9	V358 C361 A362 Y446 L450 M489 V492 L510 Y511 H512 Y517	V358-F514 HydrophobicContact CG1-CD1 4.21Å; V358-F514 VanDerWaalsContact CG1-O 3.29Å; V358-F514 WeakPolarHBondContact CG1-O 3.32Å; C361-F514 HydrophobicContact CB-CB 4.38Å; C361-F514 HydrophobicContact CB-CD1 3.78Å; C361-F514 HydrophobicContact CB-CD2 3.98Å; C361-F514 HydrophobicContact CB-CE1 4.01Å; C361-F514 HydrophobicContact CB-CE2 4.22Å; C361-F514 HydrophobicContact CB-CG 3.78Å; C361-F514 HydrophobicContact CB-CZ 4.23Å; A362-F514 HydrophobicContact CB-CB 3.72Å; Y446-F514 HydrophobicContact CE1-CE2 4.03Å; Y446-F514 WeakPolarHBondContact OH-CD2 3.45Å; Y446-F514 WeakPolarHBondContact OH-CE2 3.35Å; L450-F514 HydrophobicContact CD1-CE2 3.85Å; L450-F514 HydrophobicContact CD1-CZ 3.7Å; L450-F514 HydrophobicContact CD2-CE1 4.44Å; L450-F514 HydrophobicContact CD2-CE2 3.76Å; L450-F514 HydrophobicContact CD2-CZ 3.63Å; L450-F514 HydrophobicContact CG-CE2 4.45Å; L450-F514 HydrophobicContact CG-CZ 4.3Å; M489-F514 HydrophobicContact CE-CE1 4.16Å; M489-F514 HydrophobicContact CE-CZ 4.36Å; M489-F514 HydrophobicContact CG-CE1 3.95Å; M489-F514 HydrophobicContact CG-CZ 4.14Å; M489-F514 HydrophobicContact SD-CE1 4.3Å; V492-F514 HydrophobicContact CG1-CE2 4.15Å; V492-F514 HydrophobicContact CG1-CZ 4.32Å; L510-F514 VanDerWaalsContact O-CD2 3.28Å; L510-F514 WeakPolarHBondContact O-CD2 3.46Å; L510-F514 PolarHBondContact O-N 2.72Å; L510-F514 VanDerWaalsContact O-N 3.12Å; Y511-F514 PolarHBondContact O-N 3.17Å; H512-F514 PolarHBondContact O-N 3.14Å; F514-Y517 HydrophobicContact CD1-CD2 4.47Å; F514-Y517 VanDerWaalsContact O-CB 3.29Å; F514-Y517 WeakPolarHBondContact O-CB 3.27Å; F514-Y517 PolarHBondContact O-N 3.09Å
515	D	89.3	Confident	78.5	Confident	18 Å²	18	71.3 Å²	71.3	10%	0.096	37%	0.371	C	S	.	.	H	α-helix	trans	-72.3	-34.1	179.7	-159.7	28.3	0	0	0	112	N145 K149 A362 Y511 H512	N145-D515 PolarHBondContact ND2-OD1 2.87Å; N145-D515 PolarHBondContact ND2-OD2 2.81Å; K149-D515 IonicContact NZ-OD1 3.62Å; K149-D515 PolarHBondContact NZ-OD1 3.37Å; A362-D515 HydrophobicContact CB-CB 4.24Å; Y511-D515 HydrophobicContact CD2-CB 4.37Å; Y511-D515 HydrophobicContact CE2-CB 4.05Å; Y511-D515 VanDerWaalsContact O-CB 3.28Å; Y511-D515 WeakPolarHBondContact O-CB 3.35Å; Y511-D515 PolarHBondContact O-N 3.27Å; Y511-D515 PolarHBondContact OH-OD2 2.93Å; H512-D515 PolarHBondContact O-N 2.87Å
516	D	87.1	Confident	75.5	Confident	67 Å²	67	75 Å²	75	36%	0.358	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	12.7	175.9	-65.9	-28.8	0	0	0	113.6	N145 H512 F518 V519 S520	N145-D516 PolarHBondContact ND2-OD1 3.17Å; H512-D516 WeakPolarHBondContact O-CB 3.5Å; H512-D516 PolarHBondContact O-N 2.81Å; D516-F518 PolarHBondContact O-N 3.46Å; D516-V519 PolarHBondContact O-N 2.69Å; D516-S520 PolarHBondContact O-N 2.67Å; D516-S520 PolarHBondContact O-OG 3.04Å
