DDX6_HUMAN Loading...

Probable ATP-dependent RNA helicase DDX6

Essential for the formation of P-bodies, cytosolic membrane-less ribonucleoprotein granules involved in RNA metabolism through the coordinated storage of mRNAs encoding regulatory functions^1,2,3. Plays a role in P-bodies to coordinate the storage of translationally inactive mRNAs in the cytoplasm and prevent their degradation⁴. In the process of mRNA degradation, plays a role in mRNA decapping⁵. Blocks autophagy in nutrient-rich conditions by repressing the expression of ATG-related genes through degradation of their transcripts⁶.

AlphaFold DB , UniProt , Accession P26196, Species HUMAN (Homo sapiens, Human), Gene DDX6, Length 483 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.6	Very low	32.2	Very low	244 Å²	244	144.5 Å²	144.5	100%	1.202	80%	0.8	S	S	*	*				0	122.1	0	-66.3	-171.6	-155.7	0	0	108.1	T3	M1-T3 PolarHBondContact O-N 3.2Å
2	S	31.2	Very low	32.3	Very low	122 Å²	122	137.9 Å²	137.9	85%	0.853	76%	0.761	S	S	*	*			trans	-76	102.3	-174.5	48.1	0	0	0	0	111.3	A4	S2-A4 PolarHBondContact O-N 3.02Å; S2-A4 VanDerWaalsContact O-N 3.17Å
3	T	32.9	Very low	31.8	Very low	132 Å²	132	131.4 Å²	131.4	81%	0.81	74%	0.744	S	S	*	*			trans	-75.6	100.6	163.9	51	0	0	0	0	107.8	M1 R5	M1-T3 PolarHBondContact O-N 3.2Å; T3-R5 PolarHBondContact O-N 3.44Å; T3-R5 VanDerWaalsContact O-N 3.13Å
4	A	30.2	Very low	31.3	Very low	84 Å²	84	134.9 Å²	134.9	69%	0.694	76%	0.759	S	S	*	*			trans	-54.7	116	166.5	0	0	0	0	0	108	S2 T6	S2-A4 PolarHBondContact O-N 3.02Å; S2-A4 VanDerWaalsContact O-N 3.17Å; A4-T6 PolarHBondContact O-N 3.46Å
5	R	37.1	Very low	30.9	Very low	183 Å²	183	133.2 Å²	133.2	69%	0.691	76%	0.759	S	S	*	*			trans	-63.1	104.3	173.6	-75.3	-179.5	172.8	178.1	-3.8	107.2	T3	T3-R5 PolarHBondContact O-N 3.44Å; T3-R5 VanDerWaalsContact O-N 3.13Å
6	T	32	Very low	30.5	Very low	130 Å²	130	132.3 Å²	132.3	80%	0.798	76%	0.763	S	S	*	*			trans	-69.7	147.3	-178.7	38.4	0	0	0	0	111.9	A4 N8	A4-T6 PolarHBondContact O-N 3.46Å; T6-N8 PolarHBondContact O-N 3.1Å
7	E	31.4	Very low	30.2	Very low	176 Å²	176	135.3 Å²	135.3	82%	0.822	77%	0.769	S	S	*	*			trans	-57	114.3	177.5	-60.5	175.6	152.5	0	0	111.4
8	N	31.3	Very low	30	Very low	151 Å²	151	135.6 Å²	135.6	81%	0.807	77%	0.768	S	S	*	*			trans	-122.8	99.1	158.4	-106.8	-10.7	0	0	0	107.7	T6 V10	T6-N8 PolarHBondContact O-N 3.1Å; N8-V10 PolarHBondContact O-N 3.25Å
9	P	33.9	Very low	29.9	Very low	104 Å²	104	132.9 Å²	132.9	68%	0.675	77%	0.774	S	S	*	*			trans	-70.5	104.5	171.4	27.8	-28.2	0	0	0	107.7	I11	P9-I11 VanDerWaalsContact C-N 3.32Å; P9-I11 PolarHBondContact O-N 2.74Å
10	V	33	Very low	30.1	Very low	110 Å²	110	131.5 Å²	131.5	67%	0.667	76%	0.759	S	S	*	*			trans	-68.8	94.3	170.5	179.8	0	0	0	0	107.6	N8 M12	N8-V10 PolarHBondContact O-N 3.25Å; V10-M12 HydrophobicContact CG1-CG 4.31Å; V10-M12 PolarHBondContact O-N 2.76Å; V10-M12 VanDerWaalsContact O-N 3.1Å
11	I	29.9	Very low	30.2	Very low	153 Å²	153	133.7 Å²	133.7	79%	0.785	77%	0.768	S	S	*	*			trans	-71.4	99.8	168.8	-61.6	176.9	0	0	0	106.6	P9 G13	P9-I11 VanDerWaalsContact C-N 3.32Å; P9-I11 PolarHBondContact O-N 2.74Å; I11-G13 PolarHBondContact O-N 3.39Å; I11-G13 VanDerWaalsContact O-N 3.11Å
12	M	32.9	Very low	30.4	Very low	66 Å²	66	132.8 Å²	132.8	33%	0.325	75%	0.751	S	S	.	*			trans	-68.4	106.4	176.9	-81.6	-164	-102	0	0	110.3	V10 T327 R331	V10-M12 HydrophobicContact CG1-CG 4.31Å; V10-M12 PolarHBondContact O-N 2.76Å; V10-M12 VanDerWaalsContact O-N 3.1Å; M12-T327 HydrophobicContact CE-CG2 4.28Å; M12-T327 HydrophobicContact SD-CG2 4.24Å; M12-R331 PolarHBondContact SD-NH1 3.23Å
13	G	25.9	Very low	30.4	Very low	53 Å²	53	129.7 Å²	129.7	55%	0.546	74%	0.738	S	S	.	*			trans	-59.7	142.6	174.4	0	0	0	0	0	113.2	I11 R331	I11-G13 PolarHBondContact O-N 3.39Å; I11-G13 VanDerWaalsContact O-N 3.11Å; G13-R331 PolarHBondContact O-NH2 3.33Å
14	L	24.5	Very low	30.3	Very low	181 Å²	181	129.7 Å²	129.7	95%	0.948	74%	0.741	S	S	*	*			trans	-80.3	118.1	179.8	-68.1	156.9	0	0	0	110
15	S	25.1	Very low	30.2	Very low	109 Å²	109	132.5 Å²	132.5	76%	0.762	75%	0.749	S	S	*	*			trans	-128.3	111	158.3	61.2	0	0	0	0	108.1	Q17	S15-Q17 PolarHBondContact O-N 2.83Å
16	S	24.4	Very low	29.8	Very low	118 Å²	118	133 Å²	133	83%	0.825	76%	0.756	S	S	*	*			trans	-73.4	107.3	178.8	55	0	0	0	0	110.3
17	Q	25.8	Very low	29.7	Very low	184 Å²	184	132.6 Å²	132.6	86%	0.86	76%	0.755	S	S	*	*			trans	-169.3	98.3	158.2	-108.6	173.2	52.1	0	0	108.4	S15	S15-Q17 PolarHBondContact O-N 2.83Å
18	N	27.3	Very low	29.5	Very low	140 Å²	140	131.3 Å²	131.3	75%	0.749	76%	0.76	S	S	*	*			trans	-178.7	112.5	143.4	-95.9	-19.1	0	0	0	109.1	Q20	N18-Q20 PolarHBondContact O-N 3.33Å; N18-Q20 VanDerWaalsContact O-N 3.16Å
19	G	27	Very low	29.4	Very low	86 Å²	86	127.7 Å²	127.7	89%	0.887	76%	0.758	S	S	*	*			trans	-71.4	101.8	173	0	0	0	0	0	109.9
20	Q	34.9	Very low	29	Very low	103 Å²	103	126.1 Å²	126.1	48%	0.481	76%	0.761	S	S	.	*			trans	-97.8	126.5	167.4	-77.3	-179.1	-6.2	0	0	109.5	N18 R22	N18-Q20 PolarHBondContact O-N 3.33Å; N18-Q20 VanDerWaalsContact O-N 3.16Å; Q20-R22 PolarHBondContact O-N 2.61Å; Q20-R22 VanDerWaalsContact O-N 3.15Å
21	L	32.6	Very low	28.7	Very low	179 Å²	179	127.5 Å²	127.5	94%	0.937	77%	0.772	S	S	*	*			trans	-61.6	110.1	179.9	-71.8	158.6	0	0	0	110.1	G23	L21-G23 PolarHBondContact O-N 3.12Å
22	R	34.1	Very low	28.5	Very low	224 Å²	224	124 Å²	124	85%	0.845	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-64	116.2	166.5	-73.2	-178.1	172	-166.9	-2.6	108.1	Q20	Q20-R22 PolarHBondContact O-N 2.61Å; Q20-R22 VanDerWaalsContact O-N 3.15Å
23	G	32	Very low	28	Very low	57 Å²	57	124.7 Å²	124.7	59%	0.588	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-63.1	151.7	177.2	0	0	0	0	0	112.2	L21	L21-G23 PolarHBondContact O-N 3.12Å
24	P	30.5	Very low	27.8	Very low	133 Å²	133	126.2 Å²	126.2	86%	0.864	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-69.5	138.7	-177.5	26.3	-31.8	0	0	0	112.1	K26	P24-K26 PolarHBondContact O-N 3.18Å
25	V	27.9	Very low	27.8	Very low	142 Å²	142	121.5 Å²	121.5	86%	0.861	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-70.1	120.3	172.5	178.8	0	0	0	0	108.7
26	K	29.8	Very low	27.7	Very low	193 Å²	193	122 Å²	122	84%	0.839	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-77.7	133	-180	-140.6	178.7	-172.7	-179.5	0	110.5	P24	P24-K26 PolarHBondContact O-N 3.18Å
27	P	29.3	Very low	27.7	Very low	122 Å²	122	124.8 Å²	124.8	79%	0.792	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-73.5	142.1	174.4	-11.9	26.8	0	0	0	112.1	G29	P27-G29 PolarHBondContact O-N 3.44Å
28	T	27.4	Very low	27.7	Very low	149 Å²	149	123.1 Å²	123.1	91%	0.914	81%	0.81	S	S	*	*			trans	-73.5	109.3	174.7	48	0	0	0	0	110.9
29	G	29.7	Very low	27.4	Very low	75 Å²	75	124.9 Å²	124.9	77%	0.773	81%	0.814	S	S	*	*			trans	-125.5	117.1	171.1	0	0	0	0	0	110.4	P27	P27-G29 PolarHBondContact O-N 3.44Å
30	G	24.5	Very low	27.3	Very low	72 Å²	72	129.5 Å²	129.5	74%	0.742	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-77	163.6	179.3	0	0	0	0	0	113.5
31	P	27.4	Very low	26.8	Very low	138 Å²	138	133.9 Å²	133.9	90%	0.896	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-86.2	118	-172.7	30.3	-25.3	0	0	0	111.7
32	G	25.4	Very low	26.2	Very low	80 Å²	80	133 Å²	133	83%	0.825	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-98.3	131.8	167.9	0	0	0	0	0	110.3
33	G	22.3	Very low	25.7	Very low	81 Å²	81	128 Å²	128	84%	0.835	82%	0.816	S	S	*	*			trans	-99.7	-173.7	-174.1	0	0	0	0	0	115.6
34	G	21.8	Very low	25.3	Very low	85 Å²	85	132.1 Å²	132.1	88%	0.876	82%	0.82	S	S	*	*			trans	92.4	120.5	155.7	0	0	0	0	0	115.6
35	G	25.5	Very low	25	Very low	81 Å²	81	134.6 Å²	134.6	84%	0.835	83%	0.825	S	S	*	*			trans	164.4	82.2	169.4	0	0	0	0	0	115.2
36	T	22.4	Very low	24.8	Very low	121 Å²	121	136 Å²	136	74%	0.742	82%	0.82	S	S	*	*			trans	-59	150.9	178.3	14	0	0	0	0	116.9
37	Q	23.3	Very low	24.4	Very low	176 Å²	176	133.5 Å²	133.5	82%	0.822	82%	0.815	S	S	*	*			trans	58.8	116.5	139.3	-67.9	172.9	7.3	0	0	120
38	T	26.1	Very low	24.2	Very low	148 Å²	148	134.4 Å²	134.4	91%	0.908	82%	0.819	S	S	*	*				-151.6	128.3	122	-40.5	0	0	0	0	109.9
39	Q	21	Very low	23.9	Very low	178 Å²	178	134.1 Å²	134.1	83%	0.832	81%	0.811	S	S	*	*			trans	-114.5	129.4	178.3	177.5	175	17.8	0	0	106.2
40	Q	24.5	Very low	23.7	Very low	182 Å²	182	136.8 Å²	136.8	85%	0.85	81%	0.813	S	S	*	*			trans	161	118.2	156.6	-92.7	161	27.2	0	0	108.7
41	Q	25.2	Very low	23.6	Very low	196 Å²	196	140.4 Å²	140.4	92%	0.916	81%	0.814	S	S	*	*				172.2	146.2	90.9	-153.1	164.7	41.7	0	0	109.5
42	M	20.6	Very low	23.5	Very low	161 Å²	161	141.5 Å²	141.5	79%	0.793	81%	0.812	S	S	*	*			trans	-108.4	164.4	-161.3	-152	173.9	-164.5	0	0	109.7
43	N	23.4	Very low	23.4	Very low	119 Å²	119	144.9 Å²	144.9	64%	0.636	81%	0.811	S	S	*	*			trans	96.6	120.3	145.1	-78	-22.4	0	0	0	121.9
44	Q	22.7	Very low	23.5	Very low	142 Å²	142	144.1 Å²	144.1	66%	0.664	80%	0.804	S	S	*	*				78.9	106.2	126.7	-69.7	177.8	40.8	0	0	119.5
45	L	25.6	Very low	23.7	Very low	185 Å²	185	147 Å²	147	97%	0.969	81%	0.805	S	S	*	*				-139.6	126.5	127.9	-100.6	114.2	0	0	0	110.4
46	K	23.2	Very low	23.6	Very low	173 Å²	173	152.5 Å²	152.5	75%	0.752	81%	0.808	S	S	*	*			trans	-94.1	148	-179	-82.6	175.7	171.4	174.7	0	110.8
47	N	21.8	Very low	23.8	Very low	140 Å²	140	155.3 Å²	155.3	75%	0.749	81%	0.813	S	S	*	*			trans	47.3	119.4	142.7	-71.7	0.8	0	0	0	120.3
48	T	25.1	Very low	23.9	Very low	140 Å²	140	155.3 Å²	155.3	86%	0.859	81%	0.813	S	S	*	*			trans	-141	115.2	139.7	-34	0	0	0	0	109.6
49	N	20.5	Very low	23.8	Very low	143 Å²	143	153.4 Å²	153.4	77%	0.765	81%	0.813	S	S	*	*			trans	-74.5	139.7	168.7	-81.1	-24.9	0	0	0	109.3
50	T	25.1	Very low	24.1	Very low	132 Å²	132	152.4 Å²	152.4	81%	0.81	81%	0.808	S	S	*	*			trans	-155.1	111.9	142.3	-27.3	0	0	0	0	110.2
51	I	22.2	Very low	24.1	Very low	148 Å²	148	149.8 Å²	149.8	76%	0.759	81%	0.809	S	S	*	*			trans	-88.9	124.5	169.5	-66.6	166.6	0	0	0	105.8
52	N	26.9	Very low	24.3	Very low	161 Å²	161	147 Å²	147	86%	0.861	80%	0.798	S	S	*	*			trans	-117.1	116.2	173	-131.7	9.8	0	0	0	109.4
53	N	22.9	Very low	24.6	Very low	151 Å²	151	146.4 Å²	146.4	81%	0.807	80%	0.804	S	S	*	*			trans	-91.7	144.4	177.5	-92.3	-24.1	0	0	0	110.2
54	G	23	Very low	24.8	Very low	65 Å²	65	146.1 Å²	146.1	67%	0.67	81%	0.806	S	S	*	*			trans	102	113.3	145.8	0	0	0	0	0	115.8
55	T	27.1	Very low	25.2	Very low	146 Å²	146	146.1 Å²	146.1	90%	0.896	82%	0.816	S	S	*	*				-175.9	128.3	114.4	20.7	0	0	0	0	110.2
56	Q	22.8	Very low	25.6	Very low	196 Å²	196	144.3 Å²	144.3	92%	0.916	81%	0.806	S	S	*	*			trans	-77.6	126.6	168.8	-72.5	169	-15	0	0	108.5
57	Q	27	Very low	26.5	Very low	180 Å²	180	145.7 Å²	145.7	84%	0.841	81%	0.812	S	S	*	*			trans	-141.2	112.1	163	-105.2	173.9	14.6	0	0	111.4
58	Q	25.7	Very low	27.5	Very low	175 Å²	175	145.2 Å²	145.2	82%	0.818	82%	0.817	S	S	*	*			trans	31.8	117.8	144.6	-72	173.2	-2.9	0	0	119.9	Q60	Q58-Q60 PolarHBondContact O-N 3.06Å
59	A	23.4	Very low	28.9	Very low	109 Å²	109	140.2 Å²	140.2	90%	0.901	79%	0.793	S	S	*	*			trans	-64.9	119.2	164.8	0	0	0	0	0	111.4
60	Q	28	Very low	30.8	Very low	157 Å²	157	138.1 Å²	138.1	73%	0.734	78%	0.782	S	S	*	*			trans	-113.8	124	161.7	-77.7	-177.2	-5.2	0	0	108.7	Q58 M62	Q58-Q60 PolarHBondContact O-N 3.06Å; Q60-M62 PolarHBondContact O-N 3.42Å
61	S	24.6	Very low	33.1	Very low	126 Å²	126	136.9 Å²	136.9	88%	0.881	77%	0.77	S	S	*	*			trans	-68.2	104.9	172.8	54.5	0	0	0	0	109.7
62	M	29.4	Very low	36	Very low	138 Å²	138	131.1 Å²	131.1	68%	0.68	74%	0.739	S	S	*	*			trans	-123.2	112.4	162	-70.9	-159.4	-163.2	0	0	108.9	Q60 T64	Q60-M62 PolarHBondContact O-N 3.42Å; M62-T64 HydrophobicContact CB-CG2 4.41Å; M62-T64 PolarHBondContact O-N 3.21Å; M62-T64 PolarHBondContact O-OG1 3.21Å
63	T	25.8	Very low	38.6	Very low	149 Å²	149	127 Å²	127	91%	0.914	71%	0.713	S	S	*	*			trans	-58.1	95.3	158.6	27.3	0	0	0	0	108.9
64	T	28.7	Very low	41.5	Very low	112 Å²	112	127.9 Å²	127.9	69%	0.687	71%	0.71	S	S	*	*			trans	-120.8	102.1	172.5	37.7	0	0	0	0	110.3	M62 I66	M62-T64 HydrophobicContact CB-CG2 4.41Å; M62-T64 PolarHBondContact O-N 3.21Å; M62-T64 PolarHBondContact O-OG1 3.21Å; T64-I66 PolarHBondContact O-N 3.31Å; T64-I66 VanDerWaalsContact O-N 3.1Å
65	T	31.3	Very low	44.4	Very low	142 Å²	142	129.4 Å²	129.4	87%	0.871	71%	0.706	S	S	*	*			trans	-61.1	97	160	-43.9	0	0	0	0	108.8
66	I	33.8	Very low	47.4	Very low	148 Å²	148	123.3 Å²	123.3	76%	0.759	67%	0.668	S	S	*	*			trans	-168.4	118.7	153	-84.2	137.7	0	0	0	104.8	T64 P68	T64-I66 PolarHBondContact O-N 3.31Å; T64-I66 VanDerWaalsContact O-N 3.1Å; I66-P68 VanDerWaalsContact O-CD 3.27Å; I66-P68 WeakPolarHBondContact O-CD 3.27Å
67	K	41.5	Very low	50.5	Low	201 Å²	201	122.1 Å²	122.1	87%	0.874	66%	0.66	S	S	*	*			trans	-66.7	116	175.2	-75.6	-177.3	177.9	178	0	108.7	G69	K67-G69 PolarHBondContact O-N 3.44Å
68	P	42.5	Very low	53.4	Low	131 Å²	131	118.5 Å²	118.5	85%	0.851	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	115.9	172.3	24.5	-16.6	0	0	0	107.3	I66	I66-P68 VanDerWaalsContact O-CD 3.27Å; I66-P68 WeakPolarHBondContact O-CD 3.27Å
69	G	55.4	Low	56.5	Low	34 Å²	34	112.7 Å²	112.7	35%	0.351	62%	0.623	S	S	.	*	T	Hydrogen-bonded Turn	trans	164.5	-6.9	176	0	0	0	0	0	118.4	K67 W72 R105	K67-G69 PolarHBondContact O-N 3.44Å; G69-W72 PolarHBondContact O-NE1 3.13Å; G69-R105 PolarHBondContact O-NH1 2.72Å
70	D	60.1	Low	59.5	Low	100 Å²	100	113.5 Å²	113.5	54%	0.535	62%	0.619	S	S	.	*			trans	-95.9	2.3	-179.9	-88.5	-13.7	0	0	0	115.2	W72 K73	D70-W72 PolarHBondContact O-N 3.29Å; D70-W72 VanDerWaalsContact O-N 3.15Å; D70-W72 PolarHBondContact OD1-NE1 3.03Å; D70-K73 PolarHBondContact O-N 3.09Å
71	D	73	Confident	62.3	Low	105 Å²	105	113.2 Å²	113.2	56%	0.561	62%	0.615	S	S	*	*	H	α-helix	trans	-61.1	-25.2	176.1	-81.7	-31.6	0	0	0	113.3	K73 K74	D71-K73 PolarHBondContact O-N 3.14Å; D71-K74 VanDerWaalsContact O-CB 3.31Å; D71-K74 WeakPolarHBondContact O-CB 3.22Å; D71-K74 PolarHBondContact O-N 2.79Å; D71-K74 WeakPolarHBondContact OD1-CE 3.45Å; D71-K74 IonicContact OD1-NZ 3.87Å; D71-K74 PolarHBondContact OD1-NZ 3.35Å
72	W	82.3	Confident	65.2	Low	28 Å²	28	109.6 Å²	109.6	11%	0.106	59%	0.586	C	S	.	*	H	α-helix	trans	-58.2	-33.3	173.9	71.2	-69.2	0	0	0	112.7	G69 D70 K74 T75 L76 R105 L108 M109 F112	G69-W72 PolarHBondContact O-NE1 3.13Å; D70-W72 PolarHBondContact O-N 3.29Å; D70-W72 VanDerWaalsContact O-N 3.15Å; D70-W72 PolarHBondContact OD1-NE1 3.03Å; W72-K74 PolarHBondContact O-N 2.85Å; W72-T75 WeakPolarHBondContact O-CB 3.35Å; W72-T75 PolarHBondContact O-N 3.36Å; W72-T75 PolarHBondContact O-OG1 2.79Å; W72-L76 HydrophobicContact CE3-CD1 4.05Å; W72-L76 HydrophobicContact CE3-CD2 4.11Å; W72-L76 HydrophobicContact CE3-CG 4.22Å; W72-L76 HydrophobicContact CZ3-CD1 3.7Å; W72-L76 HydrophobicContact CZ3-CD2 4.14Å; W72-L76 HydrophobicContact CZ3-CG 4.29Å; W72-R105 VanDerWaalsContact CE2-CD 3.48Å; W72-R105 VanDerWaalsContact CG-NH1 3.29Å; W72-L108 HydrophobicContact CH2-CB 3.69Å; W72-L108 HydrophobicContact CZ2-CB 4.47Å; W72-L108 HydrophobicContact CZ3-CB 4.34Å; W72-M109 HydrophobicContact CE3-CG 3.39Å; W72-M109 HydrophobicContact CE3-SD 4.43Å; W72-M109 HydrophobicContact CZ3-CB 4.16Å; W72-M109 HydrophobicContact CZ3-CG 3.41Å; W72-M109 VanDerWaalsContact CZ3-CG 3.41Å; W72-F112 AromaticContact CH2-CD2 3.67Å; W72-F112 HydrophobicContact CH2-CD2 3.67Å; W72-F112 AromaticContact CH2-CE2 3.77Å; W72-F112 HydrophobicContact CH2-CE2 3.77Å; W72-F112 HydrophobicContact CZ2-CE2 4.44Å; W72-F112 HydrophobicContact CZ3-CD2 4.15Å
73	K	82.8	Confident	67.9	Low	75 Å²	75	109.5 Å²	109.5	33%	0.326	59%	0.588	S	S	.	*	H	α-helix	trans	-61.8	-32.5	177.5	-71.3	-173.6	176.7	178.9	0	111.5	D70 D71 T75 L76 E99	D70-K73 PolarHBondContact O-N 3.09Å; D71-K73 PolarHBondContact O-N 3.14Å; K73-T75 PolarHBondContact O-N 3.05Å; K73-L76 HydrophobicContact CB-CD1 4.41Å; K73-L76 HydrophobicContact CG-CD1 4.4Å; K73-L76 WeakPolarHBondContact O-CB 3.45Å; K73-L76 PolarHBondContact O-N 3.02Å; K73-E99 WeakPolarHBondContact CE-OE1 3.42Å; K73-E99 IonicContact NZ-OE1 2.65Å; K73-E99 PolarHBondContact NZ-OE1 2.77Å
74	K	83.3	Confident	70.8	Confident	169 Å²	169	105 Å²	105	74%	0.735	55%	0.554	S	S	*	*	H	α-helix	trans	-67.6	-20.5	175.9	-58.1	175.2	-179.7	161.8	0	112.8	D71 W72	D71-K74 VanDerWaalsContact O-CB 3.31Å; D71-K74 WeakPolarHBondContact O-CB 3.22Å; D71-K74 PolarHBondContact O-N 2.79Å; D71-K74 WeakPolarHBondContact OD1-CE 3.45Å; D71-K74 IonicContact OD1-NZ 3.87Å; D71-K74 PolarHBondContact OD1-NZ 3.35Å; W72-K74 PolarHBondContact O-N 2.85Å
75	T	84.9	Confident	73.7	Confident	96 Å²	96	103.9 Å²	103.9	59%	0.589	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-10.6	177.9	71.4	0	0	0	0	113.2	W72 K73	W72-T75 WeakPolarHBondContact O-CB 3.35Å; W72-T75 PolarHBondContact O-N 3.36Å; W72-T75 PolarHBondContact O-OG1 2.79Å; K73-T75 PolarHBondContact O-N 3.05Å
76	L	88.3	Confident	76.5	Confident	18 Å²	18	100.1 Å²	100.1	9%	0.094	52%	0.515	C	S	.	.			trans	-73.5	140.2	-177.8	-61	177.1	0	0	0	111.6	W72 K73 L78 M109 F112 E113	W72-L76 HydrophobicContact CE3-CD1 4.05Å; W72-L76 HydrophobicContact CE3-CD2 4.11Å; W72-L76 HydrophobicContact CE3-CG 4.22Å; W72-L76 HydrophobicContact CZ3-CD1 3.7Å; W72-L76 HydrophobicContact CZ3-CD2 4.14Å; W72-L76 HydrophobicContact CZ3-CG 4.29Å; K73-L76 HydrophobicContact CB-CD1 4.41Å; K73-L76 HydrophobicContact CG-CD1 4.4Å; K73-L76 WeakPolarHBondContact O-CB 3.45Å; K73-L76 PolarHBondContact O-N 3.02Å; L76-L78 HydrophobicContact CB-CD2 3.77Å; L76-L78 HydrophobicContact CB-CG 4.08Å; L76-L78 HydrophobicContact CD1-CD2 3.98Å; L76-L78 PolarHBondContact O-N 3.47Å; L76-M109 HydrophobicContact CD2-CB 3.72Å; L76-M109 HydrophobicContact CD2-CE 4.17Å; L76-M109 HydrophobicContact CD2-CG 3.82Å; L76-F112 HydrophobicContact CD1-CB 3.75Å; L76-F112 HydrophobicContact CD1-CD2 4.23Å; L76-F112 HydrophobicContact CD1-CG 4.38Å; L76-E113 HydrophobicContact CB-CG 4.39Å; L76-E113 HydrophobicContact CD2-CG 4.22Å
77	K	87.9	Confident	79.3	Confident	171 Å²	171	94.1 Å²	94.1	74%	0.743	49%	0.485	S	S	*	.			trans	-91	80.1	170.4	-66.3	-179.9	-178	-179.1	0	109.3	E113	K77-E113 PolarHBondContact N-OE1 3.22Å
78	L	89.2	Confident	81.7	Confident	104 Å²	104	86.7 Å²	86.7	55%	0.545	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-71	138.6	-178.8	-57.4	179.6	0	0	0	111	L76 F112	L76-L78 HydrophobicContact CB-CD2 3.77Å; L76-L78 HydrophobicContact CB-CG 4.08Å; L76-L78 HydrophobicContact CD1-CD2 3.98Å; L76-L78 PolarHBondContact O-N 3.47Å; L78-F112 HydrophobicContact CD2-CB 3.88Å; L78-F112 WeakPolarHBondContact CD2-O 3.14Å
79	P	89.6	Confident	84.1	Confident	53 Å²	53	81.5 Å²	81.5	34%	0.344	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-69.5	163.4	169.4	30.4	-33.5	0	0	0	110.7	K81 E113	P79-K81 PolarHBondContact O-N 3.18Å; P79-E113 WeakPolarHBondContact CD-O 3.04Å
80	P	88.1	Confident	85.8	Confident	127 Å²	127	80.3 Å²	80.3	83%	0.825	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-55.4	139.4	172.5	-23.2	33.6	0	0	0	111.4	D82	P80-D82 PolarHBondContact O-N 3.39Å
81	K	85.1	Confident	87.3	Confident	150 Å²	150	79 Å²	79	65%	0.652	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-63.8	135.5	178.3	-68.6	-166.8	173.5	-171.1	0	110.9	P79 L83 E117	P79-K81 PolarHBondContact O-N 3.18Å; K81-L83 HydrophobicContact CB-CD2 4.11Å; K81-L83 PolarHBondContact O-N 3.49Å; K81-E117 VanDerWaalsContact CE-OE1 3.26Å; K81-E117 WeakPolarHBondContact CE-OE1 3.26Å; K81-E117 IonicContact NZ-OE1 3.75Å
82	D	86.3	Confident	88.1	Confident	51 Å²	51	78.1 Å²	78.1	27%	0.273	41%	0.407	S	S	.	.			trans	-86.5	99	173.2	-170.3	-8	0	0	0	110.1	P80 R84 H430	P80-D82 PolarHBondContact O-N 3.39Å; D82-R84 VanDerWaalsContact C-N 3.3Å; D82-R84 VanDerWaalsContact OD1-CB 3.29Å; D82-R84 WeakPolarHBondContact OD1-CB 3.39Å; D82-R84 VanDerWaalsContact OD1-CG 3.28Å; D82-R84 WeakPolarHBondContact OD1-CG 3.42Å; D82-R84 IonicContact OD1-CZ 2.84Å; D82-R84 PolarHBondContact OD1-N 3.23Å; D82-R84 VanDerWaalsContact OD1-N 3.13Å; D82-R84 IonicContact OD1-NE 2.65Å; D82-R84 PolarHBondContact OD1-NE 3.2Å; D82-R84 IonicContact OD1-NH2 2.99Å; D82-R84 IonicContact OD2-CZ 3.9Å; D82-R84 IonicContact OD2-NE 3.14Å; D82-R84 PolarHBondContact OD2-NE 3.32Å; D82-R84 IonicContact OD2-NH2 2.88Å; D82-R84 PolarHBondContact OD2-NH2 2.86Å; D82-H430 IonicContact OD1-CE1 3.94Å; D82-H430 IonicContact OD2-CE1 2.84Å; D82-H430 PolarHBondContact OD2-CE1 2.92Å; D82-H430 IonicContact OD2-NE2 2.8Å; D82-H430 PolarHBondContact OD2-NE2 2.82Å
83	L	85.4	Confident	88.6	Confident	135 Å²	135	79 Å²	79	71%	0.707	42%	0.416	S	S	*	.			trans	-86.9	3.7	-178.3	-56.3	-179.7	0	0	0	113.4	K81	K81-L83 HydrophobicContact CB-CD2 4.11Å; K81-L83 PolarHBondContact O-N 3.49Å
84	R	88	Confident	89	Confident	55 Å²	55	82.5 Å²	82.5	21%	0.208	43%	0.431	C	S	.	.	S	Bend	trans	-67.4	147.8	178.1	-63.4	176	-67.9	177.1	-4.2	110	D82 K86 H430 A471	D82-R84 VanDerWaalsContact C-N 3.3Å; D82-R84 VanDerWaalsContact OD1-CB 3.29Å; D82-R84 WeakPolarHBondContact OD1-CB 3.39Å; D82-R84 VanDerWaalsContact OD1-CG 3.28Å; D82-R84 WeakPolarHBondContact OD1-CG 3.42Å; D82-R84 IonicContact OD1-CZ 2.84Å; D82-R84 PolarHBondContact OD1-N 3.23Å; D82-R84 VanDerWaalsContact OD1-N 3.13Å; D82-R84 IonicContact OD1-NE 2.65Å; D82-R84 PolarHBondContact OD1-NE 3.2Å; D82-R84 IonicContact OD1-NH2 2.99Å; D82-R84 IonicContact OD2-CZ 3.9Å; D82-R84 IonicContact OD2-NE 3.14Å; D82-R84 PolarHBondContact OD2-NE 3.32Å; D82-R84 IonicContact OD2-NH2 2.88Å; D82-R84 PolarHBondContact OD2-NH2 2.86Å; R84-K86 PolarHBondContact O-N 2.96Å; R84-H430 WeakPolarHBondContact CB-ND1 3.32Å; R84-H430 VanDerWaalsContact CZ-CD2 3.45Å; R84-H430 VanDerWaalsContact CZ-NE2 3.26Å; R84-H430 PolarHBondContact NE-CE1 3.49Å; R84-H430 VanDerWaalsContact NE-CE1 3.32Å; R84-H430 PolarHBondContact NH2-CD2 3.33Å; R84-H430 PolarHBondContact NH2-NE2 3.4Å; R84-A471 HydrophobicContact CG-CB 4.32Å
85	I	88.2	Confident	89.4	Confident	88 Å²	88	76.6 Å²	76.6	45%	0.451	42%	0.418	S	S	.	.			trans	-52	140.8	171.2	-163	171	0	0	0	111.4	H430 L431 H474	I85-H430 PolarHBondContact O-ND1 2.78Å; I85-L431 HydrophobicContact CG2-CD1 3.73Å; I85-L431 HydrophobicContact CG2-CD2 4.35Å; I85-L431 HydrophobicContact CG2-CG 3.71Å; I85-H474 HydrophobicContact CB-CB 4.41Å; I85-H474 HydrophobicContact CG2-CB 3.91Å
86	K	91.4	Very high	89.8	Confident	64 Å²	64	74.7 Å²	74.7	28%	0.278	40%	0.404	S	S	.	.			trans	-126.6	128.2	177.8	-67.4	173.6	-172	165.4	0	109.3	R84 V90 T91 G429	R84-K86 PolarHBondContact O-N 2.96Å; K86-V90 HydrophobicContact CB-CG2 3.87Å; K86-V90 HydrophobicContact CG-CG2 4.4Å; K86-T91 HydrophobicContact CB-CG2 3.63Å; K86-G429 CarbonylContact C-O 3.48Å; K86-G429 WeakPolarHBondContact CA-O 3.45Å
87	T	92.6	Very high	90.1	Very high	22 Å²	22	76.5 Å²	76.5	14%	0.135	41%	0.412	C	S	.	.			trans	-71.7	165.1	178.5	68.3	0	0	0	0	112.6	D89 V90 T91 K307 G429 L431	T87-D89 PolarHBondContact O-N 3.04Å; T87-D89 PolarHBondContact OG1-N 3.02Å; T87-D89 PolarHBondContact OG1-OD2 3.27Å; T87-V90 PolarHBondContact O-N 3.05Å; T87-T91 PolarHBondContact O-N 3.15Å; T87-T91 PolarHBondContact O-OG1 3.26Å; T87-T91 VanDerWaalsContact O-OG1 3.13Å; T87-K307 HydrophobicContact CG2-CB 4.28Å; T87-G429 VanDerWaalsContact CG2-O 3.31Å; T87-G429 WeakPolarHBondContact CG2-O 3.43Å; T87-G429 PolarHBondContact N-O 3.2Å; T87-L431 HydrophobicContact CG2-CD2 4.01Å
88	S	92.5	Very high	90.5	Very high	45 Å²	45	68.3 Å²	68.3	32%	0.315	38%	0.377	S	S	.	.	H	α-helix	trans	-56.7	-18.6	175	73.2	0	0	0	0	113.9	V90 T91 S92 K307	S88-V90 PolarHBondContact O-N 3.35Å; S88-V90 VanDerWaalsContact O-N 3.16Å; S88-T91 WeakPolarHBondContact CA-OG1 3.4Å; S88-S92 WeakPolarHBondContact O-CB 3.37Å; S88-S92 PolarHBondContact O-N 3.05Å; S88-S92 VanDerWaalsContact O-N 3.15Å; S88-K307 WeakPolarHBondContact OG-CD 3.45Å; S88-K307 PolarHBondContact OG-NZ 2.96Å
89	D	90.9	Very high	90.7	Very high	21 Å²	21	66 Å²	66	11%	0.112	36%	0.363	C	S	.	.	H	α-helix	trans	-60.7	-20.9	175.8	-64.3	-44.6	0	0	0	112.5	T87 K141 T144 K307	T87-D89 PolarHBondContact O-N 3.04Å; T87-D89 PolarHBondContact OG1-N 3.02Å; T87-D89 PolarHBondContact OG1-OD2 3.27Å; D89-K141 WeakPolarHBondContact OD1-CD 3.4Å; D89-K141 WeakPolarHBondContact OD1-CE 3.38Å; D89-K141 IonicContact OD1-NZ 3.97Å; D89-K141 PolarHBondContact OD1-NZ 3.49Å; D89-K141 IonicContact OD2-NZ 3.91Å; D89-T144 HydrophobicContact CB-CG2 4.3Å; D89-K307 WeakPolarHBondContact OD2-CB 3.21Å; D89-K307 PolarHBondContact OD2-N 3.28Å
90	V	91.4	Very high	90.9	Very high	10 Å²	10	68.3 Å²	68.3	6%	0.061	37%	0.372	C	S	.	.	H	α-helix	trans	-127.9	-7.1	176.9	-57.7	0	0	0	0	114.5	K86 T87 S88 P121 T144 F428	K86-V90 HydrophobicContact CB-CG2 3.87Å; K86-V90 HydrophobicContact CG-CG2 4.4Å; T87-V90 PolarHBondContact O-N 3.05Å; S88-V90 PolarHBondContact O-N 3.35Å; S88-V90 VanDerWaalsContact O-N 3.16Å; V90-P121 VanDerWaalsContact C-CD 3.5Å; V90-P121 WeakPolarHBondContact O-CD 3.34Å; V90-T144 HydrophobicContact CG1-CG2 4.45Å; V90-F428 HydrophobicContact CG1-CD2 4.3Å; V90-F428 HydrophobicContact CG1-CG 4.48Å; V90-F428 WeakPolarHBondContact CG2-O 3.43Å
91	T	92.2	Very high	91.3	Very high	72 Å²	72	63.3 Å²	63.3	44%	0.442	34%	0.337	S	S	.	.	H	α-helix	trans	-111	-13.5	-178.9	60.1	0	0	0	0	114.6	K86 T87 S88 T93	K86-T91 HydrophobicContact CB-CG2 3.63Å; T87-T91 PolarHBondContact O-N 3.15Å; T87-T91 PolarHBondContact O-OG1 3.26Å; T87-T91 VanDerWaalsContact O-OG1 3.13Å; S88-T91 WeakPolarHBondContact CA-OG1 3.4Å; T91-T93 PolarHBondContact O-N 2.73Å
92	S	90.9	Very high	91.7	Very high	87 Å²	87	61.7 Å²	61.7	61%	0.608	34%	0.343	S	S	*	.			trans	-77.2	66.1	179.9	-174.7	0	0	0	0	111.9	S88 P121	S88-S92 WeakPolarHBondContact O-CB 3.37Å; S88-S92 PolarHBondContact O-N 3.05Å; S88-S92 VanDerWaalsContact O-N 3.15Å; S92-P121 WeakPolarHBondContact O-CG 3.31Å
93	T	91.4	Very high	92.1	Very high	47 Å²	47	59.9 Å²	59.9	29%	0.288	33%	0.334	S	S	.	.			trans	-103.4	165.5	-177.4	65.3	0	0	0	0	111.4	T91 G95 P119 P121 E124	T91-T93 PolarHBondContact O-N 2.73Å; T93-G95 PolarHBondContact O-N 2.81Å; T93-G95 PolarHBondContact OG1-N 2.82Å; T93-P119 WeakPolarHBondContact CG2-O 3.03Å; T93-P121 HydrophobicContact CG2-CG 3.9Å; T93-E124 WeakPolarHBondContact CA-OE2 3.29Å; T93-E124 WeakPolarHBondContact CB-OE2 3.49Å
94	K	92	Very high	92.6	Very high	147 Å²	147	57 Å²	57	64%	0.639	32%	0.316	S	S	*	.			trans	-76.3	-6.4	171.1	-62.5	168.5	176.7	164.3	0	112.2	E124 E125	K94-E124 WeakPolarHBondContact CA-OE1 3.12Å; K94-E124 WeakPolarHBondContact CB-OE1 3.26Å; K94-E124 PolarHBondContact N-OE1 3.44Å; K94-E124 PolarHBondContact N-OE2 3.48Å; K94-E125 WeakPolarHBondContact CE-OE1 3.23Å; K94-E125 VanDerWaalsContact NZ-CD 3.27Å; K94-E125 IonicContact NZ-OE1 3.88Å; K94-E125 PolarHBondContact NZ-OE1 3.31Å; K94-E125 IonicContact NZ-OE2 2.73Å; K94-E125 PolarHBondContact NZ-OE2 3.08Å; K94-E125 VanDerWaalsContact NZ-OE2 3.14Å
95	G	90.7	Very high	92.9	Very high	46 Å²	46	59.6 Å²	59.6	47%	0.474	33%	0.325	S	S	.	.			trans	93.3	16.3	177.4	0	0	0	0	0	114	T93 E124	T93-G95 PolarHBondContact O-N 2.81Å; T93-G95 PolarHBondContact OG1-N 2.82Å; G95-E124 PolarHBondContact N-OE1 3.23Å; G95-E124 VanDerWaalsContact N-OE1 3.16Å
96	N	93.5	Very high	93.2	Very high	55 Å²	55	59.4 Å²	59.4	29%	0.294	32%	0.323	S	S	.	.			trans	-71.1	146.9	175.9	-61.6	-17.3	0	0	0	111	Y101 P119 E124	N96-Y101 HydrophobicContact CB-CE1 4.37Å; N96-Y101 WeakPolarHBondContact CB-OH 3.21Å; N96-P119 VanDerWaalsContact O-CD 3.25Å; N96-P119 WeakPolarHBondContact O-CD 3.26Å; N96-P119 WeakPolarHBondContact O-CG 3.49Å; N96-E124 HydrophobicContact CB-CG 4.07Å; N96-E124 WeakPolarHBondContact CB-OE1 3.19Å; N96-E124 PolarHBondContact N-OE1 2.84Å; N96-E124 WeakPolarHBondContact ND2-CG 3.34Å
97	E	94.5	Very high	93.5	Very high	56 Å²	56	56.4 Å²	56.4	26%	0.262	31%	0.31	S	S	.	.			trans	-101.7	163.8	171.3	-56.5	-62.6	161.6	0	0	110.3	E99 D100 K118	E97-E99 PolarHBondContact O-N 3.3Å; E97-D100 PolarHBondContact N-OD2 3.2Å; E97-D100 WeakPolarHBondContact O-CB 3.27Å; E97-D100 PolarHBondContact O-N 2.74Å; E97-K118 WeakPolarHBondContact OE1-CE 3.31Å; E97-K118 IonicContact OE1-NZ 3.01Å; E97-K118 PolarHBondContact OE1-NZ 2.92Å; E97-K118 WeakPolarHBondContact OE2-CG 3.41Å; E97-K118 IonicContact OE2-NZ 2.81Å
98	F	96.2	Very high	93.7	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-64.6	-29.6	178.5	-76.2	-67.4	0	0	0	112.7	D100 Y101 L108 I111 W116 P119 I127 I152	F98-D100 PolarHBondContact O-N 3.17Å; F98-Y101 HydrophobicContact CD1-CD2 4.18Å; F98-Y101 HydrophobicContact CD1-CE2 4.01Å; F98-Y101 WeakPolarHBondContact O-CD2 3.34Å; F98-Y101 PolarHBondContact O-N 2.78Å; F98-L108 HydrophobicContact CB-CD2 3.97Å; F98-I111 HydrophobicContact CD1-CG2 4.34Å; F98-I111 HydrophobicContact CD2-CG2 3.68Å; F98-I111 HydrophobicContact CE1-CG2 4.48Å; F98-I111 HydrophobicContact CE2-CG2 3.83Å; F98-I111 HydrophobicContact CG-CG2 3.95Å; F98-I111 HydrophobicContact CZ-CG2 4.23Å; F98-W116 HydrophobicContact CE2-CB 3.87Å; F98-W116 WeakPolarHBondContact CE2-O 3.33Å; F98-W116 HydrophobicContact CZ-CB 4.22Å; F98-P119 HydrophobicContact CD1-CB 4.29Å; F98-P119 HydrophobicContact CE1-CB 3.79Å; F98-P119 VanDerWaalsContact CZ-CA 3.49Å; F98-P119 HydrophobicContact CZ-CB 3.95Å; F98-I127 HydrophobicContact CD1-CD1 4.41Å; F98-I127 HydrophobicContact CE1-CD1 3.99Å; F98-I152 HydrophobicContact CD1-CD1 4.1Å; F98-I152 HydrophobicContact CE1-CD1 3.53Å; F98-I152 HydrophobicContact CZ-CD1 4.28Å
99	E	93.6	Very high	93.9	Very high	56 Å²	56	55.3 Å²	55.3	26%	0.262	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-65.8	-25	176.6	-66	94	148.5	0	0	113.2	K73 E97 Y101 C102 L108 F112	K73-E99 WeakPolarHBondContact CE-OE1 3.42Å; K73-E99 IonicContact NZ-OE1 2.65Å; K73-E99 PolarHBondContact NZ-OE1 2.77Å; E97-E99 PolarHBondContact O-N 3.3Å; E99-Y101 PolarHBondContact O-N 2.84Å; E99-C102 PolarHBondContact O-N 3.49Å; E99-L108 HydrophobicContact CG-CD1 4.25Å; E99-L108 HydrophobicContact CG-CD2 4.4Å; E99-F112 WeakPolarHBondContact OE1-CE2 3.41Å; E99-F112 WeakPolarHBondContact OE1-CZ 3.46Å
100	D	94.5	Very high	94.1	Very high	100 Å²	100	54.3 Å²	54.3	54%	0.535	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-68.1	-16.5	179.1	-62.5	-34	0	0	0	112.2	E97 F98 C102	E97-D100 PolarHBondContact N-OD2 3.2Å; E97-D100 WeakPolarHBondContact O-CB 3.27Å; E97-D100 PolarHBondContact O-N 2.74Å; F98-D100 PolarHBondContact O-N 3.17Å; D100-C102 VanDerWaalsContact C-N 3.29Å; D100-C102 PolarHBondContact O-N 2.81Å
101	Y	95.3	Very high	94.4	Very high	22 Å²	22	53.9 Å²	53.9	9%	0.086	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-85.5	4.6	178.2	-52.1	-42.9	0	0	0	114.1	N96 F98 E99 L103 P119 E124 I127 P128	N96-Y101 HydrophobicContact CB-CE1 4.37Å; N96-Y101 WeakPolarHBondContact CB-OH 3.21Å; F98-Y101 HydrophobicContact CD1-CD2 4.18Å; F98-Y101 HydrophobicContact CD1-CE2 4.01Å; F98-Y101 WeakPolarHBondContact O-CD2 3.34Å; F98-Y101 PolarHBondContact O-N 2.78Å; E99-Y101 PolarHBondContact O-N 2.84Å; Y101-L103 PolarHBondContact O-N 3.05Å; Y101-P119 HydrophobicContact CE2-CB 4.19Å; Y101-P119 HydrophobicContact CE2-CG 4.1Å; Y101-P119 WeakPolarHBondContact OH-CG 3.27Å; Y101-E124 WeakPolarHBondContact OH-CA 3.4Å; Y101-I127 HydrophobicContact CD1-CG2 4.5Å; Y101-I127 HydrophobicContact CD2-CB 4.42Å; Y101-I127 HydrophobicContact CD2-CD1 4.41Å; Y101-I127 HydrophobicContact CD2-CG2 3.8Å; Y101-I127 HydrophobicContact CE2-CB 4.45Å; Y101-I127 HydrophobicContact CE2-CD1 4.16Å; Y101-I127 HydrophobicContact CE2-CG2 4.32Å; Y101-I127 HydrophobicContact CG-CG2 3.92Å; Y101-P128 HydrophobicContact CD1-CG 3.75Å; Y101-P128 HydrophobicContact CE1-CG 3.58Å
102	C	93.5	Very high	94.5	Very high	116 Å²	116	51.5 Å²	51.5	78%	0.784	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.2	36.8	178.3	-64.3	0	0	0	0	113.8	E99 D100	E99-C102 PolarHBondContact O-N 3.49Å; D100-C102 VanDerWaalsContact C-N 3.29Å; D100-C102 PolarHBondContact O-N 2.81Å
103	L	96.6	Very high	94.7	Very high	14 Å²	14	48.8 Å²	48.8	7%	0.073	25%	0.252	C	S	.	.			trans	-70.4	154.8	-179.3	-58.6	173.6	0	0	0	111.9	Y101 R105 L107 L108 I111 L131 I152 E156	Y101-L103 PolarHBondContact O-N 3.05Å; L103-R105 PolarHBondContact O-N 3.2Å; L103-L107 HydrophobicContact CB-CD2 4.49Å; L103-L107 HydrophobicContact CD2-CD2 4.34Å; L103-L108 HydrophobicContact CB-CD1 4.46Å; L103-L108 HydrophobicContact CB-CD2 4.07Å; L103-L108 HydrophobicContact CB-CG 3.96Å; L103-L108 HydrophobicContact CD1-CD2 3.95Å; L103-I111 HydrophobicContact CD1-CD1 3.75Å; L103-L131 HydrophobicContact CD2-CD1 3.92Å; L103-L131 HydrophobicContact CD2-CD2 4.37Å; L103-I152 HydrophobicContact CD1-CG2 3.61Å; L103-I152 HydrophobicContact CD2-CG2 3.99Å; L103-I152 HydrophobicContact CG-CG2 4.48Å; L103-E156 HydrophobicContact CD2-CB 4.15Å; L103-E156 HydrophobicContact CD2-CG 3.94Å
104	K	95.3	Very high	94.8	Very high	75 Å²	75	49.4 Å²	49.4	33%	0.326	25%	0.252	S	S	.	.			trans	-52.8	140.3	170.1	-75.2	159.4	-173.3	168.3	0	110.5	E106 L107 L108 E156 L158	K104-E106 PolarHBondContact O-N 2.88Å; K104-L107 HydrophobicContact CB-CB 4.26Å; K104-L107 WeakPolarHBondContact O-CB 3.31Å; K104-L107 PolarHBondContact O-N 2.8Å; K104-L108 PolarHBondContact O-N 3.47Å; K104-E156 WeakPolarHBondContact CB-OE2 3.16Å; K104-E156 WeakPolarHBondContact CD-OE1 3.49Å; K104-E156 WeakPolarHBondContact CE-OE1 3.21Å; K104-E156 VanDerWaalsContact CG-OE1 3.31Å; K104-E156 WeakPolarHBondContact CG-OE1 3.41Å; K104-E156 WeakPolarHBondContact CG-OE2 3.36Å; K104-E156 PolarHBondContact N-OE2 3.46Å; K104-E156 PolarHBondContact NZ-O 3.09Å; K104-E156 IonicContact NZ-OE1 2.68Å; K104-L158 PolarHBondContact NZ-O 3.45Å; K104-L158 VanDerWaalsContact NZ-O 3.09Å
105	R	94.5	Very high	94.8	Very high	108 Å²	108	44 Å²	44	41%	0.408	24%	0.239	S	C	.	.	H	α-helix	trans	-55.6	-44.8	-179	-176.5	65.1	61.6	108.6	-0	111.1	G69 W72 L103 L107 L108 M109	G69-R105 PolarHBondContact O-NH1 2.72Å; W72-R105 VanDerWaalsContact CE2-CD 3.48Å; W72-R105 VanDerWaalsContact CG-NH1 3.29Å; L103-R105 PolarHBondContact O-N 3.2Å; R105-L107 VanDerWaalsContact C-N 3.26Å; R105-L107 PolarHBondContact O-N 2.86Å; R105-L108 WeakPolarHBondContact O-CB 3.43Å; R105-L108 PolarHBondContact O-N 3.16Å; R105-M109 HydrophobicContact CG-SD 4.46Å; R105-M109 VanDerWaalsContact O-CG 3.26Å; R105-M109 WeakPolarHBondContact O-CG 3.29Å; R105-M109 PolarHBondContact O-N 3.02Å
106	E	94.9	Very high	94.9	Very high	85 Å²	85	44 Å²	44	40%	0.397	23%	0.225	S	C	.	.	H	α-helix	trans	-62	-34.9	-179.7	-60.5	75.8	-165.5	0	0	111.7	K104 G110 H190 M191	K104-E106 PolarHBondContact O-N 2.88Å; E106-G110 PolarHBondContact O-N 3.29Å; E106-H190 HydrophobicContact CB-CB 4.25Å; E106-H190 WeakPolarHBondContact O-CB 3.14Å; E106-M191 HydrophobicContact CB-CG 4.22Å
107	L	96.9	Very high	94.7	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-71.8	-44.1	175.8	-177.8	58.2	0	0	0	111	L103 K104 R105 M109 G110 I111 I152 L155 E156 V187 M191	L103-L107 HydrophobicContact CB-CD2 4.49Å; L103-L107 HydrophobicContact CD2-CD2 4.34Å; K104-L107 HydrophobicContact CB-CB 4.26Å; K104-L107 WeakPolarHBondContact O-CB 3.31Å; K104-L107 PolarHBondContact O-N 2.8Å; R105-L107 VanDerWaalsContact C-N 3.26Å; R105-L107 PolarHBondContact O-N 2.86Å; L107-M109 VanDerWaalsContact C-N 3.27Å; L107-M109 PolarHBondContact O-N 3.29Å; L107-G110 PolarHBondContact O-N 3.35Å; L107-G110 VanDerWaalsContact O-N 3.09Å; L107-I111 HydrophobicContact CG-CD1 4.07Å; L107-I111 WeakPolarHBondContact O-CG1 3.45Å; L107-I111 PolarHBondContact O-N 3.03Å; L107-I152 HydrophobicContact CD2-CG2 4.27Å; L107-L155 HydrophobicContact CD1-CB 3.93Å; L107-L155 HydrophobicContact CD1-CD1 3.97Å; L107-L155 HydrophobicContact CD2-CB 4.35Å; L107-E156 HydrophobicContact CD2-CB 3.77Å; L107-V187 HydrophobicContact CD1-CG1 3.59Å; L107-M191 HydrophobicContact CD1-SD 4.27Å
108	L	96.6	Very high	94.6	Very high	10 Å²	10	48.4 Å²	48.4	5%	0.052	24%	0.242	C	C	.	.	H	α-helix	trans	-58.4	-39	174.9	-69.4	168.4	0	0	0	112.1	W72 F98 E99 L103 K104 R105 G110 I111 F112	W72-L108 HydrophobicContact CH2-CB 3.69Å; W72-L108 HydrophobicContact CZ2-CB 4.47Å; W72-L108 HydrophobicContact CZ3-CB 4.34Å; F98-L108 HydrophobicContact CB-CD2 3.97Å; E99-L108 HydrophobicContact CG-CD1 4.25Å; E99-L108 HydrophobicContact CG-CD2 4.4Å; L103-L108 HydrophobicContact CB-CD1 4.46Å; L103-L108 HydrophobicContact CB-CD2 4.07Å; L103-L108 HydrophobicContact CB-CG 3.96Å; L103-L108 HydrophobicContact CD1-CD2 3.95Å; K104-L108 PolarHBondContact O-N 3.47Å; R105-L108 WeakPolarHBondContact O-CB 3.43Å; R105-L108 PolarHBondContact O-N 3.16Å; L108-G110 VanDerWaalsContact C-N 3.34Å; L108-G110 PolarHBondContact O-N 3.47Å; L108-I111 PolarHBondContact O-N 2.61Å; L108-F112 HydrophobicContact CB-CE2 4.41Å; L108-F112 WeakPolarHBondContact O-CD2 3.49Å; L108-F112 PolarHBondContact O-N 3.14Å
109	M	95.7	Very high	94.7	Very high	35 Å²	35	48.6 Å²	48.6	17%	0.172	24%	0.242	C	C	.	.	H	α-helix	trans	-56.5	-47.1	173.1	-65.6	172.1	72.5	0	0	112	W72 L76 R105 L107 E113 H190	W72-M109 HydrophobicContact CE3-CG 3.39Å; W72-M109 HydrophobicContact CE3-SD 4.43Å; W72-M109 HydrophobicContact CZ3-CB 4.16Å; W72-M109 HydrophobicContact CZ3-CG 3.41Å; W72-M109 VanDerWaalsContact CZ3-CG 3.41Å; L76-M109 HydrophobicContact CD2-CB 3.72Å; L76-M109 HydrophobicContact CD2-CE 4.17Å; L76-M109 HydrophobicContact CD2-CG 3.82Å; R105-M109 HydrophobicContact CG-SD 4.46Å; R105-M109 VanDerWaalsContact O-CG 3.26Å; R105-M109 WeakPolarHBondContact O-CG 3.29Å; R105-M109 PolarHBondContact O-N 3.02Å; L107-M109 VanDerWaalsContact C-N 3.27Å; L107-M109 PolarHBondContact O-N 3.29Å; M109-E113 WeakPolarHBondContact O-CG 3.21Å; M109-E113 PolarHBondContact O-N 2.84Å; M109-H190 HydrophobicContact CB-CB 4.07Å; M109-H190 HydrophobicContact SD-CB 4.36Å
110	G	96.6	Very high	94.8	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-67.6	-37.8	178	0	0	0	0	0	113.6	E106 L107 L108 M114 V187	E106-G110 PolarHBondContact O-N 3.29Å; L107-G110 PolarHBondContact O-N 3.35Å; L107-G110 VanDerWaalsContact O-N 3.09Å; L108-G110 VanDerWaalsContact C-N 3.34Å; L108-G110 PolarHBondContact O-N 3.47Å; G110-M114 VanDerWaalsContact O-CG 3.3Å; G110-M114 WeakPolarHBondContact O-CG 3.35Å; G110-M114 PolarHBondContact O-N 2.93Å; G110-M114 VanDerWaalsContact O-N 3.08Å; G110-V187 WeakPolarHBondContact CA-O 3.5Å
