A0A087YBT1_POEFO Loading...

F-box protein 31

AlphaFold DB , UniProt , Accession A0A087YBT1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 553 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28.5	Very low	31.8	Very low	229 Å²	229	158.8 Å²	158.8	100%	1.128	79%	0.792	S	S	*	*				0	87.2	0	-168.9	-167.9	-65.5	0	0	101.8
2	D	29.3	Very low	31.6	Very low	156 Å²	156	161.9 Å²	161.9	83%	0.834	80%	0.802	S	S	*	*			trans	-99.2	118.5	-148.6	-58.5	-12.5	0	0	0	107.5	E4	D2-E4 PolarHBondContact O-N 3.5Å
3	E	29.7	Very low	31.4	Very low	188 Å²	188	166.9 Å²	166.9	88%	0.879	81%	0.807	S	S	*	*			trans	-70.4	119.6	176.8	-69.4	179.2	157.9	0	0	108.8	E5	E3-E5 PolarHBondContact O-N 2.84Å
4	E	35.3	Very low	31.2	Very low	189 Å²	189	173.2 Å²	173.2	88%	0.883	82%	0.818	S	S	*	*			trans	-70.4	91.3	170.1	-72	180	150.9	0	0	109.1	D2 E6	D2-E4 PolarHBondContact O-N 3.5Å; E4-E6 PolarHBondContact O-N 3.09Å
5	E	30.4	Very low	31	Very low	169 Å²	169	169 Å²	169	79%	0.79	81%	0.814	S	S	*	*			trans	-76.1	101.6	159.9	-97.5	-174.9	148.8	0	0	109.2	E3 E7	E3-E5 PolarHBondContact O-N 2.84Å; E5-E7 PolarHBondContact O-N 3.45Å
6	E	31.8	Very low	30.7	Very low	163 Å²	163	169.4 Å²	169.4	76%	0.762	82%	0.822	S	S	*	*			trans	-64.1	95.3	166.5	-77.1	-172.5	142.2	0	0	110.2	E4 R8	E4-E6 PolarHBondContact O-N 3.09Å; E6-R8 PolarHBondContact O-N 3.03Å; E6-R8 VanDerWaalsContact O-N 3.14Å
7	E	35	Very low	30.5	Very low	95 Å²	95	165.9 Å²	165.9	44%	0.444	83%	0.828	S	S	.	*			trans	-71.9	103.6	167.6	-76.2	175.1	169.1	0	0	109.7	E5 I9 K249 R540	E5-E7 PolarHBondContact O-N 3.45Å; E7-I9 PolarHBondContact O-N 3.33Å; E7-K249 IonicContact OE2-NZ 3.91Å; E7-R540 IonicContact OE1-NH2 3.24Å
8	R	32.6	Very low	30.3	Very low	225 Å²	225	161 Å²	161	85%	0.849	83%	0.826	S	S	*	*			trans	-59.5	123.8	165.3	-92.4	179.1	171.4	168.2	-1.3	109.9	E6 V10	E6-R8 PolarHBondContact O-N 3.03Å; E6-R8 VanDerWaalsContact O-N 3.14Å; R8-V10 HydrophobicContact CB-CG2 4.12Å; R8-V10 PolarHBondContact O-N 2.82Å; R8-V10 VanDerWaalsContact O-N 3.08Å
9	I	34.7	Very low	30.1	Very low	151 Å²	151	158.7 Å²	158.7	77%	0.774	83%	0.826	S	S	*	*			trans	-73	97.7	162.1	-60.1	172.8	0	0	0	106.8	E7 G11	E7-I9 PolarHBondContact O-N 3.33Å; I9-G11 PolarHBondContact O-N 3.19Å
10	V	33.6	Very low	29.9	Very low	119 Å²	119	156.8 Å²	156.8	72%	0.721	83%	0.825	S	S	*	*			trans	-79.6	112.5	-174.6	177.1	0	0	0	0	110.7	R8	R8-V10 HydrophobicContact CB-CG2 4.12Å; R8-V10 PolarHBondContact O-N 2.82Å; R8-V10 VanDerWaalsContact O-N 3.08Å
11	G	28.5	Very low	29.7	Very low	63 Å²	63	153.1 Å²	153.1	65%	0.649	83%	0.825	S	S	*	*			trans	-74.5	132	152.8	0	0	0	0	0	110	I9 R13	I9-G11 PolarHBondContact O-N 3.19Å; G11-R13 PolarHBondContact O-N 2.82Å
12	Q	30.3	Very low	29.7	Very low	196 Å²	196	146 Å²	146	92%	0.916	81%	0.809	S	S	*	*			trans	-52.2	128	179.3	-77.1	171.7	-18.2	0	0	112.2
13	R	28	Very low	30	Very low	227 Å²	227	144.9 Å²	144.9	86%	0.857	81%	0.811	S	S	*	*			trans	-129.5	135.4	162.3	-92.3	-171.7	177.9	-173.8	0.5	111.1	G11	G11-R13 PolarHBondContact O-N 2.82Å
14	R	29.1	Very low	29.8	Very low	255 Å²	255	139.9 Å²	139.9	96%	0.962	81%	0.81	S	S	*	*			trans	-61.1	137.3	173.2	-76.2	177.3	168.4	178.3	-4.9	110.9
15	S	28.1	Very low	29.4	Very low	110 Å²	110	142 Å²	142	77%	0.769	81%	0.81	S	S	*	*			trans	-81.9	136.8	174.5	44.9	0	0	0	0	111.9
16	D	26.9	Very low	29.2	Very low	176 Å²	176	139.9 Å²	139.9	94%	0.941	81%	0.808	S	S	*	*			trans	-144	142.2	146.8	-91.7	-33	0	0	0	109.5
17	A	27.3	Very low	29	Very low	110 Å²	110	136.3 Å²	136.3	91%	0.909	81%	0.806	S	S	*	*			trans	-88.8	157.5	-161.2	0	0	0	0	0	114.5
18	G	26.5	Very low	28.6	Very low	77 Å²	77	136.6 Å²	136.6	79%	0.794	83%	0.825	S	S	*	*			trans	173.3	89.6	166.2	0	0	0	0	0	114.5
19	S	25.6	Very low	28.4	Very low	118 Å²	118	130.3 Å²	130.3	83%	0.825	82%	0.821	S	S	*	*			trans	-48.4	153.4	164.3	-160.1	0	0	0	0	111.5
20	C	25.9	Very low	28	Very low	120 Å²	120	128 Å²	128	81%	0.811	82%	0.824	S	S	*	*				-177.4	146.4	51.6	36	0	0	0	0	108.5
21	G	26.9	Very low	27.7	Very low	80 Å²	80	126.7 Å²	126.7	83%	0.825	83%	0.826	S	S	*	*				131.5	125.5	105	0	0	0	0	0	112
22	G	27.4	Very low	27.6	Very low	78 Å²	78	128.7 Å²	128.7	80%	0.804	84%	0.836	S	S	*	*			trans	-86.4	-165.4	-168.4	0	0	0	0	0	117.7
23	P	36.1	Very low	27.6	Very low	134 Å²	134	122.9 Å²	122.9	87%	0.87	82%	0.822	S	S	*	*			trans	-112.8	164.1	-142	40.3	-32.8	0	0	0	115.7
24	G	26	Very low	27.5	Very low	82 Å²	82	118.6 Å²	118.6	85%	0.845	82%	0.821	S	S	*	*			trans	-123.5	122.1	170.1	0	0	0	0	0	112.4
25	R	26.6	Very low	27.4	Very low	234 Å²	234	111.3 Å²	111.3	88%	0.883	82%	0.815	S	S	*	*			trans	-88.2	165.3	178.5	-68.1	166.2	79.8	-169.4	9.3	112.2
26	V	27	Very low	27.4	Very low	125 Å²	125	114.9 Å²	114.9	76%	0.758	82%	0.82	S	S	*	*			trans	114.5	126.5	134	-167.2	0	0	0	0	119.1
27	A	27.8	Very low	28.1	Very low	88 Å²	88	112 Å²	112	73%	0.727	81%	0.811	S	S	*	*			trans	73.2	123.4	150.4	0	0	0	0	0	119.5
28	A	25.7	Very low	28.2	Very low	101 Å²	101	111.8 Å²	111.8	84%	0.835	80%	0.803	S	S	*	*			cis	81	112.3	38.2	0	0	0	0	0	115.1
29	A	28	Very low	28.4	Very low	93 Å²	93	115.9 Å²	115.9	77%	0.769	81%	0.806	S	S	*	*			trans	157.2	110.1	142.3	0	0	0	0	0	108.2
30	A	27.5	Very low	28.5	Very low	102 Å²	102	114.6 Å²	114.6	84%	0.843	80%	0.803	S	S	*	*				73.8	145.5	93.9	0	0	0	0	0	113.3
31	A	27.3	Very low	28.7	Very low	91 Å²	91	115.1 Å²	115.1	75%	0.752	81%	0.807	S	S	*	*			cis	-175.1	148.8	-20.7	0	0	0	0	0	104.7
32	A	26.1	Very low	28.9	Very low	105 Å²	105	119.9 Å²	119.9	87%	0.868	81%	0.807	S	S	*	*			trans	62.8	148.5	152.7	0	0	0	0	0	118.3
33	A	28.9	Very low	29	Very low	75 Å²	75	127.1 Å²	127.1	62%	0.62	81%	0.812	S	S	*	*			cis	-172.3	159.8	-3.3	0	0	0	0	0	107.9
34	T	27.1	Very low	28.7	Very low	137 Å²	137	124 Å²	124	84%	0.84	81%	0.805	S	S	*	*			trans	60.8	116.3	146	52.2	0	0	0	0	120.4
35	A	27.6	Very low	29	Very low	101 Å²	101	126.4 Å²	126.4	84%	0.835	81%	0.808	S	S	*	*				162.4	117.2	97.3	0	0	0	0	0	111.2
36	E	27.3	Very low	29.2	Very low	185 Å²	185	118.3 Å²	118.3	86%	0.864	80%	0.798	S	S	*	*			trans	-70.1	166.5	151.8	-84.3	-171	-178.4	0	0	109.6
37	P	41.8	Very low	29.6	Very low	116 Å²	116	120.7 Å²	120.7	75%	0.753	80%	0.8	S	S	*	*			cis	-151.8	-178.2	37.5	40.3	-17.3	0	0	0	118.8
38	S	29.2	Very low	29.9	Very low	105 Å²	105	122.9 Å²	122.9	73%	0.734	80%	0.8	S	S	*	*			trans	111.8	97.8	143.3	98.7	0	0	0	0	118.5
39	D	29.7	Very low	30.4	Very low	163 Å²	163	123.5 Å²	123.5	87%	0.872	79%	0.794	S	S	*	*				46.9	141.2	117.3	-80.4	-19.6	0	0	0	123.9
40	A	29.2	Very low	30.8	Very low	92 Å²	92	126.6 Å²	126.6	76%	0.76	80%	0.797	S	S	*	*			trans	81.2	118.5	161.7	0	0	0	0	0	114.7
41	C	30.5	Very low	31.5	Very low	131 Å²	131	133.5 Å²	133.5	89%	0.885	80%	0.801	S	S	*	*				-177	159.2	60.5	39.8	0	0	0	0	110.8
42	E	31.1	Very low	31.9	Very low	179 Å²	179	133 Å²	133	84%	0.836	81%	0.805	S	S	*	*			trans	-76.2	167.4	-172.1	-67	173.6	123.6	0	0	115.4
43	Y	29.6	Very low	32.7	Very low	230 Å²	230	131.9 Å²	131.9	90%	0.902	80%	0.803	S	S	*	*			trans	95	125.3	141.2	-126.9	-93.1	0	0	0	118.6
44	G	29.4	Very low	33.4	Very low	70 Å²	70	133.2 Å²	133.2	72%	0.722	81%	0.808	S	S	*	*			trans	144.2	91.5	153.4	0	0	0	0	0	116.8
45	S	31.9	Very low	34.3	Very low	131 Å²	131	134.6 Å²	134.6	92%	0.916	81%	0.811	S	S	*	*			trans	-57.1	152	169.9	-168.2	0	0	0	0	114.9
46	G	30.7	Very low	35.4	Very low	64 Å²	64	136.2 Å²	136.2	66%	0.66	81%	0.81	S	S	*	*			trans	147.2	100.2	149.3	0	0	0	0	0	120
47	H	34.5	Very low	37	Very low	175 Å²	175	129.8 Å²	129.8	81%	0.81	79%	0.794	S	S	*	*			trans	65.1	103.3	135.9	-89.4	68.7	0	0	0	123.2
48	N	34.7	Very low	37.9	Very low	134 Å²	134	129.7 Å²	129.7	72%	0.717	79%	0.793	S	S	*	*				83.7	140.7	109.3	-134.8	9.6	0	0	0	122.6
49	T	35.9	Very low	39.7	Very low	115 Å²	115	130.6 Å²	130.6	71%	0.706	80%	0.796	S	S	*	*			trans	76.8	125	170.5	75.2	0	0	0	0	115.3
50	N	36.7	Very low	41.5	Very low	157 Å²	157	130.9 Å²	130.9	84%	0.84	79%	0.792	S	S	*	*			cis	-156.7	150.5	48.7	-121.8	-18.2	0	0	0	113.4
51	R	42.4	Very low	43.7	Very low	248 Å²	248	129.7 Å²	129.7	94%	0.936	78%	0.776	S	S	*	*			trans	-56.6	145.7	173.7	-80.1	167.6	153.9	178.1	-7.3	113.7
52	G	35.3	Very low	46.1	Very low	81 Å²	81	132.2 Å²	132.2	84%	0.835	78%	0.775	S	S	*	*			trans	-165.9	79	162.9	0	0	0	0	0	113.8
53	G	43.8	Very low	48.8	Very low	80 Å²	80	125.9 Å²	125.9	83%	0.825	75%	0.751	S	S	*	*			trans	70.5	78.3	153	0	0	0	0	0	118.9	N55	G53-N55 PolarHBondContact O-N 3.25Å
54	S	42.3	Very low	51.7	Low	103 Å²	103	118.9 Å²	118.9	72%	0.72	73%	0.729	S	S	*	*			trans	-81.1	108.4	159.1	59.9	0	0	0	0	109.4	T56	S54-T56 PolarHBondContact O-N 3.35Å
55	N	46.5	Very low	54.6	Low	167 Å²	167	119.1 Å²	119.1	89%	0.893	71%	0.712	S	S	*	*			trans	-55.3	100.9	159.5	-106.6	-5.7	0	0	0	108.1	G53 G57	G53-N55 PolarHBondContact O-N 3.25Å; N55-G57 PolarHBondContact O-N 3.43Å
56	T	50.8	Low	57.3	Low	135 Å²	135	118.1 Å²	118.1	83%	0.828	69%	0.692	S	S	*	*			trans	-83.7	65.8	172.4	55.1	0	0	0	0	109.2	S54	S54-T56 PolarHBondContact O-N 3.35Å
57	G	61.5	Low	60.3	Low	50 Å²	50	116.4 Å²	116.4	52%	0.515	67%	0.668	S	S	.	*	S	Bend	trans	-91.4	150.9	154.4	0	0	0	0	0	108.5	N55	N55-G57 PolarHBondContact O-N 3.43Å
58	P	60.7	Low	63.1	Low	113 Å²	113	111 Å²	111	73%	0.734	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-53.6	137.1	171.2	22.8	-30.5	0	0	0	109	H60	P58-H60 PolarHBondContact O-N 2.88Å; P58-H60 VanDerWaalsContact O-N 3.13Å
59	P	65.8	Low	65.9	Low	125 Å²	125	107.8 Å²	107.8	81%	0.812	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-56.7	123.3	-178	22.2	-31.5	0	0	0	109.1
60	H	69.1	Low	68.7	Low	168 Å²	168	108.8 Å²	108.8	78%	0.778	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-70.1	128.9	170	-82.1	-64.9	0	0	0	107.8	P58 E62	P58-H60 PolarHBondContact O-N 2.88Å; P58-H60 VanDerWaalsContact O-N 3.13Å; H60-E62 PolarHBondContact O-N 2.87Å
61	P	74.6	Confident	71.4	Confident	67 Å²	67	105.9 Å²	105.9	44%	0.435	62%	0.616	S	S	.	*	P	Polyproline II helix	trans	-62.1	122.7	179.4	23.9	-31.2	0	0	0	109.4	S63 E66 L67	P61-S63 VanDerWaalsContact C-N 3.34Å; P61-E66 HydrophobicContact CB-CB 3.97Å; P61-L67 HydrophobicContact CB-CD2 3.85Å; P61-L67 HydrophobicContact CG-CD2 3.49Å; P61-L67 VanDerWaalsContact CG-CD2 3.49Å
62	E	80.8	Confident	73.9	Confident	185 Å²	185	94 Å²	94	86%	0.864	57%	0.571	S	S	*	*	S	Bend	trans	-83.7	-17.9	-178.8	-65.1	-169.7	168	0	0	111.5	H60 E66	H60-E62 PolarHBondContact O-N 2.87Å; E62-E66 PolarHBondContact N-OE2 2.91Å
63	S	88.5	Confident	76.7	Confident	46 Å²	46	91.5 Å²	91.5	32%	0.322	54%	0.539	S	S	.	.	S	Bend	trans	-136.1	151.7	177.5	73.7	0	0	0	0	112.4	P61 M65 E66	P61-S63 VanDerWaalsContact C-N 3.34Å; S63-M65 PolarHBondContact O-N 3.46Å; S63-M65 VanDerWaalsContact O-N 3.07Å; S63-E66 WeakPolarHBondContact CB-OE1 3.4Å; S63-E66 PolarHBondContact O-N 2.85Å; S63-E66 VanDerWaalsContact OG-CD 3.26Å; S63-E66 WeakPolarHBondContact OG-CG 3.42Å; S63-E66 PolarHBondContact OG-OE1 3.04Å
64	L	90.8	Very high	79.2	Confident	83 Å²	83	92.2 Å²	92.2	44%	0.435	52%	0.521	S	S	.	.	G	3₁₀ helix	trans	-54.9	-29.7	173.9	-175.5	67.6	0	0	0	111.6	E66 L67 L72 I75 F94	L64-E66 VanDerWaalsContact C-N 3.27Å; L64-E66 PolarHBondContact O-N 3.24Å; L64-L67 HydrophobicContact CD1-CD1 3.65Å; L64-L67 WeakPolarHBondContact O-CB 3.46Å; L64-L67 PolarHBondContact O-N 3.21Å; L64-L72 HydrophobicContact CD1-CD2 3.91Å; L64-L72 HydrophobicContact CG-CD2 3.97Å; L64-I75 HydrophobicContact CD1-CD1 4.17Å; L64-F94 HydrophobicContact CD2-CE2 4.05Å; L64-F94 HydrophobicContact CD2-CZ 3.7Å; L64-F94 HydrophobicContact CG-CZ 3.93Å
65	M	88.3	Confident	81.7	Confident	75 Å²	75	90.4 Å²	90.4	37%	0.369	50%	0.503	S	S	.	.	G	3₁₀ helix	trans	-68.6	-22	179.5	-69.3	-65.2	-64.1	0	0	113.7	S63 L67 C91 K93 F94	S63-M65 PolarHBondContact O-N 3.46Å; S63-M65 VanDerWaalsContact O-N 3.07Å; M65-L67 VanDerWaalsContact C-N 3.33Å; M65-C91 HydrophobicContact CE-CB 4.3Å; M65-C91 WeakPolarHBondContact CE-SG 3.09Å; M65-C91 PolarHBondContact SD-SG 2.77Å; M65-K93 HydrophobicContact CE-CB 3.75Å; M65-K93 HydrophobicContact CE-CD 3.95Å; M65-K93 HydrophobicContact CE-CG 4.4Å; M65-K93 PolarHBondContact O-NZ 2.82Å; M65-F94 HydrophobicContact CG-CZ 4.38Å; M65-F94 HydrophobicContact SD-CD1 3.85Å; M65-F94 HydrophobicContact SD-CE1 3.23Å; M65-F94 WeakPolarHBondContact SD-CE1 3.39Å; M65-F94 HydrophobicContact SD-CE2 4.19Å; M65-F94 HydrophobicContact SD-CZ 3.42Å; M65-F94 WeakPolarHBondContact SD-CZ 3.39Å
66	E	90.6	Very high	84	Confident	109 Å²	109	82.7 Å²	82.7	51%	0.509	46%	0.461	S	S	.	.	G	3₁₀ helix	trans	-84.5	-10.5	179.4	-74.2	153.4	-135.6	0	0	112.9	P61 E62 S63 L64	P61-E66 HydrophobicContact CB-CB 3.97Å; E62-E66 PolarHBondContact N-OE2 2.91Å; S63-E66 WeakPolarHBondContact CB-OE1 3.4Å; S63-E66 PolarHBondContact O-N 2.85Å; S63-E66 VanDerWaalsContact OG-CD 3.26Å; S63-E66 WeakPolarHBondContact OG-CG 3.42Å; S63-E66 PolarHBondContact OG-OE1 3.04Å; L64-E66 VanDerWaalsContact C-N 3.27Å; L64-E66 PolarHBondContact O-N 3.24Å
67	L	92.7	Very high	86	Confident	28 Å²	28	76.5 Å²	76.5	15%	0.147	42%	0.423	C	S	.	.	S	Bend	trans	-61.9	143.3	176.4	-65.3	-174.3	0	0	0	111.6	P61 L64 M65 L71 L72 I75 K93	P61-L67 HydrophobicContact CB-CD2 3.85Å; P61-L67 HydrophobicContact CG-CD2 3.49Å; P61-L67 VanDerWaalsContact CG-CD2 3.49Å; L64-L67 HydrophobicContact CD1-CD1 3.65Å; L64-L67 WeakPolarHBondContact O-CB 3.46Å; L64-L67 PolarHBondContact O-N 3.21Å; M65-L67 VanDerWaalsContact C-N 3.33Å; L67-L71 HydrophobicContact CD2-CD1 4.42Å; L67-L72 HydrophobicContact CB-CD1 4.34Å; L67-L72 HydrophobicContact CB-CD2 4.08Å; L67-L72 HydrophobicContact CB-CG 3.89Å; L67-L72 HydrophobicContact CD1-CD2 4.19Å; L67-I75 HydrophobicContact CD1-CD1 3.55Å; L67-K93 PolarHBondContact O-NZ 2.94Å
68	P	93.6	Very high	87.6	Confident	63 Å²	63	78.3 Å²	78.3	41%	0.409	42%	0.421	S	S	.	.			trans	-51.9	142.8	166.5	-25.8	33.2	0	0	0	111.7	E70 L71 L72	P68-E70 WeakPolarHBondContact CB-OE2 3.49Å; P68-E70 PolarHBondContact O-N 3.46Å; P68-E70 VanDerWaalsContact O-N 3.14Å; P68-L71 HydrophobicContact CG-CD1 4.41Å; P68-L71 PolarHBondContact O-N 3.26Å; P68-L71 VanDerWaalsContact O-N 3.13Å; P68-L72 PolarHBondContact O-N 3.45Å
69	P	93.1	Very high	89.2	Confident	66 Å²	66	75.6 Å²	75.6	43%	0.429	40%	0.4	S	S	.	.	H	α-helix	trans	-52.8	-34.2	179.4	-26.8	35.5	0	0	0	114	L72 V73	P69-L72 PolarHBondContact O-N 3.49Å; P69-V73 VanDerWaalsContact O-CG2 3.32Å; P69-V73 WeakPolarHBondContact O-CG2 3.4Å; P69-V73 PolarHBondContact O-N 3.21Å
70	E	94	Very high	90.6	Very high	136 Å²	136	72.7 Å²	72.7	64%	0.636	38%	0.381	S	S	*	.	H	α-helix	trans	-64.9	-41.8	-179.2	-55.5	77	-169.8	0	0	111.6	P68 L72 V73 E74	P68-E70 WeakPolarHBondContact CB-OE2 3.49Å; P68-E70 PolarHBondContact O-N 3.46Å; P68-E70 VanDerWaalsContact O-N 3.14Å; E70-L72 VanDerWaalsContact C-N 3.35Å; E70-V73 PolarHBondContact O-N 2.94Å; E70-E74 PolarHBondContact O-N 3.43Å
71	L	94.6	Very high	91.7	Very high	95 Å²	95	64.7 Å²	64.7	50%	0.497	34%	0.344	S	S	.	.	H	α-helix	trans	-68.8	-36.9	175.5	-66.2	-173.9	0	0	0	111.2	L67 P68 E74 I75	L67-L71 HydrophobicContact CD2-CD1 4.42Å; P68-L71 HydrophobicContact CG-CD1 4.41Å; P68-L71 PolarHBondContact O-N 3.26Å; P68-L71 VanDerWaalsContact O-N 3.13Å; L71-E74 PolarHBondContact O-N 3.16Å; L71-I75 WeakPolarHBondContact O-CB 3.45Å; L71-I75 WeakPolarHBondContact O-CD1 3.28Å; L71-I75 WeakPolarHBondContact O-CG1 3.13Å; L71-I75 PolarHBondContact O-N 3.45Å
72	L	95	Very high	92.7	Very high	0 Å²	0	64.5 Å²	64.5	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-66.4	-39.3	174.8	-69.8	170.8	0	0	0	112.1	L64 L67 P68 P69 E70 I75 F76 F94 I97	L64-L72 HydrophobicContact CD1-CD2 3.91Å; L64-L72 HydrophobicContact CG-CD2 3.97Å; L67-L72 HydrophobicContact CB-CD1 4.34Å; L67-L72 HydrophobicContact CB-CD2 4.08Å; L67-L72 HydrophobicContact CB-CG 3.89Å; L67-L72 HydrophobicContact CD1-CD2 4.19Å; P68-L72 PolarHBondContact O-N 3.45Å; P69-L72 PolarHBondContact O-N 3.49Å; E70-L72 VanDerWaalsContact C-N 3.35Å; L72-I75 PolarHBondContact O-N 3.31Å; L72-F76 HydrophobicContact CB-CE2 4.27Å; L72-F76 HydrophobicContact CB-CZ 4.48Å; L72-F76 HydrophobicContact CD2-CE1 4.45Å; L72-F76 HydrophobicContact CD2-CZ 4.1Å; L72-F76 WeakPolarHBondContact O-CB 3.33Å; L72-F76 WeakPolarHBondContact O-CD2 3.44Å; L72-F76 WeakPolarHBondContact O-CG 3.34Å; L72-F76 PolarHBondContact O-N 3.45Å; L72-F94 HydrophobicContact CD1-CE1 4.2Å; L72-F94 HydrophobicContact CD2-CE1 4.13Å; L72-I97 HydrophobicContact CB-CD1 3.78Å; L72-I97 HydrophobicContact CB-CG2 4.36Å; L72-I97 HydrophobicContact CD1-CD1 3.4Å; L72-I97 HydrophobicContact CG-CD1 4.22Å
73	V	94.6	Very high	93.4	Very high	28 Å²	28	57.7 Å²	57.7	17%	0.17	31%	0.312	C	S	.	.	H	α-helix	trans	-60	-45.9	172.4	168.4	0	0	0	0	110.3	P69 E70 S77 I97 T100 I103	P69-V73 VanDerWaalsContact O-CG2 3.32Å; P69-V73 WeakPolarHBondContact O-CG2 3.4Å; P69-V73 PolarHBondContact O-N 3.21Å; E70-V73 PolarHBondContact O-N 2.94Å; V73-S77 WeakPolarHBondContact O-CB 3.3Å; V73-S77 PolarHBondContact O-N 2.87Å; V73-S77 PolarHBondContact O-OG 2.8Å; V73-I97 HydrophobicContact CG2-CG2 3.76Å; V73-T100 HydrophobicContact CG1-CG2 4.46Å; V73-T100 HydrophobicContact CG2-CG2 4.33Å; V73-I103 HydrophobicContact CG1-CD1 4.31Å; V73-I103 HydrophobicContact CG1-CG1 3.92Å; V73-I103 HydrophobicContact CG2-CD1 4.35Å
74	E	95.4	Very high	93.7	Very high	94 Å²	94	55.5 Å²	55.5	44%	0.439	30%	0.297	S	S	.	.	H	α-helix	trans	-63.8	-46.6	178.1	-173.9	58.4	-154.9	0	0	111.4	E70 L71 F76 S77 L78 R106	E70-E74 PolarHBondContact O-N 3.43Å; L71-E74 PolarHBondContact O-N 3.16Å; E74-F76 PolarHBondContact O-N 3.13Å; E74-S77 WeakPolarHBondContact O-CB 3.35Å; E74-S77 PolarHBondContact O-N 3.25Å; E74-L78 WeakPolarHBondContact O-CG 3.38Å; E74-L78 PolarHBondContact O-N 3.36Å; E74-R106 IonicContact OE1-CZ 3.95Å; E74-R106 IonicContact OE1-NH1 2.85Å; E74-R106 PolarHBondContact OE1-NH1 3.47Å; E74-R106 IonicContact OE2-NH1 3.77Å
75	I	95.3	Very high	93.8	Very high	65 Å²	65	54.8 Å²	54.8	33%	0.333	30%	0.297	S	S	.	.	H	α-helix	trans	-59.1	-50.3	177.8	-68.4	163.5	0	0	0	110.8	L64 L67 L71 L72 S77 L78	L64-I75 HydrophobicContact CD1-CD1 4.17Å; L67-I75 HydrophobicContact CD1-CD1 3.55Å; L71-I75 WeakPolarHBondContact O-CB 3.45Å; L71-I75 WeakPolarHBondContact O-CD1 3.28Å; L71-I75 WeakPolarHBondContact O-CG1 3.13Å; L71-I75 PolarHBondContact O-N 3.45Å; L72-I75 PolarHBondContact O-N 3.31Å; I75-S77 VanDerWaalsContact C-N 3.27Å; I75-S77 PolarHBondContact O-N 3.04Å; I75-L78 WeakPolarHBondContact O-CB 3.41Å; I75-L78 PolarHBondContact O-N 2.68Å; I75-L78 VanDerWaalsContact O-N 3.1Å
76	F	94.6	Very high	94.1	Very high	5 Å²	5	56.3 Å²	56.3	2%	0.022	31%	0.307	C	S	.	.	H	α-helix	trans	-67.6	-30.7	-179.8	-62.3	-16.9	0	0	0	112.2	L72 E74 L78 L79 L84 V87 F94 I97 L98 I103	L72-F76 HydrophobicContact CB-CE2 4.27Å; L72-F76 HydrophobicContact CB-CZ 4.48Å; L72-F76 HydrophobicContact CD2-CE1 4.45Å; L72-F76 HydrophobicContact CD2-CZ 4.1Å; L72-F76 WeakPolarHBondContact O-CB 3.33Å; L72-F76 WeakPolarHBondContact O-CD2 3.44Å; L72-F76 WeakPolarHBondContact O-CG 3.34Å; L72-F76 PolarHBondContact O-N 3.45Å; E74-F76 PolarHBondContact O-N 3.13Å; F76-L78 PolarHBondContact O-N 2.8Å; F76-L79 HydrophobicContact CD1-CD1 4.09Å; F76-L79 PolarHBondContact O-N 2.84Å; F76-L79 VanDerWaalsContact O-N 3.17Å; F76-L84 HydrophobicContact CB-CD2 4.44Å; F76-L84 WeakPolarHBondContact O-CD2 3.33Å; F76-V87 HydrophobicContact CD1-CG1 4.01Å; F76-V87 HydrophobicContact CD2-CG1 4.35Å; F76-V87 HydrophobicContact CE1-CG1 3.65Å; F76-V87 HydrophobicContact CE2-CG1 4.01Å; F76-V87 HydrophobicContact CG-CG1 4.36Å; F76-V87 HydrophobicContact CZ-CG1 3.65Å; F76-F94 HydrophobicContact CE2-CB 4.21Å; F76-F94 HydrophobicContact CE2-CD1 4.01Å; F76-F94 HydrophobicContact CE2-CG 4.02Å; F76-F94 HydrophobicContact CZ-CB 4.28Å; F76-F94 AromaticContact CZ-CD1 3.66Å; F76-F94 HydrophobicContact CZ-CD1 3.66Å; F76-F94 AromaticContact CZ-CD2 3.8Å; F76-F94 HydrophobicContact CZ-CD2 3.8Å; F76-F94 AromaticContact CZ-CE1 3.84Å; F76-F94 HydrophobicContact CZ-CE1 3.84Å; F76-F94 AromaticContact CZ-CE2 3.99Å; F76-F94 HydrophobicContact CZ-CE2 3.99Å; F76-F94 AromaticContact CZ-CG 3.65Å; F76-F94 HydrophobicContact CZ-CG 3.65Å; F76-F94 HydrophobicContact CZ-CZ 4.02Å; F76-I97 HydrophobicContact CD2-CB 4.47Å; F76-I97 HydrophobicContact CD2-CG2 3.69Å; F76-I97 HydrophobicContact CE2-CB 4.25Å; F76-I97 HydrophobicContact CE2-CG2 3.85Å; F76-L98 HydrophobicContact CB-CD2 4.03Å; F76-L98 HydrophobicContact CD2-CD2 3.89Å; F76-L98 HydrophobicContact CD2-CG 4.12Å; F76-L98 HydrophobicContact CG-CD2 4.22Å; F76-I103 HydrophobicContact CB-CD1 4.23Å
77	S	92.8	Very high	94.3	Very high	5 Å²	5	52.1 Å²	52.1	4%	0.035	29%	0.289	C	S	.	.	H	α-helix	trans	-65.6	-15.3	173.4	-67	0	0	0	0	113.4	V73 E74 I75 I103 R106 R107	V73-S77 WeakPolarHBondContact O-CB 3.3Å; V73-S77 PolarHBondContact O-N 2.87Å; V73-S77 PolarHBondContact O-OG 2.8Å; E74-S77 WeakPolarHBondContact O-CB 3.35Å; E74-S77 PolarHBondContact O-N 3.25Å; I75-S77 VanDerWaalsContact C-N 3.27Å; I75-S77 PolarHBondContact O-N 3.04Å; S77-I103 WeakPolarHBondContact OG-CG1 3.33Å; S77-R106 WeakPolarHBondContact O-CD 3.49Å; S77-R107 VanDerWaalsContact O-CZ 3.27Å; S77-R107 PolarHBondContact O-NE 3.25Å; S77-R107 PolarHBondContact O-NH2 3.02Å
78	L	94.3	Very high	94.3	Very high	89 Å²	89	51.9 Å²	51.9	47%	0.466	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-9.8	175.8	-63.4	170.2	0	0	0	113.4	E74 I75 F76	E74-L78 WeakPolarHBondContact O-CG 3.38Å; E74-L78 PolarHBondContact O-N 3.36Å; I75-L78 WeakPolarHBondContact O-CB 3.41Å; I75-L78 PolarHBondContact O-N 2.68Å; I75-L78 VanDerWaalsContact O-N 3.1Å; F76-L78 PolarHBondContact O-N 2.8Å
79	L	94.9	Very high	94.4	Very high	56 Å²	56	55.9 Å²	55.9	29%	0.293	31%	0.308	S	S	.	.	S	Bend	trans	-83.7	149.4	179.9	-62.6	177.3	0	0	0	110.9	F76 V83 L84 V87 R107	F76-L79 HydrophobicContact CD1-CD1 4.09Å; F76-L79 PolarHBondContact O-N 2.84Å; F76-L79 VanDerWaalsContact O-N 3.17Å; L79-V83 HydrophobicContact CB-CG2 3.72Å; L79-V83 HydrophobicContact CD1-CG2 4.34Å; L79-V83 HydrophobicContact CG-CG2 4.44Å; L79-L84 HydrophobicContact CB-CD2 3.92Å; L79-L84 HydrophobicContact CD1-CD2 4.34Å; L79-V87 HydrophobicContact CD1-CG2 3.91Å; L79-R107 WeakPolarHBondContact O-CD 3.44Å; L79-R107 PolarHBondContact O-NE 3.33Å; L79-R107 PolarHBondContact O-NH1 3.06Å
80	P	95.3	Very high	94.6	Very high	63 Å²	63	57.5 Å²	57.5	41%	0.409	32%	0.317	S	S	.	.			trans	-55	140.8	168.7	-24.9	33.9	0	0	0	111.9	T82 V83 E111	P80-T82 PolarHBondContact O-N 2.92Å; P80-T82 VanDerWaalsContact O-N 3.1Å; P80-V83 HydrophobicContact CB-CG2 4.44Å; P80-V83 WeakPolarHBondContact O-CG2 3.23Å; P80-V83 PolarHBondContact O-N 3.23Å; P80-E111 WeakPolarHBondContact CA-OE1 3.46Å
81	G	93	Very high	94.6	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-25.7	179.5	0	0	0	0	0	113.1	V83 L84 P85 E111 Y161	G81-V83 VanDerWaalsContact C-N 3.32Å; G81-V83 PolarHBondContact O-N 3.01Å; G81-L84 PolarHBondContact O-N 3.46Å; G81-P85 WeakPolarHBondContact O-CD 3.36Å; G81-E111 PolarHBondContact N-OE1 3.05Å; G81-Y161 VanDerWaalsContact C-OH 3.26Å; G81-Y161 VanDerWaalsContact CA-OH 3.23Å; G81-Y161 WeakPolarHBondContact CA-OH 3.38Å
82	T	93.9	Very high	94.7	Very high	64 Å²	64	57.4 Å²	57.4	39%	0.393	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-27.9	176.1	53.5	0	0	0	0	113.9	P80 P85 Y161	P80-T82 PolarHBondContact O-N 2.92Å; P80-T82 VanDerWaalsContact O-N 3.1Å; T82-P85 WeakPolarHBondContact O-CD 3.44Å; T82-Y161 PolarHBondContact N-OH 3.13Å
83	V	95.6	Very high	94.7	Very high	41 Å²	41	60.4 Å²	60.4	25%	0.248	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-16.5	-179.8	-55.1	0	0	0	0	113	L79 P80 G81 P85 N86 V87	L79-V83 HydrophobicContact CB-CG2 3.72Å; L79-V83 HydrophobicContact CD1-CG2 4.34Å; L79-V83 HydrophobicContact CG-CG2 4.44Å; P80-V83 HydrophobicContact CB-CG2 4.44Å; P80-V83 WeakPolarHBondContact O-CG2 3.23Å; P80-V83 PolarHBondContact O-N 3.23Å; G81-V83 VanDerWaalsContact C-N 3.32Å; G81-V83 PolarHBondContact O-N 3.01Å; V83-P85 VanDerWaalsContact C-CD 3.46Å; V83-N86 WeakPolarHBondContact O-CB 3.42Å; V83-N86 PolarHBondContact O-N 3.23Å; V83-V87 PolarHBondContact O-N 2.74Å
84	L	94.3	Very high	94.7	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-57.6	-37.5	179.9	-59.3	-176.5	0	0	0	113.8	F76 L79 G81 N86 V87 A88 L98 I103 W104 R107	F76-L84 HydrophobicContact CB-CD2 4.44Å; F76-L84 WeakPolarHBondContact O-CD2 3.33Å; L79-L84 HydrophobicContact CB-CD2 3.92Å; L79-L84 HydrophobicContact CD1-CD2 4.34Å; G81-L84 PolarHBondContact O-N 3.46Å; L84-N86 VanDerWaalsContact C-N 3.28Å; L84-N86 PolarHBondContact O-N 3.27Å; L84-V87 PolarHBondContact O-N 3.43Å; L84-A88 PolarHBondContact O-N 3.37Å; L84-L98 HydrophobicContact CB-CD2 4.26Å; L84-L98 HydrophobicContact CD1-CD2 4.43Å; L84-L98 HydrophobicContact CD2-CD2 3.91Å; L84-L98 HydrophobicContact CG-CD2 4.43Å; L84-L98 VanDerWaalsContact O-CD1 3.26Å; L84-L98 WeakPolarHBondContact O-CD1 3.28Å; L84-I103 HydrophobicContact CD1-CG2 3.78Å; L84-W104 HydrophobicContact CB-CH2 3.93Å; L84-W104 HydrophobicContact CB-CZ2 4.17Å; L84-W104 HydrophobicContact CD1-CD2 4.49Å; L84-W104 HydrophobicContact CD1-CE3 4.37Å; L84-W104 HydrophobicContact CD1-CH2 4Å; L84-W104 HydrophobicContact CD1-CZ2 4.12Å; L84-W104 HydrophobicContact CD1-CZ3 4.12Å; L84-R107 HydrophobicContact CD1-CG 3.93Å
85	P	93.6	Very high	94.6	Very high	68 Å²	68	63.2 Å²	63.2	44%	0.442	33%	0.331	S	S	.	.	H	α-helix	trans	-56.6	-40.3	172	-27	36.1	0	0	0	113	G81 T82 V83 A88 L89	G81-P85 WeakPolarHBondContact O-CD 3.36Å; T82-P85 WeakPolarHBondContact O-CD 3.44Å; V83-P85 VanDerWaalsContact C-CD 3.46Å; P85-A88 WeakPolarHBondContact O-CB 3.44Å; P85-A88 PolarHBondContact O-N 2.68Å; P85-L89 WeakPolarHBondContact O-CG 3.44Å; P85-L89 PolarHBondContact O-N 3.13Å
86	N	95	Very high	94.6	Very high	107 Å²	107	67 Å²	67	57%	0.572	35%	0.347	S	S	*	.	H	α-helix	trans	-67.2	-41.4	177.8	-65.7	-22.9	0	0	0	111.2	V83 L84 A88 L89 V90	V83-N86 WeakPolarHBondContact O-CB 3.42Å; V83-N86 PolarHBondContact O-N 3.23Å; L84-N86 VanDerWaalsContact C-N 3.28Å; L84-N86 PolarHBondContact O-N 3.27Å; N86-A88 VanDerWaalsContact C-N 3.27Å; N86-A88 PolarHBondContact O-N 3.09Å; N86-L89 WeakPolarHBondContact O-CB 3.42Å; N86-L89 PolarHBondContact O-N 3.34Å; N86-V90 PolarHBondContact O-N 3.45Å
87	V	94.8	Very high	94.5	Very high	22 Å²	22	67.4 Å²	67.4	13%	0.133	35%	0.35	C	S	.	.	H	α-helix	trans	-60.7	-38.3	174.3	179.5	0	0	0	0	111.1	F76 L79 V83 L84 L89 V90 F94 L98	F76-V87 HydrophobicContact CD1-CG1 4.01Å; F76-V87 HydrophobicContact CD2-CG1 4.35Å; F76-V87 HydrophobicContact CE1-CG1 3.65Å; F76-V87 HydrophobicContact CE2-CG1 4.01Å; F76-V87 HydrophobicContact CG-CG1 4.36Å; F76-V87 HydrophobicContact CZ-CG1 3.65Å; L79-V87 HydrophobicContact CD1-CG2 3.91Å; V83-V87 PolarHBondContact O-N 2.74Å; L84-V87 PolarHBondContact O-N 3.43Å; V87-L89 PolarHBondContact O-N 3.04Å; V87-V90 WeakPolarHBondContact O-CB 3.46Å; V87-V90 PolarHBondContact O-N 2.81Å; V87-F94 HydrophobicContact CG1-CB 4.26Å; V87-F94 HydrophobicContact CG1-CD2 3.88Å; V87-F94 HydrophobicContact CG1-CG 4.36Å; V87-F94 WeakPolarHBondContact O-CB 3.26Å; V87-L98 HydrophobicContact CB-CD1 3.89Å; V87-L98 HydrophobicContact CG1-CD1 3.84Å
88	A	93.4	Very high	94.6	Very high	23 Å²	23	67.3 Å²	67.3	19%	0.19	35%	0.349	C	S	.	.	H	α-helix	trans	-64.9	-23.9	176.3	0	0	0	0	0	113.4	L84 P85 N86 R95 L98	L84-A88 PolarHBondContact O-N 3.37Å; P85-A88 WeakPolarHBondContact O-CB 3.44Å; P85-A88 PolarHBondContact O-N 2.68Å; N86-A88 VanDerWaalsContact C-N 3.27Å; N86-A88 PolarHBondContact O-N 3.09Å; A88-R95 WeakPolarHBondContact O-CB 3.39Å; A88-L98 HydrophobicContact CB-CD1 3.6Å; A88-L98 VanDerWaalsContact N-CD1 3.31Å
89	L	95.4	Very high	94.3	Very high	147 Å²	147	67.8 Å²	67.8	77%	0.77	35%	0.352	S	S	*	.	H	α-helix	trans	-83	-14.9	178.3	-65.9	173.3	0	0	0	113.3	P85 N86 V87	P85-L89 WeakPolarHBondContact O-CG 3.44Å; P85-L89 PolarHBondContact O-N 3.13Å; N86-L89 WeakPolarHBondContact O-CB 3.42Å; N86-L89 PolarHBondContact O-N 3.34Å; V87-L89 PolarHBondContact O-N 3.04Å
90	V	96.5	Very high	94.1	Very high	99 Å²	99	67.5 Å²	67.5	60%	0.6	35%	0.352	S	S	*	.	H	α-helix	trans	-64.8	-48.3	-176.8	176.6	0	0	0	0	112	N86 V87 F94	N86-V90 PolarHBondContact O-N 3.45Å; V87-V90 WeakPolarHBondContact O-CB 3.46Å; V87-V90 PolarHBondContact O-N 2.81Å; V90-F94 HydrophobicContact CB-CD2 3.83Å; V90-F94 HydrophobicContact CB-CE2 4.34Å; V90-F94 HydrophobicContact CG1-CD2 3.92Å; V90-F94 HydrophobicContact CG1-CE2 3.97Å; V90-F94 HydrophobicContact CG2-CD2 4.4Å
91	C	95.2	Very high	93.6	Very high	36 Å²	36	67.5 Å²	67.5	24%	0.243	35%	0.347	C	S	.	.			trans	-162.6	168.4	179.6	72.1	0	0	0	0	113.1	M65 K93 F94 R95	M65-C91 HydrophobicContact CE-CB 4.3Å; M65-C91 WeakPolarHBondContact CE-SG 3.09Å; M65-C91 PolarHBondContact SD-SG 2.77Å; C91-K93 VanDerWaalsContact C-N 3.33Å; C91-K93 PolarHBondContact O-N 2.92Å; C91-F94 PolarHBondContact O-N 2.76Å; C91-F94 VanDerWaalsContact SG-CG 3.56Å; C91-F94 PolarHBondContact SG-N 2.76Å; C91-R95 PolarHBondContact O-N 2.96Å
92	K	95.5	Very high	93.4	Very high	193 Å²	193	70.6 Å²	70.6	84%	0.839	37%	0.366	S	S	*	.	H	α-helix	trans	-59.1	-39.7	177.5	-66.2	-177.9	-178.6	177.4	0	113	R95 Q96	K92-R95 PolarHBondContact O-N 2.86Å; K92-Q96 WeakPolarHBondContact O-CB 3.1Å; K92-Q96 PolarHBondContact O-N 3.25Å
93	K	94.8	Very high	93.3	Very high	63 Å²	63	67.5 Å²	67.5	27%	0.274	35%	0.347	S	S	.	.	H	α-helix	trans	-62	-48.5	179.3	-174.1	178.3	174.4	-179.9	0	110.7	M65 L67 C91 Q96 I97	M65-K93 HydrophobicContact CE-CB 3.75Å; M65-K93 HydrophobicContact CE-CD 3.95Å; M65-K93 HydrophobicContact CE-CG 4.4Å; M65-K93 PolarHBondContact O-NZ 2.82Å; L67-K93 PolarHBondContact O-NZ 2.94Å; C91-K93 VanDerWaalsContact C-N 3.33Å; C91-K93 PolarHBondContact O-N 2.92Å; K93-Q96 PolarHBondContact O-N 2.81Å; K93-I97 HydrophobicContact CG-CD1 3.9Å; K93-I97 VanDerWaalsContact O-CG1 3.3Å; K93-I97 WeakPolarHBondContact O-CG1 3.49Å; K93-I97 PolarHBondContact O-N 2.7Å
94	F	95.4	Very high	93.1	Very high	10 Å²	10	66 Å²	66	4%	0.044	34%	0.337	C	S	.	.	H	α-helix	trans	-66.9	-41.1	-179.7	-70	2.3	0	0	0	111.9	L64 M65 L72 F76 V87 V90 C91 Q96 I97 L98	L64-F94 HydrophobicContact CD2-CE2 4.05Å; L64-F94 HydrophobicContact CD2-CZ 3.7Å; L64-F94 HydrophobicContact CG-CZ 3.93Å; M65-F94 HydrophobicContact CG-CZ 4.38Å; M65-F94 HydrophobicContact SD-CD1 3.85Å; M65-F94 HydrophobicContact SD-CE1 3.23Å; M65-F94 WeakPolarHBondContact SD-CE1 3.39Å; M65-F94 HydrophobicContact SD-CE2 4.19Å; M65-F94 HydrophobicContact SD-CZ 3.42Å; M65-F94 WeakPolarHBondContact SD-CZ 3.39Å; L72-F94 HydrophobicContact CD1-CE1 4.2Å; L72-F94 HydrophobicContact CD2-CE1 4.13Å; F76-F94 HydrophobicContact CE2-CB 4.21Å; F76-F94 HydrophobicContact CE2-CD1 4.01Å; F76-F94 HydrophobicContact CE2-CG 4.02Å; F76-F94 HydrophobicContact CZ-CB 4.28Å; F76-F94 AromaticContact CZ-CD1 3.66Å; F76-F94 HydrophobicContact CZ-CD1 3.66Å; F76-F94 AromaticContact CZ-CD2 3.8Å; F76-F94 HydrophobicContact CZ-CD2 3.8Å; F76-F94 AromaticContact CZ-CE1 3.84Å; F76-F94 HydrophobicContact CZ-CE1 3.84Å; F76-F94 AromaticContact CZ-CE2 3.99Å; F76-F94 HydrophobicContact CZ-CE2 3.99Å; F76-F94 AromaticContact CZ-CG 3.65Å; F76-F94 HydrophobicContact CZ-CG 3.65Å; F76-F94 HydrophobicContact CZ-CZ 4.02Å; V87-F94 HydrophobicContact CG1-CB 4.26Å; V87-F94 HydrophobicContact CG1-CD2 3.88Å; V87-F94 HydrophobicContact CG1-CG 4.36Å; V87-F94 WeakPolarHBondContact O-CB 3.26Å; V90-F94 HydrophobicContact CB-CD2 3.83Å; V90-F94 HydrophobicContact CB-CE2 4.34Å; V90-F94 HydrophobicContact CG1-CD2 3.92Å; V90-F94 HydrophobicContact CG1-CE2 3.97Å; V90-F94 HydrophobicContact CG2-CD2 4.4Å; C91-F94 PolarHBondContact O-N 2.76Å; C91-F94 VanDerWaalsContact SG-CG 3.56Å; C91-F94 PolarHBondContact SG-N 2.76Å; F94-Q96 VanDerWaalsContact C-N 3.29Å; F94-Q96 PolarHBondContact O-N 3.25Å; F94-I97 PolarHBondContact O-N 3.19Å; F94-L98 WeakPolarHBondContact O-CB 3.4Å; F94-L98 WeakPolarHBondContact O-CG 3.49Å; F94-L98 PolarHBondContact O-N 3.23Å
95	R	93.8	Very high	92.8	Very high	171 Å²	171	69.6 Å²	69.6	65%	0.645	35%	0.35	S	S	*	.	H	α-helix	trans	-56.4	-43.5	172.5	-172.3	174.4	173.2	176.2	-1.8	112.3	A88 C91 K92 L98 N99	A88-R95 WeakPolarHBondContact O-CB 3.39Å; C91-R95 PolarHBondContact O-N 2.96Å; K92-R95 PolarHBondContact O-N 2.86Å; R95-L98 PolarHBondContact O-N 2.75Å; R95-N99 PolarHBondContact O-N 3.28Å
96	Q	94.2	Very high	92.7	Very high	145 Å²	145	69.8 Å²	69.8	68%	0.678	34%	0.342	S	S	*	.	H	α-helix	trans	-67	-43	178	-174.4	177.8	-0.7	0	0	111.7	K92 K93 F94 L98 N99	K92-Q96 WeakPolarHBondContact O-CB 3.1Å; K92-Q96 PolarHBondContact O-N 3.25Å; K93-Q96 PolarHBondContact O-N 2.81Å; F94-Q96 VanDerWaalsContact C-N 3.29Å; F94-Q96 PolarHBondContact O-N 3.25Å; Q96-L98 VanDerWaalsContact C-N 3.3Å; Q96-L98 PolarHBondContact O-N 3.14Å; Q96-N99 WeakPolarHBondContact O-CB 3.16Å; Q96-N99 PolarHBondContact O-N 2.81Å
97	I	93.6	Very high	92.6	Very high	13 Å²	13	65.2 Å²	65.2	7%	0.067	32%	0.317	C	S	.	.	H	α-helix	trans	-62.1	-39.3	177	-69	167.9	0	0	0	111	L72 V73 F76 K93 F94 N99 T100 I103	L72-I97 HydrophobicContact CB-CD1 3.78Å; L72-I97 HydrophobicContact CB-CG2 4.36Å; L72-I97 HydrophobicContact CD1-CD1 3.4Å; L72-I97 HydrophobicContact CG-CD1 4.22Å; V73-I97 HydrophobicContact CG2-CG2 3.76Å; F76-I97 HydrophobicContact CD2-CB 4.47Å; F76-I97 HydrophobicContact CD2-CG2 3.69Å; F76-I97 HydrophobicContact CE2-CB 4.25Å; F76-I97 HydrophobicContact CE2-CG2 3.85Å; K93-I97 HydrophobicContact CG-CD1 3.9Å; K93-I97 VanDerWaalsContact O-CG1 3.3Å; K93-I97 WeakPolarHBondContact O-CG1 3.49Å; K93-I97 PolarHBondContact O-N 2.7Å; F94-I97 PolarHBondContact O-N 3.19Å; I97-N99 PolarHBondContact O-N 3.41Å; I97-T100 WeakPolarHBondContact O-CB 3.34Å; I97-T100 PolarHBondContact O-N 3.23Å; I97-T100 PolarHBondContact O-OG1 3.25Å; I97-I103 HydrophobicContact CG2-CD1 4.33Å
98	L	93.5	Very high	92.4	Very high	4 Å²	4	64.1 Å²	64.1	2%	0.021	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-4.9	179.2	-71.9	171.2	0	0	0	114.6	F76 L84 V87 A88 F94 R95 Q96 T100 I103 W104	F76-L98 HydrophobicContact CB-CD2 4.03Å; F76-L98 HydrophobicContact CD2-CD2 3.89Å; F76-L98 HydrophobicContact CD2-CG 4.12Å; F76-L98 HydrophobicContact CG-CD2 4.22Å; L84-L98 HydrophobicContact CB-CD2 4.26Å; L84-L98 HydrophobicContact CD1-CD2 4.43Å; L84-L98 HydrophobicContact CD2-CD2 3.91Å; L84-L98 HydrophobicContact CG-CD2 4.43Å; L84-L98 VanDerWaalsContact O-CD1 3.26Å; L84-L98 WeakPolarHBondContact O-CD1 3.28Å; V87-L98 HydrophobicContact CB-CD1 3.89Å; V87-L98 HydrophobicContact CG1-CD1 3.84Å; A88-L98 HydrophobicContact CB-CD1 3.6Å; A88-L98 VanDerWaalsContact N-CD1 3.31Å; F94-L98 WeakPolarHBondContact O-CB 3.4Å; F94-L98 WeakPolarHBondContact O-CG 3.49Å; F94-L98 PolarHBondContact O-N 3.23Å; R95-L98 PolarHBondContact O-N 2.75Å; Q96-L98 VanDerWaalsContact C-N 3.3Å; Q96-L98 PolarHBondContact O-N 3.14Å; L98-T100 PolarHBondContact O-N 2.66Å; L98-I103 HydrophobicContact CD2-CD1 4.06Å; L98-I103 HydrophobicContact CD2-CG2 4.39Å; L98-W104 PolarHBondContact O-NE1 2.89Å