517	Y	86.9	Confident	72.4	Confident	7 Å²	7	81.3 Å²	81.3	3%	0.027	43%	0.429	C	S	.	.	H	α-helix	trans	-54.3	-48.2	-171.6	-172.4	-96.5	0	0	0	113.6	V358 P486 A488 M489 F513 F514 V519 S520 V521	V358-Y517 HydrophobicContact CG1-CD1 3.93Å; V358-Y517 HydrophobicContact CG1-CG 3.78Å; V358-Y517 HydrophobicContact CG2-CD1 3.87Å; V358-Y517 HydrophobicContact CG2-CE1 4.07Å; V358-Y517 HydrophobicContact CG2-CG 4.25Å; P486-Y517 WeakPolarHBondContact CB-OH 3.29Å; P486-Y517 WeakPolarHBondContact CG-OH 3.4Å; A488-Y517 HydrophobicContact CB-CE2 4.3Å; M489-Y517 HydrophobicContact CB-CE2 4.47Å; F513-Y517 HydrophobicContact CD1-CD2 4.39Å; F513-Y517 AromaticContact CE1-CD2 3.68Å; F513-Y517 HydrophobicContact CE1-CD2 3.68Å; F513-Y517 AromaticContact CE1-CE2 3.86Å; F513-Y517 HydrophobicContact CE1-CE2 3.86Å; F513-Y517 AromaticContact CZ-CD2 3.93Å; F513-Y517 HydrophobicContact CZ-CD2 3.93Å; F513-Y517 AromaticContact CZ-CE2 3.87Å; F513-Y517 HydrophobicContact CZ-CE2 3.87Å; F513-Y517 WeakPolarHBondContact O-CA 3.48Å; F513-Y517 PolarHBondContact O-N 2.8Å; F513-Y517 VanDerWaalsContact O-N 3.16Å; F514-Y517 HydrophobicContact CD1-CD2 4.47Å; F514-Y517 VanDerWaalsContact O-CB 3.29Å; F514-Y517 WeakPolarHBondContact O-CB 3.27Å; F514-Y517 PolarHBondContact O-N 3.09Å; Y517-V519 VanDerWaalsContact C-N 3.33Å; Y517-V519 PolarHBondContact O-N 3.49Å; Y517-S520 PolarHBondContact O-OG 3.39Å; Y517-V521 WeakPolarHBondContact O-CB 3.33Å; Y517-V521 WeakPolarHBondContact O-CG2 3.25Å; Y517-V521 PolarHBondContact O-N 3.34Å
518	F	79.4	Confident	69.3	Low	90 Å²	90	86.7 Å²	86.7	40%	0.395	47%	0.467	S	S	.	.	H	α-helix	trans	-81.4	-11.8	-179.2	-65	-75.7	0	0	0	113.9	L354 V358 D516 Q522	L354-F518 HydrophobicContact CG-CZ 4.33Å; V358-F518 HydrophobicContact CB-CE2 3.94Å; V358-F518 HydrophobicContact CB-CZ 4.37Å; V358-F518 HydrophobicContact CG1-CD2 4.39Å; V358-F518 HydrophobicContact CG1-CE2 3.78Å; V358-F518 HydrophobicContact CG2-CE2 4.22Å; V358-F518 HydrophobicContact CG2-CZ 4.18Å; D516-F518 PolarHBondContact O-N 3.46Å; F518-Q522 WeakPolarHBondContact O-CG 3.17Å
519	V	72.6	Confident	66.5	Low	107 Å²	107	90.3 Å²	90.3	65%	0.648	48%	0.484	S	S	*	.	H	α-helix	trans	-84.7	-43.4	175.2	-178.2	0	0	0	0	109.8	D516 Y517	D516-V519 PolarHBondContact O-N 2.69Å; Y517-V519 VanDerWaalsContact C-N 3.33Å; Y517-V519 PolarHBondContact O-N 3.49Å