111	I	96.7	Very high	94.8	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-59.4	-49.1	175	-69.9	168.5	0	0	0	110.6	F98 L103 L107 L108 M114 W116 I152 V187	F98-I111 HydrophobicContact CD1-CG2 4.34Å; F98-I111 HydrophobicContact CD2-CG2 3.68Å; F98-I111 HydrophobicContact CE1-CG2 4.48Å; F98-I111 HydrophobicContact CE2-CG2 3.83Å; F98-I111 HydrophobicContact CG-CG2 3.95Å; F98-I111 HydrophobicContact CZ-CG2 4.23Å; L103-I111 HydrophobicContact CD1-CD1 3.75Å; L107-I111 HydrophobicContact CG-CD1 4.07Å; L107-I111 WeakPolarHBondContact O-CG1 3.45Å; L107-I111 PolarHBondContact O-N 3.03Å; L108-I111 PolarHBondContact O-N 2.61Å; I111-M114 WeakPolarHBondContact O-CB 3.37Å; I111-M114 PolarHBondContact O-N 3.23Å; I111-W116 HydrophobicContact CG2-CB 3.89Å; I111-W116 HydrophobicContact CG2-CE3 4.25Å; I111-W116 PolarHBondContact O-N 2.92Å; I111-I152 HydrophobicContact CD1-CD1 3.87Å; I111-I152 HydrophobicContact CD1-CG1 3.9Å; I111-I152 HydrophobicContact CD1-CG2 4.1Å; I111-I152 HydrophobicContact CG1-CD1 4.22Å; I111-I152 HydrophobicContact CG1-CG1 4.21Å; I111-V187 HydrophobicContact CG1-CG1 4.08Å
112	F	95.4	Very high	94.9	Very high	22 Å²	22	40.7 Å²	40.7	10%	0.096	20%	0.204	C	C	.	.	H	α-helix	trans	-71.8	-35.3	-179.3	-70.7	-50.4	0	0	0	113.5	W72 L76 L78 E99 L108 M114 G115 W116	W72-F112 AromaticContact CH2-CD2 3.67Å; W72-F112 HydrophobicContact CH2-CD2 3.67Å; W72-F112 AromaticContact CH2-CE2 3.77Å; W72-F112 HydrophobicContact CH2-CE2 3.77Å; W72-F112 HydrophobicContact CZ2-CE2 4.44Å; W72-F112 HydrophobicContact CZ3-CD2 4.15Å; L76-F112 HydrophobicContact CD1-CB 3.75Å; L76-F112 HydrophobicContact CD1-CD2 4.23Å; L76-F112 HydrophobicContact CD1-CG 4.38Å; L78-F112 HydrophobicContact CD2-CB 3.88Å; L78-F112 WeakPolarHBondContact CD2-O 3.14Å; E99-F112 WeakPolarHBondContact OE1-CE2 3.41Å; E99-F112 WeakPolarHBondContact OE1-CZ 3.46Å; L108-F112 HydrophobicContact CB-CE2 4.41Å; L108-F112 WeakPolarHBondContact O-CD2 3.49Å; L108-F112 PolarHBondContact O-N 3.14Å; F112-M114 PolarHBondContact O-N 2.88Å; F112-G115 WeakPolarHBondContact O-CA 3.28Å; F112-G115 PolarHBondContact O-N 3.3Å; F112-W116 WeakPolarHBondContact CD1-O 3.3Å
113	E	95	Very high	95.1	Very high	31 Å²	31	35.4 Å²	35.4	15%	0.145	17%	0.168	C	C	.	.	H	α-helix	trans	-67.1	-21.4	172.3	-74.1	-165.4	167	0	0	113.1	L76 K77 P79 M109 G115 K189 H190	L76-E113 HydrophobicContact CB-CG 4.39Å; L76-E113 HydrophobicContact CD2-CG 4.22Å; K77-E113 PolarHBondContact N-OE1 3.22Å; P79-E113 WeakPolarHBondContact CD-O 3.04Å; M109-E113 WeakPolarHBondContact O-CG 3.21Å; M109-E113 PolarHBondContact O-N 2.84Å; E113-G115 PolarHBondContact O-N 3.17Å; E113-K189 IonicContact OE2-NZ 3.06Å; E113-K189 PolarHBondContact OE2-NZ 3.42Å; E113-H190 IonicContact OE1-CE1 3.14Å; E113-H190 IonicContact OE1-NE2 2.92Å; E113-H190 PolarHBondContact OE1-NE2 3.49Å; E113-H190 IonicContact OE2-CD2 2.67Å; E113-H190 IonicContact OE2-CE1 2.61Å; E113-H190 IonicContact OE2-NE2 2.78Å; E113-H190 PolarHBondContact OE2-NE2 2.99Å
114	M	92.5	Very high	95.1	Very high	59 Å²	59	35 Å²	35	29%	0.291	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-10.5	167.5	-71.5	-86.7	85.6	0	0	113.2	G110 I111 F112 W116 Q186 V187	G110-M114 VanDerWaalsContact O-CG 3.3Å; G110-M114 WeakPolarHBondContact O-CG 3.35Å; G110-M114 PolarHBondContact O-N 2.93Å; G110-M114 VanDerWaalsContact O-N 3.08Å; I111-M114 WeakPolarHBondContact O-CB 3.37Å; I111-M114 PolarHBondContact O-N 3.23Å; F112-M114 PolarHBondContact O-N 2.88Å; M114-W116 HydrophobicContact CB-CD2 4.12Å; M114-W116 HydrophobicContact CB-CG 4.21Å; M114-Q186 HydrophobicContact CE-CB 3.21Å; M114-Q186 HydrophobicContact CE-CG 3.7Å; M114-Q186 HydrophobicContact CG-CB 4.41Å; M114-Q186 HydrophobicContact SD-CB 3.47Å; M114-Q186 WeakPolarHBondContact SD-CB 3.29Å; M114-Q186 HydrophobicContact SD-CG 4.34Å; M114-V187 HydrophobicContact CG-CG2 3.72Å; M114-V187 HydrophobicContact SD-CG2 4.18Å
115	G	91.6	Very high	95.2	Very high	35 Å²	35	33.1 Å²	33.1	36%	0.361	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.1	16.7	-174.7	0	0	0	0	0	113.8	F112 E113 E117	F112-G115 WeakPolarHBondContact O-CA 3.28Å; F112-G115 PolarHBondContact O-N 3.3Å; E113-G115 PolarHBondContact O-N 3.17Å; G115-E117 PolarHBondContact O-N 3.01Å
116	W	93.5	Very high	95.3	Very high	46 Å²	46	28 Å²	28	17%	0.174	14%	0.139	C	C	.	.			trans	-84.4	92	175.5	-60.6	-11	0	0	0	109.2	F98 I111 F112 M114 I152 I183 V187	F98-W116 HydrophobicContact CE2-CB 3.87Å; F98-W116 WeakPolarHBondContact CE2-O 3.33Å; F98-W116 HydrophobicContact CZ-CB 4.22Å; I111-W116 HydrophobicContact CG2-CB 3.89Å; I111-W116 HydrophobicContact CG2-CE3 4.25Å; I111-W116 PolarHBondContact O-N 2.92Å; F112-W116 WeakPolarHBondContact CD1-O 3.3Å; M114-W116 HydrophobicContact CB-CD2 4.12Å; M114-W116 HydrophobicContact CB-CG 4.21Å; W116-I152 HydrophobicContact CE3-CD1 4.21Å; W116-I152 HydrophobicContact CZ3-CD1 4.14Å; W116-I152 HydrophobicContact CZ3-CG1 4.29Å; W116-I183 HydrophobicContact CH2-CG2 3.6Å; W116-I183 HydrophobicContact CZ2-CG2 3.8Å; W116-V187 HydrophobicContact CE3-CG2 4.44Å; W116-V187 HydrophobicContact CH2-CG2 3.6Å; W116-V187 HydrophobicContact CZ2-CG2 4.43Å; W116-V187 HydrophobicContact CZ3-CG2 3.6Å
117	E	89.2	Confident	95.5	Very high	85 Å²	85	24 Å²	24	40%	0.397	12%	0.12	S	C	.	.			trans	-74.3	-44.1	-178	-62.4	-177.1	146.1	0	0	112.1	K81 G115	K81-E117 VanDerWaalsContact CE-OE1 3.26Å; K81-E117 WeakPolarHBondContact CE-OE1 3.26Å; K81-E117 IonicContact NZ-OE1 3.75Å; G115-E117 PolarHBondContact O-N 3.01Å
118	K	93.4	Very high	95.5	Very high	118 Å²	118	26.4 Å²	26.4	51%	0.513	14%	0.136	S	C	.	.	S	Bend	trans	-134.6	148.4	-177.8	-56.5	-154.8	179	-156.6	0	111.7	E97	E97-K118 WeakPolarHBondContact OE1-CE 3.31Å; E97-K118 IonicContact OE1-NZ 3.01Å; E97-K118 PolarHBondContact OE1-NZ 2.92Å; E97-K118 WeakPolarHBondContact OE2-CG 3.41Å; E97-K118 IonicContact OE2-NZ 2.81Å
119	P	96.8	Very high	95.6	Very high	3 Å²	3	27.8 Å²	27.8	2%	0.019	14%	0.143	C	C	.	.			trans	-65.4	138	173.7	27.4	-33.7	0	0	0	110.8	T93 N96 F98 Y101 Q123 E124	T93-P119 WeakPolarHBondContact CG2-O 3.03Å; N96-P119 VanDerWaalsContact O-CD 3.25Å; N96-P119 WeakPolarHBondContact O-CD 3.26Å; N96-P119 WeakPolarHBondContact O-CG 3.49Å; F98-P119 HydrophobicContact CD1-CB 4.29Å; F98-P119 HydrophobicContact CE1-CB 3.79Å; F98-P119 VanDerWaalsContact CZ-CA 3.49Å; F98-P119 HydrophobicContact CZ-CB 3.95Å; Y101-P119 HydrophobicContact CE2-CB 4.19Å; Y101-P119 HydrophobicContact CE2-CG 4.1Å; Y101-P119 WeakPolarHBondContact OH-CG 3.27Å; P119-Q123 HydrophobicContact CB-CB 3.81Å; P119-E124 HydrophobicContact CB-CB 4.3Å; P119-E124 HydrophobicContact CG-CB 4.44Å
120	S	95.9	Very high	95.7	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.135	C	C	.	.			trans	-72.5	166.2	165.9	72.2	0	0	0	0	111	I122 Q123 E124 T144	S120-I122 PolarHBondContact O-N 2.88Å; S120-I122 VanDerWaalsContact O-N 3.13Å; S120-I122 WeakPolarHBondContact OG-CG2 3.45Å; S120-Q123 CarbonylContact O-C 3.6Å; S120-Q123 WeakPolarHBondContact O-CA 3.42Å; S120-Q123 WeakPolarHBondContact O-CB 3.47Å; S120-Q123 PolarHBondContact O-N 2.99Å; S120-Q123 WeakPolarHBondContact OG-CG 3.34Å; S120-E124 PolarHBondContact O-N 3.35Å; S120-T144 VanDerWaalsContact CB-O 3.29Å; S120-T144 WeakPolarHBondContact CB-O 3.27Å; S120-T144 PolarHBondContact OG-O 3.16Å
121	P	96	Very high	95.7	Very high	11 Å²	11	28.3 Å²	28.3	7%	0.071	15%	0.146	C	C	.	.	H	α-helix	trans	-55.5	-37.4	-178.5	-28	36	0	0	0	113.3	V90 S92 T93 Q123 E124 E125 L300	V90-P121 VanDerWaalsContact C-CD 3.5Å; V90-P121 WeakPolarHBondContact O-CD 3.34Å; S92-P121 WeakPolarHBondContact O-CG 3.31Å; T93-P121 HydrophobicContact CG2-CG 3.9Å; P121-Q123 VanDerWaalsContact C-N 3.34Å; P121-Q123 PolarHBondContact O-N 2.93Å; P121-E124 PolarHBondContact O-N 3.29Å; P121-E125 WeakPolarHBondContact O-CG 3.4Å; P121-E125 PolarHBondContact O-N 3.31Å; P121-L300 HydrophobicContact CB-CD1 4.09Å
122	I	96.2	Very high	95.7	Very high	2 Å²	2	32.4 Å²	32.4	1%	0.01	18%	0.175	C	C	.	.	H	α-helix	trans	-68.6	-34.6	175.6	-173.8	55.9	0	0	0	112.2	S120 S126 A138 A140 T144 K146 A149 Y276 I298 L300	S120-I122 PolarHBondContact O-N 2.88Å; S120-I122 VanDerWaalsContact O-N 3.13Å; S120-I122 WeakPolarHBondContact OG-CG2 3.45Å; I122-S126 WeakPolarHBondContact O-CB 3.25Å; I122-S126 PolarHBondContact O-N 3.14Å; I122-S126 PolarHBondContact O-OG 2.64Å; I122-A138 HydrophobicContact CD1-CB 3.86Å; I122-A140 HydrophobicContact CB-CB 4.11Å; I122-A140 HydrophobicContact CD1-CB 4.03Å; I122-A140 HydrophobicContact CG1-CB 3.86Å; I122-T144 WeakPolarHBondContact CG2-O 3.47Å; I122-K146 HydrophobicContact CG1-CG 4.47Å; I122-A149 HydrophobicContact CG1-CB 4.27Å; I122-Y276 HydrophobicContact CD1-CE1 4.22Å; I122-Y276 HydrophobicContact CG1-CE1 4.18Å; I122-I298 HydrophobicContact CD1-CG2 3.9Å; I122-L300 HydrophobicContact CB-CD1 3.67Å; I122-L300 HydrophobicContact CD1-CD1 3.89Å; I122-L300 HydrophobicContact CG1-CD1 4.36Å; I122-L300 VanDerWaalsContact N-CD1 3.35Å
123	Q	97.8	Very high	95.7	Very high	4 Å²	4	32.7 Å²	32.7	2%	0.019	18%	0.184	C	C	.	.	H	α-helix	trans	-70.8	-44.4	175.4	-66.8	170.7	-10.8	0	0	110.4	P119 S120 P121 E125 S126 I127 G145 A149	P119-Q123 HydrophobicContact CB-CB 3.81Å; S120-Q123 CarbonylContact O-C 3.6Å; S120-Q123 WeakPolarHBondContact O-CA 3.42Å; S120-Q123 WeakPolarHBondContact O-CB 3.47Å; S120-Q123 PolarHBondContact O-N 2.99Å; S120-Q123 WeakPolarHBondContact OG-CG 3.34Å; P121-Q123 VanDerWaalsContact C-N 3.34Å; P121-Q123 PolarHBondContact O-N 2.93Å; Q123-E125 PolarHBondContact O-N 3.2Å; Q123-S126 PolarHBondContact O-N 3.29Å; Q123-I127 HydrophobicContact CB-CD1 3.77Å; Q123-I127 HydrophobicContact CB-CG1 4.45Å; Q123-I127 HydrophobicContact CG-CD1 4.49Å; Q123-I127 VanDerWaalsContact O-CB 3.26Å; Q123-I127 WeakPolarHBondContact O-CB 3.45Å; Q123-I127 WeakPolarHBondContact O-CD1 3.41Å; Q123-I127 WeakPolarHBondContact O-CG1 3.13Å; Q123-I127 PolarHBondContact O-N 3Å; Q123-G145 PolarHBondContact NE2-O 2.95Å; Q123-A149 HydrophobicContact CB-CB 4.44Å; Q123-A149 HydrophobicContact CG-CB 3.78Å
124	E	97.5	Very high	95.8	Very high	5 Å²	5	36.3 Å²	36.3	2%	0.023	20%	0.196	C	C	.	.	H	α-helix	trans	-62.2	-42.7	-179.7	-175.1	179.4	-124.1	0	0	113.1	T93 K94 G95 N96 Y101 P119 S120 P121 P128	T93-E124 WeakPolarHBondContact CA-OE2 3.29Å; T93-E124 WeakPolarHBondContact CB-OE2 3.49Å; K94-E124 WeakPolarHBondContact CA-OE1 3.12Å; K94-E124 WeakPolarHBondContact CB-OE1 3.26Å; K94-E124 PolarHBondContact N-OE1 3.44Å; K94-E124 PolarHBondContact N-OE2 3.48Å; G95-E124 PolarHBondContact N-OE1 3.23Å; G95-E124 VanDerWaalsContact N-OE1 3.16Å; N96-E124 HydrophobicContact CB-CG 4.07Å; N96-E124 WeakPolarHBondContact CB-OE1 3.19Å; N96-E124 PolarHBondContact N-OE1 2.84Å; N96-E124 WeakPolarHBondContact ND2-CG 3.34Å; Y101-E124 WeakPolarHBondContact OH-CA 3.4Å; P119-E124 HydrophobicContact CB-CB 4.3Å; P119-E124 HydrophobicContact CG-CB 4.44Å; S120-E124 PolarHBondContact O-N 3.35Å; P121-E124 PolarHBondContact O-N 3.29Å; E124-P128 WeakPolarHBondContact O-CD 3.13Å
125	E	96.4	Very high	96.1	Very high	37 Å²	37	33.9 Å²	33.9	17%	0.173	18%	0.184	C	C	.	.	H	α-helix	trans	-76.5	-32.4	178.1	-67.2	-54.8	121	0	0	113.3	K94 P121 Q123 I129 I298 L300	K94-E125 WeakPolarHBondContact CE-OE1 3.23Å; K94-E125 VanDerWaalsContact NZ-CD 3.27Å; K94-E125 IonicContact NZ-OE1 3.88Å; K94-E125 PolarHBondContact NZ-OE1 3.31Å; K94-E125 IonicContact NZ-OE2 2.73Å; K94-E125 PolarHBondContact NZ-OE2 3.08Å; K94-E125 VanDerWaalsContact NZ-OE2 3.14Å; P121-E125 WeakPolarHBondContact O-CG 3.4Å; P121-E125 PolarHBondContact O-N 3.31Å; Q123-E125 PolarHBondContact O-N 3.2Å; E125-I129 WeakPolarHBondContact O-CG1 3.35Å; E125-I298 HydrophobicContact CB-CD1 4.02Å; E125-I298 HydrophobicContact CB-CG1 4.39Å; E125-I298 HydrophobicContact CB-CG2 4.02Å; E125-L300 HydrophobicContact CG-CD2 4.34Å
126	S	97.8	Very high	96.4	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-94.1	-35.3	-170.9	67.5	0	0	0	0	114.3	I122 Q123 I129 A130 I136 A149 Y276	I122-S126 WeakPolarHBondContact O-CB 3.25Å; I122-S126 PolarHBondContact O-N 3.14Å; I122-S126 PolarHBondContact O-OG 2.64Å; Q123-S126 PolarHBondContact O-N 3.29Å; S126-I129 PolarHBondContact O-N 3.34Å; S126-A130 VanDerWaalsContact O-CB 3.3Å; S126-A130 WeakPolarHBondContact O-CB 3.49Å; S126-A130 PolarHBondContact O-N 2.67Å; S126-I136 VanDerWaalsContact O-CD1 3.31Å; S126-I136 WeakPolarHBondContact O-CD1 3.38Å; S126-A149 WeakPolarHBondContact OG-CB 3.44Å; S126-Y276 WeakPolarHBondContact CB-OH 3.18Å; S126-Y276 PolarHBondContact OG-OH 3.35Å
127	I	98.2	Very high	96.6	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-59.7	-51.8	-173.9	-69.2	168.5	0	0	0	111.2	F98 Y101 Q123 I129 A130 L131 I152	F98-I127 HydrophobicContact CD1-CD1 4.41Å; F98-I127 HydrophobicContact CE1-CD1 3.99Å; Y101-I127 HydrophobicContact CD1-CG2 4.5Å; Y101-I127 HydrophobicContact CD2-CB 4.42Å; Y101-I127 HydrophobicContact CD2-CD1 4.41Å; Y101-I127 HydrophobicContact CD2-CG2 3.8Å; Y101-I127 HydrophobicContact CE2-CB 4.45Å; Y101-I127 HydrophobicContact CE2-CD1 4.16Å; Y101-I127 HydrophobicContact CE2-CG2 4.32Å; Y101-I127 HydrophobicContact CG-CG2 3.92Å; Q123-I127 HydrophobicContact CB-CD1 3.77Å; Q123-I127 HydrophobicContact CB-CG1 4.45Å; Q123-I127 HydrophobicContact CG-CD1 4.49Å; Q123-I127 VanDerWaalsContact O-CB 3.26Å; Q123-I127 WeakPolarHBondContact O-CB 3.45Å; Q123-I127 WeakPolarHBondContact O-CD1 3.41Å; Q123-I127 WeakPolarHBondContact O-CG1 3.13Å; Q123-I127 PolarHBondContact O-N 3Å; I127-I129 VanDerWaalsContact C-N 3.28Å; I127-I129 PolarHBondContact O-N 3.07Å; I127-A130 PolarHBondContact O-N 3.31Å; I127-L131 HydrophobicContact CG2-CD1 3.85Å; I127-L131 HydrophobicContact CG2-CG 4.3Å; I127-L131 VanDerWaalsContact O-CG 3.28Å; I127-L131 WeakPolarHBondContact O-CG 3.49Å; I127-L131 PolarHBondContact O-N 3.45Å; I127-I152 HydrophobicContact CD1-CB 4.28Å; I127-I152 HydrophobicContact CD1-CD1 3.81Å; I127-I152 HydrophobicContact CD1-CG2 4.26Å; I127-I152 HydrophobicContact CG2-CG2 4.24Å
128	P	97.5	Very high	97	Very high	51 Å²	51	26.5 Å²	26.5	33%	0.331	14%	0.142	S	C	.	.	H	α-helix	trans	-60.1	-39.6	-179.5	-22.8	33.7	0	0	0	112.7	Y101 E124 L131 S132	Y101-P128 HydrophobicContact CD1-CG 3.75Å; Y101-P128 HydrophobicContact CE1-CG 3.58Å; E124-P128 WeakPolarHBondContact O-CD 3.13Å; P128-L131 PolarHBondContact O-N 2.96Å; P128-S132 PolarHBondContact O-N 3.09Å
129	I	97.3	Very high	97	Very high	39 Å²	39	24.1 Å²	24.1	20%	0.2	13%	0.13	C	C	.	.	H	α-helix	trans	-69.8	-41.1	-179.3	-56.2	-61.1	0	0	0	110.7	E125 S126 I127 L131 S132 R134 I136 Y296	E125-I129 WeakPolarHBondContact O-CG1 3.35Å; S126-I129 PolarHBondContact O-N 3.34Å; I127-I129 VanDerWaalsContact C-N 3.28Å; I127-I129 PolarHBondContact O-N 3.07Å; I129-L131 VanDerWaalsContact C-N 3.33Å; I129-L131 PolarHBondContact O-N 2.98Å; I129-S132 WeakPolarHBondContact O-CB 3.18Å; I129-S132 PolarHBondContact O-N 3.08Å; I129-S132 PolarHBondContact O-OG 3.27Å; I129-R134 HydrophobicContact CG2-CB 4.15Å; I129-I136 HydrophobicContact CB-CD1 3.95Å; I129-I136 HydrophobicContact CB-CG1 4.43Å; I129-I136 HydrophobicContact CG2-CD1 3.95Å; I129-I136 HydrophobicContact CG2-CG1 3.88Å; I129-Y296 HydrophobicContact CB-CD1 4.26Å; I129-Y296 HydrophobicContact CD1-CD1 4.32Å; I129-Y296 HydrophobicContact CD1-CE1 4.3Å; I129-Y296 HydrophobicContact CD1-CG 4.44Å; I129-Y296 HydrophobicContact CG1-CD1 3.74Å; I129-Y296 HydrophobicContact CG1-CE1 3.85Å; I129-Y296 HydrophobicContact CG1-CG 4.23Å; I129-Y296 HydrophobicContact CG2-CD1 3.93Å; I129-Y296 HydrophobicContact CG2-CG 3.85Å
130	A	98	Very high	96.7	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-65.6	-39.3	177.1	0	0	0	0	0	111	S126 I127 S132 G133 I136 P153 Q272 L274	S126-A130 VanDerWaalsContact O-CB 3.3Å; S126-A130 WeakPolarHBondContact O-CB 3.49Å; S126-A130 PolarHBondContact O-N 2.67Å; I127-A130 PolarHBondContact O-N 3.31Å; A130-S132 VanDerWaalsContact C-N 3.29Å; A130-S132 PolarHBondContact O-N 3.19Å; A130-G133 PolarHBondContact O-N 3.22Å; A130-G133 VanDerWaalsContact O-N 3.12Å; A130-I136 HydrophobicContact CB-CD1 3.77Å; A130-P153 HydrophobicContact CB-CB 3.49Å; A130-P153 VanDerWaalsContact CB-CB 3.49Å; A130-P153 HydrophobicContact CB-CG 3.46Å; A130-P153 VanDerWaalsContact CB-CG 3.46Å; A130-Q272 PolarHBondContact O-NE2 3.26Å; A130-Q272 PolarHBondContact O-OE1 3.38Å; A130-L274 HydrophobicContact CB-CD1 4.06Å; A130-L274 HydrophobicContact CB-CD2 4.25Å
131	L	97.8	Very high	96.5	Very high	47 Å²	47	24.5 Å²	24.5	25%	0.246	13%	0.132	C	C	.	.	H	α-helix	trans	-62.8	-34	173.9	-69.9	173.6	0	0	0	112.5	L103 I127 P128 I129 G133 P153 E156	L103-L131 HydrophobicContact CD2-CD1 3.92Å; L103-L131 HydrophobicContact CD2-CD2 4.37Å; I127-L131 HydrophobicContact CG2-CD1 3.85Å; I127-L131 HydrophobicContact CG2-CG 4.3Å; I127-L131 VanDerWaalsContact O-CG 3.28Å; I127-L131 WeakPolarHBondContact O-CG 3.49Å; I127-L131 PolarHBondContact O-N 3.45Å; P128-L131 PolarHBondContact O-N 2.96Å; I129-L131 VanDerWaalsContact C-N 3.33Å; I129-L131 PolarHBondContact O-N 2.98Å; L131-G133 PolarHBondContact O-N 3.31Å; L131-P153 HydrophobicContact CD2-CB 3.86Å; L131-P153 HydrophobicContact CG-CB 4.03Å; L131-E156 HydrophobicContact CD2-CB 3.75Å; L131-E156 HydrophobicContact CD2-CG 3.56Å
132	S	96.1	Very high	96	Very high	85 Å²	85	24.2 Å²	24.2	59%	0.594	13%	0.13	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-12.9	175.4	80.9	0	0	0	0	114.1	P128 I129 A130	P128-S132 PolarHBondContact O-N 3.09Å; I129-S132 WeakPolarHBondContact O-CB 3.18Å; I129-S132 PolarHBondContact O-N 3.08Å; I129-S132 PolarHBondContact O-OG 3.27Å; A130-S132 VanDerWaalsContact C-N 3.29Å; A130-S132 PolarHBondContact O-N 3.19Å
133	G	96	Very high	95.5	Very high	28 Å²	28	24.4 Å²	24.4	29%	0.289	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.2	6.9	-179.7	0	0	0	0	0	115.4	A130 L131 R157 Q272	A130-G133 PolarHBondContact O-N 3.22Å; A130-G133 VanDerWaalsContact O-N 3.12Å; L131-G133 PolarHBondContact O-N 3.31Å; G133-R157 VanDerWaalsContact CA-NH1 3.26Å; G133-Q272 VanDerWaalsContact C-NE2 3.25Å
134	R	97.3	Very high	95.1	Very high	108 Å²	108	24.6 Å²	24.6	41%	0.408	13%	0.134	S	C	.	.			trans	-79.7	143.9	176	-170.3	173.6	178.3	-174.1	-4.9	111.6	I129 Q272 K294 P295	I129-R134 HydrophobicContact CG2-CB 4.15Å; R134-Q272 PolarHBondContact O-NE2 3.1Å; R134-K294 VanDerWaalsContact CZ-O 3.31Å; R134-K294 PolarHBondContact NE-O 2.64Å; R134-K294 PolarHBondContact NH2-O 2.84Å; R134-P295 PolarHBondContact NH2-O 2.78Å
135	D	98.4	Very high	94.8	Very high	8 Å²	8	25.1 Å²	25.1	4%	0.043	14%	0.141	C	C	.	.			trans	-60.6	148.2	171.7	-72.5	-3.2	0	0	0	111.2	Q272 I273 L292 Q293 P295 Y296	D135-Q272 WeakPolarHBondContact OD1-CA 3.44Å; D135-I273 VanDerWaalsContact CA-O 3.27Å; D135-I273 WeakPolarHBondContact CA-O 3.2Å; D135-I273 WeakPolarHBondContact CB-O 3.37Å; D135-I273 PolarHBondContact OD1-N 2.97Å; D135-L292 HydrophobicContact CB-CG 4.43Å; D135-L292 WeakPolarHBondContact OD2-CA 3.29Å; D135-Q293 PolarHBondContact OD2-N 3.21Å; D135-P295 HydrophobicContact CB-CB 4.05Å; D135-P295 CarbonylContact O-C 3.56Å; D135-P295 WeakPolarHBondContact O-CA 3.48Å; D135-Y296 PolarHBondContact O-N 2.75Å
136	I	98.4	Very high	94.7	Very high	0 Å²	0	24 Å²	24	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	138.3	179.5	-66	-176.3	0	0	0	110.1	S126 I129 A130 A138 I273 L274 L275 I298	S126-I136 VanDerWaalsContact O-CD1 3.31Å; S126-I136 WeakPolarHBondContact O-CD1 3.38Å; I129-I136 HydrophobicContact CB-CD1 3.95Å; I129-I136 HydrophobicContact CB-CG1 4.43Å; I129-I136 HydrophobicContact CG2-CD1 3.95Å; I129-I136 HydrophobicContact CG2-CG1 3.88Å; A130-I136 HydrophobicContact CB-CD1 3.77Å; I136-A138 HydrophobicContact CG2-CB 3.83Å; I136-I273 PolarHBondContact N-O 3.1Å; I136-L274 HydrophobicContact CB-CD2 3.9Å; I136-L274 HydrophobicContact CD1-CD2 4.12Å; I136-L274 HydrophobicContact CG1-CD2 3.89Å; I136-L275 PolarHBondContact O-N 3.22Å; I136-I298 HydrophobicContact CG2-CD1 4Å
137	L	96.7	Very high	94.6	Very high	10 Å²	10	25.1 Å²	25.1	5%	0.052	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	104.1	164.1	-174.7	80.6	0	0	0	108.5	L275 F280 M288 L292 P295 Y296 E297 I298	L137-L275 HydrophobicContact CD1-CB 4.22Å; L137-L275 HydrophobicContact CD1-CD1 4Å; L137-L275 HydrophobicContact CD1-CD2 3.84Å; L137-L275 HydrophobicContact CD1-CG 4.22Å; L137-F280 HydrophobicContact CD1-CE1 3.67Å; L137-F280 HydrophobicContact CD1-CZ 4.4Å; L137-F280 HydrophobicContact CD2-CD1 4.47Å; L137-F280 HydrophobicContact CD2-CE1 3.79Å; L137-F280 HydrophobicContact CG-CE1 3.61Å; L137-F280 HydrophobicContact CG-CZ 4.23Å; L137-M288 HydrophobicContact CD1-CG 4.39Å; L137-M288 HydrophobicContact CD1-SD 4.17Å; L137-M288 HydrophobicContact CD2-SD 3.38Å; L137-M288 WeakPolarHBondContact CD2-SD 3.47Å; L137-M288 HydrophobicContact CG-SD 4.29Å; L137-L292 HydrophobicContact CD1-CD2 4.24Å; L137-P295 HydrophobicContact CB-CB 4.3Å; L137-Y296 PolarHBondContact N-O 3.34Å; L137-E297 HydrophobicContact CB-CG 4.2Å; L137-E297 HydrophobicContact CD2-CB 4.49Å; L137-E297 HydrophobicContact CD2-CG 3.85Å; L137-E297 CarbonylContact O-C 3.42Å; L137-E297 WeakPolarHBondContact O-CA 3.24Å; L137-I298 PolarHBondContact O-N 3.39Å
138	A	96.6	Very high	94.5	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	117.5	-173.6	0	0	0	0	0	112.2	I122 I136 L275 Y276 S277 I298	I122-A138 HydrophobicContact CD1-CB 3.86Å; I136-A138 HydrophobicContact CG2-CB 3.83Å; A138-L275 PolarHBondContact N-O 3.25Å; A138-Y276 HydrophobicContact CB-CD1 3.36Å; A138-Y276 HydrophobicContact CB-CE1 3.43Å; A138-Y276 VanDerWaalsContact CB-CE1 3.43Å; A138-Y276 HydrophobicContact CB-CG 4.01Å; A138-Y276 WeakPolarHBondContact O-CA 3.47Å; A138-S277 PolarHBondContact O-N 3.04Å; A138-I298 HydrophobicContact CB-CB 4.5Å
139	R	93.8	Very high	94.5	Very high	68 Å²	68	22.7 Å²	22.7	26%	0.257	13%	0.128	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	109.2	170.2	-173.1	167.5	-171	-165.6	-1.9	110.7	S277 A278 F280 I298 N299 L300 M301	R139-S277 WeakPolarHBondContact CA-O 3.38Å; R139-A278 PolarHBondContact NE-O 3.29Å; R139-F280 HydrophobicContact CB-CD2 3.96Å; R139-F280 HydrophobicContact CB-CE2 3.25Å; R139-F280 HydrophobicContact CB-CZ 3.61Å; R139-F280 VanDerWaalsContact CD-CD2 3.4Å; R139-F280 HydrophobicContact CG-CD2 3.64Å; R139-F280 HydrophobicContact CG-CE2 3.35Å; R139-F280 HydrophobicContact CG-CZ 4.22Å; R139-I298 PolarHBondContact N-O 3.11Å; R139-N299 HydrophobicContact CB-CB 4.49Å; R139-L300 PolarHBondContact O-N 2.85Å; R139-L300 VanDerWaalsContact O-N 3.11Å; R139-M301 HydrophobicContact CG-CB 4.41Å; R139-M301 HydrophobicContact CG-CG 4.11Å; R139-M301 HydrophobicContact CG-SD 3.49Å; R139-M301 WeakPolarHBondContact CG-SD 3.45Å
140	A	92.1	Very high	94.6	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.008	12%	0.118	C	C	.	.			trans	-147.5	147.6	178.6	0	0	0	0	0	112.8	I122 K146 S277 M301	I122-A140 HydrophobicContact CB-CB 4.11Å; I122-A140 HydrophobicContact CD1-CB 4.03Å; I122-A140 HydrophobicContact CG1-CB 3.86Å; A140-K146 HydrophobicContact CB-CD 4.19Å; A140-K146 HydrophobicContact CB-CG 4.19Å; A140-K146 PolarHBondContact O-NZ 3.06Å; A140-S277 PolarHBondContact N-O 3.03Å; A140-S277 VanDerWaalsContact N-O 3.13Å; A140-M301 VanDerWaalsContact CA-SD 3.56Å
141	K	89.9	Confident	94.6	Very high	10 Å²	10	20.9 Å²	20.9	4%	0.043	12%	0.118	C	C	.	.			trans	-55.7	158	179.1	-63.1	171.5	-175.5	-171.5	0	111.6	D89 T144 K146 M301 E303 T305 L306	D89-K141 WeakPolarHBondContact OD1-CD 3.4Å; D89-K141 WeakPolarHBondContact OD1-CE 3.38Å; D89-K141 IonicContact OD1-NZ 3.97Å; D89-K141 PolarHBondContact OD1-NZ 3.49Å; D89-K141 IonicContact OD2-NZ 3.91Å; K141-T144 HydrophobicContact CB-CG2 3.72Å; K141-T144 PolarHBondContact O-OG1 3.45Å; K141-K146 PolarHBondContact O-NZ 3.38Å; K141-M301 HydrophobicContact CG-CE 3.76Å; K141-M301 HydrophobicContact CG-CG 4.06Å; K141-M301 HydrophobicContact CG-SD 4.28Å; K141-M301 PolarHBondContact N-SD 2.81Å; K141-M301 VanDerWaalsContact N-SD 3.43Å; K141-E303 WeakPolarHBondContact CE-O 3.15Å; K141-T305 WeakPolarHBondContact CD-O 3.41Å; K141-T305 WeakPolarHBondContact CE-O 3.48Å; K141-T305 PolarHBondContact NZ-O 2.98Å; K141-L306 HydrophobicContact CB-CD2 3.81Å; K141-L306 HydrophobicContact CB-CG 4.49Å; K141-L306 HydrophobicContact CD-CD2 3.98Å; K141-L306 HydrophobicContact CG-CD2 4.47Å
142	N	86.3	Confident	94.7	Very high	5 Å²	5	18.6 Å²	18.6	3%	0.027	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	138.6	174.1	-66.8	-31.2	0	0	0	110	K146 L306 H420	N142-K146 PolarHBondContact OD1-NZ 2.98Å; N142-K146 VanDerWaalsContact OD1-NZ 3.12Å; N142-L306 WeakPolarHBondContact O-CD1 3.15Å; N142-L306 WeakPolarHBondContact O-CD2 3.31Å; N142-H420 PolarHBondContact ND2-ND1 2.87Å
143	G	85.1	Confident	94.8	Very high	7 Å²	7	14.6 Å²	14.6	7%	0.072	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.4	10.2	178.5	0	0	0	0	0	117.1	G145 R427 F428	G143-G145 VanDerWaalsContact C-N 3.33Å; G143-R427 VanDerWaalsContact CA-NH1 3.35Å; G143-F428 VanDerWaalsContact O-CA 3.23Å; G143-F428 WeakPolarHBondContact O-CA 3.41Å; G143-F428 PolarHBondContact O-N 3.43Å
144	T	88.9	Confident	94.9	Very high	7 Å²	7	13.3 Å²	13.3	4%	0.043	7%	0.065	C	C	.	.	S	Bend	trans	-89.2	7.7	177.9	56.3	0	0	0	0	114.3	D89 V90 S120 I122 K141 L306	D89-T144 HydrophobicContact CB-CG2 4.3Å; V90-T144 HydrophobicContact CG1-CG2 4.45Å; S120-T144 VanDerWaalsContact CB-O 3.29Å; S120-T144 WeakPolarHBondContact CB-O 3.27Å; S120-T144 PolarHBondContact OG-O 3.16Å; I122-T144 WeakPolarHBondContact CG2-O 3.47Å; K141-T144 HydrophobicContact CB-CG2 3.72Å; K141-T144 PolarHBondContact O-OG1 3.45Å; T144-L306 HydrophobicContact CG2-CD2 4.27Å
145	G	91.6	Very high	95	Very high	17 Å²	17	8.1 Å²	8.1	18%	0.175	5%	0.045	C	C	.	.	S	Bend	trans	94.3	21	178.1	0	0	0	0	0	115.8	Q123 G143 S147 G148 A149	Q123-G145 PolarHBondContact NE2-O 2.95Å; G143-G145 VanDerWaalsContact C-N 3.33Å; G145-S147 PolarHBondContact O-N 2.78Å; G145-S147 VanDerWaalsContact O-N 3.14Å; G145-G148 PolarHBondContact O-N 2.92Å; G145-G148 VanDerWaalsContact O-N 3.11Å; G145-A149 PolarHBondContact O-N 2.95Å
146	K	94.6	Very high	94.9	Very high	13 Å²	13	9.3 Å²	9.3	6%	0.057	5%	0.051	C	C	.	.	H	α-helix	trans	-48.1	-40	176.1	-64.6	-168.4	-73.8	-101.3	0	113.5	I122 A140 K141 N142 G148 A149 Y150 Y276	I122-K146 HydrophobicContact CG1-CG 4.47Å; A140-K146 HydrophobicContact CB-CD 4.19Å; A140-K146 HydrophobicContact CB-CG 4.19Å; A140-K146 PolarHBondContact O-NZ 3.06Å; K141-K146 PolarHBondContact O-NZ 3.38Å; N142-K146 PolarHBondContact OD1-NZ 2.98Å; N142-K146 VanDerWaalsContact OD1-NZ 3.12Å; K146-G148 PolarHBondContact O-N 3.3Å; K146-A149 WeakPolarHBondContact O-CA 3.29Å; K146-A149 WeakPolarHBondContact O-CB 3.41Å; K146-A149 PolarHBondContact O-N 3.29Å; K146-Y150 WeakPolarHBondContact O-CD1 3.19Å; K146-Y150 WeakPolarHBondContact O-CE1 3.45Å; K146-Y150 PolarHBondContact O-N 2.68Å; K146-Y276 HydrophobicContact CB-CD1 4.23Å; K146-Y276 HydrophobicContact CD-CD1 4.28Å; K146-Y276 HydrophobicContact CG-CD1 4.28Å
147	S	95.8	Very high	94.8	Very high	23 Å²	23	13.9 Å²	13.9	16%	0.161	7%	0.068	C	C	.	.	H	α-helix	trans	-60.9	-43.5	179.9	-55.3	0	0	0	0	113.6	G145 A149 Y150 L151	G145-S147 PolarHBondContact O-N 2.78Å; G145-S147 VanDerWaalsContact O-N 3.14Å; S147-A149 VanDerWaalsContact C-N 3.27Å; S147-A149 PolarHBondContact O-N 3.45Å; S147-Y150 VanDerWaalsContact CA-CE1 3.45Å; S147-Y150 VanDerWaalsContact CA-CZ 3.49Å; S147-Y150 PolarHBondContact OG-OH 3.02Å; S147-L151 WeakPolarHBondContact O-CB 3.49Å; S147-L151 WeakPolarHBondContact O-CG 3.36Å; S147-L151 PolarHBondContact O-N 3.26Å
148	G	96.9	Very high	94.9	Very high	1 Å²	1	13.7 Å²	13.7	1%	0.01	7%	0.067	C	C	.	.	H	α-helix	trans	-64	-36.4	172.8	0	0	0	0	0	112	G145 K146 Y150 L151 I152	G145-G148 PolarHBondContact O-N 2.92Å; G145-G148 VanDerWaalsContact O-N 3.11Å; K146-G148 PolarHBondContact O-N 3.3Å; G148-Y150 VanDerWaalsContact C-N 3.31Å; G148-Y150 PolarHBondContact O-N 3.4Å; G148-L151 PolarHBondContact O-N 2.89Å; G148-I152 WeakPolarHBondContact O-CB 3.31Å; G148-I152 WeakPolarHBondContact O-CD1 3.41Å; G148-I152 VanDerWaalsContact O-CG1 3.23Å; G148-I152 WeakPolarHBondContact O-CG1 3.38Å; G148-I152 PolarHBondContact O-N 2.82Å; G148-I152 VanDerWaalsContact O-N 3.08Å
149	A	97.9	Very high	94.8	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-59	-38.7	-176.8	0	0	0	0	0	112.8	I122 Q123 S126 G145 K146 S147 P153 Y276	I122-A149 HydrophobicContact CG1-CB 4.27Å; Q123-A149 HydrophobicContact CB-CB 4.44Å; Q123-A149 HydrophobicContact CG-CB 3.78Å; S126-A149 WeakPolarHBondContact OG-CB 3.44Å; G145-A149 PolarHBondContact O-N 2.95Å; K146-A149 WeakPolarHBondContact O-CA 3.29Å; K146-A149 WeakPolarHBondContact O-CB 3.41Å; K146-A149 PolarHBondContact O-N 3.29Å; S147-A149 VanDerWaalsContact C-N 3.27Å; S147-A149 PolarHBondContact O-N 3.45Å; A149-P153 WeakPolarHBondContact O-CD 3.25Å; A149-P153 VanDerWaalsContact O-CG 3.26Å; A149-P153 WeakPolarHBondContact O-CG 3.29Å; A149-Y276 HydrophobicContact CB-CE1 4Å
150	Y	98.3	Very high	94.9	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-97.4	-29	175	62.1	-109.3	0	0	0	114.8	K146 S147 G148 L154 V169 V180 V244 D246 Y276	K146-Y150 WeakPolarHBondContact O-CD1 3.19Å; K146-Y150 WeakPolarHBondContact O-CE1 3.45Å; K146-Y150 PolarHBondContact O-N 2.68Å; S147-Y150 VanDerWaalsContact CA-CE1 3.45Å; S147-Y150 VanDerWaalsContact CA-CZ 3.49Å; S147-Y150 PolarHBondContact OG-OH 3.02Å; G148-Y150 VanDerWaalsContact C-N 3.31Å; G148-Y150 PolarHBondContact O-N 3.4Å; Y150-L154 WeakPolarHBondContact O-CB 3.41Å; Y150-L154 PolarHBondContact O-N 2.84Å; Y150-V169 HydrophobicContact CD2-CG2 4.47Å; Y150-V169 HydrophobicContact CE2-CG1 3.84Å; Y150-V169 HydrophobicContact CE2-CG2 4.29Å; Y150-V180 HydrophobicContact CE2-CG1 4.06Å; Y150-V180 WeakPolarHBondContact OH-CG2 3.49Å; Y150-V244 HydrophobicContact CD1-CG1 3.8Å; Y150-V244 HydrophobicContact CD2-CB 4.37Å; Y150-V244 HydrophobicContact CD2-CG1 3.74Å; Y150-V244 HydrophobicContact CD2-CG2 4.14Å; Y150-V244 HydrophobicContact CE1-CG1 4.25Å; Y150-V244 HydrophobicContact CE2-CG1 4.21Å; Y150-V244 HydrophobicContact CG-CG1 3.56Å; Y150-V244 HydrophobicContact CG-CG2 4.28Å; Y150-D246 HydrophobicContact CE1-CB 4.06Å; Y150-D246 PolarHBondContact OH-OD2 2.94Å; Y150-Y276 AromaticContact CD1-CD2 3.8Å; Y150-Y276 HydrophobicContact CD1-CD2 3.8Å; Y150-Y276 AromaticContact CD1-CE2 3.93Å; Y150-Y276 HydrophobicContact CD1-CE2 3.93Å; Y150-Y276 HydrophobicContact CD1-CG 4.15Å; Y150-Y276 HydrophobicContact CG-CD2 4.42Å; Y150-Y276 HydrophobicContact CG-CE2 4.2Å
151	L	98.7	Very high	95.1	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-71.3	-37.1	-178.2	-73.3	176.5	0	0	0	112.3	S147 G148 L154 L155 V169 V180 I183 C184	S147-L151 WeakPolarHBondContact O-CB 3.49Å; S147-L151 WeakPolarHBondContact O-CG 3.36Å; S147-L151 PolarHBondContact O-N 3.26Å; G148-L151 PolarHBondContact O-N 2.89Å; L151-L154 PolarHBondContact O-N 2.85Å; L151-L155 WeakPolarHBondContact O-CB 3.27Å; L151-L155 VanDerWaalsContact O-CG 3.24Å; L151-L155 WeakPolarHBondContact O-CG 3.39Å; L151-L155 PolarHBondContact O-N 2.8Å; L151-V169 HydrophobicContact CD2-CG2 4.36Å; L151-V180 HydrophobicContact CD1-CG1 4.2Å; L151-V180 HydrophobicContact CD2-CG1 4.19Å; L151-I183 HydrophobicContact CD1-CB 4.1Å; L151-I183 HydrophobicContact CD1-CG2 3.65Å; L151-C184 HydrophobicContact CD1-CB 4.1Å; L151-C184 HydrophobicContact CD2-CB 3.91Å
152	I	98.7	Very high	95.4	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-60.2	-58.1	179.7	-68.4	168.5	0	0	0	111.4	F98 L103 L107 I111 W116 I127 G148 L154 L155 E156	F98-I152 HydrophobicContact CD1-CD1 4.1Å; F98-I152 HydrophobicContact CE1-CD1 3.53Å; F98-I152 HydrophobicContact CZ-CD1 4.28Å; L103-I152 HydrophobicContact CD1-CG2 3.61Å; L103-I152 HydrophobicContact CD2-CG2 3.99Å; L103-I152 HydrophobicContact CG-CG2 4.48Å; L107-I152 HydrophobicContact CD2-CG2 4.27Å; I111-I152 HydrophobicContact CD1-CD1 3.87Å; I111-I152 HydrophobicContact CD1-CG1 3.9Å; I111-I152 HydrophobicContact CD1-CG2 4.1Å; I111-I152 HydrophobicContact CG1-CD1 4.22Å; I111-I152 HydrophobicContact CG1-CG1 4.21Å; W116-I152 HydrophobicContact CE3-CD1 4.21Å; W116-I152 HydrophobicContact CZ3-CD1 4.14Å; W116-I152 HydrophobicContact CZ3-CG1 4.29Å; I127-I152 HydrophobicContact CD1-CB 4.28Å; I127-I152 HydrophobicContact CD1-CD1 3.81Å; I127-I152 HydrophobicContact CD1-CG2 4.26Å; I127-I152 HydrophobicContact CG2-CG2 4.24Å; G148-I152 WeakPolarHBondContact O-CB 3.31Å; G148-I152 WeakPolarHBondContact O-CD1 3.41Å; G148-I152 VanDerWaalsContact O-CG1 3.23Å; G148-I152 WeakPolarHBondContact O-CG1 3.38Å; G148-I152 PolarHBondContact O-N 2.82Å; G148-I152 VanDerWaalsContact O-N 3.08Å; I152-L154 VanDerWaalsContact C-N 3.28Å; I152-L154 PolarHBondContact O-N 2.89Å; I152-L155 PolarHBondContact O-N 2.96Å; I152-E156 WeakPolarHBondContact O-CB 3.26Å; I152-E156 PolarHBondContact O-N 3.31Å
153	P	98.4	Very high	95.8	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-65.6	-31.7	179.3	25.7	-35.6	0	0	0	112.5	A130 L131 A149 R157	A130-P153 HydrophobicContact CB-CB 3.49Å; A130-P153 VanDerWaalsContact CB-CB 3.49Å; A130-P153 HydrophobicContact CB-CG 3.46Å; A130-P153 VanDerWaalsContact CB-CG 3.46Å; L131-P153 HydrophobicContact CD2-CB 3.86Å; L131-P153 HydrophobicContact CG-CB 4.03Å; A149-P153 WeakPolarHBondContact O-CD 3.25Å; A149-P153 VanDerWaalsContact O-CG 3.26Å; A149-P153 WeakPolarHBondContact O-CG 3.29Å; P153-R157 WeakPolarHBondContact O-CG 3.4Å; P153-R157 PolarHBondContact O-N 3.4Å; P153-R157 VanDerWaalsContact O-N 3.13Å
154	L	98.4	Very high	96.4	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-61.2	-49.9	174.4	-178.4	158.1	0	0	0	111.6	Y150 L151 I152 R157 A167 V169 V218 M242 V244	Y150-L154 WeakPolarHBondContact O-CB 3.41Å; Y150-L154 PolarHBondContact O-N 2.84Å; L151-L154 PolarHBondContact O-N 2.85Å; I152-L154 VanDerWaalsContact C-N 3.28Å; I152-L154 PolarHBondContact O-N 2.89Å; L154-R157 PolarHBondContact O-N 3.44Å; L154-A167 HydrophobicContact CD1-CB 3.74Å; L154-A167 HydrophobicContact CD2-CB 3.7Å; L154-A167 HydrophobicContact CG-CB 3.51Å; L154-V169 HydrophobicContact CD1-CG2 3.62Å; L154-V218 HydrophobicContact CD2-CB 4.47Å; L154-V218 HydrophobicContact CD2-CG1 3.9Å; L154-V218 HydrophobicContact CD2-CG2 3.65Å; L154-M242 HydrophobicContact CB-SD 3.62Å; L154-M242 HydrophobicContact CD1-SD 4.26Å; L154-M242 HydrophobicContact CG-SD 3.96Å; L154-V244 HydrophobicContact CD1-CG2 3.97Å
155	L	98.6	Very high	96.8	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-66.5	-41.6	179.1	-73.5	172.6	0	0	0	111.4	L107 L151 I152 R157 L158 V187 M191	L107-L155 HydrophobicContact CD1-CB 3.93Å; L107-L155 HydrophobicContact CD1-CD1 3.97Å; L107-L155 HydrophobicContact CD2-CB 4.35Å; L151-L155 WeakPolarHBondContact O-CB 3.27Å; L151-L155 VanDerWaalsContact O-CG 3.24Å; L151-L155 WeakPolarHBondContact O-CG 3.39Å; L151-L155 PolarHBondContact O-N 2.8Å; I152-L155 PolarHBondContact O-N 2.96Å; L155-R157 VanDerWaalsContact C-N 3.25Å; L155-R157 PolarHBondContact O-N 3.02Å; L155-L158 HydrophobicContact CD2-CD1 3.8Å; L155-L158 WeakPolarHBondContact O-CB 3.37Å; L155-L158 WeakPolarHBondContact O-CG 3.17Å; L155-L158 PolarHBondContact O-N 3.48Å; L155-L158 VanDerWaalsContact O-N 3.14Å; L155-V187 HydrophobicContact CD1-CB 3.94Å; L155-V187 HydrophobicContact CD1-CG1 3.59Å; L155-M191 HydrophobicContact CB-SD 4.13Å; L155-M191 HydrophobicContact CD2-SD 4.32Å; L155-M191 VanDerWaalsContact O-CE 3.29Å; L155-M191 WeakPolarHBondContact O-CE 3.38Å
156	E	97.9	Very high	97.2	Very high	33 Å²	33	35.7 Å²	35.7	15%	0.154	17%	0.169	C	C	.	.	H	α-helix	trans	-57.7	-40.4	177.9	-179.2	50.6	-134.7	0	0	111.6	L103 K104 L107 L131 I152 L158	L103-E156 HydrophobicContact CD2-CB 4.15Å; L103-E156 HydrophobicContact CD2-CG 3.94Å; K104-E156 WeakPolarHBondContact CB-OE2 3.16Å; K104-E156 WeakPolarHBondContact CD-OE1 3.49Å; K104-E156 WeakPolarHBondContact CE-OE1 3.21Å; K104-E156 VanDerWaalsContact CG-OE1 3.31Å; K104-E156 WeakPolarHBondContact CG-OE1 3.41Å; K104-E156 WeakPolarHBondContact CG-OE2 3.36Å; K104-E156 PolarHBondContact N-OE2 3.46Å; K104-E156 PolarHBondContact NZ-O 3.09Å; K104-E156 IonicContact NZ-OE1 2.68Å; L107-E156 HydrophobicContact CD2-CB 3.77Å; L131-E156 HydrophobicContact CD2-CB 3.75Å; L131-E156 HydrophobicContact CD2-CG 3.56Å; I152-E156 WeakPolarHBondContact O-CB 3.26Å; I152-E156 PolarHBondContact O-N 3.31Å; E156-L158 VanDerWaalsContact C-N 3.26Å; E156-L158 PolarHBondContact O-N 3.02Å
157	R	96.1	Very high	97.4	Very high	96 Å²	96	35.2 Å²	35.2	36%	0.362	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-6.3	-179.1	-71.3	-166.6	68.2	168.4	6.9	115.1	G133 P153 L154 L155	G133-R157 VanDerWaalsContact CA-NH1 3.26Å; P153-R157 WeakPolarHBondContact O-CG 3.4Å; P153-R157 PolarHBondContact O-N 3.4Å; P153-R157 VanDerWaalsContact O-N 3.13Å; L154-R157 PolarHBondContact O-N 3.44Å; L155-R157 VanDerWaalsContact C-N 3.25Å; L155-R157 PolarHBondContact O-N 3.02Å
158	L	97.3	Very high	97.5	Very high	6 Å²	6	34.1 Å²	34.1	3%	0.031	16%	0.16	C	C	.	.			trans	-67.1	136.3	178.6	-62	-179.6	0	0	0	112.1	K104 L155 E156 L160 Q166 A167 H217 V218	K104-L158 PolarHBondContact NZ-O 3.45Å; K104-L158 VanDerWaalsContact NZ-O 3.09Å; L155-L158 HydrophobicContact CD2-CD1 3.8Å; L155-L158 WeakPolarHBondContact O-CB 3.37Å; L155-L158 WeakPolarHBondContact O-CG 3.17Å; L155-L158 PolarHBondContact O-N 3.48Å; L155-L158 VanDerWaalsContact O-N 3.14Å; E156-L158 VanDerWaalsContact C-N 3.26Å; E156-L158 PolarHBondContact O-N 3.02Å; L158-L160 HydrophobicContact CB-CD2 4.13Å; L158-L160 HydrophobicContact CD1-CD2 4.42Å; L158-Q166 HydrophobicContact CD2-CB 3.85Å; L158-A167 HydrophobicContact CD2-CB 4.39Å; L158-H217 HydrophobicContact CD1-CB 4.32Å; L158-V218 HydrophobicContact CD1-CG2 3.64Å; L158-V218 HydrophobicContact CD2-CG2 3.97Å; L158-V218 HydrophobicContact CG-CG2 4.39Å
159	D	96.3	Very high	97.6	Very high	54 Å²	54	34 Å²	34	29%	0.289	16%	0.159	S	C	.	.			trans	-103.1	94.1	167.7	-176.6	-0.6	0	0	0	109.4	K161 K162 Q166	D159-K161 PolarHBondContact O-N 3.5Å; D159-K161 WeakPolarHBondContact OD1-CB 3.35Å; D159-K161 PolarHBondContact OD1-N 2.57Å; D159-K162 HydrophobicContact CB-CD 4.36Å; D159-K162 PolarHBondContact O-N 3.37Å; D159-K162 WeakPolarHBondContact OD2-CD 3.13Å; D159-K162 WeakPolarHBondContact OD2-CE 3.41Å; D159-K162 IonicContact OD2-NZ 2.74Å; D159-K162 PolarHBondContact OD2-NZ 3.46Å; D159-Q166 PolarHBondContact O-NE2 3.08Å