99	N	89.1	Confident	92.2	Very high	98 Å²	98	66.2 Å²	66.2	52%	0.524	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-4	165.2	-65.9	-25.8	0	0	0	112.2	R95 Q96 I97 E101	R95-N99 PolarHBondContact O-N 3.28Å; Q96-N99 WeakPolarHBondContact O-CB 3.16Å; Q96-N99 PolarHBondContact O-N 2.81Å; I97-N99 PolarHBondContact O-N 3.41Å; N99-E101 PolarHBondContact O-N 2.85Å
100	T	89.6	Confident	92	Very high	50 Å²	50	64 Å²	64	31%	0.307	31%	0.306	S	S	.	.			trans	-69.4	116.9	177.1	-52.3	0	0	0	0	110.3	V73 I97 L98 T102 I103	V73-T100 HydrophobicContact CG1-CG2 4.46Å; V73-T100 HydrophobicContact CG2-CG2 4.33Å; I97-T100 WeakPolarHBondContact O-CB 3.34Å; I97-T100 PolarHBondContact O-N 3.23Å; I97-T100 PolarHBondContact O-OG1 3.25Å; L98-T100 PolarHBondContact O-N 2.66Å; T100-T102 VanDerWaalsContact C-N 3.28Å; T100-T102 VanDerWaalsContact CG2-OG1 3.28Å; T100-T102 WeakPolarHBondContact CG2-OG1 3.19Å; T100-T102 PolarHBondContact O-N 2.69Å; T100-I103 WeakPolarHBondContact O-CB 3.45Å; T100-I103 PolarHBondContact O-N 2.74Å
101	E	85.4	Confident	91.8	Very high	64 Å²	64	61.3 Å²	61.3	30%	0.299	29%	0.287	S	S	.	.	H	α-helix	trans	-58.6	-35.4	-176.3	-170.3	-154.8	125.1	0	0	113.4	N99 I103 W104 R105 R119 Y157	N99-E101 PolarHBondContact O-N 2.85Å; E101-I103 PolarHBondContact O-N 3.21Å; E101-W104 PolarHBondContact O-N 2.87Å; E101-W104 VanDerWaalsContact O-N 3.15Å; E101-R105 WeakPolarHBondContact O-CB 3.45Å; E101-R105 PolarHBondContact O-N 3.24Å; E101-R119 IonicContact OE1-CZ 2.71Å; E101-R119 IonicContact OE1-NE 3.77Å; E101-R119 PolarHBondContact OE1-NE 2.87Å; E101-R119 IonicContact OE1-NH2 3.67Å; E101-R119 PolarHBondContact OE1-NH2 2.7Å; E101-R119 IonicContact OE2-NE 2.99Å; E101-R119 IonicContact OE2-NH2 3.78Å; E101-Y157 HydrophobicContact CG-CD2 3.6Å; E101-Y157 HydrophobicContact CG-CE2 4.41Å; E101-Y157 HydrophobicContact CG-CG 4.46Å; E101-Y157 VanDerWaalsContact OE1-CD2 3.25Å; E101-Y157 WeakPolarHBondContact OE1-CD2 3.44Å; E101-Y157 WeakPolarHBondContact OE1-CE2 3.47Å
102	T	88.4	Confident	91.6	Very high	64 Å²	64	60.3 Å²	60.3	39%	0.393	28%	0.279	S	S	.	.	H	α-helix	trans	-61.3	-30.5	-177.7	54	0	0	0	0	113	T100 R106	T100-T102 VanDerWaalsContact C-N 3.28Å; T100-T102 VanDerWaalsContact CG2-OG1 3.28Å; T100-T102 WeakPolarHBondContact CG2-OG1 3.19Å; T100-T102 PolarHBondContact O-N 2.69Å; T102-R106 WeakPolarHBondContact O-CB 3.48Å; T102-R106 PolarHBondContact O-N 2.83Å; T102-R106 VanDerWaalsContact O-N 3.1Å
103	I	91.7	Very high	91.3	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-61.9	-56.5	174.5	-58.8	176.6	0	0	0	108.8	V73 F76 S77 L84 I97 L98 T100 E101 R105 R106 R107	V73-I103 HydrophobicContact CG1-CD1 4.31Å; V73-I103 HydrophobicContact CG1-CG1 3.92Å; V73-I103 HydrophobicContact CG2-CD1 4.35Å; F76-I103 HydrophobicContact CB-CD1 4.23Å; S77-I103 WeakPolarHBondContact OG-CG1 3.33Å; L84-I103 HydrophobicContact CD1-CG2 3.78Å; I97-I103 HydrophobicContact CG2-CD1 4.33Å; L98-I103 HydrophobicContact CD2-CD1 4.06Å; L98-I103 HydrophobicContact CD2-CG2 4.39Å; T100-I103 WeakPolarHBondContact O-CB 3.45Å; T100-I103 PolarHBondContact O-N 2.74Å; E101-I103 PolarHBondContact O-N 3.21Å; I103-R105 PolarHBondContact O-N 2.77Å; I103-R106 WeakPolarHBondContact O-CB 3.16Å; I103-R106 PolarHBondContact O-N 2.84Å; I103-R106 VanDerWaalsContact O-N 3.15Å; I103-R107 WeakPolarHBondContact O-CG 3.42Å; I103-R107 PolarHBondContact O-N 2.98Å; I103-R107 VanDerWaalsContact O-N 3.08Å
104	W	91.1	Very high	90.9	Very high	9 Å²	9	50.1 Å²	50.1	3%	0.034	25%	0.246	C	C	.	.	H	α-helix	trans	-66.3	-37	-177.6	-64.1	97.1	0	0	0	112.7	L84 L98 E101 R106 R107 C108 R158 Y161	L84-W104 HydrophobicContact CB-CH2 3.93Å; L84-W104 HydrophobicContact CB-CZ2 4.17Å; L84-W104 HydrophobicContact CD1-CD2 4.49Å; L84-W104 HydrophobicContact CD1-CE3 4.37Å; L84-W104 HydrophobicContact CD1-CH2 4Å; L84-W104 HydrophobicContact CD1-CZ2 4.12Å; L84-W104 HydrophobicContact CD1-CZ3 4.12Å; L98-W104 PolarHBondContact O-NE1 2.89Å; E101-W104 PolarHBondContact O-N 2.87Å; E101-W104 VanDerWaalsContact O-N 3.15Å; W104-R106 VanDerWaalsContact C-N 3.29Å; W104-R106 PolarHBondContact O-N 2.84Å; W104-R107 PolarHBondContact O-N 3.43Å; W104-C108 PolarHBondContact O-N 2.69Å; W104-C108 PolarHBondContact O-SG 2.9Å; W104-R158 HydrophobicContact CB-CB 4.24Å; W104-R158 HydrophobicContact CD2-CB 3.8Å; W104-R158 HydrophobicContact CD2-CG 3.79Å; W104-R158 HydrophobicContact CE3-CB 4.48Å; W104-R158 HydrophobicContact CE3-CG 4.31Å; W104-R158 HydrophobicContact CG-CB 3.63Å; W104-R158 HydrophobicContact CG-CG 4.15Å; W104-R158 HydrophobicContact CH2-CG 4.44Å; W104-R158 HydrophobicContact CZ2-CG 3.93Å; W104-Y161 AromaticContact CE3-CD1 3.97Å; W104-Y161 HydrophobicContact CE3-CD1 3.97Å; W104-Y161 HydrophobicContact CE3-CD2 4.26Å; W104-Y161 AromaticContact CE3-CG 3.76Å; W104-Y161 HydrophobicContact CE3-CG 3.76Å; W104-Y161 AromaticContact CZ3-CD1 3.55Å; W104-Y161 HydrophobicContact CZ3-CD1 3.55Å; W104-Y161 HydrophobicContact CZ3-CE1 4.01Å; W104-Y161 AromaticContact CZ3-CG 3.86Å; W104-Y161 HydrophobicContact CZ3-CG 3.86Å
105	R	89.2	Confident	89.8	Confident	75 Å²	75	60.3 Å²	60.3	28%	0.283	28%	0.284	S	S	.	.	H	α-helix	trans	-54.8	-48	171.4	176.7	174.9	178.3	-179.3	6.4	111.2	E101 I103 R107 C108 V109 D117 Y157	E101-R105 WeakPolarHBondContact O-CB 3.45Å; E101-R105 PolarHBondContact O-N 3.24Å; I103-R105 PolarHBondContact O-N 2.77Å; R105-R107 VanDerWaalsContact C-N 3.34Å; R105-R107 PolarHBondContact O-N 3.03Å; R105-C108 PolarHBondContact O-N 3.44Å; R105-V109 VanDerWaalsContact O-CG2 3.23Å; R105-V109 WeakPolarHBondContact O-CG2 3.41Å; R105-V109 PolarHBondContact O-N 2.82Å; R105-D117 IonicContact CZ-OD1 3.61Å; R105-D117 IonicContact CZ-OD2 2.77Å; R105-D117 IonicContact NH1-OD1 3.72Å; R105-D117 IonicContact NH1-OD2 2.62Å; R105-D117 PolarHBondContact NH1-OD2 3.13Å; R105-D117 IonicContact NH2-OD1 3.94Å; R105-D117 IonicContact NH2-OD2 2.79Å; R105-D117 PolarHBondContact NH2-OD2 3.44Å; R105-Y157 VanDerWaalsContact CA-CD1 3.45Å; R105-Y157 HydrophobicContact CB-CD1 3.78Å; R105-Y157 HydrophobicContact CB-CD2 3.79Å; R105-Y157 HydrophobicContact CB-CE1 3.9Å; R105-Y157 HydrophobicContact CB-CE2 3.93Å; R105-Y157 HydrophobicContact CB-CG 3.7Å; R105-Y157 HydrophobicContact CG-CD1 4.03Å; R105-Y157 HydrophobicContact CG-CD2 4.32Å; R105-Y157 HydrophobicContact CG-CE1 3.62Å; R105-Y157 HydrophobicContact CG-CE2 3.95Å; R105-Y157 HydrophobicContact CG-CG 4.35Å
106	R	90.8	Very high	88.5	Confident	72 Å²	72	53.8 Å²	53.8	27%	0.272	26%	0.261	S	S	.	.	H	α-helix	trans	-62.1	-42	178.5	-168.2	178.5	-178.3	169.2	-3	111.4	E74 S77 T102 I103 W104 V109 E110	E74-R106 IonicContact OE1-CZ 3.95Å; E74-R106 IonicContact OE1-NH1 2.85Å; E74-R106 PolarHBondContact OE1-NH1 3.47Å; E74-R106 IonicContact OE2-NH1 3.77Å; S77-R106 WeakPolarHBondContact O-CD 3.49Å; T102-R106 WeakPolarHBondContact O-CB 3.48Å; T102-R106 PolarHBondContact O-N 2.83Å; T102-R106 VanDerWaalsContact O-N 3.1Å; I103-R106 WeakPolarHBondContact O-CB 3.16Å; I103-R106 PolarHBondContact O-N 2.84Å; I103-R106 VanDerWaalsContact O-N 3.15Å; W104-R106 VanDerWaalsContact C-N 3.29Å; W104-R106 PolarHBondContact O-N 2.84Å; R106-V109 PolarHBondContact O-N 3.48Å; R106-E110 HydrophobicContact CG-CG 4.15Å; R106-E110 WeakPolarHBondContact CG-OE1 3.17Å; R106-E110 IonicContact CZ-OE1 3.5Å; R106-E110 IonicContact NE-OE1 2.82Å; R106-E110 PolarHBondContact NE-OE1 2.89Å; R106-E110 IonicContact NH2-OE1 3.33Å; R106-E110 WeakPolarHBondContact O-CB 3.18Å; R106-E110 WeakPolarHBondContact O-CG 3.36Å; R106-E110 PolarHBondContact O-N 3.49Å
107	R	93.1	Very high	87.2	Confident	11 Å²	11	48 Å²	48	4%	0.042	24%	0.235	C	C	.	.	H	α-helix	trans	-62.2	-46.9	175.9	-56.1	-62.8	83.5	-137.8	6.3	112.1	S77 L79 L84 I103 W104 R105 V109 E110 E111 Y161	S77-R107 VanDerWaalsContact O-CZ 3.27Å; S77-R107 PolarHBondContact O-NE 3.25Å; S77-R107 PolarHBondContact O-NH2 3.02Å; L79-R107 WeakPolarHBondContact O-CD 3.44Å; L79-R107 PolarHBondContact O-NE 3.33Å; L79-R107 PolarHBondContact O-NH1 3.06Å; L84-R107 HydrophobicContact CD1-CG 3.93Å; I103-R107 WeakPolarHBondContact O-CG 3.42Å; I103-R107 PolarHBondContact O-N 2.98Å; I103-R107 VanDerWaalsContact O-N 3.08Å; W104-R107 PolarHBondContact O-N 3.43Å; R105-R107 VanDerWaalsContact C-N 3.34Å; R105-R107 PolarHBondContact O-N 3.03Å; R107-V109 VanDerWaalsContact C-N 3.28Å; R107-V109 PolarHBondContact O-N 2.88Å; R107-E110 IonicContact CZ-OE2 3.92Å; R107-E110 IonicContact NH1-OE2 2.84Å; R107-E110 IonicContact NH2-OE1 3.95Å; R107-E110 IonicContact NH2-OE2 3.99Å; R107-E110 PolarHBondContact NH2-OE2 2.86Å; R107-E110 PolarHBondContact O-N 3.1Å; R107-E111 WeakPolarHBondContact CD-OE1 3.25Å; R107-E111 IonicContact CZ-OE1 2.74Å; R107-E111 IonicContact NE-OE1 2.69Å; R107-E111 IonicContact NH1-OE1 3.11Å; R107-E111 PolarHBondContact NH1-OE1 2.75Å; R107-E111 VanDerWaalsContact O-CB 3.28Å; R107-E111 WeakPolarHBondContact O-CB 3.3Å; R107-E111 PolarHBondContact O-N 3.14Å; R107-Y161 HydrophobicContact CB-CD2 3.96Å; R107-Y161 HydrophobicContact CB-CE2 3.8Å
108	C	91	Very high	85.8	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-59.3	-38.3	176.7	-63.1	0	0	0	0	112.5	W104 R105 F112 G113 M114 Y157 L165	W104-C108 PolarHBondContact O-N 2.69Å; W104-C108 PolarHBondContact O-SG 2.9Å; R105-C108 PolarHBondContact O-N 3.44Å; C108-F112 CarbonylContact O-C 3.46Å; C108-F112 WeakPolarHBondContact O-CB 3.15Å; C108-F112 PolarHBondContact O-N 2.85Å; C108-G113 PolarHBondContact O-N 2.89Å; C108-M114 HydrophobicContact CB-CB 4.3Å; C108-M114 HydrophobicContact CB-CE 3.82Å; C108-M114 HydrophobicContact CB-SD 4.22Å; C108-M114 WeakPolarHBondContact O-CB 3.41Å; C108-M114 PolarHBondContact O-N 2.82Å; C108-Y157 HydrophobicContact CB-CD1 4.21Å; C108-L165 HydrophobicContact CB-CD1 3.75Å; C108-L165 VanDerWaalsContact SG-CD1 3.58Å
109	V	89.7	Confident	84.3	Confident	66 Å²	66	52.6 Å²	52.6	40%	0.4	25%	0.252	S	S	.	.	H	α-helix	trans	-73.1	-51.4	178.6	174.7	0	0	0	0	111.2	R105 R106 R107 G113 M114	R105-V109 VanDerWaalsContact O-CG2 3.23Å; R105-V109 WeakPolarHBondContact O-CG2 3.41Å; R105-V109 PolarHBondContact O-N 2.82Å; R106-V109 PolarHBondContact O-N 3.48Å; R107-V109 VanDerWaalsContact C-N 3.28Å; R107-V109 PolarHBondContact O-N 2.88Å; V109-G113 WeakPolarHBondContact O-CA 3.42Å; V109-G113 PolarHBondContact O-N 2.91Å; V109-M114 WeakPolarHBondContact CG2-O 3.4Å
110	E	90.9	Very high	82.7	Confident	101 Å²	101	54.6 Å²	54.6	47%	0.472	26%	0.256	S	S	.	.	H	α-helix	trans	-74	-36.2	-172.4	-70.9	-174.6	-172.4	0	0	112.9	R106 R107	R106-E110 HydrophobicContact CG-CG 4.15Å; R106-E110 WeakPolarHBondContact CG-OE1 3.17Å; R106-E110 IonicContact CZ-OE1 3.5Å; R106-E110 IonicContact NE-OE1 2.82Å; R106-E110 PolarHBondContact NE-OE1 2.89Å; R106-E110 IonicContact NH2-OE1 3.33Å; R106-E110 WeakPolarHBondContact O-CB 3.18Å; R106-E110 WeakPolarHBondContact O-CG 3.36Å; R106-E110 PolarHBondContact O-N 3.49Å; R107-E110 IonicContact CZ-OE2 3.92Å; R107-E110 IonicContact NH1-OE2 2.84Å; R107-E110 IonicContact NH2-OE1 3.95Å; R107-E110 IonicContact NH2-OE2 3.99Å; R107-E110 PolarHBondContact NH2-OE2 2.86Å; R107-E110 PolarHBondContact O-N 3.1Å
111	E	92.4	Very high	81.2	Confident	42 Å²	42	53.3 Å²	53.3	20%	0.196	25%	0.247	C	C	.	.	H	α-helix	trans	-92.5	-29.2	-175	-62	174.3	-158.8	0	0	112.7	P80 G81 R107 Y161	P80-E111 WeakPolarHBondContact CA-OE1 3.46Å; G81-E111 PolarHBondContact N-OE1 3.05Å; R107-E111 WeakPolarHBondContact CD-OE1 3.25Å; R107-E111 IonicContact CZ-OE1 2.74Å; R107-E111 IonicContact NE-OE1 2.69Å; R107-E111 IonicContact NH1-OE1 3.11Å; R107-E111 PolarHBondContact NH1-OE1 2.75Å; R107-E111 VanDerWaalsContact O-CB 3.28Å; R107-E111 WeakPolarHBondContact O-CB 3.3Å; R107-E111 PolarHBondContact O-N 3.14Å; E111-Y161 PolarHBondContact OE2-OH 2.84Å
112	F	91.6	Very high	79.7	Confident	15 Å²	15	55.8 Å²	55.8	7%	0.066	26%	0.258	C	S	.	.	H	α-helix	trans	-122.9	0.1	-173.1	-60.7	-85.2	0	0	0	114	C108 M114 Y161 L165 R169 L172 V190	C108-F112 CarbonylContact O-C 3.46Å; C108-F112 WeakPolarHBondContact O-CB 3.15Å; C108-F112 PolarHBondContact O-N 2.85Å; F112-M114 PolarHBondContact O-N 3.37Å; F112-Y161 HydrophobicContact CD2-CD2 4.49Å; F112-Y161 HydrophobicContact CD2-CE2 4.26Å; F112-Y161 HydrophobicContact CE2-CD2 4.04Å; F112-Y161 AromaticContact CE2-CE2 3.54Å; F112-Y161 HydrophobicContact CE2-CE2 3.54Å; F112-L165 HydrophobicContact CB-CD1 4.02Å; F112-L165 HydrophobicContact CB-CD2 4.39Å; F112-L165 HydrophobicContact CD1-CB 3.95Å; F112-L165 HydrophobicContact CD2-CB 3.93Å; F112-L165 HydrophobicContact CD2-CD1 3.89Å; F112-L165 HydrophobicContact CE1-CB 3.98Å; F112-L165 HydrophobicContact CE2-CB 4Å; F112-L165 HydrophobicContact CG-CB 3.91Å; F112-L165 HydrophobicContact CG-CD1 3.98Å; F112-L165 HydrophobicContact CG-CD2 4.48Å; F112-L165 HydrophobicContact CG-CG 4.35Å; F112-L165 HydrophobicContact CZ-CB 4.01Å; F112-R169 HydrophobicContact CE1-CB 3.82Å; F112-R169 HydrophobicContact CZ-CB 4.33Å; F112-L172 HydrophobicContact CD1-CD1 3.6Å; F112-L172 HydrophobicContact CE1-CD1 4.08Å; F112-V190 HydrophobicContact CB-CG2 4.34Å
113	G	87.6	Confident	77.9	Confident	40 Å²	40	57 Å²	57	41%	0.412	27%	0.274	S	S	.	.			trans	66.9	19.4	177.2	0	0	0	0	0	114.4	C108 V109 R115	C108-G113 PolarHBondContact O-N 2.89Å; V109-G113 WeakPolarHBondContact O-CA 3.42Å; V109-G113 PolarHBondContact O-N 2.91Å; G113-R115 WeakPolarHBondContact O-CG 3.39Å; G113-R115 PolarHBondContact O-N 3.14Å; G113-R115 VanDerWaalsContact O-N 3.16Å
114	M	86	Confident	76	Confident	2 Å²	2	61.5 Å²	61.5	1%	0.01	30%	0.302	C	S	.	.			trans	-64.8	115.3	-176.9	-164.7	174.6	85.7	0	0	110.4	C108 V109 F112 Y157 V160 L165 V190	C108-M114 HydrophobicContact CB-CB 4.3Å; C108-M114 HydrophobicContact CB-CE 3.82Å; C108-M114 HydrophobicContact CB-SD 4.22Å; C108-M114 WeakPolarHBondContact O-CB 3.41Å; C108-M114 PolarHBondContact O-N 2.82Å; V109-M114 WeakPolarHBondContact CG2-O 3.4Å; F112-M114 PolarHBondContact O-N 3.37Å; M114-Y157 HydrophobicContact CE-CD1 3.43Å; M114-Y157 VanDerWaalsContact CE-CD1 3.43Å; M114-Y157 HydrophobicContact CE-CE1 3.14Å; M114-V160 HydrophobicContact SD-CG1 3.94Å; M114-L165 HydrophobicContact SD-CD1 4.25Å; M114-V190 HydrophobicContact CB-CG1 4.18Å; M114-V190 HydrophobicContact CG-CG1 3.98Å
115	R	72.4	Confident	74.1	Confident	224 Å²	224	63.6 Å²	63.6	85%	0.845	33%	0.327	S	S	*	.			trans	-90.3	-19.7	-171.9	-62.8	-169.5	177.4	-139.6	0.8	114.8	G113	G113-R115 WeakPolarHBondContact O-CG 3.39Å; G113-R115 PolarHBondContact O-N 3.14Å; G113-R115 VanDerWaalsContact O-N 3.16Å
116	E	67.9	Low	72.2	Confident	34 Å²	34	62.2 Å²	62.2	16%	0.159	33%	0.327	C	S	.	.			trans	-85.1	140.7	-170.7	-59.6	-170.3	163.1	0	0	112.6	M121 R135 Y157 G192	E116-M121 HydrophobicContact CB-SD 4.15Å; E116-R135 IonicContact OE1-NH2 3.99Å; E116-Y157 PolarHBondContact O-OH 3.02Å; E116-G192 WeakPolarHBondContact OE2-CA 3.49Å
117	D	66.2	Low	70.5	Confident	25 Å²	25	60.5 Å²	60.5	13%	0.134	33%	0.326	C	S	.	.			trans	-97.2	107.8	175.9	-168.9	-20.5	0	0	0	108.5	R105 R119 K120 M121 Y157	R105-D117 IonicContact CZ-OD1 3.61Å; R105-D117 IonicContact CZ-OD2 2.77Å; R105-D117 IonicContact NH1-OD1 3.72Å; R105-D117 IonicContact NH1-OD2 2.62Å; R105-D117 PolarHBondContact NH1-OD2 3.13Å; R105-D117 IonicContact NH2-OD1 3.94Å; R105-D117 IonicContact NH2-OD2 2.79Å; R105-D117 PolarHBondContact NH2-OD2 3.44Å; D117-R119 PolarHBondContact O-N 3.15Å; D117-R119 VanDerWaalsContact O-N 3.14Å; D117-R119 WeakPolarHBondContact OD1-CB 3.18Å; D117-R119 PolarHBondContact OD1-N 2.85Å; D117-K120 HydrophobicContact CB-CB 4.01Å; D117-K120 HydrophobicContact CB-CD 3.92Å; D117-K120 HydrophobicContact CB-CG 3.82Å; D117-K120 WeakPolarHBondContact O-CB 3.17Å; D117-K120 PolarHBondContact O-N 3.23Å; D117-M121 PolarHBondContact O-N 3.3Å; D117-M121 VanDerWaalsContact O-N 3.13Å; D117-Y157 WeakPolarHBondContact CA-OH 3.49Å
118	L	64.4	Low	68.5	Low	12 Å²	12	60.2 Å²	60.2	6%	0.063	33%	0.326	C	S	.	.	H	α-helix	trans	-54.9	-35.4	-177.2	-62	179.6	0	0	0	111.1	K120 M121 E122 Y157 V160 L193	L118-K120 PolarHBondContact O-N 3.04Å; L118-M121 HydrophobicContact CD2-SD 4.48Å; L118-M121 WeakPolarHBondContact O-CB 3.11Å; L118-M121 PolarHBondContact O-N 3.01Å; L118-E122 WeakPolarHBondContact O-CG 3.33Å; L118-E122 PolarHBondContact O-N 2.7Å; L118-Y157 HydrophobicContact CB-CE2 3.96Å; L118-Y157 HydrophobicContact CD1-CD1 4.04Å; L118-Y157 HydrophobicContact CD1-CD2 3.72Å; L118-Y157 HydrophobicContact CD1-CE1 3.99Å; L118-Y157 HydrophobicContact CD1-CE2 3.65Å; L118-Y157 HydrophobicContact CD1-CG 3.93Å; L118-Y157 HydrophobicContact CG-CD2 4.41Å; L118-Y157 HydrophobicContact CG-CE1 4.03Å; L118-Y157 HydrophobicContact CG-CE2 3.83Å; L118-Y157 PolarHBondContact N-OH 3.27Å; L118-V160 HydrophobicContact CD1-CG2 4.35Å; L118-L193 HydrophobicContact CD2-CD1 4.2Å; L118-L193 HydrophobicContact CD2-CD2 3.57Å; L118-L193 HydrophobicContact CD2-CG 3.96Å
119	R	61.2	Low	66.5	Low	101 Å²	101	64.3 Å²	64.3	38%	0.381	35%	0.345	S	S	.	.	H	α-helix	trans	-70	-32.3	179	-52.5	-178.5	-151.9	170.4	6.4	112.5	E101 D117 A123	E101-R119 IonicContact OE1-CZ 2.71Å; E101-R119 IonicContact OE1-NE 3.77Å; E101-R119 PolarHBondContact OE1-NE 2.87Å; E101-R119 IonicContact OE1-NH2 3.67Å; E101-R119 PolarHBondContact OE1-NH2 2.7Å; E101-R119 IonicContact OE2-NE 2.99Å; E101-R119 IonicContact OE2-NH2 3.78Å; D117-R119 PolarHBondContact O-N 3.15Å; D117-R119 VanDerWaalsContact O-N 3.14Å; D117-R119 WeakPolarHBondContact OD1-CB 3.18Å; D117-R119 PolarHBondContact OD1-N 2.85Å; R119-A123 WeakPolarHBondContact O-CB 3.19Å; R119-A123 PolarHBondContact O-N 3.47Å
120	K	56.9	Low	64.9	Low	139 Å²	139	64.5 Å²	64.5	60%	0.604	34%	0.343	S	S	*	.	H	α-helix	trans	-72.5	-33.3	174.1	-68.7	-175.4	-175.6	178.5	0	111.1	D117 L118 T124	D117-K120 HydrophobicContact CB-CB 4.01Å; D117-K120 HydrophobicContact CB-CD 3.92Å; D117-K120 HydrophobicContact CB-CG 3.82Å; D117-K120 WeakPolarHBondContact O-CB 3.17Å; D117-K120 PolarHBondContact O-N 3.23Å; L118-K120 PolarHBondContact O-N 3.04Å; K120-T124 WeakPolarHBondContact O-CB 3.23Å; K120-T124 WeakPolarHBondContact O-CG2 3.39Å; K120-T124 PolarHBondContact O-N 3.23Å; K120-T124 PolarHBondContact O-OG1 3.37Å
121	M	57.8	Low	63.1	Low	24 Å²	24	62.2 Å²	62.2	12%	0.118	33%	0.334	C	S	.	.	H	α-helix	trans	-67.2	-44.7	175.8	-62.9	179.4	67.6	0	0	111.1	E116 D117 L118 T124 G125 L131	E116-M121 HydrophobicContact CB-SD 4.15Å; D117-M121 PolarHBondContact O-N 3.3Å; D117-M121 VanDerWaalsContact O-N 3.13Å; L118-M121 HydrophobicContact CD2-SD 4.48Å; L118-M121 WeakPolarHBondContact O-CB 3.11Å; L118-M121 PolarHBondContact O-N 3.01Å; M121-T124 PolarHBondContact O-OG1 3.16Å; M121-G125 PolarHBondContact O-N 3.3Å; M121-L131 HydrophobicContact CE-CD1 4.03Å
122	E	54.4	Low	61.2	Low	115 Å²	115	60.9 Å²	60.9	54%	0.537	33%	0.328	S	S	.	.	H	α-helix	trans	-60.5	-46.8	172.6	-71.2	172.2	179.3	0	0	112	L118 T124 G125	L118-E122 WeakPolarHBondContact O-CG 3.33Å; L118-E122 PolarHBondContact O-N 2.7Å; E122-T124 PolarHBondContact O-N 3.49Å; E122-G125 PolarHBondContact O-N 2.83Å
123	A	49.5	Very low	59.5	Low	89 Å²	89	62.6 Å²	62.6	74%	0.736	34%	0.339	S	S	*	.	H	α-helix	trans	-70.9	-30.7	-177.3	0	0	0	0	0	114.3	R119	R119-A123 WeakPolarHBondContact O-CB 3.19Å; R119-A123 PolarHBondContact O-N 3.47Å
124	T	52.3	Low	57.8	Low	95 Å²	95	67.3 Å²	67.3	58%	0.583	35%	0.348	S	S	*	.	H	α-helix	trans	-86.7	-9.7	178.1	53.3	0	0	0	0	113.1	K120 M121 E122 V126	K120-T124 WeakPolarHBondContact O-CB 3.23Å; K120-T124 WeakPolarHBondContact O-CG2 3.39Å; K120-T124 PolarHBondContact O-N 3.23Å; K120-T124 PolarHBondContact O-OG1 3.37Å; M121-T124 PolarHBondContact O-OG1 3.16Å; E122-T124 PolarHBondContact O-N 3.49Å; T124-V126 PolarHBondContact O-N 3.35Å; T124-V126 VanDerWaalsContact O-N 3.16Å
125	G	51	Low	56.3	Low	54 Å²	54	73.2 Å²	73.2	56%	0.557	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.7	15.9	-178.1	0	0	0	0	0	113.8	M121 E122	M121-G125 PolarHBondContact O-N 3.3Å; E122-G125 PolarHBondContact O-N 2.83Å
126	V	49.5	Very low	55.1	Low	46 Å²	46	64.1 Å²	64.1	28%	0.279	34%	0.339	S	S	.	.			trans	-89.8	119.8	178.4	-176.9	0	0	0	0	107.7	T124 D130 L131	T124-V126 PolarHBondContact O-N 3.35Å; T124-V126 VanDerWaalsContact O-N 3.16Å; V126-D130 HydrophobicContact CG1-CB 3.91Å; V126-L131 HydrophobicContact CG1-CD2 4.03Å; V126-L131 HydrophobicContact CG1-CG 3.91Å
127	S	53.9	Low	54	Low	35 Å²	35	65.8 Å²	65.8	25%	0.245	35%	0.352	C	S	.	.			trans	-71.3	151.4	179.3	74	0	0	0	0	110.9	Q129 D130 L131	S127-Q129 PolarHBondContact O-N 3.44Å; S127-D130 WeakPolarHBondContact CB-OD2 3.3Å; S127-D130 PolarHBondContact N-OD2 2.86Å; S127-D130 VanDerWaalsContact N-OD2 3.1Å; S127-D130 WeakPolarHBondContact O-CB 2.71Å; S127-D130 PolarHBondContact O-N 2.96Å; S127-D130 PolarHBondContact OG-N 2.97Å; S127-D130 PolarHBondContact OG-OD2 3.36Å; S127-L131 PolarHBondContact O-N 3.3Å
128	S	51.4	Low	52.7	Low	6 Å²	6	70.1 Å²	70.1	4%	0.042	38%	0.381	C	S	.	.	H	α-helix	trans	-56.2	-32.6	172.3	68.1	0	0	0	0	111.5	Y132 Y152	S128-Y132 VanDerWaalsContact O-CB 3.29Å; S128-Y132 WeakPolarHBondContact O-CB 3.46Å; S128-Y132 PolarHBondContact O-N 2.96Å; S128-Y152 PolarHBondContact OG-OH 3.29Å
129	Q	50.5	Low	51.5	Low	85 Å²	85	80.8 Å²	80.8	40%	0.397	42%	0.421	S	S	.	.	H	α-helix	trans	-65.8	-36.3	173.2	-172.1	170.9	3.1	0	0	112.7	S127 Y132 V133	S127-Q129 PolarHBondContact O-N 3.44Å; Q129-Y132 WeakPolarHBondContact O-CB 3.04Å; Q129-Y132 PolarHBondContact O-N 2.84Å; Q129-V133 HydrophobicContact CG-CG2 4.3Å; Q129-V133 WeakPolarHBondContact O-CB 3.32Å; Q129-V133 VanDerWaalsContact O-CG2 3.23Å; Q129-V133 WeakPolarHBondContact O-CG2 3.33Å; Q129-V133 PolarHBondContact O-N 3.5Å
130	D	55.1	Low	50.4	Low	70 Å²	70	79.6 Å²	79.6	37%	0.374	42%	0.424	S	S	.	.	H	α-helix	trans	-69.6	-40.5	177.6	-65.3	-47.5	0	0	0	112.4	V126 S127 Y132 K134	V126-D130 HydrophobicContact CG1-CB 3.91Å; S127-D130 WeakPolarHBondContact CB-OD2 3.3Å; S127-D130 PolarHBondContact N-OD2 2.86Å; S127-D130 VanDerWaalsContact N-OD2 3.1Å; S127-D130 WeakPolarHBondContact O-CB 2.71Å; S127-D130 PolarHBondContact O-N 2.96Å; S127-D130 PolarHBondContact OG-N 2.97Å; S127-D130 PolarHBondContact OG-OD2 3.36Å; D130-Y132 VanDerWaalsContact C-N 3.32Å; D130-K134 WeakPolarHBondContact O-CB 3.37Å; D130-K134 VanDerWaalsContact O-CG 3.31Å; D130-K134 WeakPolarHBondContact O-CG 3.5Å; D130-K134 PolarHBondContact O-N 3.46Å
131	L	52.2	Low	49.3	Very low	54 Å²	54	82.2 Å²	82.2	28%	0.283	44%	0.436	S	S	.	.	H	α-helix	trans	-63.2	-42.6	173	-69	176.5	0	0	0	110.6	M121 V126 S127 R135	M121-L131 HydrophobicContact CE-CD1 4.03Å; V126-L131 HydrophobicContact CG1-CD2 4.03Å; V126-L131 HydrophobicContact CG1-CG 3.91Å; S127-L131 PolarHBondContact O-N 3.3Å; L131-R135 VanDerWaalsContact O-CB 3.29Å; L131-R135 WeakPolarHBondContact O-CB 3.39Å; L131-R135 PolarHBondContact O-N 2.95Å; L131-R135 VanDerWaalsContact O-N 3.1Å
132	Y	52.9	Low	48.3	Very low	14 Å²	14	86.5 Å²	86.5	6%	0.055	47%	0.468	C	S	.	.	H	α-helix	trans	-62.5	-52.4	176.3	-179.6	-91.4	0	0	0	112	S128 Q129 D130 K134 R135 V136 F194 I196 M233	S128-Y132 VanDerWaalsContact O-CB 3.29Å; S128-Y132 WeakPolarHBondContact O-CB 3.46Å; S128-Y132 PolarHBondContact O-N 2.96Å; Q129-Y132 WeakPolarHBondContact O-CB 3.04Å; Q129-Y132 PolarHBondContact O-N 2.84Å; D130-Y132 VanDerWaalsContact C-N 3.32Å; Y132-K134 VanDerWaalsContact C-N 3.33Å; Y132-K134 PolarHBondContact O-N 3.23Å; Y132-R135 PolarHBondContact O-N 2.97Å; Y132-V136 HydrophobicContact CD1-CB 4.41Å; Y132-V136 HydrophobicContact CD1-CG2 3.93Å; Y132-V136 HydrophobicContact CD2-CG2 3.71Å; Y132-V136 HydrophobicContact CE1-CB 4.07Å; Y132-V136 HydrophobicContact CE1-CG1 4.19Å; Y132-V136 HydrophobicContact CE1-CG2 3.65Å; Y132-V136 HydrophobicContact CE2-CG2 3.43Å; Y132-V136 VanDerWaalsContact CE2-CG2 3.43Å; Y132-V136 HydrophobicContact CG-CG2 3.94Å; Y132-V136 VanDerWaalsContact O-CB 3.29Å; Y132-V136 WeakPolarHBondContact O-CB 3.46Å; Y132-V136 WeakPolarHBondContact O-CG2 3.31Å; Y132-V136 PolarHBondContact O-N 3.43Å; Y132-F194 HydrophobicContact CD2-CD2 4.44Å; Y132-F194 HydrophobicContact CD2-CG 4.47Å; Y132-I196 HydrophobicContact CD2-CD1 3.9Å; Y132-I196 HydrophobicContact CE2-CD1 3.63Å; Y132-I196 HydrophobicContact CE2-CG1 4.24Å; Y132-M233 HydrophobicContact CE1-CE 4.19Å; Y132-M233 WeakPolarHBondContact OH-CE 3.35Å
133	V	55.9	Low	47.4	Very low	50 Å²	50	82.7 Å²	82.7	30%	0.303	46%	0.459	S	S	.	.	H	α-helix	trans	-60.4	-42.2	-179.1	169.5	0	0	0	0	111	Q129 R135 V137 V140	Q129-V133 HydrophobicContact CG-CG2 4.3Å; Q129-V133 WeakPolarHBondContact O-CB 3.32Å; Q129-V133 VanDerWaalsContact O-CG2 3.23Å; Q129-V133 WeakPolarHBondContact O-CG2 3.33Å; Q129-V133 PolarHBondContact O-N 3.5Å; V133-R135 VanDerWaalsContact C-N 3.29Å; V133-R135 PolarHBondContact O-N 2.93Å; V133-V137 CarbonylContact O-C 3.52Å; V133-V137 WeakPolarHBondContact O-CA 3.23Å; V133-V137 PolarHBondContact O-N 3.38Å; V133-V140 HydrophobicContact CG1-CB 4.34Å; V133-V140 HydrophobicContact CG1-CG2 3.98Å
134	K	52.3	Low	47	Very low	140 Å²	140	90.6 Å²	90.6	61%	0.609	47%	0.47	S	S	*	.	H	α-helix	trans	-62.1	-35.2	174.8	-76.5	176.1	-180	174.2	0	113	D130 Y132	D130-K134 WeakPolarHBondContact O-CB 3.37Å; D130-K134 VanDerWaalsContact O-CG 3.31Å; D130-K134 WeakPolarHBondContact O-CG 3.5Å; D130-K134 PolarHBondContact O-N 3.46Å; Y132-K134 VanDerWaalsContact C-N 3.33Å; Y132-K134 PolarHBondContact O-N 3.23Å
135	R	54.2	Low	46.2	Very low	126 Å²	126	93.8 Å²	93.8	48%	0.475	48%	0.476	S	S	.	.	H	α-helix	trans	-84.6	-31.5	-176.6	-162.6	174.8	-63.3	175.4	10.3	112.9	E116 L131 Y132 V133 D191	E116-R135 IonicContact OE1-NH2 3.99Å; L131-R135 VanDerWaalsContact O-CB 3.29Å; L131-R135 WeakPolarHBondContact O-CB 3.39Å; L131-R135 PolarHBondContact O-N 2.95Å; L131-R135 VanDerWaalsContact O-N 3.1Å; Y132-R135 PolarHBondContact O-N 2.97Å; V133-R135 VanDerWaalsContact C-N 3.29Å; V133-R135 PolarHBondContact O-N 2.93Å; R135-D191 WeakPolarHBondContact CD-OD2 3.29Å; R135-D191 IonicContact CZ-OD1 2.69Å; R135-D191 IonicContact CZ-OD2 3.81Å; R135-D191 IonicContact NE-OD2 2.78Å; R135-D191 IonicContact NH1-OD1 3.75Å; R135-D191 PolarHBondContact NH1-OD1 3.45Å; R135-D191 IonicContact NH1-OD2 3.87Å; R135-D191 PolarHBondContact NH1-OD2 3.34Å
136	V	47.3	Very low	45.2	Very low	32 Å²	32	98.9 Å²	98.9	19%	0.194	49%	0.488	C	S	.	.	H	α-helix	trans	-93.4	-31.1	-175.9	177.7	0	0	0	0	111.8	Y132 W198 P216	Y132-V136 HydrophobicContact CD1-CB 4.41Å; Y132-V136 HydrophobicContact CD1-CG2 3.93Å; Y132-V136 HydrophobicContact CD2-CG2 3.71Å; Y132-V136 HydrophobicContact CE1-CB 4.07Å; Y132-V136 HydrophobicContact CE1-CG1 4.19Å; Y132-V136 HydrophobicContact CE1-CG2 3.65Å; Y132-V136 HydrophobicContact CE2-CG2 3.43Å; Y132-V136 VanDerWaalsContact CE2-CG2 3.43Å; Y132-V136 HydrophobicContact CG-CG2 3.94Å; Y132-V136 VanDerWaalsContact O-CB 3.29Å; Y132-V136 WeakPolarHBondContact O-CB 3.46Å; Y132-V136 WeakPolarHBondContact O-CG2 3.31Å; Y132-V136 PolarHBondContact O-N 3.43Å; V136-W198 HydrophobicContact CB-CH2 4.41Å; V136-W198 HydrophobicContact CG2-CH2 3.61Å; V136-W198 HydrophobicContact CG2-CZ2 4.15Å; V136-P216 HydrophobicContact CG1-CG 3.79Å
137	V	45.8	Very low	44.3	Very low	69 Å²	69	104.6 Å²	104.6	42%	0.418	51%	0.509	S	S	.	.			trans	-131.3	85.1	179.8	-168.6	0	0	0	0	110.2	V133 R139 V140	V133-V137 CarbonylContact O-C 3.52Å; V133-V137 WeakPolarHBondContact O-CA 3.23Å; V133-V137 PolarHBondContact O-N 3.38Å; V137-R139 PolarHBondContact O-N 2.97Å; V137-V140 HydrophobicContact CB-CG2 3.96Å; V137-V140 HydrophobicContact CG1-CG2 3.68Å; V137-V140 PolarHBondContact O-N 3.01Å
138	P	38.6	Very low	43.2	Very low	116 Å²	116	109.7 Å²	109.7	75%	0.753	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-17.2	-176.3	-21.7	31.7	0	0	0	114.5
139	R	37.9	Very low	42.4	Very low	237 Å²	237	115.5 Å²	115.5	89%	0.894	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	-1.4	-175.4	-77	-177	153.4	173	-5.2	114.8	V137 K141	V137-R139 PolarHBondContact O-N 2.97Å; R139-K141 PolarHBondContact O-N 3.09Å
140	V	39.4	Very low	41.8	Very low	75 Å²	75	114.7 Å²	114.7	46%	0.455	57%	0.565	S	S	.	*			trans	-72.8	101.9	172.1	-175.3	0	0	0	0	108.3	V133 V137 S142	V133-V140 HydrophobicContact CG1-CB 4.34Å; V133-V140 HydrophobicContact CG1-CG2 3.98Å; V137-V140 HydrophobicContact CB-CG2 3.96Å; V137-V140 HydrophobicContact CG1-CG2 3.68Å; V137-V140 PolarHBondContact O-N 3.01Å; V140-S142 PolarHBondContact O-N 3.38Å
141	K	33	Very low	41.1	Very low	195 Å²	195	115.6 Å²	115.6	85%	0.848	57%	0.569	S	S	*	*			trans	-54.3	127.1	167	-73.3	-176.4	178.9	178.9	0	107.4	R139 G143	R139-K141 PolarHBondContact O-N 3.09Å; K141-G143 PolarHBondContact O-N 3.29Å
142	S	37.9	Very low	41	Very low	114 Å²	114	117 Å²	117	80%	0.797	57%	0.571	S	S	*	*			trans	-50.6	86.6	174	172.2	0	0	0	0	110.6	V140	V140-S142 PolarHBondContact O-N 3.38Å
143	G	35.8	Very low	40.8	Very low	34 Å²	34	122.7 Å²	122.7	35%	0.351	60%	0.598	S	S	.	*			trans	-71.8	144.4	161.5	0	0	0	0	0	108	K141 F145	K141-G143 PolarHBondContact O-N 3.29Å; G143-F145 VanDerWaalsContact C-CD2 3.48Å; G143-F145 VanDerWaalsContact CA-CE2 3.45Å; G143-F145 VanDerWaalsContact O-CD2 3.23Å; G143-F145 WeakPolarHBondContact O-CD2 3.44Å; G143-F145 PolarHBondContact O-N 3.21Å
144	R	39.3	Very low	41	Very low	255 Å²	255	128.2 Å²	128.2	96%	0.962	62%	0.621	S	S	*	*			trans	-72.4	82.1	171.2	-153.5	-179.8	-165.8	-176.7	3.6	106.7
145	F	36.9	Very low	41.8	Very low	162 Å²	162	123.1 Å²	123.1	71%	0.711	60%	0.599	S	S	*	*			trans	-89.9	122.7	-177.7	-74	-76.7	0	0	0	109.6	G143	G143-F145 VanDerWaalsContact C-CD2 3.48Å; G143-F145 VanDerWaalsContact CA-CE2 3.45Å; G143-F145 VanDerWaalsContact O-CD2 3.23Å; G143-F145 WeakPolarHBondContact O-CD2 3.44Å; G143-F145 PolarHBondContact O-N 3.21Å
146	M	28.6	Very low	43	Very low	161 Å²	161	119.7 Å²	119.7	79%	0.793	59%	0.59	S	S	*	*			trans	-59.4	145.9	173.4	-83.4	169.8	-86	0	0	110.2	L148	M146-L148 VanDerWaalsContact C-N 3.34Å; M146-L148 PolarHBondContact O-N 3.5Å
147	K	31.5	Very low	44.9	Very low	167 Å²	167	118.1 Å²	118.1	73%	0.726	58%	0.581	S	S	*	*			trans	-39.8	96.9	162.6	-112.6	-169.9	171.5	-161	0	108.7	D151	K147-D151 IonicContact NZ-OD1 3.59Å; K147-D151 PolarHBondContact NZ-OD1 3.01Å
148	L	31.4	Very low	46.9	Very low	142 Å²	142	119.6 Å²	119.6	74%	0.743	58%	0.579	S	S	*	*			trans	-113.1	104.6	170.4	-86.3	163.2	0	0	0	104.6	M146	M146-L148 VanDerWaalsContact C-N 3.34Å; M146-L148 PolarHBondContact O-N 3.5Å
149	L	34.8	Very low	49.1	Very low	128 Å²	128	114.9 Å²	114.9	67%	0.67	55%	0.548	S	S	*	.	S	Bend	trans	119.8	148.6	170.6	-64.9	167.3	0	0	0	114.6
150	P	37.2	Very low	51.5	Low	68 Å²	68	103.6 Å²	103.6	44%	0.442	51%	0.505	S	S	.	.			trans	-69.1	160.2	-148.6	-14.2	29.3	0	0	0	112	Y152 E224	P150-Y152 PolarHBondContact O-N 2.72Å; P150-Y152 VanDerWaalsContact O-N 3.09Å; P150-E224 VanDerWaalsContact CB-OE1 3.29Å; P150-E224 WeakPolarHBondContact CB-OE1 3.43Å; P150-E224 VanDerWaalsContact CD-OE1 3.31Å; P150-E224 WeakPolarHBondContact CD-OE1 3.41Å; P150-E224 WeakPolarHBondContact CG-OE1 3.13Å
151	D	39.5	Very low	53.9	Low	89 Å²	89	100.3 Å²	100.3	48%	0.476	49%	0.485	S	S	.	.			trans	-54.1	118.4	178.8	-60.8	-58.1	0	0	0	109.7	K147 E153	K147-D151 IonicContact NZ-OD1 3.59Å; K147-D151 PolarHBondContact NZ-OD1 3.01Å; D151-E153 HydrophobicContact CB-CB 4.27Å; D151-E153 HydrophobicContact CB-CG 3.81Å; D151-E153 PolarHBondContact O-N 2.93Å
152	Y	49.8	Very low	56.7	Low	82 Å²	82	93.4 Å²	93.4	32%	0.322	46%	0.459	S	S	.	.			trans	-63.2	30.3	168	-84.5	-89.4	0	0	0	111.7	S128 P150 H154 M155 L193	S128-Y152 PolarHBondContact OG-OH 3.29Å; P150-Y152 PolarHBondContact O-N 2.72Å; P150-Y152 VanDerWaalsContact O-N 3.09Å; Y152-H154 PolarHBondContact O-N 2.82Å; Y152-M155 HydrophobicContact CD1-CE 4.42Å; Y152-M155 HydrophobicContact CE1-CE 4.42Å; Y152-L193 HydrophobicContact CE1-CD1 4.21Å
153	E	50.6	Low	59.1	Low	134 Å²	134	90.6 Å²	90.6	63%	0.626	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	110.1	177.9	-79.2	175.4	-179.4	0	0	107.1	D151	D151-E153 HydrophobicContact CB-CB 4.27Å; D151-E153 HydrophobicContact CB-CG 3.81Å; D151-E153 PolarHBondContact O-N 2.93Å
154	H	60	Low	61.8	Low	167 Å²	167	89 Å²	89	77%	0.773	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.7	26.6	166.2	-38.7	-52.4	0	0	0	119.1	Y152	Y152-H154 PolarHBondContact O-N 2.82Å
155	M	68.8	Low	64.3	Low	32 Å²	32	76.8 Å²	76.8	16%	0.158	37%	0.37	C	S	.	.			trans	-91.6	113.6	166	-164.8	164.1	68.2	0	0	111.6	Y152 V160 L193 L222	Y152-M155 HydrophobicContact CD1-CE 4.42Å; Y152-M155 HydrophobicContact CE1-CE 4.42Å; M155-V160 HydrophobicContact CE-CG2 4.32Å; M155-V160 HydrophobicContact CG-CG2 4.27Å; M155-V160 HydrophobicContact SD-CG2 4.42Å; M155-L193 HydrophobicContact CE-CD1 3.29Å; M155-L193 HydrophobicContact CE-CD2 3.3Å; M155-L193 HydrophobicContact CE-CG 3.83Å; M155-L222 HydrophobicContact CG-CD2 4.36Å; M155-L222 HydrophobicContact SD-CB 3.89Å; M155-L222 HydrophobicContact SD-CD2 3.48Å; M155-L222 WeakPolarHBondContact SD-CD2 3.47Å; M155-L222 HydrophobicContact SD-CG 3.67Å
156	D	79.6	Confident	67	Low	54 Å²	54	71.7 Å²	71.7	29%	0.289	35%	0.348	S	S	.	.			trans	-99.5	165.4	179.2	73.5	16.5	0	0	0	112.8	R158 D159 V160	D156-R158 PolarHBondContact O-N 3.14Å; D156-R158 WeakPolarHBondContact OD1-CA 3.36Å; D156-R158 VanDerWaalsContact OD1-CB 3.29Å; D156-R158 WeakPolarHBondContact OD1-CB 3.36Å; D156-R158 PolarHBondContact OD1-N 2.9Å; D156-R158 VanDerWaalsContact OD1-N 3.07Å; D156-D159 PolarHBondContact O-N 3.22Å; D156-D159 WeakPolarHBondContact OD1-CB 3.27Å; D156-D159 PolarHBondContact OD1-N 3.08Å; D156-V160 PolarHBondContact O-N 2.84Å; D156-V160 VanDerWaalsContact O-N 3.14Å