520	S	60.7	Low	63.6	Low	80 Å²	80	92.1 Å²	92.1	56%	0.559	54%	0.536	S	S	*	.	H	α-helix	trans	-72.8	-28	-179.2	56.2	0	0	0	0	114	D516 Y517	D516-S520 PolarHBondContact O-N 2.67Å; D516-S520 PolarHBondContact O-OG 3.04Å; Y517-S520 PolarHBondContact O-OG 3.39Å
521	V	54	Low	61.9	Low	84 Å²	84	96.8 Å²	96.8	51%	0.509	56%	0.563	S	S	.	*	S	Bend	trans	-88.7	-11.8	-178.1	-179.7	0	0	0	0	112.8	Y517	Y517-V521 WeakPolarHBondContact O-CB 3.33Å; Y517-V521 WeakPolarHBondContact O-CG2 3.25Å; Y517-V521 PolarHBondContact O-N 3.34Å
522	Q	45	Very low	60	Low	126 Å²	126	99.7 Å²	99.7	59%	0.589	58%	0.584	S	S	*	*	S	Bend	trans	-68.3	132.3	173.6	-81.8	179.8	17	0	0	110.2	F518 S524	F518-Q522 WeakPolarHBondContact O-CG 3.17Å; Q522-S524 PolarHBondContact O-N 2.7Å; Q522-S524 VanDerWaalsContact O-N 3.16Å
523	P	34.5	Very low	58.2	Low	122 Å²	122	100.3 Å²	100.3	79%	0.792	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-54.8	125.8	173.1	-20.7	30.9	0	0	0	108.9	Y525	P523-Y525 PolarHBondContact O-N 2.82Å
524	S	36.2	Very low	56	Low	116 Å²	116	103.9 Å²	103.9	81%	0.811	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-47.2	126	174.8	-37.3	0	0	0	0	108.3	Q522 A526	Q522-S524 PolarHBondContact O-N 2.7Å; Q522-S524 VanDerWaalsContact O-N 3.16Å; S524-A526 PolarHBondContact O-N 2.63Å
525	Y	35.1	Very low	53.6	Low	206 Å²	206	110.4 Å²	110.4	81%	0.808	66%	0.657	S	S	*	*			trans	-35.6	115.5	179.3	-83.4	-99.6	0	0	0	110.7	P523 Q527	P523-Y525 PolarHBondContact O-N 2.82Å; Y525-Q527 PolarHBondContact O-N 3.3Å
526	A	34.6	Very low	51.2	Low	98 Å²	98	116.5 Å²	116.5	81%	0.81	70%	0.695	S	S	*	*			trans	-57.4	114.2	167.5	0	0	0	0	0	106.3	S524 S528	S524-A526 PolarHBondContact O-N 2.63Å; A526-S528 PolarHBondContact O-N 2.82Å
527	Q	32.7	Very low	48.7	Very low	185 Å²	185	120.1 Å²	120.1	86%	0.864	72%	0.719	S	S	*	*			trans	-55	119.1	172.4	-78.1	178.2	-14.2	0	0	106.7	Y525 E529	Y525-Q527 PolarHBondContact O-N 3.3Å; Q527-E529 PolarHBondContact O-N 3Å
528	S	35.1	Very low	45.7	Very low	113 Å²	113	128.8 Å²	128.8	79%	0.79	77%	0.772	S	S	*	*			trans	-56.6	108.8	170.2	48.2	0	0	0	0	107.6	A526 G530	A526-S528 PolarHBondContact O-N 2.82Å; S528-G530 PolarHBondContact O-N 3.27Å; S528-G530 VanDerWaalsContact O-N 3.16Å
529	E	37.3	Very low	42.9	Very low	198 Å²	198	132 Å²	132	93%	0.925	80%	0.804	S	S	*	*			trans	-56.8	117.3	165.9	-69.7	-176.1	159.2	0	0	107.2	Q527	Q527-E529 PolarHBondContact O-N 3Å
530	G	37.1	Very low	40.2	Very low	149 Å²	149	134.3 Å²	134.3	100%	1.536	82%	0.818	S	S	*	*			trans	-85.2	0	173.3	0	0	0	0	0	111.9	S528	S528-G530 PolarHBondContact O-N 3.27Å; S528-G530 VanDerWaalsContact O-N 3.16Å

Retrieved 530 of 530 residues in 156.9 ms (Link to these results)

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