160	L	95.8	Very high	97.6	Very high	52 Å²	52	34 Å²	34	27%	0.272	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-3.6	-175.4	-57.9	-176.4	0	0	0	114.5	L158 K162 M191 A194	L158-L160 HydrophobicContact CB-CD2 4.13Å; L158-L160 HydrophobicContact CD1-CD2 4.42Å; L160-K162 VanDerWaalsContact C-N 3.32Å; L160-M191 HydrophobicContact CD1-CB 4.04Å; L160-M191 HydrophobicContact CD1-CE 4.42Å; L160-M191 WeakPolarHBondContact CD1-O 3.38Å; L160-A194 HydrophobicContact CD2-CB 4.03Å
161	K	95	Very high	97.6	Very high	194 Å²	194	34 Å²	34	84%	0.843	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-11	173.3	-60.3	178.7	-179.6	177.7	0	112.4	D159	D159-K161 PolarHBondContact O-N 3.5Å; D159-K161 WeakPolarHBondContact OD1-CB 3.35Å; D159-K161 PolarHBondContact OD1-N 2.57Å
162	K	96.1	Very high	97.3	Very high	104 Å²	104	34.6 Å²	34.6	45%	0.452	16%	0.163	S	C	.	.	S	Bend	trans	-107.5	111.4	-178.3	-69.6	178.7	-179.1	131.5	0	110.3	D159 L160 N164 Q166 H217	D159-K162 HydrophobicContact CB-CD 4.36Å; D159-K162 PolarHBondContact O-N 3.37Å; D159-K162 WeakPolarHBondContact OD2-CD 3.13Å; D159-K162 WeakPolarHBondContact OD2-CE 3.41Å; D159-K162 IonicContact OD2-NZ 2.74Å; D159-K162 PolarHBondContact OD2-NZ 3.46Å; L160-K162 VanDerWaalsContact C-N 3.32Å; K162-N164 PolarHBondContact O-N 3.19Å; K162-Q166 PolarHBondContact O-NE2 3.4Å; K162-H217 PolarHBondContact O-CD2 3.37Å; K162-H217 PolarHBondContact O-NE2 3.02Å
163	D	95.6	Very high	97	Very high	118 Å²	118	35.6 Å²	35.6	63%	0.631	17%	0.169	S	C	*	.			trans	-76.8	61.4	179.9	-66.4	-52.8	0	0	0	112.4	T215	D163-T215 HydrophobicContact CB-CG2 3.96Å; D163-T215 WeakPolarHBondContact CB-OG1 3.43Å; D163-T215 VanDerWaalsContact CG-OG1 3.28Å; D163-T215 VanDerWaalsContact OD1-CG2 3.23Å; D163-T215 WeakPolarHBondContact OD1-CG2 3.34Å; D163-T215 PolarHBondContact OD1-OG1 2.74Å
164	N	97.1	Very high	96.7	Very high	35 Å²	35	39.2 Å²	39.2	19%	0.187	18%	0.183	C	C	.	.	S	Bend	trans	-144.7	163.2	178.1	56.4	34.6	0	0	0	112	K162 Q166 V216 H239	K162-N164 PolarHBondContact O-N 3.19Å; N164-Q166 PolarHBondContact O-N 2.79Å; N164-Q166 WeakPolarHBondContact OD1-CG 3.38Å; N164-V216 CarbonylContact C-O 3.44Å; N164-H239 HydrophobicContact CB-CB 4.11Å; N164-H239 PolarHBondContact ND2-CD2 3.2Å; N164-H239 VanDerWaalsContact ND2-CG 3.27Å
165	I	98.6	Very high	96.3	Very high	10 Å²	10	39.2 Å²	39.2	5%	0.051	18%	0.183	C	C	.	.			trans	-71.8	117.8	174.1	-54.6	170.3	0	0	0	107.7	M168 L212 V216 V219 A235 H239 V240	I165-M168 HydrophobicContact CG2-CG 4.27Å; I165-L212 HydrophobicContact CD1-CD2 4.07Å; I165-V216 VanDerWaalsContact CA-O 3.27Å; I165-V216 WeakPolarHBondContact CA-O 3.46Å; I165-V216 HydrophobicContact CG1-CB 4.34Å; I165-V216 HydrophobicContact CG1-CG1 4.4Å; I165-V216 WeakPolarHBondContact CG1-O 3.44Å; I165-V216 PolarHBondContact N-O 2.85Å; I165-V219 HydrophobicContact CD1-CG2 3.86Å; I165-V219 HydrophobicContact CG1-CG2 4.14Å; I165-V219 HydrophobicContact CG2-CB 4.39Å; I165-V219 HydrophobicContact CG2-CG2 3.86Å; I165-A235 HydrophobicContact CD1-CB 4.37Å; I165-H239 CarbonylContact O-C 3.59Å; I165-H239 VanDerWaalsContact O-C 3.27Å; I165-V240 HydrophobicContact CB-CG2 4.3Å; I165-V240 HydrophobicContact CG2-CG2 3.81Å; I165-V240 PolarHBondContact O-N 3.19Å
166	Q	98.5	Very high	96	Very high	10 Å²	10	39.3 Å²	39.3	5%	0.047	18%	0.183	C	C	.	.			trans	-108.9	-26.2	-176.1	-65.9	174.8	40.2	0	0	112.3	L158 D159 K162 N164 H217 V240 Q241 M242	L158-Q166 HydrophobicContact CD2-CB 3.85Å; D159-Q166 PolarHBondContact O-NE2 3.08Å; K162-Q166 PolarHBondContact O-NE2 3.4Å; N164-Q166 PolarHBondContact O-N 2.79Å; N164-Q166 WeakPolarHBondContact OD1-CG 3.38Å; Q166-H217 PolarHBondContact N-O 2.85Å; Q166-V240 WeakPolarHBondContact O-CA 3.44Å; Q166-Q241 PolarHBondContact O-N 2.95Å; Q166-M242 PolarHBondContact O-N 3.41Å
167	A	98.8	Very high	95.9	Very high	2 Å²	2	37.7 Å²	37.7	2%	0.017	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	149.3	179.9	0	0	0	0	0	113.2	L154 L158 H217 V218 V219 M242	L154-A167 HydrophobicContact CD1-CB 3.74Å; L154-A167 HydrophobicContact CD2-CB 3.7Å; L154-A167 HydrophobicContact CG-CB 3.51Å; L158-A167 HydrophobicContact CD2-CB 4.39Å; A167-H217 PolarHBondContact N-O 2.95Å; A167-V218 WeakPolarHBondContact O-CA 3.23Å; A167-V219 PolarHBondContact O-N 3.16Å; A167-M242 VanDerWaalsContact CA-O 3.29Å; A167-M242 WeakPolarHBondContact CA-O 3.45Å; A167-M242 HydrophobicContact CB-CB 4.41Å
168	M	98.8	Very high	95.8	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	138.7	178.4	-70.6	179.7	52.3	0	0	111.3	I165 I170 V219 I226 V237 V240 M242 I243 V244 I263 L267	I165-M168 HydrophobicContact CG2-CG 4.27Å; M168-I170 HydrophobicContact CE-CD1 3.76Å; M168-V219 CarbonylContact C-O 3.59Å; M168-V219 VanDerWaalsContact CA-O 3.26Å; M168-V219 WeakPolarHBondContact CA-O 3.1Å; M168-V219 HydrophobicContact CG-CB 4.33Å; M168-I226 HydrophobicContact CE-CD1 4.28Å; M168-I226 HydrophobicContact CE-CG1 3.46Å; M168-I226 VanDerWaalsContact CE-CG1 3.46Å; M168-I226 HydrophobicContact CE-CG2 4.47Å; M168-V237 HydrophobicContact SD-CG1 3.78Å; M168-V240 HydrophobicContact CB-CG1 4.45Å; M168-V240 HydrophobicContact CG-CG1 4.11Å; M168-V240 HydrophobicContact CG-CG2 4.05Å; M168-V240 HydrophobicContact SD-CG1 4.24Å; M168-V240 HydrophobicContact SD-CG2 3.87Å; M168-M242 PolarHBondContact N-O 2.96Å; M168-I243 HydrophobicContact CB-CD1 4.49Å; M168-I243 HydrophobicContact CB-CG1 4.19Å; M168-I243 CarbonylContact O-C 3.5Å; M168-I243 VanDerWaalsContact O-CA 3.31Å; M168-I243 WeakPolarHBondContact O-CA 3.14Å; M168-V244 PolarHBondContact O-N 3.34Å; M168-I263 HydrophobicContact CE-CG2 4.41Å; M168-L267 HydrophobicContact SD-CD2 3.95Å
169	V	98.9	Very high	95.6	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	116.9	168.6	-174.8	0	0	0	0	108.3	Y150 L151 L154 V171 V180 V219 I220 A221 V244	Y150-V169 HydrophobicContact CD2-CG2 4.47Å; Y150-V169 HydrophobicContact CE2-CG1 3.84Å; Y150-V169 HydrophobicContact CE2-CG2 4.29Å; L151-V169 HydrophobicContact CD2-CG2 4.36Å; L154-V169 HydrophobicContact CD1-CG2 3.62Å; V169-V171 HydrophobicContact CG1-CG1 4.19Å; V169-V180 HydrophobicContact CG1-CG1 4.28Å; V169-V219 PolarHBondContact N-O 2.67Å; V169-I220 HydrophobicContact CB-CB 4.47Å; V169-I220 HydrophobicContact CB-CG1 3.98Å; V169-I220 HydrophobicContact CB-CG2 4.34Å; V169-I220 HydrophobicContact CG2-CG1 4.12Å; V169-I220 CarbonylContact O-C 3.12Å; V169-I220 WeakPolarHBondContact O-CA 3.33Å; V169-A221 PolarHBondContact O-N 3.3Å; V169-V244 HydrophobicContact CB-CB 4.29Å; V169-V244 HydrophobicContact CG1-CB 4.03Å; V169-V244 HydrophobicContact CG1-CG1 4.14Å; V169-V244 HydrophobicContact CG2-CB 4.1Å; V169-V244 HydrophobicContact CG2-CG2 4.21Å
170	I	98.6	Very high	95.6	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	130.1	177.5	-51.6	-53.8	0	0	0	108.9	M168 A221 P223 I226 I243 V244 D246 L251 M260	M168-I170 HydrophobicContact CE-CD1 3.76Å; I170-A221 WeakPolarHBondContact CA-O 3.24Å; I170-P223 HydrophobicContact CG2-CB 4.45Å; I170-P223 HydrophobicContact CG2-CG 3.66Å; I170-I226 HydrophobicContact CD1-CG2 3.94Å; I170-I243 HydrophobicContact CG1-CD1 3.83Å; I170-I243 HydrophobicContact CG1-CG1 4.22Å; I170-V244 PolarHBondContact N-O 3.3Å; I170-D246 PolarHBondContact O-N 2.83Å; I170-L251 HydrophobicContact CB-CD1 4.26Å; I170-L251 HydrophobicContact CG2-CD1 4.02Å; I170-L251 HydrophobicContact CG2-CD2 3.84Å; I170-L251 WeakPolarHBondContact O-CD1 3.33Å; I170-M260 HydrophobicContact CB-CE 4.32Å; I170-M260 HydrophobicContact CG1-CE 4.37Å; I170-M260 HydrophobicContact CG2-CE 4.03Å; I170-M260 HydrophobicContact CG2-SD 3.77Å
171	V	96.7	Very high	95.7	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.146	C	C	.	.			trans	-133.7	146.4	-178.8	-69.8	0	0	0	0	110.2	V169 T173 L176 A177 V180 A221 T222 P223 D246	V169-V171 HydrophobicContact CG1-CG1 4.19Å; V171-T173 VanDerWaalsContact C-N 3.34Å; V171-T173 PolarHBondContact O-N 3.23Å; V171-L176 HydrophobicContact CB-CB 4.37Å; V171-L176 HydrophobicContact CB-CD2 4.01Å; V171-L176 HydrophobicContact CB-CG 4.06Å; V171-L176 HydrophobicContact CG1-CD2 3.98Å; V171-L176 HydrophobicContact CG1-CG 3.93Å; V171-A177 HydrophobicContact CG2-CB 3.49Å; V171-A177 VanDerWaalsContact CG2-CB 3.49Å; V171-V180 HydrophobicContact CG1-CG2 4.45Å; V171-A221 PolarHBondContact N-O 3.14Å; V171-T222 WeakPolarHBondContact O-CA 3.18Å; V171-P223 WeakPolarHBondContact O-CD 3.43Å; V171-D246 HydrophobicContact CG1-CB 4.04Å
172	P	93.9	Very high	95.7	Very high	12 Å²	12	25.4 Å²	25.4	8%	0.078	12%	0.124	C	C	.	.	S	Bend	trans	-74.7	-22	-173	27.6	-37.2	0	0	0	114.1	D246 E247 K250 L251	P172-D246 VanDerWaalsContact CD-O 3.3Å; P172-D246 WeakPolarHBondContact CD-O 3.5Å; P172-E247 HydrophobicContact CG-CB 3.7Å; P172-E247 HydrophobicContact CG-CG 4.36Å; P172-K250 HydrophobicContact CB-CB 3.91Å; P172-K250 HydrophobicContact CB-CG 3.56Å; P172-K250 HydrophobicContact CG-CB 4.17Å; P172-K250 HydrophobicContact CG-CG 4.25Å; P172-L251 HydrophobicContact CB-CD2 4Å; P172-L251 HydrophobicContact CB-CG 4.45Å
173	T	91.5	Very high	95.7	Very high	21 Å²	21	21.7 Å²	21.7	13%	0.129	11%	0.109	C	C	.	.	S	Bend	trans	-124.8	149.6	-173.8	70.8	0	0	0	0	112.2	V171 E175 L176 A177	V171-T173 VanDerWaalsContact C-N 3.34Å; V171-T173 PolarHBondContact O-N 3.23Å; T173-E175 VanDerWaalsContact C-N 3.34Å; T173-L176 PolarHBondContact O-N 3.44Å; T173-L176 WeakPolarHBondContact OG1-CB 3.42Å; T173-L176 PolarHBondContact OG1-N 3.25Å; T173-A177 PolarHBondContact O-N 3.04Å; T173-A177 VanDerWaalsContact O-N 3.11Å
174	R	91.8	Very high	95.8	Very high	76 Å²	76	16 Å²	16	29%	0.287	8%	0.079	S	C	.	.	H	α-helix	trans	-67.3	-39.6	-176.5	-54.1	175.4	179	178.8	-8.4	110.9	A177 L178 T200 G201 T222 Q370	R174-A177 WeakPolarHBondContact O-CB 3.41Å; R174-A177 PolarHBondContact O-N 3.28Å; R174-L178 WeakPolarHBondContact O-CG 3.42Å; R174-L178 PolarHBondContact O-N 3.26Å; R174-L178 VanDerWaalsContact O-N 3.13Å; R174-T200 HydrophobicContact CB-CG2 4.18Å; R174-G201 WeakPolarHBondContact CD-O 3.42Å; R174-G201 PolarHBondContact NE-O 2.86Å; R174-G201 PolarHBondContact NH1-O 3.28Å; R174-G201 PolarHBondContact NH2-O 2.96Å; R174-T222 HydrophobicContact CG-CG2 4.04Å; R174-Q370 VanDerWaalsContact CD-CD 3.47Å
175	E	91	Very high	95.8	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.005	9%	0.089	C	C	.	.	H	α-helix	trans	-68.7	-35.8	178.6	-66.5	85.6	-177.7	0	0	112.5	T173 A177 L178 Q179 Q370 R373 F377 F394 I398	T173-E175 VanDerWaalsContact C-N 3.34Å; E175-A177 VanDerWaalsContact C-N 3.33Å; E175-L178 PolarHBondContact O-N 3.29Å; E175-Q179 PolarHBondContact O-N 3.5Å; E175-Q370 PolarHBondContact OE1-NE2 3.07Å; E175-R373 IonicContact OE1-CZ 2.71Å; E175-R373 IonicContact OE1-NE 3.75Å; E175-R373 PolarHBondContact OE1-NE 3.4Å; E175-R373 IonicContact OE1-NH2 2.84Å; E175-R373 PolarHBondContact OE1-NH2 3.37Å; E175-R373 IonicContact OE2-CZ 3.29Å; E175-R373 IonicContact OE2-NH2 3.73Å; E175-R373 PolarHBondContact OE2-NH2 3.01Å; E175-F377 HydrophobicContact CB-CD1 4.33Å; E175-F377 HydrophobicContact CB-CE1 4.4Å; E175-F377 HydrophobicContact CG-CD1 4.38Å; E175-F394 HydrophobicContact CB-CZ 4.21Å; E175-F394 HydrophobicContact CG-CE1 4.34Å; E175-F394 HydrophobicContact CG-CE2 3.9Å; E175-F394 HydrophobicContact CG-CZ 3.52Å; E175-I398 HydrophobicContact CB-CD1 3.61Å
176	L	92.5	Very high	95.7	Very high	1 Å²	1	22 Å²	22	1%	0.005	11%	0.107	C	C	.	.	H	α-helix	trans	-65.4	-39.5	172.6	-175	54.8	0	0	0	111.1	V171 T173 L178 Q179 V180 E247	V171-L176 HydrophobicContact CB-CB 4.37Å; V171-L176 HydrophobicContact CB-CD2 4.01Å; V171-L176 HydrophobicContact CB-CG 4.06Å; V171-L176 HydrophobicContact CG1-CD2 3.98Å; V171-L176 HydrophobicContact CG1-CG 3.93Å; T173-L176 PolarHBondContact O-N 3.44Å; T173-L176 WeakPolarHBondContact OG1-CB 3.42Å; T173-L176 PolarHBondContact OG1-N 3.25Å; L176-L178 VanDerWaalsContact C-N 3.33Å; L176-L178 PolarHBondContact O-N 3.43Å; L176-Q179 PolarHBondContact O-N 2.89Å; L176-V180 HydrophobicContact CD1-CG2 3.79Å; L176-V180 HydrophobicContact CG-CG2 4.12Å; L176-V180 WeakPolarHBondContact O-CB 3.25Å; L176-V180 VanDerWaalsContact O-CG2 3.31Å; L176-V180 WeakPolarHBondContact O-CG2 3.27Å; L176-V180 PolarHBondContact O-N 3.39Å; L176-E247 HydrophobicContact CD2-CG 3.98Å
177	A	95.4	Very high	95.6	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-59.1	-45.5	176.1	0	0	0	0	0	111.8	V171 T173 R174 E175 V180 S181 T200 I220	V171-A177 HydrophobicContact CG2-CB 3.49Å; V171-A177 VanDerWaalsContact CG2-CB 3.49Å; T173-A177 PolarHBondContact O-N 3.04Å; T173-A177 VanDerWaalsContact O-N 3.11Å; R174-A177 WeakPolarHBondContact O-CB 3.41Å; R174-A177 PolarHBondContact O-N 3.28Å; E175-A177 VanDerWaalsContact C-N 3.33Å; A177-V180 PolarHBondContact O-N 3.42Å; A177-S181 VanDerWaalsContact O-CB 3.29Å; A177-S181 WeakPolarHBondContact O-CB 3.43Å; A177-S181 PolarHBondContact O-N 3.24Å; A177-S181 PolarHBondContact O-OG 3.42Å; A177-T200 HydrophobicContact CB-CG2 3.47Å; A177-T200 VanDerWaalsContact CB-CG2 3.47Å; A177-I220 HydrophobicContact CB-CG2 4.2Å
178	L	92.9	Very high	95.6	Very high	50 Å²	50	21.8 Å²	21.8	26%	0.262	11%	0.106	S	C	.	.	H	α-helix	trans	-62.7	-45.3	176.7	-65.9	175.9	0	0	0	111.3	R174 E175 L176 S181 Q182 A198	R174-L178 WeakPolarHBondContact O-CG 3.42Å; R174-L178 PolarHBondContact O-N 3.26Å; R174-L178 VanDerWaalsContact O-N 3.13Å; E175-L178 PolarHBondContact O-N 3.29Å; L176-L178 VanDerWaalsContact C-N 3.33Å; L176-L178 PolarHBondContact O-N 3.43Å; L178-S181 WeakPolarHBondContact CA-OG 3.36Å; L178-S181 PolarHBondContact O-N 3.24Å; L178-S181 PolarHBondContact O-OG 3.46Å; L178-Q182 WeakPolarHBondContact O-CG 3.43Å; L178-Q182 PolarHBondContact O-N 3.3Å; L178-A198 HydrophobicContact CD2-CB 4.24Å
179	Q	93.6	Very high	95.4	Very high	4 Å²	4	27.1 Å²	27.1	2%	0.019	13%	0.13	C	C	.	.	H	α-helix	trans	-60.4	-51.4	177.3	-177.8	179.5	-66.6	0	0	112	E175 L176 S181 Q182 I183 G397	E175-Q179 PolarHBondContact O-N 3.5Å; L176-Q179 PolarHBondContact O-N 2.89Å; Q179-S181 VanDerWaalsContact C-N 3.28Å; Q179-S181 PolarHBondContact O-N 3.08Å; Q179-Q182 PolarHBondContact O-N 3.08Å; Q179-I183 HydrophobicContact CG-CD1 4.1Å; Q179-I183 WeakPolarHBondContact O-CG1 3.2Å; Q179-I183 PolarHBondContact O-N 3.01Å; Q179-G397 PolarHBondContact NE2-O 3.31Å; Q179-G397 VanDerWaalsContact NE2-O 3.1Å
180	V	96.8	Very high	95.3	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-63	-37.3	-179.8	176.6	0	0	0	0	110.6	Y150 L151 V169 V171 L176 A177 Q182 I183 C184 I220	Y150-V180 HydrophobicContact CE2-CG1 4.06Å; Y150-V180 WeakPolarHBondContact OH-CG2 3.49Å; L151-V180 HydrophobicContact CD1-CG1 4.2Å; L151-V180 HydrophobicContact CD2-CG1 4.19Å; V169-V180 HydrophobicContact CG1-CG1 4.28Å; V171-V180 HydrophobicContact CG1-CG2 4.45Å; L176-V180 HydrophobicContact CD1-CG2 3.79Å; L176-V180 HydrophobicContact CG-CG2 4.12Å; L176-V180 WeakPolarHBondContact O-CB 3.25Å; L176-V180 VanDerWaalsContact O-CG2 3.31Å; L176-V180 WeakPolarHBondContact O-CG2 3.27Å; L176-V180 PolarHBondContact O-N 3.39Å; A177-V180 PolarHBondContact O-N 3.42Å; V180-Q182 PolarHBondContact O-N 3.25Å; V180-I183 PolarHBondContact O-N 2.97Å; V180-C184 VanDerWaalsContact O-CB 3.27Å; V180-C184 WeakPolarHBondContact O-CB 3.28Å; V180-C184 PolarHBondContact O-N 3.21Å; V180-I220 HydrophobicContact CB-CG2 4.11Å; V180-I220 HydrophobicContact CG1-CD1 4.05Å; V180-I220 HydrophobicContact CG1-CG2 4.09Å
181	S	97	Very high	95.1	Very high	8 Å²	8	30.5 Å²	30.5	6%	0.056	15%	0.145	C	C	.	.	H	α-helix	trans	-65	-38	175.1	72.7	0	0	0	0	113.6	A177 L178 Q179 C184 I185	A177-S181 VanDerWaalsContact O-CB 3.29Å; A177-S181 WeakPolarHBondContact O-CB 3.43Å; A177-S181 PolarHBondContact O-N 3.24Å; A177-S181 PolarHBondContact O-OG 3.42Å; L178-S181 WeakPolarHBondContact CA-OG 3.36Å; L178-S181 PolarHBondContact O-N 3.24Å; L178-S181 PolarHBondContact O-OG 3.46Å; Q179-S181 VanDerWaalsContact C-N 3.28Å; Q179-S181 PolarHBondContact O-N 3.08Å; S181-C184 PolarHBondContact O-N 3.2Å; S181-I185 WeakPolarHBondContact O-CB 3.4Å; S181-I185 WeakPolarHBondContact O-CD1 3.4Å; S181-I185 WeakPolarHBondContact O-CG1 3.44Å; S181-I185 PolarHBondContact O-N 3.3Å
182	Q	95.4	Very high	94.4	Very high	82 Å²	82	34.3 Å²	34.3	38%	0.383	19%	0.185	S	C	.	.	H	α-helix	trans	-67.1	-44.5	176.7	-74.8	171.8	-11.8	0	0	110.3	L178 Q179 V180 C184 I185 Q186	L178-Q182 WeakPolarHBondContact O-CG 3.43Å; L178-Q182 PolarHBondContact O-N 3.3Å; Q179-Q182 PolarHBondContact O-N 3.08Å; V180-Q182 PolarHBondContact O-N 3.25Å; Q182-C184 VanDerWaalsContact C-N 3.33Å; Q182-C184 PolarHBondContact O-N 3.25Å; Q182-I185 PolarHBondContact O-N 2.89Å; Q182-Q186 WeakPolarHBondContact O-CG 3.3Å; Q182-Q186 PolarHBondContact O-N 3.15Å
183	I	96.1	Very high	94.1	Very high	25 Å²	25	35 Å²	35	13%	0.128	19%	0.194	C	C	.	.	H	α-helix	trans	-58.6	-48.1	174.8	-63.2	166.7	0	0	0	109.9	W116 L151 Q179 V180 I185 Q186 V187	W116-I183 HydrophobicContact CH2-CG2 3.6Å; W116-I183 HydrophobicContact CZ2-CG2 3.8Å; L151-I183 HydrophobicContact CD1-CB 4.1Å; L151-I183 HydrophobicContact CD1-CG2 3.65Å; Q179-I183 HydrophobicContact CG-CD1 4.1Å; Q179-I183 WeakPolarHBondContact O-CG1 3.2Å; Q179-I183 PolarHBondContact O-N 3.01Å; V180-I183 PolarHBondContact O-N 2.97Å; I183-I185 PolarHBondContact O-N 2.81Å; I183-Q186 PolarHBondContact O-N 3.31Å; I183-V187 HydrophobicContact CG2-CG2 4.15Å; I183-V187 VanDerWaalsContact O-CG2 3.25Å; I183-V187 WeakPolarHBondContact O-CG2 3.36Å; I183-V187 PolarHBondContact O-N 2.8Å
184	C	98.3	Very high	94.4	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-58.5	-48.1	179.5	-171	0	0	0	0	112.2	L151 V180 S181 Q182 Q186 V187 S188 V196 I220	L151-C184 HydrophobicContact CD1-CB 4.1Å; L151-C184 HydrophobicContact CD2-CB 3.91Å; V180-C184 VanDerWaalsContact O-CB 3.27Å; V180-C184 WeakPolarHBondContact O-CB 3.28Å; V180-C184 PolarHBondContact O-N 3.21Å; S181-C184 PolarHBondContact O-N 3.2Å; Q182-C184 VanDerWaalsContact C-N 3.33Å; Q182-C184 PolarHBondContact O-N 3.25Å; C184-Q186 VanDerWaalsContact C-N 3.32Å; C184-Q186 PolarHBondContact O-N 3.39Å; C184-V187 PolarHBondContact O-N 3.44Å; C184-S188 VanDerWaalsContact O-CB 3.28Å; C184-S188 WeakPolarHBondContact O-CB 3.44Å; C184-S188 PolarHBondContact O-N 3.43Å; C184-S188 PolarHBondContact O-OG 3Å; C184-S188 VanDerWaalsContact O-OG 3.08Å; C184-V196 HydrophobicContact CB-CG1 4.16Å; C184-V196 HydrophobicContact CB-CG2 4.42Å; C184-V196 VanDerWaalsContact SG-CG2 3.59Å; C184-I220 HydrophobicContact CB-CD1 3.77Å
185	I	97.4	Very high	94.6	Very high	78 Å²	78	36.1 Å²	36.1	40%	0.4	20%	0.202	S	C	.	.	H	α-helix	trans	-60.1	-41.7	177.9	-71.6	164.6	0	0	0	111.6	S181 Q182 I183 S188 K189 V196	S181-I185 WeakPolarHBondContact O-CB 3.4Å; S181-I185 WeakPolarHBondContact O-CD1 3.4Å; S181-I185 WeakPolarHBondContact O-CG1 3.44Å; S181-I185 PolarHBondContact O-N 3.3Å; Q182-I185 PolarHBondContact O-N 2.89Å; I183-I185 PolarHBondContact O-N 2.81Å; I185-S188 PolarHBondContact O-N 2.9Å; I185-S188 PolarHBondContact O-OG 3.27Å; I185-K189 PolarHBondContact O-N 2.91Å; I185-K189 VanDerWaalsContact O-N 3.15Å; I185-V196 HydrophobicContact CD1-CB 4.47Å; I185-V196 HydrophobicContact CG1-CB 3.78Å; I185-V196 HydrophobicContact CG1-CG1 4.27Å; I185-V196 HydrophobicContact CG1-CG2 4.13Å
186	Q	95.9	Very high	95	Very high	91 Å²	91	36.9 Å²	36.9	43%	0.425	21%	0.207	S	C	.	.	H	α-helix	trans	-71.6	-43.3	-178.3	-66.7	-63	-42.6	0	0	112	M114 Q182 I183 C184 S188 K189	M114-Q186 HydrophobicContact CE-CB 3.21Å; M114-Q186 HydrophobicContact CE-CG 3.7Å; M114-Q186 HydrophobicContact CG-CB 4.41Å; M114-Q186 HydrophobicContact SD-CB 3.47Å; M114-Q186 WeakPolarHBondContact SD-CB 3.29Å; M114-Q186 HydrophobicContact SD-CG 4.34Å; Q182-Q186 WeakPolarHBondContact O-CG 3.3Å; Q182-Q186 PolarHBondContact O-N 3.15Å; I183-Q186 PolarHBondContact O-N 3.31Å; C184-Q186 VanDerWaalsContact C-N 3.32Å; C184-Q186 PolarHBondContact O-N 3.39Å; Q186-S188 VanDerWaalsContact C-N 3.28Å; Q186-S188 PolarHBondContact O-N 3.31Å; Q186-K189 WeakPolarHBondContact O-CB 3.46Å; Q186-K189 PolarHBondContact O-N 3.43Å
187	V	97.4	Very high	95.2	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-63.6	-36	174.6	177	0	0	0	0	110.8	L107 G110 I111 M114 W116 L155 I183 C184 K189	L107-V187 HydrophobicContact CD1-CG1 3.59Å; G110-V187 WeakPolarHBondContact CA-O 3.5Å; I111-V187 HydrophobicContact CG1-CG1 4.08Å; M114-V187 HydrophobicContact CG-CG2 3.72Å; M114-V187 HydrophobicContact SD-CG2 4.18Å; W116-V187 HydrophobicContact CE3-CG2 4.44Å; W116-V187 HydrophobicContact CH2-CG2 3.6Å; W116-V187 HydrophobicContact CZ2-CG2 4.43Å; W116-V187 HydrophobicContact CZ3-CG2 3.6Å; L155-V187 HydrophobicContact CD1-CB 3.94Å; L155-V187 HydrophobicContact CD1-CG1 3.59Å; I183-V187 HydrophobicContact CG2-CG2 4.15Å; I183-V187 VanDerWaalsContact O-CG2 3.25Å; I183-V187 WeakPolarHBondContact O-CG2 3.36Å; I183-V187 PolarHBondContact O-N 2.8Å; C184-V187 PolarHBondContact O-N 3.44Å; V187-K189 VanDerWaalsContact C-N 3.33Å; V187-K189 PolarHBondContact O-N 3.45Å
188	S	97.6	Very high	95.3	Very high	8 Å²	8	38.6 Å²	38.6	6%	0.056	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	2.4	-179.6	76.4	0	0	0	0	114.7	C184 I185 Q186 H190 M191	C184-S188 VanDerWaalsContact O-CB 3.28Å; C184-S188 WeakPolarHBondContact O-CB 3.44Å; C184-S188 PolarHBondContact O-N 3.43Å; C184-S188 PolarHBondContact O-OG 3Å; C184-S188 VanDerWaalsContact O-OG 3.08Å; I185-S188 PolarHBondContact O-N 2.9Å; I185-S188 PolarHBondContact O-OG 3.27Å; Q186-S188 VanDerWaalsContact C-N 3.28Å; Q186-S188 PolarHBondContact O-N 3.31Å; S188-H190 VanDerWaalsContact C-N 3.29Å; S188-H190 PolarHBondContact O-N 3.28Å; S188-M191 WeakPolarHBondContact O-CB 3.25Å; S188-M191 PolarHBondContact O-N 3.47Å; S188-M191 VanDerWaalsContact O-N 3.08Å
189	K	95	Very high	95.5	Very high	113 Å²	113	36.3 Å²	36.3	49%	0.491	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-37.2	-168	175.2	-175.3	161.8	-154.6	0	114	E113 I185 Q186 V187	E113-K189 IonicContact OE2-NZ 3.06Å; E113-K189 PolarHBondContact OE2-NZ 3.42Å; I185-K189 PolarHBondContact O-N 2.91Å; I185-K189 VanDerWaalsContact O-N 3.15Å; Q186-K189 WeakPolarHBondContact O-CB 3.46Å; Q186-K189 PolarHBondContact O-N 3.43Å; V187-K189 VanDerWaalsContact C-N 3.33Å; V187-K189 PolarHBondContact O-N 3.45Å
190	H	95.8	Very high	95.5	Very high	54 Å²	54	36.3 Å²	36.3	25%	0.25	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-7.4	-177.5	-68.6	-77.2	0	0	0	113.9	E106 M109 E113 S188 G192	E106-H190 HydrophobicContact CB-CB 4.25Å; E106-H190 WeakPolarHBondContact O-CB 3.14Å; M109-H190 HydrophobicContact CB-CB 4.07Å; M109-H190 HydrophobicContact SD-CB 4.36Å; E113-H190 IonicContact OE1-CE1 3.14Å; E113-H190 IonicContact OE1-NE2 2.92Å; E113-H190 PolarHBondContact OE1-NE2 3.49Å; E113-H190 IonicContact OE2-CD2 2.67Å; E113-H190 IonicContact OE2-CE1 2.61Å; E113-H190 IonicContact OE2-NE2 2.78Å; E113-H190 PolarHBondContact OE2-NE2 2.99Å; S188-H190 VanDerWaalsContact C-N 3.29Å; S188-H190 PolarHBondContact O-N 3.28Å; H190-G192 PolarHBondContact O-N 3.4Å
191	M	95	Very high	95.1	Very high	16 Å²	16	37 Å²	37	8%	0.079	22%	0.216	C	C	.	.	S	Bend	trans	-71.7	-1.6	-177.8	-61	176.4	69.2	0	0	113.6	E106 L107 L155 L160 S188 G193 A194	E106-M191 HydrophobicContact CB-CG 4.22Å; L107-M191 HydrophobicContact CD1-SD 4.27Å; L155-M191 HydrophobicContact CB-SD 4.13Å; L155-M191 HydrophobicContact CD2-SD 4.32Å; L155-M191 VanDerWaalsContact O-CE 3.29Å; L155-M191 WeakPolarHBondContact O-CE 3.38Å; L160-M191 HydrophobicContact CD1-CB 4.04Å; L160-M191 HydrophobicContact CD1-CE 4.42Å; L160-M191 WeakPolarHBondContact CD1-O 3.38Å; S188-M191 WeakPolarHBondContact O-CB 3.25Å; S188-M191 PolarHBondContact O-N 3.47Å; S188-M191 VanDerWaalsContact O-N 3.08Å; M191-G193 PolarHBondContact O-N 3.5Å; M191-A194 HydrophobicContact CB-CB 4.29Å; M191-A194 HydrophobicContact SD-CB 4.4Å
192	G	82.7	Confident	94.5	Very high	81 Å²	81	39.1 Å²	39.1	84%	0.835	24%	0.238	S	C	*	.	S	Bend	trans	69	2.7	167.3	0	0	0	0	0	116.9	H190	H190-G192 PolarHBondContact O-N 3.4Å
193	G	87.7	Confident	94	Very high	25 Å²	25	37.6 Å²	37.6	26%	0.258	24%	0.235	S	C	.	.	S	Bend	trans	-170.6	-8.1	-176.9	0	0	0	0	0	115.8	M191 K195 H217	M191-G193 PolarHBondContact O-N 3.5Å; G193-K195 WeakPolarHBondContact O-CG 3.39Å; G193-K195 PolarHBondContact O-N 3.24Å; G193-H217 PolarHBondContact O-CE1 2.83Å; G193-H217 PolarHBondContact O-ND1 2.86Å
194	A	96.3	Very high	93.6	Very high	18 Å²	18	40.4 Å²	40.4	15%	0.149	25%	0.25	C	S	.	.			trans	-59.3	128.4	177.6	0	0	0	0	0	110.7	L160 M191	L160-A194 HydrophobicContact CD2-CB 4.03Å; M191-A194 HydrophobicContact CB-CB 4.29Å; M191-A194 HydrophobicContact SD-CB 4.4Å
195	K	97.6	Very high	93.3	Very high	103 Å²	103	42.7 Å²	42.7	45%	0.448	26%	0.262	S	S	.	.			trans	-120.6	110.2	-177.6	-63.6	-56.9	-178.5	179.6	0	108.4	G193 T215 H217 V218	G193-K195 WeakPolarHBondContact O-CG 3.39Å; G193-K195 PolarHBondContact O-N 3.24Å; K195-T215 VanDerWaalsContact CB-O 3.27Å; K195-T215 WeakPolarHBondContact CB-O 3.4Å; K195-T215 HydrophobicContact CG-CG2 4.46Å; K195-T215 WeakPolarHBondContact CG-O 3.45Å; K195-H217 PolarHBondContact N-ND1 2.97Å; K195-H217 VanDerWaalsContact N-ND1 3.14Å; K195-H217 PolarHBondContact O-N 2.85Å; K195-V218 PolarHBondContact O-N 3.15Å; K195-V218 VanDerWaalsContact O-N 3.07Å
196	V	98.1	Very high	93.1	Very high	18 Å²	18	47.3 Å²	47.3	11%	0.109	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	136.4	-178.7	-174.2	0	0	0	0	108.7	C184 I185 V218 I220	C184-V196 HydrophobicContact CB-CG1 4.16Å; C184-V196 HydrophobicContact CB-CG2 4.42Å; C184-V196 VanDerWaalsContact SG-CG2 3.59Å; I185-V196 HydrophobicContact CD1-CB 4.47Å; I185-V196 HydrophobicContact CG1-CB 3.78Å; I185-V196 HydrophobicContact CG1-CG1 4.27Å; I185-V196 HydrophobicContact CG1-CG2 4.13Å; V196-V218 CarbonylContact C-O 3.27Å; V196-V218 WeakPolarHBondContact CA-O 3.36Å; V196-V218 HydrophobicContact CG1-CB 4.36Å; V196-V218 HydrophobicContact CG1-CG1 4.46Å; V196-V218 HydrophobicContact CG2-CB 4.28Å; V196-I220 HydrophobicContact CG1-CD1 3.65Å; V196-I220 HydrophobicContact CG1-CG1 4.42Å
197	M	97.4	Very high	93	Very high	8 Å²	8	47.2 Å²	47.2	4%	0.039	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	131.8	174.6	178.1	177.7	176	0	0	109.7	D208 R211 L212 V216 V218 V219 I220	M197-D208 HydrophobicContact CE-CB 3.66Å; M197-D208 WeakPolarHBondContact CE-O 3.36Å; M197-R211 HydrophobicContact CE-CB 4.09Å; M197-R211 HydrophobicContact CE-CG 4.09Å; M197-R211 HydrophobicContact CG-CG 4.05Å; M197-R211 HydrophobicContact SD-CB 4.24Å; M197-R211 HydrophobicContact SD-CG 3.68Å; M197-L212 HydrophobicContact CE-CD1 4.24Å; M197-L212 HydrophobicContact CE-CG 3.95Å; M197-L212 HydrophobicContact SD-CD1 4.47Å; M197-L212 HydrophobicContact SD-CD2 3.72Å; M197-L212 HydrophobicContact SD-CG 3.73Å; M197-V216 HydrophobicContact CB-CG1 3.66Å; M197-V216 HydrophobicContact CB-CG2 4.07Å; M197-V216 HydrophobicContact SD-CG2 4.05Å; M197-V218 PolarHBondContact N-O 3.24Å; M197-V219 WeakPolarHBondContact O-CA 3.42Å; M197-I220 PolarHBondContact O-N 2.92Å
198	A	97	Very high	92.9	Very high	29 Å²	29	48 Å²	48	24%	0.24	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	130.3	165.9	0	0	0	0	0	109.4	L178 I220	L178-A198 HydrophobicContact CD2-CB 4.24Å; A198-I220 CarbonylContact C-O 3.59Å; A198-I220 VanDerWaalsContact CA-O 3.24Å; A198-I220 WeakPolarHBondContact CA-O 3.32Å
199	T	96.9	Very high	92.7	Very high	2 Å²	2	50.1 Å²	50.1	1%	0.012	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	126.8	175.2	179.1	0	0	0	0	111.5	D208 V219 I220 A221 T222 R225 I226 L229	T199-D208 PolarHBondContact OG1-OD2 2.8Å; T199-V219 HydrophobicContact CG2-CG1 3.87Å; T199-I220 PolarHBondContact N-O 3.11Å; T199-A221 HydrophobicContact CG2-CB 3.57Å; T199-A221 WeakPolarHBondContact O-CA 3.24Å; T199-A221 WeakPolarHBondContact O-CB 3.46Å; T199-T222 PolarHBondContact O-N 3.44Å; T199-R225 HydrophobicContact CG2-CG 4.37Å; T199-R225 WeakPolarHBondContact OG1-CG 3.17Å; T199-I226 HydrophobicContact CG2-CD1 4.49Å; T199-L229 HydrophobicContact CG2-CD1 4.03Å; T199-L229 WeakPolarHBondContact OG1-CD1 3.4Å
200	T	94.8	Very high	92.8	Very high	4 Å²	4	49.8 Å²	49.8	3%	0.025	29%	0.293	C	S	.	.			trans	-142	152.9	-172.3	74.7	0	0	0	0	111.6	R174 A177 T203 T222 R225	R174-T200 HydrophobicContact CB-CG2 4.18Å; A177-T200 HydrophobicContact CB-CG2 3.47Å; A177-T200 VanDerWaalsContact CB-CG2 3.47Å; T200-T203 PolarHBondContact O-OG1 2.84Å; T200-T222 WeakPolarHBondContact CA-OG1 3.49Å; T200-T222 HydrophobicContact CG2-CG2 4.05Å; T200-R225 PolarHBondContact O-NH1 3.41Å; T200-R225 PolarHBondContact O-NH2 3.33Å
201	G	88.4	Confident	92.7	Very high	15 Å²	15	50.4 Å²	50.4	16%	0.155	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	153.8	174.2	0	0	0	0	0	112.2	R174 T203 T222	R174-G201 WeakPolarHBondContact CD-O 3.42Å; R174-G201 PolarHBondContact NE-O 2.86Å; R174-G201 PolarHBondContact NH1-O 3.28Å; R174-G201 PolarHBondContact NH2-O 2.96Å; G201-T203 PolarHBondContact O-N 3.37Å; G201-T222 PolarHBondContact N-OG1 3.49Å
202	G	84.5	Confident	92.8	Very high	51 Å²	51	51 Å²	51	53%	0.526	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.3	1.8	176.8	0	0	0	0	0	115.8
203	T	84.7	Confident	93.3	Very high	50 Å²	50	53.3 Å²	53.3	31%	0.307	29%	0.289	S	S	.	.	S	Bend	trans	-91.6	164.8	159.3	66.3	0	0	0	0	110.3	T200 G201 L205 R225	T200-T203 PolarHBondContact O-OG1 2.84Å; G201-T203 PolarHBondContact O-N 3.37Å; T203-L205 PolarHBondContact O-N 2.88Å; T203-R225 PolarHBondContact O-NH1 3.05Å; T203-R225 PolarHBondContact O-NH2 2.92Å; T203-R225 PolarHBondContact OG1-NH1 3.07Å
204	N	87.8	Confident	93.6	Very high	84 Å²	84	57.3 Å²	57.3	45%	0.449	31%	0.305	S	S	.	.			trans	-66	119.3	178.1	-178.3	3.5	0	0	0	110.9	R206 D207	N204-R206 VanDerWaalsContact C-N 3.27Å; N204-R206 PolarHBondContact O-N 3.19Å; N204-R206 WeakPolarHBondContact OD1-CB 3.48Å; N204-R206 PolarHBondContact OD1-N 3.11Å; N204-D207 HydrophobicContact CB-CB 4.43Å; N204-D207 VanDerWaalsContact CB-OD2 3.3Å; N204-D207 WeakPolarHBondContact CB-OD2 3.38Å; N204-D207 VanDerWaalsContact ND2-CG 3.27Å; N204-D207 PolarHBondContact ND2-OD1 3.13Å; N204-D207 VanDerWaalsContact ND2-OD1 3.1Å; N204-D207 PolarHBondContact ND2-OD2 2.98Å; N204-D207 PolarHBondContact O-N 2.77Å
205	L	91.4	Very high	93.5	Very high	48 Å²	48	58.4 Å²	58.4	25%	0.251	31%	0.31	S	S	.	.	H	α-helix	trans	-63	-34.6	179.9	179.3	66.1	0	0	0	111.9	T203 D207 D208 I209 L229 K232	T203-L205 PolarHBondContact O-N 2.88Å; L205-D207 VanDerWaalsContact C-N 3.29Å; L205-D207 PolarHBondContact O-N 2.99Å; L205-D208 PolarHBondContact O-N 3.49Å; L205-I209 HydrophobicContact CD1-CD1 4.41Å; L205-I209 HydrophobicContact CD1-CG1 4.43Å; L205-I209 HydrophobicContact CD2-CD1 4.27Å; L205-I209 HydrophobicContact CG-CD1 3.85Å; L205-I209 HydrophobicContact CG-CG1 4.3Å; L205-I209 VanDerWaalsContact O-CG1 3.31Å; L205-I209 WeakPolarHBondContact O-CG1 3.4Å; L205-I209 PolarHBondContact O-N 3.39Å; L205-L229 HydrophobicContact CD1-CD2 3.61Å; L205-L229 HydrophobicContact CD1-CG 4.3Å; L205-K232 HydrophobicContact CD2-CD 4.36Å
206	R	93.7	Very high	93.6	Very high	175 Å²	175	53.8 Å²	53.8	66%	0.66	29%	0.29	S	S	*	.	H	α-helix	trans	-61.9	-40.3	-178.7	-176.8	178.7	177.6	174.8	0.6	111.6	N204 D208 I209 M210	N204-R206 VanDerWaalsContact C-N 3.27Å; N204-R206 PolarHBondContact O-N 3.19Å; N204-R206 WeakPolarHBondContact OD1-CB 3.48Å; N204-R206 PolarHBondContact OD1-N 3.11Å; R206-D208 VanDerWaalsContact C-N 3.33Å; R206-I209 PolarHBondContact O-N 3.1Å; R206-M210 HydrophobicContact CG-SD 4.19Å; R206-M210 WeakPolarHBondContact O-CG 3.27Å; R206-M210 PolarHBondContact O-N 3.11Å
207	D	93.5	Very high	93.6	Very high	90 Å²	90	53.1 Å²	53.1	48%	0.481	29%	0.286	S	S	.	.	H	α-helix	trans	-67.7	-38.2	-179.1	-57.7	-17.6	0	0	0	110.5	N204 L205 M210 R211	N204-D207 HydrophobicContact CB-CB 4.43Å; N204-D207 VanDerWaalsContact CB-OD2 3.3Å; N204-D207 WeakPolarHBondContact CB-OD2 3.38Å; N204-D207 VanDerWaalsContact ND2-CG 3.27Å; N204-D207 PolarHBondContact ND2-OD1 3.13Å; N204-D207 VanDerWaalsContact ND2-OD1 3.1Å; N204-D207 PolarHBondContact ND2-OD2 2.98Å; N204-D207 PolarHBondContact O-N 2.77Å; L205-D207 VanDerWaalsContact C-N 3.29Å; L205-D207 PolarHBondContact O-N 2.99Å; D207-M210 PolarHBondContact O-N 2.88Å; D207-R211 WeakPolarHBondContact O-CB 3.27Å; D207-R211 PolarHBondContact O-N 3.04Å
208	D	95	Very high	93.7	Very high	16 Å²	16	52.7 Å²	52.7	9%	0.086	28%	0.284	C	S	.	.	H	α-helix	trans	-64.8	-41.9	173.7	-71.7	-10.4	0	0	0	111.6	M197 T199 L205 R206 R211 L212 R225 L229	M197-D208 HydrophobicContact CE-CB 3.66Å; M197-D208 WeakPolarHBondContact CE-O 3.36Å; T199-D208 PolarHBondContact OG1-OD2 2.8Å; L205-D208 PolarHBondContact O-N 3.49Å; R206-D208 VanDerWaalsContact C-N 3.33Å; D208-R211 PolarHBondContact O-N 2.79Å; D208-L212 WeakPolarHBondContact O-CG 3.43Å; D208-L212 PolarHBondContact O-N 3.48Å; D208-R225 IonicContact OD2-CZ 2.81Å; D208-R225 IonicContact OD2-NH1 3.31Å; D208-R225 PolarHBondContact OD2-NH1 3.33Å; D208-L229 HydrophobicContact CB-CD1 4.37Å
209	I	94.5	Very high	93.7	Very high	53 Å²	53	51.4 Å²	51.4	27%	0.272	27%	0.273	S	S	.	.	H	α-helix	trans	-61.8	-50.1	176.8	-67	169	0	0	0	110.1	L205 R206 R211 L212 D213 L229 V234	L205-I209 HydrophobicContact CD1-CD1 4.41Å; L205-I209 HydrophobicContact CD1-CG1 4.43Å; L205-I209 HydrophobicContact CD2-CD1 4.27Å; L205-I209 HydrophobicContact CG-CD1 3.85Å; L205-I209 HydrophobicContact CG-CG1 4.3Å; L205-I209 VanDerWaalsContact O-CG1 3.31Å; L205-I209 WeakPolarHBondContact O-CG1 3.4Å; L205-I209 PolarHBondContact O-N 3.39Å; R206-I209 PolarHBondContact O-N 3.1Å; I209-R211 VanDerWaalsContact C-N 3.27Å; I209-R211 PolarHBondContact O-N 2.94Å; I209-L212 PolarHBondContact O-N 3.27Å; I209-D213 PolarHBondContact O-N 3.48Å; I209-L229 HydrophobicContact CG1-CD2 4.16Å; I209-V234 HydrophobicContact CB-CG1 4.26Å; I209-V234 HydrophobicContact CG1-CG1 4.07Å; I209-V234 HydrophobicContact CG1-CG2 4.22Å; I209-V234 HydrophobicContact CG2-CG1 4.06Å
210	M	95.3	Very high	93.8	Very high	106 Å²	106	51.3 Å²	51.3	52%	0.522	27%	0.272	S	S	.	.	H	α-helix	trans	-60.6	-37.4	177.9	-70.3	178.6	65.8	0	0	111.9	R206 D207 L212 D213	R206-M210 HydrophobicContact CG-SD 4.19Å; R206-M210 WeakPolarHBondContact O-CG 3.27Å; R206-M210 PolarHBondContact O-N 3.11Å; D207-M210 PolarHBondContact O-N 2.88Å; M210-L212 VanDerWaalsContact C-N 3.28Å; M210-L212 PolarHBondContact O-N 3.08Å; M210-D213 WeakPolarHBondContact O-CB 3.34Å; M210-D213 PolarHBondContact O-N 3.06Å
211	R	94.8	Very high	94	Very high	67 Å²	67	51.1 Å²	51.1	25%	0.253	27%	0.271	S	S	.	.	H	α-helix	trans	-66.4	-30.2	176.5	178	58.3	-171.4	95	-1.5	112.7	M197 D207 D208 I209 D213 D214 T215	M197-R211 HydrophobicContact CE-CB 4.09Å; M197-R211 HydrophobicContact CE-CG 4.09Å; M197-R211 HydrophobicContact CG-CG 4.05Å; M197-R211 HydrophobicContact SD-CB 4.24Å; M197-R211 HydrophobicContact SD-CG 3.68Å; D207-R211 WeakPolarHBondContact O-CB 3.27Å; D207-R211 PolarHBondContact O-N 3.04Å; D208-R211 PolarHBondContact O-N 2.79Å; I209-R211 VanDerWaalsContact C-N 3.27Å; I209-R211 PolarHBondContact O-N 2.94Å; R211-D213 VanDerWaalsContact C-N 3.3Å; R211-D214 PolarHBondContact O-N 3.43Å; R211-T215 PolarHBondContact NH1-O 3.13Å; R211-T215 PolarHBondContact NH2-O 3.33Å
212	L	96.2	Very high	94.4	Very high	27 Å²	27	51 Å²	51	14%	0.141	27%	0.268	C	S	.	.	H	α-helix	trans	-79.5	-10.8	177.5	-76	167.2	0	0	0	113.4	I165 M197 D208 I209 M210 D214 V216 L229 V234 A235	I165-L212 HydrophobicContact CD1-CD2 4.07Å; M197-L212 HydrophobicContact CE-CD1 4.24Å; M197-L212 HydrophobicContact CE-CG 3.95Å; M197-L212 HydrophobicContact SD-CD1 4.47Å; M197-L212 HydrophobicContact SD-CD2 3.72Å; M197-L212 HydrophobicContact SD-CG 3.73Å; D208-L212 WeakPolarHBondContact O-CG 3.43Å; D208-L212 PolarHBondContact O-N 3.48Å; I209-L212 PolarHBondContact O-N 3.27Å; M210-L212 VanDerWaalsContact C-N 3.28Å; M210-L212 PolarHBondContact O-N 3.08Å; L212-D214 VanDerWaalsContact C-N 3.25Å; L212-V216 HydrophobicContact CD2-CB 4.45Å; L212-V216 HydrophobicContact CD2-CG2 4.12Å; L212-L229 HydrophobicContact CD1-CD1 4.09Å; L212-L229 HydrophobicContact CD1-CD2 4.17Å; L212-V234 HydrophobicContact CB-CG1 3.89Å; L212-V234 HydrophobicContact CD1-CB 4.49Å; L212-V234 HydrophobicContact CD1-CG1 3.66Å; L212-V234 HydrophobicContact CG-CG1 4.42Å; L212-A235 HydrophobicContact CD1-CB 4.13Å
213	D	92.9	Very high	95	Very high	130 Å²	130	48.6 Å²	48.6	70%	0.695	24%	0.243	S	C	*	.	H	α-helix	trans	-70.5	-26.4	168.3	-66.2	-32.8	0	0	0	111.5	I209 M210 R211	I209-D213 PolarHBondContact O-N 3.48Å; M210-D213 WeakPolarHBondContact O-CB 3.34Å; M210-D213 PolarHBondContact O-N 3.06Å; R211-D213 VanDerWaalsContact C-N 3.3Å
214	D	94.3	Very high	95.6	Very high	109 Å²	109	48 Å²	48	58%	0.583	25%	0.247	S	C	*	.	S	Bend	trans	-87.8	159.7	170.7	-69.2	-39.9	0	0	0	111.7	R211 L212 V216	R211-D214 PolarHBondContact O-N 3.43Å; L212-D214 VanDerWaalsContact C-N 3.25Å; D214-V216 PolarHBondContact O-N 3.15Å
215	T	95.7	Very high	96	Very high	42 Å²	42	45.3 Å²	45.3	26%	0.258	23%	0.23	S	C	.	.			trans	-54.6	130	174.7	-57.2	0	0	0	0	112.3	D163 K195 R211	D163-T215 HydrophobicContact CB-CG2 3.96Å; D163-T215 WeakPolarHBondContact CB-OG1 3.43Å; D163-T215 VanDerWaalsContact CG-OG1 3.28Å; D163-T215 VanDerWaalsContact OD1-CG2 3.23Å; D163-T215 WeakPolarHBondContact OD1-CG2 3.34Å; D163-T215 PolarHBondContact OD1-OG1 2.74Å; K195-T215 VanDerWaalsContact CB-O 3.27Å; K195-T215 WeakPolarHBondContact CB-O 3.4Å; K195-T215 HydrophobicContact CG-CG2 4.46Å; K195-T215 WeakPolarHBondContact CG-O 3.45Å; R211-T215 PolarHBondContact NH1-O 3.13Å; R211-T215 PolarHBondContact NH2-O 3.33Å
216	V	98.2	Very high	96.3	Very high	5 Å²	5	43.1 Å²	43.1	3%	0.03	22%	0.219	C	C	.	.			trans	-132	121.6	169.9	178.2	0	0	0	0	108.5	N164 I165 M197 L212 D214 V218 V219	N164-V216 CarbonylContact C-O 3.44Å; I165-V216 VanDerWaalsContact CA-O 3.27Å; I165-V216 WeakPolarHBondContact CA-O 3.46Å; I165-V216 HydrophobicContact CG1-CB 4.34Å; I165-V216 HydrophobicContact CG1-CG1 4.4Å; I165-V216 WeakPolarHBondContact CG1-O 3.44Å; I165-V216 PolarHBondContact N-O 2.85Å; M197-V216 HydrophobicContact CB-CG1 3.66Å; M197-V216 HydrophobicContact CB-CG2 4.07Å; M197-V216 HydrophobicContact SD-CG2 4.05Å; L212-V216 HydrophobicContact CD2-CB 4.45Å; L212-V216 HydrophobicContact CD2-CG2 4.12Å; D214-V216 PolarHBondContact O-N 3.15Å; V216-V218 WeakPolarHBondContact CG1-O 3.01Å; V216-V219 HydrophobicContact CG1-CG2 3.63Å