157	Y	86.3	Confident	70.1	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-62.7	-23.9	178.4	-76.8	-91.6	0	0	0	113	E101 R105 C108 M114 E116 D117 L118 Y161	E101-Y157 HydrophobicContact CG-CD2 3.6Å; E101-Y157 HydrophobicContact CG-CE2 4.41Å; E101-Y157 HydrophobicContact CG-CG 4.46Å; E101-Y157 VanDerWaalsContact OE1-CD2 3.25Å; E101-Y157 WeakPolarHBondContact OE1-CD2 3.44Å; E101-Y157 WeakPolarHBondContact OE1-CE2 3.47Å; R105-Y157 VanDerWaalsContact CA-CD1 3.45Å; R105-Y157 HydrophobicContact CB-CD1 3.78Å; R105-Y157 HydrophobicContact CB-CD2 3.79Å; R105-Y157 HydrophobicContact CB-CE1 3.9Å; R105-Y157 HydrophobicContact CB-CE2 3.93Å; R105-Y157 HydrophobicContact CB-CG 3.7Å; R105-Y157 HydrophobicContact CG-CD1 4.03Å; R105-Y157 HydrophobicContact CG-CD2 4.32Å; R105-Y157 HydrophobicContact CG-CE1 3.62Å; R105-Y157 HydrophobicContact CG-CE2 3.95Å; R105-Y157 HydrophobicContact CG-CG 4.35Å; C108-Y157 HydrophobicContact CB-CD1 4.21Å; M114-Y157 HydrophobicContact CE-CD1 3.43Å; M114-Y157 VanDerWaalsContact CE-CD1 3.43Å; M114-Y157 HydrophobicContact CE-CE1 3.14Å; E116-Y157 PolarHBondContact O-OH 3.02Å; D117-Y157 WeakPolarHBondContact CA-OH 3.49Å; L118-Y157 HydrophobicContact CB-CE2 3.96Å; L118-Y157 HydrophobicContact CD1-CD1 4.04Å; L118-Y157 HydrophobicContact CD1-CD2 3.72Å; L118-Y157 HydrophobicContact CD1-CE1 3.99Å; L118-Y157 HydrophobicContact CD1-CE2 3.65Å; L118-Y157 HydrophobicContact CD1-CG 3.93Å; L118-Y157 HydrophobicContact CG-CD2 4.41Å; L118-Y157 HydrophobicContact CG-CE1 4.03Å; L118-Y157 HydrophobicContact CG-CE2 3.83Å; L118-Y157 PolarHBondContact N-OH 3.27Å; Y157-Y161 WeakPolarHBondContact O-CB 3.33Å; Y157-Y161 PolarHBondContact O-N 3.4Å
158	R	87.3	Confident	73.1	Confident	100 Å²	100	61 Å²	61	38%	0.377	30%	0.303	S	S	.	.	H	α-helix	trans	-68.3	-45.6	176.1	-178.7	174.7	-179.2	-109.3	-3.8	109.7	W104 D156 V160 Y161 T162	W104-R158 HydrophobicContact CB-CB 4.24Å; W104-R158 HydrophobicContact CD2-CB 3.8Å; W104-R158 HydrophobicContact CD2-CG 3.79Å; W104-R158 HydrophobicContact CE3-CB 4.48Å; W104-R158 HydrophobicContact CE3-CG 4.31Å; W104-R158 HydrophobicContact CG-CB 3.63Å; W104-R158 HydrophobicContact CG-CG 4.15Å; W104-R158 HydrophobicContact CH2-CG 4.44Å; W104-R158 HydrophobicContact CZ2-CG 3.93Å; D156-R158 PolarHBondContact O-N 3.14Å; D156-R158 WeakPolarHBondContact OD1-CA 3.36Å; D156-R158 VanDerWaalsContact OD1-CB 3.29Å; D156-R158 WeakPolarHBondContact OD1-CB 3.36Å; D156-R158 PolarHBondContact OD1-N 2.9Å; D156-R158 VanDerWaalsContact OD1-N 3.07Å; R158-V160 PolarHBondContact O-N 2.81Å; R158-Y161 PolarHBondContact O-N 2.83Å; R158-T162 HydrophobicContact CG-CG2 4.38Å; R158-T162 WeakPolarHBondContact O-CB 3.42Å; R158-T162 WeakPolarHBondContact O-CG2 3.47Å; R158-T162 PolarHBondContact O-N 3.4Å; R158-T162 PolarHBondContact O-OG1 2.91Å
159	D	86.3	Confident	76	Confident	16 Å²	16	58.9 Å²	58.9	9%	0.086	28%	0.284	C	S	.	.	H	α-helix	trans	-63	-41.3	176.9	-77.6	-33.3	0	0	0	111.6	D156 T162 H163 K226	D156-D159 PolarHBondContact O-N 3.22Å; D156-D159 WeakPolarHBondContact OD1-CB 3.27Å; D156-D159 PolarHBondContact OD1-N 3.08Å; D159-T162 PolarHBondContact O-N 3.4Å; D159-T162 PolarHBondContact O-OG1 3.39Å; D159-H163 VanDerWaalsContact O-CB 3.3Å; D159-H163 WeakPolarHBondContact O-CB 3.02Å; D159-H163 PolarHBondContact O-N 3.04Å; D159-H163 PolarHBondContact O-ND1 3.07Å; D159-H163 IonicContact OD1-CE1 2.66Å; D159-H163 PolarHBondContact OD1-CE1 2.87Å; D159-H163 VanDerWaalsContact OD1-CE1 3.24Å; D159-H163 IonicContact OD1-ND1 3.77Å; D159-K226 VanDerWaalsContact CG-NZ 3.33Å; D159-K226 IonicContact OD1-NZ 2.73Å; D159-K226 PolarHBondContact OD1-NZ 2.83Å; D159-K226 IonicContact OD2-NZ 3.54Å; D159-K226 PolarHBondContact OD2-NZ 2.79Å; D159-K226 VanDerWaalsContact OD2-NZ 3.11Å
160	V	87.1	Confident	78.9	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-61.2	-47	173.5	175.2	0	0	0	0	110.9	M114 L118 M155 D156 R158 L164 L165 L193	M114-V160 HydrophobicContact SD-CG1 3.94Å; L118-V160 HydrophobicContact CD1-CG2 4.35Å; M155-V160 HydrophobicContact CE-CG2 4.32Å; M155-V160 HydrophobicContact CG-CG2 4.27Å; M155-V160 HydrophobicContact SD-CG2 4.42Å; D156-V160 PolarHBondContact O-N 2.84Å; D156-V160 VanDerWaalsContact O-N 3.14Å; R158-V160 PolarHBondContact O-N 2.81Å; V160-L164 HydrophobicContact CG1-CD2 4.48Å; V160-L164 WeakPolarHBondContact O-CA 3.36Å; V160-L164 WeakPolarHBondContact O-CB 3.13Å; V160-L164 PolarHBondContact O-N 2.77Å; V160-L165 HydrophobicContact CG1-CD1 3.95Å; V160-L165 HydrophobicContact CG1-CG 3.94Å; V160-L165 PolarHBondContact O-N 2.78Å; V160-L193 HydrophobicContact CG2-CD2 3.7Å
161	Y	90.9	Very high	81.7	Confident	7 Å²	7	52.6 Å²	52.6	3%	0.027	25%	0.246	C	C	.	.	I	π-helix	trans	-60.4	-49.3	177.8	-171.8	-78.9	0	0	0	111.4	G81 T82 W104 R107 E111 F112 Y157 R158 H166	G81-Y161 VanDerWaalsContact C-OH 3.26Å; G81-Y161 VanDerWaalsContact CA-OH 3.23Å; G81-Y161 WeakPolarHBondContact CA-OH 3.38Å; T82-Y161 PolarHBondContact N-OH 3.13Å; W104-Y161 AromaticContact CE3-CD1 3.97Å; W104-Y161 HydrophobicContact CE3-CD1 3.97Å; W104-Y161 HydrophobicContact CE3-CD2 4.26Å; W104-Y161 AromaticContact CE3-CG 3.76Å; W104-Y161 HydrophobicContact CE3-CG 3.76Å; W104-Y161 AromaticContact CZ3-CD1 3.55Å; W104-Y161 HydrophobicContact CZ3-CD1 3.55Å; W104-Y161 HydrophobicContact CZ3-CE1 4.01Å; W104-Y161 AromaticContact CZ3-CG 3.86Å; W104-Y161 HydrophobicContact CZ3-CG 3.86Å; R107-Y161 HydrophobicContact CB-CD2 3.96Å; R107-Y161 HydrophobicContact CB-CE2 3.8Å; E111-Y161 PolarHBondContact OE2-OH 2.84Å; F112-Y161 HydrophobicContact CD2-CD2 4.49Å; F112-Y161 HydrophobicContact CD2-CE2 4.26Å; F112-Y161 HydrophobicContact CE2-CD2 4.04Å; F112-Y161 AromaticContact CE2-CE2 3.54Å; F112-Y161 HydrophobicContact CE2-CE2 3.54Å; Y157-Y161 WeakPolarHBondContact O-CB 3.33Å; Y157-Y161 PolarHBondContact O-N 3.4Å; R158-Y161 PolarHBondContact O-N 2.83Å; Y161-H166 HydrophobicContact CD1-CB 4.14Å; Y161-H166 HydrophobicContact CE1-CB 3.85Å; Y161-H166 WeakPolarHBondContact O-CB 3.12Å; Y161-H166 PolarHBondContact O-N 2.83Å
162	T	90.8	Very high	84.4	Confident	49 Å²	49	48.9 Å²	48.9	30%	0.301	23%	0.226	S	C	.	.	I	π-helix	trans	-78.7	-32.5	-171	56.2	0	0	0	0	114	R158 D159 P167	R158-T162 HydrophobicContact CG-CG2 4.38Å; R158-T162 WeakPolarHBondContact O-CB 3.42Å; R158-T162 WeakPolarHBondContact O-CG2 3.47Å; R158-T162 PolarHBondContact O-N 3.4Å; R158-T162 PolarHBondContact O-OG1 2.91Å; D159-T162 PolarHBondContact O-N 3.4Å; D159-T162 PolarHBondContact O-OG1 3.39Å; T162-P167 VanDerWaalsContact O-CD 3.25Å; T162-P167 WeakPolarHBondContact O-CD 3.3Å; T162-P167 WeakPolarHBondContact O-CG 3.48Å
163	H	89.6	Confident	86.7	Confident	55 Å²	55	45 Å²	45	26%	0.255	21%	0.211	S	C	.	.	I	π-helix	trans	-107.4	-14.8	-172.2	-53.6	103.4	0	0	0	113.8	D159 L222 K226	D159-H163 VanDerWaalsContact O-CB 3.3Å; D159-H163 WeakPolarHBondContact O-CB 3.02Å; D159-H163 PolarHBondContact O-N 3.04Å; D159-H163 PolarHBondContact O-ND1 3.07Å; D159-H163 IonicContact OD1-CE1 2.66Å; D159-H163 PolarHBondContact OD1-CE1 2.87Å; D159-H163 VanDerWaalsContact OD1-CE1 3.24Å; D159-H163 IonicContact OD1-ND1 3.77Å; H163-L222 HydrophobicContact CB-CD1 4.39Å; H163-L222 HydrophobicContact CB-CD2 4.3Å; H163-K226 WeakPolarHBondContact CB-O 3.43Å; H163-K226 PolarHBondContact CD2-O 3.36Å; H163-K226 VanDerWaalsContact CG-O 3.22Å
164	L	90.6	Very high	89	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	18%	0.181	C	C	.	.	I	π-helix	trans	-122.7	-61.9	-180	-176.5	66.6	0	0	0	112	V160 Y168 L193 I195 I220 A228	V160-L164 HydrophobicContact CG1-CD2 4.48Å; V160-L164 WeakPolarHBondContact O-CA 3.36Å; V160-L164 WeakPolarHBondContact O-CB 3.13Å; V160-L164 PolarHBondContact O-N 2.77Å; L164-Y168 HydrophobicContact CD1-CD2 4.43Å; L164-Y168 VanDerWaalsContact O-CD2 3.28Å; L164-Y168 WeakPolarHBondContact O-CD2 3.2Å; L164-Y168 PolarHBondContact O-N 2.8Å; L164-L193 WeakPolarHBondContact CD2-O 3.45Å; L164-I195 HydrophobicContact CD1-CD1 3.9Å; L164-I195 HydrophobicContact CD1-CG1 4.14Å; L164-I195 HydrophobicContact CG-CD1 3.99Å; L164-I195 HydrophobicContact CG-CG1 4.2Å; L164-I220 HydrophobicContact CD1-CB 4.13Å; L164-I220 HydrophobicContact CD1-CG2 3.66Å; L164-A228 HydrophobicContact CD1-CB 4.26Å
165	L	92.9	Very high	90.8	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	14%	0.144	C	C	.	.	I	π-helix	trans	-71	-54.6	-169.1	-58.1	179.4	0	0	0	112.6	C108 F112 M114 V160 Y168 R169 V190	C108-L165 HydrophobicContact CB-CD1 3.75Å; C108-L165 VanDerWaalsContact SG-CD1 3.58Å; F112-L165 HydrophobicContact CB-CD1 4.02Å; F112-L165 HydrophobicContact CB-CD2 4.39Å; F112-L165 HydrophobicContact CD1-CB 3.95Å; F112-L165 HydrophobicContact CD2-CB 3.93Å; F112-L165 HydrophobicContact CD2-CD1 3.89Å; F112-L165 HydrophobicContact CE1-CB 3.98Å; F112-L165 HydrophobicContact CE2-CB 4Å; F112-L165 HydrophobicContact CG-CB 3.91Å; F112-L165 HydrophobicContact CG-CD1 3.98Å; F112-L165 HydrophobicContact CG-CD2 4.48Å; F112-L165 HydrophobicContact CG-CG 4.35Å; F112-L165 HydrophobicContact CZ-CB 4.01Å; M114-L165 HydrophobicContact SD-CD1 4.25Å; V160-L165 HydrophobicContact CG1-CD1 3.95Å; V160-L165 HydrophobicContact CG1-CG 3.94Å; V160-L165 PolarHBondContact O-N 2.78Å; L165-Y168 CarbonylContact O-C 3.51Å; L165-Y168 PolarHBondContact O-N 2.86Å; L165-R169 WeakPolarHBondContact O-CA 3.39Å; L165-R169 PolarHBondContact O-N 2.9Å; L165-V190 HydrophobicContact CD2-CB 4.41Å; L165-V190 HydrophobicContact CD2-CG1 3.74Å; L165-V190 HydrophobicContact CD2-CG2 3.71Å
166	H	93.7	Very high	92.2	Very high	55 Å²	55	29.7 Å²	29.7	26%	0.255	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-47.1	-178.3	-177.5	-94.5	0	0	0	112.2	Y161 Y168 R169	Y161-H166 HydrophobicContact CD1-CB 4.14Å; Y161-H166 HydrophobicContact CE1-CB 3.85Å; Y161-H166 WeakPolarHBondContact O-CB 3.12Å; Y161-H166 PolarHBondContact O-N 2.83Å; H166-Y168 VanDerWaalsContact C-N 3.28Å; H166-Y168 PolarHBondContact O-N 2.74Å; H166-R169 PolarHBondContact CE1-NH1 3.33Å; H166-R169 WeakPolarHBondContact O-CB 3.46Å; H166-R169 WeakPolarHBondContact O-CD 3.42Å; H166-R169 WeakPolarHBondContact O-CG 3.18Å; H166-R169 PolarHBondContact O-N 2.85Å; H166-R169 PolarHBondContact O-NH1 2.79Å
167	P	92.9	Very high	93.1	Very high	57 Å²	57	27.2 Å²	27.2	37%	0.37	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-37.2	179.2	-27.3	37.3	0	0	0	114	T162	T162-P167 VanDerWaalsContact O-CD 3.25Å; T162-P167 WeakPolarHBondContact O-CD 3.3Å; T162-P167 WeakPolarHBondContact O-CG 3.48Å
168	Y	94.1	Very high	93.6	Very high	47 Å²	47	29.8 Å²	29.8	18%	0.184	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.9	12.3	-177.9	-65.9	-80.2	0	0	0	113.5	L164 L165 H166 H170 I171 I195 I220 A228 V230	L164-Y168 HydrophobicContact CD1-CD2 4.43Å; L164-Y168 VanDerWaalsContact O-CD2 3.28Å; L164-Y168 WeakPolarHBondContact O-CD2 3.2Å; L164-Y168 PolarHBondContact O-N 2.8Å; L165-Y168 CarbonylContact O-C 3.51Å; L165-Y168 PolarHBondContact O-N 2.86Å; H166-Y168 VanDerWaalsContact C-N 3.28Å; H166-Y168 PolarHBondContact O-N 2.74Å; Y168-H170 PolarHBondContact O-N 2.87Å; Y168-H170 VanDerWaalsContact O-N 3.09Å; Y168-I171 HydrophobicContact CD1-CD1 4.01Å; Y168-I171 HydrophobicContact CD1-CG1 4.45Å; Y168-I171 HydrophobicContact CG-CD1 4.5Å; Y168-I171 WeakPolarHBondContact O-CG1 3.47Å; Y168-I171 PolarHBondContact O-N 2.78Å; Y168-I195 HydrophobicContact CD2-CD1 4.45Å; Y168-I195 HydrophobicContact CG-CD1 4.26Å; Y168-I220 HydrophobicContact CD1-CD1 3.35Å; Y168-I220 HydrophobicContact CD2-CD1 4.22Å; Y168-I220 HydrophobicContact CD2-CG2 4.08Å; Y168-I220 HydrophobicContact CE1-CD1 3.56Å; Y168-I220 HydrophobicContact CE1-CG2 4.39Å; Y168-I220 HydrophobicContact CE2-CD1 4.41Å; Y168-I220 HydrophobicContact CE2-CG2 3.7Å; Y168-I220 HydrophobicContact CG-CD1 3.7Å; Y168-A228 HydrophobicContact CE2-CB 3.65Å; Y168-V230 HydrophobicContact CE1-CG2 4.48Å
169	R	93.8	Very high	94.1	Very high	96 Å²	96	25.7 Å²	25.7	36%	0.362	13%	0.125	S	C	.	.	G	3₁₀ helix	trans	-54.1	-34.3	-179	70.3	-166.1	177.5	-74.1	1.1	113.7	F112 L165 H166 I171 L172	F112-R169 HydrophobicContact CE1-CB 3.82Å; F112-R169 HydrophobicContact CZ-CB 4.33Å; L165-R169 WeakPolarHBondContact O-CA 3.39Å; L165-R169 PolarHBondContact O-N 2.9Å; H166-R169 PolarHBondContact CE1-NH1 3.33Å; H166-R169 WeakPolarHBondContact O-CB 3.46Å; H166-R169 WeakPolarHBondContact O-CD 3.42Å; H166-R169 WeakPolarHBondContact O-CG 3.18Å; H166-R169 PolarHBondContact O-N 2.85Å; H166-R169 PolarHBondContact O-NH1 2.79Å; R169-I171 VanDerWaalsContact C-N 3.31Å; R169-I171 PolarHBondContact O-N 2.79Å; R169-L172 PolarHBondContact O-N 3.46Å
170	H	94.5	Very high	94.5	Very high	64 Å²	64	25.9 Å²	25.9	30%	0.296	13%	0.131	S	C	.	.	G	3₁₀ helix	trans	-73.7	-19.1	-177.6	-64.7	-56	0	0	0	113.7	Y168 W175 T246 R314	Y168-H170 PolarHBondContact O-N 2.87Å; Y168-H170 VanDerWaalsContact O-N 3.09Å; H170-W175 WeakPolarHBondContact O-CH2 3.39Å; H170-W175 VanDerWaalsContact O-CZ2 3.27Å; H170-W175 WeakPolarHBondContact O-CZ2 3.4Å; H170-T246 HydrophobicContact CB-CG2 4.2Å; H170-R314 PolarHBondContact O-NH2 3.35Å
171	I	96.9	Very high	95	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-90.8	-9.4	177	65.9	159.3	0	0	0	112.7	Y168 R169 W175 V188 I195 F218 I220 I244 F252	Y168-I171 HydrophobicContact CD1-CD1 4.01Å; Y168-I171 HydrophobicContact CD1-CG1 4.45Å; Y168-I171 HydrophobicContact CG-CD1 4.5Å; Y168-I171 WeakPolarHBondContact O-CG1 3.47Å; Y168-I171 PolarHBondContact O-N 2.78Å; R169-I171 VanDerWaalsContact C-N 3.31Å; R169-I171 PolarHBondContact O-N 2.79Å; I171-W175 WeakPolarHBondContact O-CZ2 3.29Å; I171-W175 PolarHBondContact O-NE1 3.38Å; I171-V188 HydrophobicContact CD1-CG1 4.07Å; I171-V188 HydrophobicContact CG1-CG1 4.21Å; I171-V188 WeakPolarHBondContact O-CB 3.31Å; I171-V188 WeakPolarHBondContact O-CG1 3.39Å; I171-V188 WeakPolarHBondContact O-CG2 3.46Å; I171-I195 HydrophobicContact CD1-CG2 4.25Å; I171-F218 HydrophobicContact CD1-CE2 4.21Å; I171-I220 HydrophobicContact CD1-CD1 3.55Å; I171-I244 HydrophobicContact CD1-CD1 4.04Å; I171-I244 HydrophobicContact CG2-CG2 4.19Å; I171-F252 HydrophobicContact CB-CD1 4.13Å; I171-F252 HydrophobicContact CB-CE1 4.31Å; I171-F252 HydrophobicContact CB-CG 4.26Å; I171-F252 HydrophobicContact CG2-CB 3.77Å; I171-F252 HydrophobicContact CG2-CD1 3.96Å; I171-F252 HydrophobicContact CG2-CD2 4.04Å; I171-F252 HydrophobicContact CG2-CG 3.66Å
172	L	96.6	Very high	95.3	Very high	12 Å²	12	27.5 Å²	27.5	6%	0.063	14%	0.141	C	C	.	.			trans	-68.1	143.8	176.7	-60.2	178.6	0	0	0	110.8	F112 R169 V188 V190 I195 R314	F112-L172 HydrophobicContact CD1-CD1 3.6Å; F112-L172 HydrophobicContact CE1-CD1 4.08Å; R169-L172 PolarHBondContact O-N 3.46Å; L172-V188 HydrophobicContact CD2-CG1 4.19Å; L172-V190 HydrophobicContact CD1-CG2 4.06Å; L172-V190 HydrophobicContact CD2-CG2 3.95Å; L172-I195 HydrophobicContact CD2-CG2 3.87Å; L172-R314 PolarHBondContact O-NH1 3.41Å
173	G	97.4	Very high	95.7	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	117.5	-163.6	179.2	0	0	0	0	0	114.4	W175 N187 V188 H532	G173-W175 PolarHBondContact O-NE1 2.87Å; G173-N187 PolarHBondContact O-OD1 2.91Å; G173-V188 PolarHBondContact N-O 3.43Å; G173-V188 VanDerWaalsContact N-O 3.07Å; G173-V188 PolarHBondContact O-N 3.31Å; G173-H532 VanDerWaalsContact CA-O 3.32Å; G173-H532 WeakPolarHBondContact CA-O 3.46Å
174	L	98.6	Very high	96.1	Very high	1 Å²	1	23.3 Å²	23.3	1%	0.005	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	138.4	-174.8	-160.4	70.4	0	0	0	111.3	L185 N187 I315 L317 L330 L530 A533	L174-L185 HydrophobicContact CD1-CD1 3.69Å; L174-L185 HydrophobicContact CD1-CG 4.35Å; L174-L185 HydrophobicContact CD2-CD1 4.08Å; L174-L185 HydrophobicContact CG-CD1 3.88Å; L174-N187 HydrophobicContact CD1-CB 3.92Å; L174-I315 HydrophobicContact CB-CG1 4.17Å; L174-I315 HydrophobicContact CD2-CD1 3.95Å; L174-I315 HydrophobicContact CD2-CG1 4.02Å; L174-I315 HydrophobicContact CG-CD1 3.97Å; L174-I315 HydrophobicContact CG-CG1 3.85Å; L174-I315 PolarHBondContact O-N 3.36Å; L174-I315 VanDerWaalsContact O-O 3.05Å; L174-L317 HydrophobicContact CD2-CD2 4.18Å; L174-L317 HydrophobicContact CD2-CG 4.34Å; L174-L330 HydrophobicContact CD2-CD1 4.49Å; L174-L530 HydrophobicContact CD1-CD1 4.06Å; L174-L530 HydrophobicContact CD1-CD2 4.35Å; L174-L530 HydrophobicContact CD2-CD1 4.39Å; L174-A533 HydrophobicContact CB-CB 3.85Å; L174-A533 HydrophobicContact CD2-CB 4.1Å; L174-A533 HydrophobicContact CG-CB 4.42Å
175	W	98.6	Very high	96.4	Very high	1 Å²	1	23.3 Å²	23.3	0%	0.004	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	147.2	-170.9	-53.7	87.2	0	0	0	112.3	H170 I171 G173 L186 F252 Y312 R313 R314	H170-W175 WeakPolarHBondContact O-CH2 3.39Å; H170-W175 VanDerWaalsContact O-CZ2 3.27Å; H170-W175 WeakPolarHBondContact O-CZ2 3.4Å; I171-W175 WeakPolarHBondContact O-CZ2 3.29Å; I171-W175 PolarHBondContact O-NE1 3.38Å; G173-W175 PolarHBondContact O-NE1 2.87Å; W175-L186 HydrophobicContact CB-CB 4.24Å; W175-L186 HydrophobicContact CB-CD2 4.44Å; W175-L186 PolarHBondContact N-O 2.82Å; W175-L186 PolarHBondContact O-N 3.46Å; W175-F252 AromaticContact CD1-CE1 3.96Å; W175-F252 AromaticContact CD2-CD1 3.86Å; W175-F252 HydrophobicContact CD2-CD1 3.86Å; W175-F252 AromaticContact CD2-CE1 3.45Å; W175-F252 HydrophobicContact CD2-CE1 3.45Å; W175-F252 VanDerWaalsContact CD2-CE1 3.45Å; W175-F252 AromaticContact CE2-CD1 3.88Å; W175-F252 AromaticContact CE2-CE1 3.54Å; W175-F252 AromaticContact CE3-CD1 3.73Å; W175-F252 HydrophobicContact CE3-CD1 3.73Å; W175-F252 AromaticContact CE3-CE1 3.76Å; W175-F252 HydrophobicContact CE3-CE1 3.76Å; W175-F252 AromaticContact CG-CE1 3.78Å; W175-F252 HydrophobicContact CG-CE1 3.78Å; W175-F252 AromaticContact CH2-CD1 3.75Å; W175-F252 HydrophobicContact CH2-CD1 3.75Å; W175-F252 HydrophobicContact CH2-CE1 4.28Å; W175-F252 AromaticContact CZ2-CD1 3.86Å; W175-F252 HydrophobicContact CZ2-CD1 3.86Å; W175-F252 AromaticContact CZ2-CE1 3.99Å; W175-F252 HydrophobicContact CZ2-CE1 3.99Å; W175-F252 AromaticContact CZ3-CD1 3.68Å; W175-F252 HydrophobicContact CZ3-CD1 3.68Å; W175-F252 HydrophobicContact CZ3-CE1 4.17Å; W175-F252 AromaticContact NE1-CE1 3.81Å; W175-Y312 HydrophobicContact CB-CD1 4.33Å; W175-R313 WeakPolarHBondContact CA-O 3.24Å; W175-R313 VanDerWaalsContact CE3-C 3.42Å; W175-R314 HydrophobicContact CE3-CB 3.99Å; W175-R314 VanDerWaalsContact CE3-N 3.31Å; W175-R314 HydrophobicContact CH2-CB 4.18Å; W175-R314 VanDerWaalsContact CH2-CZ 3.47Å; W175-R314 VanDerWaalsContact CZ2-CZ 3.42Å; W175-R314 VanDerWaalsContact CZ2-NH2 3.28Å; W175-R314 HydrophobicContact CZ3-CB 3.75Å
176	Q	98.5	Very high	96.7	Very high	9 Å²	9	23.3 Å²	23.3	4%	0.042	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	124.7	167.8	-174.6	179	55.1	0	0	108.6	Y312 R313 I315 L357	Q176-Y312 WeakPolarHBondContact O-CA 2.98Å; Q176-R313 PolarHBondContact N-O 2.71Å; Q176-R313 PolarHBondContact O-N 3.46Å; Q176-I315 HydrophobicContact CB-CD1 4.27Å; Q176-I315 HydrophobicContact CB-CG2 3.87Å; Q176-L357 PolarHBondContact NE2-O 3.34Å
177	P	97.8	Very high	96.9	Very high	2 Å²	2	20.7 Å²	20.7	1%	0.013	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	143.3	172.6	32.3	-33.2	0	0	0	111.1	I179 G183 G184 L310 T311 Y312	P177-I179 HydrophobicContact CB-CD1 3.86Å; P177-I179 HydrophobicContact CB-CG1 3.82Å; P177-I179 HydrophobicContact CG-CD1 3.82Å; P177-I179 HydrophobicContact CG-CG1 4.08Å; P177-I179 PolarHBondContact O-N 3.47Å; P177-I179 VanDerWaalsContact O-N 3.12Å; P177-G183 WeakPolarHBondContact O-CA 3.38Å; P177-G184 VanDerWaalsContact CD-CA 3.44Å; P177-G184 WeakPolarHBondContact CD-O 3.4Å; P177-L310 HydrophobicContact CB-CD1 4.49Å; P177-T311 WeakPolarHBondContact CA-O 3.25Å; P177-Y312 HydrophobicContact CB-CD1 3.72Å; P177-Y312 HydrophobicContact CB-CE1 3.62Å; P177-Y312 HydrophobicContact CG-CE1 4.41Å
178	D	96.7	Very high	97.2	Very high	54 Å²	54	18 Å²	18	29%	0.289	9%	0.092	S	C	.	.			trans	-82.9	82.1	177.1	-165.7	-16.5	0	0	0	110	Y306 T311 R313	D178-Y306 WeakPolarHBondContact O-CE1 3.3Å; D178-T311 PolarHBondContact N-O 3.19Å; D178-R313 IonicContact OD2-CZ 3.79Å; D178-R313 IonicContact OD2-NE 2.95Å; D178-R313 PolarHBondContact OD2-NE 2.78Å; D178-R313 IonicContact OD2-NH2 3.09Å; D178-R313 PolarHBondContact OD2-NH2 3.18Å
179	I	96.9	Very high	97.2	Very high	14 Å²	14	16.5 Å²	16.5	7%	0.072	9%	0.088	C	C	.	.			trans	-117.7	57.4	-177.4	-46	-177.1	0	0	0	109.9	P177 Y182 Y302 T303 Y306 L310	P177-I179 HydrophobicContact CB-CD1 3.86Å; P177-I179 HydrophobicContact CB-CG1 3.82Å; P177-I179 HydrophobicContact CG-CD1 3.82Å; P177-I179 HydrophobicContact CG-CG1 4.08Å; P177-I179 PolarHBondContact O-N 3.47Å; P177-I179 VanDerWaalsContact O-N 3.12Å; I179-Y182 PolarHBondContact O-N 2.94Å; I179-Y302 HydrophobicContact CG2-CD1 4.39Å; I179-Y302 HydrophobicContact CG2-CE1 4.35Å; I179-T303 HydrophobicContact CG2-CG2 3.84Å; I179-Y306 HydrophobicContact CG2-CD2 3.97Å; I179-Y306 HydrophobicContact CG2-CE2 3.7Å; I179-L310 HydrophobicContact CD1-CD1 4.22Å; I179-L310 HydrophobicContact CD1-CD2 3.76Å; I179-L310 HydrophobicContact CG1-CD2 3.66Å
180	G	95.6	Very high	97.1	Very high	20 Å²	20	12.9 Å²	12.9	21%	0.206	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.8	-130	-177.9	0	0	0	0	0	111.3	Y182 Y302 Y306	G180-Y182 PolarHBondContact O-N 2.8Å; G180-Y302 WeakPolarHBondContact CA-OH 3.2Å; G180-Y306 PolarHBondContact N-OH 3.35Å
181	P	97.4	Very high	96.5	Very high	28 Å²	28	11.1 Å²	11.1	18%	0.182	7%	0.069	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-12.9	-178.5	32.1	-35.7	0	0	0	114.1	G359 D360 P361 P364 A365	P181-G359 CarbonylContact O-C 3.59Å; P181-G359 WeakPolarHBondContact O-CA 3.42Å; P181-D360 WeakPolarHBondContact CB-O 3.33Å; P181-D360 PolarHBondContact O-N 2.79Å; P181-P361 HydrophobicContact CG-CG 4.34Å; P181-P364 HydrophobicContact CB-CB 4.11Å; P181-P364 HydrophobicContact CB-CG 4.23Å; P181-A365 PolarHBondContact O-N 2.62Å
182	Y	98.3	Very high	95.5	Very high	14 Å²	14	11.2 Å²	11.2	6%	0.055	7%	0.07	C	C	.	.			trans	-84.1	-30.3	-168.5	-61	-68.3	0	0	0	114.1	I179 G180 K299 Y302 T303 T358 G359 P361	I179-Y182 PolarHBondContact O-N 2.94Å; G180-Y182 PolarHBondContact O-N 2.8Å; Y182-K299 HydrophobicContact CD1-CD 3.8Å; Y182-K299 HydrophobicContact CD1-CG 3.81Å; Y182-K299 HydrophobicContact CE1-CB 3.78Å; Y182-K299 HydrophobicContact CE1-CD 3.75Å; Y182-K299 HydrophobicContact CE1-CG 3.56Å; Y182-K299 HydrophobicContact CE2-CG 4.37Å; Y182-K299 HydrophobicContact CG-CG 4.31Å; Y182-K299 WeakPolarHBondContact OH-CA 3.49Å; Y182-Y302 AromaticContact CD2-CD1 3.71Å; Y182-Y302 HydrophobicContact CD2-CD1 3.71Å; Y182-Y302 HydrophobicContact CD2-CE1 4.2Å; Y182-Y302 HydrophobicContact CD2-CG 4.46Å; Y182-Y302 AromaticContact CE2-CD1 3.59Å; Y182-Y302 HydrophobicContact CE2-CD1 3.59Å; Y182-Y302 HydrophobicContact CE2-CE1 4.31Å; Y182-Y302 AromaticContact CE2-CG 3.89Å; Y182-Y302 HydrophobicContact CE2-CG 3.89Å; Y182-T303 HydrophobicContact CD2-CG2 3.93Å; Y182-T303 HydrophobicContact CE2-CG2 4.44Å; Y182-T303 HydrophobicContact CG-CG2 4.32Å; Y182-T358 WeakPolarHBondContact O-CA 3.32Å; Y182-T358 WeakPolarHBondContact O-CB 3.47Å; Y182-G359 WeakPolarHBondContact CA-O 3.25Å; Y182-G359 PolarHBondContact O-N 3.17Å; Y182-G359 VanDerWaalsContact O-N 3.07Å; Y182-P361 HydrophobicContact CE1-CG 4.39Å
183	G	97.9	Very high	94.6	Very high	7 Å²	7	11 Å²	11	7%	0.072	7%	0.069	C	C	.	.	B	Isolated β-bridge	trans	56.3	-141.3	-175.9	0	0	0	0	0	113.2	P177	P177-G183 WeakPolarHBondContact O-CA 3.38Å
184	G	97.8	Very high	94	Very high	8 Å²	8	11.6 Å²	11.6	8%	0.082	7%	0.072	C	C	.	.			trans	156.4	177.6	-175.7	0	0	0	0	0	112.4	P177 L357	P177-G184 VanDerWaalsContact CD-CA 3.44Å; P177-G184 WeakPolarHBondContact CD-O 3.4Å; G184-L357 PolarHBondContact N-O 3.48Å; G184-L357 VanDerWaalsContact N-O 3.1Å
185	L	98.6	Very high	93.8	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	117.5	174	-173.4	63.2	0	0	0	109.9	L174 M199 Y200 I315 L330 I342 L357 L526	L174-L185 HydrophobicContact CD1-CD1 3.69Å; L174-L185 HydrophobicContact CD1-CG 4.35Å; L174-L185 HydrophobicContact CD2-CD1 4.08Å; L174-L185 HydrophobicContact CG-CD1 3.88Å; L185-M199 WeakPolarHBondContact O-CA 3.34Å; L185-Y200 HydrophobicContact CD2-CG 4.36Å; L185-Y200 PolarHBondContact O-N 3.16Å; L185-I315 HydrophobicContact CD1-CD1 3.85Å; L185-L330 HydrophobicContact CD1-CD1 4.25Å; L185-L330 HydrophobicContact CD2-CD1 3.72Å; L185-I342 HydrophobicContact CB-CD1 4Å; L185-I342 HydrophobicContact CD2-CD1 4.24Å; L185-L357 HydrophobicContact CD1-CD1 4.07Å; L185-L526 HydrophobicContact CD2-CD1 4.08Å
186	L	98.7	Very high	93.7	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	130.9	174.5	-177.3	86.9	0	0	0	109.3	W175 V188 W198 M199 L217 F218 F252 Y312	W175-L186 HydrophobicContact CB-CB 4.24Å; W175-L186 HydrophobicContact CB-CD2 4.44Å; W175-L186 PolarHBondContact N-O 2.82Å; W175-L186 PolarHBondContact O-N 3.46Å; L186-V188 HydrophobicContact CD2-CG2 3.55Å; L186-V188 HydrophobicContact CG-CG2 4.11Å; L186-W198 WeakPolarHBondContact CA-O 3.36Å; L186-M199 HydrophobicContact CD1-CB 4.32Å; L186-L217 HydrophobicContact CD1-CD1 4.1Å; L186-L217 HydrophobicContact CD1-CG 4.46Å; L186-F218 HydrophobicContact CD2-CE1 3.96Å; L186-F218 HydrophobicContact CD2-CZ 4.42Å; L186-F252 HydrophobicContact CD2-CE1 4.45Å; L186-F252 HydrophobicContact CD2-CZ 3.76Å; L186-Y312 HydrophobicContact CB-CD1 4.14Å; L186-Y312 HydrophobicContact CB-CE1 4.01Å; L186-Y312 HydrophobicContact CD1-CE1 4.38Å; L186-Y312 HydrophobicContact CD2-CD1 3.64Å; L186-Y312 HydrophobicContact CD2-CE1 3.52Å; L186-Y312 HydrophobicContact CD2-CE2 4.46Å; L186-Y312 HydrophobicContact CD2-CG 4.15Å; L186-Y312 HydrophobicContact CG-CD1 4.46Å; L186-Y312 HydrophobicContact CG-CE1 4.17Å
187	N	98.3	Very high	93.6	Very high	1 Å²	1	11.1 Å²	11.1	1%	0.005	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	120.9	168.6	-170	20.1	0	0	0	110	G173 L174 V189 W198 Y200 L530 P531	G173-N187 PolarHBondContact O-OD1 2.91Å; L174-N187 HydrophobicContact CD1-CB 3.92Å; N187-V189 VanDerWaalsContact ND2-CG1 3.33Å; N187-V189 WeakPolarHBondContact ND2-CG1 3.31Å; N187-W198 PolarHBondContact N-O 3.35Å; N187-W198 PolarHBondContact O-N 3.07Å; N187-Y200 HydrophobicContact CB-CD2 4.33Å; N187-Y200 HydrophobicContact CB-CE2 3.79Å; N187-L530 HydrophobicContact CB-CD2 4.1Å; N187-L530 WeakPolarHBondContact ND2-CA 3.45Å; N187-P531 WeakPolarHBondContact ND2-CD 3.23Å; N187-P531 PolarHBondContact OD1-O 3.25Å
188	V	97.9	Very high	93.6	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	116.2	179.8	-174.3	0	0	0	0	108.8	I171 L172 G173 L186 I195 I196 F218 F252	I171-V188 HydrophobicContact CD1-CG1 4.07Å; I171-V188 HydrophobicContact CG1-CG1 4.21Å; I171-V188 WeakPolarHBondContact O-CB 3.31Å; I171-V188 WeakPolarHBondContact O-CG1 3.39Å; I171-V188 WeakPolarHBondContact O-CG2 3.46Å; L172-V188 HydrophobicContact CD2-CG1 4.19Å; G173-V188 PolarHBondContact N-O 3.43Å; G173-V188 VanDerWaalsContact N-O 3.07Å; G173-V188 PolarHBondContact O-N 3.31Å; L186-V188 HydrophobicContact CD2-CG2 3.55Å; L186-V188 HydrophobicContact CG-CG2 4.11Å; V188-I195 HydrophobicContact CG1-CG2 3.54Å; V188-I196 WeakPolarHBondContact CA-O 3.44Å; V188-F218 HydrophobicContact CG1-CE2 4.29Å; V188-F218 HydrophobicContact CG1-CZ 4.17Å; V188-F218 HydrophobicContact CG2-CZ 3.79Å; V188-F252 HydrophobicContact CG2-CE1 4.36Å; V188-F252 HydrophobicContact CG2-CZ 4.03Å
189	V	94.8	Very high	93.6	Very high	16 Å²	16	10.4 Å²	10.4	10%	0.097	6%	0.063	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	155.8	-170.3	-55.7	0	0	0	0	111.8	N187 I195 I196 P531	N187-V189 VanDerWaalsContact ND2-CG1 3.33Å; N187-V189 WeakPolarHBondContact ND2-CG1 3.31Å; V189-I195 CarbonylContact O-C 3.54Å; V189-I195 WeakPolarHBondContact O-CA 3.39Å; V189-I196 PolarHBondContact N-O 3.44Å; V189-I196 PolarHBondContact O-N 3.1Å; V189-P531 HydrophobicContact CG1-CB 4.1Å; V189-P531 HydrophobicContact CG1-CG 4.03Å
190	V	91.2	Very high	93.6	Very high	20 Å²	20	10.2 Å²	10.2	12%	0.121	6%	0.061	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	124.1	168.4	-177	0	0	0	0	108.7	F112 M114 L165 L172 I195	F112-V190 HydrophobicContact CB-CG2 4.34Å; M114-V190 HydrophobicContact CB-CG1 4.18Å; M114-V190 HydrophobicContact CG-CG1 3.98Å; L165-V190 HydrophobicContact CD2-CB 4.41Å; L165-V190 HydrophobicContact CD2-CG1 3.74Å; L165-V190 HydrophobicContact CD2-CG2 3.71Å; L172-V190 HydrophobicContact CD1-CG2 4.06Å; L172-V190 HydrophobicContact CD2-CG2 3.95Å; V190-I195 HydrophobicContact CG2-CG1 4.36Å
191	D	81.6	Confident	93.6	Very high	27 Å²	27	10.1 Å²	10.1	14%	0.144	6%	0.056	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	95.4	174.4	-167.9	0.7	0	0	0	109.6	R135 L193 F194 I196	R135-D191 WeakPolarHBondContact CD-OD2 3.29Å; R135-D191 IonicContact CZ-OD1 2.69Å; R135-D191 IonicContact CZ-OD2 3.81Å; R135-D191 IonicContact NE-OD2 2.78Å; R135-D191 IonicContact NH1-OD1 3.75Å; R135-D191 PolarHBondContact NH1-OD1 3.45Å; R135-D191 IonicContact NH1-OD2 3.87Å; R135-D191 PolarHBondContact NH1-OD2 3.34Å; D191-L193 PolarHBondContact O-N 3.34Å; D191-F194 PolarHBondContact N-O 2.87Å; D191-F194 WeakPolarHBondContact O-CB 3.49Å; D191-F194 PolarHBondContact O-N 2.91Å; D191-I196 HydrophobicContact CB-CD1 3.84Å
192	G	76.3	Confident	93.6	Very high	2 Å²	2	9.6 Å²	9.6	2%	0.021	5%	0.053	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.5	-120.7	-174.9	0	0	0	0	0	112.3	E116 F194	E116-G192 WeakPolarHBondContact OE2-CA 3.49Å; G192-F194 VanDerWaalsContact C-N 3.28Å
193	L	77.5	Confident	93.5	Very high	8 Å²	8	9.2 Å²	9.2	4%	0.042	5%	0.052	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	9.4	176.4	-65.4	173.3	0	0	0	113.4	L118 Y152 M155 V160 L164 D191	L118-L193 HydrophobicContact CD2-CD1 4.2Å; L118-L193 HydrophobicContact CD2-CD2 3.57Å; L118-L193 HydrophobicContact CD2-CG 3.96Å; Y152-L193 HydrophobicContact CE1-CD1 4.21Å; M155-L193 HydrophobicContact CE-CD1 3.29Å; M155-L193 HydrophobicContact CE-CD2 3.3Å; M155-L193 HydrophobicContact CE-CG 3.83Å; V160-L193 HydrophobicContact CG2-CD2 3.7Å; L164-L193 WeakPolarHBondContact CD2-O 3.45Å; D191-L193 PolarHBondContact O-N 3.34Å
194	F	86.1	Confident	93.4	Very high	12 Å²	12	10.4 Å²	10.4	5%	0.053	6%	0.055	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	144.6	179.1	-61.1	-90.3	0	0	0	111	Y132 D191 G192 I196 R219 I220 H221	Y132-F194 HydrophobicContact CD2-CD2 4.44Å; Y132-F194 HydrophobicContact CD2-CG 4.47Å; D191-F194 PolarHBondContact N-O 2.87Å; D191-F194 WeakPolarHBondContact O-CB 3.49Å; D191-F194 PolarHBondContact O-N 2.91Å; G192-F194 VanDerWaalsContact C-N 3.28Å; F194-I196 HydrophobicContact CB-CD1 4.06Å; F194-I196 HydrophobicContact CB-CG1 3.76Å; F194-R219 HydrophobicContact CD1-CB 4.37Å; F194-R219 HydrophobicContact CD1-CG 4.37Å; F194-I220 CarbonylContact C-O 3.53Å; F194-I220 VanDerWaalsContact CA-O 3.25Å; F194-I220 WeakPolarHBondContact CA-O 3.47Å; F194-H221 HydrophobicContact CD1-CB 3.39Å; F194-H221 HydrophobicContact CE1-CB 3.41Å; F194-H221 VanDerWaalsContact CE1-CB 3.41Å; F194-H221 AromaticContact CE1-CG 3.67Å; F194-H221 HydrophobicContact CG-CB 4.25Å; F194-H221 HydrophobicContact CZ-CB 4.33Å
195	I	93.8	Very high	93.2	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	6%	0.055	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	124.4	154.3	-61.6	173	0	0	0	106.3	L164 Y168 I171 L172 V188 V189 V190 R219 I220	L164-I195 HydrophobicContact CD1-CD1 3.9Å; L164-I195 HydrophobicContact CD1-CG1 4.14Å; L164-I195 HydrophobicContact CG-CD1 3.99Å; L164-I195 HydrophobicContact CG-CG1 4.2Å; Y168-I195 HydrophobicContact CD2-CD1 4.45Å; Y168-I195 HydrophobicContact CG-CD1 4.26Å; I171-I195 HydrophobicContact CD1-CG2 4.25Å; L172-I195 HydrophobicContact CD2-CG2 3.87Å; V188-I195 HydrophobicContact CG1-CG2 3.54Å; V189-I195 CarbonylContact O-C 3.54Å; V189-I195 WeakPolarHBondContact O-CA 3.39Å; V190-I195 HydrophobicContact CG2-CG1 4.36Å; I195-R219 CarbonylContact O-C 3.6Å; I195-R219 WeakPolarHBondContact O-CA 3.16Å; I195-I220 HydrophobicContact CB-CB 4.12Å; I195-I220 HydrophobicContact CB-CD1 4.32Å; I195-I220 HydrophobicContact CB-CG1 4.33Å; I195-I220 HydrophobicContact CG2-CD1 4.34Å; I195-I220 PolarHBondContact N-O 2.7Å; I195-I220 PolarHBondContact O-N 2.91Å
196	I	95.3	Very high	92.9	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	7%	0.065	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	128.9	-174.2	-53.7	168.1	0	0	0	109.4	Y132 V188 V189 D191 F194 W198 P216 R219	Y132-I196 HydrophobicContact CD2-CD1 3.9Å; Y132-I196 HydrophobicContact CE2-CD1 3.63Å; Y132-I196 HydrophobicContact CE2-CG1 4.24Å; V188-I196 WeakPolarHBondContact CA-O 3.44Å; V189-I196 PolarHBondContact N-O 3.44Å; V189-I196 PolarHBondContact O-N 3.1Å; D191-I196 HydrophobicContact CB-CD1 3.84Å; F194-I196 HydrophobicContact CB-CD1 4.06Å; F194-I196 HydrophobicContact CB-CG1 3.76Å; I196-W198 HydrophobicContact CD1-CZ2 4Å; I196-W198 HydrophobicContact CG2-CD2 3.92Å; I196-W198 HydrophobicContact CG2-CG 4.12Å; I196-W198 HydrophobicContact CG2-CZ2 3.96Å; I196-P216 HydrophobicContact CG2-CB 3.93Å; I196-R219 HydrophobicContact CG1-CB 4.3Å
197	G	97.4	Very high	92.7	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	101.8	167.3	0	0	0	0	0	110.6	P216 L217 F218	G197-P216 WeakPolarHBondContact O-CA 3.48Å; G197-L217 PolarHBondContact O-N 3.11Å; G197-F218 PolarHBondContact N-O 3.1Å; G197-F218 VanDerWaalsContact N-O 3.12Å
198	W	96.8	Very high	92.6	Very high	29 Å²	29	17.2 Å²	17.2	11%	0.11	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	114.4	176.8	-69.8	104.1	0	0	0	110.7	V136 L186 N187 I196 Y200 R214 P216	V136-W198 HydrophobicContact CB-CH2 4.41Å; V136-W198 HydrophobicContact CG2-CH2 3.61Å; V136-W198 HydrophobicContact CG2-CZ2 4.15Å; L186-W198 WeakPolarHBondContact CA-O 3.36Å; N187-W198 PolarHBondContact N-O 3.35Å; N187-W198 PolarHBondContact O-N 3.07Å; I196-W198 HydrophobicContact CD1-CZ2 4Å; I196-W198 HydrophobicContact CG2-CD2 3.92Å; I196-W198 HydrophobicContact CG2-CG 4.12Å; I196-W198 HydrophobicContact CG2-CZ2 3.96Å; W198-Y200 HydrophobicContact CB-CD2 4.34Å; W198-Y200 HydrophobicContact CB-CE2 3.81Å; W198-Y200 WeakPolarHBondContact O-CD2 3.32Å; W198-R214 HydrophobicContact CE3-CB 4.3Å; W198-P216 HydrophobicContact CE3-CB 4.24Å; W198-P216 HydrophobicContact CH2-CB 4.44Å; W198-P216 HydrophobicContact CZ3-CB 4.09Å; W198-P216 HydrophobicContact CZ3-CG 4.18Å
199	M	96.7	Very high	92.5	Very high	13 Å²	13	22 Å²	22	6%	0.064	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	126.4	169.4	173.3	170.5	-91.7	0	0	109.2	L185 L186 L201 R214 R215 L217	L185-M199 WeakPolarHBondContact O-CA 3.34Å; L186-M199 HydrophobicContact CD1-CB 4.32Å; M199-L201 HydrophobicContact CG-CD2 4.23Å; M199-L201 HydrophobicContact CG-CG 4.16Å; M199-L201 HydrophobicContact SD-CD2 4.22Å; M199-R214 VanDerWaalsContact O-CA 3.31Å; M199-R214 WeakPolarHBondContact O-CA 3.3Å; M199-R215 HydrophobicContact CB-CG 4.14Å; M199-R215 PolarHBondContact N-O 2.84Å; M199-R215 PolarHBondContact O-N 2.8Å; M199-L217 HydrophobicContact CB-CD1 3.89Å; M199-L217 HydrophobicContact CB-CD2 4.27Å; M199-L217 HydrophobicContact CB-CG 3.77Å; M199-L217 HydrophobicContact CE-CD1 3.54Å; M199-L217 HydrophobicContact CG-CD1 4.47Å; M199-L217 HydrophobicContact SD-CD1 3.92Å; M199-L217 HydrophobicContact SD-CD2 4.12Å; M199-L217 HydrophobicContact SD-CG 4.32Å