217	H	98.7	Very high	96.5	Very high	4 Å²	4	35.3 Å²	35.3	2%	0.019	19%	0.19	C	C	.	.	S	Bend	trans	-92.7	-37.6	178	-62.1	109.4	0	0	0	111.8	L158 K162 Q166 A167 G193 K195	L158-H217 HydrophobicContact CD1-CB 4.32Å; K162-H217 PolarHBondContact O-CD2 3.37Å; K162-H217 PolarHBondContact O-NE2 3.02Å; Q166-H217 PolarHBondContact N-O 2.85Å; A167-H217 PolarHBondContact N-O 2.95Å; G193-H217 PolarHBondContact O-CE1 2.83Å; G193-H217 PolarHBondContact O-ND1 2.86Å; K195-H217 PolarHBondContact N-ND1 2.97Å; K195-H217 VanDerWaalsContact N-ND1 3.14Å; K195-H217 PolarHBondContact O-N 2.85Å
218	V	98.8	Very high	96.7	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	128.2	-176.8	-175.6	0	0	0	0	110.3	L154 L158 A167 K195 V196 M197 V216 I220	L154-V218 HydrophobicContact CD2-CB 4.47Å; L154-V218 HydrophobicContact CD2-CG1 3.9Å; L154-V218 HydrophobicContact CD2-CG2 3.65Å; L158-V218 HydrophobicContact CD1-CG2 3.64Å; L158-V218 HydrophobicContact CD2-CG2 3.97Å; L158-V218 HydrophobicContact CG-CG2 4.39Å; A167-V218 WeakPolarHBondContact O-CA 3.23Å; K195-V218 PolarHBondContact O-N 3.15Å; K195-V218 VanDerWaalsContact O-N 3.07Å; V196-V218 CarbonylContact C-O 3.27Å; V196-V218 WeakPolarHBondContact CA-O 3.36Å; V196-V218 HydrophobicContact CG1-CB 4.36Å; V196-V218 HydrophobicContact CG1-CG1 4.46Å; V196-V218 HydrophobicContact CG2-CB 4.28Å; M197-V218 PolarHBondContact N-O 3.24Å; V216-V218 WeakPolarHBondContact CG1-O 3.01Å; V218-I220 HydrophobicContact CG1-CD1 4.5Å; V218-I220 HydrophobicContact CG1-CG1 4.18Å
219	V	98.7	Very high	96.8	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.006	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	124.1	172.9	174.5	0	0	0	0	110.3	I165 A167 M168 V169 M197 T199 V216 A221 I226	I165-V219 HydrophobicContact CD1-CG2 3.86Å; I165-V219 HydrophobicContact CG1-CG2 4.14Å; I165-V219 HydrophobicContact CG2-CB 4.39Å; I165-V219 HydrophobicContact CG2-CG2 3.86Å; A167-V219 PolarHBondContact O-N 3.16Å; M168-V219 CarbonylContact C-O 3.59Å; M168-V219 VanDerWaalsContact CA-O 3.26Å; M168-V219 WeakPolarHBondContact CA-O 3.1Å; M168-V219 HydrophobicContact CG-CB 4.33Å; V169-V219 PolarHBondContact N-O 2.67Å; M197-V219 WeakPolarHBondContact O-CA 3.42Å; T199-V219 HydrophobicContact CG2-CG1 3.87Å; V216-V219 HydrophobicContact CG1-CG2 3.63Å; V219-A221 HydrophobicContact CG1-CB 3.99Å; V219-I226 HydrophobicContact CG1-CD1 3.85Å; V219-I226 HydrophobicContact CG1-CG1 4.44Å
220	I	98.8	Very high	97	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	117	174.8	-61.1	163.1	0	0	0	107.5	V169 A177 V180 C184 V196 M197 A198 T199 V218	V169-I220 HydrophobicContact CB-CB 4.47Å; V169-I220 HydrophobicContact CB-CG1 3.98Å; V169-I220 HydrophobicContact CB-CG2 4.34Å; V169-I220 HydrophobicContact CG2-CG1 4.12Å; V169-I220 CarbonylContact O-C 3.12Å; V169-I220 WeakPolarHBondContact O-CA 3.33Å; A177-I220 HydrophobicContact CB-CG2 4.2Å; V180-I220 HydrophobicContact CB-CG2 4.11Å; V180-I220 HydrophobicContact CG1-CD1 4.05Å; V180-I220 HydrophobicContact CG1-CG2 4.09Å; C184-I220 HydrophobicContact CB-CD1 3.77Å; V196-I220 HydrophobicContact CG1-CD1 3.65Å; V196-I220 HydrophobicContact CG1-CG1 4.42Å; M197-I220 PolarHBondContact O-N 2.92Å; A198-I220 CarbonylContact C-O 3.59Å; A198-I220 VanDerWaalsContact CA-O 3.24Å; A198-I220 WeakPolarHBondContact CA-O 3.32Å; T199-I220 PolarHBondContact N-O 3.11Å; V218-I220 HydrophobicContact CG1-CD1 4.5Å; V218-I220 HydrophobicContact CG1-CG1 4.18Å
221	A	98.4	Very high	97.1	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	157.5	-164.7	0	0	0	0	0	115.9	V169 I170 V171 T199 V219 I226	V169-A221 PolarHBondContact O-N 3.3Å; I170-A221 WeakPolarHBondContact CA-O 3.24Å; V171-A221 PolarHBondContact N-O 3.14Å; T199-A221 HydrophobicContact CG2-CB 3.57Å; T199-A221 WeakPolarHBondContact O-CA 3.24Å; T199-A221 WeakPolarHBondContact O-CB 3.46Å; V219-A221 HydrophobicContact CG1-CB 3.99Å; A221-I226 HydrophobicContact CB-CB 3.69Å; A221-I226 HydrophobicContact CB-CG1 4.29Å; A221-I226 HydrophobicContact CB-CG2 4.06Å
222	T	96.7	Very high	97.2	Very high	13 Å²	13	35.4 Å²	35.4	8%	0.08	19%	0.186	C	C	.	.			trans	-84.9	142.2	163.5	59	0	0	0	0	110.7	V171 R174 T199 T200 G201 G224 R225 I226	V171-T222 WeakPolarHBondContact O-CA 3.18Å; R174-T222 HydrophobicContact CG-CG2 4.04Å; T199-T222 PolarHBondContact O-N 3.44Å; T200-T222 WeakPolarHBondContact CA-OG1 3.49Å; T200-T222 HydrophobicContact CG2-CG2 4.05Å; G201-T222 PolarHBondContact N-OG1 3.49Å; T222-G224 PolarHBondContact O-N 3.38Å; T222-R225 PolarHBondContact O-N 2.86Å; T222-I226 PolarHBondContact O-N 3.38Å
223	P	97.5	Very high	97.1	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-50.5	-52.1	-169.6	-27.8	30.8	0	0	0	114.9	I170 V171 R225 I226 L227 L251 F256 I259 M260 I263	I170-P223 HydrophobicContact CG2-CB 4.45Å; I170-P223 HydrophobicContact CG2-CG 3.66Å; V171-P223 WeakPolarHBondContact O-CD 3.43Å; P223-R225 VanDerWaalsContact C-N 3.32Å; P223-R225 PolarHBondContact O-N 2.88Å; P223-I226 VanDerWaalsContact O-CG2 3.27Å; P223-I226 WeakPolarHBondContact O-CG2 3.41Å; P223-I226 PolarHBondContact O-N 3.37Å; P223-L227 WeakPolarHBondContact O-CB 3.29Å; P223-L227 PolarHBondContact O-N 2.93Å; P223-L251 HydrophobicContact CG-CD2 3.64Å; P223-F256 HydrophobicContact CG-CD1 4.43Å; P223-F256 HydrophobicContact CG-CG 4.48Å; P223-I259 HydrophobicContact CB-CB 4.41Å; P223-I259 HydrophobicContact CB-CG2 3.55Å; P223-M260 HydrophobicContact CB-SD 3.97Å; P223-M260 HydrophobicContact CG-SD 3.8Å; P223-I263 HydrophobicContact CB-CD1 4.02Å
224	G	96.2	Very high	97.2	Very high	38 Å²	38	32 Å²	32	39%	0.392	18%	0.181	S	C	.	.	H	α-helix	trans	-62.6	-35.4	-173.8	0	0	0	0	0	114	T222 D228	T222-G224 PolarHBondContact O-N 3.38Å; G224-D228 WeakPolarHBondContact O-CB 3.29Å; G224-D228 PolarHBondContact O-N 3.39Å
225	R	96.4	Very high	97.4	Very high	28 Å²	28	27 Å²	27	11%	0.106	15%	0.154	C	C	.	.	H	α-helix	trans	-75.3	-44.4	-179.5	172.3	57.4	63.1	79.9	3	111.9	T199 T200 T203 D208 T222 P223 L227 D228 L229	T199-R225 HydrophobicContact CG2-CG 4.37Å; T199-R225 WeakPolarHBondContact OG1-CG 3.17Å; T200-R225 PolarHBondContact O-NH1 3.41Å; T200-R225 PolarHBondContact O-NH2 3.33Å; T203-R225 PolarHBondContact O-NH1 3.05Å; T203-R225 PolarHBondContact O-NH2 2.92Å; T203-R225 PolarHBondContact OG1-NH1 3.07Å; D208-R225 IonicContact OD2-CZ 2.81Å; D208-R225 IonicContact OD2-NH1 3.31Å; D208-R225 PolarHBondContact OD2-NH1 3.33Å; T222-R225 PolarHBondContact O-N 2.86Å; P223-R225 VanDerWaalsContact C-N 3.32Å; P223-R225 PolarHBondContact O-N 2.88Å; R225-L227 VanDerWaalsContact C-N 3.31Å; R225-L227 PolarHBondContact O-N 3.28Å; R225-D228 PolarHBondContact O-N 2.92Å; R225-L229 HydrophobicContact CG-CD1 4.16Å; R225-L229 WeakPolarHBondContact O-CG 3.31Å; R225-L229 PolarHBondContact O-N 3.24Å; R225-L229 VanDerWaalsContact O-N 3.08Å
226	I	98	Very high	97.5	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.01	17%	0.173	C	C	.	.	H	α-helix	trans	-67.1	-37.7	-179.8	-171.4	51.5	0	0	0	111.3	M168 I170 T199 V219 A221 T222 P223 D228 L229 I230 A235 I263	M168-I226 HydrophobicContact CE-CD1 4.28Å; M168-I226 HydrophobicContact CE-CG1 3.46Å; M168-I226 VanDerWaalsContact CE-CG1 3.46Å; M168-I226 HydrophobicContact CE-CG2 4.47Å; I170-I226 HydrophobicContact CD1-CG2 3.94Å; T199-I226 HydrophobicContact CG2-CD1 4.49Å; V219-I226 HydrophobicContact CG1-CD1 3.85Å; V219-I226 HydrophobicContact CG1-CG1 4.44Å; A221-I226 HydrophobicContact CB-CB 3.69Å; A221-I226 HydrophobicContact CB-CG1 4.29Å; A221-I226 HydrophobicContact CB-CG2 4.06Å; T222-I226 PolarHBondContact O-N 3.38Å; P223-I226 VanDerWaalsContact O-CG2 3.27Å; P223-I226 WeakPolarHBondContact O-CG2 3.41Å; P223-I226 PolarHBondContact O-N 3.37Å; I226-D228 VanDerWaalsContact C-N 3.32Å; I226-D228 PolarHBondContact O-N 3.5Å; I226-L229 PolarHBondContact O-N 3.45Å; I226-I230 HydrophobicContact CD1-CD1 4.39Å; I226-I230 HydrophobicContact CD1-CG1 4.35Å; I226-I230 HydrophobicContact CG1-CD1 3.99Å; I226-I230 HydrophobicContact CG1-CG1 4.45Å; I226-I230 VanDerWaalsContact O-CG1 3.25Å; I226-I230 WeakPolarHBondContact O-CG1 3.35Å; I226-I230 PolarHBondContact O-N 3.01Å; I226-A235 HydrophobicContact CD1-CB 4Å; I226-I263 HydrophobicContact CG2-CD1 3.79Å; I226-I263 HydrophobicContact CG2-CG1 4.45Å
227	L	97.9	Very high	97.5	Very high	11 Å²	11	32.3 Å²	32.3	6%	0.058	17%	0.174	C	C	.	.	H	α-helix	trans	-62.7	-40.3	174.8	-174.5	60	0	0	0	112	P223 R225 I230 K231 I259 D262 I263	P223-L227 WeakPolarHBondContact O-CB 3.29Å; P223-L227 PolarHBondContact O-N 2.93Å; R225-L227 VanDerWaalsContact C-N 3.31Å; R225-L227 PolarHBondContact O-N 3.28Å; L227-I230 PolarHBondContact O-N 3.13Å; L227-K231 HydrophobicContact CD1-CD 4.31Å; L227-K231 HydrophobicContact CD1-CG 4.23Å; L227-K231 HydrophobicContact CG-CD 4.11Å; L227-K231 HydrophobicContact CG-CG 4.4Å; L227-K231 WeakPolarHBondContact O-CB 3.13Å; L227-K231 WeakPolarHBondContact O-CG 3.27Å; L227-K231 PolarHBondContact O-N 3.46Å; L227-I259 HydrophobicContact CB-CG2 4.22Å; L227-I259 HydrophobicContact CD2-CB 4.38Å; L227-I259 HydrophobicContact CD2-CG2 3.75Å; L227-D262 HydrophobicContact CD1-CB 3.91Å; L227-D262 HydrophobicContact CD2-CB 3.69Å; L227-D262 HydrophobicContact CG-CB 4.48Å; L227-I263 HydrophobicContact CB-CD1 4.36Å; L227-I263 HydrophobicContact CB-CG1 3.95Å; L227-I263 HydrophobicContact CD1-CG1 3.98Å; L227-I263 HydrophobicContact CG-CG1 4.41Å
228	D	97.5	Very high	97.4	Very high	59 Å²	59	37.5 Å²	37.5	32%	0.316	20%	0.202	S	C	.	.	H	α-helix	trans	-60.8	-45.2	175.5	-173.9	44.3	0	0	0	111.7	G224 R225 I226 I230 K231 K232	G224-D228 WeakPolarHBondContact O-CB 3.29Å; G224-D228 PolarHBondContact O-N 3.39Å; R225-D228 PolarHBondContact O-N 2.92Å; I226-D228 VanDerWaalsContact C-N 3.32Å; I226-D228 PolarHBondContact O-N 3.5Å; D228-I230 PolarHBondContact O-N 3.39Å; D228-K231 PolarHBondContact O-N 3.45Å; D228-K232 WeakPolarHBondContact O-CB 3.21Å; D228-K232 VanDerWaalsContact O-CG 3.27Å; D228-K232 WeakPolarHBondContact O-CG 3.44Å; D228-K232 PolarHBondContact O-N 3.34Å; D228-K232 WeakPolarHBondContact OD1-CE 3.21Å; D228-K232 IonicContact OD1-NZ 3.77Å; D228-K232 VanDerWaalsContact OD2-CE 3.32Å; D228-K232 WeakPolarHBondContact OD2-CE 3.45Å
229	L	98.3	Very high	97.3	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-65	-37.5	177.4	-70.5	167.8	0	0	0	112.9	T199 L205 D208 I209 L212 R225 I226 G233 V234 A235	T199-L229 HydrophobicContact CG2-CD1 4.03Å; T199-L229 WeakPolarHBondContact OG1-CD1 3.4Å; L205-L229 HydrophobicContact CD1-CD2 3.61Å; L205-L229 HydrophobicContact CD1-CG 4.3Å; D208-L229 HydrophobicContact CB-CD1 4.37Å; I209-L229 HydrophobicContact CG1-CD2 4.16Å; L212-L229 HydrophobicContact CD1-CD1 4.09Å; L212-L229 HydrophobicContact CD1-CD2 4.17Å; R225-L229 HydrophobicContact CG-CD1 4.16Å; R225-L229 WeakPolarHBondContact O-CG 3.31Å; R225-L229 PolarHBondContact O-N 3.24Å; R225-L229 VanDerWaalsContact O-N 3.08Å; I226-L229 PolarHBondContact O-N 3.45Å; L229-G233 PolarHBondContact O-N 3.48Å; L229-V234 HydrophobicContact CD2-CB 4.36Å; L229-V234 HydrophobicContact CD2-CG1 4.39Å; L229-V234 PolarHBondContact O-N 2.87Å; L229-A235 HydrophobicContact CB-CB 3.79Å; L229-A235 PolarHBondContact O-N 3.07Å; L229-A235 VanDerWaalsContact O-N 3.09Å
230	I	98.2	Very high	97.3	Very high	20 Å²	20	42.6 Å²	42.6	10%	0.103	23%	0.226	C	C	.	.	H	α-helix	trans	-66.6	-49.3	174.8	-67.2	165.2	0	0	0	110.1	I226 L227 D228 K232 G233 A235 V237 T266	I226-I230 HydrophobicContact CD1-CD1 4.39Å; I226-I230 HydrophobicContact CD1-CG1 4.35Å; I226-I230 HydrophobicContact CG1-CD1 3.99Å; I226-I230 HydrophobicContact CG1-CG1 4.45Å; I226-I230 VanDerWaalsContact O-CG1 3.25Å; I226-I230 WeakPolarHBondContact O-CG1 3.35Å; I226-I230 PolarHBondContact O-N 3.01Å; L227-I230 PolarHBondContact O-N 3.13Å; D228-I230 PolarHBondContact O-N 3.39Å; I230-K232 PolarHBondContact O-N 2.9Å; I230-G233 WeakPolarHBondContact O-CA 3.33Å; I230-G233 PolarHBondContact O-N 3.03Å; I230-A235 HydrophobicContact CG1-CB 4.02Å; I230-V237 HydrophobicContact CD1-CG1 3.83Å; I230-V237 HydrophobicContact CD1-CG2 4.31Å; I230-V237 HydrophobicContact CG1-CG1 3.8Å; I230-V237 HydrophobicContact CG1-CG2 4.34Å; I230-V237 HydrophobicContact CG2-CG2 4.22Å; I230-T266 HydrophobicContact CG2-CG2 3.9Å
231	K	97	Very high	97.3	Very high	136 Å²	136	47 Å²	47	59%	0.591	25%	0.246	S	C	*	.	H	α-helix	trans	-62.5	-29.5	-179.8	-75.9	-177.2	176.8	175.5	0	112.7	L227 D228 G233 D262	L227-K231 HydrophobicContact CD1-CD 4.31Å; L227-K231 HydrophobicContact CD1-CG 4.23Å; L227-K231 HydrophobicContact CG-CD 4.11Å; L227-K231 HydrophobicContact CG-CG 4.4Å; L227-K231 WeakPolarHBondContact O-CB 3.13Å; L227-K231 WeakPolarHBondContact O-CG 3.27Å; L227-K231 PolarHBondContact O-N 3.46Å; D228-K231 PolarHBondContact O-N 3.45Å; K231-G233 VanDerWaalsContact C-N 3.26Å; K231-G233 PolarHBondContact O-N 2.9Å; K231-D262 IonicContact NZ-OD2 2.8Å; K231-D262 PolarHBondContact NZ-OD2 3.4Å
232	K	96.2	Very high	97.3	Very high	118 Å²	118	47.2 Å²	47.2	51%	0.513	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-5.7	172.8	-71.4	176.6	-173.7	-62.2	0	114	L205 D228 I230 V234	L205-K232 HydrophobicContact CD2-CD 4.36Å; D228-K232 WeakPolarHBondContact O-CB 3.21Å; D228-K232 VanDerWaalsContact O-CG 3.27Å; D228-K232 WeakPolarHBondContact O-CG 3.44Å; D228-K232 PolarHBondContact O-N 3.34Å; D228-K232 WeakPolarHBondContact OD1-CE 3.21Å; D228-K232 IonicContact OD1-NZ 3.77Å; D228-K232 VanDerWaalsContact OD2-CE 3.32Å; D228-K232 WeakPolarHBondContact OD2-CE 3.45Å; I230-K232 PolarHBondContact O-N 2.9Å; K232-V234 HydrophobicContact CB-CG2 3.94Å; K232-V234 PolarHBondContact O-N 3.39Å
233	G	94.8	Very high	97.4	Very high	50 Å²	50	46.6 Å²	46.6	52%	0.515	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.8	13.6	-176.9	0	0	0	0	0	114.4	L229 I230 K231	L229-G233 PolarHBondContact O-N 3.48Å; I230-G233 WeakPolarHBondContact O-CA 3.33Å; I230-G233 PolarHBondContact O-N 3.03Å; K231-G233 VanDerWaalsContact C-N 3.26Å; K231-G233 PolarHBondContact O-N 2.9Å
234	V	95.7	Very high	97.4	Very high	37 Å²	37	46.6 Å²	46.6	22%	0.224	24%	0.243	C	C	.	.			trans	-85	-50.8	-179.4	-176.9	0	0	0	0	110	I209 L212 L229 K232 K236	I209-V234 HydrophobicContact CB-CG1 4.26Å; I209-V234 HydrophobicContact CG1-CG1 4.07Å; I209-V234 HydrophobicContact CG1-CG2 4.22Å; I209-V234 HydrophobicContact CG2-CG1 4.06Å; L212-V234 HydrophobicContact CB-CG1 3.89Å; L212-V234 HydrophobicContact CD1-CB 4.49Å; L212-V234 HydrophobicContact CD1-CG1 3.66Å; L212-V234 HydrophobicContact CG-CG1 4.42Å; L229-V234 HydrophobicContact CD2-CB 4.36Å; L229-V234 HydrophobicContact CD2-CG1 4.39Å; L229-V234 PolarHBondContact O-N 2.87Å; K232-V234 HydrophobicContact CB-CG2 3.94Å; K232-V234 PolarHBondContact O-N 3.39Å; V234-K236 PolarHBondContact O-N 2.96Å
235	A	97.6	Very high	97.5	Very high	3 Å²	3	44.8 Å²	44.8	3%	0.025	23%	0.225	C	C	.	.	S	Bend	trans	-83.9	102.1	174.4	0	0	0	0	0	109.8	I165 L212 I226 L229 I230 V237	I165-A235 HydrophobicContact CD1-CB 4.37Å; L212-A235 HydrophobicContact CD1-CB 4.13Å; I226-A235 HydrophobicContact CD1-CB 4Å; L229-A235 HydrophobicContact CB-CB 3.79Å; L229-A235 PolarHBondContact O-N 3.07Å; L229-A235 VanDerWaalsContact O-N 3.09Å; I230-A235 HydrophobicContact CG1-CB 4.02Å; A235-V237 PolarHBondContact O-N 3.08Å
236	K	97.5	Very high	97.5	Very high	151 Å²	151	43.6 Å²	43.6	66%	0.657	22%	0.221	S	C	*	.			trans	-82.4	111.7	177.2	-60.9	178.6	-175.2	172.4	0	110.2	V234	V234-K236 PolarHBondContact O-N 2.96Å
237	V	97.8	Very high	97.3	Very high	7 Å²	7	43.6 Å²	43.6	4%	0.042	22%	0.221	C	C	.	.			trans	-107.6	7.3	-172.7	-65	0	0	0	0	113.9	M168 I230 A235 H239 V240 L267 P268	M168-V237 HydrophobicContact SD-CG1 3.78Å; I230-V237 HydrophobicContact CD1-CG1 3.83Å; I230-V237 HydrophobicContact CD1-CG2 4.31Å; I230-V237 HydrophobicContact CG1-CG1 3.8Å; I230-V237 HydrophobicContact CG1-CG2 4.34Å; I230-V237 HydrophobicContact CG2-CG2 4.22Å; A235-V237 PolarHBondContact O-N 3.08Å; V237-H239 PolarHBondContact O-N 3.05Å; V237-V240 HydrophobicContact CB-CG2 3.84Å; V237-V240 HydrophobicContact CG1-CG2 4.12Å; V237-V240 WeakPolarHBondContact O-CB 3.47Å; V237-V240 WeakPolarHBondContact O-CG2 3.46Å; V237-V240 PolarHBondContact O-N 3.42Å; V237-L267 HydrophobicContact CB-CD2 3.75Å; V237-L267 HydrophobicContact CG1-CD2 4.29Å; V237-L267 HydrophobicContact CG2-CD2 3.94Å; V237-P268 VanDerWaalsContact O-CD 3.29Å; V237-P268 WeakPolarHBondContact O-CD 3.46Å
238	D	97	Very high	97.2	Very high	114 Å²	114	43.1 Å²	43.1	61%	0.61	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	-17	-176.6	-50.8	-76.1	0	0	0	114.1	P268	D238-P268 WeakPolarHBondContact O-CG 3.13Å
239	H	97.8	Very high	97	Very high	107 Å²	107	40.5 Å²	40.5	50%	0.495	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.5	6.9	179.5	-62.4	-61.2	0	0	0	113.6	N164 I165 V237 Q241	N164-H239 HydrophobicContact CB-CB 4.11Å; N164-H239 PolarHBondContact ND2-CD2 3.2Å; N164-H239 VanDerWaalsContact ND2-CG 3.27Å; I165-H239 CarbonylContact O-C 3.59Å; I165-H239 VanDerWaalsContact O-C 3.27Å; V237-H239 PolarHBondContact O-N 3.05Å; H239-Q241 PolarHBondContact O-N 2.95Å; H239-Q241 VanDerWaalsContact O-N 3.16Å
240	V	98.5	Very high	96.8	Very high	1 Å²	1	43 Å²	43	1%	0.006	22%	0.215	C	C	.	.			trans	-69.5	113.6	176.9	175.2	0	0	0	0	109.4	I165 Q166 M168 V237 M242 L267	I165-V240 HydrophobicContact CB-CG2 4.3Å; I165-V240 HydrophobicContact CG2-CG2 3.81Å; I165-V240 PolarHBondContact O-N 3.19Å; Q166-V240 WeakPolarHBondContact O-CA 3.44Å; M168-V240 HydrophobicContact CB-CG1 4.45Å; M168-V240 HydrophobicContact CG-CG1 4.11Å; M168-V240 HydrophobicContact CG-CG2 4.05Å; M168-V240 HydrophobicContact SD-CG1 4.24Å; M168-V240 HydrophobicContact SD-CG2 3.87Å; V237-V240 HydrophobicContact CB-CG2 3.84Å; V237-V240 HydrophobicContact CG1-CG2 4.12Å; V237-V240 WeakPolarHBondContact O-CB 3.47Å; V237-V240 WeakPolarHBondContact O-CG2 3.46Å; V237-V240 PolarHBondContact O-N 3.42Å; V240-M242 WeakPolarHBondContact CG1-O 3.26Å; V240-L267 HydrophobicContact CB-CD2 4.11Å; V240-L267 HydrophobicContact CG1-CD2 4.14Å; V240-L267 HydrophobicContact CG2-CD2 4.4Å
241	Q	97.3	Very high	96.6	Very high	91 Å²	91	42 Å²	42	43%	0.425	21%	0.21	S	C	.	.			trans	-97.7	-23.6	-179.5	-63.6	-178	-11.4	0	0	112.5	Q166 H239 R271 Q272	Q166-Q241 PolarHBondContact O-N 2.95Å; H239-Q241 PolarHBondContact O-N 2.95Å; H239-Q241 VanDerWaalsContact O-N 3.16Å; Q241-R271 CarbonylContact O-C 3.58Å; Q241-R271 WeakPolarHBondContact O-CA 3.11Å; Q241-Q272 PolarHBondContact O-N 3.13Å
242	M	98.5	Very high	96.6	Very high	5 Å²	5	35.7 Å²	35.7	3%	0.025	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	132.6	-178.1	-174.1	-172.9	-76.9	0	0	110.7	L154 Q166 A167 M168 V240 Q272 L274	L154-M242 HydrophobicContact CB-SD 3.62Å; L154-M242 HydrophobicContact CD1-SD 4.26Å; L154-M242 HydrophobicContact CG-SD 3.96Å; Q166-M242 PolarHBondContact O-N 3.41Å; A167-M242 VanDerWaalsContact CA-O 3.29Å; A167-M242 WeakPolarHBondContact CA-O 3.45Å; A167-M242 HydrophobicContact CB-CB 4.41Å; M168-M242 PolarHBondContact N-O 2.96Å; V240-M242 WeakPolarHBondContact CG1-O 3.26Å; M242-Q272 CarbonylContact C-O 3.54Å; M242-Q272 WeakPolarHBondContact CA-O 3.38Å; M242-L274 HydrophobicContact CE-CD1 4.17Å; M242-L274 HydrophobicContact CG-CD1 4.32Å; M242-L274 HydrophobicContact CG-CG 4.38Å; M242-L274 HydrophobicContact SD-CD1 3.73Å; M242-L274 HydrophobicContact SD-CG 4.41Å
243	I	98.6	Very high	96.4	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	133.3	169.4	-175.6	167.2	0	0	0	110.6	M168 I170 L245 I263 I264 L267 Q272 I273 L274	M168-I243 HydrophobicContact CB-CD1 4.49Å; M168-I243 HydrophobicContact CB-CG1 4.19Å; M168-I243 CarbonylContact O-C 3.5Å; M168-I243 VanDerWaalsContact O-CA 3.31Å; M168-I243 WeakPolarHBondContact O-CA 3.14Å; I170-I243 HydrophobicContact CG1-CD1 3.83Å; I170-I243 HydrophobicContact CG1-CG1 4.22Å; I243-L245 HydrophobicContact CD1-CD1 4.34Å; I243-L245 HydrophobicContact CG1-CD1 3.99Å; I243-L245 HydrophobicContact CG2-CD1 4.5Å; I243-I263 HydrophobicContact CD1-CG2 4.22Å; I243-I264 HydrophobicContact CD1-CD1 4.11Å; I243-I264 HydrophobicContact CG2-CD1 4.29Å; I243-L267 HydrophobicContact CB-CD1 4.06Å; I243-L267 HydrophobicContact CD1-CD1 3.58Å; I243-L267 HydrophobicContact CG1-CD1 4.4Å; I243-L267 HydrophobicContact CG2-CD1 4.02Å; I243-Q272 PolarHBondContact N-O 3.26Å; I243-I273 HydrophobicContact CG2-CB 4.34Å; I243-I273 HydrophobicContact CG2-CG1 3.77Å; I243-I273 HydrophobicContact CG2-CG2 4.39Å; I243-I273 WeakPolarHBondContact O-CA 3.15Å; I243-L274 PolarHBondContact O-N 2.85Å
244	V	98.8	Very high	96.1	Very high	0 Å²	0	38 Å²	38	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	134.6	175.8	-177.8	0	0	0	0	109.6	Y150 L154 M168 V169 I170 L274 Y276	Y150-V244 HydrophobicContact CD1-CG1 3.8Å; Y150-V244 HydrophobicContact CD2-CB 4.37Å; Y150-V244 HydrophobicContact CD2-CG1 3.74Å; Y150-V244 HydrophobicContact CD2-CG2 4.14Å; Y150-V244 HydrophobicContact CE1-CG1 4.25Å; Y150-V244 HydrophobicContact CE2-CG1 4.21Å; Y150-V244 HydrophobicContact CG-CG1 3.56Å; Y150-V244 HydrophobicContact CG-CG2 4.28Å; L154-V244 HydrophobicContact CD1-CG2 3.97Å; M168-V244 PolarHBondContact O-N 3.34Å; V169-V244 HydrophobicContact CB-CB 4.29Å; V169-V244 HydrophobicContact CG1-CB 4.03Å; V169-V244 HydrophobicContact CG1-CG1 4.14Å; V169-V244 HydrophobicContact CG2-CB 4.1Å; V169-V244 HydrophobicContact CG2-CG2 4.21Å; I170-V244 PolarHBondContact N-O 3.3Å; V244-L274 CarbonylContact C-O 3.58Å; V244-L274 VanDerWaalsContact CA-O 3.27Å; V244-L274 WeakPolarHBondContact CA-O 2.99Å; V244-L274 HydrophobicContact CG2-CB 4.21Å; V244-L274 HydrophobicContact CG2-CD1 4.15Å; V244-L274 HydrophobicContact CG2-CG 4.46Å; V244-Y276 HydrophobicContact CG1-CD2 4.21Å
245	L	98.5	Very high	95.7	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	101.8	171.2	-74.5	71	0	0	0	107.7	I243 A248 L251 L252 M260 I273 L274 L275 Y276 F287	I243-L245 HydrophobicContact CD1-CD1 4.34Å; I243-L245 HydrophobicContact CG1-CD1 3.99Å; I243-L245 HydrophobicContact CG2-CD1 4.5Å; L245-A248 HydrophobicContact CB-CB 4.27Å; L245-L251 HydrophobicContact CB-CD1 3.91Å; L245-L251 HydrophobicContact CG-CD1 4.24Å; L245-L252 HydrophobicContact CD2-CD2 4.42Å; L245-M260 HydrophobicContact CD1-CE 4.47Å; L245-M260 HydrophobicContact CD2-CE 3.75Å; L245-M260 HydrophobicContact CG-CE 3.87Å; L245-I273 HydrophobicContact CD1-CG2 4.04Å; L245-L274 PolarHBondContact N-O 3.49Å; L245-L275 HydrophobicContact CB-CG 4.46Å; L245-Y276 PolarHBondContact O-N 3.37Å; L245-F287 HydrophobicContact CD2-CD1 4.42Å; L245-F287 HydrophobicContact CD2-CE1 3.66Å; L245-F287 HydrophobicContact CD2-CE2 4.44Å; L245-F287 HydrophobicContact CD2-CZ 3.66Å
246	D	96.9	Very high	95.5	Very high	4 Å²	4	43.5 Å²	43.5	2%	0.021	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	141.6	176.3	-176.1	29.6	0	0	0	110.6	Y150 I170 V171 P172 L251	Y150-D246 HydrophobicContact CE1-CB 4.06Å; Y150-D246 PolarHBondContact OH-OD2 2.94Å; I170-D246 PolarHBondContact O-N 2.83Å; V171-D246 HydrophobicContact CG1-CB 4.04Å; P172-D246 VanDerWaalsContact CD-O 3.3Å; P172-D246 WeakPolarHBondContact CD-O 3.5Å; D246-L251 WeakPolarHBondContact O-CD1 3.23Å
247	E	93.8	Very high	95.3	Very high	2 Å²	2	38.9 Å²	38.9	1%	0.009	19%	0.194	C	C	.	.	S	Bend	trans	53.7	51.9	-168.9	-56.8	-81.3	-160.6	0	0	111	P172 L176 D249 K250 L251 Y276 R396 G397 H420	P172-E247 HydrophobicContact CG-CB 3.7Å; P172-E247 HydrophobicContact CG-CG 4.36Å; L176-E247 HydrophobicContact CD2-CG 3.98Å; E247-D249 VanDerWaalsContact C-N 3.32Å; E247-D249 VanDerWaalsContact C-OD1 3.31Å; E247-D249 PolarHBondContact O-N 3.18Å; E247-K250 PolarHBondContact O-N 3.32Å; E247-L251 PolarHBondContact O-N 3.43Å; E247-Y276 PolarHBondContact N-O 3.18Å; E247-Y276 VanDerWaalsContact N-O 3.11Å; E247-R396 HydrophobicContact CG-CB 4.22Å; E247-G397 WeakPolarHBondContact OE1-CA 3.14Å; E247-G397 PolarHBondContact OE1-N 2.86Å; E247-H420 IonicContact OE2-CE1 3.81Å; E247-H420 PolarHBondContact OE2-CE1 3.36Å; E247-H420 IonicContact OE2-ND1 3.8Å
248	A	95.2	Very high	95.2	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-64.5	-29.3	-168.3	0	0	0	0	0	114.9	L245 K250 L251 L252 L275 Y276	L245-A248 HydrophobicContact CB-CB 4.27Å; A248-K250 PolarHBondContact O-N 3.24Å; A248-L251 PolarHBondContact O-N 3.39Å; A248-L252 HydrophobicContact CB-CD1 4.37Å; A248-L252 VanDerWaalsContact O-CB 3.26Å; A248-L252 WeakPolarHBondContact O-CB 3.27Å; A248-L252 VanDerWaalsContact O-CG 3.27Å; A248-L252 WeakPolarHBondContact O-CG 3.26Å; A248-L252 PolarHBondContact O-N 3.26Å; A248-L275 HydrophobicContact CB-CD1 4.1Å; A248-L275 HydrophobicContact CB-CD2 3.31Å; A248-L275 HydrophobicContact CB-CG 3.51Å; A248-Y276 PolarHBondContact N-O 3.01Å; A248-Y276 VanDerWaalsContact N-O 3.1Å
249	D	93.2	Very high	95.2	Very high	4 Å²	4	41.3 Å²	41.3	2%	0.021	20%	0.203	C	C	.	.	H	α-helix	trans	-51.9	-42.2	169.2	51.2	2.3	0	0	0	112.2	E247 S253 S277 T279 P281 V284 R396 H420	E247-D249 VanDerWaalsContact C-N 3.32Å; E247-D249 VanDerWaalsContact C-OD1 3.31Å; E247-D249 PolarHBondContact O-N 3.18Å; D249-S253 PolarHBondContact O-N 3.41Å; D249-S277 WeakPolarHBondContact CB-OG 3.45Å; D249-S277 PolarHBondContact N-OG 3.21Å; D249-S277 PolarHBondContact OD1-OG 2.72Å; D249-S277 PolarHBondContact OD2-OG 2.96Å; D249-T279 VanDerWaalsContact CB-OG1 3.23Å; D249-T279 WeakPolarHBondContact CB-OG1 3.48Å; D249-T279 PolarHBondContact OD2-OG1 3.32Å; D249-P281 HydrophobicContact CB-CG 4.2Å; D249-V284 HydrophobicContact CB-CG2 4.35Å; D249-R396 VanDerWaalsContact CG-NH1 3.31Å; D249-R396 IonicContact OD1-NH1 2.96Å; D249-R396 PolarHBondContact OD1-NH1 3.18Å; D249-R396 IonicContact OD2-NH1 2.69Å; D249-R396 PolarHBondContact OD2-NH1 3.48Å; D249-H420 IonicContact OD2-NE2 2.73Å
250	K	92.9	Very high	95.1	Very high	53 Å²	53	36.2 Å²	36.2	23%	0.23	18%	0.179	C	C	.	.	H	α-helix	trans	-74.4	-43.8	174.2	-171.8	57.8	-169.9	155	0	112.2	P172 E247 A248 L252 S253 D255 F256	P172-K250 HydrophobicContact CB-CB 3.91Å; P172-K250 HydrophobicContact CB-CG 3.56Å; P172-K250 HydrophobicContact CG-CB 4.17Å; P172-K250 HydrophobicContact CG-CG 4.25Å; E247-K250 PolarHBondContact O-N 3.32Å; A248-K250 PolarHBondContact O-N 3.24Å; K250-L252 PolarHBondContact O-N 3.29Å; K250-S253 PolarHBondContact NZ-OG 3.33Å; K250-S253 WeakPolarHBondContact O-CB 3.48Å; K250-S253 PolarHBondContact O-N 3.24Å; K250-S253 VanDerWaalsContact O-N 3.09Å; K250-S253 PolarHBondContact O-OG 3.27Å; K250-D255 IonicContact NZ-OD2 3.4Å; K250-D255 PolarHBondContact NZ-OD2 2.86Å; K250-F256 HydrophobicContact CG-CE2 4.38Å; K250-F256 WeakPolarHBondContact O-CD2 3.44Å
251	L	95.7	Very high	95	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-61.3	-28.6	179.9	-68.1	176.7	0	0	0	112.9	I170 P172 P223 L245 D246 E247 A248 F256 M260	I170-L251 HydrophobicContact CB-CD1 4.26Å; I170-L251 HydrophobicContact CG2-CD1 4.02Å; I170-L251 HydrophobicContact CG2-CD2 3.84Å; I170-L251 WeakPolarHBondContact O-CD1 3.33Å; P172-L251 HydrophobicContact CB-CD2 4Å; P172-L251 HydrophobicContact CB-CG 4.45Å; P223-L251 HydrophobicContact CG-CD2 3.64Å; L245-L251 HydrophobicContact CB-CD1 3.91Å; L245-L251 HydrophobicContact CG-CD1 4.24Å; D246-L251 WeakPolarHBondContact O-CD1 3.23Å; E247-L251 PolarHBondContact O-N 3.43Å; A248-L251 PolarHBondContact O-N 3.39Å; L251-F256 CarbonylContact O-C 3.53Å; L251-F256 WeakPolarHBondContact O-CB 3.24Å; L251-M260 HydrophobicContact CB-CG 4.41Å; L251-M260 HydrophobicContact CB-SD 4.48Å; L251-M260 HydrophobicContact CD2-SD 4.46Å; L251-M260 VanDerWaalsContact O-CG 3.24Å; L251-M260 WeakPolarHBondContact O-CG 2.97Å
252	L	95.2	Very high	95	Very high	2 Å²	2	36.1 Å²	36.1	1%	0.01	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.5	17.5	-179.6	-55.9	173.7	0	0	0	111.6	L245 A248 K250 M260 L275 S283 V284 F287	L245-L252 HydrophobicContact CD2-CD2 4.42Å; A248-L252 HydrophobicContact CB-CD1 4.37Å; A248-L252 VanDerWaalsContact O-CB 3.26Å; A248-L252 WeakPolarHBondContact O-CB 3.27Å; A248-L252 VanDerWaalsContact O-CG 3.27Å; A248-L252 WeakPolarHBondContact O-CG 3.26Å; A248-L252 PolarHBondContact O-N 3.26Å; K250-L252 PolarHBondContact O-N 3.29Å; L252-M260 HydrophobicContact CD2-CB 4.18Å; L252-M260 HydrophobicContact CD2-CG 4.29Å; L252-L275 HydrophobicContact CD1-CD1 4.18Å; L252-S283 WeakPolarHBondContact O-CB 3.34Å; L252-S283 PolarHBondContact O-OG 2.84Å; L252-S283 VanDerWaalsContact O-OG 3.08Å; L252-V284 HydrophobicContact CB-CG2 4.45Å; L252-V284 HydrophobicContact CD1-CB 4.36Å; L252-V284 HydrophobicContact CD1-CG2 4.06Å; L252-F287 HydrophobicContact CD1-CB 3.5Å; L252-F287 HydrophobicContact CD1-CD1 3.75Å; L252-F287 HydrophobicContact CD1-CD2 4.23Å; L252-F287 HydrophobicContact CD1-CG 3.55Å; L252-F287 HydrophobicContact CD2-CB 4.03Å; L252-F287 HydrophobicContact CD2-CD1 4.29Å; L252-F287 HydrophobicContact CD2-CD2 3.38Å; L252-F287 HydrophobicContact CD2-CE2 3.86Å; L252-F287 HydrophobicContact CD2-CG 3.63Å; L252-F287 HydrophobicContact CD2-CZ 4.49Å; L252-F287 HydrophobicContact CG-CB 4.34Å; L252-F287 HydrophobicContact CG-CD2 4.46Å; L252-F287 HydrophobicContact CG-CG 4.25Å
253	S	92.2	Very high	95	Very high	26 Å²	26	35.9 Å²	35.9	18%	0.182	18%	0.179	C	C	.	.	S	Bend	trans	-74.7	165.9	167.7	67	0	0	0	0	110.9	D249 K250 D255 F256 V257	D249-S253 PolarHBondContact O-N 3.41Å; K250-S253 PolarHBondContact NZ-OG 3.33Å; K250-S253 WeakPolarHBondContact O-CB 3.48Å; K250-S253 PolarHBondContact O-N 3.24Å; K250-S253 VanDerWaalsContact O-N 3.09Å; K250-S253 PolarHBondContact O-OG 3.27Å; S253-D255 PolarHBondContact O-N 3.28Å; S253-F256 PolarHBondContact O-N 3.4Å; S253-V257 PolarHBondContact O-N 3.23Å
254	Q	88.8	Confident	94.9	Very high	190 Å²	190	35.9 Å²	35.9	89%	0.888	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-27.3	-177.9	-69.4	-179	-8.3	0	0	113.5	F256	Q254-F256 VanDerWaalsContact C-N 3.32Å; Q254-F256 PolarHBondContact O-N 3.2Å
255	D	87.4	Confident	94.8	Very high	108 Å²	108	42 Å²	42	58%	0.578	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-30.1	-179.7	-59.2	-29.4	0	0	0	113.1	K250 S253	K250-D255 IonicContact NZ-OD2 3.4Å; K250-D255 PolarHBondContact NZ-OD2 2.86Å; S253-D255 PolarHBondContact O-N 3.28Å
256	F	93	Very high	94.7	Very high	48 Å²	48	44.6 Å²	44.6	21%	0.211	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-126.2	-15.9	-167.4	-65	-48	0	0	0	114	P223 K250 L251 S253 Q254 Q258 I259 M260	P223-F256 HydrophobicContact CG-CD1 4.43Å; P223-F256 HydrophobicContact CG-CG 4.48Å; K250-F256 HydrophobicContact CG-CE2 4.38Å; K250-F256 WeakPolarHBondContact O-CD2 3.44Å; L251-F256 CarbonylContact O-C 3.53Å; L251-F256 WeakPolarHBondContact O-CB 3.24Å; S253-F256 PolarHBondContact O-N 3.4Å; Q254-F256 VanDerWaalsContact C-N 3.32Å; Q254-F256 PolarHBondContact O-N 3.2Å; F256-Q258 VanDerWaalsContact C-N 3.31Å; F256-Q258 PolarHBondContact O-N 2.79Å; F256-I259 HydrophobicContact CD1-CD1 4.38Å; F256-I259 CarbonylContact O-C 3.53Å; F256-I259 WeakPolarHBondContact O-CA 3.41Å; F256-I259 WeakPolarHBondContact O-CB 3.46Å; F256-I259 PolarHBondContact O-N 2.89Å; F256-M260 WeakPolarHBondContact O-CG 3.49Å; F256-M260 PolarHBondContact O-N 3.12Å
257	V	94	Very high	94.7	Very high	54 Å²	54	44.8 Å²	44.8	33%	0.327	23%	0.228	S	C	.	.	H	α-helix	trans	-52.9	-46	-173.4	66.6	0	0	0	0	112.7	S253 I259 M260 E261	S253-V257 PolarHBondContact O-N 3.23Å; V257-I259 VanDerWaalsContact C-N 3.34Å; V257-I259 PolarHBondContact O-N 2.98Å; V257-M260 WeakPolarHBondContact O-CB 3.11Å; V257-M260 PolarHBondContact O-N 2.73Å; V257-E261 WeakPolarHBondContact O-CG 3.21Å; V257-E261 PolarHBondContact O-N 3Å
258	Q	95.1	Very high	94.9	Very high	127 Å²	127	46.5 Å²	46.5	59%	0.593	24%	0.239	S	C	*	.	H	α-helix	trans	-65.8	-37.7	178.9	-173.6	58.9	47.6	0	0	112.5	F256 M260 E261 D262	F256-Q258 VanDerWaalsContact C-N 3.31Å; F256-Q258 PolarHBondContact O-N 2.79Å; Q258-M260 VanDerWaalsContact C-N 3.3Å; Q258-E261 PolarHBondContact O-N 3.24Å; Q258-D262 PolarHBondContact NE2-OD1 2.85Å; Q258-D262 VanDerWaalsContact NE2-OD1 3.07Å; Q258-D262 PolarHBondContact O-N 2.87Å
259	I	97.1	Very high	94.7	Very high	46 Å²	46	56.4 Å²	56.4	24%	0.236	28%	0.282	C	S	.	.	H	α-helix	trans	-66.5	-38.7	176.9	-61.6	174.5	0	0	0	109.6	P223 L227 F256 V257 D262 I263	P223-I259 HydrophobicContact CB-CB 4.41Å; P223-I259 HydrophobicContact CB-CG2 3.55Å; L227-I259 HydrophobicContact CB-CG2 4.22Å; L227-I259 HydrophobicContact CD2-CB 4.38Å; L227-I259 HydrophobicContact CD2-CG2 3.75Å; F256-I259 HydrophobicContact CD1-CD1 4.38Å; F256-I259 CarbonylContact O-C 3.53Å; F256-I259 WeakPolarHBondContact O-CA 3.41Å; F256-I259 WeakPolarHBondContact O-CB 3.46Å; F256-I259 PolarHBondContact O-N 2.89Å; V257-I259 VanDerWaalsContact C-N 3.34Å; V257-I259 PolarHBondContact O-N 2.98Å; I259-D262 PolarHBondContact O-N 2.82Å; I259-I263 HydrophobicContact CG2-CD1 4.06Å; I259-I263 VanDerWaalsContact O-CG1 3.25Å; I259-I263 WeakPolarHBondContact O-CG1 3.44Å; I259-I263 PolarHBondContact O-N 2.97Å
260	M	97.5	Very high	94.7	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-66.5	-43.6	176.3	-69	-53.1	-56.2	0	0	111.8	I170 P223 L245 L251 L252 F256 V257 Q258 D262 I263 I264	I170-M260 HydrophobicContact CB-CE 4.32Å; I170-M260 HydrophobicContact CG1-CE 4.37Å; I170-M260 HydrophobicContact CG2-CE 4.03Å; I170-M260 HydrophobicContact CG2-SD 3.77Å; P223-M260 HydrophobicContact CB-SD 3.97Å; P223-M260 HydrophobicContact CG-SD 3.8Å; L245-M260 HydrophobicContact CD1-CE 4.47Å; L245-M260 HydrophobicContact CD2-CE 3.75Å; L245-M260 HydrophobicContact CG-CE 3.87Å; L251-M260 HydrophobicContact CB-CG 4.41Å; L251-M260 HydrophobicContact CB-SD 4.48Å; L251-M260 HydrophobicContact CD2-SD 4.46Å; L251-M260 VanDerWaalsContact O-CG 3.24Å; L251-M260 WeakPolarHBondContact O-CG 2.97Å; L252-M260 HydrophobicContact CD2-CB 4.18Å; L252-M260 HydrophobicContact CD2-CG 4.29Å; F256-M260 WeakPolarHBondContact O-CG 3.49Å; F256-M260 PolarHBondContact O-N 3.12Å; V257-M260 WeakPolarHBondContact O-CB 3.11Å; V257-M260 PolarHBondContact O-N 2.73Å; Q258-M260 VanDerWaalsContact C-N 3.3Å; M260-D262 PolarHBondContact O-N 3.43Å; M260-I263 PolarHBondContact O-N 3.01Å; M260-I263 HydrophobicContact SD-CD1 4.13Å; M260-I264 WeakPolarHBondContact O-CB 3.48Å; M260-I264 WeakPolarHBondContact O-CG1 3.49Å; M260-I264 PolarHBondContact O-N 3.04Å
261	E	96.1	Very high	94.9	Very high	48 Å²	48	63.1 Å²	63.1	22%	0.224	32%	0.317	C	S	.	.	H	α-helix	trans	-55.9	-50.3	172.8	-70.7	-65.1	158.2	0	0	111.1	V257 Q258 I263 I264 L265 H291	V257-E261 WeakPolarHBondContact O-CG 3.21Å; V257-E261 PolarHBondContact O-N 3Å; Q258-E261 PolarHBondContact O-N 3.24Å; E261-I263 PolarHBondContact O-N 3.25Å; E261-I264 PolarHBondContact O-N 2.69Å; E261-L265 VanDerWaalsContact O-CG 3.29Å; E261-L265 WeakPolarHBondContact O-CG 3.49Å; E261-L265 PolarHBondContact O-N 3.38Å; E261-H291 IonicContact OE1-CD2 3.99Å; E261-H291 IonicContact OE1-CE1 3.77Å; E261-H291 IonicContact OE1-NE2 3.72Å; E261-H291 PolarHBondContact OE1-NE2 3.01Å; E261-H291 IonicContact OE2-CE1 3.73Å; E261-H291 PolarHBondContact OE2-CE1 3.42Å; E261-H291 IonicContact OE2-NE2 2.64Å; E261-H291 PolarHBondContact OE2-NE2 3.06Å
262	D	97.3	Very high	95	Very high	42 Å²	42	63.5 Å²	63.5	23%	0.225	32%	0.319	C	S	.	.	H	α-helix	trans	-56.9	-46.9	176.6	-79.5	18	0	0	0	111.8	L227 K231 Q258 I259 M260 I264 L265 T266	L227-D262 HydrophobicContact CD1-CB 3.91Å; L227-D262 HydrophobicContact CD2-CB 3.69Å; L227-D262 HydrophobicContact CG-CB 4.48Å; K231-D262 IonicContact NZ-OD2 2.8Å; K231-D262 PolarHBondContact NZ-OD2 3.4Å; Q258-D262 PolarHBondContact NE2-OD1 2.85Å; Q258-D262 VanDerWaalsContact NE2-OD1 3.07Å; Q258-D262 PolarHBondContact O-N 2.87Å; I259-D262 PolarHBondContact O-N 2.82Å; M260-D262 PolarHBondContact O-N 3.43Å; D262-I264 PolarHBondContact O-N 2.6Å; D262-L265 PolarHBondContact O-N 3.05Å; D262-T266 WeakPolarHBondContact O-CG2 3.3Å; D262-T266 PolarHBondContact O-N 3.27Å
263	I	98	Very high	95.1	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-58.5	-51.1	178	-70.5	164.4	0	0	0	110	M168 P223 I226 L227 I243 I259 M260 E261 L265 T266 L267	M168-I263 HydrophobicContact CE-CG2 4.41Å; P223-I263 HydrophobicContact CB-CD1 4.02Å; I226-I263 HydrophobicContact CG2-CD1 3.79Å; I226-I263 HydrophobicContact CG2-CG1 4.45Å; L227-I263 HydrophobicContact CB-CD1 4.36Å; L227-I263 HydrophobicContact CB-CG1 3.95Å; L227-I263 HydrophobicContact CD1-CG1 3.98Å; L227-I263 HydrophobicContact CG-CG1 4.41Å; I243-I263 HydrophobicContact CD1-CG2 4.22Å; I259-I263 HydrophobicContact CG2-CD1 4.06Å; I259-I263 VanDerWaalsContact O-CG1 3.25Å; I259-I263 WeakPolarHBondContact O-CG1 3.44Å; I259-I263 PolarHBondContact O-N 2.97Å; M260-I263 PolarHBondContact O-N 3.01Å; M260-I263 HydrophobicContact SD-CD1 4.13Å; E261-I263 PolarHBondContact O-N 3.25Å; I263-L265 VanDerWaalsContact C-N 3.26Å; I263-L265 PolarHBondContact O-N 3.3Å; I263-T266 PolarHBondContact O-N 2.85Å; I263-T266 PolarHBondContact O-OG1 2.99Å; I263-L267 WeakPolarHBondContact O-CG 3.32Å; I263-L267 PolarHBondContact O-N 2.82Å
264	I	96.8	Very high	95.4	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-61.4	-37.1	-175.9	-68.1	-70.2	0	0	0	111.4	I243 M260 E261 D262 T266 L267 R271 I273 F287 H291	I243-I264 HydrophobicContact CD1-CD1 4.11Å; I243-I264 HydrophobicContact CG2-CD1 4.29Å; M260-I264 WeakPolarHBondContact O-CB 3.48Å; M260-I264 WeakPolarHBondContact O-CG1 3.49Å; M260-I264 PolarHBondContact O-N 3.04Å; E261-I264 PolarHBondContact O-N 2.69Å; D262-I264 PolarHBondContact O-N 2.6Å; I264-T266 VanDerWaalsContact C-N 3.28Å; I264-T266 PolarHBondContact O-N 3.47Å; I264-L267 HydrophobicContact CD1-CD1 4.38Å; I264-L267 PolarHBondContact O-N 3.5Å; I264-R271 PolarHBondContact O-NH1 3.23Å; I264-R271 PolarHBondContact O-NH2 3.4Å; I264-R271 VanDerWaalsContact O-NH2 3.08Å; I264-I273 HydrophobicContact CD1-CD1 4.43Å; I264-F287 HydrophobicContact CD1-CZ 4.05Å; I264-F287 HydrophobicContact CG1-CE2 4.05Å; I264-F287 HydrophobicContact CG1-CZ 3.94Å; I264-H291 WeakPolarHBondContact CG2-ND1 3.28Å
265	L	95.6	Very high	95.9	Very high	129 Å²	129	53.2 Å²	53.2	68%	0.675	27%	0.268	S	S	*	.	H	α-helix	trans	-66.8	-26.3	176.2	-71	172.5	0	0	0	113.6	E261 D262 I263	E261-L265 VanDerWaalsContact O-CG 3.29Å; E261-L265 WeakPolarHBondContact O-CG 3.49Å; E261-L265 PolarHBondContact O-N 3.38Å; D262-L265 PolarHBondContact O-N 3.05Å; I263-L265 VanDerWaalsContact C-N 3.26Å; I263-L265 PolarHBondContact O-N 3.3Å
266	T	96.8	Very high	96.4	Very high	53 Å²	53	48 Å²	48	33%	0.325	24%	0.24	S	C	.	.	H	α-helix	trans	-80	-17	176	63.2	0	0	0	0	114.3	I230 D262 I263 I264	I230-T266 HydrophobicContact CG2-CG2 3.9Å; D262-T266 WeakPolarHBondContact O-CG2 3.3Å; D262-T266 PolarHBondContact O-N 3.27Å; I263-T266 PolarHBondContact O-N 2.85Å; I263-T266 PolarHBondContact O-OG1 2.99Å; I264-T266 VanDerWaalsContact C-N 3.28Å; I264-T266 PolarHBondContact O-N 3.47Å
267	L	97.3	Very high	96.4	Very high	9 Å²	9	45.8 Å²	45.8	5%	0.047	23%	0.23	C	C	.	.	S	Bend	trans	-81.3	157.5	-177.9	-59.3	-179.4	0	0	0	112	M168 V237 V240 I243 I263 I264 R271	M168-L267 HydrophobicContact SD-CD2 3.95Å; V237-L267 HydrophobicContact CB-CD2 3.75Å; V237-L267 HydrophobicContact CG1-CD2 4.29Å; V237-L267 HydrophobicContact CG2-CD2 3.94Å; V240-L267 HydrophobicContact CB-CD2 4.11Å; V240-L267 HydrophobicContact CG1-CD2 4.14Å; V240-L267 HydrophobicContact CG2-CD2 4.4Å; I243-L267 HydrophobicContact CB-CD1 4.06Å; I243-L267 HydrophobicContact CD1-CD1 3.58Å; I243-L267 HydrophobicContact CG1-CD1 4.4Å; I243-L267 HydrophobicContact CG2-CD1 4.02Å; I263-L267 WeakPolarHBondContact O-CG 3.32Å; I263-L267 PolarHBondContact O-N 2.82Å; I264-L267 HydrophobicContact CD1-CD1 4.38Å; I264-L267 PolarHBondContact O-N 3.5Å; L267-R271 PolarHBondContact O-NH1 2.98Å
268	P	96.9	Very high	96.2	Very high	37 Å²	37	43.2 Å²	43.2	24%	0.24	22%	0.215	C	C	.	.			trans	-54.9	139.3	172.2	-27	36.5	0	0	0	112	V237 D238 N270 R271	V237-P268 VanDerWaalsContact O-CD 3.29Å; V237-P268 WeakPolarHBondContact O-CD 3.46Å; D238-P268 WeakPolarHBondContact O-CG 3.13Å; P268-N270 VanDerWaalsContact C-N 3.28Å; P268-N270 PolarHBondContact O-N 2.84Å; P268-R271 VanDerWaalsContact C-NH1 3.29Å; P268-R271 WeakPolarHBondContact O-CB 3.49Å; P268-R271 WeakPolarHBondContact O-CD 3.4Å; P268-R271 VanDerWaalsContact O-CG 3.27Å; P268-R271 WeakPolarHBondContact O-CG 3.39Å; P268-R271 PolarHBondContact O-NH1 3.41Å
269	K	92.4	Very high	95.8	Very high	208 Å²	208	38.2 Å²	38.2	90%	0.904	19%	0.193	S	C	*	.	S	Bend	trans	-60.9	-37.1	-178.3	-68.4	-173.9	178.5	-178.4	0	112.8	R271	K269-R271 VanDerWaalsContact C-N 3.33Å; K269-R271 PolarHBondContact O-N 3.1Å
270	N	92.8	Very high	95.4	Very high	156 Å²	156	39 Å²	39	83%	0.834	20%	0.195	S	C	*	.	S	Bend	trans	-89.2	73.5	176.7	-170.1	25.4	0	0	0	110	P268	P268-N270 VanDerWaalsContact C-N 3.28Å; P268-N270 PolarHBondContact O-N 2.84Å
271	R	96.1	Very high	95.1	Very high	43 Å²	43	41.4 Å²	41.4	16%	0.162	21%	0.21	C	C	.	.			trans	-123.6	148	178.2	62.9	-171.8	168.7	-105.5	1.7	109.2	Q241 I264 L267 P268 K269 I273	Q241-R271 CarbonylContact O-C 3.58Å; Q241-R271 WeakPolarHBondContact O-CA 3.11Å; I264-R271 PolarHBondContact O-NH1 3.23Å; I264-R271 PolarHBondContact O-NH2 3.4Å; I264-R271 VanDerWaalsContact O-NH2 3.08Å; L267-R271 PolarHBondContact O-NH1 2.98Å; P268-R271 VanDerWaalsContact C-NH1 3.29Å; P268-R271 WeakPolarHBondContact O-CB 3.49Å; P268-R271 WeakPolarHBondContact O-CD 3.4Å; P268-R271 VanDerWaalsContact O-CG 3.27Å; P268-R271 WeakPolarHBondContact O-CG 3.39Å; P268-R271 PolarHBondContact O-NH1 3.41Å; K269-R271 VanDerWaalsContact C-N 3.33Å; K269-R271 PolarHBondContact O-N 3.1Å; R271-I273 HydrophobicContact CG-CG1 4.38Å
272	Q	98.3	Very high	94.8	Very high	7 Å²	7	44.8 Å²	44.8	3%	0.033	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	134.9	169.8	-174.8	-179.2	14.2	0	0	109.8	A130 G133 R134 D135 Q241 M242 I243 L274	A130-Q272 PolarHBondContact O-NE2 3.26Å; A130-Q272 PolarHBondContact O-OE1 3.38Å; G133-Q272 VanDerWaalsContact C-NE2 3.25Å; R134-Q272 PolarHBondContact O-NE2 3.1Å; D135-Q272 WeakPolarHBondContact OD1-CA 3.44Å; Q241-Q272 PolarHBondContact O-N 3.13Å; M242-Q272 CarbonylContact C-O 3.54Å; M242-Q272 WeakPolarHBondContact CA-O 3.38Å; I243-Q272 PolarHBondContact N-O 3.26Å; Q272-L274 HydrophobicContact CG-CD2 3.91Å
273	I	98.6	Very high	94.6	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.01	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	122.3	177.2	-56	176.7	0	0	0	109.3	D135 I136 I243 L245 I264 R271 H291 L292	D135-I273 VanDerWaalsContact CA-O 3.27Å; D135-I273 WeakPolarHBondContact CA-O 3.2Å; D135-I273 WeakPolarHBondContact CB-O 3.37Å; D135-I273 PolarHBondContact OD1-N 2.97Å; I136-I273 PolarHBondContact N-O 3.1Å; I243-I273 HydrophobicContact CG2-CB 4.34Å; I243-I273 HydrophobicContact CG2-CG1 3.77Å; I243-I273 HydrophobicContact CG2-CG2 4.39Å; I243-I273 WeakPolarHBondContact O-CA 3.15Å; L245-I273 HydrophobicContact CD1-CG2 4.04Å; I264-I273 HydrophobicContact CD1-CD1 4.43Å; R271-I273 HydrophobicContact CG-CG1 4.38Å; I273-H291 HydrophobicContact CD1-CB 4.09Å; I273-L292 HydrophobicContact CB-CD1 4.15Å; I273-L292 HydrophobicContact CB-CG 4.37Å; I273-L292 HydrophobicContact CD1-CD1 4.12Å; I273-L292 HydrophobicContact CG2-CD1 3.74Å; I273-L292 HydrophobicContact CG2-CG 4.3Å
274	L	98.7	Very high	94.4	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	112.4	173.3	-45.6	-178.6	0	0	0	109.8	A130 I136 M242 I243 V244 L245 Q272 Y276	A130-L274 HydrophobicContact CB-CD1 4.06Å; A130-L274 HydrophobicContact CB-CD2 4.25Å; I136-L274 HydrophobicContact CB-CD2 3.9Å; I136-L274 HydrophobicContact CD1-CD2 4.12Å; I136-L274 HydrophobicContact CG1-CD2 3.89Å; M242-L274 HydrophobicContact CE-CD1 4.17Å; M242-L274 HydrophobicContact CG-CD1 4.32Å; M242-L274 HydrophobicContact CG-CG 4.38Å; M242-L274 HydrophobicContact SD-CD1 3.73Å; M242-L274 HydrophobicContact SD-CG 4.41Å; I243-L274 PolarHBondContact O-N 2.85Å; V244-L274 CarbonylContact C-O 3.58Å; V244-L274 VanDerWaalsContact CA-O 3.27Å; V244-L274 WeakPolarHBondContact CA-O 2.99Å; V244-L274 HydrophobicContact CG2-CB 4.21Å; V244-L274 HydrophobicContact CG2-CD1 4.15Å; V244-L274 HydrophobicContact CG2-CG 4.46Å; L245-L274 PolarHBondContact N-O 3.49Å; Q272-L274 HydrophobicContact CG-CD2 3.91Å; L274-Y276 HydrophobicContact CB-CD2 4.39Å; L274-Y276 HydrophobicContact CB-CE2 3.78Å
275	L	98.2	Very high	94.2	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	123.3	-177.8	-169.6	163.7	0	0	0	110	I136 L137 A138 L245 A248 L252 V284 F287 L292	I136-L275 PolarHBondContact O-N 3.22Å; L137-L275 HydrophobicContact CD1-CB 4.22Å; L137-L275 HydrophobicContact CD1-CD1 4Å; L137-L275 HydrophobicContact CD1-CD2 3.84Å; L137-L275 HydrophobicContact CD1-CG 4.22Å; A138-L275 PolarHBondContact N-O 3.25Å; L245-L275 HydrophobicContact CB-CG 4.46Å; A248-L275 HydrophobicContact CB-CD1 4.1Å; A248-L275 HydrophobicContact CB-CD2 3.31Å; A248-L275 HydrophobicContact CB-CG 3.51Å; L252-L275 HydrophobicContact CD1-CD1 4.18Å; L275-V284 HydrophobicContact CD1-CG1 4.1Å; L275-V284 HydrophobicContact CD2-CG1 4.13Å; L275-F287 HydrophobicContact CD1-CD1 3.97Å; L275-F287 HydrophobicContact CD1-CE1 4.34Å; L275-L292 HydrophobicContact CB-CD2 4.45Å
276	Y	97.4	Very high	94.2	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	127.7	178.1	-71.6	-96.2	0	0	0	110.8	I122 S126 A138 K146 A149 Y150 V244 L245 E247 A248 L274	I122-Y276 HydrophobicContact CD1-CE1 4.22Å; I122-Y276 HydrophobicContact CG1-CE1 4.18Å; S126-Y276 WeakPolarHBondContact CB-OH 3.18Å; S126-Y276 PolarHBondContact OG-OH 3.35Å; A138-Y276 HydrophobicContact CB-CD1 3.36Å; A138-Y276 HydrophobicContact CB-CE1 3.43Å; A138-Y276 VanDerWaalsContact CB-CE1 3.43Å; A138-Y276 HydrophobicContact CB-CG 4.01Å; A138-Y276 WeakPolarHBondContact O-CA 3.47Å; K146-Y276 HydrophobicContact CB-CD1 4.23Å; K146-Y276 HydrophobicContact CD-CD1 4.28Å; K146-Y276 HydrophobicContact CG-CD1 4.28Å; A149-Y276 HydrophobicContact CB-CE1 4Å; Y150-Y276 AromaticContact CD1-CD2 3.8Å; Y150-Y276 HydrophobicContact CD1-CD2 3.8Å; Y150-Y276 AromaticContact CD1-CE2 3.93Å; Y150-Y276 HydrophobicContact CD1-CE2 3.93Å; Y150-Y276 HydrophobicContact CD1-CG 4.15Å; Y150-Y276 HydrophobicContact CG-CD2 4.42Å; Y150-Y276 HydrophobicContact CG-CE2 4.2Å; V244-Y276 HydrophobicContact CG1-CD2 4.21Å; L245-Y276 PolarHBondContact O-N 3.37Å; E247-Y276 PolarHBondContact N-O 3.18Å; E247-Y276 VanDerWaalsContact N-O 3.11Å; A248-Y276 PolarHBondContact N-O 3.01Å; A248-Y276 VanDerWaalsContact N-O 3.1Å; L274-Y276 HydrophobicContact CB-CD2 4.39Å; L274-Y276 HydrophobicContact CB-CE2 3.78Å
277	S	93.5	Very high	94.1	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	160.5	174.8	-165.2	0	0	0	0	112.9	A138 R139 A140 D249 T279	A138-S277 PolarHBondContact O-N 3.04Å; R139-S277 WeakPolarHBondContact CA-O 3.38Å; A140-S277 PolarHBondContact N-O 3.03Å; A140-S277 VanDerWaalsContact N-O 3.13Å; D249-S277 WeakPolarHBondContact CB-OG 3.45Å; D249-S277 PolarHBondContact N-OG 3.21Å; D249-S277 PolarHBondContact OD1-OG 2.72Å; D249-S277 PolarHBondContact OD2-OG 2.96Å; S277-T279 WeakPolarHBondContact CB-O 3.38Å; S277-T279 PolarHBondContact OG-N 2.93Å; S277-T279 PolarHBondContact OG-O 3.1Å
278	A	89.2	Confident	93.9	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.242	C	C	.	.	S	Bend	trans	-88.4	-35.9	169.6	0	0	0	0	0	111.4	R139 L419	R139-A278 PolarHBondContact NE-O 3.29Å; A278-L419 HydrophobicContact CB-CD2 4.36Å
279	T	88.3	Confident	93.8	Very high	22 Å²	22	52.5 Å²	52.5	14%	0.135	26%	0.26	C	S	.	.			trans	-117.1	151.8	-178.1	79.6	0	0	0	0	111.8	D249 S277 P281 E416 L419	D249-T279 VanDerWaalsContact CB-OG1 3.23Å; D249-T279 WeakPolarHBondContact CB-OG1 3.48Å; D249-T279 PolarHBondContact OD2-OG1 3.32Å; S277-T279 WeakPolarHBondContact CB-O 3.38Å; S277-T279 PolarHBondContact OG-N 2.93Å; S277-T279 PolarHBondContact OG-O 3.1Å; T279-P281 VanDerWaalsContact C-CD 3.43Å; T279-P281 WeakPolarHBondContact O-CD 3.46Å; T279-E416 HydrophobicContact CG2-CG 4.08Å; T279-L419 HydrophobicContact CG2-CD2 4.14Å
280	F	88.6	Confident	93.9	Very high	64 Å²	64	46.4 Å²	46.4	28%	0.281	24%	0.243	S	C	.	.			trans	-129.1	68.2	-170.9	-81.7	-104.6	0	0	0	110.6	L137 R139 V284	L137-F280 HydrophobicContact CD1-CE1 3.67Å; L137-F280 HydrophobicContact CD1-CZ 4.4Å; L137-F280 HydrophobicContact CD2-CD1 4.47Å; L137-F280 HydrophobicContact CD2-CE1 3.79Å; L137-F280 HydrophobicContact CG-CE1 3.61Å; L137-F280 HydrophobicContact CG-CZ 4.23Å; R139-F280 HydrophobicContact CB-CD2 3.96Å; R139-F280 HydrophobicContact CB-CE2 3.25Å; R139-F280 HydrophobicContact CB-CZ 3.61Å; R139-F280 VanDerWaalsContact CD-CD2 3.4Å; R139-F280 HydrophobicContact CG-CD2 3.64Å; R139-F280 HydrophobicContact CG-CE2 3.35Å; R139-F280 HydrophobicContact CG-CZ 4.22Å; F280-V284 HydrophobicContact CD1-CG1 3.94Å; F280-V284 HydrophobicContact CE1-CG1 4.12Å
281	P	89.2	Confident	94	Very high	49 Å²	49	40.3 Å²	40.3	32%	0.318	21%	0.21	S	C	.	.			trans	-67.7	165.3	173.8	30.2	-35.8	0	0	0	111.4	D249 T279 S283 V284 Q285	D249-P281 HydrophobicContact CB-CG 4.2Å; T279-P281 VanDerWaalsContact C-CD 3.43Å; T279-P281 WeakPolarHBondContact O-CD 3.46Å; P281-S283 PolarHBondContact O-N 2.71Å; P281-V284 HydrophobicContact CG-CG2 3.87Å; P281-V284 WeakPolarHBondContact O-CB 3.23Å; P281-V284 PolarHBondContact O-N 3.13Å; P281-Q285 PolarHBondContact O-N 3.33Å
282	L	91.4	Very high	94	Very high	119 Å²	119	38.8 Å²	38.8	62%	0.623	21%	0.205	S	C	*	.	H	α-helix	trans	-54.7	-28	178.2	-70.3	174.2	0	0	0	113.6	Q285 K286	L282-Q285 PolarHBondContact O-N 3.29Å; L282-K286 WeakPolarHBondContact O-CB 3.31Å; L282-K286 VanDerWaalsContact O-CG 3.29Å; L282-K286 WeakPolarHBondContact O-CG 3.46Å; L282-K286 PolarHBondContact O-N 3.48Å
283	S	93.1	Very high	93.8	Very high	40 Å²	40	45.2 Å²	45.2	28%	0.28	23%	0.234	S	C	.	.	H	α-helix	trans	-66.3	-38.9	176.1	55.2	0	0	0	0	112.6	L252 P281 K286 F287	L252-S283 WeakPolarHBondContact O-CB 3.34Å; L252-S283 PolarHBondContact O-OG 2.84Å; L252-S283 VanDerWaalsContact O-OG 3.08Å; P281-S283 PolarHBondContact O-N 2.71Å; S283-K286 PolarHBondContact O-N 2.88Å; S283-F287 WeakPolarHBondContact O-CB 3.49Å; S283-F287 PolarHBondContact O-N 3.44Å
284	V	93	Very high	93.5	Very high	1 Å²	1	53.7 Å²	53.7	1%	0.006	27%	0.271	C	S	.	.	H	α-helix	trans	-64.3	-44.6	173.4	176.1	0	0	0	0	110.1	D249 L252 L275 F280 P281 K286 F287 M288	D249-V284 HydrophobicContact CB-CG2 4.35Å; L252-V284 HydrophobicContact CB-CG2 4.45Å; L252-V284 HydrophobicContact CD1-CB 4.36Å; L252-V284 HydrophobicContact CD1-CG2 4.06Å; L275-V284 HydrophobicContact CD1-CG1 4.1Å; L275-V284 HydrophobicContact CD2-CG1 4.13Å; F280-V284 HydrophobicContact CD1-CG1 3.94Å; F280-V284 HydrophobicContact CE1-CG1 4.12Å; P281-V284 HydrophobicContact CG-CG2 3.87Å; P281-V284 WeakPolarHBondContact O-CB 3.23Å; P281-V284 PolarHBondContact O-N 3.13Å; V284-K286 PolarHBondContact O-N 2.74Å; V284-F287 PolarHBondContact O-N 3.02Å; V284-M288 WeakPolarHBondContact O-CB 3.41Å; V284-M288 PolarHBondContact O-N 2.6Å
285	Q	93.3	Very high	93.5	Very high	101 Å²	101	54.7 Å²	54.7	47%	0.472	28%	0.278	S	S	.	.	H	α-helix	trans	-62.3	-41.4	177.6	-169	-179.2	19.7	0	0	112.3	P281 L282 M288 N289	P281-Q285 PolarHBondContact O-N 3.33Å; L282-Q285 PolarHBondContact O-N 3.29Å; Q285-M288 HydrophobicContact CG-CE 4.21Å; Q285-M288 WeakPolarHBondContact O-CB 3.33Å; Q285-M288 PolarHBondContact O-N 2.65Å; Q285-N289 VanDerWaalsContact O-CG 3.28Å; Q285-N289 PolarHBondContact O-N 3.26Å; Q285-N289 PolarHBondContact O-ND2 3.28Å
286	K	94.7	Very high	93.4	Very high	147 Å²	147	58.4 Å²	58.4	64%	0.639	29%	0.292	S	S	*	.	H	α-helix	trans	-62.5	-47.3	175.3	-76.5	177.7	-178.3	-173.7	0	111.5	L282 S283 V284 M288 N289 S290	L282-K286 WeakPolarHBondContact O-CB 3.31Å; L282-K286 VanDerWaalsContact O-CG 3.29Å; L282-K286 WeakPolarHBondContact O-CG 3.46Å; L282-K286 PolarHBondContact O-N 3.48Å; S283-K286 PolarHBondContact O-N 2.88Å; V284-K286 PolarHBondContact O-N 2.74Å; K286-M288 VanDerWaalsContact C-N 3.32Å; K286-M288 PolarHBondContact O-N 2.81Å; K286-N289 PolarHBondContact O-N 3.01Å; K286-S290 PolarHBondContact O-N 3.03Å; K286-S290 PolarHBondContact O-OG 3.19Å; K286-S290 VanDerWaalsContact O-OG 3.1Å
287	F	94.6	Very high	93.4	Very high	4 Å²	4	64.3 Å²	64.3	2%	0.018	32%	0.32	C	S	.	.	H	α-helix	trans	-60.2	-43.8	177.5	-178.3	-90.4	0	0	0	111.8	L245 L252 I264 L275 S283 V284 N289 S290 H291 L292	L245-F287 HydrophobicContact CD2-CD1 4.42Å; L245-F287 HydrophobicContact CD2-CE1 3.66Å; L245-F287 HydrophobicContact CD2-CE2 4.44Å; L245-F287 HydrophobicContact CD2-CZ 3.66Å; L252-F287 HydrophobicContact CD1-CB 3.5Å; L252-F287 HydrophobicContact CD1-CD1 3.75Å; L252-F287 HydrophobicContact CD1-CD2 4.23Å; L252-F287 HydrophobicContact CD1-CG 3.55Å; L252-F287 HydrophobicContact CD2-CB 4.03Å; L252-F287 HydrophobicContact CD2-CD1 4.29Å; L252-F287 HydrophobicContact CD2-CD2 3.38Å; L252-F287 HydrophobicContact CD2-CE2 3.86Å; L252-F287 HydrophobicContact CD2-CG 3.63Å; L252-F287 HydrophobicContact CD2-CZ 4.49Å; L252-F287 HydrophobicContact CG-CB 4.34Å; L252-F287 HydrophobicContact CG-CD2 4.46Å; L252-F287 HydrophobicContact CG-CG 4.25Å; I264-F287 HydrophobicContact CD1-CZ 4.05Å; I264-F287 HydrophobicContact CG1-CE2 4.05Å; I264-F287 HydrophobicContact CG1-CZ 3.94Å; L275-F287 HydrophobicContact CD1-CD1 3.97Å; L275-F287 HydrophobicContact CD1-CE1 4.34Å; S283-F287 WeakPolarHBondContact O-CB 3.49Å; S283-F287 PolarHBondContact O-N 3.44Å; V284-F287 PolarHBondContact O-N 3.02Å; F287-N289 PolarHBondContact O-N 3.09Å; F287-S290 PolarHBondContact O-N 3.36Å; F287-H291 AromaticContact CD2-CD2 3.38Å; F287-H291 WeakPolarHBondContact CD2-CD2 3.38Å; F287-H291 HydrophobicContact CE1-CB 4.28Å; F287-H291 AromaticContact CE2-CD2 3.36Å; F287-H291 WeakPolarHBondContact CE2-CD2 3.36Å; F287-H291 AromaticContact CE2-NE2 3.94Å; F287-H291 AromaticContact CG-CD2 3.94Å; F287-H291 HydrophobicContact CZ-CB 4.19Å; F287-H291 AromaticContact CZ-CD2 3.91Å; F287-H291 PolarHBondContact O-CD2 3.04Å; F287-H291 PolarHBondContact O-N 3.04Å; F287-L292 HydrophobicContact CD1-CD1 4.04Å; F287-L292 HydrophobicContact CE1-CD1 3.77Å
288	M	93.1	Very high	93.5	Very high	25 Å²	25	64.8 Å²	64.8	12%	0.123	32%	0.323	C	S	.	.	H	α-helix	trans	-54.6	-53.6	174.9	176.5	-169.4	80.5	0	0	111.2	L137 V284 Q285 K286 S290 H291 L292 P295	L137-M288 HydrophobicContact CD1-CG 4.39Å; L137-M288 HydrophobicContact CD1-SD 4.17Å; L137-M288 HydrophobicContact CD2-SD 3.38Å; L137-M288 WeakPolarHBondContact CD2-SD 3.47Å; L137-M288 HydrophobicContact CG-SD 4.29Å; V284-M288 WeakPolarHBondContact O-CB 3.41Å; V284-M288 PolarHBondContact O-N 2.6Å; Q285-M288 HydrophobicContact CG-CE 4.21Å; Q285-M288 WeakPolarHBondContact O-CB 3.33Å; Q285-M288 PolarHBondContact O-N 2.65Å; K286-M288 VanDerWaalsContact C-N 3.32Å; K286-M288 PolarHBondContact O-N 2.81Å; M288-S290 PolarHBondContact O-N 3.06Å; M288-H291 PolarHBondContact O-N 2.9Å; M288-L292 HydrophobicContact CB-CD2 4.29Å; M288-L292 HydrophobicContact CG-CB 4.34Å; M288-L292 HydrophobicContact CG-CD2 3.94Å; M288-L292 WeakPolarHBondContact O-CB 3.33Å; M288-L292 PolarHBondContact O-N 2.66Å; M288-P295 HydrophobicContact CG-CG 4.17Å
289	N	94.8	Very high	93.6	Very high	115 Å²	115	69.6 Å²	69.6	62%	0.615	35%	0.348	S	S	*	.	H	α-helix	trans	-63	-31.4	-178.5	-68.8	-19.2	0	0	0	113.1	Q285 K286 F287	Q285-N289 VanDerWaalsContact O-CG 3.28Å; Q285-N289 PolarHBondContact O-N 3.26Å; Q285-N289 PolarHBondContact O-ND2 3.28Å; K286-N289 PolarHBondContact O-N 3.01Å; F287-N289 PolarHBondContact O-N 3.09Å
290	S	94.6	Very high	93.6	Very high	79 Å²	79	71.9 Å²	71.9	55%	0.552	36%	0.359	S	S	*	.	H	α-helix	trans	-79.7	-37.8	-179.2	-64.5	0	0	0	0	113.4	K286 F287 M288	K286-S290 PolarHBondContact O-N 3.03Å; K286-S290 PolarHBondContact O-OG 3.19Å; K286-S290 VanDerWaalsContact O-OG 3.1Å; F287-S290 PolarHBondContact O-N 3.36Å; M288-S290 PolarHBondContact O-N 3.06Å
291	H	95.4	Very high	93.3	Very high	29 Å²	29	69.5 Å²	69.5	13%	0.134	35%	0.349	C	S	.	.	H	α-helix	trans	-119.4	-30.1	-164.5	-63.3	-69.1	0	0	0	115	E261 I264 I273 F287 M288	E261-H291 IonicContact OE1-CD2 3.99Å; E261-H291 IonicContact OE1-CE1 3.77Å; E261-H291 IonicContact OE1-NE2 3.72Å; E261-H291 PolarHBondContact OE1-NE2 3.01Å; E261-H291 IonicContact OE2-CE1 3.73Å; E261-H291 PolarHBondContact OE2-CE1 3.42Å; E261-H291 IonicContact OE2-NE2 2.64Å; E261-H291 PolarHBondContact OE2-NE2 3.06Å; I264-H291 WeakPolarHBondContact CG2-ND1 3.28Å; I273-H291 HydrophobicContact CD1-CB 4.09Å; F287-H291 AromaticContact CD2-CD2 3.38Å; F287-H291 WeakPolarHBondContact CD2-CD2 3.38Å; F287-H291 HydrophobicContact CE1-CB 4.28Å; F287-H291 AromaticContact CE2-CD2 3.36Å; F287-H291 WeakPolarHBondContact CE2-CD2 3.36Å; F287-H291 AromaticContact CE2-NE2 3.94Å; F287-H291 AromaticContact CG-CD2 3.94Å; F287-H291 HydrophobicContact CZ-CB 4.19Å; F287-H291 AromaticContact CZ-CD2 3.91Å; F287-H291 PolarHBondContact O-CD2 3.04Å; F287-H291 PolarHBondContact O-N 3.04Å; M288-H291 PolarHBondContact O-N 2.9Å
292	L	95.2	Very high	92.9	Very high	11 Å²	11	76.5 Å²	76.5	6%	0.058	38%	0.377	C	S	.	.			trans	-84.7	137.9	-175	-80.8	54.9	0	0	0	110.6	D135 L137 I273 L275 F287 M288 P295	D135-L292 HydrophobicContact CB-CG 4.43Å; D135-L292 WeakPolarHBondContact OD2-CA 3.29Å; L137-L292 HydrophobicContact CD1-CD2 4.24Å; I273-L292 HydrophobicContact CB-CD1 4.15Å; I273-L292 HydrophobicContact CB-CG 4.37Å; I273-L292 HydrophobicContact CD1-CD1 4.12Å; I273-L292 HydrophobicContact CG2-CD1 3.74Å; I273-L292 HydrophobicContact CG2-CG 4.3Å; L275-L292 HydrophobicContact CB-CD2 4.45Å; F287-L292 HydrophobicContact CD1-CD1 4.04Å; F287-L292 HydrophobicContact CE1-CD1 3.77Å; M288-L292 HydrophobicContact CB-CD2 4.29Å; M288-L292 HydrophobicContact CG-CB 4.34Å; M288-L292 HydrophobicContact CG-CD2 3.94Å; M288-L292 WeakPolarHBondContact O-CB 3.33Å; M288-L292 PolarHBondContact O-N 2.66Å; L292-P295 HydrophobicContact CB-CB 4.13Å; L292-P295 HydrophobicContact CB-CG 3.91Å; L292-P295 HydrophobicContact CD2-CB 3.95Å; L292-P295 HydrophobicContact CD2-CG 4.12Å; L292-P295 HydrophobicContact CG-CB 4.45Å
293	Q	94.1	Very high	92.6	Very high	141 Å²	141	75.6 Å²	75.6	66%	0.659	37%	0.37	S	S	*	.	S	Bend	trans	-102	99.3	-178.1	-60.9	-58.4	-49.4	0	0	110.8	D135	D135-Q293 PolarHBondContact OD2-N 3.21Å
294	K	93.9	Very high	92.1	Very high	180 Å²	180	75.1 Å²	75.1	78%	0.783	36%	0.364	S	S	*	.	S	Bend	trans	44.8	55.8	-177.6	-62.6	-178.8	-179.5	178.6	0	111.9	R134	R134-K294 VanDerWaalsContact CZ-O 3.31Å; R134-K294 PolarHBondContact NE-O 2.64Å; R134-K294 PolarHBondContact NH2-O 2.84Å
295	P	96.8	Very high	91.9	Very high	21 Å²	21	75.5 Å²	75.5	14%	0.136	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-58.5	151.4	-174.2	27.4	-35.2	0	0	0	111.4	R134 D135 L137 M288 L292	R134-P295 PolarHBondContact NH2-O 2.78Å; D135-P295 HydrophobicContact CB-CB 4.05Å; D135-P295 CarbonylContact O-C 3.56Å; D135-P295 WeakPolarHBondContact O-CA 3.48Å; L137-P295 HydrophobicContact CB-CB 4.3Å; M288-P295 HydrophobicContact CG-CG 4.17Å; L292-P295 HydrophobicContact CB-CB 4.13Å; L292-P295 HydrophobicContact CB-CG 3.91Å; L292-P295 HydrophobicContact CD2-CB 3.95Å; L292-P295 HydrophobicContact CD2-CG 4.12Å; L292-P295 HydrophobicContact CG-CB 4.45Å
296	Y	97.6	Very high	91.6	Very high	78 Å²	78	71.2 Å²	71.2	31%	0.306	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	117.3	165.1	-171.9	-105.3	0	0	0	108.5	I129 D135 L137 I298	I129-Y296 HydrophobicContact CB-CD1 4.26Å; I129-Y296 HydrophobicContact CD1-CD1 4.32Å; I129-Y296 HydrophobicContact CD1-CE1 4.3Å; I129-Y296 HydrophobicContact CD1-CG 4.44Å; I129-Y296 HydrophobicContact CG1-CD1 3.74Å; I129-Y296 HydrophobicContact CG1-CE1 3.85Å; I129-Y296 HydrophobicContact CG1-CG 4.23Å; I129-Y296 HydrophobicContact CG2-CD1 3.93Å; I129-Y296 HydrophobicContact CG2-CG 3.85Å; D135-Y296 PolarHBondContact O-N 2.75Å; L137-Y296 PolarHBondContact N-O 3.34Å; Y296-I298 HydrophobicContact CD1-CD1 3.92Å; Y296-I298 HydrophobicContact CD1-CG1 3.5Å; Y296-I298 HydrophobicContact CE1-CD1 4.1Å; Y296-I298 HydrophobicContact CE1-CG1 3.56Å
297	E	96.4	Very high	91.3	Very high	125 Å²	125	69.6 Å²	69.6	58%	0.584	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90	119.3	-178	-59.5	-172.3	-161.6	0	0	110.1	L137	L137-E297 HydrophobicContact CB-CG 4.2Å; L137-E297 HydrophobicContact CD2-CB 4.49Å; L137-E297 HydrophobicContact CD2-CG 3.85Å; L137-E297 CarbonylContact O-C 3.42Å; L137-E297 WeakPolarHBondContact O-CA 3.24Å
298	I	95.4	Very high	91.2	Very high	10 Å²	10	69.5 Å²	69.5	5%	0.051	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	116.6	177.2	-59.7	170.2	0	0	0	107.1	I122 E125 I136 L137 A138 R139 Y296 L300	I122-I298 HydrophobicContact CD1-CG2 3.9Å; E125-I298 HydrophobicContact CB-CD1 4.02Å; E125-I298 HydrophobicContact CB-CG1 4.39Å; E125-I298 HydrophobicContact CB-CG2 4.02Å; I136-I298 HydrophobicContact CG2-CD1 4Å; L137-I298 PolarHBondContact O-N 3.39Å; A138-I298 HydrophobicContact CB-CB 4.5Å; R139-I298 PolarHBondContact N-O 3.11Å; Y296-I298 HydrophobicContact CD1-CD1 3.92Å; Y296-I298 HydrophobicContact CD1-CG1 3.5Å; Y296-I298 HydrophobicContact CE1-CD1 4.1Å; Y296-I298 HydrophobicContact CE1-CG1 3.56Å; I298-L300 HydrophobicContact CG2-CD1 3.98Å; I298-L300 HydrophobicContact CG2-CD2 4.43Å; I298-L300 HydrophobicContact CG2-CG 3.82Å
299	N	93	Very high	91.3	Very high	101 Å²	101	68.6 Å²	68.6	54%	0.54	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	106.9	172.9	-175.7	16.3	0	0	0	110.5	R139 M301	R139-N299 HydrophobicContact CB-CB 4.49Å; N299-M301 PolarHBondContact OD1-N 3.4Å
300	L	87.9	Confident	91.4	Very high	69 Å²	69	64.8 Å²	64.8	36%	0.361	32%	0.317	S	S	.	.			trans	-105.9	19.2	-179.6	-62.3	171.5	0	0	0	112.3	P121 I122 E125 R139 I298	P121-L300 HydrophobicContact CB-CD1 4.09Å; I122-L300 HydrophobicContact CB-CD1 3.67Å; I122-L300 HydrophobicContact CD1-CD1 3.89Å; I122-L300 HydrophobicContact CG1-CD1 4.36Å; I122-L300 VanDerWaalsContact N-CD1 3.35Å; E125-L300 HydrophobicContact CG-CD2 4.34Å; R139-L300 PolarHBondContact O-N 2.85Å; R139-L300 VanDerWaalsContact O-N 3.11Å; I298-L300 HydrophobicContact CG2-CD1 3.98Å; I298-L300 HydrophobicContact CG2-CD2 4.43Å; I298-L300 HydrophobicContact CG2-CG 3.82Å
301	M	81.9	Confident	91.5	Very high	14 Å²	14	61.9 Å²	61.9	7%	0.069	29%	0.294	C	S	.	.			trans	-120.4	94.8	-173.3	-59.8	-177.7	65.5	0	0	110.5	R139 A140 K141 N299 L304	R139-M301 HydrophobicContact CG-CB 4.41Å; R139-M301 HydrophobicContact CG-CG 4.11Å; R139-M301 HydrophobicContact CG-SD 3.49Å; R139-M301 WeakPolarHBondContact CG-SD 3.45Å; A140-M301 VanDerWaalsContact CA-SD 3.56Å; K141-M301 HydrophobicContact CG-CE 3.76Å; K141-M301 HydrophobicContact CG-CG 4.06Å; K141-M301 HydrophobicContact CG-SD 4.28Å; K141-M301 PolarHBondContact N-SD 2.81Å; K141-M301 VanDerWaalsContact N-SD 3.43Å; N299-M301 PolarHBondContact OD1-N 3.4Å; M301-L304 HydrophobicContact CE-CB 4.4Å; M301-L304 HydrophobicContact CE-CD2 3.43Å; M301-L304 VanDerWaalsContact CE-CD2 3.43Å; M301-L304 HydrophobicContact CE-CG 4.46Å
302	E	80.7	Confident	91.7	Very high	196 Å²	196	61.9 Å²	61.9	92%	0.916	29%	0.293	S	S	*	.	S	Bend	trans	-72.5	-52.5	160	-66.9	-176.9	165.5	0	0	109.5
303	E	84.2	Confident	91.8	Very high	101 Å²	101	63.3 Å²	63.3	47%	0.472	30%	0.298	S	S	.	.	S	Bend	trans	-100.1	150.1	172.6	-64.6	171.2	170.6	0	0	110.5	K141	K141-E303 WeakPolarHBondContact CE-O 3.15Å
304	L	84.6	Confident	92	Very high	30 Å²	30	56.9 Å²	56.9	16%	0.157	27%	0.27	C	S	.	.	S	Bend	trans	-80.9	-36.3	178.8	-73.3	173.9	0	0	0	112.7	M301 L419 L453	M301-L304 HydrophobicContact CE-CB 4.4Å; M301-L304 HydrophobicContact CE-CD2 3.43Å; M301-L304 VanDerWaalsContact CE-CD2 3.43Å; M301-L304 HydrophobicContact CE-CG 4.46Å; L304-L419 HydrophobicContact CB-CD1 4.4Å; L304-L419 HydrophobicContact CB-CD2 4.38Å; L304-L419 VanDerWaalsContact O-CD1 3.24Å; L304-L419 WeakPolarHBondContact O-CD1 3.25Å; L304-L453 HydrophobicContact CB-CD2 4.02Å; L304-L453 HydrophobicContact CD1-CD2 3.46Å; L304-L453 VanDerWaalsContact CD1-CD2 3.46Å; L304-L453 HydrophobicContact CG-CD2 4.38Å
305	T	86.8	Confident	92.2	Very high	9 Å²	9	54.3 Å²	54.3	6%	0.055	26%	0.256	C	S	.	.	S	Bend	trans	-81.7	157.1	-176.2	56.1	0	0	0	0	112	K141 L419 I422 L453 T455	K141-T305 WeakPolarHBondContact CD-O 3.41Å; K141-T305 WeakPolarHBondContact CE-O 3.48Å; K141-T305 PolarHBondContact NZ-O 2.98Å; T305-L419 HydrophobicContact CG2-CD1 4.36Å; T305-I422 HydrophobicContact CG2-CD1 3.97Å; T305-L453 HydrophobicContact CG2-CD1 4.45Å; T305-T455 HydrophobicContact CG2-CG2 4.18Å
306	L	87	Confident	92.2	Very high	11 Å²	11	54 Å²	54	6%	0.058	25%	0.253	C	S	.	.			trans	-73.9	132.9	173.4	-72.8	167	0	0	0	109.6	K141 N142 T144 G308 V309	K141-L306 HydrophobicContact CB-CD2 3.81Å; K141-L306 HydrophobicContact CB-CG 4.49Å; K141-L306 HydrophobicContact CD-CD2 3.98Å; K141-L306 HydrophobicContact CG-CD2 4.47Å; N142-L306 WeakPolarHBondContact O-CD1 3.15Å; N142-L306 WeakPolarHBondContact O-CD2 3.31Å; T144-L306 HydrophobicContact CG2-CD2 4.27Å; L306-G308 PolarHBondContact O-N 3.25Å; L306-V309 HydrophobicContact CB-CB 4.27Å; L306-V309 HydrophobicContact CB-CG2 3.78Å; L306-V309 HydrophobicContact CD1-CG2 3.97Å; L306-V309 PolarHBondContact O-N 3.39Å
307	K	89.9	Confident	92.2	Very high	112 Å²	112	53.9 Å²	53.9	49%	0.487	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-28.8	177.8	-66.5	-174.4	-179	-175.3	0	112	T87 S88 D89 V309	T87-K307 HydrophobicContact CG2-CB 4.28Å; S88-K307 WeakPolarHBondContact OG-CD 3.45Å; S88-K307 PolarHBondContact OG-NZ 2.96Å; D89-K307 WeakPolarHBondContact OD2-CB 3.21Å; D89-K307 PolarHBondContact OD2-N 3.28Å; K307-V309 VanDerWaalsContact C-N 3.29Å; K307-V309 PolarHBondContact O-N 3.32Å
308	G	91.8	Very high	92.2	Very high	2 Å²	2	52.2 Å²	52.2	2%	0.021	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-8.8	178.4	0	0	0	0	0	114.5	L306 L431 G432	L306-G308 PolarHBondContact O-N 3.25Å; G308-L431 CarbonylContact O-C 3.53Å; G308-L431 VanDerWaalsContact O-CA 3.26Å; G308-L431 WeakPolarHBondContact O-CA 3.44Å; G308-G432 PolarHBondContact O-N 3.3Å
309	V	94.7	Very high	92.3	Very high	7 Å²	7	63.2 Å²	63.2	4%	0.042	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	106.3	-176.7	180	0	0	0	0	110.6	L306 K307 Q311 I422 S425 G432 A434	L306-V309 HydrophobicContact CB-CB 4.27Å; L306-V309 HydrophobicContact CB-CG2 3.78Å; L306-V309 HydrophobicContact CD1-CG2 3.97Å; L306-V309 PolarHBondContact O-N 3.39Å; K307-V309 VanDerWaalsContact C-N 3.29Å; K307-V309 PolarHBondContact O-N 3.32Å; V309-Q311 HydrophobicContact CG1-CG 4.29Å; V309-I422 HydrophobicContact CG1-CB 4.34Å; V309-S425 WeakPolarHBondContact CG2-O 3.48Å; V309-G432 CarbonylContact C-O 3.51Å; V309-G432 WeakPolarHBondContact CA-O 3.29Å; V309-A434 HydrophobicContact CG1-CB 3.74Å
310	T	96.8	Very high	92.5	Very high	35 Å²	35	63.1 Å²	63.1	22%	0.215	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	128.8	172.3	-58.6	0	0	0	0	110	Y312 G432 L433 A434 L468	T310-Y312 HydrophobicContact CG2-CD2 4.2Å; T310-Y312 HydrophobicContact CG2-CE1 4.26Å; T310-Y312 HydrophobicContact CG2-CE2 3.53Å; T310-G432 PolarHBondContact N-O 3.48Å; T310-L433 HydrophobicContact CG2-CD1 4.29Å; T310-A434 PolarHBondContact O-N 3.46Å; T310-L468 HydrophobicContact CG2-CD1 4.25Å
311	Q	97.9	Very high	93	Very high	17 Å²	17	60 Å²	60	8%	0.079	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	121.1	-172.7	-63.1	166.1	75.9	0	0	110.9	V309 Y418 I422 A434 T455 I457 K458	V309-Q311 HydrophobicContact CG1-CG 4.29Å; Q311-Y418 VanDerWaalsContact OE1-CE1 3.3Å; Q311-Y418 PolarHBondContact OE1-OH 2.83Å; Q311-I422 HydrophobicContact CG-CD1 4.17Å; Q311-A434 WeakPolarHBondContact CA-O 3.36Å; Q311-A434 HydrophobicContact CG-CB 4.29Å; Q311-T455 PolarHBondContact NE2-OG1 3.16Å; Q311-I457 HydrophobicContact CB-CG1 4.4Å; Q311-I457 HydrophobicContact CB-CG2 4.34Å; Q311-K458 PolarHBondContact O-N 3.15Å
312	Y	98.3	Very high	93.8	Very high	29 Å²	29	61.8 Å²	61.8	11%	0.114	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	155.3	174.6	-66.2	-57.2	0	0	0	112.4	T310 L433 A434 I435 N436 K458 I460 P461 I464	T310-Y312 HydrophobicContact CG2-CD2 4.2Å; T310-Y312 HydrophobicContact CG2-CE1 4.26Å; T310-Y312 HydrophobicContact CG2-CE2 3.53Å; Y312-L433 HydrophobicContact CD2-CD1 3.65Å; Y312-L433 HydrophobicContact CE2-CD1 3.74Å; Y312-A434 PolarHBondContact N-O 2.79Å; Y312-I435 CarbonylContact O-C 3.6Å; Y312-I435 WeakPolarHBondContact O-CA 3.48Å; Y312-N436 WeakPolarHBondContact O-CB 3.3Å; Y312-N436 PolarHBondContact O-N 3.16Å; Y312-N436 PolarHBondContact O-ND2 2.99Å; Y312-K458 CarbonylContact C-O 3.56Å; Y312-K458 WeakPolarHBondContact CA-O 3.42Å; Y312-K458 HydrophobicContact CD1-CB 3.89Å; Y312-K458 HydrophobicContact CE1-CB 4.01Å; Y312-I460 HydrophobicContact CG-CG1 4.45Å; Y312-P461 HydrophobicContact CE1-CG 4.27Å; Y312-P461 HydrophobicContact CE2-CG 4.46Å; Y312-I464 HydrophobicContact CD2-CD1 4.17Å; Y312-I464 HydrophobicContact CD2-CG1 4.31Å; Y312-I464 HydrophobicContact CE2-CD1 4.39Å; Y312-I464 HydrophobicContact CE2-CG1 4.07Å; Y312-I464 HydrophobicContact CE2-CG2 4.04Å
313	Y	98.2	Very high	94.6	Very high	41 Å²	41	58.7 Å²	58.7	16%	0.161	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	144.3	165.3	77.8	-93	0	0	0	112.5	N436 I438 I457 K458 P459 I460	Y313-N436 CarbonylContact C-O 3.57Å; Y313-N436 VanDerWaalsContact CA-O 3.25Å; Y313-N436 WeakPolarHBondContact CA-O 3.02Å; Y313-I438 HydrophobicContact CD2-CB 4.5Å; Y313-I438 HydrophobicContact CD2-CG1 4.26Å; Y313-I438 HydrophobicContact CG-CG1 4.26Å; Y313-I457 HydrophobicContact CD1-CG2 4.07Å; Y313-I457 WeakPolarHBondContact CD1-O 3.44Å; Y313-I457 VanDerWaalsContact CE1-O 3.27Å; Y313-I457 WeakPolarHBondContact CE1-O 3.46Å; Y313-K458 VanDerWaalsContact CD1-O 3.3Å; Y313-K458 WeakPolarHBondContact CD1-O 3.44Å; Y313-K458 PolarHBondContact N-O 3.26Å; Y313-P459 HydrophobicContact CE1-CB 4.03Å; Y313-P459 HydrophobicContact CE2-CB 4.46Å; Y313-I460 WeakPolarHBondContact O-CB 3.46Å; Y313-I460 PolarHBondContact O-N 3.43Å
314	A	98.1	Very high	95.2	Very high	7 Å²	7	54.4 Å²	54.4	6%	0.058	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	117.7	168.2	0	0	0	0	0	108.1	V316 N436 L437 I438 I460	A314-V316 HydrophobicContact CB-CG1 4.45Å; A314-V316 PolarHBondContact O-N 2.76Å; A314-N436 PolarHBondContact N-O 2.89Å; A314-L437 HydrophobicContact CB-CD2 3.94Å; A314-I438 PolarHBondContact O-N 3.36Å; A314-I460 HydrophobicContact CB-CG2 3.9Å
315	Y	97.6	Very high	95.8	Very high	125 Å²	125	53 Å²	53	49%	0.49	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	118.2	176.7	-168.6	-97	0	0	0	110.1	I438 Y440	Y315-I438 CarbonylContact C-O 3.59Å; Y315-I438 WeakPolarHBondContact CA-O 3.41Å; Y315-I438 HydrophobicContact CD2-CB 4.45Å; Y315-I438 HydrophobicContact CD2-CG2 4.02Å; Y315-I438 HydrophobicContact CE2-CG2 4.41Å; Y315-Y440 VanDerWaalsContact OH-CA 3.26Å; Y315-Y440 WeakPolarHBondContact OH-CA 3.14Å; Y315-Y440 VanDerWaalsContact OH-CB 3.29Å; Y315-Y440 WeakPolarHBondContact OH-CB 3.13Å; Y315-Y440 WeakPolarHBondContact OH-CD2 3.37Å
316	V	98.1	Very high	96.3	Very high	14 Å²	14	54.8 Å²	54.8	9%	0.085	25%	0.254	C	S	.	.			trans	-145	154.4	-171.8	-64.8	0	0	0	0	111.1	A314 Q320 K321 C324 L437 I438 T439	A314-V316 HydrophobicContact CB-CG1 4.45Å; A314-V316 PolarHBondContact O-N 2.76Å; V316-Q320 HydrophobicContact CB-CB 4.19Å; V316-K321 HydrophobicContact CG2-CG 3.67Å; V316-C324 HydrophobicContact CG1-CB 4.02Å; V316-L437 HydrophobicContact CG2-CB 4.07Å; V316-I438 PolarHBondContact N-O 3.49Å; V316-T439 WeakPolarHBondContact O-CA 3.42Å
317	T	97.7	Very high	96.8	Very high	76 Å²	76	55.5 Å²	55.5	47%	0.466	26%	0.259	S	S	.	.			trans	-79.4	159.6	164.4	63.8	0	0	0	0	110.7	R319 Q320 K321	T317-R319 PolarHBondContact O-N 3.22Å; T317-R319 VanDerWaalsContact O-N 3.17Å; T317-Q320 PolarHBondContact O-N 3.11Å; T317-Q320 WeakPolarHBondContact OG1-CG 3.22Å; T317-Q320 PolarHBondContact OG1-OE1 3.23Å; T317-K321 PolarHBondContact O-N 3.38Å
318	E	96.5	Very high	97.1	Very high	90 Å²	90	50.5 Å²	50.5	42%	0.421	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-52.5	-39.7	175.8	-83	-61.8	123.3	0	0	112.7	Q320 K321 R346 T439	E318-Q320 PolarHBondContact O-N 3.02Å; E318-K321 PolarHBondContact O-N 3Å; E318-K321 WeakPolarHBondContact OE1-CD 3.44Å; E318-K321 WeakPolarHBondContact OE1-CE 3.47Å; E318-K321 IonicContact OE1-NZ 3.01Å; E318-K321 PolarHBondContact OE1-NZ 3.32Å; E318-R346 IonicContact OE2-CZ 3.63Å; E318-R346 IonicContact OE2-NH1 3.82Å; E318-R346 IonicContact OE2-NH2 2.89Å; E318-R346 PolarHBondContact OE2-NH2 3.05Å; E318-T439 HydrophobicContact CG-CG2 4.28Å; E318-T439 WeakPolarHBondContact OE1-CG2 3.46Å
319	R	96.1	Very high	97.4	Very high	242 Å²	242	50.8 Å²	50.8	91%	0.913	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-66.5	-26.6	179.4	-64.2	-178.4	-175.7	155.3	1.4	112.8	T317	T317-R319 PolarHBondContact O-N 3.22Å; T317-R319 VanDerWaalsContact O-N 3.17Å
320	Q	97.8	Very high	97.3	Very high	99 Å²	99	53.3 Å²	53.3	46%	0.463	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-88.8	-15.5	-179.1	-72.4	164.4	-33.3	0	0	113.1	V316 T317 E318 V322 H323 C324	V316-Q320 HydrophobicContact CB-CB 4.19Å; T317-Q320 PolarHBondContact O-N 3.11Å; T317-Q320 WeakPolarHBondContact OG1-CG 3.22Å; T317-Q320 PolarHBondContact OG1-OE1 3.23Å; E318-Q320 PolarHBondContact O-N 3.02Å; Q320-V322 VanDerWaalsContact C-N 3.35Å; Q320-V322 PolarHBondContact O-N 3.34Å; Q320-H323 WeakPolarHBondContact O-CB 3.45Å; Q320-H323 PolarHBondContact O-N 3.5Å; Q320-C324 WeakPolarHBondContact O-CB 3.28Å; Q320-C324 PolarHBondContact O-N 2.96Å
321	K	98.4	Very high	97.2	Very high	2 Å²	2	56.6 Å²	56.6	1%	0.009	26%	0.264	C	S	.	.	H	α-helix	trans	-54.9	-45.1	-174.8	-77.5	-173.5	166.6	177.3	0	113.7	V316 T317 E318 C324 L325 F409 D410 L437	V316-K321 HydrophobicContact CG2-CG 3.67Å; T317-K321 PolarHBondContact O-N 3.38Å; E318-K321 PolarHBondContact O-N 3Å; E318-K321 WeakPolarHBondContact OE1-CD 3.44Å; E318-K321 WeakPolarHBondContact OE1-CE 3.47Å; E318-K321 IonicContact OE1-NZ 3.01Å; E318-K321 PolarHBondContact OE1-NZ 3.32Å; K321-C324 PolarHBondContact O-N 3.46Å; K321-L325 WeakPolarHBondContact O-CB 3.34Å; K321-L325 PolarHBondContact O-N 3.43Å; K321-F409 HydrophobicContact CB-CD2 4.48Å; K321-F409 HydrophobicContact CB-CE1 4.1Å; K321-F409 HydrophobicContact CB-CE2 3.67Å; K321-F409 HydrophobicContact CB-CZ 3.44Å; K321-F409 VanDerWaalsContact CB-CZ 3.44Å; K321-F409 HydrophobicContact CD-CD1 4.26Å; K321-F409 HydrophobicContact CD-CE1 3.93Å; K321-F409 HydrophobicContact CD-CZ 4.16Å; K321-F409 WeakPolarHBondContact CD-O 3.35Å; K321-F409 WeakPolarHBondContact CE-O 3.39Å; K321-F409 HydrophobicContact CG-CZ 4.41Å; K321-F409 PolarHBondContact NZ-O 3.48Å; K321-D410 IonicContact NZ-OD1 3.89Å; K321-D410 PolarHBondContact NZ-OD1 3Å; K321-L437 HydrophobicContact CB-CD1 4Å; K321-L437 HydrophobicContact CD-CB 4.49Å; K321-L437 HydrophobicContact CG-CB 4.35Å; K321-L437 HydrophobicContact CG-CD1 4.01Å
322	V	97.9	Very high	97.1	Very high	52 Å²	52	56.2 Å²	56.2	32%	0.315	26%	0.263	S	S	.	.	H	α-helix	trans	-66.8	-38.6	178.8	178.4	0	0	0	0	111.5	Q320 L325 N326 L350 L357 F409	Q320-V322 VanDerWaalsContact C-N 3.35Å; Q320-V322 PolarHBondContact O-N 3.34Å; V322-L325 PolarHBondContact O-N 2.68Å; V322-N326 PolarHBondContact O-N 2.92Å; V322-L350 HydrophobicContact CG2-CD1 4.43Å; V322-L357 HydrophobicContact CG1-CD1 4.33Å; V322-F409 HydrophobicContact CG2-CE2 4.43Å; V322-F409 HydrophobicContact CG2-CZ 4.04Å
323	H	97.3	Very high	97	Very high	132 Å²	132	57.9 Å²	57.9	61%	0.611	27%	0.271	S	S	*	.	H	α-helix	trans	-65	-47.1	175.6	177.8	76.3	0	0	0	111.1	Q320 L325 N326 T327	Q320-H323 WeakPolarHBondContact O-CB 3.45Å; Q320-H323 PolarHBondContact O-N 3.5Å; H323-L325 VanDerWaalsContact C-N 3.33Å; H323-L325 PolarHBondContact O-N 3.34Å; H323-N326 WeakPolarHBondContact O-CB 3.41Å; H323-N326 PolarHBondContact O-N 3.11Å; H323-N326 VanDerWaalsContact O-N 3.17Å; H323-T327 PolarHBondContact O-N 3.2Å; H323-T327 PolarHBondContact O-OG1 3.24Å
324	C	97.9	Very high	96.8	Very high	10 Å²	10	56.2 Å²	56.2	7%	0.068	27%	0.265	C	S	.	.	H	α-helix	trans	-57.1	-46.6	175.2	-178.2	0	0	0	0	111.2	V316 Q320 K321 N326 T327 L328	V316-C324 HydrophobicContact CG1-CB 4.02Å; Q320-C324 WeakPolarHBondContact O-CB 3.28Å; Q320-C324 PolarHBondContact O-N 2.96Å; K321-C324 PolarHBondContact O-N 3.46Å; C324-N326 VanDerWaalsContact C-N 3.31Å; C324-N326 PolarHBondContact O-N 2.93Å; C324-T327 WeakPolarHBondContact O-CB 3.3Å; C324-T327 PolarHBondContact O-N 3.2Å; C324-T327 VanDerWaalsContact O-N 3.1Å; C324-L328 WeakPolarHBondContact O-CG 3.37Å; C324-L328 PolarHBondContact O-N 3.04Å