200	Y	97.8	Very high	92.5	Very high	9 Å²	9	24.2 Å²	24.2	4%	0.035	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	128.7	176.7	-76.6	-109	0	0	0	109	L185 N187 W198 M212 R213 R214 D528 L530	L185-Y200 HydrophobicContact CD2-CG 4.36Å; L185-Y200 PolarHBondContact O-N 3.16Å; N187-Y200 HydrophobicContact CB-CD2 4.33Å; N187-Y200 HydrophobicContact CB-CE2 3.79Å; W198-Y200 HydrophobicContact CB-CD2 4.34Å; W198-Y200 HydrophobicContact CB-CE2 3.81Å; W198-Y200 WeakPolarHBondContact O-CD2 3.32Å; Y200-M212 HydrophobicContact CD1-CB 4Å; Y200-M212 HydrophobicContact CD1-CG 4.33Å; Y200-R213 WeakPolarHBondContact CA-O 3.31Å; Y200-R214 HydrophobicContact CD1-CG 3.76Å; Y200-R214 HydrophobicContact CD2-CG 4.46Å; Y200-R214 HydrophobicContact CE1-CG 3.73Å; Y200-R214 HydrophobicContact CE2-CG 4.39Å; Y200-R214 HydrophobicContact CG-CG 4.15Å; Y200-R214 VanDerWaalsContact CZ-CD 3.41Å; Y200-D528 HydrophobicContact CE1-CB 3.71Å; Y200-L530 HydrophobicContact CE1-CD2 3.93Å; Y200-L530 HydrophobicContact CE2-CD2 3.97Å
201	L	96.3	Very high	92.7	Very high	19 Å²	19	27.9 Å²	27.9	10%	0.099	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	139.8	-178.1	-61.5	154.5	0	0	0	108.5	M199 M212 R213 R215	M199-L201 HydrophobicContact CG-CD2 4.23Å; M199-L201 HydrophobicContact CG-CG 4.16Å; M199-L201 HydrophobicContact SD-CD2 4.22Å; L201-M212 VanDerWaalsContact O-CE 3.29Å; L201-M212 WeakPolarHBondContact O-CE 3.4Å; L201-R213 HydrophobicContact CB-CB 4.15Å; L201-R213 PolarHBondContact N-O 3Å; L201-R213 PolarHBondContact O-N 2.58Å; L201-R215 HydrophobicContact CD1-CG 4.19Å
202	P	96.6	Very high	93.4	Very high	16 Å²	16	27.2 Å²	27.2	10%	0.104	14%	0.138	C	C	.	.			trans	-61.5	157.5	176.7	27.6	-34.1	0	0	0	110.6	R213 L340	P202-R213 PolarHBondContact O-NE 2.95Å; P202-R213 PolarHBondContact O-NH2 3.3Å; P202-L340 HydrophobicContact CB-CB 3.87Å; P202-L340 HydrophobicContact CB-CD1 4.49Å; P202-L340 HydrophobicContact CG-CB 4.31Å
203	P	96.4	Very high	94.3	Very high	6 Å²	6	29.8 Å²	29.8	4%	0.039	15%	0.147	C	C	.	.			trans	-62	175.2	169.6	28.6	-34.7	0	0	0	111.2	R207 D210 K332 L340	P203-R207 WeakPolarHBondContact CG-O 3.32Å; P203-D210 HydrophobicContact CB-CB 3.47Å; P203-D210 VanDerWaalsContact CB-CB 3.47Å; P203-D210 HydrophobicContact CG-CB 3.9Å; P203-K332 HydrophobicContact CG-CD 3.97Å; P203-L340 HydrophobicContact CG-CD1 3.75Å; P203-L340 WeakPolarHBondContact O-CD1 3.4Å
204	H	95.8	Very high	95	Very high	32 Å²	32	36.2 Å²	36.2	15%	0.148	17%	0.17	C	C	.	.	S	Bend	trans	-70.5	140.9	178.1	-52.4	151.9	0	0	0	111	R207 E278 E279 W280 G281	H204-R207 PolarHBondContact ND1-NH2 2.81Å; H204-R207 WeakPolarHBondContact O-CB 3.38Å; H204-R207 PolarHBondContact O-N 2.82Å; H204-E278 PolarHBondContact NE2-O 2.89Å; H204-E279 VanDerWaalsContact CD2-C 3.48Å; H204-E279 PolarHBondContact CD2-O 2.94Å; H204-E279 VanDerWaalsContact CD2-O 3.23Å; H204-W280 WeakPolarHBondContact CB-O 3.44Å; H204-G281 WeakPolarHBondContact CE1-CA 3.26Å; H204-G281 PolarHBondContact CE1-N 3.07Å; H204-G281 PolarHBondContact NE2-N 3.14Å
205	D	93.4	Very high	95.2	Very high	14 Å²	14	38.3 Å²	38.3	8%	0.075	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	139.2	174.7	-177.8	77.6	0	0	0	111.8	W280 L340	D205-W280 HydrophobicContact CB-CE3 4.1Å; D205-W280 HydrophobicContact CB-CZ3 3.65Å; D205-L340 HydrophobicContact CB-CG 4.33Å
206	P	93.4	Very high	95.2	Very high	31 Å²	31	39.2 Å²	39.2	20%	0.201	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	cis	-99.8	27	-2.6	40.5	-36.8	0	0	0	113	V208 R469 N470	P206-V208 PolarHBondContact O-N 3.45Å; P206-R469 HydrophobicContact CB-CB 3.94Å; P206-N470 WeakPolarHBondContact CB-OD1 3.45Å; P206-N470 VanDerWaalsContact O-CG 3.23Å; P206-N470 PolarHBondContact O-ND2 2.65Å; P206-N470 PolarHBondContact O-OD1 3.08Å
207	R	94.4	Very high	95.2	Very high	108 Å²	108	39.2 Å²	39.2	41%	0.408	18%	0.184	S	C	.	.			trans	-77.3	66.4	-169.4	-57.4	-169.1	-60.6	-94.8	-0.5	112.6	P203 H204 E209 D210	P203-R207 WeakPolarHBondContact CG-O 3.32Å; H204-R207 PolarHBondContact ND1-NH2 2.81Å; H204-R207 WeakPolarHBondContact O-CB 3.38Å; H204-R207 PolarHBondContact O-N 2.82Å; R207-E209 PolarHBondContact O-N 2.9Å; R207-E209 VanDerWaalsContact O-N 3.13Å; R207-D210 HydrophobicContact CB-CB 4.19Å; R207-D210 WeakPolarHBondContact CB-OD2 3.22Å; R207-D210 VanDerWaalsContact CD-OD2 3.28Å; R207-D210 WeakPolarHBondContact CD-OD2 3.49Å; R207-D210 IonicContact CZ-OD2 3.5Å; R207-D210 IonicContact NE-OD2 3.96Å; R207-D210 PolarHBondContact NE-OD2 3.42Å; R207-D210 IonicContact NH2-OD2 2.71Å; R207-D210 WeakPolarHBondContact O-CB 3.42Å; R207-D210 PolarHBondContact O-N 3.2Å; R207-D210 VanDerWaalsContact O-N 3.09Å
208	V	95.6	Very high	95.2	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-21.8	-173.2	76.3	0	0	0	0	113.9	P206 K332 L340 L522 S524	P206-V208 PolarHBondContact O-N 3.45Å; V208-K332 VanDerWaalsContact CG2-C 3.48Å; V208-K332 HydrophobicContact CG2-CB 3.77Å; V208-K332 WeakPolarHBondContact CG2-O 3.48Å; V208-K332 WeakPolarHBondContact O-CE 3.4Å; V208-L340 HydrophobicContact CB-CD2 4.45Å; V208-L522 HydrophobicContact CG1-CD2 3.75Å; V208-L522 HydrophobicContact CG1-CG 3.98Å; V208-S524 WeakPolarHBondContact O-CB 3.35Å
209	E	95.4	Very high	95.1	Very high	101 Å²	101	38.9 Å²	38.9	47%	0.472	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-11.9	178.9	-61.9	-172.5	167.9	0	0	113.5	R207 R509	R207-E209 PolarHBondContact O-N 2.9Å; R207-E209 VanDerWaalsContact O-N 3.13Å; E209-R509 WeakPolarHBondContact OE1-CD 3.2Å; E209-R509 IonicContact OE1-CZ 3.65Å; E209-R509 IonicContact OE1-NE 3.77Å; E209-R509 IonicContact OE1-NH1 2.74Å; E209-R509 PolarHBondContact OE1-NH1 2.78Å; E209-R509 IonicContact OE2-NH1 3.85Å
210	D	95.6	Very high	94.9	Very high	61 Å²	61	38.3 Å²	38.3	33%	0.326	18%	0.18	S	C	.	.	S	Bend	trans	-65.4	153.1	178.2	-77.5	4.2	0	0	0	111.1	P203 R207 K332	P203-D210 HydrophobicContact CB-CB 3.47Å; P203-D210 VanDerWaalsContact CB-CB 3.47Å; P203-D210 HydrophobicContact CG-CB 3.9Å; R207-D210 HydrophobicContact CB-CB 4.19Å; R207-D210 WeakPolarHBondContact CB-OD2 3.22Å; R207-D210 VanDerWaalsContact CD-OD2 3.28Å; R207-D210 WeakPolarHBondContact CD-OD2 3.49Å; R207-D210 IonicContact CZ-OD2 3.5Å; R207-D210 IonicContact NE-OD2 3.96Å; R207-D210 PolarHBondContact NE-OD2 3.42Å; R207-D210 IonicContact NH2-OD2 2.71Å; R207-D210 WeakPolarHBondContact O-CB 3.42Å; R207-D210 PolarHBondContact O-N 3.2Å; R207-D210 VanDerWaalsContact O-N 3.09Å; D210-K332 WeakPolarHBondContact O-CE 3.42Å
211	P	95.4	Very high	94.4	Very high	97 Å²	97	38.3 Å²	38.3	63%	0.63	18%	0.18	S	C	*	.	P	Polyproline II helix	trans	-65.7	156.7	178	27.9	-35.5	0	0	0	112.1
212	M	95.9	Very high	93.7	Very high	14 Å²	14	37.7 Å²	37.7	7%	0.069	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-63.1	140.5	175.4	-65.2	-62.9	-72.7	0	0	111.2	Y200 L201 K332 I342 L526	Y200-M212 HydrophobicContact CD1-CB 4Å; Y200-M212 HydrophobicContact CD1-CG 4.33Å; L201-M212 VanDerWaalsContact O-CE 3.29Å; L201-M212 WeakPolarHBondContact O-CE 3.4Å; M212-K332 HydrophobicContact SD-CD 3.7Å; M212-K332 HydrophobicContact SD-CG 3.72Å; M212-I342 HydrophobicContact CE-CD1 3.55Å; M212-I342 HydrophobicContact CE-CG1 4.19Å; M212-L526 HydrophobicContact CE-CD1 3.91Å; M212-L526 HydrophobicContact CG-CD1 3.57Å; M212-L526 HydrophobicContact CG-CG 3.71Å; M212-L526 HydrophobicContact SD-CD1 3.84Å; M212-L526 HydrophobicContact SD-CG 4.38Å
213	R	94.7	Very high	92.3	Very high	56 Å²	56	40.2 Å²	40.2	21%	0.211	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	147	165.1	-63.6	177.5	-65.6	117.6	2.7	108.3	Y200 L201 P202 E278 E279	Y200-R213 WeakPolarHBondContact CA-O 3.31Å; L201-R213 HydrophobicContact CB-CB 4.15Å; L201-R213 PolarHBondContact N-O 3Å; L201-R213 PolarHBondContact O-N 2.58Å; P202-R213 PolarHBondContact O-NE 2.95Å; P202-R213 PolarHBondContact O-NH2 3.3Å; R213-E278 PolarHBondContact NH1-O 2.77Å; R213-E279 IonicContact CZ-OE1 3.75Å; R213-E279 VanDerWaalsContact CZ-OE1 3.26Å; R213-E279 IonicContact NH1-OE1 3.75Å; R213-E279 PolarHBondContact NH1-OE1 2.85Å; R213-E279 IonicContact NH2-OE1 3.34Å; R213-E279 PolarHBondContact NH2-OE1 2.77Å
214	R	91.3	Very high	90.6	Very high	142 Å²	142	46.2 Å²	46.2	54%	0.536	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	140.4	-179.6	-63.7	-178.8	-64.7	-178.4	-6.8	110.7	W198 M199 Y200 D528	W198-R214 HydrophobicContact CE3-CB 4.3Å; M199-R214 VanDerWaalsContact O-CA 3.31Å; M199-R214 WeakPolarHBondContact O-CA 3.3Å; Y200-R214 HydrophobicContact CD1-CG 3.76Å; Y200-R214 HydrophobicContact CD2-CG 4.46Å; Y200-R214 HydrophobicContact CE1-CG 3.73Å; Y200-R214 HydrophobicContact CE2-CG 4.39Å; Y200-R214 HydrophobicContact CG-CG 4.15Å; Y200-R214 VanDerWaalsContact CZ-CD 3.41Å; R214-D528 IonicContact CZ-OD1 3.8Å; R214-D528 IonicContact NE-OD1 2.76Å; R214-D528 IonicContact NH1-OD1 3.97Å
215	R	90.4	Very high	88.7	Confident	56 Å²	56	48.4 Å²	48.4	21%	0.211	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	144	171.8	66.6	-178.4	-175.5	-175.9	0.6	111.3	M199 L201 L217 E278	M199-R215 HydrophobicContact CB-CG 4.14Å; M199-R215 PolarHBondContact N-O 2.84Å; M199-R215 PolarHBondContact O-N 2.8Å; L201-R215 HydrophobicContact CD1-CG 4.19Å; R215-L217 HydrophobicContact CG-CD2 4.47Å; R215-E278 IonicContact NH1-OE2 2.87Å
216	P	94.3	Very high	87.5	Confident	19 Å²	19	53.2 Å²	53.2	12%	0.123	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	135.9	174	33	-32.5	0	0	0	109.8	V136 I196 G197 W198 M233	V136-P216 HydrophobicContact CG1-CG 3.79Å; I196-P216 HydrophobicContact CG2-CB 3.93Å; G197-P216 WeakPolarHBondContact O-CA 3.48Å; W198-P216 HydrophobicContact CE3-CB 4.24Å; W198-P216 HydrophobicContact CH2-CB 4.44Å; W198-P216 HydrophobicContact CZ3-CB 4.09Å; W198-P216 HydrophobicContact CZ3-CG 4.18Å; P216-M233 HydrophobicContact CB-CB 4.19Å; P216-M233 HydrophobicContact CB-CG 4.27Å; P216-M233 HydrophobicContact CG-CB 4.2Å; P216-M233 HydrophobicContact CG-CE 4.34Å; P216-M233 WeakPolarHBondContact O-CB 3.36Å
217	L	96	Very high	87	Confident	1 Å²	1	59 Å²	59	1%	0.005	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	-30.6	172.7	-68.9	-169.9	0	0	0	113.2	L186 G197 M199 R215 M233 Y234 N308 L310 Y312	L186-L217 HydrophobicContact CD1-CD1 4.1Å; L186-L217 HydrophobicContact CD1-CG 4.46Å; G197-L217 PolarHBondContact O-N 3.11Å; M199-L217 HydrophobicContact CB-CD1 3.89Å; M199-L217 HydrophobicContact CB-CD2 4.27Å; M199-L217 HydrophobicContact CB-CG 3.77Å; M199-L217 HydrophobicContact CE-CD1 3.54Å; M199-L217 HydrophobicContact CG-CD1 4.47Å; M199-L217 HydrophobicContact SD-CD1 3.92Å; M199-L217 HydrophobicContact SD-CD2 4.12Å; M199-L217 HydrophobicContact SD-CG 4.32Å; R215-L217 HydrophobicContact CG-CD2 4.47Å; L217-M233 PolarHBondContact O-N 2.92Å; L217-Y234 HydrophobicContact CD2-CD2 4.08Å; L217-N308 PolarHBondContact O-ND2 2.68Å; L217-L310 HydrophobicContact CD1-CD1 4.42Å; L217-Y312 WeakPolarHBondContact CD1-OH 3.45Å
218	F	96.8	Very high	86.7	Confident	3 Å²	3	54.5 Å²	54.5	1%	0.013	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	161.9	174.3	63.1	-94.2	0	0	0	109.8	I171 L186 V188 G197 I220 E231 I244 F252 T254	I171-F218 HydrophobicContact CD1-CE2 4.21Å; L186-F218 HydrophobicContact CD2-CE1 3.96Å; L186-F218 HydrophobicContact CD2-CZ 4.42Å; V188-F218 HydrophobicContact CG1-CE2 4.29Å; V188-F218 HydrophobicContact CG1-CZ 4.17Å; V188-F218 HydrophobicContact CG2-CZ 3.79Å; G197-F218 PolarHBondContact N-O 3.1Å; G197-F218 VanDerWaalsContact N-O 3.12Å; F218-I220 HydrophobicContact CD2-CG1 4.33Å; F218-E231 CarbonylContact C-O 3.58Å; F218-E231 WeakPolarHBondContact CA-O 3.42Å; F218-E231 WeakPolarHBondContact CB-O 3.5Å; F218-I244 HydrophobicContact CD2-CD1 3.64Å; F218-I244 HydrophobicContact CE2-CD1 3.63Å; F218-I244 HydrophobicContact CG-CD1 4.3Å; F218-I244 HydrophobicContact CZ-CD1 4.28Å; F218-F252 AromaticContact CE1-CE2 3.96Å; F218-F252 HydrophobicContact CE1-CE2 3.96Å; F218-F252 HydrophobicContact CE1-CZ 4.1Å; F218-F252 AromaticContact CZ-CE2 3.9Å; F218-F252 HydrophobicContact CZ-CE2 3.9Å; F218-F252 AromaticContact CZ-CZ 3.97Å; F218-F252 HydrophobicContact CZ-CZ 3.97Å; F218-T254 HydrophobicContact CD1-CG2 3.56Å; F218-T254 HydrophobicContact CE1-CG2 3.82Å; F218-T254 HydrophobicContact CG-CG2 4.23Å
219	R	94.6	Very high	86.5	Confident	19 Å²	19	56.8 Å²	56.8	7%	0.072	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	152.2	166	69	-176.3	-176.4	171.5	3.3	111.1	F194 I195 I196 E231 M233	F194-R219 HydrophobicContact CD1-CB 4.37Å; F194-R219 HydrophobicContact CD1-CG 4.37Å; I195-R219 CarbonylContact O-C 3.6Å; I195-R219 WeakPolarHBondContact O-CA 3.16Å; I196-R219 HydrophobicContact CG1-CB 4.3Å; R219-E231 HydrophobicContact CG-CB 4.15Å; R219-E231 IonicContact CZ-OE2 3.75Å; R219-E231 PolarHBondContact N-O 2.91Å; R219-E231 IonicContact NE-OE2 3.58Å; R219-E231 PolarHBondContact NE-OE2 3.46Å; R219-E231 IonicContact NH2-OE1 3.61Å; R219-E231 IonicContact NH2-OE2 3.67Å; R219-E231 PolarHBondContact NH2-OE2 3.33Å; R219-E231 PolarHBondContact O-N 2.79Å; R219-M233 HydrophobicContact CB-CG 4.48Å; R219-M233 HydrophobicContact CG-CG 4.24Å; R219-M233 HydrophobicContact CG-SD 3.82Å
220	I	93.8	Very high	86.4	Confident	0 Å²	0	53 Å²	53	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	131.4	175.2	-42.6	179.1	0	0	0	107.3	L164 Y168 I171 F194 I195 F218 A228 T229 V230 I244	L164-I220 HydrophobicContact CD1-CB 4.13Å; L164-I220 HydrophobicContact CD1-CG2 3.66Å; Y168-I220 HydrophobicContact CD1-CD1 3.35Å; Y168-I220 HydrophobicContact CD2-CD1 4.22Å; Y168-I220 HydrophobicContact CD2-CG2 4.08Å; Y168-I220 HydrophobicContact CE1-CD1 3.56Å; Y168-I220 HydrophobicContact CE1-CG2 4.39Å; Y168-I220 HydrophobicContact CE2-CD1 4.41Å; Y168-I220 HydrophobicContact CE2-CG2 3.7Å; Y168-I220 HydrophobicContact CG-CD1 3.7Å; I171-I220 HydrophobicContact CD1-CD1 3.55Å; F194-I220 CarbonylContact C-O 3.53Å; F194-I220 VanDerWaalsContact CA-O 3.25Å; F194-I220 WeakPolarHBondContact CA-O 3.47Å; I195-I220 HydrophobicContact CB-CB 4.12Å; I195-I220 HydrophobicContact CB-CD1 4.32Å; I195-I220 HydrophobicContact CB-CG1 4.33Å; I195-I220 HydrophobicContact CG2-CD1 4.34Å; I195-I220 PolarHBondContact N-O 2.7Å; I195-I220 PolarHBondContact O-N 2.91Å; F218-I220 HydrophobicContact CD2-CG1 4.33Å; I220-A228 HydrophobicContact CG2-CB 3.82Å; I220-T229 CarbonylContact C-O 3.45Å; I220-T229 VanDerWaalsContact CA-O 3.26Å; I220-T229 WeakPolarHBondContact CA-O 3.47Å; I220-V230 HydrophobicContact CG1-CG2 4.24Å; I220-V230 HydrophobicContact CG2-CG2 4.1Å; I220-I244 HydrophobicContact CD1-CD1 3.4Å; I220-I244 VanDerWaalsContact CD1-CD1 3.4Å; I220-I244 HydrophobicContact CG1-CD1 3.79Å
221	H	86.5	Confident	86.4	Confident	9 Å²	9	52.1 Å²	52.1	4%	0.042	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	169.7	-176.2	61.2	-80.7	0	0	0	111.9	F194 L223 A228 T229 E231	F194-H221 HydrophobicContact CD1-CB 3.39Å; F194-H221 HydrophobicContact CE1-CB 3.41Å; F194-H221 VanDerWaalsContact CE1-CB 3.41Å; F194-H221 AromaticContact CE1-CG 3.67Å; F194-H221 HydrophobicContact CG-CB 4.25Å; F194-H221 HydrophobicContact CZ-CB 4.33Å; H221-L223 VanDerWaalsContact CD2-CD1 3.48Å; H221-L223 WeakPolarHBondContact CD2-CD1 3.21Å; H221-L223 WeakPolarHBondContact NE2-CD1 3.31Å; H221-A228 CarbonylContact O-C 3.49Å; H221-A228 VanDerWaalsContact O-CA 3.26Å; H221-A228 WeakPolarHBondContact O-CA 3.39Å; H221-T229 PolarHBondContact CD2-OG1 3.02Å; H221-T229 PolarHBondContact CE1-OG1 2.95Å; H221-T229 PolarHBondContact N-O 3.25Å; H221-T229 PolarHBondContact ND1-OG1 3.5Å; H221-T229 PolarHBondContact NE2-OG1 2.64Å; H221-T229 PolarHBondContact O-N 3.28Å; H221-T229 PolarHBondContact O-OG1 3.47Å; H221-T229 VanDerWaalsContact O-OG1 3.05Å; H221-E231 IonicContact CE1-OE1 3.6Å; H221-E231 IonicContact CE1-OE2 3.98Å; H221-E231 PolarHBondContact CE1-OE2 3.27Å; H221-E231 VanDerWaalsContact CE1-OE2 3.27Å; H221-E231 IonicContact ND1-OE2 3.77Å
222	L	80.9	Confident	86.4	Confident	6 Å²	6	47.7 Å²	47.7	3%	0.031	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	109.9	-176.5	-166.3	58.1	0	0	0	109.6	M155 H163 K227	M155-L222 HydrophobicContact CG-CD2 4.36Å; M155-L222 HydrophobicContact SD-CB 3.89Å; M155-L222 HydrophobicContact SD-CD2 3.48Å; M155-L222 WeakPolarHBondContact SD-CD2 3.47Å; M155-L222 HydrophobicContact SD-CG 3.67Å; H163-L222 HydrophobicContact CB-CD1 4.39Å; H163-L222 HydrophobicContact CB-CD2 4.3Å; L222-K227 VanDerWaalsContact CD1-C 3.47Å; L222-K227 WeakPolarHBondContact CD1-O 3.36Å
223	L	67	Low	86.3	Confident	70 Å²	70	48.4 Å²	48.4	37%	0.366	23%	0.23	S	C	.	.			trans	-110.6	102	172.6	-71.6	155.4	0	0	0	107.8	H221 S225	H221-L223 VanDerWaalsContact CD2-CD1 3.48Å; H221-L223 WeakPolarHBondContact CD2-CD1 3.21Å; H221-L223 WeakPolarHBondContact NE2-CD1 3.31Å; L223-S225 PolarHBondContact O-N 3.44Å; L223-S225 PolarHBondContact O-OG 3.48Å
224	E	60.9	Low	86.2	Confident	132 Å²	132	48.1 Å²	48.1	62%	0.617	23%	0.23	S	C	*	.	S	Bend	trans	61	-22.4	162.8	-65.8	165.8	-158.5	0	0	120.1	P150	P150-E224 VanDerWaalsContact CB-OE1 3.29Å; P150-E224 WeakPolarHBondContact CB-OE1 3.43Å; P150-E224 VanDerWaalsContact CD-OE1 3.31Å; P150-E224 WeakPolarHBondContact CD-OE1 3.41Å; P150-E224 WeakPolarHBondContact CG-OE1 3.13Å
225	S	56.9	Low	86.2	Confident	78 Å²	78	42.5 Å²	42.5	55%	0.545	22%	0.216	S	C	.	.	S	Bend	trans	-111.9	17.7	-162.3	60	0	0	0	0	116.3	L223 K227	L223-S225 PolarHBondContact O-N 3.44Å; L223-S225 PolarHBondContact O-OG 3.48Å; S225-K227 PolarHBondContact O-N 2.81Å
226	K	67.5	Low	86.1	Confident	114 Å²	114	45 Å²	45	50%	0.496	23%	0.23	S	C	.	.	S	Bend	trans	51.2	13.5	-170.6	-62.4	-175.2	-175.7	-106.4	0	114	D159 H163	D159-K226 VanDerWaalsContact CG-NZ 3.33Å; D159-K226 IonicContact OD1-NZ 2.73Å; D159-K226 PolarHBondContact OD1-NZ 2.83Å; D159-K226 IonicContact OD2-NZ 3.54Å; D159-K226 PolarHBondContact OD2-NZ 2.79Å; D159-K226 VanDerWaalsContact OD2-NZ 3.11Å; H163-K226 WeakPolarHBondContact CB-O 3.43Å; H163-K226 PolarHBondContact CD2-O 3.36Å; H163-K226 VanDerWaalsContact CG-O 3.22Å
227	K	82.2	Confident	85.9	Confident	153 Å²	153	49.5 Å²	49.5	67%	0.665	25%	0.247	S	C	*	.	S	Bend	trans	-119.8	120.9	177.8	-173.9	178.3	179.4	-179.4	0	108.7	L222 S225	L222-K227 VanDerWaalsContact CD1-C 3.47Å; L222-K227 WeakPolarHBondContact CD1-O 3.36Å; S225-K227 PolarHBondContact O-N 2.81Å
228	A	88.6	Confident	85.6	Confident	14 Å²	14	51 Å²	51	12%	0.116	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	135.2	172.8	0	0	0	0	0	110.7	L164 Y168 I220 H221	L164-A228 HydrophobicContact CD1-CB 4.26Å; Y168-A228 HydrophobicContact CE2-CB 3.65Å; I220-A228 HydrophobicContact CG2-CB 3.82Å; H221-A228 CarbonylContact O-C 3.49Å; H221-A228 VanDerWaalsContact O-CA 3.26Å; H221-A228 WeakPolarHBondContact O-CA 3.39Å
229	T	91.1	Very high	85.3	Confident	48 Å²	48	53.6 Å²	53.6	29%	0.294	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	132.3	173.9	43.9	0	0	0	0	108.9	I220 H221	I220-T229 CarbonylContact C-O 3.45Å; I220-T229 VanDerWaalsContact CA-O 3.26Å; I220-T229 WeakPolarHBondContact CA-O 3.47Å; H221-T229 PolarHBondContact CD2-OG1 3.02Å; H221-T229 PolarHBondContact CE1-OG1 2.95Å; H221-T229 PolarHBondContact N-O 3.25Å; H221-T229 PolarHBondContact ND1-OG1 3.5Å; H221-T229 PolarHBondContact NE2-OG1 2.64Å; H221-T229 PolarHBondContact O-N 3.28Å; H221-T229 PolarHBondContact O-OG1 3.47Å; H221-T229 VanDerWaalsContact O-OG1 3.05Å
230	V	94.4	Very high	85.2	Confident	22 Å²	22	53.1 Å²	53.1	13%	0.133	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	129.3	175.9	-179.5	0	0	0	0	108.3	Y168 I220 G242 I244	Y168-V230 HydrophobicContact CE1-CG2 4.48Å; I220-V230 HydrophobicContact CG1-CG2 4.24Å; I220-V230 HydrophobicContact CG2-CG2 4.1Å; V230-G242 WeakPolarHBondContact CB-O 3.5Å; V230-G242 PolarHBondContact O-N 2.9Å; V230-I244 HydrophobicContact CG1-CD1 3.89Å; V230-I244 HydrophobicContact CG1-CG1 3.94Å
231	E	94.9	Very high	85.2	Confident	41 Å²	41	59.1 Å²	59.1	19%	0.192	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	134.2	177.7	-70.5	178.8	156.5	0	0	110.7	F218 R219 H221 P239 H240	F218-E231 CarbonylContact C-O 3.58Å; F218-E231 WeakPolarHBondContact CA-O 3.42Å; F218-E231 WeakPolarHBondContact CB-O 3.5Å; R219-E231 HydrophobicContact CG-CB 4.15Å; R219-E231 IonicContact CZ-OE2 3.75Å; R219-E231 PolarHBondContact N-O 2.91Å; R219-E231 IonicContact NE-OE2 3.58Å; R219-E231 PolarHBondContact NE-OE2 3.46Å; R219-E231 IonicContact NH2-OE1 3.61Å; R219-E231 IonicContact NH2-OE2 3.67Å; R219-E231 PolarHBondContact NH2-OE2 3.33Å; R219-E231 PolarHBondContact O-N 2.79Å; H221-E231 IonicContact CE1-OE1 3.6Å; H221-E231 IonicContact CE1-OE2 3.98Å; H221-E231 PolarHBondContact CE1-OE2 3.27Å; H221-E231 VanDerWaalsContact CE1-OE2 3.27Å; H221-E231 IonicContact ND1-OE2 3.77Å; E231-P239 HydrophobicContact CB-CB 4.36Å; E231-H240 CarbonylContact C-O 3.59Å; E231-H240 WeakPolarHBondContact CA-O 3.46Å; E231-H240 WeakPolarHBondContact CB-O 3.38Å
232	C	96.3	Very high	85.7	Confident	4 Å²	4	58.9 Å²	58.9	3%	0.027	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	134.9	163.9	179.9	0	0	0	0	108.7	P239 H240 C256 N308	C232-P239 WeakPolarHBondContact O-CA 3.48Å; C232-H240 VanDerWaalsContact CB-NE2 3.32Å; C232-H240 WeakPolarHBondContact CB-NE2 3.4Å; C232-H240 PolarHBondContact N-O 3.05Å; C232-H240 PolarHBondContact O-N 2.86Å; C232-H240 VanDerWaalsContact O-N 3.09Å; C232-H240 PolarHBondContact O-ND1 3.16Å; C232-H240 VanDerWaalsContact SG-CE1 3.59Å; C232-H240 PolarHBondContact SG-NE2 2.95Å; C232-C256 HydrophobicContact CB-CB 4.35Å; C232-N308 PolarHBondContact SG-ND2 2.8Å
233	M	93.7	Very high	86.4	Confident	29 Å²	29	61.6 Å²	61.6	14%	0.143	32%	0.32	C	S	.	.			trans	-109.6	3.7	-179	-62.1	-64.2	-51	0	0	112.4	Y132 P216 L217 R219 P239	Y132-M233 HydrophobicContact CE1-CE 4.19Å; Y132-M233 WeakPolarHBondContact OH-CE 3.35Å; P216-M233 HydrophobicContact CB-CB 4.19Å; P216-M233 HydrophobicContact CB-CG 4.27Å; P216-M233 HydrophobicContact CG-CB 4.2Å; P216-M233 HydrophobicContact CG-CE 4.34Å; P216-M233 WeakPolarHBondContact O-CB 3.36Å; L217-M233 PolarHBondContact O-N 2.92Å; R219-M233 HydrophobicContact CB-CG 4.48Å; R219-M233 HydrophobicContact CG-CG 4.24Å; R219-M233 HydrophobicContact CG-SD 3.82Å; M233-P239 HydrophobicContact CE-CB 4.34Å; M233-P239 HydrophobicContact CE-CG 3.74Å; M233-P239 HydrophobicContact SD-CB 3.7Å; M233-P239 HydrophobicContact SD-CG 3.75Å
234	Y	92.6	Very high	87.8	Confident	51 Å²	51	59.5 Å²	59.5	20%	0.2	31%	0.309	C	S	.	.			trans	-77.1	153.6	-176	-169.6	-104.4	0	0	0	112.4	L217 H240 H262 N308	L217-Y234 HydrophobicContact CD2-CD2 4.08Å; Y234-H240 PolarHBondContact O-CE1 3.23Å; Y234-H240 VanDerWaalsContact O-CE1 3.27Å; Y234-H262 HydrophobicContact CD1-CB 4.07Å; Y234-H262 AromaticContact CD1-CD2 3.67Å; Y234-H262 AromaticContact CD1-CE1 3.75Å; Y234-H262 AromaticContact CD1-CG 3.56Å; Y234-H262 AromaticContact CD1-ND1 3.61Å; Y234-H262 AromaticContact CD1-NE2 3.8Å; Y234-H262 HydrophobicContact CE1-CB 4.19Å; Y234-H262 PolarHBondContact O-CD2 3.05Å; Y234-N308 HydrophobicContact CD1-CB 3.96Å; Y234-N308 HydrophobicContact CD2-CB 4.25Å; Y234-N308 HydrophobicContact CG-CB 3.73Å
235	G	90.4	Very high	89.4	Confident	24 Å²	24	58.1 Å²	58.1	25%	0.247	30%	0.302	C	S	.	.	S	Bend	trans	80.4	-169.3	-176.5	0	0	0	0	0	113.8
236	H	88.2	Confident	91.1	Very high	107 Å²	107	57.8 Å²	57.8	50%	0.495	30%	0.297	S	S	.	.	S	Bend	trans	-118.5	6.8	-166.7	-55.1	-80.1	0	0	0	113.7	E278	H236-E278 IonicContact CE1-OE1 3.8Å
237	K	90.8	Very high	91.6	Very high	114 Å²	114	56.5 Å²	56.5	50%	0.496	30%	0.299	S	S	.	.	S	Bend	trans	-100.5	9.3	179.4	-59.4	-170.4	-166.1	154.9	0	114.1	D260 H261 R263	K237-D260 PolarHBondContact NZ-O 2.96Å; K237-H261 HydrophobicContact CB-CB 4.32Å; K237-R263 WeakPolarHBondContact CE-O 3.34Å; K237-R263 PolarHBondContact NZ-O 2.78Å
238	G	88.5	Confident	91.8	Very high	32 Å²	32	55.6 Å²	55.6	33%	0.33	30%	0.295	S	S	.	.			trans	89.8	-178.7	178.1	0	0	0	0	0	114.5	H240	G238-H240 PolarHBondContact O-ND1 3.21Å
239	P	91.1	Very high	91.7	Very high	59 Å²	59	60 Å²	60	38%	0.383	31%	0.311	S	S	.	.			trans	-60.6	139.9	179.8	-17.6	29.2	0	0	0	111.8	E231 C232 M233	E231-P239 HydrophobicContact CB-CB 4.36Å; C232-P239 WeakPolarHBondContact O-CA 3.48Å; M233-P239 HydrophobicContact CE-CB 4.34Å; M233-P239 HydrophobicContact CE-CG 3.74Å; M233-P239 HydrophobicContact SD-CB 3.7Å; M233-P239 HydrophobicContact SD-CG 3.75Å
240	H	92.8	Very high	91.8	Very high	8 Å²	8	60.7 Å²	60.7	4%	0.037	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	173	179.8	55.7	-82.2	0	0	0	110.4	E231 C232 Y234 G238 G242 C256 H261 H262	E231-H240 CarbonylContact C-O 3.59Å; E231-H240 WeakPolarHBondContact CA-O 3.46Å; E231-H240 WeakPolarHBondContact CB-O 3.38Å; C232-H240 VanDerWaalsContact CB-NE2 3.32Å; C232-H240 WeakPolarHBondContact CB-NE2 3.4Å; C232-H240 PolarHBondContact N-O 3.05Å; C232-H240 PolarHBondContact O-N 2.86Å; C232-H240 VanDerWaalsContact O-N 3.09Å; C232-H240 PolarHBondContact O-ND1 3.16Å; C232-H240 VanDerWaalsContact SG-CE1 3.59Å; C232-H240 PolarHBondContact SG-NE2 2.95Å; Y234-H240 PolarHBondContact O-CE1 3.23Å; Y234-H240 VanDerWaalsContact O-CE1 3.27Å; G238-H240 PolarHBondContact O-ND1 3.21Å; H240-G242 PolarHBondContact O-N 3.18Å; H240-C256 VanDerWaalsContact CD2-SG 3.54Å; H240-C256 PolarHBondContact NE2-SG 2.6Å; H240-H261 VanDerWaalsContact CB-CD2 3.49Å; H240-H261 WeakPolarHBondContact CB-CD2 3.34Å; H240-H261 AromaticContact CG-CD2 3.66Å; H240-H261 AromaticContact CG-CG 3.53Å; H240-H261 WeakPolarHBondContact ND1-CB 3.32Å; H240-H261 AromaticContact ND1-CD2 3.75Å; H240-H261 AromaticContact ND1-CG 3.66Å; H240-H262 AromaticContact CE1-CD2 3.8Å; H240-H262 AromaticContact CE1-NE2 3.64Å; H240-H262 AromaticContact NE2-CD2 3.77Å; H240-H262 AromaticContact NE2-NE2 3.26Å; H240-H262 PolarHBondContact NE2-NE2 2.71Å
241	K	94.6	Very high	91.9	Very high	126 Å²	126	61.6 Å²	61.6	55%	0.548	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	130	-171.1	-171.3	-179.5	175.9	-175.7	0	111.8	N257	K241-N257 PolarHBondContact O-N 3.1Å; K241-N257 PolarHBondContact O-OD1 3.45Å
242	G	95.6	Very high	92.1	Very high	5 Å²	5	59.6 Å²	59.6	5%	0.052	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	173.2	169.9	0	0	0	0	0	112	V230 H240 K255	V230-G242 WeakPolarHBondContact CB-O 3.5Å; V230-G242 PolarHBondContact O-N 2.9Å; H240-G242 PolarHBondContact O-N 3.18Å; G242-K255 CarbonylContact C-O 3.58Å; G242-K255 VanDerWaalsContact CA-O 3.29Å; G242-K255 WeakPolarHBondContact CA-O 3.43Å
243	D	96.4	Very high	92.1	Very high	62 Å²	62	60.4 Å²	60.4	33%	0.332	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	152	176.7	-63.8	-59.1	0	0	0	110.4	T254 K255 N257	D243-T254 WeakPolarHBondContact O-CA 3.46Å; D243-K255 HydrophobicContact CB-CB 4.36Å; D243-K255 PolarHBondContact N-O 3.01Å; D243-K255 PolarHBondContact O-N 2.78Å; D243-N257 PolarHBondContact OD2-ND2 2.91Å; D243-N257 PolarHBondContact OD2-OD1 2.82Å; D243-N257 VanDerWaalsContact OD2-OD1 3.11Å
244	I	96.6	Very high	92.3	Very high	27 Å²	27	59.4 Å²	59.4	14%	0.138	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	131.5	169.7	-74.6	165.9	0	0	0	108.6	I171 F218 I220 V230 F252 S253 T254	I171-I244 HydrophobicContact CD1-CD1 4.04Å; I171-I244 HydrophobicContact CG2-CG2 4.19Å; F218-I244 HydrophobicContact CD2-CD1 3.64Å; F218-I244 HydrophobicContact CE2-CD1 3.63Å; F218-I244 HydrophobicContact CG-CD1 4.3Å; F218-I244 HydrophobicContact CZ-CD1 4.28Å; I220-I244 HydrophobicContact CD1-CD1 3.4Å; I220-I244 VanDerWaalsContact CD1-CD1 3.4Å; I220-I244 HydrophobicContact CG1-CD1 3.79Å; V230-I244 HydrophobicContact CG1-CD1 3.89Å; V230-I244 HydrophobicContact CG1-CG1 3.94Å; I244-F252 HydrophobicContact CG2-CD2 4.13Å; I244-S253 WeakPolarHBondContact CA-O 3.3Å; I244-T254 HydrophobicContact CG1-CG2 4.16Å
245	Q	94.8	Very high	92.5	Very high	103 Å²	103	62.1 Å²	62.1	48%	0.481	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	123.5	175.8	-61.4	177.8	27.6	0	0	108.9	F252 S253	Q245-F252 CarbonylContact O-C 3.47Å; Q245-F252 VanDerWaalsContact O-CA 3.25Å; Q245-F252 WeakPolarHBondContact O-CA 3.17Å; Q245-F252 WeakPolarHBondContact O-CB 3.15Å; Q245-S253 PolarHBondContact N-O 3.1Å; Q245-S253 PolarHBondContact O-N 3.17Å
246	T	91.3	Very high	92.8	Very high	70 Å²	70	61.3 Å²	61.3	43%	0.429	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	116.2	173.3	-51	0	0	0	0	108.1	H170	H170-T246 HydrophobicContact CB-CG2 4.2Å
247	V	78.8	Confident	92.8	Very high	88 Å²	88	59.4 Å²	59.4	53%	0.533	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	-43.9	-178.4	-172.8	0	0	0	0	109.8	E251	V247-E251 PolarHBondContact N-O 3.24Å
248	K	86.3	Confident	93	Very high	133 Å²	133	57.6 Å²	57.6	58%	0.578	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.4	169	-179.3	-61.3	174.6	-173.7	163.3	0	109.8	D250 E251	K248-D250 PolarHBondContact O-N 2.92Å; K248-D250 VanDerWaalsContact O-N 3.16Å; K248-E251 HydrophobicContact CB-CB 4.22Å; K248-E251 PolarHBondContact N-O 2.64Å; K248-E251 PolarHBondContact O-N 2.85Å
249	K	86	Confident	93.2	Very high	108 Å²	108	58.8 Å²	58.8	47%	0.47	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-34.3	174.7	-175.4	-179.7	174.7	-176.9	0	112.5	E7 R314	E7-K249 IonicContact OE2-NZ 3.91Å; K249-R314 PolarHBondContact O-NH2 3.28Å
250	D	93.9	Very high	93.4	Very high	61 Å²	61	60.1 Å²	60.1	33%	0.326	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.3	18.6	-174.4	-62.5	-27.5	0	0	0	113.3	K248 R314	K248-D250 PolarHBondContact O-N 2.92Å; K248-D250 VanDerWaalsContact O-N 3.16Å; D250-R314 HydrophobicContact CB-CB 3.84Å; D250-R314 PolarHBondContact O-N 3.48Å; D250-R314 VanDerWaalsContact OD1-CD 3.23Å; D250-R314 WeakPolarHBondContact OD1-CD 3.43Å; D250-R314 IonicContact OD1-CZ 3.7Å; D250-R314 IonicContact OD1-NE 3.98Å; D250-R314 PolarHBondContact OD1-NE 3.33Å
251	E	96.8	Very high	93.5	Very high	41 Å²	41	61.6 Å²	61.6	19%	0.192	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	129.7	179.4	-169.1	-173.5	112.4	0	0	112.6	V247 K248 T311 Y312	V247-E251 PolarHBondContact N-O 3.24Å; K248-E251 HydrophobicContact CB-CB 4.22Å; K248-E251 PolarHBondContact N-O 2.64Å; K248-E251 PolarHBondContact O-N 2.85Å; E251-T311 HydrophobicContact CG-CG2 3.72Å; E251-Y312 VanDerWaalsContact CA-O 3.32Å; E251-Y312 WeakPolarHBondContact CA-O 3.42Å
252	F	97.9	Very high	93.5	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	163.2	170	81.2	-86.5	0	0	0	111.2	I171 W175 L186 V188 F218 I244 Q245 T254 Y312	I171-F252 HydrophobicContact CB-CD1 4.13Å; I171-F252 HydrophobicContact CB-CE1 4.31Å; I171-F252 HydrophobicContact CB-CG 4.26Å; I171-F252 HydrophobicContact CG2-CB 3.77Å; I171-F252 HydrophobicContact CG2-CD1 3.96Å; I171-F252 HydrophobicContact CG2-CD2 4.04Å; I171-F252 HydrophobicContact CG2-CG 3.66Å; W175-F252 AromaticContact CD1-CE1 3.96Å; W175-F252 AromaticContact CD2-CD1 3.86Å; W175-F252 HydrophobicContact CD2-CD1 3.86Å; W175-F252 AromaticContact CD2-CE1 3.45Å; W175-F252 HydrophobicContact CD2-CE1 3.45Å; W175-F252 VanDerWaalsContact CD2-CE1 3.45Å; W175-F252 AromaticContact CE2-CD1 3.88Å; W175-F252 AromaticContact CE2-CE1 3.54Å; W175-F252 AromaticContact CE3-CD1 3.73Å; W175-F252 HydrophobicContact CE3-CD1 3.73Å; W175-F252 AromaticContact CE3-CE1 3.76Å; W175-F252 HydrophobicContact CE3-CE1 3.76Å; W175-F252 AromaticContact CG-CE1 3.78Å; W175-F252 HydrophobicContact CG-CE1 3.78Å; W175-F252 AromaticContact CH2-CD1 3.75Å; W175-F252 HydrophobicContact CH2-CD1 3.75Å; W175-F252 HydrophobicContact CH2-CE1 4.28Å; W175-F252 AromaticContact CZ2-CD1 3.86Å; W175-F252 HydrophobicContact CZ2-CD1 3.86Å; W175-F252 AromaticContact CZ2-CE1 3.99Å; W175-F252 HydrophobicContact CZ2-CE1 3.99Å; W175-F252 AromaticContact CZ3-CD1 3.68Å; W175-F252 HydrophobicContact CZ3-CD1 3.68Å; W175-F252 HydrophobicContact CZ3-CE1 4.17Å; W175-F252 AromaticContact NE1-CE1 3.81Å; L186-F252 HydrophobicContact CD2-CE1 4.45Å; L186-F252 HydrophobicContact CD2-CZ 3.76Å; V188-F252 HydrophobicContact CG2-CE1 4.36Å; V188-F252 HydrophobicContact CG2-CZ 4.03Å; F218-F252 AromaticContact CE1-CE2 3.96Å; F218-F252 HydrophobicContact CE1-CE2 3.96Å; F218-F252 HydrophobicContact CE1-CZ 4.1Å; F218-F252 AromaticContact CZ-CE2 3.9Å; F218-F252 HydrophobicContact CZ-CE2 3.9Å; F218-F252 AromaticContact CZ-CZ 3.97Å; F218-F252 HydrophobicContact CZ-CZ 3.97Å; I244-F252 HydrophobicContact CG2-CD2 4.13Å; Q245-F252 CarbonylContact O-C 3.47Å; Q245-F252 VanDerWaalsContact O-CA 3.25Å; Q245-F252 WeakPolarHBondContact O-CA 3.17Å; Q245-F252 WeakPolarHBondContact O-CB 3.15Å; F252-T254 HydrophobicContact CE2-CG2 4.11Å; F252-Y312 HydrophobicContact CD2-CD2 4.04Å; F252-Y312 HydrophobicContact CE1-CD2 4.08Å; F252-Y312 AromaticContact CE1-CG 3.95Å; F252-Y312 HydrophobicContact CE1-CG 3.95Å; F252-Y312 AromaticContact CE2-CD2 3.5Å; F252-Y312 HydrophobicContact CE2-CD2 3.5Å; F252-Y312 VanDerWaalsContact CE2-CD2 3.5Å; F252-Y312 AromaticContact CE2-CE2 3.98Å; F252-Y312 HydrophobicContact CE2-CE2 3.98Å; F252-Y312 HydrophobicContact CE2-CG 4.19Å; F252-Y312 AromaticContact CZ-CD2 3.52Å; F252-Y312 HydrophobicContact CZ-CD2 3.52Å; F252-Y312 HydrophobicContact CZ-CE2 4.15Å; F252-Y312 AromaticContact CZ-CG 3.73Å; F252-Y312 HydrophobicContact CZ-CG 3.73Å; F252-Y312 PolarHBondContact N-O 2.97Å; F252-Y312 VanDerWaalsContact N-O 3.12Å; F252-Y312 PolarHBondContact O-N 3.4Å
253	S	97.9	Very high	93.5	Very high	20 Å²	20	59.4 Å²	59.4	14%	0.14	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	152.3	175.2	61.8	0	0	0	0	112.7	I244 Q245 L310	I244-S253 WeakPolarHBondContact CA-O 3.3Å; Q245-S253 PolarHBondContact N-O 3.1Å; Q245-S253 PolarHBondContact O-N 3.17Å; S253-L310 CarbonylContact C-O 3.53Å; S253-L310 WeakPolarHBondContact CA-O 3.49Å; S253-L310 VanDerWaalsContact CB-O 3.28Å; S253-L310 WeakPolarHBondContact CB-O 3.19Å
254	T	97.8	Very high	93.4	Very high	9 Å²	9	58 Å²	58	6%	0.055	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	148.3	169.9	54	0	0	0	0	110	F218 D243 I244 F252 N308 C309 L310 Y312	F218-T254 HydrophobicContact CD1-CG2 3.56Å; F218-T254 HydrophobicContact CE1-CG2 3.82Å; F218-T254 HydrophobicContact CG-CG2 4.23Å; D243-T254 WeakPolarHBondContact O-CA 3.46Å; I244-T254 HydrophobicContact CG1-CG2 4.16Å; F252-T254 HydrophobicContact CE2-CG2 4.11Å; T254-N308 PolarHBondContact OG1-O 2.79Å; T254-C309 CarbonylContact O-C 3.52Å; T254-C309 VanDerWaalsContact O-CA 3.27Å; T254-C309 WeakPolarHBondContact O-CA 3.21Å; T254-L310 PolarHBondContact N-O 3.03Å; T254-L310 PolarHBondContact O-N 3.35Å; T254-L310 PolarHBondContact OG1-N 3.39Å; T254-Y312 HydrophobicContact CG2-CE2 3.82Å
255	K	96.7	Very high	93.3	Very high	107 Å²	107	62.8 Å²	62.8	47%	0.465	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	129.3	169.9	-175.2	177.6	-178.4	177.7	0	109.6	G242 D243	G242-K255 CarbonylContact C-O 3.58Å; G242-K255 VanDerWaalsContact CA-O 3.29Å; G242-K255 WeakPolarHBondContact CA-O 3.43Å; D243-K255 HydrophobicContact CB-CB 4.36Å; D243-K255 PolarHBondContact N-O 3.01Å; D243-K255 PolarHBondContact O-N 2.78Å
256	C	95.5	Very high	93.3	Very high	7 Å²	7	59.9 Å²	59.9	5%	0.047	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	132.6	167.8	178.6	0	0	0	0	109.5	C232 H240 Q258 T259 H262 C309	C232-C256 HydrophobicContact CB-CB 4.35Å; H240-C256 VanDerWaalsContact CD2-SG 3.54Å; H240-C256 PolarHBondContact NE2-SG 2.6Å; C256-Q258 VanDerWaalsContact SG-C 3.54Å; C256-Q258 PolarHBondContact SG-N 2.99Å; C256-T259 HydrophobicContact CB-CG2 4.25Å; C256-H262 VanDerWaalsContact SG-CE1 3.51Å; C256-H262 PolarHBondContact SG-NE2 2.91Å; C256-H262 VanDerWaalsContact SG-NE2 3.35Å; C256-C309 PolarHBondContact N-SG 3.14Å
257	N	89.1	Confident	93.5	Very high	68 Å²	68	58 Å²	58	36%	0.364	31%	0.313	S	S	.	.	S	Bend	trans	-97.1	-7.1	177.2	-46.9	101.5	0	0	0	113	K241 D243	K241-N257 PolarHBondContact O-N 3.1Å; K241-N257 PolarHBondContact O-OD1 3.45Å; D243-N257 PolarHBondContact OD2-ND2 2.91Å; D243-N257 PolarHBondContact OD2-OD1 2.82Å; D243-N257 VanDerWaalsContact OD2-OD1 3.11Å
258	Q	93.6	Very high	94.3	Very high	75 Å²	75	58.2 Å²	58.2	35%	0.35	31%	0.305	S	S	.	.			trans	-138	61.7	-170.4	-56.8	-177.8	-69.9	0	0	110.3	C256 D260 H261	C256-Q258 VanDerWaalsContact SG-C 3.54Å; C256-Q258 PolarHBondContact SG-N 2.99Å; Q258-D260 WeakPolarHBondContact CA-OD1 3.29Å; Q258-D260 WeakPolarHBondContact CB-OD1 3.48Å; Q258-D260 PolarHBondContact O-N 2.84Å; Q258-D260 VanDerWaalsContact O-N 3.12Å; Q258-H261 WeakPolarHBondContact O-CB 3.35Å; Q258-H261 PolarHBondContact O-N 2.52Å; Q258-H261 PolarHBondContact O-ND1 3.07Å; Q258-H261 VanDerWaalsContact O-ND1 3.14Å
259	T	94.1	Very high	94.7	Very high	57 Å²	57	59.3 Å²	59.3	35%	0.35	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-67.4	-10.1	-175.5	54.3	0	0	0	0	114.3	C256 H261 H262 D307	C256-T259 HydrophobicContact CB-CG2 4.25Å; T259-H261 PolarHBondContact O-N 3.23Å; T259-H262 VanDerWaalsContact O-CB 3.29Å; T259-H262 WeakPolarHBondContact O-CB 3.25Å; T259-H262 PolarHBondContact O-N 2.99Å; T259-D307 WeakPolarHBondContact CB-OD2 3.37Å; T259-D307 HydrophobicContact CG2-CB 4.39Å; T259-D307 WeakPolarHBondContact CG2-OD2 3.44Å
260	D	94.4	Very high	95.2	Very high	88 Å²	88	56.5 Å²	56.5	47%	0.471	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-58.2	-24.7	167.6	65.2	-54.5	0	0	0	112.3	K237 Q258 H262 R263	K237-D260 PolarHBondContact NZ-O 2.96Å; Q258-D260 WeakPolarHBondContact CA-OD1 3.29Å; Q258-D260 WeakPolarHBondContact CB-OD1 3.48Å; Q258-D260 PolarHBondContact O-N 2.84Å; Q258-D260 VanDerWaalsContact O-N 3.12Å; D260-H262 PolarHBondContact O-N 3.18Å; D260-R263 PolarHBondContact O-N 2.91Å
261	H	94.8	Very high	95.3	Very high	39 Å²	39	54.5 Å²	54.5	18%	0.181	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-69	-22.2	173.8	-69.7	65.4	0	0	0	113.3	K237 H240 Q258 T259	K237-H261 HydrophobicContact CB-CB 4.32Å; H240-H261 VanDerWaalsContact CB-CD2 3.49Å; H240-H261 WeakPolarHBondContact CB-CD2 3.34Å; H240-H261 AromaticContact CG-CD2 3.66Å; H240-H261 AromaticContact CG-CG 3.53Å; H240-H261 WeakPolarHBondContact ND1-CB 3.32Å; H240-H261 AromaticContact ND1-CD2 3.75Å; H240-H261 AromaticContact ND1-CG 3.66Å; Q258-H261 WeakPolarHBondContact O-CB 3.35Å; Q258-H261 PolarHBondContact O-N 2.52Å; Q258-H261 PolarHBondContact O-ND1 3.07Å; Q258-H261 VanDerWaalsContact O-ND1 3.14Å; T259-H261 PolarHBondContact O-N 3.23Å
262	H	94.8	Very high	95.2	Very high	7 Å²	7	53.9 Å²	53.9	3%	0.032	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-84.4	-20.7	179.5	-48.8	171.5	0	0	0	112.2	Y234 H240 C256 T259 D260 D307	Y234-H262 HydrophobicContact CD1-CB 4.07Å; Y234-H262 AromaticContact CD1-CD2 3.67Å; Y234-H262 AromaticContact CD1-CE1 3.75Å; Y234-H262 AromaticContact CD1-CG 3.56Å; Y234-H262 AromaticContact CD1-ND1 3.61Å; Y234-H262 AromaticContact CD1-NE2 3.8Å; Y234-H262 HydrophobicContact CE1-CB 4.19Å; Y234-H262 PolarHBondContact O-CD2 3.05Å; H240-H262 AromaticContact CE1-CD2 3.8Å; H240-H262 AromaticContact CE1-NE2 3.64Å; H240-H262 AromaticContact NE2-CD2 3.77Å; H240-H262 AromaticContact NE2-NE2 3.26Å; H240-H262 PolarHBondContact NE2-NE2 2.71Å; C256-H262 VanDerWaalsContact SG-CE1 3.51Å; C256-H262 PolarHBondContact SG-NE2 2.91Å; C256-H262 VanDerWaalsContact SG-NE2 3.35Å; T259-H262 VanDerWaalsContact O-CB 3.29Å; T259-H262 WeakPolarHBondContact O-CB 3.25Å; T259-H262 PolarHBondContact O-N 2.99Å; D260-H262 PolarHBondContact O-N 3.18Å; H262-D307 PolarHBondContact CE1-O 2.62Å; H262-D307 IonicContact CE1-OD1 2.6Å; H262-D307 IonicContact CG-OD1 2.71Å; H262-D307 IonicContact ND1-OD1 3.56Å; H262-D307 PolarHBondContact ND1-OD1 3Å; H262-D307 IonicContact ND1-OD2 3.92Å
263	R	95.6	Very high	95.1	Very high	77 Å²	77	60.7 Å²	60.7	29%	0.291	31%	0.311	S	S	.	.			trans	-80.2	135.8	-175.4	-56	-59.1	108.8	-170.5	12.7	111.5	K237 D260 E271 D307	K237-R263 WeakPolarHBondContact CE-O 3.34Å; K237-R263 PolarHBondContact NZ-O 2.78Å; D260-R263 PolarHBondContact O-N 2.91Å; R263-E271 WeakPolarHBondContact CD-OE1 3.16Å; R263-E271 IonicContact CZ-OE1 3.87Å; R263-E271 IonicContact CZ-OE2 2.96Å; R263-E271 IonicContact NE-OE1 3.24Å; R263-E271 IonicContact NH1-OE1 3.64Å; R263-E271 PolarHBondContact NH1-OE1 3.18Å; R263-E271 IonicContact NH1-OE2 3.27Å; R263-E271 PolarHBondContact NH1-OE2 3.16Å; R263-D307 IonicContact CZ-OD1 3.99Å; R263-D307 IonicContact NH2-OD1 2.94Å; R263-D307 PolarHBondContact NH2-OD1 3.45Å; R263-D307 IonicContact NH2-OD2 2.66Å; R263-D307 PolarHBondContact NH2-OD2 3.09Å
264	M	95.3	Very high	95	Very high	32 Å²	32	61 Å²	61	16%	0.158	31%	0.312	C	S	.	.			trans	-96.4	151.4	174.5	-60.6	-171.8	80	0	0	111.9	G266 G267 E270 E271 T274	M264-G266 VanDerWaalsContact C-N 3.27Å; M264-G266 PolarHBondContact O-N 3.49Å; M264-G267 WeakPolarHBondContact O-CA 3.38Å; M264-G267 PolarHBondContact O-N 2.79Å; M264-E270 HydrophobicContact CB-CB 4.26Å; M264-E270 HydrophobicContact CB-CG 4.17Å; M264-E270 WeakPolarHBondContact CB-OE2 3.23Å; M264-E270 HydrophobicContact CE-CG 3.86Å; M264-E270 HydrophobicContact SD-CG 3.94Å; M264-E271 HydrophobicContact CB-CG 4.06Å; M264-E271 HydrophobicContact CG-CG 3.9Å; M264-E271 HydrophobicContact SD-CG 4.35Å; M264-T274 HydrophobicContact CE-CG2 4.49Å; M264-T274 HydrophobicContact SD-CG2 4.36Å; M264-T274 PolarHBondContact SD-OG1 3.42Å
265	P	94.4	Very high	94.9	Very high	128 Å²	128	61.5 Å²	61.5	83%	0.831	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-34.9	-178.6	-25.1	35.2	0	0	0	114.3	G267	P265-G267 PolarHBondContact O-N 2.8Å
266	G	94.8	Very high	94.8	Very high	42 Å²	42	56.7 Å²	56.7	43%	0.433	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	12	174.4	0	0	0	0	0	114.3	M264 E270	M264-G266 VanDerWaalsContact C-N 3.27Å; M264-G266 PolarHBondContact O-N 3.49Å; G266-E270 VanDerWaalsContact CA-OE2 3.22Å; G266-E270 WeakPolarHBondContact CA-OE2 3.4Å; G266-E270 PolarHBondContact N-OE2 3.01Å
267	G	95.5	Very high	94.7	Very high	30 Å²	30	62.8 Å²	62.8	31%	0.309	32%	0.32	S	S	.	.	H	α-helix	trans	63.6	-156.9	176.6	0	0	0	0	0	113.8	M264 P265 Q269 E270 E271	M264-G267 WeakPolarHBondContact O-CA 3.38Å; M264-G267 PolarHBondContact O-N 2.79Å; P265-G267 PolarHBondContact O-N 2.8Å; G267-Q269 PolarHBondContact O-N 3.35Å; G267-Q269 VanDerWaalsContact O-N 3.16Å; G267-E270 PolarHBondContact O-N 2.91Å; G267-E270 VanDerWaalsContact O-N 3.11Å; G267-E271 WeakPolarHBondContact O-CG 3.39Å; G267-E271 PolarHBondContact O-N 2.82Å; G267-E271 VanDerWaalsContact O-N 3.1Å
268	R	94.4	Very high	94.8	Very high	94 Å²	94	62.9 Å²	62.9	36%	0.355	32%	0.319	S	S	.	.	H	α-helix	trans	-60.4	-27.4	-174.4	-66.6	-68.5	-69.2	159	-7.3	114	E271 F272 S304	R268-E271 VanDerWaalsContact CD-OE2 3.23Å; R268-E271 WeakPolarHBondContact CD-OE2 3.29Å; R268-E271 IonicContact CZ-OE2 3.37Å; R268-E271 IonicContact NE-OE2 3.27Å; R268-E271 IonicContact NH1-OE2 2.77Å; R268-E271 PolarHBondContact NH1-OE2 3.45Å; R268-F272 WeakPolarHBondContact O-CB 3.29Å; R268-F272 PolarHBondContact O-N 2.94Å; R268-S304 PolarHBondContact NH1-OG 2.69Å; R268-S304 PolarHBondContact NH2-OG 2.66Å
269	Q	95.1	Very high	94.8	Very high	156 Å²	156	60.5 Å²	60.5	73%	0.729	31%	0.307	S	S	*	.	H	α-helix	trans	-69.5	-41.7	177	-69.3	-179.1	-10.1	0	0	111.8	G267 R273	G267-Q269 PolarHBondContact O-N 3.35Å; G267-Q269 VanDerWaalsContact O-N 3.16Å; Q269-R273 WeakPolarHBondContact O-CG 3.47Å; Q269-R273 PolarHBondContact O-N 3.31Å; Q269-R273 VanDerWaalsContact O-N 3.07Å
270	E	95.9	Very high	94.7	Very high	49 Å²	49	58.7 Å²	58.7	23%	0.229	29%	0.294	C	S	.	.	H	α-helix	trans	-69.1	-40.2	174.8	-172.2	179.4	-158.2	0	0	111.7	M264 G266 G267 F272 R273 T274	M264-E270 HydrophobicContact CB-CB 4.26Å; M264-E270 HydrophobicContact CB-CG 4.17Å; M264-E270 WeakPolarHBondContact CB-OE2 3.23Å; M264-E270 HydrophobicContact CE-CG 3.86Å; M264-E270 HydrophobicContact SD-CG 3.94Å; G266-E270 VanDerWaalsContact CA-OE2 3.22Å; G266-E270 WeakPolarHBondContact CA-OE2 3.4Å; G266-E270 PolarHBondContact N-OE2 3.01Å; G267-E270 PolarHBondContact O-N 2.91Å; G267-E270 VanDerWaalsContact O-N 3.11Å; E270-F272 VanDerWaalsContact C-N 3.32Å; E270-F272 PolarHBondContact O-N 3.07Å; E270-R273 PolarHBondContact O-N 2.88Å; E270-T274 WeakPolarHBondContact O-CB 3.43Å; E270-T274 PolarHBondContact O-N 3.38Å; E270-T274 PolarHBondContact O-OG1 3.43Å
271	E	96.3	Very high	94.5	Very high	18 Å²	18	56.4 Å²	56.4	8%	0.084	29%	0.291	C	S	.	.	H	α-helix	trans	-58	-45.1	173.7	-67.1	172.5	-157.1	0	0	111.5	R263 M264 G267 R268 W275 F300	R263-E271 WeakPolarHBondContact CD-OE1 3.16Å; R263-E271 IonicContact CZ-OE1 3.87Å; R263-E271 IonicContact CZ-OE2 2.96Å; R263-E271 IonicContact NE-OE1 3.24Å; R263-E271 IonicContact NH1-OE1 3.64Å; R263-E271 PolarHBondContact NH1-OE1 3.18Å; R263-E271 IonicContact NH1-OE2 3.27Å; R263-E271 PolarHBondContact NH1-OE2 3.16Å; M264-E271 HydrophobicContact CB-CG 4.06Å; M264-E271 HydrophobicContact CG-CG 3.9Å; M264-E271 HydrophobicContact SD-CG 4.35Å; G267-E271 WeakPolarHBondContact O-CG 3.39Å; G267-E271 PolarHBondContact O-N 2.82Å; G267-E271 VanDerWaalsContact O-N 3.1Å; R268-E271 VanDerWaalsContact CD-OE2 3.23Å; R268-E271 WeakPolarHBondContact CD-OE2 3.29Å; R268-E271 IonicContact CZ-OE2 3.37Å; R268-E271 IonicContact NE-OE2 3.27Å; R268-E271 IonicContact NH1-OE2 2.77Å; R268-E271 PolarHBondContact NH1-OE2 3.45Å; E271-W275 VanDerWaalsContact O-CB 3.26Å; E271-W275 WeakPolarHBondContact O-CB 3.5Å; E271-W275 PolarHBondContact O-N 3.22Å; E271-F300 HydrophobicContact CB-CE2 4.5Å; E271-F300 HydrophobicContact CB-CZ 4.12Å
272	F	96.4	Very high	94.3	Very high	28 Å²	28	59.5 Å²	59.5	12%	0.123	30%	0.301	C	S	.	.	H	α-helix	trans	-63.4	-47.7	177.6	175.7	-117.5	0	0	0	112.1	R268 E270 T274 W275 L276 L284 I296 L297 F300	R268-F272 WeakPolarHBondContact O-CB 3.29Å; R268-F272 PolarHBondContact O-N 2.94Å; E270-F272 VanDerWaalsContact C-N 3.32Å; E270-F272 PolarHBondContact O-N 3.07Å; F272-T274 VanDerWaalsContact C-N 3.34Å; F272-T274 PolarHBondContact O-N 2.94Å; F272-W275 HydrophobicContact CD2-CE3 4.24Å; F272-W275 HydrophobicContact CE2-CE3 4.23Å; F272-W275 HydrophobicContact CE2-CZ3 4.2Å; F272-W275 PolarHBondContact O-N 2.62Å; F272-L276 HydrophobicContact CE1-CD2 4.36Å; F272-L276 HydrophobicContact CZ-CD2 4.28Å; F272-L276 VanDerWaalsContact O-CB 3.27Å; F272-L276 WeakPolarHBondContact O-CB 3.39Å; F272-L276 PolarHBondContact O-N 2.9Å; F272-L284 HydrophobicContact CE1-CD2 4.19Å; F272-L284 HydrophobicContact CZ-CD1 4.14Å; F272-L284 HydrophobicContact CZ-CD2 4.48Å; F272-I296 HydrophobicContact CE2-CG2 4.29Å; F272-I296 HydrophobicContact CZ-CG2 4.44Å; F272-L297 HydrophobicContact CD2-CD1 4.4Å; F272-L297 HydrophobicContact CE2-CD1 4.07Å; F272-L297 HydrophobicContact CZ-CD1 4.19Å; F272-F300 HydrophobicContact CB-CD1 4.12Å; F272-F300 HydrophobicContact CB-CE1 3.68Å; F272-F300 HydrophobicContact CB-CE2 4.28Å; F272-F300 HydrophobicContact CB-CZ 3.76Å; F272-F300 HydrophobicContact CD2-CB 3.9Å; F272-F300 AromaticContact CD2-CD1 3.53Å; F272-F300 HydrophobicContact CD2-CD1 3.53Å; F272-F300 HydrophobicContact CD2-CD2 4.07Å; F272-F300 HydrophobicContact CD2-CE1 4.01Å; F272-F300 HydrophobicContact CD2-CE2 4.49Å; F272-F300 AromaticContact CD2-CG 3.55Å; F272-F300 HydrophobicContact CD2-CG 3.55Å; F272-F300 HydrophobicContact CD2-CZ 4.46Å; F272-F300 HydrophobicContact CE2-CB 4.09Å; F272-F300 HydrophobicContact CE2-CD1 4.37Å; F272-F300 HydrophobicContact CE2-CG 4.25Å; F272-F300 HydrophobicContact CG-CD1 4.19Å; F272-F300 HydrophobicContact CG-CE1 4.24Å
273	R	95.6	Very high	94.1	Very high	144 Å²	144	62.1 Å²	62.1	54%	0.543	32%	0.318	S	S	.	.	H	α-helix	trans	-61.1	-43.1	179.1	-74.6	-174.9	-67.3	97.5	-2.9	112	Q269 E270 L276 E277	Q269-R273 WeakPolarHBondContact O-CG 3.47Å; Q269-R273 PolarHBondContact O-N 3.31Å; Q269-R273 VanDerWaalsContact O-N 3.07Å; E270-R273 PolarHBondContact O-N 2.88Å; R273-L276 PolarHBondContact O-N 2.69Å; R273-E277 PolarHBondContact O-N 3.35Å
274	T	94.8	Very high	93.8	Very high	25 Å²	25	60.6 Å²	60.6	15%	0.153	32%	0.315	C	S	.	.	H	α-helix	trans	-65	-45.8	178.3	-52.8	0	0	0	0	110.7	M264 E270 F272 L276 E277 E278	M264-T274 HydrophobicContact CE-CG2 4.49Å; M264-T274 HydrophobicContact SD-CG2 4.36Å; M264-T274 PolarHBondContact SD-OG1 3.42Å; E270-T274 WeakPolarHBondContact O-CB 3.43Å; E270-T274 PolarHBondContact O-N 3.38Å; E270-T274 PolarHBondContact O-OG1 3.43Å; F272-T274 VanDerWaalsContact C-N 3.34Å; F272-T274 PolarHBondContact O-N 2.94Å; T274-L276 VanDerWaalsContact C-N 3.32Å; T274-L276 PolarHBondContact O-N 2.77Å; T274-E277 PolarHBondContact O-N 3.39Å; T274-E278 WeakPolarHBondContact O-CG 3.05Å; T274-E278 PolarHBondContact O-N 3.35Å
275	W	95.4	Very high	93.5	Very high	21 Å²	21	66.2 Å²	66.2	8%	0.08	34%	0.341	C	S	.	.	H	α-helix	trans	-61.3	-40	175	175.8	89.9	0	0	0	112.3	E271 F272 E278 E279 I296 K299 F300	E271-W275 VanDerWaalsContact O-CB 3.26Å; E271-W275 WeakPolarHBondContact O-CB 3.5Å; E271-W275 PolarHBondContact O-N 3.22Å; F272-W275 HydrophobicContact CD2-CE3 4.24Å; F272-W275 HydrophobicContact CE2-CE3 4.23Å; F272-W275 HydrophobicContact CE2-CZ3 4.2Å; F272-W275 PolarHBondContact O-N 2.62Å; W275-E278 PolarHBondContact O-N 3.49Å; W275-E279 HydrophobicContact CD2-CG 4.03Å; W275-E279 HydrophobicContact CG-CG 4.36Å; W275-E279 HydrophobicContact CZ2-CB 4.32Å; W275-E279 HydrophobicContact CZ2-CG 3.81Å; W275-E279 WeakPolarHBondContact O-CB 3.18Å; W275-E279 WeakPolarHBondContact O-CG 3.48Å; W275-E279 PolarHBondContact O-N 3.06Å; W275-I296 HydrophobicContact CH2-CG2 4.1Å; W275-I296 HydrophobicContact CZ3-CG2 3.63Å; W275-K299 HydrophobicContact CH2-CB 4.5Å; W275-K299 HydrophobicContact CH2-CG 4.49Å; W275-K299 HydrophobicContact CZ2-CG 4.28Å; W275-F300 HydrophobicContact CB-CD2 4Å; W275-F300 HydrophobicContact CB-CE2 4.06Å; W275-F300 HydrophobicContact CD2-CB 4.22Å; W275-F300 AromaticContact CD2-CD2 3.73Å; W275-F300 HydrophobicContact CD2-CD2 3.73Å; W275-F300 HydrophobicContact CD2-CG 4.41Å; W275-F300 HydrophobicContact CE3-CB 3.91Å; W275-F300 AromaticContact CE3-CD2 3.97Å; W275-F300 HydrophobicContact CE3-CD2 3.97Å; W275-F300 HydrophobicContact CE3-CG 4.28Å; W275-F300 AromaticContact CG-CD2 3.74Å; W275-F300 HydrophobicContact CG-CD2 3.74Å; W275-F300 HydrophobicContact CG-CE2 4.24Å; W275-F300 HydrophobicContact CH2-CB 4.11Å; W275-F300 HydrophobicContact CZ2-CB 4.4Å; W275-F300 HydrophobicContact CZ3-CB 3.85Å
276	L	95.3	Very high	93.2	Very high	6 Å²	6	64.8 Å²	64.8	3%	0.031	32%	0.324	C	S	.	.	H	α-helix	trans	-66.3	-42.2	178.8	-172.5	68.9	0	0	0	111.5	F272 R273 T274 E278 E279 W280 G281 R282 L284 I287 I296	F272-L276 HydrophobicContact CE1-CD2 4.36Å; F272-L276 HydrophobicContact CZ-CD2 4.28Å; F272-L276 VanDerWaalsContact O-CB 3.27Å; F272-L276 WeakPolarHBondContact O-CB 3.39Å; F272-L276 PolarHBondContact O-N 2.9Å; R273-L276 PolarHBondContact O-N 2.69Å; T274-L276 VanDerWaalsContact C-N 3.32Å; T274-L276 PolarHBondContact O-N 2.77Å; L276-E278 VanDerWaalsContact C-N 3.34Å; L276-E279 PolarHBondContact O-N 3.28Å; L276-W280 HydrophobicContact CD1-CB 4.23Å; L276-W280 HydrophobicContact CD1-CG 4.09Å; L276-W280 WeakPolarHBondContact O-CA 3.26Å; L276-W280 WeakPolarHBondContact O-CB 3.33Å; L276-W280 PolarHBondContact O-N 2.71Å; L276-G281 PolarHBondContact O-N 2.83Å; L276-R282 WeakPolarHBondContact CG-O 3.25Å; L276-L284 HydrophobicContact CD2-CB 3.97Å; L276-L284 HydrophobicContact CD2-CD1 4.38Å; L276-I287 HydrophobicContact CD1-CD1 4.32Å; L276-I296 HydrophobicContact CD1-CG2 3.5Å
277	E	93.9	Very high	92.9	Very high	135 Å²	135	63 Å²	63	63%	0.631	30%	0.304	S	S	*	.	H	α-helix	trans	-61.6	-42.9	173	-174.2	179.7	178.5	0	0	111.2	R273 T274 G281	R273-E277 PolarHBondContact O-N 3.35Å; T274-E277 PolarHBondContact O-N 3.39Å; E277-G281 WeakPolarHBondContact O-CA 3.35Å; E277-G281 PolarHBondContact O-N 3Å
278	E	91.4	Very high	92.1	Very high	70 Å²	70	70.4 Å²	70.4	33%	0.327	33%	0.328	S	S	.	.	H	α-helix	trans	-64.7	-47.5	177.6	-74.5	-178.8	-178.4	0	0	112.3	H204 R213 R215 H236 T274 W275 L276	H204-E278 PolarHBondContact NE2-O 2.89Å; R213-E278 PolarHBondContact NH1-O 2.77Å; R215-E278 IonicContact NH1-OE2 2.87Å; H236-E278 IonicContact CE1-OE1 3.8Å; T274-E278 WeakPolarHBondContact O-CG 3.05Å; T274-E278 PolarHBondContact O-N 3.35Å; W275-E278 PolarHBondContact O-N 3.49Å; L276-E278 VanDerWaalsContact C-N 3.34Å
279	E	91.7	Very high	91.8	Very high	24 Å²	24	71.2 Å²	71.2	11%	0.112	34%	0.336	C	S	.	.	H	α-helix	trans	-84.1	-31.5	-172.5	-70.9	-66.7	88.6	0	0	114.5	H204 R213 W275 L276	H204-E279 VanDerWaalsContact CD2-C 3.48Å; H204-E279 PolarHBondContact CD2-O 2.94Å; H204-E279 VanDerWaalsContact CD2-O 3.23Å; R213-E279 IonicContact CZ-OE1 3.75Å; R213-E279 VanDerWaalsContact CZ-OE1 3.26Å; R213-E279 IonicContact NH1-OE1 3.75Å; R213-E279 PolarHBondContact NH1-OE1 2.85Å; R213-E279 IonicContact NH2-OE1 3.34Å; R213-E279 PolarHBondContact NH2-OE1 2.77Å; W275-E279 HydrophobicContact CD2-CG 4.03Å; W275-E279 HydrophobicContact CG-CG 4.36Å; W275-E279 HydrophobicContact CZ2-CB 4.32Å; W275-E279 HydrophobicContact CZ2-CG 3.81Å; W275-E279 WeakPolarHBondContact O-CB 3.18Å; W275-E279 WeakPolarHBondContact O-CG 3.48Å; W275-E279 PolarHBondContact O-N 3.06Å; L276-E279 PolarHBondContact O-N 3.28Å
280	W	92.1	Very high	91.5	Very high	20 Å²	20	71 Å²	71	8%	0.076	33%	0.334	C	S	.	.	H	α-helix	trans	-122.8	-21.3	-174.3	-67.4	84.1	0	0	0	113.9	H204 D205 L276 R282 M292 I296	H204-W280 WeakPolarHBondContact CB-O 3.44Å; D205-W280 HydrophobicContact CB-CE3 4.1Å; D205-W280 HydrophobicContact CB-CZ3 3.65Å; L276-W280 HydrophobicContact CD1-CB 4.23Å; L276-W280 HydrophobicContact CD1-CG 4.09Å; L276-W280 WeakPolarHBondContact O-CA 3.26Å; L276-W280 WeakPolarHBondContact O-CB 3.33Å; L276-W280 PolarHBondContact O-N 2.71Å; W280-R282 PolarHBondContact O-N 2.99Å; W280-M292 HydrophobicContact CE3-CE 3.79Å; W280-M292 HydrophobicContact CH2-CE 4.02Å; W280-M292 HydrophobicContact CH2-CG 4.39Å; W280-M292 HydrophobicContact CH2-SD 4.38Å; W280-M292 HydrophobicContact CZ3-CE 3.4Å; W280-M292 HydrophobicContact CZ3-SD 4.19Å; W280-I296 HydrophobicContact CD2-CD1 3.81Å; W280-I296 HydrophobicContact CD2-CG1 4.43Å; W280-I296 VanDerWaalsContact CE2-CD1 3.41Å; W280-I296 HydrophobicContact CE3-CD1 4.26Å; W280-I296 HydrophobicContact CG-CD1 4.36Å; W280-I296 HydrophobicContact CH2-CD1 4Å; W280-I296 HydrophobicContact CH2-CG1 4.26Å; W280-I296 HydrophobicContact CZ2-CD1 3.53Å; W280-I296 HydrophobicContact CZ2-CG1 3.45Å; W280-I296 VanDerWaalsContact CZ2-CG1 3.45Å; W280-I296 HydrophobicContact CZ3-CD1 4.36Å
281	G	91.8	Very high	91.3	Very high	40 Å²	40	73.5 Å²	73.5	41%	0.412	35%	0.346	S	S	.	.	S	Bend	trans	63	23.3	-178	0	0	0	0	0	113.8	H204 L276 E277	H204-G281 WeakPolarHBondContact CE1-CA 3.26Å; H204-G281 PolarHBondContact CE1-N 3.07Å; H204-G281 PolarHBondContact NE2-N 3.14Å; L276-G281 PolarHBondContact O-N 2.83Å; E277-G281 WeakPolarHBondContact O-CA 3.35Å; E277-G281 PolarHBondContact O-N 3Å
282	R	90.2	Very high	91.1	Very high	103 Å²	103	73.3 Å²	73.3	39%	0.389	35%	0.345	S	S	.	.	S	Bend	trans	-140.2	157.6	-177.8	-64.5	-173.7	-164.4	-166.4	7	110	L276 W280 E286	L276-R282 WeakPolarHBondContact CG-O 3.25Å; W280-R282 PolarHBondContact O-N 2.99Å; R282-E286 VanDerWaalsContact CA-OE2 3.23Å; R282-E286 WeakPolarHBondContact CA-OE2 3.45Å; R282-E286 HydrophobicContact CB-CB 4.27Å; R282-E286 WeakPolarHBondContact CB-OE2 3.41Å
283	T	90.9	Very high	90.9	Very high	63 Å²	63	74.7 Å²	74.7	39%	0.387	35%	0.352	S	S	.	.			trans	-81.1	166.3	168.4	82.8	0	0	0	0	110.8	E285 E286	T283-E285 VanDerWaalsContact C-N 3.25Å; T283-E285 WeakPolarHBondContact CB-OE2 3.35Å; T283-E285 PolarHBondContact O-N 2.97Å; T283-E285 PolarHBondContact OG1-OE2 2.74Å; T283-E286 PolarHBondContact N-OE2 2.93Å; T283-E286 PolarHBondContact O-N 3.08Å
284	L	89.4	Confident	90.9	Very high	44 Å²	44	73.8 Å²	73.8	23%	0.23	35%	0.354	C	S	.	.	S	Bend	trans	-66.4	-33.6	-179.3	-166.6	67.4	0	0	0	111.1	F272 L276 E286 I287 Q293	F272-L284 HydrophobicContact CE1-CD2 4.19Å; F272-L284 HydrophobicContact CZ-CD1 4.14Å; F272-L284 HydrophobicContact CZ-CD2 4.48Å; L276-L284 HydrophobicContact CD2-CB 3.97Å; L276-L284 HydrophobicContact CD2-CD1 4.38Å; L284-E286 VanDerWaalsContact C-N 3.3Å; L284-E286 PolarHBondContact O-N 3.3Å; L284-I287 WeakPolarHBondContact O-CB 3.4Å; L284-I287 PolarHBondContact O-N 3.21Å; L284-Q293 HydrophobicContact CD1-CB 3.86Å; L284-Q293 HydrophobicContact CD1-CG 3.81Å; L284-Q293 HydrophobicContact CG-CB 4.46Å; L284-Q293 HydrophobicContact CG-CG 4.18Å; L284-Q293 PolarHBondContact O-NE2 3.26Å
285	E	87.9	Confident	90.9	Very high	150 Å²	150	73.3 Å²	73.3	70%	0.701	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-27.6	179.2	-55.7	77.2	-167.2	0	0	112.7	T283 I287	T283-E285 VanDerWaalsContact C-N 3.25Å; T283-E285 WeakPolarHBondContact CB-OE2 3.35Å; T283-E285 PolarHBondContact O-N 2.97Å; T283-E285 PolarHBondContact OG1-OE2 2.74Å; E285-I287 PolarHBondContact O-N 3.45Å
286	E	88.8	Confident	91	Very high	99 Å²	99	72.5 Å²	72.5	46%	0.463	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-10.6	175.8	-66.9	173.2	156.5	0	0	112.6	R282 T283 L284 F288	R282-E286 VanDerWaalsContact CA-OE2 3.23Å; R282-E286 WeakPolarHBondContact CA-OE2 3.45Å; R282-E286 HydrophobicContact CB-CB 4.27Å; R282-E286 WeakPolarHBondContact CB-OE2 3.41Å; T283-E286 PolarHBondContact N-OE2 2.93Å; T283-E286 PolarHBondContact O-N 3.08Å; L284-E286 VanDerWaalsContact C-N 3.3Å; L284-E286 PolarHBondContact O-N 3.3Å; E286-F288 PolarHBondContact O-N 3.45Å
287	I	87.1	Confident	91	Very high	3 Å²	3	75.9 Å²	75.9	2%	0.015	37%	0.365	C	S	.	.			trans	-92.7	97.1	177.6	-64.5	170.1	0	0	0	108.2	L276 L284 E285 H289 M292 Q293 I296	L276-I287 HydrophobicContact CD1-CD1 4.32Å; L284-I287 WeakPolarHBondContact O-CB 3.4Å; L284-I287 PolarHBondContact O-N 3.21Å; E285-I287 PolarHBondContact O-N 3.45Å; I287-H289 VanDerWaalsContact C-N 3.29Å; I287-H289 PolarHBondContact O-N 3.34Å; I287-M292 HydrophobicContact CB-CE 4.09Å; I287-M292 HydrophobicContact CD1-CE 3.98Å; I287-M292 HydrophobicContact CG1-CE 3.77Å; I287-M292 HydrophobicContact CG2-CB 4.09Å; I287-M292 HydrophobicContact CG2-CE 3.28Å; I287-M292 HydrophobicContact CG2-CG 3.89Å; I287-M292 HydrophobicContact CG2-SD 3.93Å; I287-Q293 HydrophobicContact CB-CG 4.21Å; I287-Q293 HydrophobicContact CG2-CG 3.8Å; I287-Q293 PolarHBondContact O-NE2 2.99Å; I287-I296 HydrophobicContact CD1-CD1 3.59Å
288	F	80.6	Confident	91.1	Very high	186 Å²	186	72.4 Å²	72.4	82%	0.816	35%	0.35	S	S	*	.			trans	-67.1	-21.1	-171.4	-67.8	-75.9	0	0	0	115.8	E286	E286-F288 PolarHBondContact O-N 3.45Å
289	H	86.1	Confident	91.4	Very high	112 Å²	112	70.9 Å²	70.9	52%	0.519	34%	0.342	S	S	.	.			trans	-96.2	113	-175.3	-66.8	-68.3	0	0	0	111.4	I287 H291 M292 Q293	I287-H289 VanDerWaalsContact C-N 3.29Å; I287-H289 PolarHBondContact O-N 3.34Å; H289-H291 VanDerWaalsContact C-N 3.3Å; H289-H291 PolarHBondContact O-N 3.16Å; H289-M292 HydrophobicContact CB-CB 4.03Å; H289-M292 WeakPolarHBondContact O-CB 3.43Å; H289-M292 PolarHBondContact O-N 3.49Å; H289-Q293 PolarHBondContact O-N 3.26Å; H289-Q293 VanDerWaalsContact O-N 3.14Å
290	E	89.7	Confident	91.6	Very high	150 Å²	150	70.3 Å²	70.3	70%	0.701	34%	0.34	S	S	*	.	H	α-helix	trans	-53	-45.6	179.5	-67.1	-178.8	169.8	0	0	112.4	M292 Q293 E294	E290-M292 VanDerWaalsContact C-N 3.26Å; E290-M292 PolarHBondContact O-N 3.08Å; E290-Q293 WeakPolarHBondContact O-CA 3.32Å; E290-Q293 WeakPolarHBondContact O-CB 3.41Å; E290-Q293 PolarHBondContact O-N 3.24Å; E290-E294 PolarHBondContact O-N 3.38Å
291	H	90.9	Very high	91.8	Very high	102 Å²	102	73.1 Å²	73.1	47%	0.472	36%	0.355	S	S	.	.	H	α-helix	trans	-58.8	-36.2	177.7	-175.6	54.2	0	0	0	113.2	H289 E294 L295	H289-H291 VanDerWaalsContact C-N 3.3Å; H289-H291 PolarHBondContact O-N 3.16Å; H291-E294 IonicContact ND1-OE2 3.82Å; H291-E294 PolarHBondContact O-N 3.02Å; H291-L295 VanDerWaalsContact O-CG 3.32Å; H291-L295 WeakPolarHBondContact O-CG 3.24Å; H291-L295 PolarHBondContact O-N 3.28Å; H291-L295 VanDerWaalsContact O-N 3.09Å
292	M	92.5	Very high	92.1	Very high	15 Å²	15	75.6 Å²	75.6	7%	0.074	35%	0.352	C	S	.	.	H	α-helix	trans	-68.9	-39.3	175.5	-178.7	173.4	131	0	0	110.9	W280 I287 H289 E290 E294 L295 I296	W280-M292 HydrophobicContact CE3-CE 3.79Å; W280-M292 HydrophobicContact CH2-CE 4.02Å; W280-M292 HydrophobicContact CH2-CG 4.39Å; W280-M292 HydrophobicContact CH2-SD 4.38Å; W280-M292 HydrophobicContact CZ3-CE 3.4Å; W280-M292 HydrophobicContact CZ3-SD 4.19Å; I287-M292 HydrophobicContact CB-CE 4.09Å; I287-M292 HydrophobicContact CD1-CE 3.98Å; I287-M292 HydrophobicContact CG1-CE 3.77Å; I287-M292 HydrophobicContact CG2-CB 4.09Å; I287-M292 HydrophobicContact CG2-CE 3.28Å; I287-M292 HydrophobicContact CG2-CG 3.89Å; I287-M292 HydrophobicContact CG2-SD 3.93Å; H289-M292 HydrophobicContact CB-CB 4.03Å; H289-M292 WeakPolarHBondContact O-CB 3.43Å; H289-M292 PolarHBondContact O-N 3.49Å; E290-M292 VanDerWaalsContact C-N 3.26Å; E290-M292 PolarHBondContact O-N 3.08Å; M292-E294 VanDerWaalsContact C-N 3.33Å; M292-E294 PolarHBondContact O-N 3.4Å; M292-L295 PolarHBondContact O-N 3.01Å; M292-I296 HydrophobicContact CE-CD1 4.1Å; M292-I296 HydrophobicContact CG-CD1 3.82Å; M292-I296 HydrophobicContact CG-CG1 4.45Å; M292-I296 WeakPolarHBondContact O-CB 3.18Å; M292-I296 WeakPolarHBondContact O-CD1 3.49Å; M292-I296 WeakPolarHBondContact O-CG1 3.05Å; M292-I296 PolarHBondContact O-N 3.5Å
293	Q	93.3	Very high	92.3	Very high	56 Å²	56	72.2 Å²	72.2	26%	0.262	34%	0.343	S	S	.	.	H	α-helix	trans	-60.2	-43	174.1	-59.6	-179	6.9	0	0	111.7	L284 I287 H289 E290 I296 L297	L284-Q293 HydrophobicContact CD1-CB 3.86Å; L284-Q293 HydrophobicContact CD1-CG 3.81Å; L284-Q293 HydrophobicContact CG-CB 4.46Å; L284-Q293 HydrophobicContact CG-CG 4.18Å; L284-Q293 PolarHBondContact O-NE2 3.26Å; I287-Q293 HydrophobicContact CB-CG 4.21Å; I287-Q293 HydrophobicContact CG2-CG 3.8Å; I287-Q293 PolarHBondContact O-NE2 2.99Å; H289-Q293 PolarHBondContact O-N 3.26Å; H289-Q293 VanDerWaalsContact O-N 3.14Å; E290-Q293 WeakPolarHBondContact O-CA 3.32Å; E290-Q293 WeakPolarHBondContact O-CB 3.41Å; E290-Q293 PolarHBondContact O-N 3.24Å; Q293-I296 PolarHBondContact O-N 3.14Å; Q293-L297 WeakPolarHBondContact O-CB 3.23Å; Q293-L297 PolarHBondContact O-N 2.97Å
294	E	94.6	Very high	92.4	Very high	126 Å²	126	69.7 Å²	69.7	59%	0.589	33%	0.328	S	S	*	.	H	α-helix	trans	-61.1	-47.3	176.8	-68.9	177.2	164	0	0	112	E290 H291 M292 I296 L297 M298	E290-E294 PolarHBondContact O-N 3.38Å; H291-E294 IonicContact ND1-OE2 3.82Å; H291-E294 PolarHBondContact O-N 3.02Å; M292-E294 VanDerWaalsContact C-N 3.33Å; M292-E294 PolarHBondContact O-N 3.4Å; E294-I296 VanDerWaalsContact C-N 3.34Å; E294-I296 PolarHBondContact O-N 3.28Å; E294-L297 PolarHBondContact O-N 3.22Å; E294-M298 VanDerWaalsContact O-CB 3.32Å; E294-M298 WeakPolarHBondContact O-CB 3.21Å; E294-M298 PolarHBondContact O-N 2.8Å
295	L	95.8	Very high	92.7	Very high	14 Å²	14	74 Å²	74	7%	0.073	35%	0.347	C	S	.	.	H	α-helix	trans	-61.7	-42.1	177.7	-70.7	172.1	0	0	0	111.8	H291 M292 M298 K299	H291-L295 VanDerWaalsContact O-CG 3.32Å; H291-L295 WeakPolarHBondContact O-CG 3.24Å; H291-L295 PolarHBondContact O-N 3.28Å; H291-L295 VanDerWaalsContact O-N 3.09Å; M292-L295 PolarHBondContact O-N 3.01Å; L295-M298 HydrophobicContact CD2-CE 3.82Å; L295-M298 PolarHBondContact O-N 3.2Å; L295-K299 WeakPolarHBondContact O-CB 3.28Å; L295-K299 PolarHBondContact O-N 3.13Å
296	I	96	Very high	93	Very high	4 Å²	4	69.8 Å²	69.8	2%	0.021	33%	0.326	C	S	.	.	H	α-helix	trans	-62.9	-47.8	177.1	-73.3	171.7	0	0	0	110.8	F272 W275 L276 W280 I287 M292 Q293 E294 M298 K299 F300	F272-I296 HydrophobicContact CE2-CG2 4.29Å; F272-I296 HydrophobicContact CZ-CG2 4.44Å; W275-I296 HydrophobicContact CH2-CG2 4.1Å; W275-I296 HydrophobicContact CZ3-CG2 3.63Å; L276-I296 HydrophobicContact CD1-CG2 3.5Å; W280-I296 HydrophobicContact CD2-CD1 3.81Å; W280-I296 HydrophobicContact CD2-CG1 4.43Å; W280-I296 VanDerWaalsContact CE2-CD1 3.41Å; W280-I296 HydrophobicContact CE3-CD1 4.26Å; W280-I296 HydrophobicContact CG-CD1 4.36Å; W280-I296 HydrophobicContact CH2-CD1 4Å; W280-I296 HydrophobicContact CH2-CG1 4.26Å; W280-I296 HydrophobicContact CZ2-CD1 3.53Å; W280-I296 HydrophobicContact CZ2-CG1 3.45Å; W280-I296 VanDerWaalsContact CZ2-CG1 3.45Å; W280-I296 HydrophobicContact CZ3-CD1 4.36Å; I287-I296 HydrophobicContact CD1-CD1 3.59Å; M292-I296 HydrophobicContact CE-CD1 4.1Å; M292-I296 HydrophobicContact CG-CD1 3.82Å; M292-I296 HydrophobicContact CG-CG1 4.45Å; M292-I296 WeakPolarHBondContact O-CB 3.18Å; M292-I296 WeakPolarHBondContact O-CD1 3.49Å; M292-I296 WeakPolarHBondContact O-CG1 3.05Å; M292-I296 PolarHBondContact O-N 3.5Å; Q293-I296 PolarHBondContact O-N 3.14Å; E294-I296 VanDerWaalsContact C-N 3.34Å; E294-I296 PolarHBondContact O-N 3.28Å; I296-M298 VanDerWaalsContact C-N 3.35Å; I296-K299 PolarHBondContact O-N 3.09Å; I296-F300 PolarHBondContact O-N 3.17Å
297	L	95.9	Very high	93.2	Very high	77 Å²	77	66.3 Å²	66.3	40%	0.403	31%	0.31	S	S	.	.	H	α-helix	trans	-63.5	-43.1	179	-176.5	62.6	0	0	0	111.1	F272 Q293 E294 F300 I301	F272-L297 HydrophobicContact CD2-CD1 4.4Å; F272-L297 HydrophobicContact CE2-CD1 4.07Å; F272-L297 HydrophobicContact CZ-CD1 4.19Å; Q293-L297 WeakPolarHBondContact O-CB 3.23Å; Q293-L297 PolarHBondContact O-N 2.97Å; E294-L297 PolarHBondContact O-N 3.22Å; L297-F300 PolarHBondContact O-N 2.86Å; L297-I301 HydrophobicContact CD1-CD1 4.09Å; L297-I301 HydrophobicContact CD1-CG1 4.38Å; L297-I301 HydrophobicContact CG-CD1 3.88Å; L297-I301 VanDerWaalsContact O-CG1 3.28Å; L297-I301 WeakPolarHBondContact O-CG1 3.44Å; L297-I301 PolarHBondContact O-N 2.75Å
298	M	96.2	Very high	93.4	Very high	63 Å²	63	66.7 Å²	66.7	31%	0.31	31%	0.312	S	S	.	.	H	α-helix	trans	-61.3	-45.5	175.4	-178	176.3	59.2	0	0	111.4	E294 L295 I296 F300 I301 Y302 P361	E294-M298 VanDerWaalsContact O-CB 3.32Å; E294-M298 WeakPolarHBondContact O-CB 3.21Å; E294-M298 PolarHBondContact O-N 2.8Å; L295-M298 HydrophobicContact CD2-CE 3.82Å; L295-M298 PolarHBondContact O-N 3.2Å; I296-M298 VanDerWaalsContact C-N 3.35Å; M298-F300 PolarHBondContact O-N 2.88Å; M298-I301 PolarHBondContact O-N 3.27Å; M298-Y302 VanDerWaalsContact O-CB 3.24Å; M298-Y302 WeakPolarHBondContact O-CB 3.43Å; M298-Y302 PolarHBondContact O-N 3.02Å; M298-P361 HydrophobicContact CE-CB 4.4Å; M298-P361 HydrophobicContact CE-CG 3.53Å
299	K	97.3	Very high	94.2	Very high	38 Å²	38	60.3 Å²	60.3	17%	0.165	29%	0.29	C	S	.	.	H	α-helix	trans	-59.7	-46.2	176.1	-174.8	169.5	-175	170.4	0	111.1	Y182 W275 L295 I296 T303	Y182-K299 HydrophobicContact CD1-CD 3.8Å; Y182-K299 HydrophobicContact CD1-CG 3.81Å; Y182-K299 HydrophobicContact CE1-CB 3.78Å; Y182-K299 HydrophobicContact CE1-CD 3.75Å; Y182-K299 HydrophobicContact CE1-CG 3.56Å; Y182-K299 HydrophobicContact CE2-CG 4.37Å; Y182-K299 HydrophobicContact CG-CG 4.31Å; Y182-K299 WeakPolarHBondContact OH-CA 3.49Å; W275-K299 HydrophobicContact CH2-CB 4.5Å; W275-K299 HydrophobicContact CH2-CG 4.49Å; W275-K299 HydrophobicContact CZ2-CG 4.28Å; L295-K299 WeakPolarHBondContact O-CB 3.28Å; L295-K299 PolarHBondContact O-N 3.13Å; I296-K299 PolarHBondContact O-N 3.09Å; K299-T303 HydrophobicContact CG-CG2 4.11Å; K299-T303 VanDerWaalsContact O-CB 3.32Å; K299-T303 WeakPolarHBondContact O-CB 3.47Å; K299-T303 WeakPolarHBondContact O-CG2 3.42Å; K299-T303 PolarHBondContact O-N 2.88Å; K299-T303 PolarHBondContact O-OG1 2.88Å
300	F	97.1	Very high	94.7	Very high	12 Å²	12	55.4 Å²	55.4	5%	0.053	27%	0.268	C	S	.	.	H	α-helix	trans	-59.1	-52.5	175.6	170	-107	0	0	0	111.8	E271 F272 W275 I296 L297 M298 Y302 T303 S304	E271-F300 HydrophobicContact CB-CE2 4.5Å; E271-F300 HydrophobicContact CB-CZ 4.12Å; F272-F300 HydrophobicContact CB-CD1 4.12Å; F272-F300 HydrophobicContact CB-CE1 3.68Å; F272-F300 HydrophobicContact CB-CE2 4.28Å; F272-F300 HydrophobicContact CB-CZ 3.76Å; F272-F300 HydrophobicContact CD2-CB 3.9Å; F272-F300 AromaticContact CD2-CD1 3.53Å; F272-F300 HydrophobicContact CD2-CD1 3.53Å; F272-F300 HydrophobicContact CD2-CD2 4.07Å; F272-F300 HydrophobicContact CD2-CE1 4.01Å; F272-F300 HydrophobicContact CD2-CE2 4.49Å; F272-F300 AromaticContact CD2-CG 3.55Å; F272-F300 HydrophobicContact CD2-CG 3.55Å; F272-F300 HydrophobicContact CD2-CZ 4.46Å; F272-F300 HydrophobicContact CE2-CB 4.09Å; F272-F300 HydrophobicContact CE2-CD1 4.37Å; F272-F300 HydrophobicContact CE2-CG 4.25Å; F272-F300 HydrophobicContact CG-CD1 4.19Å; F272-F300 HydrophobicContact CG-CE1 4.24Å; W275-F300 HydrophobicContact CB-CD2 4Å; W275-F300 HydrophobicContact CB-CE2 4.06Å; W275-F300 HydrophobicContact CD2-CB 4.22Å; W275-F300 AromaticContact CD2-CD2 3.73Å; W275-F300 HydrophobicContact CD2-CD2 3.73Å; W275-F300 HydrophobicContact CD2-CG 4.41Å; W275-F300 HydrophobicContact CE3-CB 3.91Å; W275-F300 AromaticContact CE3-CD2 3.97Å; W275-F300 HydrophobicContact CE3-CD2 3.97Å; W275-F300 HydrophobicContact CE3-CG 4.28Å; W275-F300 AromaticContact CG-CD2 3.74Å; W275-F300 HydrophobicContact CG-CD2 3.74Å; W275-F300 HydrophobicContact CG-CE2 4.24Å; W275-F300 HydrophobicContact CH2-CB 4.11Å; W275-F300 HydrophobicContact CZ2-CB 4.4Å; W275-F300 HydrophobicContact CZ3-CB 3.85Å; I296-F300 PolarHBondContact O-N 3.17Å; L297-F300 PolarHBondContact O-N 2.86Å; M298-F300 PolarHBondContact O-N 2.88Å; F300-Y302 VanDerWaalsContact C-N 3.32Å; F300-Y302 PolarHBondContact O-N 2.81Å; F300-T303 PolarHBondContact O-OG1 3.1Å; F300-S304 WeakPolarHBondContact O-CB 3.4Å; F300-S304 PolarHBondContact O-N 2.87Å; F300-S304 PolarHBondContact O-OG 2.92Å