325	L	97.9	Very high	96.7	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-57.7	-42.8	176.7	-178.1	64.6	0	0	0	112.3	K321 V322 H323 T327 L328 F329 I339 L350 I354 I407 F409	K321-L325 WeakPolarHBondContact O-CB 3.34Å; K321-L325 PolarHBondContact O-N 3.43Å; V322-L325 PolarHBondContact O-N 2.68Å; H323-L325 VanDerWaalsContact C-N 3.33Å; H323-L325 PolarHBondContact O-N 3.34Å; L325-T327 VanDerWaalsContact C-N 3.34Å; L325-T327 PolarHBondContact O-N 3.38Å; L325-L328 WeakPolarHBondContact O-CB 3.38Å; L325-L328 PolarHBondContact O-N 3.49Å; L325-F329 HydrophobicContact CD1-CE1 4.26Å; L325-F329 HydrophobicContact CD1-CE2 4.11Å; L325-F329 HydrophobicContact CD1-CZ 3.89Å; L325-F329 HydrophobicContact CD2-CE2 4.06Å; L325-F329 HydrophobicContact CD2-CZ 4.28Å; L325-F329 HydrophobicContact CG-CD2 4.25Å; L325-F329 HydrophobicContact CG-CE2 3.73Å; L325-F329 HydrophobicContact CG-CZ 4.02Å; L325-F329 PolarHBondContact O-N 3.12Å; L325-I339 HydrophobicContact CD1-CD1 4.24Å; L325-I339 HydrophobicContact CD2-CD1 4.48Å; L325-L350 HydrophobicContact CD2-CD1 3.86Å; L325-L350 HydrophobicContact CD2-CD2 4.46Å; L325-L350 HydrophobicContact CD2-CG 4.48Å; L325-I354 HydrophobicContact CD2-CD1 3.82Å; L325-I354 HydrophobicContact CD2-CG1 3.84Å; L325-I407 HydrophobicContact CD1-CD1 3.64Å; L325-I407 HydrophobicContact CD1-CG2 4.28Å; L325-F409 HydrophobicContact CB-CE2 4.4Å; L325-F409 HydrophobicContact CD2-CD2 4.14Å; L325-F409 HydrophobicContact CD2-CE2 4.16Å
326	N	97.2	Very high	96.7	Very high	47 Å²	47	54.4 Å²	54.4	25%	0.251	26%	0.263	S	S	.	.	H	α-helix	trans	-61.2	-43.6	175.4	-173.2	47.6	0	0	0	111.8	V322 H323 C324 L328 F329 S330 L357 Y359	V322-N326 PolarHBondContact O-N 2.92Å; H323-N326 WeakPolarHBondContact O-CB 3.41Å; H323-N326 PolarHBondContact O-N 3.11Å; H323-N326 VanDerWaalsContact O-N 3.17Å; C324-N326 VanDerWaalsContact C-N 3.31Å; C324-N326 PolarHBondContact O-N 2.93Å; N326-L328 VanDerWaalsContact C-N 3.32Å; N326-L328 PolarHBondContact O-N 2.98Å; N326-F329 PolarHBondContact O-N 3.17Å; N326-S330 PolarHBondContact O-N 3.35Å; N326-S330 VanDerWaalsContact O-N 3.08Å; N326-S330 PolarHBondContact O-OG 3.48Å; N326-L357 HydrophobicContact CB-CD1 3.97Å; N326-Y359 WeakPolarHBondContact OD1-CE2 3.3Å; N326-Y359 PolarHBondContact OD1-OH 3.19Å
327	T	96.6	Very high	96.6	Very high	27 Å²	27	53.8 Å²	53.8	17%	0.166	26%	0.259	C	S	.	.	H	α-helix	trans	-60.9	-41	175.3	-55.7	0	0	0	0	111.8	M12 H323 C324 L325 S330 R331	M12-T327 HydrophobicContact CE-CG2 4.28Å; M12-T327 HydrophobicContact SD-CG2 4.24Å; H323-T327 PolarHBondContact O-N 3.2Å; H323-T327 PolarHBondContact O-OG1 3.24Å; C324-T327 WeakPolarHBondContact O-CB 3.3Å; C324-T327 PolarHBondContact O-N 3.2Å; C324-T327 VanDerWaalsContact O-N 3.1Å; L325-T327 VanDerWaalsContact C-N 3.34Å; L325-T327 PolarHBondContact O-N 3.38Å; T327-S330 PolarHBondContact O-N 2.88Å; T327-R331 HydrophobicContact CG2-CG 4.39Å; T327-R331 WeakPolarHBondContact O-CB 3.32Å; T327-R331 WeakPolarHBondContact O-CG 3.38Å; T327-R331 PolarHBondContact O-N 3.37Å
328	L	96.8	Very high	96.6	Very high	7 Å²	7	50.2 Å²	50.2	4%	0.037	24%	0.237	C	C	.	.	H	α-helix	trans	-61.9	-45.4	175.9	-66.2	177.2	0	0	0	111.4	C324 L325 N326 S330 R331 L332 I407 I435 L437 I460	C324-L328 WeakPolarHBondContact O-CG 3.37Å; C324-L328 PolarHBondContact O-N 3.04Å; L325-L328 WeakPolarHBondContact O-CB 3.38Å; L325-L328 PolarHBondContact O-N 3.49Å; N326-L328 VanDerWaalsContact C-N 3.32Å; N326-L328 PolarHBondContact O-N 2.98Å; L328-S330 VanDerWaalsContact C-N 3.28Å; L328-S330 PolarHBondContact O-N 3.32Å; L328-R331 PolarHBondContact O-N 3.11Å; L328-L332 HydrophobicContact CB-CD1 4.09Å; L328-L332 HydrophobicContact CD2-CD1 4.23Å; L328-L332 VanDerWaalsContact O-CB 3.28Å; L328-L332 WeakPolarHBondContact O-CB 3.41Å; L328-L332 VanDerWaalsContact O-CG 3.28Å; L328-L332 WeakPolarHBondContact O-CG 3.46Å; L328-L332 PolarHBondContact O-N 3Å; L328-I407 HydrophobicContact CD1-CD1 4.36Å; L328-I435 HydrophobicContact CD1-CD1 4.19Å; L328-I435 HydrophobicContact CD1-CG2 3.84Å; L328-I435 HydrophobicContact CD2-CD1 3.84Å; L328-L437 HydrophobicContact CD1-CD2 4.31Å; L328-I460 HydrophobicContact CD2-CD1 3.68Å
329	F	96.8	Very high	96.7	Very high	8 Å²	8	46 Å²	46	4%	0.035	22%	0.217	C	C	.	.	H	α-helix	trans	-60.2	-37.8	176.2	-70.2	-38.6	0	0	0	113	L325 N326 I334 I339 I354 Y359 N387	L325-F329 HydrophobicContact CD1-CE1 4.26Å; L325-F329 HydrophobicContact CD1-CE2 4.11Å; L325-F329 HydrophobicContact CD1-CZ 3.89Å; L325-F329 HydrophobicContact CD2-CE2 4.06Å; L325-F329 HydrophobicContact CD2-CZ 4.28Å; L325-F329 HydrophobicContact CG-CD2 4.25Å; L325-F329 HydrophobicContact CG-CE2 3.73Å; L325-F329 HydrophobicContact CG-CZ 4.02Å; L325-F329 PolarHBondContact O-N 3.12Å; N326-F329 PolarHBondContact O-N 3.17Å; F329-I334 HydrophobicContact CD1-CD1 3.59Å; F329-I334 HydrophobicContact CE1-CD1 4.14Å; F329-I339 HydrophobicContact CE1-CD1 4.14Å; F329-I339 HydrophobicContact CZ-CD1 3.66Å; F329-I354 HydrophobicContact CE2-CD1 4.34Å; F329-I354 HydrophobicContact CE2-CG1 4.07Å; F329-I354 HydrophobicContact CE2-CG2 3.78Å; F329-I354 HydrophobicContact CZ-CD1 4.19Å; F329-I354 HydrophobicContact CZ-CG1 4.41Å; F329-I354 HydrophobicContact CZ-CG2 4.07Å; F329-Y359 HydrophobicContact CB-CD1 4.22Å; F329-Y359 HydrophobicContact CB-CD2 4.48Å; F329-Y359 HydrophobicContact CB-CE1 3.62Å; F329-Y359 HydrophobicContact CB-CE2 3.92Å; F329-Y359 VanDerWaalsContact CB-CZ 3.44Å; F329-Y359 HydrophobicContact CD2-CD1 4.38Å; F329-Y359 AromaticContact CD2-CD2 3.6Å; F329-Y359 HydrophobicContact CD2-CD2 3.6Å; F329-Y359 HydrophobicContact CD2-CE1 4.43Å; F329-Y359 AromaticContact CD2-CE2 3.66Å; F329-Y359 HydrophobicContact CD2-CE2 3.66Å; F329-Y359 AromaticContact CD2-CG 3.98Å; F329-Y359 HydrophobicContact CD2-CG 3.98Å; F329-Y359 HydrophobicContact CE2-CD2 4.13Å; F329-Y359 HydrophobicContact CE2-CG 4.39Å; F329-Y359 HydrophobicContact CG-CD1 4.35Å; F329-Y359 HydrophobicContact CG-CD2 4.31Å; F329-Y359 HydrophobicContact CG-CE1 4.23Å; F329-Y359 HydrophobicContact CG-CE2 4.19Å; F329-Y359 HydrophobicContact CG-CG 4.39Å; F329-N387 WeakPolarHBondContact CE1-OD1 3.48Å
330	S	94.1	Very high	96.8	Very high	59 Å²	59	34.4 Å²	34.4	41%	0.413	17%	0.174	S	C	.	.	H	α-helix	trans	-75	-28.8	179.3	-57.3	0	0	0	0	113.6	N326 T327 L328 Y359	N326-S330 PolarHBondContact O-N 3.35Å; N326-S330 VanDerWaalsContact O-N 3.08Å; N326-S330 PolarHBondContact O-OG 3.48Å; T327-S330 PolarHBondContact O-N 2.88Å; L328-S330 VanDerWaalsContact C-N 3.28Å; L328-S330 PolarHBondContact O-N 3.32Å; S330-Y359 PolarHBondContact OG-OH 3.48Å
331	R	94.4	Very high	96.8	Very high	104 Å²	104	29.7 Å²	29.7	39%	0.392	15%	0.152	S	C	.	.	H	α-helix	trans	-95.2	-29.3	-176	-70.7	-166.7	177.4	-165.1	0.5	114.2	M12 G13 T327 L328 S462	M12-R331 PolarHBondContact SD-NH1 3.23Å; G13-R331 PolarHBondContact O-NH2 3.33Å; T327-R331 HydrophobicContact CG2-CG 4.39Å; T327-R331 WeakPolarHBondContact O-CB 3.32Å; T327-R331 WeakPolarHBondContact O-CG 3.38Å; T327-R331 PolarHBondContact O-N 3.37Å; L328-R331 PolarHBondContact O-N 3.11Å; R331-S462 PolarHBondContact NH1-O 2.89Å; R331-S462 VanDerWaalsContact NH1-O 3.14Å
332	L	95.7	Very high	96.6	Very high	9 Å²	9	33 Å²	33	5%	0.047	17%	0.169	C	C	.	.	S	Bend	trans	-93.1	144.9	-176	-59.3	174.6	0	0	0	111.8	L328 I334 V405 L433 I435 I464 Y469	L328-L332 HydrophobicContact CB-CD1 4.09Å; L328-L332 HydrophobicContact CD2-CD1 4.23Å; L328-L332 VanDerWaalsContact O-CB 3.28Å; L328-L332 WeakPolarHBondContact O-CB 3.41Å; L328-L332 VanDerWaalsContact O-CG 3.28Å; L328-L332 WeakPolarHBondContact O-CG 3.46Å; L328-L332 PolarHBondContact O-N 3Å; L332-I334 VanDerWaalsContact C-N 3.33Å; L332-I334 HydrophobicContact CB-CD1 4.04Å; L332-I334 HydrophobicContact CB-CG1 3.82Å; L332-I334 HydrophobicContact CD1-CD1 4.4Å; L332-I334 PolarHBondContact O-N 3.18Å; L332-V405 HydrophobicContact CD1-CG1 4.39Å; L332-L433 HydrophobicContact CD1-CD2 4.17Å; L332-L433 HydrophobicContact CD2-CD2 3.99Å; L332-I435 HydrophobicContact CD1-CD1 3.42Å; L332-I435 VanDerWaalsContact CD1-CD1 3.42Å; L332-I464 HydrophobicContact CD2-CB 4.33Å; L332-I464 HydrophobicContact CD2-CD1 3.71Å; L332-Y469 WeakPolarHBondContact CA-OH 3.31Å; L332-Y469 HydrophobicContact CB-CE2 4.45Å
333	Q	95.7	Very high	96.5	Very high	64 Å²	64	32.6 Å²	32.6	30%	0.299	17%	0.169	S	C	.	.			trans	-88.8	74.7	170.2	-172.3	168.8	-39.7	0	0	109.6	N335 N404 K466 Y469 V470	Q333-N335 PolarHBondContact O-N 2.68Å; Q333-N404 PolarHBondContact O-ND2 2.84Å; Q333-K466 VanDerWaalsContact OE1-NZ 3.11Å; Q333-Y469 PolarHBondContact N-OH 3.03Å; Q333-Y469 WeakPolarHBondContact O-CE2 3.46Å; Q333-V470 HydrophobicContact CB-CG2 3.92Å; Q333-V470 HydrophobicContact CG-CG1 4.17Å; Q333-V470 HydrophobicContact CG-CG2 4.37Å
334	I	95.2	Very high	96.5	Very high	7 Å²	7	27.3 Å²	27.3	4%	0.036	15%	0.147	C	C	.	.			trans	-78.6	118.9	-178.6	-68.1	159.9	0	0	0	109.3	F329 L332 R386 V405	F329-I334 HydrophobicContact CD1-CD1 3.59Å; F329-I334 HydrophobicContact CE1-CD1 4.14Å; L332-I334 VanDerWaalsContact C-N 3.33Å; L332-I334 HydrophobicContact CB-CD1 4.04Å; L332-I334 HydrophobicContact CB-CG1 3.82Å; L332-I334 HydrophobicContact CD1-CD1 4.4Å; L332-I334 PolarHBondContact O-N 3.18Å; I334-R386 PolarHBondContact O-NH2 3.22Å; I334-V405 HydrophobicContact CG1-CB 4.06Å; I334-V405 HydrophobicContact CG1-CG1 4.4Å; I334-V405 HydrophobicContact CG1-CG2 3.74Å
335	N	94.9	Very high	96.4	Very high	89 Å²	89	33.3 Å²	33.3	48%	0.476	17%	0.174	S	C	.	.	S	Bend	trans	-72.9	-67.8	168.4	-176.9	12.3	0	0	0	109.1	Q333 A402 N404	Q333-N335 PolarHBondContact O-N 2.68Å; N335-A402 WeakPolarHBondContact CB-O 3.47Å; N335-A402 PolarHBondContact ND2-O 2.85Å; N335-N404 PolarHBondContact N-OD1 3.01Å
336	Q	96.9	Very high	96.4	Very high	5 Å²	5	37.1 Å²	37.1	2%	0.023	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	149.3	162.8	-61.4	-172.6	-79.6	0	0	110.8	F380 C385 R386 A402 V403 N404 V405	Q336-F380 HydrophobicContact CB-CE2 4.27Å; Q336-F380 HydrophobicContact CB-CZ 4.11Å; Q336-F380 PolarHBondContact NE2-O 3.15Å; Q336-C385 PolarHBondContact NE2-O 2.82Å; Q336-R386 CarbonylContact C-O 3.58Å; Q336-R386 WeakPolarHBondContact CA-O 3.37Å; Q336-A402 HydrophobicContact CG-CB 4.22Å; Q336-A402 PolarHBondContact N-O 3.23Å; Q336-V403 HydrophobicContact CB-CG2 4.05Å; Q336-V403 WeakPolarHBondContact O-CA 3.36Å; Q336-N404 PolarHBondContact O-N 2.96Å; Q336-N404 PolarHBondContact O-OD1 3.14Å; Q336-V405 PolarHBondContact O-N 3.17Å
337	S	97.5	Very high	96.5	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	147.8	174.4	74.9	0	0	0	0	113.7	F380 R386 N387 L388 V405	S337-F380 WeakPolarHBondContact O-CZ 3.35Å; S337-R386 PolarHBondContact N-O 3.13Å; S337-N387 WeakPolarHBondContact O-CA 3.26Å; S337-N387 PolarHBondContact OG-OD1 3.31Å; S337-L388 PolarHBondContact O-N 3.1Å; S337-V405 WeakPolarHBondContact CA-O 3.22Å; S337-V405 WeakPolarHBondContact CB-O 3.19Å
338	I	97.3	Very high	96.5	Very high	2 Å²	2	37.7 Å²	37.7	1%	0.01	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	127.4	167	-60.5	-178.1	0	0	0	108.5	F340 F380 L388 C390 V403 V405 V406 I407 R424	I338-F340 HydrophobicContact CB-CE2 4.38Å; I338-F340 HydrophobicContact CG2-CD1 4.47Å; I338-F340 HydrophobicContact CG2-CD2 4.18Å; I338-F340 HydrophobicContact CG2-CE1 3.91Å; I338-F340 HydrophobicContact CG2-CE2 3.6Å; I338-F340 HydrophobicContact CG2-CZ 3.45Å; I338-F340 VanDerWaalsContact CG2-CZ 3.45Å; I338-F380 HydrophobicContact CD1-CE1 4.12Å; I338-F380 HydrophobicContact CG1-CE1 3.86Å; I338-F380 HydrophobicContact CG1-CZ 3.98Å; I338-L388 CarbonylContact C-O 3.54Å; I338-L388 WeakPolarHBondContact CA-O 3.42Å; I338-C390 VanDerWaalsContact CG2-SG 3.51Å; I338-V403 HydrophobicContact CD1-CG1 4.31Å; I338-V403 HydrophobicContact CD1-CG2 4.03Å; I338-V403 HydrophobicContact CG1-CG1 4.05Å; I338-V403 HydrophobicContact CG1-CG2 3.96Å; I338-V405 PolarHBondContact N-O 3.14Å; I338-V406 WeakPolarHBondContact O-CA 3.39Å; I338-I407 PolarHBondContact O-N 2.96Å; I338-R424 HydrophobicContact CD1-CB 4.04Å; I338-R424 HydrophobicContact CD1-CG 4.04Å
339	I	98.4	Very high	96.6	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	116.4	-175.2	-53.2	170.1	0	0	0	108.4	L325 F329 L350 I354 N387 L388 V389 C390 I407 F409	L325-I339 HydrophobicContact CD1-CD1 4.24Å; L325-I339 HydrophobicContact CD2-CD1 4.48Å; F329-I339 HydrophobicContact CE1-CD1 4.14Å; F329-I339 HydrophobicContact CZ-CD1 3.66Å; I339-L350 HydrophobicContact CG2-CD2 3.87Å; I339-I354 HydrophobicContact CD1-CD1 3.64Å; I339-N387 HydrophobicContact CD1-CB 4.47Å; I339-L388 PolarHBondContact N-O 3.46Å; I339-V389 HydrophobicContact CB-CG2 4.11Å; I339-V389 HydrophobicContact CD1-CG2 4.22Å; I339-V389 CarbonylContact O-C 3.44Å; I339-V389 VanDerWaalsContact O-CA 3.29Å; I339-V389 WeakPolarHBondContact O-CA 3.48Å; I339-C390 PolarHBondContact O-N 2.81Å; I339-I407 CarbonylContact C-O 3.52Å; I339-I407 VanDerWaalsContact CA-O 3.24Å; I339-I407 WeakPolarHBondContact CA-O 3.39Å; I339-I407 HydrophobicContact CG1-CB 4.2Å; I339-I407 HydrophobicContact CG1-CD1 4.39Å; I339-I407 HydrophobicContact CG2-CB 4.35Å; I339-F409 HydrophobicContact CG2-CB 3.78Å
340	F	98.4	Very high	96.7	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	130.6	-176.2	-69	-74	0	0	0	112.6	I338 C390 T395 V406 I407 F409 D410 R421 R424	I338-F340 HydrophobicContact CB-CE2 4.38Å; I338-F340 HydrophobicContact CG2-CD1 4.47Å; I338-F340 HydrophobicContact CG2-CD2 4.18Å; I338-F340 HydrophobicContact CG2-CE1 3.91Å; I338-F340 HydrophobicContact CG2-CE2 3.6Å; I338-F340 HydrophobicContact CG2-CZ 3.45Å; I338-F340 VanDerWaalsContact CG2-CZ 3.45Å; F340-C390 WeakPolarHBondContact CA-O 3.37Å; F340-C390 WeakPolarHBondContact CD1-SG 3.28Å; F340-C390 WeakPolarHBondContact CE1-SG 3.2Å; F340-T395 HydrophobicContact CD1-CG2 3.77Å; F340-T395 HydrophobicContact CE1-CG2 3.2Å; F340-T395 HydrophobicContact CE2-CG2 4.45Å; F340-T395 HydrophobicContact CZ-CG2 3.6Å; F340-V406 HydrophobicContact CD2-CG1 3.85Å; F340-V406 HydrophobicContact CE2-CG1 3.77Å; F340-I407 PolarHBondContact N-O 3.45Å; F340-F409 WeakPolarHBondContact O-CB 3.21Å; F340-F409 PolarHBondContact O-N 3.49Å; F340-D410 PolarHBondContact O-N 2.82Å; F340-D410 VanDerWaalsContact O-N 3.14Å; F340-R421 HydrophobicContact CB-CG 4.31Å; F340-R421 HydrophobicContact CD1-CG 4.04Å; F340-R421 HydrophobicContact CD2-CB 3.7Å; F340-R421 HydrophobicContact CD2-CG 3.59Å; F340-R421 HydrophobicContact CE1-CG 4.24Å; F340-R421 HydrophobicContact CE2-CB 3.68Å; F340-R421 HydrophobicContact CE2-CG 3.79Å; F340-R421 HydrophobicContact CG-CB 4.34Å; F340-R421 HydrophobicContact CG-CG 3.71Å; F340-R421 HydrophobicContact CZ-CB 4.32Å; F340-R421 HydrophobicContact CZ-CG 4.11Å; F340-R424 HydrophobicContact CE2-CG 4.1Å; F340-R424 HydrophobicContact CZ-CG 3.78Å
341	C	97.9	Very high	96.8	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.193	C	C	.	.			trans	-121.5	153.6	169.7	-56.9	0	0	0	0	110.6	S343 R346 V347 L350 C390 T391 D410	C341-S343 VanDerWaalsContact C-N 3.34Å; C341-S343 PolarHBondContact O-N 2.83Å; C341-R346 HydrophobicContact CB-CB 4.1Å; C341-V347 HydrophobicContact CB-CG2 3.77Å; C341-L350 WeakPolarHBondContact SG-CD2 3.43Å; C341-C390 PolarHBondContact N-O 2.65Å; C341-T391 WeakPolarHBondContact O-CA 3.41Å; C341-D410 WeakPolarHBondContact CA-OD2 3.43Å; C341-D410 WeakPolarHBondContact CB-OD2 3.45Å
342	N	94.7	Very high	97	Very high	71 Å²	71	41 Å²	41	38%	0.38	20%	0.202	S	C	.	.	S	Bend	trans	-81.9	-9.9	-176	-70.5	-13.1	0	0	0	113.5	D410 F411 R421	N342-D410 HydrophobicContact CB-CB 4.07Å; N342-D410 VanDerWaalsContact CG-CB 3.5Å; N342-D410 PolarHBondContact N-OD2 2.87Å; N342-D410 WeakPolarHBondContact ND2-CB 3.16Å; N342-F411 PolarHBondContact ND2-O 2.8Å; N342-F411 VanDerWaalsContact ND2-O 3.14Å; N342-R421 PolarHBondContact OD1-NH2 3.3Å
343	S	95.7	Very high	97.1	Very high	43 Å²	43	45.3 Å²	45.3	30%	0.301	22%	0.221	S	C	.	.	S	Bend	trans	-142.6	148.5	-179.9	80.9	0	0	0	0	113.7	C341 Q345 R346 V347	C341-S343 VanDerWaalsContact C-N 3.34Å; C341-S343 PolarHBondContact O-N 2.83Å; S343-Q345 VanDerWaalsContact C-N 3.29Å; S343-Q345 PolarHBondContact O-N 3.36Å; S343-R346 PolarHBondContact O-N 3.32Å; S343-R346 VanDerWaalsContact O-N 3.16Å; S343-R346 WeakPolarHBondContact OG-CG 3.45Å; S343-R346 PolarHBondContact OG-N 3.18Å; S343-V347 WeakPolarHBondContact O-CG2 3.21Å; S343-V347 PolarHBondContact O-N 3.27Å
344	S	95.9	Very high	97.2	Very high	21 Å²	21	42.3 Å²	42.3	15%	0.147	21%	0.207	C	C	.	.	H	α-helix	trans	-59.3	-38.3	178.9	-48.3	0	0	0	0	112.9	R346 V347 E348	S344-R346 VanDerWaalsContact C-N 3.33Å; S344-R346 PolarHBondContact O-N 2.95Å; S344-V347 WeakPolarHBondContact O-CB 3.27Å; S344-V347 PolarHBondContact O-N 2.8Å; S344-E348 PolarHBondContact O-N 3.02Å; S344-E348 VanDerWaalsContact O-N 3.08Å
345	Q	97.2	Very high	97.3	Very high	137 Å²	137	44.9 Å²	44.9	64%	0.64	23%	0.225	S	C	*	.	H	α-helix	trans	-62.7	-42.4	178.1	-175.2	-176.2	9.7	0	0	111.1	S343 V347 E348 L349	S343-Q345 VanDerWaalsContact C-N 3.29Å; S343-Q345 PolarHBondContact O-N 3.36Å; Q345-V347 VanDerWaalsContact C-N 3.35Å; Q345-E348 PolarHBondContact O-N 2.81Å; Q345-L349 HydrophobicContact CG-CD1 4.09Å; Q345-L349 WeakPolarHBondContact O-CB 3.43Å; Q345-L349 VanDerWaalsContact O-CG 3.28Å; Q345-L349 WeakPolarHBondContact O-CG 3.31Å; Q345-L349 PolarHBondContact O-N 3.33Å; Q345-L349 VanDerWaalsContact O-N 3.09Å
346	R	97.4	Very high	97.4	Very high	79 Å²	79	46.1 Å²	46.1	30%	0.298	23%	0.228	S	C	.	.	H	α-helix	trans	-66.4	-38.9	176.3	-72.9	178.9	69.9	84.6	-13.7	111.5	E318 C341 S343 S344 E348 L349 L350 D410	E318-R346 IonicContact OE2-CZ 3.63Å; E318-R346 IonicContact OE2-NH1 3.82Å; E318-R346 IonicContact OE2-NH2 2.89Å; E318-R346 PolarHBondContact OE2-NH2 3.05Å; C341-R346 HydrophobicContact CB-CB 4.1Å; S343-R346 PolarHBondContact O-N 3.32Å; S343-R346 VanDerWaalsContact O-N 3.16Å; S343-R346 WeakPolarHBondContact OG-CG 3.45Å; S343-R346 PolarHBondContact OG-N 3.18Å; S344-R346 VanDerWaalsContact C-N 3.33Å; S344-R346 PolarHBondContact O-N 2.95Å; R346-E348 PolarHBondContact O-N 3.14Å; R346-L349 PolarHBondContact O-N 3.32Å; R346-L350 WeakPolarHBondContact O-CB 3.35Å; R346-L350 PolarHBondContact O-N 2.86Å; R346-D410 IonicContact CZ-OD1 2.73Å; R346-D410 IonicContact CZ-OD2 3.9Å; R346-D410 IonicContact NE-OD1 3.52Å; R346-D410 PolarHBondContact NE-OD1 2.85Å; R346-D410 IonicContact NE-OD2 3.37Å; R346-D410 PolarHBondContact NE-OD2 3.4Å; R346-D410 IonicContact NH2-OD1 3.23Å; R346-D410 PolarHBondContact NH2-OD1 2.92Å; R346-D410 IonicContact NH2-OD2 2.88Å
347	V	98.3	Very high	97.3	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-54.8	-52.1	174.9	165.4	0	0	0	0	111.3	C341 S343 S344 Q345 A351 Y363 V389 C390 T391	C341-V347 HydrophobicContact CB-CG2 3.77Å; S343-V347 WeakPolarHBondContact O-CG2 3.21Å; S343-V347 PolarHBondContact O-N 3.27Å; S344-V347 WeakPolarHBondContact O-CB 3.27Å; S344-V347 PolarHBondContact O-N 2.8Å; Q345-V347 VanDerWaalsContact C-N 3.35Å; V347-A351 WeakPolarHBondContact O-CB 3.47Å; V347-A351 PolarHBondContact O-N 3Å; V347-Y363 HydrophobicContact CG1-CD2 4.29Å; V347-Y363 HydrophobicContact CG1-CG 4.39Å; V347-V389 HydrophobicContact CB-CG1 4.11Å; V347-V389 HydrophobicContact CG1-CB 4.35Å; V347-V389 HydrophobicContact CG1-CG1 3.95Å; V347-V389 WeakPolarHBondContact CG1-O 3.37Å; V347-V389 HydrophobicContact CG2-CG1 4.1Å; V347-C390 VanDerWaalsContact CG2-C 3.45Å; V347-T391 HydrophobicContact CG2-CG2 3.68Å
348	E	97.8	Very high	97.2	Very high	86 Å²	86	51.1 Å²	51.1	40%	0.402	27%	0.266	S	S	.	.	H	α-helix	trans	-64.1	-46.2	-179.7	-67.3	-179.5	-143.1	0	0	112.2	S344 Q345 R346 L350 A351 K352 Y363 H365	S344-E348 PolarHBondContact O-N 3.02Å; S344-E348 VanDerWaalsContact O-N 3.08Å; Q345-E348 PolarHBondContact O-N 2.81Å; R346-E348 PolarHBondContact O-N 3.14Å; E348-L350 PolarHBondContact O-N 3.11Å; E348-A351 PolarHBondContact O-N 3.1Å; E348-K352 PolarHBondContact O-N 3.34Å; E348-Y363 HydrophobicContact CG-CD2 4.11Å; E348-Y363 HydrophobicContact CG-CE2 3.87Å; E348-H365 VanDerWaalsContact CG-NE2 3.32Å; E348-H365 WeakPolarHBondContact CG-NE2 3.33Å; E348-H365 IonicContact OE1-CE1 3.42Å; E348-H365 PolarHBondContact OE1-CE1 3.4Å; E348-H365 VanDerWaalsContact OE1-CE1 3.24Å; E348-H365 IonicContact OE1-NE2 3.74Å; E348-H365 PolarHBondContact OE1-NE2 3.19Å
349	L	98	Very high	97.2	Very high	101 Å²	101	53.4 Å²	53.4	53%	0.529	27%	0.274	S	S	.	.	H	α-helix	trans	-63	-43.1	179.6	-71.1	174.2	0	0	0	112	Q345 R346 K352 K353	Q345-L349 HydrophobicContact CG-CD1 4.09Å; Q345-L349 WeakPolarHBondContact O-CB 3.43Å; Q345-L349 VanDerWaalsContact O-CG 3.28Å; Q345-L349 WeakPolarHBondContact O-CG 3.31Å; Q345-L349 PolarHBondContact O-N 3.33Å; Q345-L349 VanDerWaalsContact O-N 3.09Å; R346-L349 PolarHBondContact O-N 3.32Å; L349-K352 PolarHBondContact O-N 3.33Å; L349-K353 VanDerWaalsContact O-CG 3.31Å; L349-K353 WeakPolarHBondContact O-CG 2.8Å; L349-K353 PolarHBondContact O-N 3.01Å
350	L	98.5	Very high	97	Very high	8 Å²	8	56.1 Å²	56.1	4%	0.042	29%	0.294	C	S	.	.	H	α-helix	trans	-67.3	-44.2	179.5	-178	61	0	0	0	110.9	V322 L325 I339 C341 R346 E348 K352 K353 I354 V389 F409	V322-L350 HydrophobicContact CG2-CD1 4.43Å; L325-L350 HydrophobicContact CD2-CD1 3.86Å; L325-L350 HydrophobicContact CD2-CD2 4.46Å; L325-L350 HydrophobicContact CD2-CG 4.48Å; I339-L350 HydrophobicContact CG2-CD2 3.87Å; C341-L350 WeakPolarHBondContact SG-CD2 3.43Å; R346-L350 WeakPolarHBondContact O-CB 3.35Å; R346-L350 PolarHBondContact O-N 2.86Å; E348-L350 PolarHBondContact O-N 3.11Å; L350-K352 VanDerWaalsContact C-N 3.29Å; L350-K352 PolarHBondContact O-N 3.28Å; L350-K353 CarbonylContact O-C 3.5Å; L350-K353 WeakPolarHBondContact O-CA 3.49Å; L350-K353 WeakPolarHBondContact O-CB 3.28Å; L350-K353 PolarHBondContact O-N 3.22Å; L350-I354 HydrophobicContact CD1-CD1 4.32Å; L350-I354 HydrophobicContact CD1-CG1 4.24Å; L350-I354 HydrophobicContact CD2-CD1 4.45Å; L350-I354 HydrophobicContact CG-CD1 3.9Å; L350-I354 HydrophobicContact CG-CG1 4.28Å; L350-I354 WeakPolarHBondContact O-CG1 3.39Å; L350-I354 PolarHBondContact O-N 3.18Å; L350-V389 HydrophobicContact CB-CG1 4.3Å; L350-V389 HydrophobicContact CD2-CG1 4Å; L350-V389 HydrophobicContact CD2-CG2 4.3Å; L350-V389 HydrophobicContact CG-CG1 4.41Å; L350-V389 HydrophobicContact CG-CG2 4.32Å; L350-F409 HydrophobicContact CD1-CD2 4.17Å; L350-F409 HydrophobicContact CD1-CE1 4.41Å; L350-F409 HydrophobicContact CD1-CE2 3.68Å; L350-F409 HydrophobicContact CD1-CZ 3.81Å; L350-F409 HydrophobicContact CD2-CB 4.07Å; L350-F409 HydrophobicContact CD2-CD1 3.91Å; L350-F409 HydrophobicContact CD2-CD2 3.67Å; L350-F409 HydrophobicContact CD2-CE1 4.23Å; L350-F409 HydrophobicContact CD2-CE2 4.02Å; L350-F409 HydrophobicContact CD2-CG 3.61Å; L350-F409 HydrophobicContact CD2-CZ 4.28Å
351	A	98.1	Very high	96.9	Very high	3 Å²	3	56.9 Å²	56.9	3%	0.025	30%	0.299	C	S	.	.	H	α-helix	trans	-59.2	-42.6	177.1	0	0	0	0	0	111.8	V347 E348 K353 I354 S355 Y363 V389	V347-A351 WeakPolarHBondContact O-CB 3.47Å; V347-A351 PolarHBondContact O-N 3Å; E348-A351 PolarHBondContact O-N 3.1Å; A351-K353 VanDerWaalsContact C-N 3.32Å; A351-K353 PolarHBondContact O-N 2.89Å; A351-I354 PolarHBondContact O-N 2.89Å; A351-S355 PolarHBondContact O-N 3.02Å; A351-S355 PolarHBondContact O-OG 3.46Å; A351-Y363 HydrophobicContact CB-CD1 3.76Å; A351-Y363 HydrophobicContact CB-CG 4.04Å; A351-V389 HydrophobicContact CB-CB 4.38Å; A351-V389 HydrophobicContact CB-CG2 4.32Å
352	K	97.7	Very high	96.8	Very high	135 Å²	135	59.6 Å²	59.6	59%	0.587	31%	0.311	S	S	*	.	H	α-helix	trans	-59.6	-42.2	172.9	-174.4	175.5	-178.1	176.2	0	111.8	E348 L349 L350 S355 Q356	E348-K352 PolarHBondContact O-N 3.34Å; L349-K352 PolarHBondContact O-N 3.33Å; L350-K352 VanDerWaalsContact C-N 3.29Å; L350-K352 PolarHBondContact O-N 3.28Å; K352-S355 PolarHBondContact O-N 3.33Å; K352-Q356 VanDerWaalsContact O-CG 3.28Å; K352-Q356 WeakPolarHBondContact O-CG 3.46Å; K352-Q356 PolarHBondContact O-N 2.87Å
353	K	98	Very high	96.9	Very high	101 Å²	101	60.1 Å²	60.1	44%	0.439	31%	0.308	S	S	.	.	H	α-helix	trans	-66.6	-42	177.8	-72.2	-73.6	167.8	-162.2	0	112.5	L349 L350 A351 S355 Q356 L357	L349-K353 VanDerWaalsContact O-CG 3.31Å; L349-K353 WeakPolarHBondContact O-CG 2.8Å; L349-K353 PolarHBondContact O-N 3.01Å; L350-K353 CarbonylContact O-C 3.5Å; L350-K353 WeakPolarHBondContact O-CA 3.49Å; L350-K353 WeakPolarHBondContact O-CB 3.28Å; L350-K353 PolarHBondContact O-N 3.22Å; A351-K353 VanDerWaalsContact C-N 3.32Å; A351-K353 PolarHBondContact O-N 2.89Å; K353-S355 VanDerWaalsContact C-N 3.34Å; K353-S355 PolarHBondContact O-N 3.46Å; K353-Q356 WeakPolarHBondContact O-CB 3Å; K353-Q356 PolarHBondContact O-N 3.22Å; K353-L357 WeakPolarHBondContact O-CG 3.28Å; K353-L357 PolarHBondContact O-N 3.43Å
354	I	98.3	Very high	96.9	Very high	1 Å²	1	58 Å²	58	1%	0.005	29%	0.293	C	S	.	.	H	α-helix	trans	-61.6	-44.3	176	-66	170.9	0	0	0	110.6	L325 F329 I339 L350 A351 Q356 L357 G358 Y359 C361 V389	L325-I354 HydrophobicContact CD2-CD1 3.82Å; L325-I354 HydrophobicContact CD2-CG1 3.84Å; F329-I354 HydrophobicContact CE2-CD1 4.34Å; F329-I354 HydrophobicContact CE2-CG1 4.07Å; F329-I354 HydrophobicContact CE2-CG2 3.78Å; F329-I354 HydrophobicContact CZ-CD1 4.19Å; F329-I354 HydrophobicContact CZ-CG1 4.41Å; F329-I354 HydrophobicContact CZ-CG2 4.07Å; I339-I354 HydrophobicContact CD1-CD1 3.64Å; L350-I354 HydrophobicContact CD1-CD1 4.32Å; L350-I354 HydrophobicContact CD1-CG1 4.24Å; L350-I354 HydrophobicContact CD2-CD1 4.45Å; L350-I354 HydrophobicContact CG-CD1 3.9Å; L350-I354 HydrophobicContact CG-CG1 4.28Å; L350-I354 WeakPolarHBondContact O-CG1 3.39Å; L350-I354 PolarHBondContact O-N 3.18Å; A351-I354 PolarHBondContact O-N 2.89Å; I354-Q356 VanDerWaalsContact C-N 3.33Å; I354-Q356 PolarHBondContact O-N 3.35Å; I354-L357 WeakPolarHBondContact O-CB 3.34Å; I354-L357 PolarHBondContact O-N 3.37Å; I354-L357 VanDerWaalsContact O-N 3.13Å; I354-G358 PolarHBondContact O-N 3.47Å; I354-Y359 PolarHBondContact O-N 3.23Å; I354-C361 HydrophobicContact CB-CB 3.97Å; I354-C361 HydrophobicContact CG2-CB 3.59Å; I354-V389 HydrophobicContact CD1-CG2 3.5Å
355	S	96.5	Very high	96.8	Very high	61 Å²	61	57.2 Å²	57.2	43%	0.427	29%	0.287	S	S	.	.	H	α-helix	trans	-62.9	-38	174.7	-61.5	0	0	0	0	112.4	A351 K352 K353 L357 G358 Y359	A351-S355 PolarHBondContact O-N 3.02Å; A351-S355 PolarHBondContact O-OG 3.46Å; K352-S355 PolarHBondContact O-N 3.33Å; K353-S355 VanDerWaalsContact C-N 3.34Å; K353-S355 PolarHBondContact O-N 3.46Å; S355-L357 VanDerWaalsContact C-N 3.29Å; S355-L357 PolarHBondContact O-N 2.68Å; S355-G358 PolarHBondContact O-N 3.2Å; S355-Y359 WeakPolarHBondContact CA-O 3.25Å
356	Q	97.3	Very high	96.5	Very high	114 Å²	114	53.6 Å²	53.6	53%	0.533	28%	0.281	S	S	.	.	H	α-helix	trans	-64.1	-31.4	173.7	-75.6	174.6	-7.3	0	0	113	K352 K353 I354 G358	K352-Q356 VanDerWaalsContact O-CG 3.28Å; K352-Q356 WeakPolarHBondContact O-CG 3.46Å; K352-Q356 PolarHBondContact O-N 2.87Å; K353-Q356 WeakPolarHBondContact O-CB 3Å; K353-Q356 PolarHBondContact O-N 3.22Å; I354-Q356 VanDerWaalsContact C-N 3.33Å; I354-Q356 PolarHBondContact O-N 3.35Å; Q356-G358 PolarHBondContact O-N 3.05Å
357	L	95.3	Very high	96.2	Very high	63 Å²	63	58 Å²	58	33%	0.33	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-7.6	173.9	-67	170.3	0	0	0	112.8	V322 N326 K353 I354 S355 Y359	V322-L357 HydrophobicContact CG1-CD1 4.33Å; N326-L357 HydrophobicContact CB-CD1 3.97Å; K353-L357 WeakPolarHBondContact O-CG 3.28Å; K353-L357 PolarHBondContact O-N 3.43Å; I354-L357 WeakPolarHBondContact O-CB 3.34Å; I354-L357 PolarHBondContact O-N 3.37Å; I354-L357 VanDerWaalsContact O-N 3.13Å; S355-L357 VanDerWaalsContact C-N 3.29Å; S355-L357 PolarHBondContact O-N 2.68Å; L357-Y359 HydrophobicContact CB-CD2 3.8Å; L357-Y359 HydrophobicContact CB-CE2 3.94Å
358	G	95.4	Very high	95.9	Very high	47 Å²	47	59 Å²	59	49%	0.485	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.5	11.2	177	0	0	0	0	0	115	I354 S355 Q356	I354-G358 PolarHBondContact O-N 3.47Å; S355-G358 PolarHBondContact O-N 3.2Å; Q356-G358 PolarHBondContact O-N 3.05Å
359	Y	96.2	Very high	95.6	Very high	50 Å²	50	64.8 Å²	64.8	20%	0.196	33%	0.325	C	S	.	.			trans	-100.6	137.8	177.4	-56.7	-83.2	0	0	0	111.1	N326 F329 S330 I354 S355 L357 C361	N326-Y359 WeakPolarHBondContact OD1-CE2 3.3Å; N326-Y359 PolarHBondContact OD1-OH 3.19Å; F329-Y359 HydrophobicContact CB-CD1 4.22Å; F329-Y359 HydrophobicContact CB-CD2 4.48Å; F329-Y359 HydrophobicContact CB-CE1 3.62Å; F329-Y359 HydrophobicContact CB-CE2 3.92Å; F329-Y359 VanDerWaalsContact CB-CZ 3.44Å; F329-Y359 HydrophobicContact CD2-CD1 4.38Å; F329-Y359 AromaticContact CD2-CD2 3.6Å; F329-Y359 HydrophobicContact CD2-CD2 3.6Å; F329-Y359 HydrophobicContact CD2-CE1 4.43Å; F329-Y359 AromaticContact CD2-CE2 3.66Å; F329-Y359 HydrophobicContact CD2-CE2 3.66Å; F329-Y359 AromaticContact CD2-CG 3.98Å; F329-Y359 HydrophobicContact CD2-CG 3.98Å; F329-Y359 HydrophobicContact CE2-CD2 4.13Å; F329-Y359 HydrophobicContact CE2-CG 4.39Å; F329-Y359 HydrophobicContact CG-CD1 4.35Å; F329-Y359 HydrophobicContact CG-CD2 4.31Å; F329-Y359 HydrophobicContact CG-CE1 4.23Å; F329-Y359 HydrophobicContact CG-CE2 4.19Å; F329-Y359 HydrophobicContact CG-CG 4.39Å; S330-Y359 PolarHBondContact OG-OH 3.48Å; I354-Y359 PolarHBondContact O-N 3.23Å; S355-Y359 WeakPolarHBondContact CA-O 3.25Å; L357-Y359 HydrophobicContact CB-CD2 3.8Å; L357-Y359 HydrophobicContact CB-CE2 3.94Å; Y359-C361 PolarHBondContact O-N 3.26Å
360	S	93.6	Very high	95.2	Very high	58 Å²	58	60.7 Å²	60.7	41%	0.406	30%	0.303	S	S	.	.			trans	-61.2	126.8	172.5	64.9	0	0	0	0	109.9	R386 N387	S360-R386 PolarHBondContact OG-N 2.81Å; S360-N387 WeakPolarHBondContact O-CB 3.41Å; S360-N387 PolarHBondContact O-ND2 3.05Å
361	C	97.2	Very high	94.8	Very high	15 Å²	15	67.3 Å²	67.3	10%	0.101	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	126.6	179.6	-164.6	0	0	0	0	111.7	I354 Y359 C385 N387 V389	I354-C361 HydrophobicContact CB-CB 3.97Å; I354-C361 HydrophobicContact CG2-CB 3.59Å; Y359-C361 PolarHBondContact O-N 3.26Å; C361-C385 VanDerWaalsContact CA-SG 3.56Å; C361-C385 PolarHBondContact N-SG 2.86Å; C361-N387 WeakPolarHBondContact CA-O 3.43Å; C361-N387 HydrophobicContact CB-CB 4.46Å; C361-V389 WeakPolarHBondContact SG-CG2 3.39Å
362	F	96.3	Very high	94.5	Very high	58 Å²	58	70.5 Å²	70.5	25%	0.254	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	166.3	162.4	-67.9	-21.9	0	0	0	110.5	V376 D379 F380 C385 N387 L388 V389	F362-V376 HydrophobicContact CB-CG1 3.8Å; F362-V376 HydrophobicContact CD2-CG1 4.18Å; F362-V376 HydrophobicContact CG-CG1 4.26Å; F362-D379 HydrophobicContact CE2-CB 3.62Å; F362-D379 HydrophobicContact CZ-CB 4.23Å; F362-F380 HydrophobicContact CD2-CB 4.3Å; F362-C385 HydrophobicContact CD1-CB 4.13Å; F362-C385 HydrophobicContact CD2-CB 3.35Å; F362-C385 HydrophobicContact CE1-CB 4.09Å; F362-C385 HydrophobicContact CE2-CB 3.3Å; F362-C385 HydrophobicContact CG-CB 3.78Å; F362-C385 HydrophobicContact CZ-CB 3.7Å; F362-C385 PolarHBondContact N-SG 2.94Å; F362-C385 VanDerWaalsContact N-SG 3.39Å; F362-N387 PolarHBondContact N-O 3.39Å; F362-L388 HydrophobicContact CB-CD1 3.87Å; F362-V389 PolarHBondContact O-N 2.86Å
363	Y	96.9	Very high	94.2	Very high	81 Å²	81	64.6 Å²	64.6	32%	0.318	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	151.7	173	67.2	-93.5	0	0	0	112.1	V347 E348 A351 H365 M368 V389	V347-Y363 HydrophobicContact CG1-CD2 4.29Å; V347-Y363 HydrophobicContact CG1-CG 4.39Å; E348-Y363 HydrophobicContact CG-CD2 4.11Å; E348-Y363 HydrophobicContact CG-CE2 3.87Å; A351-Y363 HydrophobicContact CB-CD1 3.76Å; A351-Y363 HydrophobicContact CB-CG 4.04Å; Y363-H365 AromaticContact CD2-CD2 3.93Å; Y363-H365 AromaticContact CD2-NE2 3.9Å; Y363-H365 AromaticContact CE2-NE2 3.81Å; Y363-M368 HydrophobicContact CD2-CE 4.39Å; Y363-M368 HydrophobicContact CD2-SD 3.9Å; Y363-M368 HydrophobicContact CE2-CE 4.21Å; Y363-M368 HydrophobicContact CE2-CG 4.48Å; Y363-M368 HydrophobicContact CE2-SD 3.9Å; Y363-M368 WeakPolarHBondContact O-CE 3.41Å; Y363-V389 CarbonylContact C-O 3.47Å; Y363-V389 WeakPolarHBondContact CA-O 3.24Å
364	I	95	Very high	93.8	Very high	0 Å²	0	62 Å²	62	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	130.3	179.1	-166	147.8	0	0	0	114.2	M368 R373 V376 L388 V389 C390 T391 F394	I364-M368 VanDerWaalsContact CA-SD 3.55Å; I364-M368 HydrophobicContact CB-SD 4.43Å; I364-M368 HydrophobicContact CG1-SD 4.3Å; I364-R373 HydrophobicContact CD1-CB 3.66Å; I364-R373 HydrophobicContact CD1-CG 3.88Å; I364-R373 WeakPolarHBondContact CD1-O 3.41Å; I364-R373 HydrophobicContact CG1-CB 4.27Å; I364-R373 HydrophobicContact CG1-CG 3.92Å; I364-V376 HydrophobicContact CB-CG1 4.35Å; I364-V376 HydrophobicContact CD1-CB 4.31Å; I364-V376 HydrophobicContact CD1-CG1 4.22Å; I364-L388 HydrophobicContact CB-CD1 4.27Å; I364-L388 HydrophobicContact CG2-CD1 3.81Å; I364-L388 HydrophobicContact CG2-CD2 4.03Å; I364-L388 HydrophobicContact CG2-CG 4.09Å; I364-V389 PolarHBondContact N-O 3.12Å; I364-C390 HydrophobicContact CG2-CB 3.37Å; I364-C390 VanDerWaalsContact O-CA 3.24Å; I364-C390 WeakPolarHBondContact O-CA 3.37Å; I364-C390 WeakPolarHBondContact O-CB 3.14Å; I364-T391 PolarHBondContact O-N 3.18Å; I364-F394 HydrophobicContact CB-CD2 4.47Å; I364-F394 HydrophobicContact CB-CE2 4.25Å; I364-F394 HydrophobicContact CD1-CD2 4.19Å; I364-F394 HydrophobicContact CD1-CE1 4Å; I364-F394 HydrophobicContact CD1-CE2 3.23Å; I364-F394 HydrophobicContact CD1-CZ 3.09Å; I364-F394 HydrophobicContact CG1-CD2 3.99Å; I364-F394 HydrophobicContact CG1-CE2 3.42Å; I364-F394 VanDerWaalsContact CG1-CE2 3.42Å; I364-F394 HydrophobicContact CG1-CZ 3.82Å; I364-F394 HydrophobicContact CG2-CB 4.48Å; I364-F394 HydrophobicContact CG2-CD1 4.11Å; I364-F394 HydrophobicContact CG2-CD2 3.64Å; I364-F394 HydrophobicContact CG2-CE1 4.24Å; I364-F394 HydrophobicContact CG2-CE2 3.83Å; I364-F394 HydrophobicContact CG2-CG 3.79Å; I364-F394 HydrophobicContact CG2-CZ 4.11Å
365	H	94.4	Very high	93.5	Very high	3 Å²	3	68.8 Å²	68.8	1%	0.014	34%	0.339	C	S	.	.			trans	-156.2	168.9	176.4	59.3	71.3	0	0	0	112.6	E348 Y363 K367 M368 T391	E348-H365 VanDerWaalsContact CG-NE2 3.32Å; E348-H365 WeakPolarHBondContact CG-NE2 3.33Å; E348-H365 IonicContact OE1-CE1 3.42Å; E348-H365 PolarHBondContact OE1-CE1 3.4Å; E348-H365 VanDerWaalsContact OE1-CE1 3.24Å; E348-H365 IonicContact OE1-NE2 3.74Å; E348-H365 PolarHBondContact OE1-NE2 3.19Å; Y363-H365 AromaticContact CD2-CD2 3.93Å; Y363-H365 AromaticContact CD2-NE2 3.9Å; Y363-H365 AromaticContact CE2-NE2 3.81Å; H365-K367 VanDerWaalsContact C-N 3.29Å; H365-K367 PolarHBondContact ND1-N 3.36Å; H365-K367 PolarHBondContact O-N 2.85Å; H365-M368 PolarHBondContact N-SD 3.44Å; H365-M368 VanDerWaalsContact N-SD 3.39Å; H365-M368 WeakPolarHBondContact O-CB 3.23Å; H365-M368 PolarHBondContact O-N 2.93Å; H365-M368 VanDerWaalsContact O-N 3.12Å; H365-T391 HydrophobicContact CB-CG2 3.99Å
366	A	90.1	Very high	93.4	Very high	62 Å²	62	66.3 Å²	66.3	51%	0.512	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-27.6	-170	0	0	0	0	0	114.5	M368 L393	A366-M368 PolarHBondContact O-N 3.02Å; A366-L393 HydrophobicContact CB-CD2 4.12Å
367	K	91.6	Very high	93.1	Very high	171 Å²	171	61.4 Å²	61.4	74%	0.743	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-9.2	177.4	-57.2	-176	177.7	-175.8	0	114.6	H365	H365-K367 VanDerWaalsContact C-N 3.29Å; H365-K367 PolarHBondContact ND1-N 3.36Å; H365-K367 PolarHBondContact O-N 2.85Å
368	M	92.6	Very high	92.9	Very high	22 Å²	22	63.1 Å²	63.1	11%	0.108	30%	0.304	C	S	.	.	S	Bend	trans	-78.6	149.4	176.5	-69.6	162	75.6	0	0	111.2	Y363 I364 H365 A366 H372 R373 V376	Y363-M368 HydrophobicContact CD2-CE 4.39Å; Y363-M368 HydrophobicContact CD2-SD 3.9Å; Y363-M368 HydrophobicContact CE2-CE 4.21Å; Y363-M368 HydrophobicContact CE2-CG 4.48Å; Y363-M368 HydrophobicContact CE2-SD 3.9Å; Y363-M368 WeakPolarHBondContact O-CE 3.41Å; I364-M368 VanDerWaalsContact CA-SD 3.55Å; I364-M368 HydrophobicContact CB-SD 4.43Å; I364-M368 HydrophobicContact CG1-SD 4.3Å; H365-M368 PolarHBondContact N-SD 3.44Å; H365-M368 VanDerWaalsContact N-SD 3.39Å; H365-M368 WeakPolarHBondContact O-CB 3.23Å; H365-M368 PolarHBondContact O-N 2.93Å; H365-M368 VanDerWaalsContact O-N 3.12Å; A366-M368 PolarHBondContact O-N 3.02Å; M368-H372 WeakPolarHBondContact CE-CD2 3.23Å; M368-R373 HydrophobicContact CB-CG 3.71Å; M368-V376 HydrophobicContact CE-CG2 4.19Å
369	R	91.4	Very high	92.8	Very high	207 Å²	207	62.8 Å²	62.8	78%	0.781	29%	0.291	S	S	*	.			trans	-58.8	141.4	168.9	-66	-174.8	177.4	176.8	-0.3	110.3	E371 H372 R373	R369-E371 VanDerWaalsContact C-N 3.33Å; R369-E371 PolarHBondContact O-N 2.79Å; R369-H372 PolarHBondContact O-N 3.33Å; R369-H372 VanDerWaalsContact O-N 3.1Å; R369-R373 PolarHBondContact O-N 3.44Å
370	Q	88.6	Confident	92.7	Very high	14 Å²	14	60.4 Å²	60.4	7%	0.065	28%	0.282	C	S	.	.	H	α-helix	trans	-61	-40.5	-174.7	-170.4	59.1	44.1	0	0	112.7	R174 E175 H372 R373 N374	R174-Q370 VanDerWaalsContact CD-CD 3.47Å; E175-Q370 PolarHBondContact OE1-NE2 3.07Å; Q370-H372 VanDerWaalsContact C-N 3.26Å; Q370-H372 PolarHBondContact O-N 3.42Å; Q370-R373 WeakPolarHBondContact O-CB 3.4Å; Q370-R373 PolarHBondContact O-N 3.01Å; Q370-R373 VanDerWaalsContact O-N 3.14Å; Q370-N374 PolarHBondContact NE2-OD1 2.98Å; Q370-N374 VanDerWaalsContact O-CG 3.24Å; Q370-N374 PolarHBondContact O-N 3.29Å; Q370-N374 PolarHBondContact O-OD1 3.38Å
371	E	89.5	Confident	92.5	Very high	148 Å²	148	62.1 Å²	62.1	69%	0.692	28%	0.28	S	S	*	.	H	α-helix	trans	-58.2	-40.2	176.7	-65.4	170	-173.3	0	0	112.2	R369 N374 R375	R369-E371 VanDerWaalsContact C-N 3.33Å; R369-E371 PolarHBondContact O-N 2.79Å; E371-N374 PolarHBondContact O-N 3.16Å; E371-R375 PolarHBondContact O-N 3.37Å
372	H	92	Very high	92.3	Very high	69 Å²	69	65.8 Å²	65.8	32%	0.319	30%	0.298	S	S	.	.	H	α-helix	trans	-69.9	-39.4	177.6	-170.4	39.2	0	0	0	111.4	M368 R369 Q370 R375 V376	M368-H372 WeakPolarHBondContact CE-CD2 3.23Å; R369-H372 PolarHBondContact O-N 3.33Å; R369-H372 VanDerWaalsContact O-N 3.1Å; Q370-H372 VanDerWaalsContact C-N 3.26Å; Q370-H372 PolarHBondContact O-N 3.42Å; H372-R375 PolarHBondContact O-N 2.93Å; H372-V376 WeakPolarHBondContact O-CG2 3.46Å; H372-V376 PolarHBondContact O-N 3.39Å