301	I	96.2	Very high	95.1	Very high	78 Å²	78	50.6 Å²	50.6	40%	0.4	25%	0.249	S	C	.	.	H	α-helix	trans	-59.8	-46.2	-177.3	-68.9	168.3	0	0	0	110.2	L297 M298 S304 Q305	L297-I301 HydrophobicContact CD1-CD1 4.09Å; L297-I301 HydrophobicContact CD1-CG1 4.38Å; L297-I301 HydrophobicContact CG-CD1 3.88Å; L297-I301 VanDerWaalsContact O-CG1 3.28Å; L297-I301 WeakPolarHBondContact O-CG1 3.44Å; L297-I301 PolarHBondContact O-N 2.75Å; M298-I301 PolarHBondContact O-N 3.27Å; I301-S304 PolarHBondContact O-OG 3.21Å; I301-Q305 VanDerWaalsContact O-CG 3.29Å; I301-Q305 WeakPolarHBondContact O-CG 3.45Å; I301-Q305 PolarHBondContact O-N 3Å; I301-Q305 PolarHBondContact O-NE2 2.95Å
302	Y	96.6	Very high	95.4	Very high	92 Å²	92	45.8 Å²	45.8	36%	0.361	23%	0.226	S	C	.	.	H	α-helix	trans	-66.1	-54.5	-177.7	-171.1	-87.1	0	0	0	112.1	I179 G180 Y182 M298 F300 S304 Q305 Y306	I179-Y302 HydrophobicContact CG2-CD1 4.39Å; I179-Y302 HydrophobicContact CG2-CE1 4.35Å; G180-Y302 WeakPolarHBondContact CA-OH 3.2Å; Y182-Y302 AromaticContact CD2-CD1 3.71Å; Y182-Y302 HydrophobicContact CD2-CD1 3.71Å; Y182-Y302 HydrophobicContact CD2-CE1 4.2Å; Y182-Y302 HydrophobicContact CD2-CG 4.46Å; Y182-Y302 AromaticContact CE2-CD1 3.59Å; Y182-Y302 HydrophobicContact CE2-CD1 3.59Å; Y182-Y302 HydrophobicContact CE2-CE1 4.31Å; Y182-Y302 AromaticContact CE2-CG 3.89Å; Y182-Y302 HydrophobicContact CE2-CG 3.89Å; M298-Y302 VanDerWaalsContact O-CB 3.24Å; M298-Y302 WeakPolarHBondContact O-CB 3.43Å; M298-Y302 PolarHBondContact O-N 3.02Å; F300-Y302 VanDerWaalsContact C-N 3.32Å; F300-Y302 PolarHBondContact O-N 2.81Å; Y302-S304 VanDerWaalsContact C-N 3.3Å; Y302-S304 PolarHBondContact O-N 2.81Å; Y302-Q305 WeakPolarHBondContact O-CB 3.49Å; Y302-Q305 PolarHBondContact O-N 3.31Å; Y302-Y306 AromaticContact CD1-CE2 3.99Å; Y302-Y306 HydrophobicContact CD1-CE2 3.99Å; Y302-Y306 AromaticContact CE1-CE2 3.66Å; Y302-Y306 HydrophobicContact CE1-CE2 3.66Å; Y302-Y306 PolarHBondContact OH-OH 3.3Å
303	T	94.9	Very high	95.6	Very high	32 Å²	32	47.9 Å²	47.9	20%	0.196	23%	0.233	C	C	.	.	H	α-helix	trans	-64.9	-34.9	-176.1	57.9	0	0	0	0	112.1	I179 Y182 K299 F300 Q305 Y306	I179-T303 HydrophobicContact CG2-CG2 3.84Å; Y182-T303 HydrophobicContact CD2-CG2 3.93Å; Y182-T303 HydrophobicContact CE2-CG2 4.44Å; Y182-T303 HydrophobicContact CG-CG2 4.32Å; K299-T303 HydrophobicContact CG-CG2 4.11Å; K299-T303 VanDerWaalsContact O-CB 3.32Å; K299-T303 WeakPolarHBondContact O-CB 3.47Å; K299-T303 WeakPolarHBondContact O-CG2 3.42Å; K299-T303 PolarHBondContact O-N 2.88Å; K299-T303 PolarHBondContact O-OG1 2.88Å; F300-T303 PolarHBondContact O-OG1 3.1Å; T303-Q305 VanDerWaalsContact C-N 3.28Å; T303-Q305 PolarHBondContact O-N 2.97Å; T303-Y306 PolarHBondContact O-N 3.12Å
304	S	94.1	Very high	95.9	Very high	10 Å²	10	46.5 Å²	46.5	7%	0.07	23%	0.226	C	C	.	.	H	α-helix	trans	-73.9	-13.4	178.9	62.2	0	0	0	0	114.5	R268 F300 I301 Y302 Y306 D307	R268-S304 PolarHBondContact NH1-OG 2.69Å; R268-S304 PolarHBondContact NH2-OG 2.66Å; F300-S304 WeakPolarHBondContact O-CB 3.4Å; F300-S304 PolarHBondContact O-N 2.87Å; F300-S304 PolarHBondContact O-OG 2.92Å; I301-S304 PolarHBondContact O-OG 3.21Å; Y302-S304 VanDerWaalsContact C-N 3.3Å; Y302-S304 PolarHBondContact O-N 2.81Å; S304-Y306 PolarHBondContact O-N 2.95Å; S304-D307 PolarHBondContact O-N 2.87Å
305	Q	94.3	Very high	96	Very high	135 Å²	135	40.5 Å²	40.5	63%	0.631	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-28.6	172.1	-62.2	-51.6	-29	0	0	112.6	I301 Y302 T303 D307	I301-Q305 VanDerWaalsContact O-CG 3.29Å; I301-Q305 WeakPolarHBondContact O-CG 3.45Å; I301-Q305 PolarHBondContact O-N 3Å; I301-Q305 PolarHBondContact O-NE2 2.95Å; Y302-Q305 WeakPolarHBondContact O-CB 3.49Å; Y302-Q305 PolarHBondContact O-N 3.31Å; T303-Q305 VanDerWaalsContact C-N 3.28Å; T303-Q305 PolarHBondContact O-N 2.97Å; Q305-D307 VanDerWaalsContact C-N 3.26Å; Q305-D307 PolarHBondContact O-N 3.27Å
306	Y	94.6	Very high	96.2	Very high	62 Å²	62	41 Å²	41	24%	0.243	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-27.2	-179.9	-69.4	-97.3	0	0	0	111.7	D178 I179 G180 Y302 T303 S304 N308 C309 L310	D178-Y306 WeakPolarHBondContact O-CE1 3.3Å; I179-Y306 HydrophobicContact CG2-CD2 3.97Å; I179-Y306 HydrophobicContact CG2-CE2 3.7Å; G180-Y306 PolarHBondContact N-OH 3.35Å; Y302-Y306 AromaticContact CD1-CE2 3.99Å; Y302-Y306 HydrophobicContact CD1-CE2 3.99Å; Y302-Y306 AromaticContact CE1-CE2 3.66Å; Y302-Y306 HydrophobicContact CE1-CE2 3.66Å; Y302-Y306 PolarHBondContact OH-OH 3.3Å; T303-Y306 PolarHBondContact O-N 3.12Å; S304-Y306 PolarHBondContact O-N 2.95Å; Y306-N308 PolarHBondContact O-N 3.45Å; Y306-N308 VanDerWaalsContact O-N 3.11Å; Y306-C309 WeakPolarHBondContact O-CA 3.47Å; Y306-C309 VanDerWaalsContact O-CB 3.27Å; Y306-C309 WeakPolarHBondContact O-CB 3.48Å; Y306-C309 PolarHBondContact O-N 3.37Å; Y306-L310 HydrophobicContact CD1-CD2 3.67Å; Y306-L310 HydrophobicContact CE1-CD2 4.48Å; Y306-L310 HydrophobicContact CG-CD2 3.82Å
307	D	93.4	Very high	96.2	Very high	25 Å²	25	42 Å²	42	13%	0.134	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.2	42.6	177.2	-142.9	14.2	0	0	0	113.2	T259 H262 R263 S304 Q305 C309	T259-D307 WeakPolarHBondContact CB-OD2 3.37Å; T259-D307 HydrophobicContact CG2-CB 4.39Å; T259-D307 WeakPolarHBondContact CG2-OD2 3.44Å; H262-D307 PolarHBondContact CE1-O 2.62Å; H262-D307 IonicContact CE1-OD1 2.6Å; H262-D307 IonicContact CG-OD1 2.71Å; H262-D307 IonicContact ND1-OD1 3.56Å; H262-D307 PolarHBondContact ND1-OD1 3Å; H262-D307 IonicContact ND1-OD2 3.92Å; R263-D307 IonicContact CZ-OD1 3.99Å; R263-D307 IonicContact NH2-OD1 2.94Å; R263-D307 PolarHBondContact NH2-OD1 3.45Å; R263-D307 IonicContact NH2-OD2 2.66Å; R263-D307 PolarHBondContact NH2-OD2 3.09Å; S304-D307 PolarHBondContact O-N 2.87Å; Q305-D307 VanDerWaalsContact C-N 3.26Å; Q305-D307 PolarHBondContact O-N 3.27Å; D307-C309 PolarHBondContact O-N 2.93Å; D307-C309 VanDerWaalsContact O-N 3.15Å
308	N	92.2	Very high	96.3	Very high	11 Å²	11	38.7 Å²	38.7	6%	0.059	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.1	14	-174.8	-159.7	48.2	0	0	0	115.9	L217 C232 Y234 T254 Y306 L310	L217-N308 PolarHBondContact O-ND2 2.68Å; C232-N308 PolarHBondContact SG-ND2 2.8Å; Y234-N308 HydrophobicContact CD1-CB 3.96Å; Y234-N308 HydrophobicContact CD2-CB 4.25Å; Y234-N308 HydrophobicContact CG-CB 3.73Å; T254-N308 PolarHBondContact OG1-O 2.79Å; Y306-N308 PolarHBondContact O-N 3.45Å; Y306-N308 VanDerWaalsContact O-N 3.11Å; N308-L310 PolarHBondContact O-N 3.35Å
309	C	96.3	Very high	96.2	Very high	52 Å²	52	37.3 Å²	37.3	35%	0.351	18%	0.183	S	C	.	.			trans	-88.3	89.8	165.3	-59.5	0	0	0	0	108.6	T254 C256 Y306 D307	T254-C309 CarbonylContact O-C 3.52Å; T254-C309 VanDerWaalsContact O-CA 3.27Å; T254-C309 WeakPolarHBondContact O-CA 3.21Å; C256-C309 PolarHBondContact N-SG 3.14Å; Y306-C309 WeakPolarHBondContact O-CA 3.47Å; Y306-C309 VanDerWaalsContact O-CB 3.27Å; Y306-C309 WeakPolarHBondContact O-CB 3.48Å; Y306-C309 PolarHBondContact O-N 3.37Å; D307-C309 PolarHBondContact O-N 2.93Å; D307-C309 VanDerWaalsContact O-N 3.15Å
310	L	96.8	Very high	95.9	Very high	10 Å²	10	41.1 Å²	41.1	5%	0.052	20%	0.204	C	C	.	.			trans	-123.3	142.3	-167.2	-69.5	171.9	0	0	0	110.8	P177 I179 L217 S253 T254 Y306 N308 Y312	P177-L310 HydrophobicContact CB-CD1 4.49Å; I179-L310 HydrophobicContact CD1-CD1 4.22Å; I179-L310 HydrophobicContact CD1-CD2 3.76Å; I179-L310 HydrophobicContact CG1-CD2 3.66Å; L217-L310 HydrophobicContact CD1-CD1 4.42Å; S253-L310 CarbonylContact C-O 3.53Å; S253-L310 WeakPolarHBondContact CA-O 3.49Å; S253-L310 VanDerWaalsContact CB-O 3.28Å; S253-L310 WeakPolarHBondContact CB-O 3.19Å; T254-L310 PolarHBondContact N-O 3.03Å; T254-L310 PolarHBondContact O-N 3.35Å; T254-L310 PolarHBondContact OG1-N 3.39Å; Y306-L310 HydrophobicContact CD1-CD2 3.67Å; Y306-L310 HydrophobicContact CE1-CD2 4.48Å; Y306-L310 HydrophobicContact CG-CD2 3.82Å; N308-L310 PolarHBondContact O-N 3.35Å; L310-Y312 HydrophobicContact CB-CD2 4.42Å; L310-Y312 HydrophobicContact CB-CE1 4.37Å; L310-Y312 HydrophobicContact CB-CE2 3.66Å; L310-Y312 HydrophobicContact CD1-CE1 4.45Å; L310-Y312 VanDerWaalsContact CD1-OH 3.31Å; L310-Y312 WeakPolarHBondContact CD1-OH 3.33Å
311	T	97.4	Very high	95.6	Very high	49 Å²	49	44.5 Å²	44.5	30%	0.301	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	137.4	164.4	-60.7	0	0	0	0	108.6	P177 D178 E251	P177-T311 WeakPolarHBondContact CA-O 3.25Å; D178-T311 PolarHBondContact N-O 3.19Å; E251-T311 HydrophobicContact CG-CG2 3.72Å
312	Y	98.1	Very high	95.2	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	133.8	-177.6	-62.7	-85.7	0	0	0	109.2	W175 Q176 P177 L186 L217 E251 F252 T254 L310	W175-Y312 HydrophobicContact CB-CD1 4.33Å; Q176-Y312 WeakPolarHBondContact O-CA 2.98Å; P177-Y312 HydrophobicContact CB-CD1 3.72Å; P177-Y312 HydrophobicContact CB-CE1 3.62Å; P177-Y312 HydrophobicContact CG-CE1 4.41Å; L186-Y312 HydrophobicContact CB-CD1 4.14Å; L186-Y312 HydrophobicContact CB-CE1 4.01Å; L186-Y312 HydrophobicContact CD1-CE1 4.38Å; L186-Y312 HydrophobicContact CD2-CD1 3.64Å; L186-Y312 HydrophobicContact CD2-CE1 3.52Å; L186-Y312 HydrophobicContact CD2-CE2 4.46Å; L186-Y312 HydrophobicContact CD2-CG 4.15Å; L186-Y312 HydrophobicContact CG-CD1 4.46Å; L186-Y312 HydrophobicContact CG-CE1 4.17Å; L217-Y312 WeakPolarHBondContact CD1-OH 3.45Å; E251-Y312 VanDerWaalsContact CA-O 3.32Å; E251-Y312 WeakPolarHBondContact CA-O 3.42Å; F252-Y312 HydrophobicContact CD2-CD2 4.04Å; F252-Y312 HydrophobicContact CE1-CD2 4.08Å; F252-Y312 AromaticContact CE1-CG 3.95Å; F252-Y312 HydrophobicContact CE1-CG 3.95Å; F252-Y312 AromaticContact CE2-CD2 3.5Å; F252-Y312 HydrophobicContact CE2-CD2 3.5Å; F252-Y312 VanDerWaalsContact CE2-CD2 3.5Å; F252-Y312 AromaticContact CE2-CE2 3.98Å; F252-Y312 HydrophobicContact CE2-CE2 3.98Å; F252-Y312 HydrophobicContact CE2-CG 4.19Å; F252-Y312 AromaticContact CZ-CD2 3.52Å; F252-Y312 HydrophobicContact CZ-CD2 3.52Å; F252-Y312 HydrophobicContact CZ-CE2 4.15Å; F252-Y312 AromaticContact CZ-CG 3.73Å; F252-Y312 HydrophobicContact CZ-CG 3.73Å; F252-Y312 PolarHBondContact N-O 2.97Å; F252-Y312 VanDerWaalsContact N-O 3.12Å; F252-Y312 PolarHBondContact O-N 3.4Å; T254-Y312 HydrophobicContact CG2-CE2 3.82Å; L310-Y312 HydrophobicContact CB-CD2 4.42Å; L310-Y312 HydrophobicContact CB-CE1 4.37Å; L310-Y312 HydrophobicContact CB-CE2 3.66Å; L310-Y312 HydrophobicContact CD1-CE1 4.45Å; L310-Y312 VanDerWaalsContact CD1-OH 3.31Å; L310-Y312 WeakPolarHBondContact CD1-OH 3.33Å
313	R	97.4	Very high	94.9	Very high	59 Å²	59	47.5 Å²	47.5	22%	0.223	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	138.7	178.3	-55.6	-178.1	-171.9	-139.3	4.8	109.6	W175 Q176 D178 I315 W551	W175-R313 WeakPolarHBondContact CA-O 3.24Å; W175-R313 VanDerWaalsContact CE3-C 3.42Å; Q176-R313 PolarHBondContact N-O 2.71Å; Q176-R313 PolarHBondContact O-N 3.46Å; D178-R313 IonicContact OD2-CZ 3.79Å; D178-R313 IonicContact OD2-NE 2.95Å; D178-R313 PolarHBondContact OD2-NE 2.78Å; D178-R313 IonicContact OD2-NH2 3.09Å; D178-R313 PolarHBondContact OD2-NH2 3.18Å; R313-I315 PolarHBondContact O-N 3.21Å; R313-W551 HydrophobicContact CB-CE3 4.27Å; R313-W551 HydrophobicContact CB-CH2 3.22Å; R313-W551 HydrophobicContact CB-CZ2 3.72Å; R313-W551 HydrophobicContact CB-CZ3 3.53Å; R313-W551 VanDerWaalsContact CD-CE3 3.47Å; R313-W551 VanDerWaalsContact CD-CZ2 3.48Å; R313-W551 HydrophobicContact CG-CE3 4.48Å; R313-W551 HydrophobicContact CG-CH2 4.09Å; R313-W551 HydrophobicContact CG-CZ2 4.21Å; R313-W551 HydrophobicContact CG-CZ3 4.21Å
314	R	97.9	Very high	94.8	Very high	27 Å²	27	47.2 Å²	47.2	10%	0.102	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	135.2	-172.9	-171.7	178.5	-61.9	-75.2	1	110.9	H170 L172 W175 K249 D250 Y316	H170-R314 PolarHBondContact O-NH2 3.35Å; L172-R314 PolarHBondContact O-NH1 3.41Å; W175-R314 HydrophobicContact CE3-CB 3.99Å; W175-R314 VanDerWaalsContact CE3-N 3.31Å; W175-R314 HydrophobicContact CH2-CB 4.18Å; W175-R314 VanDerWaalsContact CH2-CZ 3.47Å; W175-R314 VanDerWaalsContact CZ2-CZ 3.42Å; W175-R314 VanDerWaalsContact CZ2-NH2 3.28Å; W175-R314 HydrophobicContact CZ3-CB 3.75Å; K249-R314 PolarHBondContact O-NH2 3.28Å; D250-R314 HydrophobicContact CB-CB 3.84Å; D250-R314 PolarHBondContact O-N 3.48Å; D250-R314 VanDerWaalsContact OD1-CD 3.23Å; D250-R314 WeakPolarHBondContact OD1-CD 3.43Å; D250-R314 IonicContact OD1-CZ 3.7Å; D250-R314 IonicContact OD1-NE 3.98Å; D250-R314 PolarHBondContact OD1-NE 3.33Å; R314-Y316 WeakPolarHBondContact CD-OH 3.36Å; R314-Y316 HydrophobicContact CG-CE1 4.18Å; R314-Y316 HydrophobicContact CG-CE2 4.32Å
315	I	98.3	Very high	94.7	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.005	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	164	169.6	60.3	168.3	0	0	0	109.7	L174 Q176 L185 R313 L357 M544 M548	L174-I315 HydrophobicContact CB-CG1 4.17Å; L174-I315 HydrophobicContact CD2-CD1 3.95Å; L174-I315 HydrophobicContact CD2-CG1 4.02Å; L174-I315 HydrophobicContact CG-CD1 3.97Å; L174-I315 HydrophobicContact CG-CG1 3.85Å; L174-I315 PolarHBondContact O-N 3.36Å; L174-I315 VanDerWaalsContact O-O 3.05Å; Q176-I315 HydrophobicContact CB-CD1 4.27Å; Q176-I315 HydrophobicContact CB-CG2 3.87Å; L185-I315 HydrophobicContact CD1-CD1 3.85Å; R313-I315 PolarHBondContact O-N 3.21Å; I315-L357 HydrophobicContact CD1-CD1 3.98Å; I315-L357 HydrophobicContact CD1-CD2 4.14Å; I315-M544 HydrophobicContact CB-SD 4Å; I315-M544 HydrophobicContact CG2-SD 3.97Å; I315-M548 HydrophobicContact CG2-CE 4.17Å; I315-M548 HydrophobicContact CG2-CG 4.23Å; I315-M548 HydrophobicContact CG2-SD 3.81Å
316	Y	98.4	Very high	94.7	Very high	24 Å²	24	42.5 Å²	42.5	9%	0.094	24%	0.235	C	C	.	.			trans	-132.5	152.5	179.7	-60.5	-73.1	0	0	0	111.2	R314 A533 A535 F541 M544	R314-Y316 WeakPolarHBondContact CD-OH 3.36Å; R314-Y316 HydrophobicContact CG-CE1 4.18Å; R314-Y316 HydrophobicContact CG-CE2 4.32Å; Y316-A533 CarbonylContact C-O 3.49Å; Y316-A533 VanDerWaalsContact CA-O 3.23Å; Y316-A533 WeakPolarHBondContact CA-O 3.45Å; Y316-A535 HydrophobicContact CD1-CB 4.35Å; Y316-A535 HydrophobicContact CD2-CB 4.27Å; Y316-A535 HydrophobicContact CG-CB 3.88Å; Y316-F541 WeakPolarHBondContact O-CE2 3.39Å; Y316-M544 HydrophobicContact CD2-CB 4.05Å; Y316-M544 HydrophobicContact CD2-CE 4.41Å; Y316-M544 HydrophobicContact CD2-CG 4.05Å; Y316-M544 HydrophobicContact CE2-CB 4.46Å
317	L	97.9	Very high	94.7	Very high	24 Å²	24	45.2 Å²	45.2	13%	0.126	25%	0.25	C	C	.	.	B	Isolated β-bridge	trans	-69.9	143.3	163.3	-66.7	179.4	0	0	0	110	L174 L330 L530 A533	L174-L317 HydrophobicContact CD2-CD2 4.18Å; L174-L317 HydrophobicContact CD2-CG 4.34Å; L317-L330 HydrophobicContact CD2-CD1 3.97Å; L317-L330 HydrophobicContact CD2-CD2 3.85Å; L317-L330 HydrophobicContact CD2-CG 3.61Å; L317-L530 HydrophobicContact CD1-CB 4.46Å; L317-L530 HydrophobicContact CD2-CD1 4.35Å; L317-A533 HydrophobicContact CD1-CB 3.77Å; L317-A533 HydrophobicContact CG-CB 3.78Å; L317-A533 PolarHBondContact N-O 3.43Å
318	P	96.2	Very high	94.9	Very high	9 Å²	9	44.5 Å²	44.5	6%	0.058	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-62	139.7	177.5	25.2	-34.3	0	0	0	111.5	P328 M344 L345 F541	P318-P328 HydrophobicContact CB-CB 3.88Å; P318-P328 HydrophobicContact CB-CG 4.23Å; P318-P328 HydrophobicContact CG-CB 3.55Å; P318-P328 HydrophobicContact CG-CG 4.12Å; P318-M344 HydrophobicContact CG-CG 4.4Å; P318-L345 WeakPolarHBondContact CG-O 3.44Å; P318-F541 VanDerWaalsContact CA-CE2 3.49Å; P318-F541 HydrophobicContact CB-CE1 4.11Å; P318-F541 HydrophobicContact CB-CE2 3.91Å; P318-F541 HydrophobicContact CB-CZ 3.63Å
319	P	94.2	Very high	95.2	Very high	34 Å²	34	44.4 Å²	44.4	22%	0.221	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-61.3	143.3	167.3	-19.7	32.3	0	0	0	111.1	A535 M538 F541	P319-A535 HydrophobicContact CG-CB 4.45Å; P319-M538 HydrophobicContact CB-CE 4.29Å; P319-M538 HydrophobicContact CG-CE 4.25Å; P319-M538 HydrophobicContact CG-SD 4Å; P319-F541 HydrophobicContact CG-CB 4.36Å
320	L	92.2	Very high	95.3	Very high	117 Å²	117	42.1 Å²	42.1	61%	0.613	23%	0.232	S	C	*	.	P	Polyproline II helix	trans	-86.4	128.7	172.9	172.7	68.8	0	0	0	109.7	D324 P328	L320-D324 HydrophobicContact CD1-CB 4.46Å; L320-P328 HydrophobicContact CB-CG 4.49Å; L320-P328 VanDerWaalsContact CD1-CD 3.48Å; L320-P328 HydrophobicContact CD1-CG 4.37Å
321	M	89.8	Confident	95.4	Very high	84 Å²	84	41.7 Å²	41.7	41%	0.414	23%	0.23	S	C	.	.			trans	-112.5	147.5	173.1	-56.5	-63.4	-70.1	0	0	111.1	S323 D324 M538	M321-S323 PolarHBondContact O-N 3.32Å; M321-S323 VanDerWaalsContact O-N 3.14Å; M321-D324 WeakPolarHBondContact CB-OD1 3.48Å; M321-D324 PolarHBondContact N-OD2 3.37Å; M321-D324 VanDerWaalsContact O-CB 3.31Å; M321-D324 WeakPolarHBondContact O-CB 3.22Å; M321-D324 VanDerWaalsContact O-CG 3.23Å; M321-D324 PolarHBondContact O-N 3.45Å; M321-M538 HydrophobicContact CG-CE 4.14Å; M321-M538 HydrophobicContact SD-CE 4.42Å
322	P	88.5	Confident	95.4	Very high	136 Å²	136	39.5 Å²	39.5	88%	0.883	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61	-23.2	179.7	-24.7	34.5	0	0	0	114.8	D324	P322-D324 VanDerWaalsContact C-N 3.33Å
323	S	89.4	Confident	95.4	Very high	97 Å²	97	39.5 Å²	39.5	68%	0.678	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84	-5.6	178.8	52.2	0	0	0	0	113.8	M321	M321-S323 PolarHBondContact O-N 3.32Å; M321-S323 VanDerWaalsContact O-N 3.14Å
324	D	92.9	Very high	95.5	Very high	25 Å²	25	36.8 Å²	36.8	13%	0.134	21%	0.206	C	C	.	.			trans	-65.7	140	-174	-69.1	-11	0	0	0	111.4	L320 M321 P322 L326 F347	L320-D324 HydrophobicContact CD1-CB 4.46Å; M321-D324 WeakPolarHBondContact CB-OD1 3.48Å; M321-D324 PolarHBondContact N-OD2 3.37Å; M321-D324 VanDerWaalsContact O-CB 3.31Å; M321-D324 WeakPolarHBondContact O-CB 3.22Å; M321-D324 VanDerWaalsContact O-CG 3.23Å; M321-D324 PolarHBondContact O-N 3.45Å; P322-D324 VanDerWaalsContact C-N 3.33Å; D324-L326 VanDerWaalsContact C-N 3.27Å; D324-L326 PolarHBondContact O-N 2.85Å; D324-F347 HydrophobicContact CB-CD2 3.62Å; D324-F347 HydrophobicContact CB-CE2 3.9Å; D324-F347 HydrophobicContact CB-CG 4.07Å; D324-F347 WeakPolarHBondContact OD1-CB 3.39Å; D324-F347 WeakPolarHBondContact OD1-CG 3.21Å
325	L	92.4	Very high	95.4	Very high	38 Å²	38	36.5 Å²	36.5	20%	0.199	21%	0.205	C	C	.	.	S	Bend	trans	-64.8	-33.8	-179.1	177.2	64.7	0	0	0	112.4	F347 L374 K479 F481 F502 L504	L325-F347 HydrophobicContact CB-CE1 3.69Å; L325-F347 HydrophobicContact CB-CZ 3.95Å; L325-L374 HydrophobicContact CD2-CD2 3.94Å; L325-K479 HydrophobicContact CD1-CD 3.98Å; L325-F481 HydrophobicContact CD1-CE2 4.26Å; L325-F481 HydrophobicContact CD1-CZ 4.43Å; L325-F481 HydrophobicContact CD2-CD2 4.22Å; L325-F481 HydrophobicContact CD2-CE2 3.62Å; L325-F481 HydrophobicContact CD2-CZ 4.36Å; L325-F502 HydrophobicContact CD2-CE1 4.29Å; L325-L504 HydrophobicContact CD1-CD2 4.05Å; L325-L504 HydrophobicContact CD2-CD2 4Å; L325-L504 HydrophobicContact CG-CD2 3.88Å
326	L	94.2	Very high	95.2	Very high	8 Å²	8	37.6 Å²	37.6	4%	0.042	22%	0.217	C	C	.	.	S	Bend	trans	-152.8	169.8	174.5	61.3	132	0	0	0	108.8	D324 P328 F331 L345 F347 L504	D324-L326 VanDerWaalsContact C-N 3.27Å; D324-L326 PolarHBondContact O-N 2.85Å; L326-P328 WeakPolarHBondContact O-CD 3.45Å; L326-P328 VanDerWaalsContact O-N 3.15Å; L326-F331 HydrophobicContact CD1-CE1 4.48Å; L326-F331 HydrophobicContact CD1-CZ 3.71Å; L326-L345 HydrophobicContact CD1-CD2 3.67Å; L326-L345 HydrophobicContact CD2-CD2 4.04Å; L326-L345 HydrophobicContact CG-CD2 4.04Å; L326-F347 HydrophobicContact CD2-CZ 3.97Å; L326-F347 HydrophobicContact CG-CE2 4.4Å; L326-F347 HydrophobicContact CG-CZ 3.98Å; L326-F347 WeakPolarHBondContact O-CE2 3.38Å; L326-L504 HydrophobicContact CD2-CD1 3.75Å
327	Q	95.4	Very high	95	Very high	120 Å²	120	38 Å²	38	56%	0.561	22%	0.223	S	C	*	.			trans	-58.8	120.6	175.4	-177.6	177.7	-4.6	0	0	110.5	R525	Q327-R525 PolarHBondContact O-NH1 3.19Å; Q327-R525 PolarHBondContact O-NH2 2.82Å
328	P	96.9	Very high	94.8	Very high	10 Å²	10	38.4 Å²	38.4	7%	0.065	22%	0.224	C	C	.	.			trans	-70.6	162.1	176.8	32.3	-35.3	0	0	0	110.4	P318 L320 L326 L345 F347	P318-P328 HydrophobicContact CB-CB 3.88Å; P318-P328 HydrophobicContact CB-CG 4.23Å; P318-P328 HydrophobicContact CG-CB 3.55Å; P318-P328 HydrophobicContact CG-CG 4.12Å; L320-P328 HydrophobicContact CB-CG 4.49Å; L320-P328 VanDerWaalsContact CD1-CD 3.48Å; L320-P328 HydrophobicContact CD1-CG 4.37Å; L326-P328 WeakPolarHBondContact O-CD 3.45Å; L326-P328 VanDerWaalsContact O-N 3.15Å; P328-L345 VanDerWaalsContact CB-O 3.31Å; P328-L345 WeakPolarHBondContact CB-O 3.39Å; P328-F347 HydrophobicContact CB-CD2 3.84Å; P328-F347 HydrophobicContact CB-CE2 3.95Å; P328-F347 HydrophobicContact CG-CD2 4.33Å
329	G	97.8	Very high	94.8	Very high	8 Å²	8	38 Å²	38	8%	0.082	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	155.1	-159.5	-176.9	0	0	0	0	0	113.9	M344 L345	G329-M344 CarbonylContact O-C 3.5Å; G329-M344 WeakPolarHBondContact O-CA 3.49Å; G329-L345 PolarHBondContact N-O 3.43Å; G329-L345 PolarHBondContact O-N 2.87Å
330	L	98.6	Very high	95	Very high	5 Å²	5	36.9 Å²	36.9	3%	0.026	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	141.5	-176	-51.1	-172.2	0	0	0	111.1	L174 L185 L317 V343 M344 L357 L526 L530	L174-L330 HydrophobicContact CD2-CD1 4.49Å; L185-L330 HydrophobicContact CD1-CD1 4.25Å; L185-L330 HydrophobicContact CD2-CD1 3.72Å; L317-L330 HydrophobicContact CD2-CD1 3.97Å; L317-L330 HydrophobicContact CD2-CD2 3.85Å; L317-L330 HydrophobicContact CD2-CG 3.61Å; L330-V343 CarbonylContact C-O 3.48Å; L330-V343 WeakPolarHBondContact CA-O 3.29Å; L330-M344 HydrophobicContact CD2-CB 3.68Å; L330-M344 HydrophobicContact CD2-CG 3.75Å; L330-M344 HydrophobicContact CD2-SD 4.2Å; L330-L357 HydrophobicContact CD1-CD1 4Å; L330-L357 HydrophobicContact CD2-CD1 3.5Å; L330-L357 VanDerWaalsContact CD2-CD1 3.5Å; L330-L357 HydrophobicContact CG-CD1 4.35Å; L330-L526 HydrophobicContact CB-CB 4.01Å; L330-L526 HydrophobicContact CB-CD1 4.2Å; L330-L526 HydrophobicContact CD1-CD1 4.29Å; L330-L526 WeakPolarHBondContact O-CB 3.16Å; L330-L526 PolarHBondContact O-N 3.25Å; L330-L530 HydrophobicContact CD1-CD1 3.78Å
331	F	98.8	Very high	95.3	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	144.9	179.5	-68.5	-103.7	0	0	0	109.7	L326 I342 V343 L345 D508 F510 S524 R525	L326-F331 HydrophobicContact CD1-CE1 4.48Å; L326-F331 HydrophobicContact CD1-CZ 3.71Å; F331-I342 CarbonylContact O-C 3.42Å; F331-I342 WeakPolarHBondContact O-CA 3.17Å; F331-V343 HydrophobicContact CB-CG2 3.89Å; F331-V343 PolarHBondContact N-O 2.96Å; F331-V343 PolarHBondContact O-N 3.03Å; F331-L345 HydrophobicContact CD2-CB 3.85Å; F331-L345 HydrophobicContact CE2-CB 3.72Å; F331-L345 HydrophobicContact CE2-CD2 3.89Å; F331-L345 HydrophobicContact CE2-CG 4.47Å; F331-L345 HydrophobicContact CZ-CD2 4.16Å; F331-D508 WeakPolarHBondContact CE1-O 3.29Å; F331-F510 HydrophobicContact CB-CE1 4.24Å; F331-F510 AromaticContact CD1-CD1 3.92Å; F331-F510 HydrophobicContact CD1-CD1 3.92Å; F331-F510 AromaticContact CD1-CE1 3.49Å; F331-F510 HydrophobicContact CD1-CE1 3.49Å; F331-F510 VanDerWaalsContact CD1-CE1 3.49Å; F331-F510 AromaticContact CD2-CE1 3.96Å; F331-F510 HydrophobicContact CD2-CE1 3.96Å; F331-F510 AromaticContact CE1-CD1 3.82Å; F331-F510 HydrophobicContact CE1-CD1 3.82Å; F331-F510 AromaticContact CE1-CE1 3.72Å; F331-F510 HydrophobicContact CE1-CE1 3.72Å; F331-F510 HydrophobicContact CE2-CE1 4.18Å; F331-F510 HydrophobicContact CG-CD1 4.5Å; F331-F510 AromaticContact CG-CE1 3.63Å; F331-F510 HydrophobicContact CG-CE1 3.63Å; F331-F510 HydrophobicContact CG-CZ 4.36Å; F331-F510 HydrophobicContact CZ-CD1 4.31Å; F331-F510 HydrophobicContact CZ-CE1 4.06Å; F331-S524 WeakPolarHBondContact CA-O 3.44Å; F331-R525 HydrophobicContact CD1-CB 4.08Å; F331-R525 HydrophobicContact CE1-CB 3.78Å; F331-R525 HydrophobicContact CE1-CG 4.47Å; F331-R525 HydrophobicContact CZ-CB 4.24Å; F331-R525 HydrophobicContact CZ-CG 4.48Å
332	K	98.6	Very high	95.7	Very high	4 Å²	4	27.4 Å²	27.4	2%	0.017	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	136.1	166.8	-54.8	162.9	-70.2	-81.2	0	106.5	P203 V208 D210 M212 E341 Y523 S524 R525	P203-K332 HydrophobicContact CG-CD 3.97Å; V208-K332 VanDerWaalsContact CG2-C 3.48Å; V208-K332 HydrophobicContact CG2-CB 3.77Å; V208-K332 WeakPolarHBondContact CG2-O 3.48Å; V208-K332 WeakPolarHBondContact O-CE 3.4Å; D210-K332 WeakPolarHBondContact O-CE 3.42Å; M212-K332 HydrophobicContact SD-CD 3.7Å; M212-K332 HydrophobicContact SD-CG 3.72Å; K332-E341 CarbonylContact C-O 3.57Å; K332-E341 WeakPolarHBondContact CA-O 3.36Å; K332-Y523 CarbonylContact O-C 3.58Å; K332-Y523 WeakPolarHBondContact O-CA 3.33Å; K332-S524 PolarHBondContact N-O 2.87Å; K332-S524 PolarHBondContact NZ-O 3.06Å; K332-S524 PolarHBondContact O-N 3.16Å; K332-R525 VanDerWaalsContact NZ-C 3.3Å; K332-R525 PolarHBondContact NZ-O 2.74Å
333	G	98.2	Very high	96.2	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	146.7	-176.3	0	0	0	0	0	112.8	Y335 L340 E341 L522	G333-Y335 WeakPolarHBondContact O-CD2 3.39Å; G333-L340 CarbonylContact O-C 3.59Å; G333-L340 VanDerWaalsContact O-CA 3.31Å; G333-L340 WeakPolarHBondContact O-CA 3.48Å; G333-E341 PolarHBondContact N-O 2.77Å; G333-E341 PolarHBondContact O-N 3.37Å; G333-L522 VanDerWaalsContact CA-O 3.32Å; G333-L522 WeakPolarHBondContact CA-O 3.14Å
334	T	98.2	Very high	96.6	Very high	2 Å²	2	16.3 Å²	16.3	1%	0.012	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	128.4	177.9	59	0	0	0	0	111.8	L340 R469 N470 S521 L522	T334-L340 HydrophobicContact CG2-CD2 3.52Å; T334-R469 HydrophobicContact CG2-CB 4.19Å; T334-N470 WeakPolarHBondContact CG2-OD1 3.26Å; T334-S521 VanDerWaalsContact O-CB 3.3Å; T334-S521 WeakPolarHBondContact O-CB 3.37Å; T334-S521 PolarHBondContact O-OG 2.99Å; T334-S521 WeakPolarHBondContact OG1-CA 3.25Å; T334-L522 PolarHBondContact N-O 3.02Å; T334-L522 VanDerWaalsContact N-O 3.14Å; T334-L522 PolarHBondContact OG1-N 3.33Å
335	Y	97.2	Very high	96.9	Very high	21 Å²	21	15.2 Å²	15.2	8%	0.082	9%	0.085	C	C	.	.			trans	-125.3	47.7	-178.9	-77.3	-93.2	0	0	0	112.4	G333 S337 H338 G339 E341 V343 K356 T369 W514 Y523	G333-Y335 WeakPolarHBondContact O-CD2 3.39Å; Y335-S337 PolarHBondContact O-N 2.97Å; Y335-H338 WeakPolarHBondContact O-CB 3.03Å; Y335-H338 PolarHBondContact O-CD2 3.25Å; Y335-H338 PolarHBondContact O-N 3.44Å; Y335-H338 VanDerWaalsContact O-N 3.16Å; Y335-G339 PolarHBondContact N-O 3.27Å; Y335-E341 HydrophobicContact CD2-CB 3.51Å; Y335-E341 HydrophobicContact CD2-CG 3.59Å; Y335-E341 HydrophobicContact CE2-CB 3.81Å; Y335-E341 HydrophobicContact CE2-CG 4.3Å; Y335-E341 HydrophobicContact CG-CB 4.28Å; Y335-E341 HydrophobicContact CG-CG 3.86Å; Y335-V343 HydrophobicContact CE2-CG1 4.04Å; Y335-V343 WeakPolarHBondContact OH-CG1 3.33Å; Y335-K356 VanDerWaalsContact CE1-CE 3.42Å; Y335-T369 VanDerWaalsContact OH-CG2 3.25Å; Y335-T369 WeakPolarHBondContact OH-CG2 3.44Å; Y335-T369 PolarHBondContact OH-OG1 3.26Å; Y335-T369 VanDerWaalsContact OH-OG1 3.13Å; Y335-W514 HydrophobicContact CE1-CZ2 4.3Å; Y335-Y523 AromaticContact CE2-CE1 3.88Å; Y335-Y523 HydrophobicContact CE2-CE1 3.88Å; Y335-Y523 VanDerWaalsContact CZ-OH 3.29Å; Y335-Y523 PolarHBondContact OH-OH 3.24Å
336	G	93.2	Very high	97.2	Very high	24 Å²	24	13.4 Å²	13.4	25%	0.247	8%	0.076	C	C	.	.	G	3₁₀ helix	trans	61.5	-126.6	172.4	0	0	0	0	0	112.7	H338 G339 R469	G336-H338 PolarHBondContact O-N 3.32Å; G336-G339 PolarHBondContact O-N 2.92Å; G336-R469 PolarHBondContact O-NH1 3.23Å
337	S	93.8	Very high	97.3	Very high	32 Å²	32	13.6 Å²	13.6	22%	0.224	8%	0.076	C	C	.	.	G	3₁₀ helix	trans	-70.4	-13.8	-179	44.9	0	0	0	0	114.1	Y335 G339	Y335-S337 PolarHBondContact O-N 2.97Å; S337-G339 VanDerWaalsContact C-N 3.3Å
338	H	95.2	Very high	97.3	Very high	33 Å²	33	9.2 Å²	9.2	15%	0.153	6%	0.056	C	C	.	.	G	3₁₀ helix	trans	-80.1	-15	176.2	-55.4	-72.5	0	0	0	112.6	Y335 G336 D360 N362	Y335-H338 WeakPolarHBondContact O-CB 3.03Å; Y335-H338 PolarHBondContact O-CD2 3.25Å; Y335-H338 PolarHBondContact O-N 3.44Å; Y335-H338 VanDerWaalsContact O-N 3.16Å; G336-H338 PolarHBondContact O-N 3.32Å; H338-D360 HydrophobicContact CB-CB 3.97Å; H338-D360 IonicContact CD2-OD2 2.66Å; H338-D360 IonicContact CG-OD2 3.76Å; H338-D360 WeakPolarHBondContact ND1-CB 3.47Å; H338-N362 PolarHBondContact CE1-OD1 2.76Å; H338-N362 PolarHBondContact NE2-OD1 3.45Å
339	G	95.6	Very high	97.1	Very high	1 Å²	1	11.7 Å²	11.7	1%	0.01	8%	0.084	C	C	.	.			trans	88.6	-142.8	-178.4	0	0	0	0	0	112.2	Y335 G336 S337	Y335-G339 PolarHBondContact N-O 3.27Å; G336-G339 PolarHBondContact O-N 2.92Å; S337-G339 VanDerWaalsContact C-N 3.3Å
340	L	97.6	Very high	96.9	Very high	9 Å²	9	16.8 Å²	16.8	5%	0.047	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	137.3	177.6	-60.6	-171	0	0	0	111.5	P202 P203 D205 V208 G333 T334	P202-L340 HydrophobicContact CB-CB 3.87Å; P202-L340 HydrophobicContact CB-CD1 4.49Å; P202-L340 HydrophobicContact CG-CB 4.31Å; P203-L340 HydrophobicContact CG-CD1 3.75Å; P203-L340 WeakPolarHBondContact O-CD1 3.4Å; D205-L340 HydrophobicContact CB-CG 4.33Å; V208-L340 HydrophobicContact CB-CD2 4.45Å; G333-L340 CarbonylContact O-C 3.59Å; G333-L340 VanDerWaalsContact O-CA 3.31Å; G333-L340 WeakPolarHBondContact O-CA 3.48Å; T334-L340 HydrophobicContact CG2-CD2 3.52Å
341	E	98.5	Very high	96.8	Very high	2 Å²	2	17.4 Å²	17.4	1%	0.009	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	156.9	172.4	-57.8	-63	167.1	0	0	111.1	K332 G333 Y335 T358 G359	K332-E341 CarbonylContact C-O 3.57Å; K332-E341 WeakPolarHBondContact CA-O 3.36Å; G333-E341 PolarHBondContact N-O 2.77Å; G333-E341 PolarHBondContact O-N 3.37Å; Y335-E341 HydrophobicContact CD2-CB 3.51Å; Y335-E341 HydrophobicContact CD2-CG 3.59Å; Y335-E341 HydrophobicContact CE2-CB 3.81Å; Y335-E341 HydrophobicContact CE2-CG 4.3Å; Y335-E341 HydrophobicContact CG-CB 4.28Å; Y335-E341 HydrophobicContact CG-CG 3.86Å; E341-T358 VanDerWaalsContact CA-OG1 3.29Å; E341-T358 WeakPolarHBondContact CA-OG1 3.49Å; E341-T358 WeakPolarHBondContact OE2-CB 3.39Å; E341-T358 PolarHBondContact OE2-OG1 3.09Å; E341-G359 PolarHBondContact OE2-N 2.99Å
342	I	98.8	Very high	96.8	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	124.6	174.9	-53	173.9	0	0	0	107.8	L185 M212 F331 L357 T358	L185-I342 HydrophobicContact CB-CD1 4Å; L185-I342 HydrophobicContact CD2-CD1 4.24Å; M212-I342 HydrophobicContact CE-CD1 3.55Å; M212-I342 HydrophobicContact CE-CG1 4.19Å; F331-I342 CarbonylContact O-C 3.42Å; F331-I342 WeakPolarHBondContact O-CA 3.17Å; I342-L357 HydrophobicContact CB-CB 4.22Å; I342-L357 HydrophobicContact CG2-CB 4.08Å; I342-L357 HydrophobicContact CG2-CD1 4.16Å; I342-L357 HydrophobicContact CG2-CG 4.43Å; I342-L357 PolarHBondContact O-N 3.15Å; I342-T358 HydrophobicContact CB-CG2 4.24Å; I342-T358 HydrophobicContact CD1-CG2 3.94Å; I342-T358 HydrophobicContact CG1-CG2 4.1Å; I342-T358 PolarHBondContact N-OG1 3.07Å; I342-T358 PolarHBondContact O-N 3Å; I342-T358 VanDerWaalsContact O-N 3.17Å
343	V	98.8	Very high	96.8	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	149.8	174.9	-58	0	0	0	0	110.7	L330 F331 Y335 A354 T355 K356 T369 Y523	L330-V343 CarbonylContact C-O 3.48Å; L330-V343 WeakPolarHBondContact CA-O 3.29Å; F331-V343 HydrophobicContact CB-CG2 3.89Å; F331-V343 PolarHBondContact N-O 2.96Å; F331-V343 PolarHBondContact O-N 3.03Å; Y335-V343 HydrophobicContact CE2-CG1 4.04Å; Y335-V343 WeakPolarHBondContact OH-CG1 3.33Å; V343-A354 HydrophobicContact CB-CB 4.5Å; V343-T355 CarbonylContact C-O 3.59Å; V343-T355 WeakPolarHBondContact CA-O 3.23Å; V343-K356 HydrophobicContact CG1-CG 4.28Å; V343-T369 HydrophobicContact CG1-CG2 3.97Å; V343-Y523 HydrophobicContact CG1-CE1 4.12Å; V343-Y523 HydrophobicContact CG2-CD1 3.58Å; V343-Y523 HydrophobicContact CG2-CE1 3.69Å
344	M	98.8	Very high	96.8	Very high	1 Å²	1	21.3 Å²	21.3	1%	0.005	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	114.7	174.4	179.1	170.5	62.2	0	0	109.2	P318 G329 L330 A354 T355 L357 F541 M544 L545	P318-M344 HydrophobicContact CG-CG 4.4Å; G329-M344 CarbonylContact O-C 3.5Å; G329-M344 WeakPolarHBondContact O-CA 3.49Å; L330-M344 HydrophobicContact CD2-CB 3.68Å; L330-M344 HydrophobicContact CD2-CG 3.75Å; L330-M344 HydrophobicContact CD2-SD 4.2Å; M344-A354 CarbonylContact O-C 3.58Å; M344-A354 VanDerWaalsContact O-CA 3.3Å; M344-A354 WeakPolarHBondContact O-CA 3.29Å; M344-T355 PolarHBondContact N-O 3.33Å; M344-T355 PolarHBondContact O-N 3.49Å; M344-L357 HydrophobicContact CB-CD1 4.34Å; M344-L357 HydrophobicContact CB-CD2 4.16Å; M344-L357 HydrophobicContact CB-CG 4.13Å; M344-L357 HydrophobicContact CE-CD2 4.34Å; M344-F541 HydrophobicContact CE-CE2 3.9Å; M344-F541 HydrophobicContact CE-CZ 3.92Å; M344-F541 HydrophobicContact SD-CE2 3.81Å; M344-F541 HydrophobicContact SD-CZ 4.09Å; M344-M544 HydrophobicContact CE-CE 4.1Å; M344-L545 HydrophobicContact CE-CD2 3.44Å; M344-L545 VanDerWaalsContact CE-CD2 3.44Å
345	L	98.6	Very high	96.8	Very high	2 Å²	2	21.3 Å²	21.3	1%	0.01	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	126.1	173.8	-178.8	69.2	0	0	0	109.9	P318 L326 P328 G329 F331 F347 A352 R353 F510	P318-L345 WeakPolarHBondContact CG-O 3.44Å; L326-L345 HydrophobicContact CD1-CD2 3.67Å; L326-L345 HydrophobicContact CD2-CD2 4.04Å; L326-L345 HydrophobicContact CG-CD2 4.04Å; P328-L345 VanDerWaalsContact CB-O 3.31Å; P328-L345 WeakPolarHBondContact CB-O 3.39Å; G329-L345 PolarHBondContact N-O 3.43Å; G329-L345 PolarHBondContact O-N 2.87Å; F331-L345 HydrophobicContact CD2-CB 3.85Å; F331-L345 HydrophobicContact CE2-CB 3.72Å; F331-L345 HydrophobicContact CE2-CD2 3.89Å; F331-L345 HydrophobicContact CE2-CG 4.47Å; F331-L345 HydrophobicContact CZ-CD2 4.16Å; L345-F347 HydrophobicContact CD2-CE2 4.45Å; L345-F347 HydrophobicContact CD2-CZ 4.23Å; L345-A352 HydrophobicContact CD1-CB 4.28Å; L345-R353 CarbonylContact C-O 3.15Å; L345-R353 WeakPolarHBondContact CA-O 3.44Å; L345-F510 HydrophobicContact CD2-CD1 4.43Å; L345-F510 HydrophobicContact CD2-CE1 4.05Å
346	S	97.9	Very high	96.9	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	156.4	-179.4	54	0	0	0	0	111.2	H348 A352 R353	S346-H348 PolarHBondContact OG-NE2 2.89Å; S346-A352 CarbonylContact O-C 3.2Å; S346-A352 WeakPolarHBondContact O-CA 3.23Å; S346-R353 PolarHBondContact N-O 3.19Å; S346-R353 PolarHBondContact O-N 2.9Å; S346-R353 PolarHBondContact OG-O 3.43Å
347	F	97	Very high	97.1	Very high	11 Å²	11	19.2 Å²	19.2	5%	0.048	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	135.9	-178	-65.4	-82.5	0	0	0	111.2	D324 L325 L326 P328 L345 A352 L374	D324-F347 HydrophobicContact CB-CD2 3.62Å; D324-F347 HydrophobicContact CB-CE2 3.9Å; D324-F347 HydrophobicContact CB-CG 4.07Å; D324-F347 WeakPolarHBondContact OD1-CB 3.39Å; D324-F347 WeakPolarHBondContact OD1-CG 3.21Å; L325-F347 HydrophobicContact CB-CE1 3.69Å; L325-F347 HydrophobicContact CB-CZ 3.95Å; L326-F347 HydrophobicContact CD2-CZ 3.97Å; L326-F347 HydrophobicContact CG-CE2 4.4Å; L326-F347 HydrophobicContact CG-CZ 3.98Å; L326-F347 WeakPolarHBondContact O-CE2 3.38Å; P328-F347 HydrophobicContact CB-CD2 3.84Å; P328-F347 HydrophobicContact CB-CE2 3.95Å; P328-F347 HydrophobicContact CG-CD2 4.33Å; L345-F347 HydrophobicContact CD2-CE2 4.45Å; L345-F347 HydrophobicContact CD2-CZ 4.23Å; F347-A352 HydrophobicContact CD1-CB 3.71Å; F347-A352 HydrophobicContact CE1-CB 3.55Å; F347-A352 HydrophobicContact CZ-CB 4.47Å; F347-L374 HydrophobicContact CD1-CD1 3.93Å; F347-L374 HydrophobicContact CE1-CD1 4.08Å
348	H	94.8	Very high	97.4	Very high	28 Å²	28	18.3 Å²	18.3	13%	0.13	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	78.2	-177.7	-60.7	-96.5	0	0	0	108.8	S346 M350 S351 E542	S346-H348 PolarHBondContact OG-NE2 2.89Å; H348-M350 PolarHBondContact O-N 3.21Å; H348-S351 PolarHBondContact N-O 3.1Å; H348-S351 PolarHBondContact O-N 3.44Å; H348-E542 IonicContact CE1-OE1 3.51Å; H348-E542 PolarHBondContact CE1-OE1 3.05Å; H348-E542 IonicContact CG-OE1 3.95Å; H348-E542 IonicContact ND1-OE1 2.77Å; H348-E542 PolarHBondContact ND1-OE1 3.07Å
349	G	92.8	Very high	97.5	Very high	63 Å²	63	16.8 Å²	16.8	65%	0.649	10%	0.097	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.4	-117.7	-172.1	0	0	0	0	0	111.1	S351	G349-S351 VanDerWaalsContact C-N 3.31Å
350	M	94.6	Very high	97.6	Very high	115 Å²	115	16.9 Å²	16.9	57%	0.567	10%	0.098	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.1	12.8	178.1	-62.9	-56.9	-60.7	0	0	113.6	H348 L374	H348-M350 PolarHBondContact O-N 3.21Å; M350-L374 HydrophobicContact CE-CB 3.88Å; M350-L374 WeakPolarHBondContact CE-O 3.31Å; M350-L374 WeakPolarHBondContact O-CA 3.13Å; M350-L374 WeakPolarHBondContact O-CB 3.29Å; M350-L374 WeakPolarHBondContact O-CG 3.32Å; M350-L374 PolarHBondContact O-N 3.47Å
351	S	96.1	Very high	97.6	Very high	18 Å²	18	17 Å²	17	13%	0.126	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	130.9	175.3	163.9	0	0	0	0	110.2	H348 G349 R353 D371 V372	H348-S351 PolarHBondContact N-O 3.1Å; H348-S351 PolarHBondContact O-N 3.44Å; G349-S351 VanDerWaalsContact C-N 3.31Å; S351-R353 WeakPolarHBondContact OG-CG 3.38Å; S351-R353 PolarHBondContact OG-NE 2.83Å; S351-D371 PolarHBondContact OG-OD1 2.93Å; S351-V372 WeakPolarHBondContact CA-O 3.36Å
352	A	98.1	Very high	97.6	Very high	1 Å²	1	18.7 Å²	18.7	1%	0.008	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	125.7	166.4	0	0	0	0	0	109.4	L345 S346 F347 V372 L374	L345-A352 HydrophobicContact CD1-CB 4.28Å; S346-A352 CarbonylContact O-C 3.2Å; S346-A352 WeakPolarHBondContact O-CA 3.23Å; F347-A352 HydrophobicContact CD1-CB 3.71Å; F347-A352 HydrophobicContact CE1-CB 3.55Å; F347-A352 HydrophobicContact CZ-CB 4.47Å; A352-V372 HydrophobicContact CB-CB 4.19Å; A352-V372 PolarHBondContact N-O 2.75Å; A352-V372 PolarHBondContact O-N 3.04Å; A352-L374 HydrophobicContact CB-CD1 4.28Å; A352-L374 HydrophobicContact CB-CD2 4.15Å; A352-L374 HydrophobicContact CB-CG 4.32Å
353	R	98.3	Very high	97.5	Very high	82 Å²	82	19.1 Å²	19.1	31%	0.309	11%	0.11	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	129.5	-172.8	-69.2	-173.2	-178.9	159	-2.9	110.9	L345 S346 S351 L368 L370	L345-R353 CarbonylContact C-O 3.15Å; L345-R353 WeakPolarHBondContact CA-O 3.44Å; S346-R353 PolarHBondContact N-O 3.19Å; S346-R353 PolarHBondContact O-N 2.9Å; S346-R353 PolarHBondContact OG-O 3.43Å; S351-R353 WeakPolarHBondContact OG-CG 3.38Å; S351-R353 PolarHBondContact OG-NE 2.83Å; R353-L368 HydrophobicContact CB-CD1 3.63Å; R353-L368 HydrophobicContact CG-CD1 3.97Å; R353-L370 WeakPolarHBondContact CA-O 3.2Å
354	A	98.6	Very high	97.5	Very high	2 Å²	2	19.5 Å²	19.5	2%	0.017	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	114.8	171.3	0	0	0	0	0	110.2	V343 M344 T369 L370	V343-A354 HydrophobicContact CB-CB 4.5Å; M344-A354 CarbonylContact O-C 3.58Å; M344-A354 VanDerWaalsContact O-CA 3.3Å; M344-A354 WeakPolarHBondContact O-CA 3.29Å; A354-T369 HydrophobicContact CB-CG2 4.12Å; A354-T369 WeakPolarHBondContact O-CG2 3.44Å; A354-T369 PolarHBondContact O-N 3.18Å; A354-L370 HydrophobicContact CB-CB 3.83Å; A354-L370 HydrophobicContact CB-CD1 4.15Å; A354-L370 HydrophobicContact CB-CG 4.16Å; A354-L370 PolarHBondContact N-O 3.46Å; A354-L370 PolarHBondContact O-N 2.82Å
355	T	98.7	Very high	97.5	Very high	2 Å²	2	19.6 Å²	19.6	1%	0.012	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	133.6	179.1	-57.6	0	0	0	0	110.1	V343 M344 L357 G366 L545 M548	V343-T355 CarbonylContact C-O 3.59Å; V343-T355 WeakPolarHBondContact CA-O 3.23Å; M344-T355 PolarHBondContact N-O 3.33Å; M344-T355 PolarHBondContact O-N 3.49Å; T355-L357 PolarHBondContact O-N 3.49Å; T355-G366 WeakPolarHBondContact CG2-O 3.47Å; T355-L545 HydrophobicContact CG2-CD2 4.17Å; T355-M548 HydrophobicContact CG2-CE 4.24Å
356	K	98.6	Very high	97.5	Very high	2 Å²	2	19.5 Å²	19.5	1%	0.009	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	126.9	178.7	-79.5	-166.9	175.9	-169.8	0	111.7	Y335 V343 T358 D360 V363 G366 Q367 T369	Y335-K356 VanDerWaalsContact CE1-CE 3.42Å; V343-K356 HydrophobicContact CG1-CG 4.28Å; K356-T358 WeakPolarHBondContact CB-O 3.48Å; K356-D360 IonicContact NZ-OD2 3.26Å; K356-D360 PolarHBondContact NZ-OD2 3.34Å; K356-V363 HydrophobicContact CD-CB 4.42Å; K356-V363 HydrophobicContact CD-CG1 4.05Å; K356-V363 VanDerWaalsContact CD-O 3.26Å; K356-V363 WeakPolarHBondContact CD-O 3.44Å; K356-V363 PolarHBondContact NZ-O 3.4Å; K356-G366 PolarHBondContact O-N 2.93Å; K356-Q367 PolarHBondContact N-O 3.01Å; K356-T369 HydrophobicContact CG-CG2 3.73Å
357	L	98.5	Very high	97.5	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	12%	0.116	C	C	.	.	S	Bend	trans	-96	-35	168.1	-60.5	-165.4	0	0	0	111.6	Q176 G184 L185 I315 L330 I342 M344 T355 M548	Q176-L357 PolarHBondContact NE2-O 3.34Å; G184-L357 PolarHBondContact N-O 3.48Å; G184-L357 VanDerWaalsContact N-O 3.1Å; L185-L357 HydrophobicContact CD1-CD1 4.07Å; I315-L357 HydrophobicContact CD1-CD1 3.98Å; I315-L357 HydrophobicContact CD1-CD2 4.14Å; L330-L357 HydrophobicContact CD1-CD1 4Å; L330-L357 HydrophobicContact CD2-CD1 3.5Å; L330-L357 VanDerWaalsContact CD2-CD1 3.5Å; L330-L357 HydrophobicContact CG-CD1 4.35Å; I342-L357 HydrophobicContact CB-CB 4.22Å; I342-L357 HydrophobicContact CG2-CB 4.08Å; I342-L357 HydrophobicContact CG2-CD1 4.16Å; I342-L357 HydrophobicContact CG2-CG 4.43Å; I342-L357 PolarHBondContact O-N 3.15Å; M344-L357 HydrophobicContact CB-CD1 4.34Å; M344-L357 HydrophobicContact CB-CD2 4.16Å; M344-L357 HydrophobicContact CB-CG 4.13Å; M344-L357 HydrophobicContact CE-CD2 4.34Å; T355-L357 PolarHBondContact O-N 3.49Å; L357-M548 HydrophobicContact CD2-CE 3.5Å; L357-M548 HydrophobicContact CD2-SD 4.47Å
358	T	98.6	Very high	97.5	Very high	13 Å²	13	20.6 Å²	20.6	8%	0.08	12%	0.119	C	C	.	.	B	Isolated β-bridge	trans	-114.2	150	158.8	65.3	0	0	0	0	108.7	Y182 E341 I342 K356	Y182-T358 WeakPolarHBondContact O-CA 3.32Å; Y182-T358 WeakPolarHBondContact O-CB 3.47Å; E341-T358 VanDerWaalsContact CA-OG1 3.29Å; E341-T358 WeakPolarHBondContact CA-OG1 3.49Å; E341-T358 WeakPolarHBondContact OE2-CB 3.39Å; E341-T358 PolarHBondContact OE2-OG1 3.09Å; I342-T358 HydrophobicContact CB-CG2 4.24Å; I342-T358 HydrophobicContact CD1-CG2 3.94Å; I342-T358 HydrophobicContact CG1-CG2 4.1Å; I342-T358 PolarHBondContact N-OG1 3.07Å; I342-T358 PolarHBondContact O-N 3Å; I342-T358 VanDerWaalsContact O-N 3.17Å; K356-T358 WeakPolarHBondContact CB-O 3.48Å
359	G	97.9	Very high	97.7	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	11%	0.113	C	C	.	.			trans	-150.3	-163.5	-179.2	0	0	0	0	0	112.5	P181 Y182 E341	P181-G359 CarbonylContact O-C 3.59Å; P181-G359 WeakPolarHBondContact O-CA 3.42Å; Y182-G359 WeakPolarHBondContact CA-O 3.25Å; Y182-G359 PolarHBondContact O-N 3.17Å; Y182-G359 VanDerWaalsContact O-N 3.07Å; E341-G359 PolarHBondContact OE2-N 2.99Å
360	D	98	Very high	98	Very high	4 Å²	4	16.4 Å²	16.4	2%	0.021	8%	0.083	C	C	.	.			trans	-142.8	167.6	-169.7	60.4	65.7	0	0	0	110.3	P181 H338 K356 N362 V363 P364	P181-D360 WeakPolarHBondContact CB-O 3.33Å; P181-D360 PolarHBondContact O-N 2.79Å; H338-D360 HydrophobicContact CB-CB 3.97Å; H338-D360 IonicContact CD2-OD2 2.66Å; H338-D360 IonicContact CG-OD2 3.76Å; H338-D360 WeakPolarHBondContact ND1-CB 3.47Å; K356-D360 IonicContact NZ-OD2 3.26Å; K356-D360 PolarHBondContact NZ-OD2 3.34Å; D360-N362 PolarHBondContact O-N 3.18Å; D360-N362 VanDerWaalsContact O-N 3.07Å; D360-N362 WeakPolarHBondContact OD1-CA 3.35Å; D360-N362 VanDerWaalsContact OD1-CB 3.25Å; D360-N362 WeakPolarHBondContact OD1-CB 3.44Å; D360-N362 PolarHBondContact OD1-N 3.19Å; D360-V363 PolarHBondContact N-O 3.22Å; D360-V363 CarbonylContact O-C 3.58Å; D360-V363 PolarHBondContact O-N 3.3Å; D360-V363 PolarHBondContact OD1-N 3.45Å; D360-P364 WeakPolarHBondContact O-CA 3.4Å
361	P	97.6	Very high	98.2	Very high	10 Å²	10	12.8 Å²	12.8	7%	0.065	7%	0.065	C	C	.	.	S	Bend	trans	-60.8	-16.2	-178.5	-24.4	34.5	0	0	0	115	P181 Y182 M298 G491 F492	P181-P361 HydrophobicContact CG-CG 4.34Å; Y182-P361 HydrophobicContact CE1-CG 4.39Å; M298-P361 HydrophobicContact CE-CB 4.4Å; M298-P361 HydrophobicContact CE-CG 3.53Å; P361-G491 CarbonylContact O-C 3.56Å; P361-G491 WeakPolarHBondContact O-CA 3.15Å; P361-G491 PolarHBondContact O-N 2.91Å; P361-F492 PolarHBondContact O-N 3.22Å
362	N	97.8	Very high	98.3	Very high	38 Å²	38	12 Å²	12	20%	0.203	6%	0.06	C	C	.	.	S	Bend	trans	-85.5	-56.1	175.5	-68.3	80.4	0	0	0	109.7	H338 D360 A488 H490 F492	H338-N362 PolarHBondContact CE1-OD1 2.76Å; H338-N362 PolarHBondContact NE2-OD1 3.45Å; D360-N362 PolarHBondContact O-N 3.18Å; D360-N362 VanDerWaalsContact O-N 3.07Å; D360-N362 WeakPolarHBondContact OD1-CA 3.35Å; D360-N362 VanDerWaalsContact OD1-CB 3.25Å; D360-N362 WeakPolarHBondContact OD1-CB 3.44Å; D360-N362 PolarHBondContact OD1-N 3.19Å; N362-A488 PolarHBondContact ND2-O 3.13Å; N362-A488 WeakPolarHBondContact O-CB 3.32Å; N362-H490 PolarHBondContact ND2-N 2.94Å; N362-F492 WeakPolarHBondContact O-CA 3.45Å; N362-F492 VanDerWaalsContact O-CD2 3.25Å; N362-F492 WeakPolarHBondContact O-CD2 3.41Å
363	V	98.2	Very high	98.3	Very high	9 Å²	9	13.8 Å²	13.8	6%	0.055	7%	0.07	C	C	.	.	S	Bend	trans	-122.5	100	175.4	-176.5	0	0	0	0	108.9	K356 D360 Q367 L486	K356-V363 HydrophobicContact CD-CB 4.42Å; K356-V363 HydrophobicContact CD-CG1 4.05Å; K356-V363 VanDerWaalsContact CD-O 3.26Å; K356-V363 WeakPolarHBondContact CD-O 3.44Å; K356-V363 PolarHBondContact NZ-O 3.4Å; D360-V363 PolarHBondContact N-O 3.22Å; D360-V363 CarbonylContact O-C 3.58Å; D360-V363 PolarHBondContact O-N 3.3Å; D360-V363 PolarHBondContact OD1-N 3.45Å; V363-Q367 HydrophobicContact CG1-CB 3.92Å; V363-L486 HydrophobicContact CG1-CD2 4.12Å
364	P	98.4	Very high	98.2	Very high	9 Å²	9	11 Å²	11	6%	0.058	6%	0.061	C	C	.	.			trans	-59.7	157.8	-176.4	-29.1	36.4	0	0	0	114.7	P181 D360 Q367 F492 T552	P181-P364 HydrophobicContact CB-CB 4.11Å; P181-P364 HydrophobicContact CB-CG 4.23Å; D360-P364 WeakPolarHBondContact O-CA 3.4Å; P364-Q367 HydrophobicContact CB-CG 4.2Å; P364-Q367 WeakPolarHBondContact O-CB 3.5Å; P364-Q367 PolarHBondContact O-N 2.87Å; P364-F492 HydrophobicContact CG-CB 3.91Å; P364-F492 HydrophobicContact CG-CD1 4.38Å; P364-F492 HydrophobicContact CG-CD2 4.42Å; P364-F492 HydrophobicContact CG-CG 4.01Å; P364-T552 HydrophobicContact CB-CG2 4.23Å
365	A	98.4	Very high	98.1	Very high	2 Å²	2	13.9 Å²	13.9	2%	0.017	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	141	162.7	0	0	0	0	0	110.6	P181 T552	P181-A365 PolarHBondContact O-N 2.62Å; A365-T552 WeakPolarHBondContact O-CB 3.48Å; A365-T552 WeakPolarHBondContact O-CG2 3.26Å; A365-T552 PolarHBondContact O-OG1 3.27Å
366	G	97.6	Very high	98	Very high	0 Å²	0	15 Å²	15	0%	0	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	94.3	-21.2	-174.3	0	0	0	0	0	114.1	T355 K356 Q549	T355-G366 WeakPolarHBondContact CG2-O 3.47Å; K356-G366 PolarHBondContact O-N 2.93Å; G366-Q549 VanDerWaalsContact O-CG 3.22Å; G366-Q549 WeakPolarHBondContact O-CG 3.22Å
367	Q	98.3	Very high	98	Very high	15 Å²	15	18.8 Å²	18.8	7%	0.07	11%	0.11	C	C	.	.	S	Bend	trans	-80.3	149.6	-179.2	-61	-60.3	-17.4	0	0	113.3	K356 V363 P364 T369 L486 F492 Q549 T552	K356-Q367 PolarHBondContact N-O 3.01Å; V363-Q367 HydrophobicContact CG1-CB 3.92Å; P364-Q367 HydrophobicContact CB-CG 4.2Å; P364-Q367 WeakPolarHBondContact O-CB 3.5Å; P364-Q367 PolarHBondContact O-N 2.87Å; Q367-T369 PolarHBondContact O-N 3.08Å; Q367-L486 HydrophobicContact CB-CD2 4.18Å; Q367-F492 HydrophobicContact CG-CE1 4.27Å; Q367-F492 HydrophobicContact CG-CE2 4.26Å; Q367-F492 HydrophobicContact CG-CZ 3.88Å; Q367-Q549 PolarHBondContact NE2-O 3.07Å; Q367-T552 VanDerWaalsContact NE2-C 3.34Å; Q367-T552 PolarHBondContact NE2-O 2.69Å; Q367-T552 PolarHBondContact NE2-OG1 3.47Å
368	L	98.1	Very high	97.9	Very high	20 Å²	20	19 Å²	19	11%	0.105	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	102.1	173.8	177.8	62.2	0	0	0	109.4	R353 L370 D371 L486	R353-L368 HydrophobicContact CB-CD1 3.63Å; R353-L368 HydrophobicContact CG-CD1 3.97Å; L368-L370 WeakPolarHBondContact CD1-O 3.42Å; L368-D371 HydrophobicContact CD2-CB 4.26Å; L368-L486 VanDerWaalsContact O-CB 3.25Å; L368-L486 WeakPolarHBondContact O-CB 3.2Å; L368-L486 WeakPolarHBondContact O-CD2 3.47Å
369	T	98.5	Very high	97.7	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.006	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	-33	-175.6	178.5	0	0	0	0	113.1	Y335 V343 A354 K356 Q367 G485 L486	Y335-T369 VanDerWaalsContact OH-CG2 3.25Å; Y335-T369 WeakPolarHBondContact OH-CG2 3.44Å; Y335-T369 PolarHBondContact OH-OG1 3.26Å; Y335-T369 VanDerWaalsContact OH-OG1 3.13Å; V343-T369 HydrophobicContact CG1-CG2 3.97Å; A354-T369 HydrophobicContact CB-CG2 4.12Å; A354-T369 WeakPolarHBondContact O-CG2 3.44Å; A354-T369 PolarHBondContact O-N 3.18Å; K356-T369 HydrophobicContact CG-CG2 3.73Å; Q367-T369 PolarHBondContact O-N 3.08Å; T369-G485 CarbonylContact O-C 3.47Å; T369-G485 VanDerWaalsContact O-CA 3.3Å; T369-G485 WeakPolarHBondContact O-CA 3.44Å; T369-L486 PolarHBondContact O-N 3.11Å
370	L	98.6	Very high	97.6	Very high	2 Å²	2	26.5 Å²	26.5	1%	0.01	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	138.5	175.6	-53	174.3	0	0	0	110.3	R353 A354 L368 T484 F510 F512 W514 Y523	R353-L370 WeakPolarHBondContact CA-O 3.2Å; A354-L370 HydrophobicContact CB-CB 3.83Å; A354-L370 HydrophobicContact CB-CD1 4.15Å; A354-L370 HydrophobicContact CB-CG 4.16Å; A354-L370 PolarHBondContact N-O 3.46Å; A354-L370 PolarHBondContact O-N 2.82Å; L368-L370 WeakPolarHBondContact CD1-O 3.42Å; L370-T484 WeakPolarHBondContact CA-O 3.29Å; L370-F510 HydrophobicContact CD1-CE2 4.24Å; L370-F512 HydrophobicContact CD1-CB 4.05Å; L370-F512 HydrophobicContact CD1-CD2 4.3Å; L370-F512 HydrophobicContact CD1-CG 4.19Å; L370-F512 HydrophobicContact CD2-CB 4.19Å; L370-F512 HydrophobicContact CD2-CD1 3.6Å; L370-F512 HydrophobicContact CD2-CD2 3.84Å; L370-F512 HydrophobicContact CD2-CE1 3.82Å; L370-F512 HydrophobicContact CD2-CE2 4.06Å; L370-F512 HydrophobicContact CD2-CG 3.59Å; L370-F512 HydrophobicContact CD2-CZ 4.04Å; L370-W514 HydrophobicContact CD2-CH2 3.83Å; L370-W514 HydrophobicContact CD2-CZ2 3.81Å; L370-Y523 HydrophobicContact CD1-CE2 4.05Å
371	D	98.4	Very high	97.4	Very high	38 Å²	38	27.2 Å²	27.2	20%	0.203	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	117.4	168	-166.1	-10.5	0	0	0	108	S351 L368 G483 T484 R497	S351-D371 PolarHBondContact OG-OD1 2.93Å; L368-D371 HydrophobicContact CD2-CB 4.26Å; D371-G483 CarbonylContact O-C 3.58Å; D371-G483 WeakPolarHBondContact O-CA 3.28Å; D371-T484 PolarHBondContact N-O 2.91Å; D371-T484 PolarHBondContact O-N 2.87Å; D371-R497 VanDerWaalsContact CB-CZ 3.46Å; D371-R497 IonicContact OD2-NH1 3.52Å
372	V	98.6	Very high	97.2	Very high	2 Å²	2	33.8 Å²	33.8	1%	0.012	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	125.2	-171.7	-176.3	0	0	0	0	108.2	S351 A352 L374 F481 F502	S351-V372 WeakPolarHBondContact CA-O 3.36Å; A352-V372 HydrophobicContact CB-CB 4.19Å; A352-V372 PolarHBondContact N-O 2.75Å; A352-V372 PolarHBondContact O-N 3.04Å; V372-L374 HydrophobicContact CG1-CD2 4.19Å; V372-L374 PolarHBondContact O-N 2.83Å; V372-F481 HydrophobicContact CG1-CB 3.6Å; V372-F481 HydrophobicContact CG1-CG 4.42Å; V372-F502 HydrophobicContact CB-CB 4.43Å; V372-F502 HydrophobicContact CB-CG 4.45Å; V372-F502 HydrophobicContact CG1-CB 3.64Å; V372-F502 HydrophobicContact CG1-CD1 4.02Å; V372-F502 HydrophobicContact CG1-CD2 4.33Å; V372-F502 HydrophobicContact CG1-CG 3.76Å; V372-F502 HydrophobicContact CG2-CB 3.87Å; V372-F502 HydrophobicContact CG2-CD2 3.6Å; V372-F502 HydrophobicContact CG2-CE2 4.31Å; V372-F502 HydrophobicContact CG2-CG 3.84Å
373	D	97.9	Very high	97.1	Very high	39 Å²	39	35.3 Å²	35.3	21%	0.209	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	104.2	178.4	-172.4	-13.8	0	0	0	109.8	S375 Q376 Y482	D373-S375 PolarHBondContact O-N 2.88Å; D373-S375 WeakPolarHBondContact OD1-CA 3.14Å; D373-S375 VanDerWaalsContact OD1-CB 3.3Å; D373-S375 WeakPolarHBondContact OD1-CB 3.47Å; D373-S375 PolarHBondContact OD1-N 3.12Å; D373-S375 PolarHBondContact OD1-OG 3.38Å; D373-S375 PolarHBondContact OD2-OG 3.5Å; D373-Q376 HydrophobicContact CB-CB 4.36Å; D373-Q376 HydrophobicContact CB-CG 4.24Å; D373-Q376 PolarHBondContact O-N 2.87Å; D373-Q376 VanDerWaalsContact OD2-CG 3.3Å; D373-Q376 WeakPolarHBondContact OD2-CG 3.17Å; D373-Y482 HydrophobicContact CB-CD1 4.08Å; D373-Y482 PolarHBondContact N-O 3.25Å
374	L	97.3	Very high	96.8	Very high	23 Å²	23	41.2 Å²	41.2	12%	0.12	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	-10.2	-179.3	-55.4	180	0	0	0	112.7	L325 F347 M350 A352 V372 Q376 F481	L325-L374 HydrophobicContact CD2-CD2 3.94Å; F347-L374 HydrophobicContact CD1-CD1 3.93Å; F347-L374 HydrophobicContact CE1-CD1 4.08Å; M350-L374 HydrophobicContact CE-CB 3.88Å; M350-L374 WeakPolarHBondContact CE-O 3.31Å; M350-L374 WeakPolarHBondContact O-CA 3.13Å; M350-L374 WeakPolarHBondContact O-CB 3.29Å; M350-L374 WeakPolarHBondContact O-CG 3.32Å; M350-L374 PolarHBondContact O-N 3.47Å; A352-L374 HydrophobicContact CB-CD1 4.28Å; A352-L374 HydrophobicContact CB-CD2 4.15Å; A352-L374 HydrophobicContact CB-CG 4.32Å; V372-L374 HydrophobicContact CG1-CD2 4.19Å; V372-L374 PolarHBondContact O-N 2.83Å; L374-Q376 VanDerWaalsContact C-N 3.33Å; L374-F481 HydrophobicContact CB-CE1 4.46Å; L374-F481 HydrophobicContact CD2-CD1 4.33Å; L374-F481 HydrophobicContact CD2-CD2 4.18Å; L374-F481 HydrophobicContact CD2-CE1 4.43Å; L374-F481 HydrophobicContact CD2-CE2 4.29Å; L374-F481 HydrophobicContact CD2-CG 4.2Å; L374-F481 HydrophobicContact CD2-CZ 4.41Å; L374-F481 WeakPolarHBondContact O-CE1 3.04Å
375	S	96.3	Very high	96.7	Very high	62 Å²	62	45.6 Å²	45.6	43%	0.434	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	-11.1	173.1	77.2	0	0	0	0	113.1	D373 P377	D373-S375 PolarHBondContact O-N 2.88Å; D373-S375 WeakPolarHBondContact OD1-CA 3.14Å; D373-S375 VanDerWaalsContact OD1-CB 3.3Å; D373-S375 WeakPolarHBondContact OD1-CB 3.47Å; D373-S375 PolarHBondContact OD1-N 3.12Å; D373-S375 PolarHBondContact OD1-OG 3.38Å; D373-S375 PolarHBondContact OD2-OG 3.5Å; S375-P377 WeakPolarHBondContact O-CD 3.31Å
376	Q	97.3	Very high	96.5	Very high	27 Å²	27	46.1 Å²	46.1	13%	0.126	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	72.4	-178.9	-58.4	-66.2	-22	0	0	110.6	D373 L374 I399 V403 Y482	D373-Q376 HydrophobicContact CB-CB 4.36Å; D373-Q376 HydrophobicContact CB-CG 4.24Å; D373-Q376 PolarHBondContact O-N 2.87Å; D373-Q376 VanDerWaalsContact OD2-CG 3.3Å; D373-Q376 WeakPolarHBondContact OD2-CG 3.17Å; L374-Q376 VanDerWaalsContact C-N 3.33Å; Q376-I399 HydrophobicContact CB-CG2 4.2Å; Q376-I399 HydrophobicContact CG-CG2 4.34Å; Q376-V403 HydrophobicContact CG-CG2 4.1Å; Q376-Y482 HydrophobicContact CB-CD1 4.41Å; Q376-Y482 PolarHBondContact O-N 3.42Å
377	P	97.2	Very high	96.4	Very high	80 Å²	80	52.2 Å²	52.2	52%	0.519	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	145.5	172	29.6	-34.6	0	0	0	110.2	S375 C480 F481	S375-P377 WeakPolarHBondContact O-CD 3.31Å; P377-C480 WeakPolarHBondContact CA-O 3.41Å; P377-F481 HydrophobicContact CB-CD1 4.24Å; P377-F481 HydrophobicContact CB-CE1 4.09Å
378	V	97.6	Very high	96.3	Very high	6 Å²	6	54.9 Å²	54.9	4%	0.036	28%	0.284	C	S	.	.			trans	-113.1	116.3	178.2	-179.5	0	0	0	0	108.5	L380 I395 I396 I399 C480 L501	V378-L380 PolarHBondContact O-N 2.81Å; V378-I395 HydrophobicContact CG1-CG2 4Å; V378-I396 HydrophobicContact CG1-CD1 4.06Å; V378-I396 HydrophobicContact CG2-CD1 3.74Å; V378-I399 HydrophobicContact CG2-CD1 3.77Å; V378-C480 HydrophobicContact CB-CB 4.2Å; V378-C480 PolarHBondContact N-O 3.27Å; V378-C480 WeakPolarHBondContact O-CB 3.35Å; V378-L501 HydrophobicContact CB-CD1 3.83Å; V378-L501 HydrophobicContact CG1-CD1 3.78Å; V378-L501 HydrophobicContact CG2-CD1 3.96Å
379	D	94.3	Very high	96.1	Very high	146 Å²	146	54.7 Å²	54.7	78%	0.781	28%	0.284	S	S	*	.	P	Polyproline II helix	trans	-72	118.8	169.9	-63.4	-41.9	0	0	0	108.9
380	L	94.6	Very high	96	Very high	23 Å²	23	59.5 Å²	59.5	12%	0.12	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-71.6	138.6	177.1	-73.5	-178.1	0	0	0	109.8	V378 F460 C477 C480 L501	V378-L380 PolarHBondContact O-N 2.81Å; L380-F460 HydrophobicContact CD1-CD2 3.89Å; L380-C477 WeakPolarHBondContact CD1-SG 3.41Å; L380-C480 HydrophobicContact CD2-CB 4.4Å; L380-C480 HydrophobicContact CG-CB 4.31Å; L380-L501 HydrophobicContact CD2-CD2 4.03Å
381	P	94.3	Very high	95.9	Very high	20 Å²	20	61 Å²	61	13%	0.13	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-69.6	170.9	172	32.9	-36.2	0	0	0	110.6	Q385 Q386 V391	P381-Q385 HydrophobicContact CB-CB 3.88Å; P381-Q385 HydrophobicContact CG-CB 4.27Å; P381-Q386 HydrophobicContact CG-CG 3.9Å; P381-Q386 VanDerWaalsContact O-CG 3.28Å; P381-Q386 WeakPolarHBondContact O-CG 3.36Å; P381-Q386 PolarHBondContact O-NE2 3.33Å; P381-V391 HydrophobicContact CB-CG1 4.42Å; P381-V391 HydrophobicContact CG-CG1 4.27Å
382	E	94.2	Very high	95.7	Very high	148 Å²	148	59.5 Å²	59.5	69%	0.692	31%	0.31	S	S	*	.	P	Polyproline II helix	trans	-52.9	150.7	173.7	-69.5	-61	151.9	0	0	112.1	D384 Q385 Q386	E382-D384 VanDerWaalsContact C-N 3.26Å; E382-D384 PolarHBondContact O-N 3.26Å; E382-D384 VanDerWaalsContact O-N 3.09Å; E382-Q385 WeakPolarHBondContact O-CA 3.27Å; E382-Q385 WeakPolarHBondContact O-CB 3.32Å; E382-Q385 PolarHBondContact O-N 3.28Å; E382-Q386 PolarHBondContact O-N 3.27Å
383	L	94.3	Very high	95.6	Very high	69 Å²	69	60.6 Å²	60.6	36%	0.361	32%	0.318	S	S	.	.	H	α-helix	trans	-54.7	-37.8	-169	-170.2	68.2	0	0	0	113.9	Q385 Q386 P459 V461	L383-Q385 VanDerWaalsContact C-N 3.32Å; L383-Q385 PolarHBondContact O-N 3.45Å; L383-Q386 PolarHBondContact O-N 3.15Å; L383-P459 HydrophobicContact CD1-CB 3.92Å; L383-P459 HydrophobicContact CD2-CB 4.4Å; L383-V461 HydrophobicContact CD1-CB 3.95Å; L383-V461 HydrophobicContact CD1-CG1 3.62Å; L383-V461 HydrophobicContact CG-CG1 4.2Å
384	D	93.4	Very high	95.5	Very high	133 Å²	133	67.5 Å²	67.5	71%	0.711	34%	0.341	S	S	*	.	H	α-helix	trans	-68	-32.9	177.4	-72.3	-28.6	0	0	0	112.5	E382	E382-D384 VanDerWaalsContact C-N 3.26Å; E382-D384 PolarHBondContact O-N 3.26Å; E382-D384 VanDerWaalsContact O-N 3.09Å
385	Q	95.1	Very high	95.5	Very high	102 Å²	102	69.2 Å²	69.2	48%	0.477	35%	0.35	S	S	.	.	H	α-helix	trans	-78.9	-29.3	178.2	-65.6	-179.2	-1.2	0	0	112.2	P381 E382 L383 R387 N388	P381-Q385 HydrophobicContact CB-CB 3.88Å; P381-Q385 HydrophobicContact CG-CB 4.27Å; E382-Q385 WeakPolarHBondContact O-CA 3.27Å; E382-Q385 WeakPolarHBondContact O-CB 3.32Å; E382-Q385 PolarHBondContact O-N 3.28Å; L383-Q385 VanDerWaalsContact C-N 3.32Å; L383-Q385 PolarHBondContact O-N 3.45Å; Q385-R387 PolarHBondContact O-N 3.15Å; Q385-N388 WeakPolarHBondContact O-CB 3.44Å; Q385-N388 PolarHBondContact O-N 3.39Å
386	Q	95.3	Very high	95.6	Very high	13 Å²	13	66.2 Å²	66.2	6%	0.061	33%	0.329	C	S	.	.	H	α-helix	trans	-58	-28.6	173.2	-65.3	179.9	24.3	0	0	112.2	P381 E382 L383 N388 P459 V461 P463	P381-Q386 HydrophobicContact CG-CG 3.9Å; P381-Q386 VanDerWaalsContact O-CG 3.28Å; P381-Q386 WeakPolarHBondContact O-CG 3.36Å; P381-Q386 PolarHBondContact O-NE2 3.33Å; E382-Q386 PolarHBondContact O-N 3.27Å; L383-Q386 PolarHBondContact O-N 3.15Å; Q386-N388 PolarHBondContact O-N 3.11Å; Q386-P459 PolarHBondContact NE2-O 3.09Å; Q386-V461 HydrophobicContact CB-CG1 3.79Å; Q386-P463 VanDerWaalsContact O-CA 3.3Å; Q386-P463 WeakPolarHBondContact O-CA 3.27Å; Q386-P463 WeakPolarHBondContact O-CB 3.43Å; Q386-P463 WeakPolarHBondContact O-CG 3.08Å
387	R	95.4	Very high	95.6	Very high	127 Å²	127	68.5 Å²	68.5	48%	0.479	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-14.7	175.2	-65.8	-175.2	179.3	-167.8	1.2	113.5	Q385 V461 L464	Q385-R387 PolarHBondContact O-N 3.15Å; R387-V461 HydrophobicContact CG-CG1 3.79Å; R387-L464 HydrophobicContact CB-CD1 4.47Å; R387-L464 HydrophobicContact CB-CG 4.26Å; R387-L464 WeakPolarHBondContact O-CB 3.27Å; R387-L464 PolarHBondContact O-N 2.79Å
388	N	95.4	Very high	95.6	Very high	71 Å²	71	66.4 Å²	66.4	38%	0.38	34%	0.335	S	S	.	.			trans	-100.2	109.6	179.8	-172.9	-20.1	0	0	0	110.7	Q385 Q386 D390 V391 L392	Q385-N388 WeakPolarHBondContact O-CB 3.44Å; Q385-N388 PolarHBondContact O-N 3.39Å; Q386-N388 PolarHBondContact O-N 3.11Å; N388-D390 PolarHBondContact O-N 3.29Å; N388-D390 WeakPolarHBondContact OD1-CB 3.14Å; N388-D390 PolarHBondContact OD1-N 3.12Å; N388-V391 HydrophobicContact CB-CB 4.41Å; N388-V391 HydrophobicContact CB-CG2 3.92Å; N388-V391 PolarHBondContact O-N 3.32Å; N388-L392 PolarHBondContact O-N 3.44Å
389	I	94.7	Very high	95.6	Very high	17 Å²	17	67.6 Å²	67.6	9%	0.087	34%	0.34	C	S	.	.	H	α-helix	trans	-63	-28.9	-179	-164.4	172.4	0	0	0	112.6	V391 L392 S393 P463 V466 K518	I389-V391 VanDerWaalsContact C-N 3.32Å; I389-V391 PolarHBondContact O-N 3.24Å; I389-L392 PolarHBondContact O-N 2.77Å; I389-S393 VanDerWaalsContact O-CB 3.26Å; I389-S393 WeakPolarHBondContact O-CB 3.34Å; I389-S393 PolarHBondContact O-N 2.66Å; I389-S393 PolarHBondContact O-OG 3.06Å; I389-P463 HydrophobicContact CB-CB 3.75Å; I389-P463 HydrophobicContact CB-CG 4.5Å; I389-P463 HydrophobicContact CG1-CB 4.22Å; I389-V466 HydrophobicContact CD1-CG2 3.68Å; I389-V466 HydrophobicContact CG1-CG2 4.33Å; I389-K518 HydrophobicContact CD1-CB 4.19Å; I389-K518 HydrophobicContact CD1-CD 4.1Å; I389-K518 HydrophobicContact CD1-CG 3.75Å
390	D	95.7	Very high	95.7	Very high	101 Å²	101	62 Å²	62	54%	0.54	31%	0.31	S	S	.	.	H	α-helix	trans	-69.4	-32.5	-179.6	-58.5	-36.8	0	0	0	111.7	N388 R394	N388-D390 PolarHBondContact O-N 3.29Å; N388-D390 WeakPolarHBondContact OD1-CB 3.14Å; N388-D390 PolarHBondContact OD1-N 3.12Å; D390-R394 WeakPolarHBondContact O-CB 3.35Å; D390-R394 PolarHBondContact O-N 3.38Å
391	V	96	Very high	95.8	Very high	33 Å²	33	66.3 Å²	66.3	20%	0.2	33%	0.329	C	S	.	.	H	α-helix	trans	-65.9	-50.8	174.2	176	0	0	0	0	109.5	P381 N388 I389 S393 R394 I395	P381-V391 HydrophobicContact CB-CG1 4.42Å; P381-V391 HydrophobicContact CG-CG1 4.27Å; N388-V391 HydrophobicContact CB-CB 4.41Å; N388-V391 HydrophobicContact CB-CG2 3.92Å; N388-V391 PolarHBondContact O-N 3.32Å; I389-V391 VanDerWaalsContact C-N 3.32Å; I389-V391 PolarHBondContact O-N 3.24Å; V391-S393 VanDerWaalsContact C-N 3.33Å; V391-S393 PolarHBondContact O-N 3.45Å; V391-R394 PolarHBondContact O-N 2.94Å; V391-I395 HydrophobicContact CG1-CD1 4.26Å; V391-I395 WeakPolarHBondContact O-CG1 3.28Å; V391-I395 PolarHBondContact O-N 3.26Å
392	L	94.5	Very high	95.9	Very high	8 Å²	8	70 Å²	70	4%	0.042	34%	0.343	C	S	.	.	H	α-helix	trans	-62.5	-42.4	179	-177.6	61.9	0	0	0	111.6	N388 I389 R394 I395 I396 P463 L501 I513 L515	N388-L392 PolarHBondContact O-N 3.44Å; I389-L392 PolarHBondContact O-N 2.77Å; L392-R394 VanDerWaalsContact C-N 3.34Å; L392-R394 PolarHBondContact O-N 3.08Å; L392-I395 PolarHBondContact O-N 3.45Å; L392-I396 HydrophobicContact CD1-CG1 4.09Å; L392-I396 HydrophobicContact CG-CG1 4.39Å; L392-I396 WeakPolarHBondContact O-CG1 3.2Å; L392-I396 PolarHBondContact O-N 3.23Å; L392-P463 HydrophobicContact CD2-CG 3.9Å; L392-L501 HydrophobicContact CD1-CD1 4.46Å; L392-L501 HydrophobicContact CD1-CD2 4.02Å; L392-L501 HydrophobicContact CD2-CD2 4.19Å; L392-I513 HydrophobicContact CD2-CD1 3.81Å; L392-I513 HydrophobicContact CD2-CG2 4.49Å; L392-L515 HydrophobicContact CD2-CD2 4.35Å; L392-L515 HydrophobicContact CG-CD2 4.36Å
393	S	96.1	Very high	95.9	Very high	25 Å²	25	64 Å²	64	18%	0.175	32%	0.317	C	S	.	.	H	α-helix	trans	-61.8	-42.4	179.8	-58.9	0	0	0	0	111.1	I389 V391 I395 I396 L397	I389-S393 VanDerWaalsContact O-CB 3.26Å; I389-S393 WeakPolarHBondContact O-CB 3.34Å; I389-S393 PolarHBondContact O-N 2.66Å; I389-S393 PolarHBondContact O-OG 3.06Å; V391-S393 VanDerWaalsContact C-N 3.33Å; V391-S393 PolarHBondContact O-N 3.45Å; S393-I395 PolarHBondContact O-N 3.08Å; S393-I396 PolarHBondContact O-N 3.26Å; S393-L397 VanDerWaalsContact O-CB 3.23Å; S393-L397 WeakPolarHBondContact O-CB 3.42Å; S393-L397 WeakPolarHBondContact O-CG 3.42Å; S393-L397 PolarHBondContact O-N 3.17Å
394	R	97.3	Very high	95.8	Very high	184 Å²	184	65.2 Å²	65.2	69%	0.694	32%	0.32	S	S	*	.	H	α-helix	trans	-61.5	-42.8	177.1	-169.8	-174	-54.7	154.4	6.4	112.5	D390 V391 L392 G398	D390-R394 WeakPolarHBondContact O-CB 3.35Å; D390-R394 PolarHBondContact O-N 3.38Å; V391-R394 PolarHBondContact O-N 2.94Å; L392-R394 VanDerWaalsContact C-N 3.34Å; L392-R394 PolarHBondContact O-N 3.08Å; R394-G398 PolarHBondContact O-N 3.33Å
395	I	97.2	Very high	95.7	Very high	58 Å²	58	65.9 Å²	65.9	30%	0.297	31%	0.313	S	S	.	.	H	α-helix	trans	-62.5	-52.1	178.6	-65.5	166.6	0	0	0	109.7	V378 V391 L392 S393 G398 I399	V378-I395 HydrophobicContact CG1-CG2 4Å; V391-I395 HydrophobicContact CG1-CD1 4.26Å; V391-I395 WeakPolarHBondContact O-CG1 3.28Å; V391-I395 PolarHBondContact O-N 3.26Å; L392-I395 PolarHBondContact O-N 3.45Å; S393-I395 PolarHBondContact O-N 3.08Å; I395-G398 PolarHBondContact O-N 3.15Å; I395-I399 HydrophobicContact CG2-CD1 4.28Å; I395-I399 WeakPolarHBondContact O-CG1 3.37Å; I395-I399 PolarHBondContact O-N 3.39Å; I395-I399 VanDerWaalsContact O-N 3.13Å
396	I	97.9	Very high	95.5	Very high	0 Å²	0	65.9 Å²	65.9	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-69	-41.2	-175	-63.7	-59.1	0	0	0	112.3	V378 L392 S393 G398 I399 H400 Y482 P499 L501 L515	V378-I396 HydrophobicContact CG1-CD1 4.06Å; V378-I396 HydrophobicContact CG2-CD1 3.74Å; L392-I396 HydrophobicContact CD1-CG1 4.09Å; L392-I396 HydrophobicContact CG-CG1 4.39Å; L392-I396 WeakPolarHBondContact O-CG1 3.2Å; L392-I396 PolarHBondContact O-N 3.23Å; S393-I396 PolarHBondContact O-N 3.26Å; I396-G398 VanDerWaalsContact C-N 3.32Å; I396-G398 PolarHBondContact O-N 3.1Å; I396-I399 PolarHBondContact O-N 3.39Å; I396-H400 WeakPolarHBondContact O-CB 3.42Å; I396-H400 PolarHBondContact O-N 3.48Å; I396-Y482 HydrophobicContact CG2-CD2 4.05Å; I396-Y482 HydrophobicContact CG2-CE2 4.34Å; I396-P499 HydrophobicContact CG2-CB 4.06Å; I396-L501 HydrophobicContact CD1-CB 4.39Å; I396-L501 HydrophobicContact CD1-CD1 3.78Å; I396-L515 HydrophobicContact CB-CD1 3.56Å; I396-L515 HydrophobicContact CG1-CD1 4.16Å; I396-L515 HydrophobicContact CG2-CD1 3.34Å
397	L	97.5	Very high	94.8	Very high	75 Å²	75	70.7 Å²	70.7	39%	0.393	34%	0.343	S	S	.	.	H	α-helix	trans	-65.6	-36.1	176	-69	173.1	0	0	0	111.6	S393 I399 H400 E401 P499	S393-L397 VanDerWaalsContact O-CB 3.23Å; S393-L397 WeakPolarHBondContact O-CB 3.42Å; S393-L397 WeakPolarHBondContact O-CG 3.42Å; S393-L397 PolarHBondContact O-N 3.17Å; L397-I399 VanDerWaalsContact C-N 3.33Å; L397-I399 PolarHBondContact O-N 3.2Å; L397-H400 WeakPolarHBondContact O-CB 3.21Å; L397-H400 PolarHBondContact O-N 3.36Å; L397-E401 WeakPolarHBondContact O-CG 3.39Å; L397-E401 PolarHBondContact O-N 3.38Å; L397-P499 HydrophobicContact CD2-CG 3.8Å
398	G	97.3	Very high	93.9	Very high	36 Å²	36	71.9 Å²	71.9	37%	0.371	35%	0.354	S	S	.	.	H	α-helix	trans	-61.7	-39.4	173	0	0	0	0	0	113	R394 I395 I396 K402	R394-G398 PolarHBondContact O-N 3.33Å; I395-G398 PolarHBondContact O-N 3.15Å; I396-G398 VanDerWaalsContact C-N 3.32Å; I396-G398 PolarHBondContact O-N 3.1Å; G398-K402 PolarHBondContact O-N 2.92Å
399	I	97.3	Very high	92.4	Very high	30 Å²	30	76 Å²	76	15%	0.154	37%	0.371	C	S	.	.	H	α-helix	trans	-67.9	-44.4	172.8	-63	168.2	0	0	0	110.4	Q376 V378 I395 I396 L397 E401 K402 V403 Y482	Q376-I399 HydrophobicContact CB-CG2 4.2Å; Q376-I399 HydrophobicContact CG-CG2 4.34Å; V378-I399 HydrophobicContact CG2-CD1 3.77Å; I395-I399 HydrophobicContact CG2-CD1 4.28Å; I395-I399 WeakPolarHBondContact O-CG1 3.37Å; I395-I399 PolarHBondContact O-N 3.39Å; I395-I399 VanDerWaalsContact O-N 3.13Å; I396-I399 PolarHBondContact O-N 3.39Å; L397-I399 VanDerWaalsContact C-N 3.33Å; L397-I399 PolarHBondContact O-N 3.2Å; I399-E401 PolarHBondContact O-N 2.64Å; I399-K402 WeakPolarHBondContact O-CB 3.32Å; I399-K402 PolarHBondContact O-N 3.32Å; I399-K402 VanDerWaalsContact O-N 3.08Å; I399-V403 HydrophobicContact CG2-CG2 4.12Å; I399-V403 WeakPolarHBondContact O-CG2 3.48Å; I399-V403 PolarHBondContact O-N 3.11Å; I399-Y482 HydrophobicContact CB-CD2 4.48Å; I399-Y482 HydrophobicContact CG2-CD1 4.09Å; I399-Y482 HydrophobicContact CG2-CD2 4.07Å; I399-Y482 HydrophobicContact CG2-CG 3.71Å
400	H	97.3	Very high	90.2	Very high	30 Å²	30	80.3 Å²	80.3	14%	0.139	40%	0.4	C	S	.	.	H	α-helix	trans	-55.6	-47.7	178.5	-174.7	71.3	0	0	0	112	I396 L397 K402 V403 Q404 Y482 P499	I396-H400 WeakPolarHBondContact O-CB 3.42Å; I396-H400 PolarHBondContact O-N 3.48Å; L397-H400 WeakPolarHBondContact O-CB 3.21Å; L397-H400 PolarHBondContact O-N 3.36Å; H400-K402 VanDerWaalsContact C-N 3.31Å; H400-K402 PolarHBondContact O-N 3.19Å; H400-V403 PolarHBondContact O-N 3.03Å; H400-Q404 PolarHBondContact NE2-NE2 3.24Å; H400-Q404 WeakPolarHBondContact O-CB 3.25Å; H400-Q404 WeakPolarHBondContact O-CG 3.48Å; H400-Q404 PolarHBondContact O-N 2.86Å; H400-Y482 HydrophobicContact CB-CE2 4.01Å; H400-Y482 AromaticContact ND1-CZ 3.77Å; H400-Y482 PolarHBondContact ND1-OH 3.15Å; H400-P499 HydrophobicContact CB-CB 4.27Å