373	R	91.8	Very high	92	Very high	12 Å²	12	65.1 Å²	65.1	5%	0.045	31%	0.308	C	S	.	.	H	α-helix	trans	-59	-46.9	173	-70.8	174.1	52.9	179.4	-0.5	112	E175 I364 M368 R369 Q370 R375 V376 F377	E175-R373 IonicContact OE1-CZ 2.71Å; E175-R373 IonicContact OE1-NE 3.75Å; E175-R373 PolarHBondContact OE1-NE 3.4Å; E175-R373 IonicContact OE1-NH2 2.84Å; E175-R373 PolarHBondContact OE1-NH2 3.37Å; E175-R373 IonicContact OE2-CZ 3.29Å; E175-R373 IonicContact OE2-NH2 3.73Å; E175-R373 PolarHBondContact OE2-NH2 3.01Å; I364-R373 HydrophobicContact CD1-CB 3.66Å; I364-R373 HydrophobicContact CD1-CG 3.88Å; I364-R373 WeakPolarHBondContact CD1-O 3.41Å; I364-R373 HydrophobicContact CG1-CB 4.27Å; I364-R373 HydrophobicContact CG1-CG 3.92Å; M368-R373 HydrophobicContact CB-CG 3.71Å; R369-R373 PolarHBondContact O-N 3.44Å; Q370-R373 WeakPolarHBondContact O-CB 3.4Å; Q370-R373 PolarHBondContact O-N 3.01Å; Q370-R373 VanDerWaalsContact O-N 3.14Å; R373-R375 VanDerWaalsContact C-N 3.34Å; R373-R375 PolarHBondContact O-N 2.98Å; R373-V376 PolarHBondContact O-N 2.86Å; R373-F377 WeakPolarHBondContact O-CB 3.43Å; R373-F377 PolarHBondContact O-N 3.43Å
374	N	89.8	Confident	91.9	Very high	45 Å²	45	66.9 Å²	66.9	24%	0.241	32%	0.322	C	S	.	.	H	α-helix	trans	-60.5	-44.2	178	-68.3	-5	0	0	0	111.1	Q370 E371 F377 H378	Q370-N374 PolarHBondContact NE2-OD1 2.98Å; Q370-N374 VanDerWaalsContact O-CG 3.24Å; Q370-N374 PolarHBondContact O-N 3.29Å; Q370-N374 PolarHBondContact O-OD1 3.38Å; E371-N374 PolarHBondContact O-N 3.16Å; N374-F377 PolarHBondContact O-N 3.19Å; N374-H378 VanDerWaalsContact O-CB 3.27Å; N374-H378 WeakPolarHBondContact O-CB 3.28Å; N374-H378 PolarHBondContact O-N 2.81Å
375	R	92.8	Very high	91.8	Very high	144 Å²	144	67 Å²	67	54%	0.543	32%	0.323	S	S	.	.	H	α-helix	trans	-61.6	-51.1	176.4	-172.5	-176.2	-58.4	137.4	5.5	111.7	E371 H372 R373 F377 H378 D379	E371-R375 PolarHBondContact O-N 3.37Å; H372-R375 PolarHBondContact O-N 2.93Å; R373-R375 VanDerWaalsContact C-N 3.34Å; R373-R375 PolarHBondContact O-N 2.98Å; R375-F377 VanDerWaalsContact C-N 3.28Å; R375-F377 PolarHBondContact O-N 2.88Å; R375-H378 PolarHBondContact O-N 2.88Å; R375-D379 WeakPolarHBondContact O-CB 3.12Å; R375-D379 PolarHBondContact O-N 3.23Å
376	V	93.2	Very high	91.9	Very high	9 Å²	9	73 Å²	73	6%	0.055	35%	0.345	C	S	.	.	H	α-helix	trans	-58	-43.6	178.3	167.3	0	0	0	0	111.1	F362 I364 M368 H372 R373 F380 L388	F362-V376 HydrophobicContact CB-CG1 3.8Å; F362-V376 HydrophobicContact CD2-CG1 4.18Å; F362-V376 HydrophobicContact CG-CG1 4.26Å; I364-V376 HydrophobicContact CB-CG1 4.35Å; I364-V376 HydrophobicContact CD1-CB 4.31Å; I364-V376 HydrophobicContact CD1-CG1 4.22Å; M368-V376 HydrophobicContact CE-CG2 4.19Å; H372-V376 WeakPolarHBondContact O-CG2 3.46Å; H372-V376 PolarHBondContact O-N 3.39Å; R373-V376 PolarHBondContact O-N 2.86Å; V376-F380 WeakPolarHBondContact O-CB 3.42Å; V376-F380 PolarHBondContact O-N 3.37Å; V376-L388 HydrophobicContact CG1-CD1 3.81Å
377	F	90.8	Very high	92.2	Very high	11 Å²	11	70.3 Å²	70.3	5%	0.048	32%	0.322	C	S	.	.	H	α-helix	trans	-64.4	-45.8	177.8	176.9	-128.6	0	0	0	112.3	E175 R373 N374 R375 F380 R381 F394 I398 I400	E175-F377 HydrophobicContact CB-CD1 4.33Å; E175-F377 HydrophobicContact CB-CE1 4.4Å; E175-F377 HydrophobicContact CG-CD1 4.38Å; R373-F377 WeakPolarHBondContact O-CB 3.43Å; R373-F377 PolarHBondContact O-N 3.43Å; N374-F377 PolarHBondContact O-N 3.19Å; R375-F377 VanDerWaalsContact C-N 3.28Å; R375-F377 PolarHBondContact O-N 2.88Å; F377-F380 PolarHBondContact O-N 3.07Å; F377-R381 VanDerWaalsContact O-CB 3.31Å; F377-R381 WeakPolarHBondContact O-CB 3.08Å; F377-R381 PolarHBondContact O-N 3.27Å; F377-F394 HydrophobicContact CB-CE1 4Å; F377-F394 HydrophobicContact CB-CZ 4.03Å; F377-F394 HydrophobicContact CD2-CD1 4.48Å; F377-F394 AromaticContact CD2-CE1 3.56Å; F377-F394 HydrophobicContact CD2-CE1 3.56Å; F377-F394 HydrophobicContact CD2-CZ 4.36Å; F377-F394 HydrophobicContact CE2-CE1 4.28Å; F377-F394 AromaticContact CG-CE1 3.92Å; F377-F394 HydrophobicContact CG-CE1 3.92Å; F377-F394 HydrophobicContact CG-CZ 4.27Å; F377-I398 HydrophobicContact CD2-CG2 4.41Å; F377-I398 HydrophobicContact CE2-CD1 4.31Å; F377-I398 HydrophobicContact CE2-CG2 3.44Å; F377-I398 VanDerWaalsContact CE2-CG2 3.44Å; F377-I398 HydrophobicContact CZ-CD1 3.98Å; F377-I398 HydrophobicContact CZ-CG2 3.92Å; F377-I400 HydrophobicContact CE2-CD1 4.09Å; F377-I400 HydrophobicContact CE2-CG1 4.39Å
378	H	91	Very high	92.5	Very high	100 Å²	100	62.2 Å²	62.2	46%	0.463	29%	0.287	S	S	.	.	H	α-helix	trans	-59.5	-50.9	177.1	-179.8	78.1	0	0	0	111.5	N374 R375 F380 R381 N382	N374-H378 VanDerWaalsContact O-CB 3.27Å; N374-H378 WeakPolarHBondContact O-CB 3.28Å; N374-H378 PolarHBondContact O-N 2.81Å; R375-H378 PolarHBondContact O-N 2.88Å; H378-F380 VanDerWaalsContact C-N 3.35Å; H378-F380 PolarHBondContact O-N 2.74Å; H378-R381 PolarHBondContact O-N 2.86Å; H378-N382 PolarHBondContact CD2-ND2 2.75Å; H378-N382 PolarHBondContact CE1-ND2 2.69Å; H378-N382 VanDerWaalsContact CE1-ND2 3.32Å; H378-N382 PolarHBondContact NE2-ND2 2.65Å; H378-N382 VanDerWaalsContact O-CG 3.28Å; H378-N382 PolarHBondContact O-N 2.89Å; H378-N382 PolarHBondContact O-ND2 2.84Å
379	D	94.4	Very high	92.7	Very high	40 Å²	40	61.1 Å²	61.1	21%	0.214	28%	0.282	C	S	.	.	H	α-helix	trans	-64	-40.7	-179	-66.9	-11.4	0	0	0	111.3	F362 R375 N382 G383 L384	F362-D379 HydrophobicContact CE2-CB 3.62Å; F362-D379 HydrophobicContact CZ-CB 4.23Å; R375-D379 WeakPolarHBondContact O-CB 3.12Å; R375-D379 PolarHBondContact O-N 3.23Å; D379-N382 PolarHBondContact O-N 3.37Å; D379-G383 PolarHBondContact O-N 3.31Å; D379-L384 HydrophobicContact CB-CB 4.25Å; D379-L384 HydrophobicContact CB-CD1 3.89Å; D379-L384 HydrophobicContact CB-CG 4.46Å; D379-L384 VanDerWaalsContact O-CB 3.28Å; D379-L384 WeakPolarHBondContact O-CB 3.2Å; D379-L384 PolarHBondContact O-N 2.86Å
380	F	93.5	Very high	93	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-65.6	-44.4	175.9	-175.7	-114	0	0	0	111.8	Q336 S337 I338 F362 V376 F377 H378 N382 G383 C385 L388 I400 V403	Q336-F380 HydrophobicContact CB-CE2 4.27Å; Q336-F380 HydrophobicContact CB-CZ 4.11Å; Q336-F380 PolarHBondContact NE2-O 3.15Å; S337-F380 WeakPolarHBondContact O-CZ 3.35Å; I338-F380 HydrophobicContact CD1-CE1 4.12Å; I338-F380 HydrophobicContact CG1-CE1 3.86Å; I338-F380 HydrophobicContact CG1-CZ 3.98Å; F362-F380 HydrophobicContact CD2-CB 4.3Å; V376-F380 WeakPolarHBondContact O-CB 3.42Å; V376-F380 PolarHBondContact O-N 3.37Å; F377-F380 PolarHBondContact O-N 3.07Å; H378-F380 VanDerWaalsContact C-N 3.35Å; H378-F380 PolarHBondContact O-N 2.74Å; F380-N382 PolarHBondContact O-N 3.12Å; F380-G383 PolarHBondContact O-N 3.3Å; F380-C385 HydrophobicContact CD2-CB 4.39Å; F380-C385 WeakPolarHBondContact CD2-O 3.45Å; F380-C385 WeakPolarHBondContact CE2-O 3.46Å; F380-L388 HydrophobicContact CD1-CB 4.02Å; F380-L388 HydrophobicContact CD1-CD2 3.64Å; F380-L388 HydrophobicContact CD1-CG 4.38Å; F380-L388 HydrophobicContact CD2-CB 3.86Å; F380-L388 HydrophobicContact CE1-CB 3.79Å; F380-L388 HydrophobicContact CE1-CD2 3.83Å; F380-L388 HydrophobicContact CE1-CG 4.46Å; F380-L388 HydrophobicContact CE2-CB 3.63Å; F380-L388 HydrophobicContact CG-CB 4.06Å; F380-L388 HydrophobicContact CG-CD2 4.18Å; F380-L388 HydrophobicContact CZ-CB 3.6Å; F380-I400 HydrophobicContact CD1-CD1 3.4Å; F380-I400 HydrophobicContact CE1-CD1 3.44Å; F380-I400 VanDerWaalsContact CE1-CD1 3.44Å; F380-V403 HydrophobicContact CE1-CG2 4Å; F380-V403 HydrophobicContact CZ-CG2 4.02Å
381	R	90.6	Very high	93.3	Very high	94 Å²	94	51.4 Å²	51.4	36%	0.355	25%	0.247	S	C	.	.	H	α-helix	trans	-62.6	-32.5	177.5	-174.1	178	174.4	-156.1	-2.1	112.5	F377 H378 G383	F377-R381 VanDerWaalsContact O-CB 3.31Å; F377-R381 WeakPolarHBondContact O-CB 3.08Å; F377-R381 PolarHBondContact O-N 3.27Å; H378-R381 PolarHBondContact O-N 2.86Å; R381-G383 PolarHBondContact O-N 2.83Å
382	N	91.7	Very high	93.3	Very high	92 Å²	92	47.1 Å²	47.1	49%	0.492	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	6.3	175.6	-66.4	-18.7	0	0	0	113.7	H378 D379 F380 L384	H378-N382 PolarHBondContact CD2-ND2 2.75Å; H378-N382 PolarHBondContact CE1-ND2 2.69Å; H378-N382 VanDerWaalsContact CE1-ND2 3.32Å; H378-N382 PolarHBondContact NE2-ND2 2.65Å; H378-N382 VanDerWaalsContact O-CG 3.28Å; H378-N382 PolarHBondContact O-N 2.89Å; H378-N382 PolarHBondContact O-ND2 2.84Å; D379-N382 PolarHBondContact O-N 3.37Å; F380-N382 PolarHBondContact O-N 3.12Å; N382-L384 VanDerWaalsContact C-N 3.3Å; N382-L384 HydrophobicContact CB-CG 4.33Å; N382-L384 PolarHBondContact O-N 3.2Å
383	G	91.5	Very high	92.7	Very high	44 Å²	44	45.8 Å²	45.8	45%	0.454	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.4	10.8	177.7	0	0	0	0	0	115	D379 F380 R381 C385	D379-G383 PolarHBondContact O-N 3.31Å; F380-G383 PolarHBondContact O-N 3.3Å; R381-G383 PolarHBondContact O-N 2.83Å; G383-C385 PolarHBondContact O-N 2.84Å
384	L	93.5	Very high	91.8	Very high	118 Å²	118	45.3 Å²	45.3	62%	0.618	22%	0.221	S	C	*	.	S	Bend	trans	-69.5	-16.4	-179.2	-58.2	-175.5	0	0	0	113.1	D379 N382	D379-L384 HydrophobicContact CB-CB 4.25Å; D379-L384 HydrophobicContact CB-CD1 3.89Å; D379-L384 HydrophobicContact CB-CG 4.46Å; D379-L384 VanDerWaalsContact O-CB 3.28Å; D379-L384 WeakPolarHBondContact O-CB 3.2Å; D379-L384 PolarHBondContact O-N 2.86Å; N382-L384 VanDerWaalsContact C-N 3.3Å; N382-L384 HydrophobicContact CB-CG 4.33Å; N382-L384 PolarHBondContact O-N 3.2Å
385	C	93.9	Very high	91.1	Very high	3 Å²	3	43.3 Å²	43.3	2%	0.02	21%	0.211	C	C	.	.			trans	-138.9	138.9	173.6	-170.2	0	0	0	0	110.6	Q336 C361 F362 F380 G383 N387	Q336-C385 PolarHBondContact NE2-O 2.82Å; C361-C385 VanDerWaalsContact CA-SG 3.56Å; C361-C385 PolarHBondContact N-SG 2.86Å; F362-C385 HydrophobicContact CD1-CB 4.13Å; F362-C385 HydrophobicContact CD2-CB 3.35Å; F362-C385 HydrophobicContact CE1-CB 4.09Å; F362-C385 HydrophobicContact CE2-CB 3.3Å; F362-C385 HydrophobicContact CG-CB 3.78Å; F362-C385 HydrophobicContact CZ-CB 3.7Å; F362-C385 PolarHBondContact N-SG 2.94Å; F362-C385 VanDerWaalsContact N-SG 3.39Å; F380-C385 HydrophobicContact CD2-CB 4.39Å; F380-C385 WeakPolarHBondContact CD2-O 3.45Å; F380-C385 WeakPolarHBondContact CE2-O 3.46Å; G383-C385 PolarHBondContact O-N 2.84Å; C385-N387 PolarHBondContact SG-O 2.86Å; C385-N387 VanDerWaalsContact SG-O 3.36Å
386	R	94.8	Very high	90.5	Very high	128 Å²	128	37.8 Å²	37.8	48%	0.483	19%	0.19	S	C	.	.	S	Bend	trans	-80.5	-27.8	-178.8	-65.8	177.5	72.9	129.3	-13.4	113.6	I334 Q336 S337 S360	I334-R386 PolarHBondContact O-NH2 3.22Å; Q336-R386 CarbonylContact C-O 3.58Å; Q336-R386 WeakPolarHBondContact CA-O 3.37Å; S337-R386 PolarHBondContact N-O 3.13Å; S360-R386 PolarHBondContact OG-N 2.81Å
387	N	97.6	Very high	89.7	Confident	6 Å²	6	37.8 Å²	37.8	3%	0.032	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	133.7	-173.3	-50.7	-67.3	0	0	0	111	F329 S337 I339 S360 C361 F362 C385	F329-N387 WeakPolarHBondContact CE1-OD1 3.48Å; S337-N387 WeakPolarHBondContact O-CA 3.26Å; S337-N387 PolarHBondContact OG-OD1 3.31Å; I339-N387 HydrophobicContact CD1-CB 4.47Å; S360-N387 WeakPolarHBondContact O-CB 3.41Å; S360-N387 PolarHBondContact O-ND2 3.05Å; C361-N387 WeakPolarHBondContact CA-O 3.43Å; C361-N387 HydrophobicContact CB-CB 4.46Å; F362-N387 PolarHBondContact N-O 3.39Å; C385-N387 PolarHBondContact SG-O 2.86Å; C385-N387 VanDerWaalsContact SG-O 3.36Å
388	L	96.9	Very high	89.4	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	116.1	174	179.9	66.8	0	0	0	110	S337 I338 I339 F362 I364 V376 F380 F394	S337-L388 PolarHBondContact O-N 3.1Å; I338-L388 CarbonylContact C-O 3.54Å; I338-L388 WeakPolarHBondContact CA-O 3.42Å; I339-L388 PolarHBondContact N-O 3.46Å; F362-L388 HydrophobicContact CB-CD1 3.87Å; I364-L388 HydrophobicContact CB-CD1 4.27Å; I364-L388 HydrophobicContact CG2-CD1 3.81Å; I364-L388 HydrophobicContact CG2-CD2 4.03Å; I364-L388 HydrophobicContact CG2-CG 4.09Å; V376-L388 HydrophobicContact CG1-CD1 3.81Å; F380-L388 HydrophobicContact CD1-CB 4.02Å; F380-L388 HydrophobicContact CD1-CD2 3.64Å; F380-L388 HydrophobicContact CD1-CG 4.38Å; F380-L388 HydrophobicContact CD2-CB 3.86Å; F380-L388 HydrophobicContact CE1-CB 3.79Å; F380-L388 HydrophobicContact CE1-CD2 3.83Å; F380-L388 HydrophobicContact CE1-CG 4.46Å; F380-L388 HydrophobicContact CE2-CB 3.63Å; F380-L388 HydrophobicContact CG-CB 4.06Å; F380-L388 HydrophobicContact CG-CD2 4.18Å; F380-L388 HydrophobicContact CZ-CB 3.6Å; L388-F394 HydrophobicContact CD2-CD1 4.21Å
389	V	98.2	Very high	89.1	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	128.7	171.5	-175.9	0	0	0	0	109.4	I339 V347 L350 A351 I354 C361 F362 Y363 I364	I339-V389 HydrophobicContact CB-CG2 4.11Å; I339-V389 HydrophobicContact CD1-CG2 4.22Å; I339-V389 CarbonylContact O-C 3.44Å; I339-V389 VanDerWaalsContact O-CA 3.29Å; I339-V389 WeakPolarHBondContact O-CA 3.48Å; V347-V389 HydrophobicContact CB-CG1 4.11Å; V347-V389 HydrophobicContact CG1-CB 4.35Å; V347-V389 HydrophobicContact CG1-CG1 3.95Å; V347-V389 WeakPolarHBondContact CG1-O 3.37Å; V347-V389 HydrophobicContact CG2-CG1 4.1Å; L350-V389 HydrophobicContact CB-CG1 4.3Å; L350-V389 HydrophobicContact CD2-CG1 4Å; L350-V389 HydrophobicContact CD2-CG2 4.3Å; L350-V389 HydrophobicContact CG-CG1 4.41Å; L350-V389 HydrophobicContact CG-CG2 4.32Å; A351-V389 HydrophobicContact CB-CB 4.38Å; A351-V389 HydrophobicContact CB-CG2 4.32Å; I354-V389 HydrophobicContact CD1-CG2 3.5Å; C361-V389 WeakPolarHBondContact SG-CG2 3.39Å; F362-V389 PolarHBondContact O-N 2.86Å; Y363-V389 CarbonylContact C-O 3.47Å; Y363-V389 WeakPolarHBondContact CA-O 3.24Å; I364-V389 PolarHBondContact N-O 3.12Å
390	C	96.6	Very high	88.9	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	163.7	-177	64.8	0	0	0	0	114.5	I338 I339 F340 C341 V347 I364 F394	I338-C390 VanDerWaalsContact CG2-SG 3.51Å; I339-C390 PolarHBondContact O-N 2.81Å; F340-C390 WeakPolarHBondContact CA-O 3.37Å; F340-C390 WeakPolarHBondContact CD1-SG 3.28Å; F340-C390 WeakPolarHBondContact CE1-SG 3.2Å; C341-C390 PolarHBondContact N-O 2.65Å; V347-C390 VanDerWaalsContact CG2-C 3.45Å; I364-C390 HydrophobicContact CG2-CB 3.37Å; I364-C390 VanDerWaalsContact O-CA 3.24Å; I364-C390 WeakPolarHBondContact O-CA 3.37Å; I364-C390 WeakPolarHBondContact O-CB 3.14Å; C390-F394 HydrophobicContact CB-CB 4.18Å
391	T	95.4	Very high	88.6	Confident	17 Å²	17	39.1 Å²	39.1	10%	0.104	20%	0.199	C	C	.	.			trans	-85.2	179	165.6	55.9	0	0	0	0	110.4	C341 V347 I364 H365 L393 F394	C341-T391 WeakPolarHBondContact O-CA 3.41Å; V347-T391 HydrophobicContact CG2-CG2 3.68Å; I364-T391 PolarHBondContact O-N 3.18Å; H365-T391 HydrophobicContact CB-CG2 3.99Å; T391-L393 PolarHBondContact O-N 3.49Å; T391-F394 PolarHBondContact O-N 2.78Å
392	D	90.1	Very high	88.6	Confident	57 Å²	57	36.2 Å²	36.2	31%	0.305	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-58.9	-10	177.5	-67.4	-50.1	0	0	0	115.5	F394 T395 T417 R421	D392-F394 PolarHBondContact O-N 3.25Å; D392-F394 VanDerWaalsContact O-N 3.13Å; D392-T395 HydrophobicContact CB-CG2 4.21Å; D392-T395 WeakPolarHBondContact O-CB 3.36Å; D392-T395 PolarHBondContact O-N 2.93Å; D392-T395 VanDerWaalsContact O-N 3.14Å; D392-T395 PolarHBondContact O-OG1 2.94Å; D392-T417 HydrophobicContact CB-CG2 4.43Å; D392-T417 VanDerWaalsContact CG-CG2 3.44Å; D392-T417 WeakPolarHBondContact OD1-CG2 3.48Å; D392-R421 IonicContact OD1-CZ 2.65Å; D392-R421 IonicContact OD1-NE 3.19Å; D392-R421 PolarHBondContact OD1-NE 2.86Å; D392-R421 IonicContact OD1-NH2 3.61Å; D392-R421 PolarHBondContact OD1-NH2 3.17Å; D392-R421 IonicContact OD2-CZ 3.23Å; D392-R421 IonicContact OD2-NH2 2.9Å; D392-R421 PolarHBondContact OD2-NH2 3.13Å
393	L	78	Confident	88.8	Confident	42 Å²	42	32 Å²	32	22%	0.22	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-50.3	-34.3	172.8	-171	64.9	0	0	0	113.7	A366 T391	A366-L393 HydrophobicContact CB-CD2 4.12Å; T391-L393 PolarHBondContact O-N 3.49Å
394	F	73.7	Confident	89	Confident	1 Å²	1	30.8 Å²	30.8	0%	0.004	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-101.6	11	-175.4	-96	-112.2	0	0	0	114.2	E175 I364 F377 L388 C390 T391 D392 I398	E175-F394 HydrophobicContact CB-CZ 4.21Å; E175-F394 HydrophobicContact CG-CE1 4.34Å; E175-F394 HydrophobicContact CG-CE2 3.9Å; E175-F394 HydrophobicContact CG-CZ 3.52Å; I364-F394 HydrophobicContact CB-CD2 4.47Å; I364-F394 HydrophobicContact CB-CE2 4.25Å; I364-F394 HydrophobicContact CD1-CD2 4.19Å; I364-F394 HydrophobicContact CD1-CE1 4Å; I364-F394 HydrophobicContact CD1-CE2 3.23Å; I364-F394 HydrophobicContact CD1-CZ 3.09Å; I364-F394 HydrophobicContact CG1-CD2 3.99Å; I364-F394 HydrophobicContact CG1-CE2 3.42Å; I364-F394 VanDerWaalsContact CG1-CE2 3.42Å; I364-F394 HydrophobicContact CG1-CZ 3.82Å; I364-F394 HydrophobicContact CG2-CB 4.48Å; I364-F394 HydrophobicContact CG2-CD1 4.11Å; I364-F394 HydrophobicContact CG2-CD2 3.64Å; I364-F394 HydrophobicContact CG2-CE1 4.24Å; I364-F394 HydrophobicContact CG2-CE2 3.83Å; I364-F394 HydrophobicContact CG2-CG 3.79Å; I364-F394 HydrophobicContact CG2-CZ 4.11Å; F377-F394 HydrophobicContact CB-CE1 4Å; F377-F394 HydrophobicContact CB-CZ 4.03Å; F377-F394 HydrophobicContact CD2-CD1 4.48Å; F377-F394 AromaticContact CD2-CE1 3.56Å; F377-F394 HydrophobicContact CD2-CE1 3.56Å; F377-F394 HydrophobicContact CD2-CZ 4.36Å; F377-F394 HydrophobicContact CE2-CE1 4.28Å; F377-F394 AromaticContact CG-CE1 3.92Å; F377-F394 HydrophobicContact CG-CE1 3.92Å; F377-F394 HydrophobicContact CG-CZ 4.27Å; L388-F394 HydrophobicContact CD2-CD1 4.21Å; C390-F394 HydrophobicContact CB-CB 4.18Å; T391-F394 PolarHBondContact O-N 2.78Å; D392-F394 PolarHBondContact O-N 3.25Å; D392-F394 VanDerWaalsContact O-N 3.13Å; F394-I398 HydrophobicContact CD1-CG1 4.31Å
395	T	74.7	Confident	89.2	Confident	4 Å²	4	25.1 Å²	25.1	3%	0.025	13%	0.126	C	C	.	.	S	Bend	trans	-82.6	-16.5	-175.2	58	0	0	0	0	114.4	F340 D392 H420 R421 R424	F340-T395 HydrophobicContact CD1-CG2 3.77Å; F340-T395 HydrophobicContact CE1-CG2 3.2Å; F340-T395 HydrophobicContact CE2-CG2 4.45Å; F340-T395 HydrophobicContact CZ-CG2 3.6Å; D392-T395 HydrophobicContact CB-CG2 4.21Å; D392-T395 WeakPolarHBondContact O-CB 3.36Å; D392-T395 PolarHBondContact O-N 2.93Å; D392-T395 VanDerWaalsContact O-N 3.14Å; D392-T395 PolarHBondContact O-OG1 2.94Å; T395-H420 CarbonylContact O-C 3.5Å; T395-H420 WeakPolarHBondContact O-CB 3.47Å; T395-R421 HydrophobicContact CG2-CB 4.37Å; T395-R421 HydrophobicContact CG2-CG 3.41Å; T395-R421 VanDerWaalsContact CG2-CG 3.41Å; T395-R424 PolarHBondContact O-NE 2.91Å; T395-R424 PolarHBondContact O-NH1 2.93Å; T395-R424 PolarHBondContact O-NH2 3.1Å
396	R	80.4	Confident	89.4	Confident	28 Å²	28	25 Å²	25	11%	0.106	13%	0.125	C	C	.	.	S	Bend	trans	-112.5	133.7	-170	-60.1	-159.5	-169.6	-135	0	113	E247 D249 I398 E416 H420 R424	E247-R396 HydrophobicContact CG-CB 4.22Å; D249-R396 VanDerWaalsContact CG-NH1 3.31Å; D249-R396 IonicContact OD1-NH1 2.96Å; D249-R396 PolarHBondContact OD1-NH1 3.18Å; D249-R396 IonicContact OD2-NH1 2.69Å; D249-R396 PolarHBondContact OD2-NH1 3.48Å; R396-I398 PolarHBondContact O-N 3.29Å; R396-E416 IonicContact CZ-OE1 3.24Å; R396-E416 VanDerWaalsContact CZ-OE1 3.23Å; R396-E416 IonicContact NH1-OE1 3.36Å; R396-E416 PolarHBondContact NH1-OE1 3.02Å; R396-E416 IonicContact NH2-OE1 2.67Å; R396-E416 PolarHBondContact NH2-OE1 2.89Å; R396-H420 HydrophobicContact CG-CB 4.34Å; R396-H420 PolarHBondContact NH1-NE2 3.39Å; R396-R424 VanDerWaalsContact C-NH1 3.29Å
397	G	76.1	Confident	89.6	Confident	9 Å²	9	18.9 Å²	18.9	9%	0.093	10%	0.102	C	C	.	.	S	Bend	trans	64.4	-35.5	176.8	0	0	0	0	0	117.9	Q179 E247 D399 R424 R427	Q179-G397 PolarHBondContact NE2-O 3.31Å; Q179-G397 VanDerWaalsContact NE2-O 3.1Å; E247-G397 WeakPolarHBondContact OE1-CA 3.14Å; E247-G397 PolarHBondContact OE1-N 2.86Å; G397-D399 PolarHBondContact O-N 2.6Å; G397-R424 VanDerWaalsContact C-NH1 3.31Å; G397-R424 VanDerWaalsContact N-NH1 3.19Å; G397-R427 PolarHBondContact O-NH2 2.92Å; G397-R427 VanDerWaalsContact O-NH2 3.16Å
398	I	84.2	Confident	89.6	Confident	2 Å²	2	18.6 Å²	18.6	1%	0.01	10%	0.101	C	C	.	.			trans	-47.8	119.9	179.2	-55.9	-51.1	0	0	0	113.5	E175 F377 F394 R396 I400 R424 R427	E175-I398 HydrophobicContact CB-CD1 3.61Å; F377-I398 HydrophobicContact CD2-CG2 4.41Å; F377-I398 HydrophobicContact CE2-CD1 4.31Å; F377-I398 HydrophobicContact CE2-CG2 3.44Å; F377-I398 VanDerWaalsContact CE2-CG2 3.44Å; F377-I398 HydrophobicContact CZ-CD1 3.98Å; F377-I398 HydrophobicContact CZ-CG2 3.92Å; F394-I398 HydrophobicContact CD1-CG1 4.31Å; R396-I398 PolarHBondContact O-N 3.29Å; I398-I400 HydrophobicContact CG2-CD1 4.02Å; I398-I400 HydrophobicContact CG2-CG1 4.02Å; I398-R424 PolarHBondContact O-NH1 3.29Å; I398-R427 PolarHBondContact O-NH2 3.36Å
399	D	86.2	Confident	89.7	Confident	47 Å²	47	19.1 Å²	19.1	25%	0.251	10%	0.103	S	C	.	.			trans	-118.6	116	-174.4	-167	2.7	0	0	0	110.2	G397 R427	G397-D399 PolarHBondContact O-N 2.6Å; D399-R427 WeakPolarHBondContact OD1-CG 3.35Å; D399-R427 IonicContact OD1-NH1 3.1Å; D399-R427 IonicContact OD2-NH1 3.64Å
400	I	89.8	Confident	89.7	Confident	9 Å²	9	19.5 Å²	19.5	5%	0.046	11%	0.105	C	C	.	.			trans	-136.4	98.1	179.5	-53.3	173.9	0	0	0	106.9	F377 F380 I398 A402 V403	F377-I400 HydrophobicContact CE2-CD1 4.09Å; F377-I400 HydrophobicContact CE2-CG1 4.39Å; F380-I400 HydrophobicContact CD1-CD1 3.4Å; F380-I400 HydrophobicContact CE1-CD1 3.44Å; F380-I400 VanDerWaalsContact CE1-CD1 3.44Å; I398-I400 HydrophobicContact CG2-CD1 4.02Å; I398-I400 HydrophobicContact CG2-CG1 4.02Å; I400-A402 PolarHBondContact O-N 3.28Å; I400-A402 VanDerWaalsContact O-N 3.1Å; I400-V403 HydrophobicContact CB-CG2 3.81Å; I400-V403 HydrophobicContact CG2-CG2 3.77Å; I400-V403 WeakPolarHBondContact O-CB 3.48Å; I400-V403 PolarHBondContact O-N 3.32Å
401	Q	86.3	Confident	89.7	Confident	121 Å²	121	19.6 Å²	19.6	57%	0.565	11%	0.105	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-23.4	-172.4	-68.1	179.6	-25.3	0	0	114.5	V403	Q401-V403 VanDerWaalsContact C-N 3.33Å
402	A	91.6	Very high	89.8	Confident	32 Å²	32	18.8 Å²	18.8	26%	0.264	10%	0.101	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-9.2	178.4	0	0	0	0	0	113.5	N335 Q336 I400 N404	N335-A402 WeakPolarHBondContact CB-O 3.47Å; N335-A402 PolarHBondContact ND2-O 2.85Å; Q336-A402 HydrophobicContact CG-CB 4.22Å; Q336-A402 PolarHBondContact N-O 3.23Å; I400-A402 PolarHBondContact O-N 3.28Å; I400-A402 VanDerWaalsContact O-N 3.1Å; A402-N404 PolarHBondContact O-N 3.18Å
403	V	95.2	Very high	90	Very high	5 Å²	5	23.5 Å²	23.5	3%	0.03	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	105.6	173.8	176.2	0	0	0	0	109.4	Q336 I338 F380 I400 Q401 V406	Q336-V403 HydrophobicContact CB-CG2 4.05Å; Q336-V403 WeakPolarHBondContact O-CA 3.36Å; I338-V403 HydrophobicContact CD1-CG1 4.31Å; I338-V403 HydrophobicContact CD1-CG2 4.03Å; I338-V403 HydrophobicContact CG1-CG1 4.05Å; I338-V403 HydrophobicContact CG1-CG2 3.96Å; F380-V403 HydrophobicContact CE1-CG2 4Å; F380-V403 HydrophobicContact CZ-CG2 4.02Å; I400-V403 HydrophobicContact CB-CG2 3.81Å; I400-V403 HydrophobicContact CG2-CG2 3.77Å; I400-V403 WeakPolarHBondContact O-CB 3.48Å; I400-V403 PolarHBondContact O-N 3.32Å; Q401-V403 VanDerWaalsContact C-N 3.33Å; V403-V406 HydrophobicContact CG1-CG2 4.38Å
404	N	95.7	Very high	90.7	Very high	17 Å²	17	26.4 Å²	26.4	9%	0.091	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	-15.3	176.7	68.9	-29.5	0	0	0	113.4	Q333 N335 Q336 A402 G432 L433 Y469	Q333-N404 PolarHBondContact O-ND2 2.84Å; N335-N404 PolarHBondContact N-OD1 3.01Å; Q336-N404 PolarHBondContact O-N 2.96Å; Q336-N404 PolarHBondContact O-OD1 3.14Å; A402-N404 PolarHBondContact O-N 3.18Å; N404-G432 WeakPolarHBondContact O-CA 3.24Å; N404-L433 PolarHBondContact O-N 3.09Å; N404-Y469 WeakPolarHBondContact CB-O 3.45Å; N404-Y469 WeakPolarHBondContact ND2-CD2 3.47Å; N404-Y469 PolarHBondContact ND2-O 3.27Å
405	V	98	Very high	91.6	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	127.7	179.1	-176.1	0	0	0	0	111.2	L332 I334 Q336 S337 I338 I407 L433 Y469	L332-V405 HydrophobicContact CD1-CG1 4.39Å; I334-V405 HydrophobicContact CG1-CB 4.06Å; I334-V405 HydrophobicContact CG1-CG1 4.4Å; I334-V405 HydrophobicContact CG1-CG2 3.74Å; Q336-V405 PolarHBondContact O-N 3.17Å; S337-V405 WeakPolarHBondContact CA-O 3.22Å; S337-V405 WeakPolarHBondContact CB-O 3.19Å; I338-V405 PolarHBondContact N-O 3.14Å; V405-I407 HydrophobicContact CG1-CD1 4.37Å; V405-I407 HydrophobicContact CG1-CG1 3.92Å; V405-L433 CarbonylContact C-O 3.59Å; V405-L433 WeakPolarHBondContact CA-O 3.47Å; V405-L433 HydrophobicContact CG1-CB 4.49Å; V405-L433 HydrophobicContact CG2-CB 4.17Å; V405-L433 HydrophobicContact CG2-CD2 4.48Å; V405-Y469 HydrophobicContact CG2-CD2 3.64Å; V405-Y469 HydrophobicContact CG2-CE2 3.96Å
406	V	97.5	Very high	92.3	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	134.1	168.1	174	0	0	0	0	108.7	I338 F340 V403 R424 L433 A434 I435	I338-V406 WeakPolarHBondContact O-CA 3.39Å; F340-V406 HydrophobicContact CD2-CG1 3.85Å; F340-V406 HydrophobicContact CE2-CG1 3.77Å; V403-V406 HydrophobicContact CG1-CG2 4.38Å; V406-R424 HydrophobicContact CG2-CB 3.7Å; V406-L433 PolarHBondContact N-O 3.47Å; V406-A434 CarbonylContact O-C 3.46Å; V406-A434 WeakPolarHBondContact O-CA 3.43Å; V406-I435 PolarHBondContact O-N 3.37Å
407	I	98.6	Very high	92.9	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	116.1	176.3	-53	178.1	0	0	0	109.2	L325 L328 I338 I339 F340 V405 F409 I435	L325-I407 HydrophobicContact CD1-CD1 3.64Å; L325-I407 HydrophobicContact CD1-CG2 4.28Å; L328-I407 HydrophobicContact CD1-CD1 4.36Å; I338-I407 PolarHBondContact O-N 2.96Å; I339-I407 CarbonylContact C-O 3.52Å; I339-I407 VanDerWaalsContact CA-O 3.24Å; I339-I407 WeakPolarHBondContact CA-O 3.39Å; I339-I407 HydrophobicContact CG1-CB 4.2Å; I339-I407 HydrophobicContact CG1-CD1 4.39Å; I339-I407 HydrophobicContact CG2-CB 4.35Å; F340-I407 PolarHBondContact N-O 3.45Å; V405-I407 HydrophobicContact CG1-CD1 4.37Å; V405-I407 HydrophobicContact CG1-CG1 3.92Å; I407-F409 PolarHBondContact O-N 2.82Å; I407-I435 CarbonylContact C-O 3.59Å; I407-I435 WeakPolarHBondContact CA-O 3.12Å
408	N	98.6	Very high	93.8	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	89.9	168.3	-67.4	-37.1	0	0	0	108.1	D410 R421 I435 N436 L437	N408-D410 VanDerWaalsContact C-N 3.3Å; N408-R421 WeakPolarHBondContact OD1-CD 3.41Å; N408-I435 PolarHBondContact N-O 3.45Å; N408-N436 WeakPolarHBondContact CB-OD1 3.28Å; N408-N436 PolarHBondContact ND2-OD1 3.02Å; N408-L437 PolarHBondContact O-N 2.83Å
409	F	98.6	Very high	94.2	Very high	10 Å²	10	29 Å²	29	4%	0.044	15%	0.147	C	C	.	.	S	Bend	trans	-65.8	-39.2	177.3	-173.2	-89.1	0	0	0	111	K321 V322 L325 I339 F340 L350 I407 L437	K321-F409 HydrophobicContact CB-CD2 4.48Å; K321-F409 HydrophobicContact CB-CE1 4.1Å; K321-F409 HydrophobicContact CB-CE2 3.67Å; K321-F409 HydrophobicContact CB-CZ 3.44Å; K321-F409 VanDerWaalsContact CB-CZ 3.44Å; K321-F409 HydrophobicContact CD-CD1 4.26Å; K321-F409 HydrophobicContact CD-CE1 3.93Å; K321-F409 HydrophobicContact CD-CZ 4.16Å; K321-F409 WeakPolarHBondContact CD-O 3.35Å; K321-F409 WeakPolarHBondContact CE-O 3.39Å; K321-F409 HydrophobicContact CG-CZ 4.41Å; K321-F409 PolarHBondContact NZ-O 3.48Å; V322-F409 HydrophobicContact CG2-CE2 4.43Å; V322-F409 HydrophobicContact CG2-CZ 4.04Å; L325-F409 HydrophobicContact CB-CE2 4.4Å; L325-F409 HydrophobicContact CD2-CD2 4.14Å; L325-F409 HydrophobicContact CD2-CE2 4.16Å; I339-F409 HydrophobicContact CG2-CB 3.78Å; F340-F409 WeakPolarHBondContact O-CB 3.21Å; F340-F409 PolarHBondContact O-N 3.49Å; L350-F409 HydrophobicContact CD1-CD2 4.17Å; L350-F409 HydrophobicContact CD1-CE1 4.41Å; L350-F409 HydrophobicContact CD1-CE2 3.68Å; L350-F409 HydrophobicContact CD1-CZ 3.81Å; L350-F409 HydrophobicContact CD2-CB 4.07Å; L350-F409 HydrophobicContact CD2-CD1 3.91Å; L350-F409 HydrophobicContact CD2-CD2 3.67Å; L350-F409 HydrophobicContact CD2-CE1 4.23Å; L350-F409 HydrophobicContact CD2-CE2 4.02Å; L350-F409 HydrophobicContact CD2-CG 3.61Å; L350-F409 HydrophobicContact CD2-CZ 4.28Å; I407-F409 PolarHBondContact O-N 2.82Å; F409-L437 HydrophobicContact CD2-CD1 3.71Å; F409-L437 HydrophobicContact CE2-CD1 4.11Å; F409-L437 HydrophobicContact CG-CD1 4.34Å
410	D	98.1	Very high	94.5	Very high	9 Å²	9	26.8 Å²	26.8	5%	0.048	14%	0.135	C	C	.	.	S	Bend	trans	-109.1	125.5	163.4	-60.4	-35.9	0	0	0	108.4	K321 F340 C341 N342 R346 N408 R421	K321-D410 IonicContact NZ-OD1 3.89Å; K321-D410 PolarHBondContact NZ-OD1 3Å; F340-D410 PolarHBondContact O-N 2.82Å; F340-D410 VanDerWaalsContact O-N 3.14Å; C341-D410 WeakPolarHBondContact CA-OD2 3.43Å; C341-D410 WeakPolarHBondContact CB-OD2 3.45Å; N342-D410 HydrophobicContact CB-CB 4.07Å; N342-D410 VanDerWaalsContact CG-CB 3.5Å; N342-D410 PolarHBondContact N-OD2 2.87Å; N342-D410 WeakPolarHBondContact ND2-CB 3.16Å; R346-D410 IonicContact CZ-OD1 2.73Å; R346-D410 IonicContact CZ-OD2 3.9Å; R346-D410 IonicContact NE-OD1 3.52Å; R346-D410 PolarHBondContact NE-OD1 2.85Å; R346-D410 IonicContact NE-OD2 3.37Å; R346-D410 PolarHBondContact NE-OD2 3.4Å; R346-D410 IonicContact NH2-OD1 3.23Å; R346-D410 PolarHBondContact NH2-OD1 2.92Å; R346-D410 IonicContact NH2-OD2 2.88Å; N408-D410 VanDerWaalsContact C-N 3.3Å; D410-R421 PolarHBondContact O-NH1 3.46Å
411	F	97.8	Very high	94.7	Very high	1 Å²	1	26.4 Å²	26.4	0%	0.004	13%	0.133	C	C	.	.			trans	-67.6	137	176.9	-162.1	-113	0	0	0	110.3	N342 Y418 N436 I438 D442 N445 L446 I449 I457	N342-F411 PolarHBondContact ND2-O 2.8Å; N342-F411 VanDerWaalsContact ND2-O 3.14Å; F411-Y418 AromaticContact CE2-CD2 3.79Å; F411-Y418 HydrophobicContact CE2-CD2 3.79Å; F411-Y418 AromaticContact CE2-CE2 3.59Å; F411-Y418 HydrophobicContact CE2-CE2 3.59Å; F411-Y418 HydrophobicContact CZ-CD2 4.12Å; F411-Y418 HydrophobicContact CZ-CE2 4.14Å; F411-N436 HydrophobicContact CD2-CB 3.91Å; F411-N436 HydrophobicContact CE2-CB 3.96Å; F411-I438 HydrophobicContact CB-CD1 3.77Å; F411-I438 HydrophobicContact CD1-CD1 3.77Å; F411-I438 HydrophobicContact CD2-CD1 3.15Å; F411-I438 HydrophobicContact CE1-CD1 4.11Å; F411-I438 HydrophobicContact CE2-CD1 3.55Å; F411-I438 HydrophobicContact CG-CD1 3.27Å; F411-I438 HydrophobicContact CZ-CD1 4.02Å; F411-D442 HydrophobicContact CB-CB 4.15Å; F411-D442 HydrophobicContact CD1-CB 4.28Å; F411-N445 HydrophobicContact CD1-CB 4.03Å; F411-N445 HydrophobicContact CE1-CB 4.11Å; F411-L446 VanDerWaalsContact CE1-CA 3.5Å; F411-L446 HydrophobicContact CE1-CB 4.07Å; F411-L446 HydrophobicContact CE1-CD1 4.38Å; F411-L446 HydrophobicContact CE2-CD1 4.39Å; F411-L446 HydrophobicContact CZ-CB 4.36Å; F411-L446 HydrophobicContact CZ-CD1 3.82Å; F411-I449 HydrophobicContact CD1-CD1 4.42Å; F411-I449 HydrophobicContact CE1-CD1 3.58Å; F411-I449 HydrophobicContact CZ-CB 4.47Å; F411-I449 HydrophobicContact CZ-CD1 3.84Å; F411-I457 HydrophobicContact CE2-CD1 4.5Å; F411-I457 HydrophobicContact CZ-CD1 4.33Å
412	P	96.1	Very high	95.1	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.006	11%	0.107	C	C	.	.			trans	-73.1	154.5	178.1	30.4	-34.6	0	0	0	111.2	T417 Y418 I449	P412-T417 HydrophobicContact CB-CG2 3.78Å; P412-Y418 HydrophobicContact CG-CD2 3.77Å; P412-Y418 HydrophobicContact CG-CG 4.21Å; P412-I449 HydrophobicContact CG-CD1 4.23Å; P412-I449 WeakPolarHBondContact O-CD1 3.28Å
413	K	94.7	Very high	95.1	Very high	155 Å²	155	19.4 Å²	19.4	67%	0.674	10%	0.096	S	C	*	.	S	Bend	trans	-83.4	-21.7	177.3	-62.4	-176.5	178.7	-176.8	0	113.5
414	L	92.8	Very high	94.9	Very high	103 Å²	103	19.3 Å²	19.3	54%	0.539	10%	0.095	S	C	.	.	S	Bend	trans	-120.5	140.1	-172.3	-57.6	177.3	0	0	0	110.4	E416 T417 Y418	L414-E416 VanDerWaalsContact C-N 3.31Å; L414-E416 PolarHBondContact O-N 3.18Å; L414-T417 PolarHBondContact O-N 2.81Å; L414-Y418 PolarHBondContact O-N 3.14Å
415	A	92.9	Very high	94.6	Very high	6 Å²	6	18.5 Å²	18.5	5%	0.05	9%	0.091	C	C	.	.	H	α-helix	trans	-62.7	-36.8	178	0	0	0	0	0	112.7	T417 Y418 L419 I449 Q452 L453	A415-T417 PolarHBondContact O-N 3.01Å; A415-Y418 WeakPolarHBondContact O-CB 3.16Å; A415-Y418 PolarHBondContact O-N 3.33Å; A415-L419 WeakPolarHBondContact O-CB 3.44Å; A415-L419 PolarHBondContact O-N 3.08Å; A415-I449 HydrophobicContact CB-CG1 4.07Å; A415-I449 HydrophobicContact CB-CG2 4.48Å; A415-Q452 HydrophobicContact CB-CB 3.96Å; A415-L453 HydrophobicContact CB-CD1 4.42Å; A415-L453 HydrophobicContact CB-CD2 3.98Å; A415-L453 HydrophobicContact CB-CG 4Å
416	E	90.1	Very high	94.2	Very high	60 Å²	60	18.7 Å²	18.7	28%	0.28	9%	0.092	S	C	.	.	H	α-helix	trans	-57.2	-51.5	174.4	-178.6	-172.9	168.7	0	0	110.9	T279 R396 L414 Y418 L419 H420	T279-E416 HydrophobicContact CG2-CG 4.08Å; R396-E416 IonicContact CZ-OE1 3.24Å; R396-E416 VanDerWaalsContact CZ-OE1 3.23Å; R396-E416 IonicContact NH1-OE1 3.36Å; R396-E416 PolarHBondContact NH1-OE1 3.02Å; R396-E416 IonicContact NH2-OE1 2.67Å; R396-E416 PolarHBondContact NH2-OE1 2.89Å; L414-E416 VanDerWaalsContact C-N 3.31Å; L414-E416 PolarHBondContact O-N 3.18Å; E416-Y418 VanDerWaalsContact C-N 3.3Å; E416-Y418 PolarHBondContact O-N 2.99Å; E416-L419 PolarHBondContact O-N 3.24Å; E416-H420 PolarHBondContact O-CD2 2.72Å; E416-H420 PolarHBondContact O-N 3.24Å; E416-H420 VanDerWaalsContact O-N 3.11Å
417	T	92.8	Very high	93.9	Very high	25 Å²	25	19.5 Å²	19.5	15%	0.153	10%	0.095	C	C	.	.	H	α-helix	trans	-58.8	-43.8	177.4	-53.2	0	0	0	0	111.4	D392 P412 L414 A415 L419 H420 R421	D392-T417 HydrophobicContact CB-CG2 4.43Å; D392-T417 VanDerWaalsContact CG-CG2 3.44Å; D392-T417 WeakPolarHBondContact OD1-CG2 3.48Å; P412-T417 HydrophobicContact CB-CG2 3.78Å; L414-T417 PolarHBondContact O-N 2.81Å; A415-T417 PolarHBondContact O-N 3.01Å; T417-L419 PolarHBondContact O-N 3.45Å; T417-H420 PolarHBondContact O-N 2.82Å; T417-R421 VanDerWaalsContact O-CG 3.32Å; T417-R421 WeakPolarHBondContact O-CG 3.27Å; T417-R421 PolarHBondContact O-N 3.16Å
418	Y	94.9	Very high	93.4	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-56.7	-49.5	175.8	-177.1	-97	0	0	0	112.3	Q311 F411 P412 L414 A415 E416 H420 R421 I422 N436 I449 L453 I457	Q311-Y418 VanDerWaalsContact OE1-CE1 3.3Å; Q311-Y418 PolarHBondContact OE1-OH 2.83Å; F411-Y418 AromaticContact CE2-CD2 3.79Å; F411-Y418 HydrophobicContact CE2-CD2 3.79Å; F411-Y418 AromaticContact CE2-CE2 3.59Å; F411-Y418 HydrophobicContact CE2-CE2 3.59Å; F411-Y418 HydrophobicContact CZ-CD2 4.12Å; F411-Y418 HydrophobicContact CZ-CE2 4.14Å; P412-Y418 HydrophobicContact CG-CD2 3.77Å; P412-Y418 HydrophobicContact CG-CG 4.21Å; L414-Y418 PolarHBondContact O-N 3.14Å; A415-Y418 WeakPolarHBondContact O-CB 3.16Å; A415-Y418 PolarHBondContact O-N 3.33Å; E416-Y418 VanDerWaalsContact C-N 3.3Å; E416-Y418 PolarHBondContact O-N 2.99Å; Y418-H420 VanDerWaalsContact C-N 3.32Å; Y418-H420 PolarHBondContact O-N 2.83Å; Y418-R421 WeakPolarHBondContact O-CB 3.3Å; Y418-R421 PolarHBondContact O-N 2.97Å; Y418-R421 VanDerWaalsContact O-N 3.17Å; Y418-I422 HydrophobicContact CD1-CD1 4.2Å; Y418-I422 HydrophobicContact CD1-CG1 4.47Å; Y418-I422 HydrophobicContact CD1-CG2 4.39Å; Y418-I422 HydrophobicContact CD2-CG2 4.37Å; Y418-I422 HydrophobicContact CE1-CD1 3.64Å; Y418-I422 HydrophobicContact CE1-CG1 4.25Å; Y418-I422 HydrophobicContact CE1-CG2 3.96Å; Y418-I422 HydrophobicContact CE2-CG2 3.93Å; Y418-I422 PolarHBondContact O-N 2.75Å; Y418-N436 VanDerWaalsContact CE2-OD1 3.28Å; Y418-N436 WeakPolarHBondContact CE2-OD1 3.17Å; Y418-N436 PolarHBondContact OH-ND2 3.44Å; Y418-N436 VanDerWaalsContact OH-ND2 3.15Å; Y418-I449 HydrophobicContact CD1-CG2 3.75Å; Y418-I449 HydrophobicContact CD2-CG2 4.35Å; Y418-I449 HydrophobicContact CE1-CG2 4.26Å; Y418-I449 HydrophobicContact CG-CD1 4.49Å; Y418-I449 HydrophobicContact CG-CG2 3.8Å; Y418-L453 HydrophobicContact CD1-CD1 3.49Å; Y418-L453 VanDerWaalsContact CD1-CD1 3.49Å; Y418-L453 HydrophobicContact CE1-CD1 4.04Å; Y418-L453 HydrophobicContact CG-CD1 4.49Å; Y418-I457 HydrophobicContact CE1-CD1 4.17Å; Y418-I457 HydrophobicContact CE2-CD1 4.06Å; Y418-I457 VanDerWaalsContact OH-CD1 3.23Å; Y418-I457 WeakPolarHBondContact OH-CD1 3.39Å
419	L	92.1	Very high	93.1	Very high	9 Å²	9	21.7 Å²	21.7	5%	0.047	11%	0.105	C	C	.	.	H	α-helix	trans	-59	-42.1	-178.8	-178.7	63.5	0	0	0	112.2	A278 T279 L304 T305 A415 E416 T417 G423	A278-L419 HydrophobicContact CB-CD2 4.36Å; T279-L419 HydrophobicContact CG2-CD2 4.14Å; L304-L419 HydrophobicContact CB-CD1 4.4Å; L304-L419 HydrophobicContact CB-CD2 4.38Å; L304-L419 VanDerWaalsContact O-CD1 3.24Å; L304-L419 WeakPolarHBondContact O-CD1 3.25Å; T305-L419 HydrophobicContact CG2-CD1 4.36Å; A415-L419 WeakPolarHBondContact O-CB 3.44Å; A415-L419 PolarHBondContact O-N 3.08Å; E416-L419 PolarHBondContact O-N 3.24Å; T417-L419 PolarHBondContact O-N 3.45Å; L419-G423 PolarHBondContact O-N 2.98Å; L419-G423 VanDerWaalsContact O-N 3.11Å
420	H	92.3	Very high	92.8	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-68.8	-39.5	177.3	-71.6	-69.6	0	0	0	112.7	N142 E247 D249 T395 R396 E416 T417 Y418 R424	N142-H420 PolarHBondContact ND2-ND1 2.87Å; E247-H420 IonicContact OE2-CE1 3.81Å; E247-H420 PolarHBondContact OE2-CE1 3.36Å; E247-H420 IonicContact OE2-ND1 3.8Å; D249-H420 IonicContact OD2-NE2 2.73Å; T395-H420 CarbonylContact O-C 3.5Å; T395-H420 WeakPolarHBondContact O-CB 3.47Å; R396-H420 HydrophobicContact CG-CB 4.34Å; R396-H420 PolarHBondContact NH1-NE2 3.39Å; E416-H420 PolarHBondContact O-CD2 2.72Å; E416-H420 PolarHBondContact O-N 3.24Å; E416-H420 VanDerWaalsContact O-N 3.11Å; T417-H420 PolarHBondContact O-N 2.82Å; Y418-H420 VanDerWaalsContact C-N 3.32Å; Y418-H420 PolarHBondContact O-N 2.83Å; H420-R424 PolarHBondContact O-NE 2.9Å
421	R	94.8	Very high	92.6	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-60.3	-56.9	176.1	-73.9	-178.2	-175.5	-166.7	1	111.6	F340 N342 D392 T395 N408 D410 T417 Y418 G423 R424	F340-R421 HydrophobicContact CB-CG 4.31Å; F340-R421 HydrophobicContact CD1-CG 4.04Å; F340-R421 HydrophobicContact CD2-CB 3.7Å; F340-R421 HydrophobicContact CD2-CG 3.59Å; F340-R421 HydrophobicContact CE1-CG 4.24Å; F340-R421 HydrophobicContact CE2-CB 3.68Å; F340-R421 HydrophobicContact CE2-CG 3.79Å; F340-R421 HydrophobicContact CG-CB 4.34Å; F340-R421 HydrophobicContact CG-CG 3.71Å; F340-R421 HydrophobicContact CZ-CB 4.32Å; F340-R421 HydrophobicContact CZ-CG 4.11Å; N342-R421 PolarHBondContact OD1-NH2 3.3Å; D392-R421 IonicContact OD1-CZ 2.65Å; D392-R421 IonicContact OD1-NE 3.19Å; D392-R421 PolarHBondContact OD1-NE 2.86Å; D392-R421 IonicContact OD1-NH2 3.61Å; D392-R421 PolarHBondContact OD1-NH2 3.17Å; D392-R421 IonicContact OD2-CZ 3.23Å; D392-R421 IonicContact OD2-NH2 2.9Å; D392-R421 PolarHBondContact OD2-NH2 3.13Å; T395-R421 HydrophobicContact CG2-CB 4.37Å; T395-R421 HydrophobicContact CG2-CG 3.41Å; T395-R421 VanDerWaalsContact CG2-CG 3.41Å; N408-R421 WeakPolarHBondContact OD1-CD 3.41Å; D410-R421 PolarHBondContact O-NH1 3.46Å; T417-R421 VanDerWaalsContact O-CG 3.32Å; T417-R421 WeakPolarHBondContact O-CG 3.27Å; T417-R421 PolarHBondContact O-N 3.16Å; Y418-R421 WeakPolarHBondContact O-CB 3.3Å; Y418-R421 PolarHBondContact O-N 2.97Å; Y418-R421 VanDerWaalsContact O-N 3.17Å; R421-G423 PolarHBondContact O-N 3.48Å; R421-R424 WeakPolarHBondContact O-CB 3.44Å; R421-R424 WeakPolarHBondContact O-CG 3.33Å; R421-R424 PolarHBondContact O-N 3.18Å; R421-R424 VanDerWaalsContact O-N 3.12Å
422	I	94.3	Very high	92.5	Very high	3 Å²	3	22.9 Å²	22.9	2%	0.015	11%	0.112	C	C	.	.	H	α-helix	trans	-67.7	-28.3	-176.2	68.9	163.5	0	0	0	111.8	T305 V309 Q311 Y418 R424 S425 A434	T305-I422 HydrophobicContact CG2-CD1 3.97Å; V309-I422 HydrophobicContact CG1-CB 4.34Å; Q311-I422 HydrophobicContact CG-CD1 4.17Å; Y418-I422 HydrophobicContact CD1-CD1 4.2Å; Y418-I422 HydrophobicContact CD1-CG1 4.47Å; Y418-I422 HydrophobicContact CD1-CG2 4.39Å; Y418-I422 HydrophobicContact CD2-CG2 4.37Å; Y418-I422 HydrophobicContact CE1-CD1 3.64Å; Y418-I422 HydrophobicContact CE1-CG1 4.25Å; Y418-I422 HydrophobicContact CE1-CG2 3.96Å; Y418-I422 HydrophobicContact CE2-CG2 3.93Å; Y418-I422 PolarHBondContact O-N 2.75Å; I422-R424 PolarHBondContact O-N 3.25Å; I422-S425 PolarHBondContact O-N 3.29Å; I422-S425 PolarHBondContact O-OG 2.94Å; I422-A434 HydrophobicContact CB-CB 3.89Å; I422-A434 HydrophobicContact CG2-CB 3.63Å
423	G	90.9	Very high	92.6	Very high	3 Å²	3	22.9 Å²	22.9	3%	0.031	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	13.1	172.6	0	0	0	0	0	114.8	L419 R421 R427	L419-G423 PolarHBondContact O-N 2.98Å; L419-G423 VanDerWaalsContact O-N 3.11Å; R421-G423 PolarHBondContact O-N 3.48Å; G423-R427 PolarHBondContact O-NE 2.67Å
424	R	91.1	Very high	92.8	Very high	4 Å²	4	15.5 Å²	15.5	2%	0.015	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-23.5	166.1	-65.6	-47	85.3	166.7	5.9	112.9	I338 F340 T395 R396 G397 I398 V406 H420 R421 I422	I338-R424 HydrophobicContact CD1-CB 4.04Å; I338-R424 HydrophobicContact CD1-CG 4.04Å; F340-R424 HydrophobicContact CE2-CG 4.1Å; F340-R424 HydrophobicContact CZ-CG 3.78Å; T395-R424 PolarHBondContact O-NE 2.91Å; T395-R424 PolarHBondContact O-NH1 2.93Å; T395-R424 PolarHBondContact O-NH2 3.1Å; R396-R424 VanDerWaalsContact C-NH1 3.29Å; G397-R424 VanDerWaalsContact C-NH1 3.31Å; G397-R424 VanDerWaalsContact N-NH1 3.19Å; I398-R424 PolarHBondContact O-NH1 3.29Å; V406-R424 HydrophobicContact CG2-CB 3.7Å; H420-R424 PolarHBondContact O-NE 2.9Å; R421-R424 WeakPolarHBondContact O-CB 3.44Å; R421-R424 WeakPolarHBondContact O-CG 3.33Å; R421-R424 PolarHBondContact O-N 3.18Å; R421-R424 VanDerWaalsContact O-N 3.12Å; I422-R424 PolarHBondContact O-N 3.25Å
425	S	90.8	Very high	93	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	5%	0.054	C	C	.	.	S	Bend	trans	-101.4	170.8	168.5	59.1	0	0	0	0	110.4	V309 I422 R427 L433	V309-S425 WeakPolarHBondContact CG2-O 3.48Å; I422-S425 PolarHBondContact O-N 3.29Å; I422-S425 PolarHBondContact O-OG 2.94Å; S425-R427 PolarHBondContact O-N 3.46Å; S425-L433 PolarHBondContact OG-O 2.85Å
426	G	89.1	Confident	93.3	Very high	3 Å²	3	10.3 Å²	10.3	3%	0.031	5%	0.051	C	C	.	.	S	Bend	trans	62.8	27.9	179.8	0	0	0	0	0	114.8	H430	G426-H430 CarbonylContact C-O 3.52Å; G426-H430 WeakPolarHBondContact CA-O 3.32Å
427	R	89.8	Confident	93.7	Very high	17 Å²	17	7.4 Å²	7.4	6%	0.064	4%	0.038	C	C	.	.	G	3₁₀ helix	trans	-64.5	144.6	-179.7	-72.1	-63.9	-165.2	123.5	-4	111.1	G143 G397 I398 D399 G423 S425 G429 H430	G143-R427 VanDerWaalsContact CA-NH1 3.35Å; G397-R427 PolarHBondContact O-NH2 2.92Å; G397-R427 VanDerWaalsContact O-NH2 3.16Å; I398-R427 PolarHBondContact O-NH2 3.36Å; D399-R427 WeakPolarHBondContact OD1-CG 3.35Å; D399-R427 IonicContact OD1-NH1 3.1Å; D399-R427 IonicContact OD2-NH1 3.64Å; G423-R427 PolarHBondContact O-NE 2.67Å; S425-R427 PolarHBondContact O-N 3.46Å; R427-G429 PolarHBondContact O-N 2.73Å; R427-H430 WeakPolarHBondContact O-CB 3.38Å; R427-H430 PolarHBondContact O-CD2 2.68Å; R427-H430 PolarHBondContact O-N 3.23Å; R427-H430 VanDerWaalsContact O-N 3.11Å
428	F	90	Very high	94	Very high	45 Å²	45	6.3 Å²	6.3	20%	0.197	3%	0.031	C	C	.	.	G	3₁₀ helix	trans	49.7	40.7	-179.2	-149.8	-104.6	0	0	0	114	V90 G143 H430	V90-F428 HydrophobicContact CG1-CD2 4.3Å; V90-F428 HydrophobicContact CG1-CG 4.48Å; V90-F428 WeakPolarHBondContact CG2-O 3.43Å; G143-F428 VanDerWaalsContact O-CA 3.23Å; G143-F428 WeakPolarHBondContact O-CA 3.41Å; G143-F428 PolarHBondContact O-N 3.43Å; F428-H430 VanDerWaalsContact C-N 3.28Å; F428-H430 PolarHBondContact O-N 2.88Å
429	G	90.3	Very high	94.1	Very high	1 Å²	1	6.9 Å²	6.9	1%	0.01	4%	0.035	C	C	.	.	G	3₁₀ helix	trans	80	0	176.7	0	0	0	0	0	115.1	K86 T87 R427	K86-G429 CarbonylContact C-O 3.48Å; K86-G429 WeakPolarHBondContact CA-O 3.45Å; T87-G429 VanDerWaalsContact CG2-O 3.31Å; T87-G429 WeakPolarHBondContact CG2-O 3.43Å; T87-G429 PolarHBondContact N-O 3.2Å; R427-G429 PolarHBondContact O-N 2.73Å
430	H	92.9	Very high	94.3	Very high	8 Å²	8	12.9 Å²	12.9	4%	0.037	6%	0.058	C	C	.	.			trans	-67.1	164.8	173.8	-62	-47.4	0	0	0	111.9	D82 R84 I85 G426 R427 F428	D82-H430 IonicContact OD1-CE1 3.94Å; D82-H430 IonicContact OD2-CE1 2.84Å; D82-H430 PolarHBondContact OD2-CE1 2.92Å; D82-H430 IonicContact OD2-NE2 2.8Å; D82-H430 PolarHBondContact OD2-NE2 2.82Å; R84-H430 WeakPolarHBondContact CB-ND1 3.32Å; R84-H430 VanDerWaalsContact CZ-CD2 3.45Å; R84-H430 VanDerWaalsContact CZ-NE2 3.26Å; R84-H430 PolarHBondContact NE-CE1 3.49Å; R84-H430 VanDerWaalsContact NE-CE1 3.32Å; R84-H430 PolarHBondContact NH2-CD2 3.33Å; R84-H430 PolarHBondContact NH2-NE2 3.4Å; I85-H430 PolarHBondContact O-ND1 2.78Å; G426-H430 CarbonylContact C-O 3.52Å; G426-H430 WeakPolarHBondContact CA-O 3.32Å; R427-H430 WeakPolarHBondContact O-CB 3.38Å; R427-H430 PolarHBondContact O-CD2 2.68Å; R427-H430 PolarHBondContact O-N 3.23Å; R427-H430 VanDerWaalsContact O-N 3.11Å; F428-H430 VanDerWaalsContact C-N 3.28Å; F428-H430 PolarHBondContact O-N 2.88Å
431	L	94.9	Very high	94.5	Very high	38 Å²	38	18.8 Å²	18.8	20%	0.199	9%	0.089	C	C	.	.			trans	-86.5	145.8	175.4	-47.8	-179.4	0	0	0	110.7	I85 T87 G308 S467 L468	I85-L431 HydrophobicContact CG2-CD1 3.73Å; I85-L431 HydrophobicContact CG2-CD2 4.35Å; I85-L431 HydrophobicContact CG2-CG 3.71Å; T87-L431 HydrophobicContact CG2-CD2 4.01Å; G308-L431 CarbonylContact O-C 3.53Å; G308-L431 VanDerWaalsContact O-CA 3.26Å; G308-L431 WeakPolarHBondContact O-CA 3.44Å; L431-S467 WeakPolarHBondContact CD1-O 3.49Å; L431-L468 VanDerWaalsContact CB-O 3.28Å; L431-L468 WeakPolarHBondContact CB-O 3.1Å
432	G	95.8	Very high	94.6	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	163	-177.8	0	0	0	0	0	112	G308 V309 T310 N404 L468	G308-G432 PolarHBondContact O-N 3.3Å; V309-G432 CarbonylContact C-O 3.51Å; V309-G432 WeakPolarHBondContact CA-O 3.29Å; T310-G432 PolarHBondContact N-O 3.48Å; N404-G432 WeakPolarHBondContact O-CA 3.24Å; G432-L468 PolarHBondContact N-O 3.07Å
433	L	97.6	Very high	94.6	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	138	-178.9	-164.2	63.4	0	0	0	110.4	T310 Y312 L332 N404 V405 V406 S425 I435 I464 Y469	T310-L433 HydrophobicContact CG2-CD1 4.29Å; Y312-L433 HydrophobicContact CD2-CD1 3.65Å; Y312-L433 HydrophobicContact CE2-CD1 3.74Å; L332-L433 HydrophobicContact CD1-CD2 4.17Å; L332-L433 HydrophobicContact CD2-CD2 3.99Å; N404-L433 PolarHBondContact O-N 3.09Å; V405-L433 CarbonylContact C-O 3.59Å; V405-L433 WeakPolarHBondContact CA-O 3.47Å; V405-L433 HydrophobicContact CG1-CB 4.49Å; V405-L433 HydrophobicContact CG2-CB 4.17Å; V405-L433 HydrophobicContact CG2-CD2 4.48Å; V406-L433 PolarHBondContact N-O 3.47Å; S425-L433 PolarHBondContact OG-O 2.85Å; L433-I435 HydrophobicContact CD2-CD1 3.78Å; L433-I435 HydrophobicContact CD2-CG1 4.03Å; L433-I435 HydrophobicContact CG-CD1 4.3Å; L433-I435 HydrophobicContact CG-CG1 3.97Å; L433-I464 HydrophobicContact CD1-CG2 4.18Å; L433-I464 HydrophobicContact CD2-CD1 4.17Å; L433-I464 HydrophobicContact CD2-CG2 4.17Å; L433-Y469 HydrophobicContact CB-CD2 4.44Å; L433-Y469 HydrophobicContact CB-CG 4.04Å; L433-Y469 HydrophobicContact CD2-CD1 4.23Å; L433-Y469 HydrophobicContact CD2-CE1 4.36Å; L433-Y469 HydrophobicContact CD2-CG 4.34Å
434	A	98.1	Very high	94.8	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	116.6	169.8	0	0	0	0	0	109.5	V309 T310 Q311 Y312 V406 I422	V309-A434 HydrophobicContact CG1-CB 3.74Å; T310-A434 PolarHBondContact O-N 3.46Å; Q311-A434 WeakPolarHBondContact CA-O 3.36Å; Q311-A434 HydrophobicContact CG-CB 4.29Å; Y312-A434 PolarHBondContact N-O 2.79Å; V406-A434 CarbonylContact O-C 3.46Å; V406-A434 WeakPolarHBondContact O-CA 3.43Å; I422-A434 HydrophobicContact CB-CB 3.89Å; I422-A434 HydrophobicContact CG2-CB 3.63Å
435	I	98.6	Very high	95.1	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	130.6	-180	-56.8	-178.8	0	0	0	110	Y312 L328 L332 V406 I407 N408 L433 I460 I464	Y312-I435 CarbonylContact O-C 3.6Å; Y312-I435 WeakPolarHBondContact O-CA 3.48Å; L328-I435 HydrophobicContact CD1-CD1 4.19Å; L328-I435 HydrophobicContact CD1-CG2 3.84Å; L328-I435 HydrophobicContact CD2-CD1 3.84Å; L332-I435 HydrophobicContact CD1-CD1 3.42Å; L332-I435 VanDerWaalsContact CD1-CD1 3.42Å; V406-I435 PolarHBondContact O-N 3.37Å; I407-I435 CarbonylContact C-O 3.59Å; I407-I435 WeakPolarHBondContact CA-O 3.12Å; N408-I435 PolarHBondContact N-O 3.45Å; L433-I435 HydrophobicContact CD2-CD1 3.78Å; L433-I435 HydrophobicContact CD2-CG1 4.03Å; L433-I435 HydrophobicContact CG-CD1 4.3Å; L433-I435 HydrophobicContact CG-CG1 3.97Å; I435-I460 HydrophobicContact CD1-CD1 4.16Å; I435-I460 HydrophobicContact CG2-CD1 4.22Å; I435-I464 HydrophobicContact CD1-CD1 4.35Å
436	N	98.7	Very high	95.4	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	117.4	-174.7	-58	-67.1	0	0	0	110.2	Y312 Y313 A314 N408 F411 Y418 I438	Y312-N436 WeakPolarHBondContact O-CB 3.3Å; Y312-N436 PolarHBondContact O-N 3.16Å; Y312-N436 PolarHBondContact O-ND2 2.99Å; Y313-N436 CarbonylContact C-O 3.57Å; Y313-N436 VanDerWaalsContact CA-O 3.25Å; Y313-N436 WeakPolarHBondContact CA-O 3.02Å; A314-N436 PolarHBondContact N-O 2.89Å; N408-N436 WeakPolarHBondContact CB-OD1 3.28Å; N408-N436 PolarHBondContact ND2-OD1 3.02Å; F411-N436 HydrophobicContact CD2-CB 3.91Å; F411-N436 HydrophobicContact CE2-CB 3.96Å; Y418-N436 VanDerWaalsContact CE2-OD1 3.28Å; Y418-N436 WeakPolarHBondContact CE2-OD1 3.17Å; Y418-N436 PolarHBondContact OH-ND2 3.44Å; Y418-N436 VanDerWaalsContact OH-ND2 3.15Å; N436-I438 HydrophobicContact CB-CD1 4.08Å; N436-I438 HydrophobicContact CB-CG1 4.29Å; N436-I438 PolarHBondContact O-N 3.42Å
437	L	98.7	Very high	95.7	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	108.7	171.9	-56.7	-168	0	0	0	108.6	A314 V316 K321 L328 N408 F409	A314-L437 HydrophobicContact CB-CD2 3.94Å; V316-L437 HydrophobicContact CG2-CB 4.07Å; K321-L437 HydrophobicContact CB-CD1 4Å; K321-L437 HydrophobicContact CD-CB 4.49Å; K321-L437 HydrophobicContact CG-CB 4.35Å; K321-L437 HydrophobicContact CG-CD1 4.01Å; L328-L437 HydrophobicContact CD1-CD2 4.31Å; N408-L437 PolarHBondContact O-N 2.83Å; F409-L437 HydrophobicContact CD2-CD1 3.71Å; F409-L437 HydrophobicContact CE2-CD1 4.11Å; F409-L437 HydrophobicContact CG-CD1 4.34Å
438	I	98.1	Very high	96	Very high	2 Å²	2	38.9 Å²	38.9	1%	0.01	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	127.1	-173.9	-59.3	-61.2	0	0	0	108.9	Y313 A314 Y315 V316 F411 N436 D442 L446	Y313-I438 HydrophobicContact CD2-CB 4.5Å; Y313-I438 HydrophobicContact CD2-CG1 4.26Å; Y313-I438 HydrophobicContact CG-CG1 4.26Å; A314-I438 PolarHBondContact O-N 3.36Å; Y315-I438 CarbonylContact C-O 3.59Å; Y315-I438 WeakPolarHBondContact CA-O 3.41Å; Y315-I438 HydrophobicContact CD2-CB 4.45Å; Y315-I438 HydrophobicContact CD2-CG2 4.02Å; Y315-I438 HydrophobicContact CE2-CG2 4.41Å; V316-I438 PolarHBondContact N-O 3.49Å; F411-I438 HydrophobicContact CB-CD1 3.77Å; F411-I438 HydrophobicContact CD1-CD1 3.77Å; F411-I438 HydrophobicContact CD2-CD1 3.15Å; F411-I438 HydrophobicContact CE1-CD1 4.11Å; F411-I438 HydrophobicContact CE2-CD1 3.55Å; F411-I438 HydrophobicContact CG-CD1 3.27Å; F411-I438 HydrophobicContact CZ-CD1 4.02Å; N436-I438 HydrophobicContact CB-CD1 4.08Å; N436-I438 HydrophobicContact CB-CG1 4.29Å; N436-I438 PolarHBondContact O-N 3.42Å; I438-D442 HydrophobicContact CD1-CB 4.45Å; I438-D442 HydrophobicContact CG2-CB 3.97Å; I438-L446 HydrophobicContact CD1-CD1 4.36Å; I438-L446 HydrophobicContact CG1-CD2 4.43Å; I438-L446 HydrophobicContact CG2-CD2 4.29Å
439	T	97.8	Very high	96.3	Very high	12 Å²	12	36.7 Å²	36.7	7%	0.074	17%	0.173	C	C	.	.			trans	-96.5	172.5	168.2	69.2	0	0	0	0	111.4	V316 E318 D441 D442	V316-T439 WeakPolarHBondContact O-CA 3.42Å; E318-T439 HydrophobicContact CG-CG2 4.28Å; E318-T439 WeakPolarHBondContact OE1-CG2 3.46Å; T439-D441 PolarHBondContact O-N 3.28Å; T439-D441 PolarHBondContact OG1-N 3.28Å; T439-D442 WeakPolarHBondContact CB-OD2 3.38Å; T439-D442 PolarHBondContact N-OD2 3.06Å; T439-D442 PolarHBondContact O-N 3Å; T439-D442 VanDerWaalsContact O-N 3.1Å; T439-D442 PolarHBondContact OG1-OD2 3.35Å
440	Y	96.2	Very high	96.5	Very high	135 Å²	135	38 Å²	38	53%	0.529	18%	0.179	S	C	.	.	G	3₁₀ helix	trans	-53.9	-41.7	172.7	-178	-109.1	0	0	0	112	Y315 D442 R443	Y315-Y440 VanDerWaalsContact OH-CA 3.26Å; Y315-Y440 WeakPolarHBondContact OH-CA 3.14Å; Y315-Y440 VanDerWaalsContact OH-CB 3.29Å; Y315-Y440 WeakPolarHBondContact OH-CB 3.13Å; Y315-Y440 WeakPolarHBondContact OH-CD2 3.37Å; Y440-D442 PolarHBondContact O-N 3.27Å; Y440-R443 VanDerWaalsContact CE1-NH1 3.3Å; Y440-R443 WeakPolarHBondContact O-CB 3.45Å; Y440-R443 WeakPolarHBondContact O-CD 3.38Å; Y440-R443 WeakPolarHBondContact O-CG 3.34Å; Y440-R443 PolarHBondContact O-N 2.9Å; Y440-R443 PolarHBondContact O-NH1 3.44Å; Y440-R443 PolarHBondContact OH-NH2 3.14Å
441	D	95.5	Very high	96.6	Very high	123 Å²	123	43.9 Å²	43.9	66%	0.658	21%	0.206	S	C	*	.	G	3₁₀ helix	trans	-68.6	-23.3	-178	-63.7	-32.4	0	0	0	112.8	T439 R443	T439-D441 PolarHBondContact O-N 3.28Å; T439-D441 PolarHBondContact OG1-N 3.28Å; D441-R443 VanDerWaalsContact C-N 3.32Å; D441-R443 PolarHBondContact O-N 2.89Å
442	D	97.3	Very high	96.5	Very high	20 Å²	20	47.8 Å²	47.8	11%	0.107	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-80.4	-10.1	179.4	-61.4	-51.1	0	0	0	113.2	F411 I438 T439 Y440 F444 N445 L446	F411-D442 HydrophobicContact CB-CB 4.15Å; F411-D442 HydrophobicContact CD1-CB 4.28Å; I438-D442 HydrophobicContact CD1-CB 4.45Å; I438-D442 HydrophobicContact CG2-CB 3.97Å; T439-D442 WeakPolarHBondContact CB-OD2 3.38Å; T439-D442 PolarHBondContact N-OD2 3.06Å; T439-D442 PolarHBondContact O-N 3Å; T439-D442 VanDerWaalsContact O-N 3.1Å; T439-D442 PolarHBondContact OG1-OD2 3.35Å; Y440-D442 PolarHBondContact O-N 3.27Å; D442-F444 VanDerWaalsContact C-N 3.28Å; D442-F444 PolarHBondContact O-N 3.24Å; D442-F444 VanDerWaalsContact O-N 3.17Å; D442-N445 WeakPolarHBondContact O-CB 3.33Å; D442-N445 PolarHBondContact O-N 3.29Å; D442-L446 PolarHBondContact O-N 3.1Å
443	R	94.4	Very high	96.2	Very high	80 Å²	80	48.4 Å²	48.4	30%	0.302	23%	0.226	S	C	.	.	H	α-helix	trans	-55.7	-36.9	-173.2	72.3	-164.3	179	-76	5.8	114.4	Y440 D441 K447	Y440-R443 VanDerWaalsContact CE1-NH1 3.3Å; Y440-R443 WeakPolarHBondContact O-CB 3.45Å; Y440-R443 WeakPolarHBondContact O-CD 3.38Å; Y440-R443 WeakPolarHBondContact O-CG 3.34Å; Y440-R443 PolarHBondContact O-N 2.9Å; Y440-R443 PolarHBondContact O-NH1 3.44Å; Y440-R443 PolarHBondContact OH-NH2 3.14Å; D441-R443 VanDerWaalsContact C-N 3.32Å; D441-R443 PolarHBondContact O-N 2.89Å; R443-K447 PolarHBondContact O-N 3.18Å
444	F	95.5	Very high	95.9	Very high	134 Å²	134	51.9 Å²	51.9	59%	0.588	26%	0.262	S	S	*	.	H	α-helix	trans	-75.3	-37.5	178.1	-64.3	-65.4	0	0	0	111.8	D442 L446 S448	D442-F444 VanDerWaalsContact C-N 3.28Å; D442-F444 PolarHBondContact O-N 3.24Å; D442-F444 VanDerWaalsContact O-N 3.17Å; F444-L446 VanDerWaalsContact C-N 3.34Å; F444-S448 VanDerWaalsContact O-CB 3.28Å; F444-S448 WeakPolarHBondContact O-CB 3.39Å; F444-S448 PolarHBondContact O-N 3Å
445	N	96.6	Very high	95.5	Very high	41 Å²	41	53.1 Å²	53.1	22%	0.219	27%	0.269	C	S	.	.	H	α-helix	trans	-65.5	-41.5	174.7	-60.9	-35.8	0	0	0	110.1	F411 D442 S448 I449	F411-N445 HydrophobicContact CD1-CB 4.03Å; F411-N445 HydrophobicContact CE1-CB 4.11Å; D442-N445 WeakPolarHBondContact O-CB 3.33Å; D442-N445 PolarHBondContact O-N 3.29Å; N445-S448 PolarHBondContact O-N 3.17Å; N445-I449 WeakPolarHBondContact O-CB 3.35Å; N445-I449 VanDerWaalsContact O-CG1 3.23Å; N445-I449 WeakPolarHBondContact O-CG1 3.17Å; N445-I449 PolarHBondContact O-N 2.99Å
446	L	96.5	Very high	95.2	Very high	14 Å²	14	58.6 Å²	58.6	7%	0.073	30%	0.295	C	S	.	.	H	α-helix	trans	-56.4	-55.5	176.4	176.7	62.6	0	0	0	110.6	F411 I438 D442 F444 S448 I449 E450 I457	F411-L446 VanDerWaalsContact CE1-CA 3.5Å; F411-L446 HydrophobicContact CE1-CB 4.07Å; F411-L446 HydrophobicContact CE1-CD1 4.38Å; F411-L446 HydrophobicContact CE2-CD1 4.39Å; F411-L446 HydrophobicContact CZ-CB 4.36Å; F411-L446 HydrophobicContact CZ-CD1 3.82Å; I438-L446 HydrophobicContact CD1-CD1 4.36Å; I438-L446 HydrophobicContact CG1-CD2 4.43Å; I438-L446 HydrophobicContact CG2-CD2 4.29Å; D442-L446 PolarHBondContact O-N 3.1Å; F444-L446 VanDerWaalsContact C-N 3.34Å; L446-S448 VanDerWaalsContact C-N 3.35Å; L446-S448 PolarHBondContact O-N 3.48Å; L446-I449 PolarHBondContact O-N 3.36Å; L446-E450 HydrophobicContact CD1-CG 4.28Å; L446-E450 WeakPolarHBondContact O-CG 3.49Å; L446-E450 PolarHBondContact O-N 3.48Å; L446-I457 HydrophobicContact CD1-CB 4.24Å; L446-I457 HydrophobicContact CD1-CD1 3.65Å; L446-I457 HydrophobicContact CD1-CG1 4.47Å
447	K	95.9	Very high	95.1	Very high	122 Å²	122	58.6 Å²	58.6	53%	0.53	30%	0.295	S	S	.	.	H	α-helix	trans	-57.6	-46.5	178.8	-178.8	175.7	173.6	179.7	0	112.2	R443 I449 E450 E451	R443-K447 PolarHBondContact O-N 3.18Å; K447-I449 VanDerWaalsContact C-N 3.32Å; K447-I449 PolarHBondContact O-N 3.08Å; K447-E450 PolarHBondContact O-N 3.49Å; K447-E451 WeakPolarHBondContact CE-OE1 3.33Å; K447-E451 IonicContact NZ-OE1 3.81Å; K447-E451 WeakPolarHBondContact O-CB 3.45Å; K447-E451 WeakPolarHBondContact O-CG 3.47Å; K447-E451 PolarHBondContact O-N 3.42Å
448	S	96.3	Very high	95	Very high	41 Å²	41	64 Å²	64	29%	0.287	32%	0.319	S	S	.	.	H	α-helix	trans	-60.4	-41.9	178.6	-178.3	0	0	0	0	112.1	F444 N445 L446 Q452	F444-S448 VanDerWaalsContact O-CB 3.28Å; F444-S448 WeakPolarHBondContact O-CB 3.39Å; F444-S448 PolarHBondContact O-N 3Å; N445-S448 PolarHBondContact O-N 3.17Å; L446-S448 VanDerWaalsContact C-N 3.35Å; L446-S448 PolarHBondContact O-N 3.48Å; S448-Q452 WeakPolarHBondContact O-CB 3.34Å; S448-Q452 VanDerWaalsContact O-CG 3.22Å; S448-Q452 WeakPolarHBondContact O-CG 3.37Å; S448-Q452 PolarHBondContact O-N 3.15Å; S448-Q452 PolarHBondContact OG-NE2 3.23Å
449	I	96.2	Very high	94.9	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-69.1	-42.9	179	-72.3	174.4	0	0	0	111.1	F411 P412 A415 Y418 N445 L446 K447 Q452 L453	F411-I449 HydrophobicContact CD1-CD1 4.42Å; F411-I449 HydrophobicContact CE1-CD1 3.58Å; F411-I449 HydrophobicContact CZ-CB 4.47Å; F411-I449 HydrophobicContact CZ-CD1 3.84Å; P412-I449 HydrophobicContact CG-CD1 4.23Å; P412-I449 WeakPolarHBondContact O-CD1 3.28Å; A415-I449 HydrophobicContact CB-CG1 4.07Å; A415-I449 HydrophobicContact CB-CG2 4.48Å; Y418-I449 HydrophobicContact CD1-CG2 3.75Å; Y418-I449 HydrophobicContact CD2-CG2 4.35Å; Y418-I449 HydrophobicContact CE1-CG2 4.26Å; Y418-I449 HydrophobicContact CG-CD1 4.49Å; Y418-I449 HydrophobicContact CG-CG2 3.8Å; N445-I449 WeakPolarHBondContact O-CB 3.35Å; N445-I449 VanDerWaalsContact O-CG1 3.23Å; N445-I449 WeakPolarHBondContact O-CG1 3.17Å; N445-I449 PolarHBondContact O-N 2.99Å; L446-I449 PolarHBondContact O-N 3.36Å; K447-I449 VanDerWaalsContact C-N 3.32Å; K447-I449 PolarHBondContact O-N 3.08Å; I449-Q452 PolarHBondContact O-N 3.5Å; I449-L453 HydrophobicContact CG2-CD1 3.7Å; I449-L453 HydrophobicContact CG2-CG 4.3Å; I449-L453 VanDerWaalsContact O-CB 3.28Å; I449-L453 WeakPolarHBondContact O-CB 3.16Å; I449-L453 VanDerWaalsContact O-CG 3.3Å; I449-L453 WeakPolarHBondContact O-CG 3.4Å; I449-L453 PolarHBondContact O-N 3.25Å
450	E	95.4	Very high	94.9	Very high	29 Å²	29	68.4 Å²	68.4	14%	0.136	35%	0.345	C	S	.	.	H	α-helix	trans	-59	-46.1	174.8	-71.6	-175.5	131.7	0	0	111.4	L446 K447 G454 T455 I457	L446-E450 HydrophobicContact CD1-CG 4.28Å; L446-E450 WeakPolarHBondContact O-CG 3.49Å; L446-E450 PolarHBondContact O-N 3.48Å; K447-E450 PolarHBondContact O-N 3.49Å; E450-G454 WeakPolarHBondContact O-CA 3.28Å; E450-G454 PolarHBondContact O-N 3.44Å; E450-T455 VanDerWaalsContact CA-O 3.3Å; E450-T455 WeakPolarHBondContact CA-O 3.48Å; E450-T455 VanDerWaalsContact CB-O 3.25Å; E450-T455 WeakPolarHBondContact CB-O 3.39Å; E450-T455 WeakPolarHBondContact CG-O 3.49Å; E450-T455 PolarHBondContact O-N 3.34Å; E450-I457 HydrophobicContact CG-CD1 4.16Å; E450-I457 HydrophobicContact CG-CG1 4.16Å; E450-I457 PolarHBondContact OE1-N 3.39Å
451	E	94.8	Very high	94.8	Very high	130 Å²	130	64.2 Å²	64.2	61%	0.607	34%	0.335	S	S	*	.	H	α-helix	trans	-64.8	-45.8	178.4	-73.4	174	175.1	0	0	112.4	K447 L453	K447-E451 WeakPolarHBondContact CE-OE1 3.33Å; K447-E451 IonicContact NZ-OE1 3.81Å; K447-E451 WeakPolarHBondContact O-CB 3.45Å; K447-E451 WeakPolarHBondContact O-CG 3.47Å; K447-E451 PolarHBondContact O-N 3.42Å; E451-L453 PolarHBondContact O-N 3.38Å
452	Q	91.6	Very high	94.6	Very high	120 Å²	120	62.7 Å²	62.7	56%	0.561	33%	0.334	S	S	*	.	H	α-helix	trans	-69.3	-32.6	-179.3	-74.1	178.5	13.9	0	0	113.1	A415 S448 I449	A415-Q452 HydrophobicContact CB-CB 3.96Å; S448-Q452 WeakPolarHBondContact O-CB 3.34Å; S448-Q452 VanDerWaalsContact O-CG 3.22Å; S448-Q452 WeakPolarHBondContact O-CG 3.37Å; S448-Q452 PolarHBondContact O-N 3.15Å; S448-Q452 PolarHBondContact OG-NE2 3.23Å; I449-Q452 PolarHBondContact O-N 3.5Å
453	L	90.5	Very high	94.4	Very high	14 Å²	14	68 Å²	68	7%	0.073	36%	0.362	C	S	.	.	H	α-helix	trans	-92.8	-10.4	-178.8	-61.7	-177	0	0	0	113.6	L304 T305 A415 Y418 I449 E451 T455	L304-L453 HydrophobicContact CB-CD2 4.02Å; L304-L453 HydrophobicContact CD1-CD2 3.46Å; L304-L453 VanDerWaalsContact CD1-CD2 3.46Å; L304-L453 HydrophobicContact CG-CD2 4.38Å; T305-L453 HydrophobicContact CG2-CD1 4.45Å; A415-L453 HydrophobicContact CB-CD1 4.42Å; A415-L453 HydrophobicContact CB-CD2 3.98Å; A415-L453 HydrophobicContact CB-CG 4Å; Y418-L453 HydrophobicContact CD1-CD1 3.49Å; Y418-L453 VanDerWaalsContact CD1-CD1 3.49Å; Y418-L453 HydrophobicContact CE1-CD1 4.04Å; Y418-L453 HydrophobicContact CG-CD1 4.49Å; I449-L453 HydrophobicContact CG2-CD1 3.7Å; I449-L453 HydrophobicContact CG2-CG 4.3Å; I449-L453 VanDerWaalsContact O-CB 3.28Å; I449-L453 WeakPolarHBondContact O-CB 3.16Å; I449-L453 VanDerWaalsContact O-CG 3.3Å; I449-L453 WeakPolarHBondContact O-CG 3.4Å; I449-L453 PolarHBondContact O-N 3.25Å; E451-L453 PolarHBondContact O-N 3.38Å; L453-T455 HydrophobicContact CB-CG2 3.81Å; L453-T455 PolarHBondContact O-N 3.13Å
454	G	90.3	Very high	94.4	Very high	72 Å²	72	64.9 Å²	64.9	74%	0.742	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.6	30.4	-175.2	0	0	0	0	0	112.8	E450	E450-G454 WeakPolarHBondContact O-CA 3.28Å; E450-G454 PolarHBondContact O-N 3.44Å
455	T	90.4	Very high	94.3	Very high	26 Å²	26	62.9 Å²	62.9	16%	0.16	35%	0.347	C	S	.	.			trans	-124.4	145.2	-176.3	-167.6	0	0	0	0	110.2	T305 Q311 E450 L453	T305-T455 HydrophobicContact CG2-CG2 4.18Å; Q311-T455 PolarHBondContact NE2-OG1 3.16Å; E450-T455 VanDerWaalsContact CA-O 3.3Å; E450-T455 WeakPolarHBondContact CA-O 3.48Å; E450-T455 VanDerWaalsContact CB-O 3.25Å; E450-T455 WeakPolarHBondContact CB-O 3.39Å; E450-T455 WeakPolarHBondContact CG-O 3.49Å; E450-T455 PolarHBondContact O-N 3.34Å; L453-T455 HydrophobicContact CB-CG2 3.81Å; L453-T455 PolarHBondContact O-N 3.13Å
456	E	92.4	Very high	94.2	Very high	115 Å²	115	64 Å²	64	54%	0.537	35%	0.35	S	S	.	.			trans	-95.7	127.8	169	-175	-178.8	-155.5	0	0	109.5	K458	E456-K458 HydrophobicContact CG-CG 4.43Å
457	I	96.4	Very high	94.1	Very high	1 Å²	1	65.1 Å²	65.1	1%	0.005	36%	0.359	C	S	.	.			trans	-95.6	110.9	171.4	-57.7	168.6	0	0	0	106.3	Q311 Y313 F411 Y418 L446 E450	Q311-I457 HydrophobicContact CB-CG1 4.4Å; Q311-I457 HydrophobicContact CB-CG2 4.34Å; Y313-I457 HydrophobicContact CD1-CG2 4.07Å; Y313-I457 WeakPolarHBondContact CD1-O 3.44Å; Y313-I457 VanDerWaalsContact CE1-O 3.27Å; Y313-I457 WeakPolarHBondContact CE1-O 3.46Å; F411-I457 HydrophobicContact CE2-CD1 4.5Å; F411-I457 HydrophobicContact CZ-CD1 4.33Å; Y418-I457 HydrophobicContact CE1-CD1 4.17Å; Y418-I457 HydrophobicContact CE2-CD1 4.06Å; Y418-I457 VanDerWaalsContact OH-CD1 3.23Å; Y418-I457 WeakPolarHBondContact OH-CD1 3.39Å; L446-I457 HydrophobicContact CD1-CB 4.24Å; L446-I457 HydrophobicContact CD1-CD1 3.65Å; L446-I457 HydrophobicContact CD1-CG1 4.47Å; E450-I457 HydrophobicContact CG-CD1 4.16Å; E450-I457 HydrophobicContact CG-CG1 4.16Å; E450-I457 PolarHBondContact OE1-N 3.39Å
458	K	96.2	Very high	94	Very high	113 Å²	113	61.4 Å²	61.4	49%	0.491	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	151.3	-172.2	-67	179.7	-177.1	177.9	0	111.4	Q311 Y312 Y313 E456 I460	Q311-K458 PolarHBondContact O-N 3.15Å; Y312-K458 CarbonylContact C-O 3.56Å; Y312-K458 WeakPolarHBondContact CA-O 3.42Å; Y312-K458 HydrophobicContact CD1-CB 3.89Å; Y312-K458 HydrophobicContact CE1-CB 4.01Å; Y313-K458 VanDerWaalsContact CD1-O 3.3Å; Y313-K458 WeakPolarHBondContact CD1-O 3.44Å; Y313-K458 PolarHBondContact N-O 3.26Å; E456-K458 HydrophobicContact CG-CG 4.43Å; K458-I460 PolarHBondContact O-N 3.3Å
459	P	97.3	Very high	93.9	Very high	76 Å²	76	59.6 Å²	59.6	49%	0.494	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	141	168.3	26.1	-33.6	0	0	0	109.9	Y313	Y313-P459 HydrophobicContact CE1-CB 4.03Å; Y313-P459 HydrophobicContact CE2-CB 4.46Å
460	I	96.7	Very high	93.7	Very high	30 Å²	30	59.6 Å²	59.6	15%	0.154	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-62.6	125.7	179.4	-166	171.3	0	0	0	110.1	Y312 Y313 A314 L328 I435 K458 I464	Y312-I460 HydrophobicContact CG-CG1 4.45Å; Y313-I460 WeakPolarHBondContact O-CB 3.46Å; Y313-I460 PolarHBondContact O-N 3.43Å; A314-I460 HydrophobicContact CB-CG2 3.9Å; L328-I460 HydrophobicContact CD2-CD1 3.68Å; I435-I460 HydrophobicContact CD1-CD1 4.16Å; I435-I460 HydrophobicContact CG2-CD1 4.22Å; K458-I460 PolarHBondContact O-N 3.3Å; I460-I464 HydrophobicContact CD1-CD1 3.79Å; I460-I464 HydrophobicContact CG1-CD1 3.75Å; I460-I464 HydrophobicContact CG1-CG1 4.34Å
461	P	95.6	Very high	93.4	Very high	48 Å²	48	60 Å²	60	31%	0.312	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-73.4	164.5	176.4	30.8	-35.1	0	0	0	111	Y312 N463 I464	Y312-P461 HydrophobicContact CE1-CG 4.27Å; Y312-P461 HydrophobicContact CE2-CG 4.46Å; P461-N463 WeakPolarHBondContact CB-O 3.43Å; P461-N463 WeakPolarHBondContact CG-O 3.33Å; P461-N463 PolarHBondContact O-N 3.3Å; P461-I464 HydrophobicContact CG-CG1 3.77Å
462	S	90.9	Very high	93	Very high	90 Å²	90	60.1 Å²	60.1	63%	0.629	34%	0.34	S	S	*	.	S	Bend	trans	-63	-32.8	176.7	53.6	0	0	0	0	112.9	R331	R331-S462 PolarHBondContact NH1-O 2.89Å; R331-S462 VanDerWaalsContact NH1-O 3.14Å
463	N	91.5	Very high	92.8	Very high	131 Å²	131	60.2 Å²	60.2	70%	0.701	34%	0.336	S	S	*	.	S	Bend	trans	-131.3	130.9	173.7	-167.7	-17.6	0	0	0	108.9	P461	P461-N463 WeakPolarHBondContact CB-O 3.43Å; P461-N463 WeakPolarHBondContact CG-O 3.33Å; P461-N463 PolarHBondContact O-N 3.3Å
464	I	94.6	Very high	92.5	Very high	15 Å²	15	60.5 Å²	60.5	8%	0.077	34%	0.337	C	S	.	.			trans	-103	124.1	178.1	-66.3	163	0	0	0	107.7	Y312 L332 L433 I435 I460 P461 K466 L468 Y469	Y312-I464 HydrophobicContact CD2-CD1 4.17Å; Y312-I464 HydrophobicContact CD2-CG1 4.31Å; Y312-I464 HydrophobicContact CE2-CD1 4.39Å; Y312-I464 HydrophobicContact CE2-CG1 4.07Å; Y312-I464 HydrophobicContact CE2-CG2 4.04Å; L332-I464 HydrophobicContact CD2-CB 4.33Å; L332-I464 HydrophobicContact CD2-CD1 3.71Å; L433-I464 HydrophobicContact CD1-CG2 4.18Å; L433-I464 HydrophobicContact CD2-CD1 4.17Å; L433-I464 HydrophobicContact CD2-CG2 4.17Å; I435-I464 HydrophobicContact CD1-CD1 4.35Å; I460-I464 HydrophobicContact CD1-CD1 3.79Å; I460-I464 HydrophobicContact CG1-CD1 3.75Å; I460-I464 HydrophobicContact CG1-CG1 4.34Å; P461-I464 HydrophobicContact CG-CG1 3.77Å; I464-K466 PolarHBondContact O-N 3.34Å; I464-L468 HydrophobicContact CG2-CD1 4.5Å; I464-Y469 HydrophobicContact CG2-CD1 4.36Å; I464-Y469 HydrophobicContact CG2-CE1 3.98Å
465	D	94.3	Very high	91.5	Very high	92 Å²	92	60.4 Å²	60.4	49%	0.492	33%	0.325	S	S	.	.			trans	-57.8	126.9	175.5	-174.8	0.5	0	0	0	110.8	S467 L468	D465-S467 VanDerWaalsContact C-N 3.27Å; D465-S467 PolarHBondContact O-N 3.07Å; D465-S467 WeakPolarHBondContact OD1-CB 3.26Å; D465-S467 PolarHBondContact OD1-N 3.25Å; D465-S467 PolarHBondContact OD1-OG 3.17Å; D465-S467 PolarHBondContact OD2-OG 3.1Å; D465-L468 HydrophobicContact CB-CD1 3.99Å; D465-L468 HydrophobicContact CB-CG 4.08Å; D465-L468 WeakPolarHBondContact O-CB 3.29Å; D465-L468 PolarHBondContact O-N 3.41Å
466	K	94.4	Very high	89.9	Confident	65 Å²	65	67.3 Å²	67.3	28%	0.283	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-68.3	-27.7	179.7	-67.8	-176.4	179.7	-171.3	0	112	Q333 I464 L468 Y469 V470 Y473	Q333-K466 VanDerWaalsContact OE1-NZ 3.11Å; I464-K466 PolarHBondContact O-N 3.34Å; K466-L468 PolarHBondContact O-N 2.83Å; K466-Y469 PolarHBondContact O-N 3.05Å; K466-Y469 VanDerWaalsContact O-N 3.11Å; K466-V470 HydrophobicContact CB-CB 4.13Å; K466-V470 HydrophobicContact CB-CG2 3.84Å; K466-V470 HydrophobicContact CG-CG2 4.23Å; K466-V470 WeakPolarHBondContact O-CB 3.42Å; K466-V470 WeakPolarHBondContact O-CG2 3.36Å; K466-V470 PolarHBondContact O-N 3.45Å; K466-Y473 HydrophobicContact CB-CD1 4.19Å; K466-Y473 HydrophobicContact CB-CD2 3.96Å; K466-Y473 HydrophobicContact CB-CE1 4.15Å; K466-Y473 HydrophobicContact CB-CE2 3.95Å; K466-Y473 HydrophobicContact CB-CG 4.1Å; K466-Y473 HydrophobicContact CD-CE1 4.22Å; K466-Y473 HydrophobicContact CD-CE2 3.75Å; K466-Y473 WeakPolarHBondContact CD-OH 3.28Å
467	S	93.5	Very high	87.9	Confident	37 Å²	37	67.4 Å²	67.4	26%	0.259	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-58.8	-17.1	175.9	77.8	0	0	0	0	113.2	L431 D465 H474	L431-S467 WeakPolarHBondContact CD1-O 3.49Å; D465-S467 VanDerWaalsContact C-N 3.27Å; D465-S467 PolarHBondContact O-N 3.07Å; D465-S467 WeakPolarHBondContact OD1-CB 3.26Å; D465-S467 PolarHBondContact OD1-N 3.25Å; D465-S467 PolarHBondContact OD1-OG 3.17Å; D465-S467 PolarHBondContact OD2-OG 3.1Å; S467-H474 PolarHBondContact O-CD2 3.33Å; S467-H474 VanDerWaalsContact O-CD2 3.23Å; S467-H474 PolarHBondContact O-NE2 2.94Å
468	L	93.8	Very high	85.5	Confident	44 Å²	44	73 Å²	73	23%	0.23	40%	0.4	C	S	.	.	G	3₁₀ helix	trans	-82.1	-11.7	-179.4	-59.2	173.7	0	0	0	113.9	T310 L431 G432 I464 D465 K466	T310-L468 HydrophobicContact CG2-CD1 4.25Å; L431-L468 VanDerWaalsContact CB-O 3.28Å; L431-L468 WeakPolarHBondContact CB-O 3.1Å; G432-L468 PolarHBondContact N-O 3.07Å; I464-L468 HydrophobicContact CG2-CD1 4.5Å; D465-L468 HydrophobicContact CB-CD1 3.99Å; D465-L468 HydrophobicContact CB-CG 4.08Å; D465-L468 WeakPolarHBondContact O-CB 3.29Å; D465-L468 PolarHBondContact O-N 3.41Å; K466-L468 PolarHBondContact O-N 2.83Å
469	Y	94.7	Very high	83	Confident	3 Å²	3	76.2 Å²	76.2	1%	0.012	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-159.8	-4.2	-173.4	71.7	-75.5	0	0	0	115.6	L332 Q333 N404 V405 L433 I464 K466	L332-Y469 WeakPolarHBondContact CA-OH 3.31Å; L332-Y469 HydrophobicContact CB-CE2 4.45Å; Q333-Y469 PolarHBondContact N-OH 3.03Å; Q333-Y469 WeakPolarHBondContact O-CE2 3.46Å; N404-Y469 WeakPolarHBondContact CB-O 3.45Å; N404-Y469 WeakPolarHBondContact ND2-CD2 3.47Å; N404-Y469 PolarHBondContact ND2-O 3.27Å; V405-Y469 HydrophobicContact CG2-CD2 3.64Å; V405-Y469 HydrophobicContact CG2-CE2 3.96Å; L433-Y469 HydrophobicContact CB-CD2 4.44Å; L433-Y469 HydrophobicContact CB-CG 4.04Å; L433-Y469 HydrophobicContact CD2-CD1 4.23Å; L433-Y469 HydrophobicContact CD2-CE1 4.36Å; L433-Y469 HydrophobicContact CD2-CG 4.34Å; I464-Y469 HydrophobicContact CG2-CD1 4.36Å; I464-Y469 HydrophobicContact CG2-CE1 3.98Å; K466-Y469 PolarHBondContact O-N 3.05Å; K466-Y469 VanDerWaalsContact O-N 3.11Å
470	V	93.4	Very high	80.5	Confident	1 Å²	1	79.6 Å²	79.6	1%	0.006	43%	0.431	C	S	.	.			trans	-109.7	112.4	-173.8	-177.1	0	0	0	0	108.7	Q333 K466 E472 Y473 H474	Q333-V470 HydrophobicContact CB-CG2 3.92Å; Q333-V470 HydrophobicContact CG-CG1 4.17Å; Q333-V470 HydrophobicContact CG-CG2 4.37Å; K466-V470 HydrophobicContact CB-CB 4.13Å; K466-V470 HydrophobicContact CB-CG2 3.84Å; K466-V470 HydrophobicContact CG-CG2 4.23Å; K466-V470 WeakPolarHBondContact O-CB 3.42Å; K466-V470 WeakPolarHBondContact O-CG2 3.36Å; K466-V470 PolarHBondContact O-N 3.45Å; V470-E472 WeakPolarHBondContact CG1-OE2 3.42Å; V470-E472 PolarHBondContact O-N 2.94Å; V470-E472 VanDerWaalsContact O-N 3.12Å; V470-Y473 HydrophobicContact CB-CD2 3.77Å; V470-Y473 HydrophobicContact CB-CE2 4.34Å; V470-Y473 HydrophobicContact CG1-CD2 3.51Å; V470-Y473 HydrophobicContact CG1-CE2 3.81Å; V470-Y473 PolarHBondContact O-N 3.2Å; V470-H474 PolarHBondContact N-NE2 2.97Å; V470-H474 PolarHBondContact O-CD2 3.19Å; V470-H474 VanDerWaalsContact O-CD2 3.26Å; V470-H474 PolarHBondContact O-NE2 3.36Å
471	A	87.9	Confident	77.9	Confident	36 Å²	36	87.1 Å²	87.1	30%	0.298	47%	0.465	S	S	.	.	G	3₁₀ helix	trans	-54.9	-35.7	-171.2	0	0	0	0	0	113.9	R84 Y473 H474	R84-A471 HydrophobicContact CG-CB 4.32Å; A471-Y473 PolarHBondContact O-N 3.03Å; A471-Y473 VanDerWaalsContact O-N 3.16Å; A471-H474 WeakPolarHBondContact O-CB 3.32Å; A471-H474 PolarHBondContact O-N 3Å
472	E	87.6	Confident	75.1	Confident	134 Å²	134	94.2 Å²	94.2	63%	0.626	49%	0.491	S	S	*	.	G	3₁₀ helix	trans	-63.9	-17.6	179.4	-59.7	87.1	165.6	0	0	113.4	V470	V470-E472 WeakPolarHBondContact CG1-OE2 3.42Å; V470-E472 PolarHBondContact O-N 2.94Å; V470-E472 VanDerWaalsContact O-N 3.12Å
473	Y	87	Confident	72.7	Confident	121 Å²	121	99.4 Å²	99.4	48%	0.475	52%	0.522	S	S	.	.	G	3₁₀ helix	trans	-97.8	2.4	177	-67.3	-105.7	0	0	0	112.4	K466 V470 A471	K466-Y473 HydrophobicContact CB-CD1 4.19Å; K466-Y473 HydrophobicContact CB-CD2 3.96Å; K466-Y473 HydrophobicContact CB-CE1 4.15Å; K466-Y473 HydrophobicContact CB-CE2 3.95Å; K466-Y473 HydrophobicContact CB-CG 4.1Å; K466-Y473 HydrophobicContact CD-CE1 4.22Å; K466-Y473 HydrophobicContact CD-CE2 3.75Å; K466-Y473 WeakPolarHBondContact CD-OH 3.28Å; V470-Y473 HydrophobicContact CB-CD2 3.77Å; V470-Y473 HydrophobicContact CB-CE2 4.34Å; V470-Y473 HydrophobicContact CG1-CD2 3.51Å; V470-Y473 HydrophobicContact CG1-CE2 3.81Å; V470-Y473 PolarHBondContact O-N 3.2Å; A471-Y473 PolarHBondContact O-N 3.03Å; A471-Y473 VanDerWaalsContact O-N 3.16Å
474	H	84.8	Confident	71.7	Confident	21 Å²	21	97.8 Å²	97.8	10%	0.097	51%	0.513	C	S	.	.	S	Bend	trans	-101.2	-14.5	-179.3	-53.8	165.6	0	0	0	113.3	I85 S467 V470 A471 E476	I85-H474 HydrophobicContact CB-CB 4.41Å; I85-H474 HydrophobicContact CG2-CB 3.91Å; S467-H474 PolarHBondContact O-CD2 3.33Å; S467-H474 VanDerWaalsContact O-CD2 3.23Å; S467-H474 PolarHBondContact O-NE2 2.94Å; V470-H474 PolarHBondContact N-NE2 2.97Å; V470-H474 PolarHBondContact O-CD2 3.19Å; V470-H474 VanDerWaalsContact O-CD2 3.26Å; V470-H474 PolarHBondContact O-NE2 3.36Å; A471-H474 WeakPolarHBondContact O-CB 3.32Å; A471-H474 PolarHBondContact O-N 3Å; H474-E476 PolarHBondContact O-N 3.05Å
475	S	68.7	Low	70.5	Confident	69 Å²	69	102.2 Å²	102.2	48%	0.483	54%	0.536	S	S	.	.	S	Bend	trans	-73.9	124.9	176.2	-54.6	0	0	0	0	108.5
476	E	57.2	Low	69.2	Low	171 Å²	171	102.7 Å²	102.7	80%	0.799	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-57.5	143.1	161.3	-70	-177.6	165.6	0	0	108.1	H474 V478	H474-E476 PolarHBondContact O-N 3.05Å; E476-V478 PolarHBondContact O-N 3.42Å
477	P	49.1	Very low	67.7	Low	117 Å²	117	104.9 Å²	104.9	76%	0.76	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-54.4	119	164.2	23.8	-29.4	0	0	0	105.8	E479	P477-E479 PolarHBondContact O-N 3.32Å
478	V	46	Very low	66.1	Low	119 Å²	119	109.2 Å²	109.2	72%	0.721	57%	0.572	S	S	*	*			trans	-50	112.3	171	-179.6	0	0	0	0	104.5	E476 D480	E476-V478 PolarHBondContact O-N 3.42Å; V478-D480 PolarHBondContact O-N 2.91Å
479	E	44.8	Very low	64.3	Low	181 Å²	181	113.5 Å²	113.5	85%	0.846	60%	0.595	S	S	*	*			trans	-56.2	105.6	166	-76.1	-172.1	159	0	0	103.7	P477 E481	P477-E479 PolarHBondContact O-N 3.32Å; E479-E481 PolarHBondContact O-N 3.11Å
480	D	44.1	Very low	62.1	Low	147 Å²	147	121.4 Å²	121.4	79%	0.786	64%	0.637	S	S	*	*			trans	-45.4	114	173.5	-78.4	-43.4	0	0	0	105.3	V478 K482	V478-D480 PolarHBondContact O-N 2.91Å; D480-K482 VanDerWaalsContact C-N 3.27Å; D480-K482 PolarHBondContact O-N 2.83Å
481	E	41.6	Very low	59.7	Low	187 Å²	187	130.7 Å²	130.7	87%	0.874	69%	0.685	S	S	*	*			trans	-49.7	104	170.3	-76.3	-177.7	157.3	0	0	104.9	E479	E479-E481 PolarHBondContact O-N 3.11Å
482	K	36.9	Very low	57.4	Low	198 Å²	198	138.6 Å²	138.6	86%	0.861	72%	0.718	S	S	*	*			trans	-57.4	127.6	175.6	-88.8	-179.3	176.4	173.8	0	105.7	D480	D480-K482 VanDerWaalsContact C-N 3.27Å; D480-K482 PolarHBondContact O-N 2.83Å
483	P	40.5	Very low	54.6	Low	198 Å²	198	139 Å²	139	100%	1.286	73%	0.726	S	S	*	*			trans	-59.7	0	-174	24	-34.2	0	0	0	113.1

Retrieved 483 of 483 residues in 96.9 ms (Link to these results)

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