401	E	96.3	Very high	88.1	Confident	112 Å²	112	80.1 Å²	80.1	52%	0.523	41%	0.413	S	S	.	.	H	α-helix	trans	-63.7	-33	176.5	-72.6	174.8	-172.2	0	0	113.1	L397 I399 R405	L397-E401 WeakPolarHBondContact O-CG 3.39Å; L397-E401 PolarHBondContact O-N 3.38Å; I399-E401 PolarHBondContact O-N 2.64Å; E401-R405 WeakPolarHBondContact O-CG 3.28Å; E401-R405 PolarHBondContact O-N 3.14Å; E401-R405 PolarHBondContact O-NE 2.89Å
402	K	95.8	Very high	85.4	Confident	97 Å²	97	84 Å²	84	42%	0.422	44%	0.441	S	S	.	.	H	α-helix	trans	-69.6	-48.5	175.4	-178.5	-174.4	168.5	-168.3	0	110.5	G398 I399 H400 Q404 R405 E406	G398-K402 PolarHBondContact O-N 2.92Å; I399-K402 WeakPolarHBondContact O-CB 3.32Å; I399-K402 PolarHBondContact O-N 3.32Å; I399-K402 VanDerWaalsContact O-N 3.08Å; H400-K402 VanDerWaalsContact C-N 3.31Å; H400-K402 PolarHBondContact O-N 3.19Å; K402-Q404 PolarHBondContact O-N 3.47Å; K402-R405 PolarHBondContact O-N 3.5Å; K402-E406 WeakPolarHBondContact CE-OE1 3.32Å; K402-E406 WeakPolarHBondContact O-CG 3.49Å; K402-E406 PolarHBondContact O-N 2.93Å; K402-E406 VanDerWaalsContact O-N 3.08Å
403	V	93.9	Very high	82.8	Confident	24 Å²	24	90.8 Å²	90.8	15%	0.145	48%	0.477	C	S	.	.	H	α-helix	trans	-62.1	-42.4	179.4	172.7	0	0	0	0	111.1	Q376 I399 H400 R405 E406 V407 Y482	Q376-V403 HydrophobicContact CG-CG2 4.1Å; I399-V403 HydrophobicContact CG2-CG2 4.12Å; I399-V403 WeakPolarHBondContact O-CG2 3.48Å; I399-V403 PolarHBondContact O-N 3.11Å; H400-V403 PolarHBondContact O-N 3.03Å; V403-R405 PolarHBondContact O-N 3.38Å; V403-E406 PolarHBondContact O-N 3.18Å; V403-V407 WeakPolarHBondContact O-CG2 3.35Å; V403-V407 PolarHBondContact O-N 2.89Å; V403-V407 VanDerWaalsContact O-N 3.1Å; V403-Y482 HydrophobicContact CB-CE1 4.4Å; V403-Y482 HydrophobicContact CG1-CE1 4.32Å; V403-Y482 HydrophobicContact CG2-CD1 4.32Å; V403-Y482 HydrophobicContact CG2-CE1 4.08Å
404	Q	92	Very high	80.2	Confident	94 Å²	94	94.3 Å²	94.3	44%	0.439	51%	0.508	S	S	.	.	H	α-helix	trans	-60.9	-43.3	176.1	-77.3	-175	-28.7	0	0	112.4	H400 K402 E406 V407 E408	H400-Q404 PolarHBondContact NE2-NE2 3.24Å; H400-Q404 WeakPolarHBondContact O-CB 3.25Å; H400-Q404 WeakPolarHBondContact O-CG 3.48Å; H400-Q404 PolarHBondContact O-N 2.86Å; K402-Q404 PolarHBondContact O-N 3.47Å; Q404-E406 VanDerWaalsContact C-N 3.34Å; Q404-E406 PolarHBondContact O-N 3.21Å; Q404-V407 PolarHBondContact O-N 3.25Å; Q404-E408 WeakPolarHBondContact O-CG 3.49Å; Q404-E408 PolarHBondContact O-N 2.96Å
405	R	92.7	Very high	77.5	Confident	146 Å²	146	91.1 Å²	91.1	55%	0.551	51%	0.514	S	S	*	.	H	α-helix	trans	-62.4	-39.5	176.6	-79	-179	-77.3	168.2	-9.7	113	E401 K402 V403 V407 E408 Q409	E401-R405 WeakPolarHBondContact O-CG 3.28Å; E401-R405 PolarHBondContact O-N 3.14Å; E401-R405 PolarHBondContact O-NE 2.89Å; K402-R405 PolarHBondContact O-N 3.5Å; V403-R405 PolarHBondContact O-N 3.38Å; R405-V407 VanDerWaalsContact C-N 3.31Å; R405-V407 PolarHBondContact O-N 3.07Å; R405-E408 PolarHBondContact O-N 3.44Å; R405-Q409 PolarHBondContact O-N 2.98Å; R405-Q409 VanDerWaalsContact O-N 3.08Å
406	E	89.9	Confident	74.4	Confident	103 Å²	103	93 Å²	93	48%	0.481	54%	0.538	S	S	.	.	H	α-helix	trans	-66.3	-33.2	177.3	-71.8	173.2	-175.2	0	0	112.2	K402 V403 Q404	K402-E406 WeakPolarHBondContact CE-OE1 3.32Å; K402-E406 WeakPolarHBondContact O-CG 3.49Å; K402-E406 PolarHBondContact O-N 2.93Å; K402-E406 VanDerWaalsContact O-N 3.08Å; V403-E406 PolarHBondContact O-N 3.18Å; Q404-E406 VanDerWaalsContact C-N 3.34Å; Q404-E406 PolarHBondContact O-N 3.21Å
407	V	81.8	Confident	71.1	Confident	113 Å²	113	99.4 Å²	99.4	69%	0.685	58%	0.581	S	S	*	*	H	α-helix	trans	-74.5	-36.3	175.5	174.1	0	0	0	0	112.1	V403 Q404 R405	V403-V407 WeakPolarHBondContact O-CG2 3.35Å; V403-V407 PolarHBondContact O-N 2.89Å; V403-V407 VanDerWaalsContact O-N 3.1Å; Q404-V407 PolarHBondContact O-N 3.25Å; R405-V407 VanDerWaalsContact C-N 3.31Å; R405-V407 PolarHBondContact O-N 3.07Å
408	E	76.6	Confident	67.9	Low	153 Å²	153	103.2 Å²	103.2	72%	0.715	61%	0.608	S	S	*	*	H	α-helix	trans	-77.5	-19.7	179	-70.9	178.8	177	0	0	113.7	Q404 R405 P410	Q404-E408 WeakPolarHBondContact O-CG 3.49Å; Q404-E408 PolarHBondContact O-N 2.96Å; R405-E408 PolarHBondContact O-N 3.44Å; E408-P410 VanDerWaalsContact C-CD 3.42Å; E408-P410 WeakPolarHBondContact O-CD 3.01Å
409	Q	62.3	Low	64.5	Low	156 Å²	156	104.7 Å²	104.7	73%	0.729	62%	0.622	S	S	*	*			trans	-120.4	67.9	179.1	-64.9	-176.7	2	0	0	113.3	R405 A411	R405-Q409 PolarHBondContact O-N 2.98Å; R405-Q409 VanDerWaalsContact O-N 3.08Å; Q409-A411 PolarHBondContact O-N 3.4Å
410	P	49.9	Very low	61.1	Low	109 Å²	109	115 Å²	115	71%	0.708	66%	0.659	S	S	*	*			trans	-72.5	98.5	172.4	28.8	-29.8	0	0	0	110.2	E408	E408-P410 VanDerWaalsContact C-CD 3.42Å; E408-P410 WeakPolarHBondContact O-CD 3.01Å
411	A	50.5	Low	57.8	Low	97 Å²	97	118.3 Å²	118.3	80%	0.802	69%	0.692	S	S	*	*			trans	42.7	86.8	163.7	0	0	0	0	0	117.7	Q409	Q409-A411 PolarHBondContact O-N 3.4Å
412	S	38.7	Very low	54.5	Low	113 Å²	113	122.4 Å²	122.4	79%	0.79	71%	0.711	S	S	*	*			trans	-92.5	-2.5	158.3	65.5	0	0	0	0	114.3
413	D	41.3	Very low	51.4	Low	152 Å²	152	127.2 Å²	127.2	81%	0.813	74%	0.735	S	S	*	*			trans	-111.9	67.8	-169.4	-73.4	5.2	0	0	0	111.7
414	A	40.7	Very low	48.2	Very low	99 Å²	99	135.2 Å²	135.2	82%	0.818	77%	0.771	S	S	*	*	S	Bend	trans	-138.4	49.9	160.9	0	0	0	0	0	110.5
415	S	40.8	Very low	45.1	Very low	116 Å²	116	135.2 Å²	135.2	81%	0.811	79%	0.787	S	S	*	*			trans	-173	87.8	161.2	173.1	0	0	0	0	111.3
416	A	32.7	Very low	41.9	Very low	99 Å²	99	136.5 Å²	136.5	82%	0.818	81%	0.805	S	S	*	*			trans	-176.8	78.2	146.2	0	0	0	0	0	112.4
417	C	28	Very low	38.9	Very low	133 Å²	133	135 Å²	135	90%	0.899	82%	0.816	S	S	*	*			trans	-169.2	76.1	142.8	41.8	0	0	0	0	110.4
418	V	29.7	Very low	36.2	Very low	156 Å²	156	134.6 Å²	134.6	95%	0.945	83%	0.825	S	S	*	*			trans	-107.7	121	154.1	176.8	0	0	0	0	107.1
419	G	26.3	Very low	33.8	Very low	66 Å²	66	132.1 Å²	132.1	68%	0.68	83%	0.831	S	S	*	*			trans	114	98.3	149.6	0	0	0	0	0	116.9
420	R	26.8	Very low	32.2	Very low	247 Å²	247	129.5 Å²	129.5	93%	0.932	84%	0.836	S	S	*	*				178	94.9	122.9	-96.1	167.7	178.9	-174	-0.5	107.7
421	A	28	Very low	31.1	Very low	99 Å²	99	133.2 Å²	133.2	82%	0.818	84%	0.844	S	S	*	*				79.6	95.5	89.8	0	0	0	0	0	111.3
422	E	26.9	Very low	29.9	Very low	198 Å²	198	137 Å²	137	93%	0.925	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-85.7	137.2	165.4	-67.7	176.8	158.8	0	0	109
423	E	29.4	Very low	29.3	Very low	199 Å²	199	137.2 Å²	137.2	93%	0.93	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-93.1	136	167.4	-79	-176.3	152.7	0	0	109.8
424	E	26.7	Very low	28.6	Very low	191 Å²	191	137.7 Å²	137.7	89%	0.893	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-69.3	147.3	170.4	-66.7	178.9	141.7	0	0	111.8
425	A	27.9	Very low	27.9	Very low	94 Å²	94	138.7 Å²	138.7	78%	0.777	84%	0.835	S	S	*	*				160	136.3	99.7	0	0	0	0	0	114.2
426	D	25.1	Very low	27.1	Very low	174 Å²	174	139 Å²	139	93%	0.93	83%	0.827	S	S	*	*			trans	97.8	138.7	133.2	-133.2	5.6	0	0	0	122.1
427	G	26.1	Very low	26.9	Very low	70 Å²	70	142.2 Å²	142.2	72%	0.722	83%	0.825	S	S	*	*			trans	119.8	87.8	152.6	0	0	0	0	0	118.2
428	A	25.6	Very low	26.8	Very low	105 Å²	105	139.6 Å²	139.6	87%	0.868	82%	0.821	S	S	*	*			trans	-69.7	149.9	166.5	0	0	0	0	0	113.7
429	A	26.8	Very low	26.8	Very low	102 Å²	102	136.7 Å²	136.7	84%	0.843	81%	0.813	S	S	*	*			trans	176.7	139.1	131.8	0	0	0	0	0	114.4
430	A	29	Very low	26.7	Very low	101 Å²	101	139.5 Å²	139.5	84%	0.835	82%	0.821	S	S	*	*			trans	81.8	108.1	146.2	0	0	0	0	0	121.1
431	E	25.8	Very low	26.7	Very low	186 Å²	186	132.6 Å²	132.6	87%	0.869	82%	0.816	S	S	*	*			trans	-61	155.4	146	-66.2	-179.5	139.5	0	0	111.8
432	E	25.7	Very low	26.7	Very low	178 Å²	178	135.3 Å²	135.3	83%	0.832	82%	0.817	S	S	*	*			trans	172.5	110.7	131.7	-93.8	-179.8	-163	0	0	107.9
433	T	25.9	Very low	26.8	Very low	116 Å²	116	129.7 Å²	129.7	71%	0.712	81%	0.805	S	S	*	*				57.4	138.2	107.7	33.1	0	0	0	0	115
434	E	25.8	Very low	26.6	Very low	162 Å²	162	126.8 Å²	126.8	76%	0.757	81%	0.805	S	S	*	*			cis	-165.8	144.6	13.6	-108.1	-165.2	-179.9	0	0	106.1
435	V	26.3	Very low	26.8	Very low	121 Å²	121	126.7 Å²	126.7	73%	0.733	81%	0.805	S	S	*	*				58.3	132.4	100.8	-169.9	0	0	0	0	112.1
436	D	25.8	Very low	26.9	Very low	122 Å²	122	128.1 Å²	128.1	65%	0.652	81%	0.809	S	S	*	*			cis	172.5	171.4	0.3	173.1	21.1	0	0	0	105.6
437	H	28.5	Very low	27.1	Very low	166 Å²	166	122.7 Å²	122.7	77%	0.769	79%	0.794	S	S	*	*			trans	105.9	114.2	154.7	-62.3	84.5	0	0	0	119.2
438	G	25.6	Very low	27.5	Very low	79 Å²	79	125.9 Å²	125.9	81%	0.814	80%	0.802	S	S	*	*			trans	175.9	63	160.6	0	0	0	0	0	115
439	A	28.6	Very low	27.8	Very low	95 Å²	95	126.4 Å²	126.4	79%	0.785	80%	0.799	S	S	*	*			trans	-47.7	161.5	164.8	0	0	0	0	0	112.7
440	C	24.6	Very low	28.4	Very low	124 Å²	124	125.4 Å²	125.4	84%	0.838	80%	0.799	S	S	*	*			cis	179.4	150.5	5	40.3	0	0	0	0	107.2
441	A	27.4	Very low	28.7	Very low	102 Å²	102	125.4 Å²	125.4	84%	0.843	79%	0.792	S	S	*	*			trans	163.1	141.6	153.2	0	0	0	0	0	108.1
442	D	27.6	Very low	29.4	Very low	156 Å²	156	122.4 Å²	122.4	83%	0.834	79%	0.792	S	S	*	*			cis	-167	154.5	-9.2	-161.9	-1.8	0	0	0	106.5
443	A	27.9	Very low	30.1	Very low	81 Å²	81	118.7 Å²	118.7	67%	0.669	79%	0.786	S	S	*	*			trans	18.8	128.6	165	0	0	0	0	0	123
444	C	26.9	Very low	31	Very low	137 Å²	137	117.6 Å²	117.6	93%	0.926	78%	0.783	S	S	*	*				-179.2	149.1	107.4	45.9	0	0	0	0	114.2
445	Q	30.8	Very low	32.5	Very low	190 Å²	190	113.5 Å²	113.5	89%	0.888	77%	0.771	S	S	*	*			trans	-84	148.8	-173.2	-58.3	165.9	-1.1	0	0	112.7
446	S	29.7	Very low	34.8	Very low	123 Å²	123	116.2 Å²	116.2	86%	0.86	78%	0.775	S	S	*	*			trans	176.3	133.6	133.6	51.8	0	0	0	0	111.8
447	G	28	Very low	37.8	Very low	61 Å²	61	113.1 Å²	113.1	63%	0.629	77%	0.766	S	S	*	*			trans	-72.3	177.9	-175.3	0	0	0	0	0	116.1	S449	G447-S449 PolarHBondContact O-N 3.42Å
448	P	35.2	Very low	40.9	Very low	137 Å²	137	108.3 Å²	108.3	89%	0.89	74%	0.744	S	S	*	*			trans	-81.5	106.9	-173.9	31.5	-29.7	0	0	0	110.4	G450	P448-G450 PolarHBondContact O-N 2.84Å; P448-G450 VanDerWaalsContact O-N 3.13Å
449	S	32.8	Very low	44.3	Very low	116 Å²	116	108.1 Å²	108.1	81%	0.811	73%	0.729	S	S	*	*			trans	-69.7	101.4	165.7	-61.4	0	0	0	0	109.3	G447 S451	G447-S449 PolarHBondContact O-N 3.42Å; S449-S451 PolarHBondContact O-N 2.68Å
450	G	38.6	Very low	47.6	Very low	80 Å²	80	103.9 Å²	103.9	83%	0.825	69%	0.693	S	S	*	*			trans	-72.5	101.1	159.6	0	0	0	0	0	109.1	P448	P448-G450 PolarHBondContact O-N 2.84Å; P448-G450 VanDerWaalsContact O-N 3.13Å
451	S	34.7	Very low	51	Low	101 Å²	101	99 Å²	99	71%	0.706	66%	0.659	S	S	*	*			trans	-101.3	100.7	167.9	59.1	0	0	0	0	109.4	S449 S453	S449-S451 PolarHBondContact O-N 2.68Å; S451-S453 VanDerWaalsContact C-N 3.25Å; S451-S453 PolarHBondContact O-N 2.85Å
452	S	41.7	Very low	54.3	Low	123 Å²	123	94.9 Å²	94.9	86%	0.86	62%	0.623	S	S	*	*			trans	-70.3	85.9	157.1	56.6	0	0	0	0	108.1	S454	S452-S454 PolarHBondContact O-N 2.9Å
453	S	38.9	Very low	57.6	Low	100 Å²	100	87.7 Å²	87.7	70%	0.699	58%	0.584	S	S	*	*			trans	-72.5	110.3	173.1	54.6	0	0	0	0	108.9	S451	S451-S453 VanDerWaalsContact C-N 3.25Å; S451-S453 PolarHBondContact O-N 2.85Å
454	S	46.3	Very low	60.8	Low	93 Å²	93	90 Å²	90	65%	0.65	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-51.8	139.2	155.9	50	0	0	0	0	108.5	S452 E456	S452-S454 PolarHBondContact O-N 2.9Å; S454-E456 PolarHBondContact O-N 3.48Å
455	P	57.4	Low	63.9	Low	77 Å²	77	86.1 Å²	86.1	50%	0.5	57%	0.569	S	S	.	*	P	Polyproline II helix	trans	-55.7	117.9	177.6	20.7	-29.6	0	0	0	109.3	A457	P455-A457 PolarHBondContact O-N 3.05Å
456	E	73.3	Confident	67	Low	177 Å²	177	77.9 Å²	77.9	83%	0.827	53%	0.531	S	S	*	.	P	Polyproline II helix	trans	-63	126.5	-179.1	-75.3	-176.2	155.7	0	0	109	S454 Q458	S454-E456 PolarHBondContact O-N 3.48Å; E456-Q458 PolarHBondContact O-N 3.31Å
457	A	89.7	Confident	70.1	Confident	57 Å²	57	78.2 Å²	78.2	47%	0.471	52%	0.521	S	S	.	.	P	Polyproline II helix	trans	-66.2	130.7	175.9	0	0	0	0	0	109.4	P455 C477	P455-A457 PolarHBondContact O-N 3.05Å; A457-C477 WeakPolarHBondContact CA-O 3.23Å
458	Q	93.8	Very high	73.2	Confident	65 Å²	65	76.9 Å²	76.9	30%	0.304	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	150.9	179.1	64.3	-179.2	-27.6	0	0	111.5	E456 T476 C477	E456-Q458 PolarHBondContact O-N 3.31Å; Q458-T476 CarbonylContact O-C 3.46Å; Q458-T476 WeakPolarHBondContact O-CA 3.48Å; Q458-C477 PolarHBondContact N-O 3.35Å; Q458-C477 PolarHBondContact O-N 2.75Å
459	P	96.8	Very high	75.8	Confident	76 Å²	76	74 Å²	74	49%	0.494	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.1	141.4	175	-26	36.3	0	0	0	113.3	L383 Q386	L383-P459 HydrophobicContact CD1-CB 3.92Å; L383-P459 HydrophobicContact CD2-CB 4.4Å; Q386-P459 PolarHBondContact NE2-O 3.09Å
460	F	97.2	Very high	78.4	Confident	6 Å²	6	69.5 Å²	69.5	3%	0.026	44%	0.442	C	S	.	.			trans	-135.6	134.3	-179.5	178.4	-98.5	0	0	0	112	L380 L462 Y473 R475 C477 V503 F505 I513	L380-F460 HydrophobicContact CD1-CD2 3.89Å; F460-L462 HydrophobicContact CE1-CD2 3.96Å; F460-L462 HydrophobicContact CE1-CG 4.2Å; F460-L462 HydrophobicContact CZ-CD2 3.82Å; F460-L462 HydrophobicContact CZ-CG 4.48Å; F460-Y473 HydrophobicContact CD1-CD2 4.27Å; F460-Y473 AromaticContact CD1-CE2 3.93Å; F460-Y473 HydrophobicContact CD1-CE2 3.93Å; F460-Y473 HydrophobicContact CE1-CD2 4.18Å; F460-Y473 AromaticContact CE1-CE2 3.87Å; F460-Y473 HydrophobicContact CE1-CE2 3.87Å; F460-R475 PolarHBondContact N-O 3.05Å; F460-C477 HydrophobicContact CB-CB 4.27Å; F460-V503 HydrophobicContact CD2-CG1 4.13Å; F460-V503 HydrophobicContact CE2-CG1 3.94Å; F460-V503 HydrophobicContact CE2-CG2 3.85Å; F460-V503 HydrophobicContact CZ-CG1 4.15Å; F460-V503 HydrophobicContact CZ-CG2 4.01Å; F460-F505 AromaticContact CD1-CE1 3.57Å; F460-F505 HydrophobicContact CD1-CE1 3.57Å; F460-F505 HydrophobicContact CD1-CZ 4.12Å; F460-F505 AromaticContact CE1-CE1 3.79Å; F460-F505 HydrophobicContact CE1-CE1 3.79Å; F460-F505 AromaticContact CE1-CZ 3.84Å; F460-F505 HydrophobicContact CE1-CZ 3.84Å; F460-F505 HydrophobicContact CG-CE1 4.17Å; F460-F505 HydrophobicContact CZ-CZ 4.49Å; F460-I513 HydrophobicContact CZ-CD1 4.25Å
461	V	97.1	Very high	80.5	Confident	22 Å²	22	73.7 Å²	73.7	13%	0.133	44%	0.44	C	S	.	.			trans	-140	139.2	170.9	69.5	0	0	0	0	110.6	L383 Q386 R387	L383-V461 HydrophobicContact CD1-CB 3.95Å; L383-V461 HydrophobicContact CD1-CG1 3.62Å; L383-V461 HydrophobicContact CG-CG1 4.2Å; Q386-V461 HydrophobicContact CB-CG1 3.79Å; R387-V461 HydrophobicContact CG-CG1 3.79Å
462	L	97.1	Very high	83.1	Confident	14 Å²	14	74.8 Å²	74.8	7%	0.073	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-66.7	144.7	174.3	-69.6	172.2	0	0	0	111.2	F460 A468 Y473 I513 F520	F460-L462 HydrophobicContact CE1-CD2 3.96Å; F460-L462 HydrophobicContact CE1-CG 4.2Å; F460-L462 HydrophobicContact CZ-CD2 3.82Å; F460-L462 HydrophobicContact CZ-CG 4.48Å; L462-A468 HydrophobicContact CD1-CB 3.86Å; L462-Y473 WeakPolarHBondContact CB-OH 3.42Å; L462-Y473 HydrophobicContact CD1-CD1 4.07Å; L462-Y473 HydrophobicContact CD1-CE1 3.45Å; L462-Y473 VanDerWaalsContact CD1-CE1 3.45Å; L462-Y473 HydrophobicContact CD1-CE2 4.2Å; L462-Y473 HydrophobicContact CG-CE1 4Å; L462-Y473 HydrophobicContact CG-CE2 3.9Å; L462-Y473 VanDerWaalsContact CG-CZ 3.48Å; L462-Y473 WeakPolarHBondContact CG-OH 3.25Å; L462-Y473 PolarHBondContact N-OH 3.19Å; L462-I513 HydrophobicContact CD2-CD1 3.95Å; L462-I513 HydrophobicContact CD2-CG1 4.1Å; L462-F520 HydrophobicContact CD1-CB 4.06Å; L462-F520 HydrophobicContact CD1-CD1 3.67Å; L462-F520 HydrophobicContact CD1-CE1 4.25Å; L462-F520 HydrophobicContact CD1-CG 3.87Å; L462-F520 HydrophobicContact CD2-CB 4.02Å; L462-F520 HydrophobicContact CD2-CD1 4.11Å; L462-F520 HydrophobicContact CD2-CD2 3.61Å; L462-F520 HydrophobicContact CD2-CE1 4.48Å; L462-F520 HydrophobicContact CD2-CE2 4.02Å; L462-F520 HydrophobicContact CD2-CG 3.64Å; L462-F520 HydrophobicContact CD2-CZ 4.43Å; L462-F520 HydrophobicContact CG-CD1 4.48Å; L462-F520 HydrophobicContact CG-CG 4.42Å
463	P	96.6	Very high	85.6	Confident	5 Å²	5	70.1 Å²	70.1	3%	0.032	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-59.3	147	171.5	-17.8	27	0	0	0	112.7	Q386 I389 L392 G465 V466	Q386-P463 VanDerWaalsContact O-CA 3.3Å; Q386-P463 WeakPolarHBondContact O-CA 3.27Å; Q386-P463 WeakPolarHBondContact O-CB 3.43Å; Q386-P463 WeakPolarHBondContact O-CG 3.08Å; I389-P463 HydrophobicContact CB-CB 3.75Å; I389-P463 HydrophobicContact CB-CG 4.5Å; I389-P463 HydrophobicContact CG1-CB 4.22Å; L392-P463 HydrophobicContact CD2-CG 3.9Å; P463-G465 PolarHBondContact O-N 3.04Å; P463-V466 HydrophobicContact CB-CG2 3.81Å; P463-V466 HydrophobicContact CG-CG2 3.97Å; P463-V466 WeakPolarHBondContact O-CB 3.28Å; P463-V466 PolarHBondContact O-N 2.97Å; P463-V466 VanDerWaalsContact O-N 3.16Å
464	L	94.3	Very high	88.4	Confident	129 Å²	129	66.2 Å²	66.2	68%	0.675	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	134.7	174.2	-68.2	173.7	0	0	0	110.1	R387 V466	R387-L464 HydrophobicContact CB-CD1 4.47Å; R387-L464 HydrophobicContact CB-CG 4.26Å; R387-L464 WeakPolarHBondContact O-CB 3.27Å; R387-L464 PolarHBondContact O-N 2.79Å; L464-V466 VanDerWaalsContact C-N 3.3Å
465	G	92	Very high	90.7	Very high	57 Å²	57	68 Å²	68	59%	0.588	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.2	-3.8	-176.8	0	0	0	0	0	114.8	P463 M467	P463-G465 PolarHBondContact O-N 3.04Å; G465-M467 PolarHBondContact O-N 3.04Å
466	V	96	Very high	92.6	Very high	16 Å²	16	67.6 Å²	67.6	10%	0.097	37%	0.367	C	S	.	.			trans	-77.4	120	168	176.1	0	0	0	0	109.3	I389 P463 L464 I513 K518 F520	I389-V466 HydrophobicContact CD1-CG2 3.68Å; I389-V466 HydrophobicContact CG1-CG2 4.33Å; P463-V466 HydrophobicContact CB-CG2 3.81Å; P463-V466 HydrophobicContact CG-CG2 3.97Å; P463-V466 WeakPolarHBondContact O-CB 3.28Å; P463-V466 PolarHBondContact O-N 2.97Å; P463-V466 VanDerWaalsContact O-N 3.16Å; L464-V466 VanDerWaalsContact C-N 3.3Å; V466-I513 HydrophobicContact CG1-CG2 4.42Å; V466-I513 HydrophobicContact CG2-CG2 4.49Å; V466-K518 CarbonylContact C-O 3.58Å; V466-K518 WeakPolarHBondContact CA-O 3.45Å; V466-F520 HydrophobicContact CG1-CB 3.76Å
467	M	93.9	Very high	93.8	Very high	131 Å²	131	59.2 Å²	59.2	65%	0.645	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.4	124.2	179.9	-64	-59.5	-63.6	0	0	110.5	G465 K518 S519 F520	G465-M467 PolarHBondContact O-N 3.04Å; M467-K518 PolarHBondContact N-O 3.23Å; M467-S519 CarbonylContact O-C 3.59Å; M467-S519 WeakPolarHBondContact O-CA 3.04Å; M467-F520 PolarHBondContact O-N 3.11Å
468	A	93.9	Very high	94.1	Very high	32 Å²	32	60.9 Å²	60.9	26%	0.264	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	131.9	172.5	0	0	0	0	0	109.7	L462 N470 F520	L462-A468 HydrophobicContact CD1-CB 3.86Å; A468-N470 VanDerWaalsContact C-N 3.32Å; A468-F520 HydrophobicContact CB-CB 4.2Å; A468-F520 HydrophobicContact CB-CD1 4Å
469	R	90.9	Very high	94.2	Very high	78 Å²	78	62 Å²	62	29%	0.294	33%	0.326	S	S	.	.	S	Bend	trans	-66.1	-38	171.4	-77.7	-84.4	108.7	119.1	-3.8	111.2	P206 T334 G336	P206-R469 HydrophobicContact CB-CB 3.94Å; T334-R469 HydrophobicContact CG2-CB 4.19Å; G336-R469 PolarHBondContact O-NH1 3.23Å
470	N	86.8	Confident	94.3	Very high	21 Å²	21	58.6 Å²	58.6	11%	0.112	30%	0.303	C	S	.	.			trans	-92.3	114.2	174.8	-73.9	69.1	0	0	0	110.6	P206 T334 A468 V472 L522	P206-N470 WeakPolarHBondContact CB-OD1 3.45Å; P206-N470 VanDerWaalsContact O-CG 3.23Å; P206-N470 PolarHBondContact O-ND2 2.65Å; P206-N470 PolarHBondContact O-OD1 3.08Å; T334-N470 WeakPolarHBondContact CG2-OD1 3.26Å; A468-N470 VanDerWaalsContact C-N 3.32Å; N470-V472 VanDerWaalsContact C-N 3.26Å; N470-L522 HydrophobicContact CB-CD2 4.01Å
471	E	82.5	Confident	94.3	Very high	168 Å²	168	59 Å²	59	79%	0.785	31%	0.305	S	S	*	.	S	Bend	trans	-71.6	-27.2	170.5	-62.1	-174.9	175.4	0	0	112	R475	E471-R475 PolarHBondContact O-NH2 3.12Å
472	V	89.8	Confident	94.4	Very high	123 Å²	123	58.6 Å²	58.6	75%	0.745	30%	0.301	S	S	*	.			trans	-98.1	111	176.4	-174.6	0	0	0	0	109.1	N470	N470-V472 VanDerWaalsContact C-N 3.26Å
473	Y	94.1	Very high	94.5	Very high	25 Å²	25	57.9 Å²	57.9	10%	0.098	30%	0.298	C	S	.	.			trans	-140.6	158.6	172.4	60.3	-90.9	0	0	0	109.7	F460 L462 R475 F520	F460-Y473 HydrophobicContact CD1-CD2 4.27Å; F460-Y473 AromaticContact CD1-CE2 3.93Å; F460-Y473 HydrophobicContact CD1-CE2 3.93Å; F460-Y473 HydrophobicContact CE1-CD2 4.18Å; F460-Y473 AromaticContact CE1-CE2 3.87Å; F460-Y473 HydrophobicContact CE1-CE2 3.87Å; L462-Y473 WeakPolarHBondContact CB-OH 3.42Å; L462-Y473 HydrophobicContact CD1-CD1 4.07Å; L462-Y473 HydrophobicContact CD1-CE1 3.45Å; L462-Y473 VanDerWaalsContact CD1-CE1 3.45Å; L462-Y473 HydrophobicContact CD1-CE2 4.2Å; L462-Y473 HydrophobicContact CG-CE1 4Å; L462-Y473 HydrophobicContact CG-CE2 3.9Å; L462-Y473 VanDerWaalsContact CG-CZ 3.48Å; L462-Y473 WeakPolarHBondContact CG-OH 3.25Å; L462-Y473 PolarHBondContact N-OH 3.19Å; Y473-R475 PolarHBondContact O-N 3.38Å; Y473-R475 PolarHBondContact OH-NH1 2.81Å; Y473-F520 HydrophobicContact CG-CE1 4.49Å
474	P	96.4	Very high	94.6	Very high	18 Å²	18	58.5 Å²	58.5	12%	0.117	30%	0.301	C	S	.	.			trans	-59	135.8	179.6	-23.5	34.3	0	0	0	112.4	T476 F505	P474-T476 VanDerWaalsContact C-N 3.32Å; P474-F505 HydrophobicContact CB-CB 3.94Å; P474-F505 HydrophobicContact CB-CD1 3.7Å; P474-F505 HydrophobicContact CB-CE1 4.33Å; P474-F505 HydrophobicContact CB-CG 3.82Å; P474-F505 HydrophobicContact CG-CB 3.91Å; P474-F505 HydrophobicContact CG-CD1 4.16Å; P474-F505 HydrophobicContact CG-CD2 4.14Å; P474-F505 HydrophobicContact CG-CG 3.81Å
475	R	96.1	Very high	94.8	Very high	130 Å²	130	52.4 Å²	52.4	49%	0.491	27%	0.269	S	S	.	.	S	Bend	trans	-93.5	10.3	-177.1	-57.4	-58.9	178.9	166.2	-8.3	113.9	F460 E471 Y473	F460-R475 PolarHBondContact N-O 3.05Å; E471-R475 PolarHBondContact O-NH2 3.12Å; Y473-R475 PolarHBondContact O-N 3.38Å; Y473-R475 PolarHBondContact OH-NH1 2.81Å
476	T	97	Very high	95.1	Very high	70 Å²	70	50.7 Å²	50.7	43%	0.429	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	139.9	177.2	55.6	0	0	0	0	108.9	Q458 P474 F505	Q458-T476 CarbonylContact O-C 3.46Å; Q458-T476 WeakPolarHBondContact O-CA 3.48Å; P474-T476 VanDerWaalsContact C-N 3.32Å; T476-F505 WeakPolarHBondContact O-CD1 3.32Å
477	C	97.1	Very high	95.2	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	158.4	173.5	69.1	0	0	0	0	111	L380 A457 Q458 F460 V503 L504 F505	L380-C477 WeakPolarHBondContact CD1-SG 3.41Å; A457-C477 WeakPolarHBondContact CA-O 3.23Å; Q458-C477 PolarHBondContact N-O 3.35Å; Q458-C477 PolarHBondContact O-N 2.75Å; F460-C477 HydrophobicContact CB-CB 4.27Å; C477-V503 HydrophobicContact CB-CG1 3.52Å; C477-L504 CarbonylContact C-O 3.54Å; C477-L504 WeakPolarHBondContact CA-O 3.35Å; C477-L504 WeakPolarHBondContact CB-O 3.02Å; C477-F505 HydrophobicContact CB-CD1 4.01Å; C477-F505 HydrophobicContact CB-CE1 4.35Å
478	R	96.4	Very high	95.4	Very high	92 Å²	92	46 Å²	46	35%	0.347	23%	0.226	S	C	.	.	S	Bend	trans	-94.4	-44.6	178.7	-69	179.7	179	-174.9	1.7	112.1	L504 E507	R478-L504 PolarHBondContact N-O 3.23Å; R478-E507 IonicContact CZ-OE1 2.78Å; R478-E507 IonicContact NH1-OE1 3.54Å; R478-E507 PolarHBondContact NH1-OE1 3.31Å
479	K	96.6	Very high	95.5	Very high	90 Å²	90	46 Å²	46	39%	0.391	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	153.2	-177.1	-64.3	-169.9	-175.4	176	0	110.6	L325 F481 L504	L325-K479 HydrophobicContact CD1-CD 3.98Å; K479-F481 HydrophobicContact CB-CD2 4.37Å; K479-F481 HydrophobicContact CB-CE2 3.61Å; K479-F481 HydrophobicContact CB-CZ 4.17Å; K479-F481 HydrophobicContact CD-CE2 4.02Å; K479-F481 HydrophobicContact CD-CZ 3.87Å; K479-F481 HydrophobicContact CG-CE2 4.46Å; K479-L504 WeakPolarHBondContact O-CB 3.15Å; K479-L504 PolarHBondContact O-N 3.33Å
480	C	98.2	Very high	95.7	Very high	4 Å²	4	47.7 Å²	47.7	3%	0.027	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	142.8	175.2	-75.1	0	0	0	0	109.3	P377 V378 L380 L501 F502	P377-C480 WeakPolarHBondContact CA-O 3.41Å; V378-C480 HydrophobicContact CB-CB 4.2Å; V378-C480 PolarHBondContact N-O 3.27Å; V378-C480 WeakPolarHBondContact O-CB 3.35Å; L380-C480 HydrophobicContact CD2-CB 4.4Å; L380-C480 HydrophobicContact CG-CB 4.31Å; C480-L501 HydrophobicContact CB-CD1 4.05Å; C480-F502 VanDerWaalsContact CA-O 3.25Å; C480-F502 WeakPolarHBondContact CA-O 3.36Å
481	F	98.5	Very high	96.1	Very high	14 Å²	14	49 Å²	49	6%	0.061	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	150.2	-177.9	-65.4	-83.9	0	0	0	110.1	L325 V372 L374 P377 K479 F502	L325-F481 HydrophobicContact CD1-CE2 4.26Å; L325-F481 HydrophobicContact CD1-CZ 4.43Å; L325-F481 HydrophobicContact CD2-CD2 4.22Å; L325-F481 HydrophobicContact CD2-CE2 3.62Å; L325-F481 HydrophobicContact CD2-CZ 4.36Å; V372-F481 HydrophobicContact CG1-CB 3.6Å; V372-F481 HydrophobicContact CG1-CG 4.42Å; L374-F481 HydrophobicContact CB-CE1 4.46Å; L374-F481 HydrophobicContact CD2-CD1 4.33Å; L374-F481 HydrophobicContact CD2-CD2 4.18Å; L374-F481 HydrophobicContact CD2-CE1 4.43Å; L374-F481 HydrophobicContact CD2-CE2 4.29Å; L374-F481 HydrophobicContact CD2-CG 4.2Å; L374-F481 HydrophobicContact CD2-CZ 4.41Å; L374-F481 WeakPolarHBondContact O-CE1 3.04Å; P377-F481 HydrophobicContact CB-CD1 4.24Å; P377-F481 HydrophobicContact CB-CE1 4.09Å; K479-F481 HydrophobicContact CB-CD2 4.37Å; K479-F481 HydrophobicContact CB-CE2 3.61Å; K479-F481 HydrophobicContact CB-CZ 4.17Å; K479-F481 HydrophobicContact CD-CE2 4.02Å; K479-F481 HydrophobicContact CD-CZ 3.87Å; K479-F481 HydrophobicContact CG-CE2 4.46Å; F481-F502 HydrophobicContact CB-CB 4.44Å; F481-F502 HydrophobicContact CB-CD1 4.39Å; F481-F502 HydrophobicContact CD2-CD1 4.03Å; F481-F502 HydrophobicContact CD2-CE1 4.41Å; F481-F502 PolarHBondContact N-O 3.28Å; F481-F502 PolarHBondContact O-N 3.29Å
482	Y	98.7	Very high	96.8	Very high	13 Å²	13	42.6 Å²	42.6	5%	0.051	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	140.2	166.9	164.8	-103.1	0	0	0	109.6	D373 Q376 I396 I399 H400 V403 T484 P499	D373-Y482 HydrophobicContact CB-CD1 4.08Å; D373-Y482 PolarHBondContact N-O 3.25Å; Q376-Y482 HydrophobicContact CB-CD1 4.41Å; Q376-Y482 PolarHBondContact O-N 3.42Å; I396-Y482 HydrophobicContact CG2-CD2 4.05Å; I396-Y482 HydrophobicContact CG2-CE2 4.34Å; I399-Y482 HydrophobicContact CB-CD2 4.48Å; I399-Y482 HydrophobicContact CG2-CD1 4.09Å; I399-Y482 HydrophobicContact CG2-CD2 4.07Å; I399-Y482 HydrophobicContact CG2-CG 3.71Å; H400-Y482 HydrophobicContact CB-CE2 4.01Å; H400-Y482 AromaticContact ND1-CZ 3.77Å; H400-Y482 PolarHBondContact ND1-OH 3.15Å; V403-Y482 HydrophobicContact CB-CE1 4.4Å; V403-Y482 HydrophobicContact CG1-CE1 4.32Å; V403-Y482 HydrophobicContact CG2-CD1 4.32Å; V403-Y482 HydrophobicContact CG2-CE1 4.08Å; Y482-T484 HydrophobicContact CE1-CG2 4.47Å; Y482-T484 HydrophobicContact CE2-CG2 4.42Å; Y482-T484 WeakPolarHBondContact OH-CG2 3.2Å; Y482-P499 HydrophobicContact CE2-CB 4.12Å
483	G	98.4	Very high	97.2	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	174.5	172	0	0	0	0	0	111.3	D371 G500	D371-G483 CarbonylContact O-C 3.58Å; D371-G483 WeakPolarHBondContact O-CA 3.28Å; G483-G500 PolarHBondContact N-O 2.92Å; G483-G500 VanDerWaalsContact N-O 3.14Å; G483-G500 PolarHBondContact O-N 3.1Å; G483-G500 VanDerWaalsContact O-O 3.08Å
484	T	98.7	Very high	97.3	Very high	18 Å²	18	44.3 Å²	44.3	11%	0.11	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	138.8	175.1	57.2	0	0	0	0	110.2	L370 D371 Y482 R497 T498	L370-T484 WeakPolarHBondContact CA-O 3.29Å; D371-T484 PolarHBondContact N-O 2.91Å; D371-T484 PolarHBondContact O-N 2.87Å; Y482-T484 HydrophobicContact CE1-CG2 4.47Å; Y482-T484 HydrophobicContact CE2-CG2 4.42Å; Y482-T484 WeakPolarHBondContact OH-CG2 3.2Å; T484-R497 PolarHBondContact O-NH2 3.48Å; T484-R497 PolarHBondContact OG1-NE 2.87Å; T484-R497 PolarHBondContact OG1-NH2 2.84Å; T484-T498 CarbonylContact C-O 3.59Å; T484-T498 WeakPolarHBondContact CA-O 3.1Å
485	G	98.6	Very high	97.4	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	140	174.5	0	0	0	0	0	110.9	T369 R497 T498 W514	T369-G485 CarbonylContact O-C 3.47Å; T369-G485 VanDerWaalsContact O-CA 3.3Å; T369-G485 WeakPolarHBondContact O-CA 3.44Å; G485-R497 CarbonylContact O-C 3.5Å; G485-R497 WeakPolarHBondContact O-CA 3.46Å; G485-T498 PolarHBondContact N-O 2.82Å; G485-T498 PolarHBondContact O-N 3.17Å; G485-T498 PolarHBondContact O-OG1 3.23Å; G485-W514 VanDerWaalsContact CA-CZ3 3.47Å
486	L	98.5	Very high	97.4	Very high	22 Å²	22	45.7 Å²	45.7	12%	0.115	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	127.6	172.1	-171.8	68	0	0	0	109.3	V363 Q367 L368 T369 F492 P495 R497	V363-L486 HydrophobicContact CG1-CD2 4.12Å; Q367-L486 HydrophobicContact CB-CD2 4.18Å; L368-L486 VanDerWaalsContact O-CB 3.25Å; L368-L486 WeakPolarHBondContact O-CB 3.2Å; L368-L486 WeakPolarHBondContact O-CD2 3.47Å; T369-L486 PolarHBondContact O-N 3.11Å; L486-F492 HydrophobicContact CD2-CE2 3.96Å; L486-F492 HydrophobicContact CD2-CZ 4.22Å; L486-P495 HydrophobicContact CD1-CB 4.17Å; L486-R497 HydrophobicContact CD1-CG 4.18Å
487	I	97.9	Very high	97.5	Very high	31 Å²	31	46.6 Å²	46.6	16%	0.159	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	157.3	171.3	65.7	167.3	0	0	0	109.4	P495 E496 T498 W514 L517	I487-P495 WeakPolarHBondContact O-CA 3.37Å; I487-E496 HydrophobicContact CD1-CG 4.09Å; I487-E496 HydrophobicContact CG1-CG 3.71Å; I487-E496 PolarHBondContact N-O 2.85Å; I487-E496 PolarHBondContact O-N 2.83Å; I487-T498 HydrophobicContact CD1-CG2 3.38Å; I487-T498 HydrophobicContact CG1-CG2 3.76Å; I487-W514 HydrophobicContact CG2-CE3 3.97Å; I487-W514 HydrophobicContact CG2-CZ3 3.76Å; I487-L517 HydrophobicContact CG2-CD1 4.06Å
488	A	97.9	Very high	97.5	Very high	17 Å²	17	46.6 Å²	46.6	14%	0.14	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	161.1	173	0	0	0	0	0	110.7	N362 F492 P495	N362-A488 PolarHBondContact ND2-O 3.13Å; N362-A488 WeakPolarHBondContact O-CB 3.32Å; A488-F492 HydrophobicContact CB-CD2 3.75Å; A488-F492 HydrophobicContact CB-CE2 4.31Å; A488-P495 HydrophobicContact CB-CB 4.02Å
489	G	96.5	Very high	97.6	Very high	33 Å²	33	42.4 Å²	42.4	34%	0.34	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	168.4	167	0	0	0	0	0	112.1	G491 F492 T493	G489-G491 PolarHBondContact O-N 3.4Å; G489-F492 PolarHBondContact O-N 3.14Å; G489-F492 VanDerWaalsContact O-N 3.16Å; G489-T493 VanDerWaalsContact C-OG1 3.32Å; G489-T493 WeakPolarHBondContact CA-OG1 3.47Å; G489-T493 PolarHBondContact N-O 3.04Å; G489-T493 PolarHBondContact O-N 2.9Å
490	H	95.2	Very high	97.7	Very high	112 Å²	112	38.1 Å²	38.1	52%	0.519	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	138.8	177.6	-178.6	-81.7	0	0	0	111	N362 T493	N362-H490 PolarHBondContact ND2-N 2.94Å; H490-T493 WeakPolarHBondContact O-CG2 3.11Å; H490-T493 PolarHBondContact O-OG1 3.43Å
491	G	95.4	Very high	97.7	Very high	50 Å²	50	38 Å²	38	52%	0.515	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.7	26.8	-173.4	0	0	0	0	0	113.1	P361 G489 T493	P361-G491 CarbonylContact O-C 3.56Å; P361-G491 WeakPolarHBondContact O-CA 3.15Å; P361-G491 PolarHBondContact O-N 2.91Å; G489-G491 PolarHBondContact O-N 3.4Å; G491-T493 PolarHBondContact O-N 3.33Å
492	F	97.1	Very high	97.7	Very high	32 Å²	32	37.4 Å²	37.4	14%	0.14	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.2	41.5	-176.3	-166.7	-134.2	0	0	0	113.3	P361 N362 P364 Q367 L486 A488 G489 P495	P361-F492 PolarHBondContact O-N 3.22Å; N362-F492 WeakPolarHBondContact O-CA 3.45Å; N362-F492 VanDerWaalsContact O-CD2 3.25Å; N362-F492 WeakPolarHBondContact O-CD2 3.41Å; P364-F492 HydrophobicContact CG-CB 3.91Å; P364-F492 HydrophobicContact CG-CD1 4.38Å; P364-F492 HydrophobicContact CG-CD2 4.42Å; P364-F492 HydrophobicContact CG-CG 4.01Å; Q367-F492 HydrophobicContact CG-CE1 4.27Å; Q367-F492 HydrophobicContact CG-CE2 4.26Å; Q367-F492 HydrophobicContact CG-CZ 3.88Å; L486-F492 HydrophobicContact CD2-CE2 3.96Å; L486-F492 HydrophobicContact CD2-CZ 4.22Å; A488-F492 HydrophobicContact CB-CD2 3.75Å; A488-F492 HydrophobicContact CB-CE2 4.31Å; G489-F492 PolarHBondContact O-N 3.14Å; G489-F492 VanDerWaalsContact O-N 3.16Å; F492-P495 HydrophobicContact CD2-CB 4.12Å; F492-P495 HydrophobicContact CE1-CG 4.46Å; F492-P495 HydrophobicContact CE2-CB 3.57Å; F492-P495 HydrophobicContact CE2-CG 4.19Å; F492-P495 HydrophobicContact CZ-CB 3.89Å; F492-P495 HydrophobicContact CZ-CG 4.09Å
493	T	97.6	Very high	97.7	Very high	77 Å²	77	36.8 Å²	36.8	47%	0.472	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	135.3	-175.7	46.6	0	0	0	0	111.5	G489 H490 G491	G489-T493 VanDerWaalsContact C-OG1 3.32Å; G489-T493 WeakPolarHBondContact CA-OG1 3.47Å; G489-T493 PolarHBondContact N-O 3.04Å; G489-T493 PolarHBondContact O-N 2.9Å; H490-T493 WeakPolarHBondContact O-CG2 3.11Å; H490-T493 PolarHBondContact O-OG1 3.43Å; G491-T493 PolarHBondContact O-N 3.33Å
494	S	97	Very high	97.7	Very high	107 Å²	107	37.1 Å²	37.1	75%	0.748	22%	0.22	S	C	*	.	E	Extended strand (participates in β ladder)	trans	48.4	58.5	-179.6	-56.7	0	0	0	0	113.3	E496	S494-E496 PolarHBondContact O-N 2.64Å
495	P	97.3	Very high	97.6	Very high	66 Å²	66	36.5 Å²	36.5	43%	0.429	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	135.5	-178.6	28.8	-35	0	0	0	111.3	L486 I487 A488 F492	L486-P495 HydrophobicContact CD1-CB 4.17Å; I487-P495 WeakPolarHBondContact O-CA 3.37Å; A488-P495 HydrophobicContact CB-CB 4.02Å; F492-P495 HydrophobicContact CD2-CB 4.12Å; F492-P495 HydrophobicContact CE1-CG 4.46Å; F492-P495 HydrophobicContact CE2-CB 3.57Å; F492-P495 HydrophobicContact CE2-CG 4.19Å; F492-P495 HydrophobicContact CZ-CB 3.89Å; F492-P495 HydrophobicContact CZ-CG 4.09Å
496	E	97.3	Very high	97.5	Very high	111 Å²	111	38 Å²	38	52%	0.519	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	154.9	179.8	68.9	-175	166.2	0	0	112	I487 S494 T498	I487-E496 HydrophobicContact CD1-CG 4.09Å; I487-E496 HydrophobicContact CG1-CG 3.71Å; I487-E496 PolarHBondContact N-O 2.85Å; I487-E496 PolarHBondContact O-N 2.83Å; S494-E496 PolarHBondContact O-N 2.64Å; E496-T498 HydrophobicContact CG-CG2 4.41Å
497	R	97.8	Very high	97.4	Very high	89 Å²	89	41.2 Å²	41.2	34%	0.336	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	121	178.7	-62.1	-159.8	72.8	117.3	18.1	109.7	D371 T484 G485 L486	D371-R497 VanDerWaalsContact CB-CZ 3.46Å; D371-R497 IonicContact OD2-NH1 3.52Å; T484-R497 PolarHBondContact O-NH2 3.48Å; T484-R497 PolarHBondContact OG1-NE 2.87Å; T484-R497 PolarHBondContact OG1-NH2 2.84Å; G485-R497 CarbonylContact O-C 3.5Å; G485-R497 WeakPolarHBondContact O-CA 3.46Å; L486-R497 HydrophobicContact CD1-CG 4.18Å
498	T	98	Very high	97.3	Very high	1 Å²	1	43 Å²	43	1%	0.006	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	142.3	178.3	55.2	0	0	0	0	110.9	T484 G485 I487 E496 E516	T484-T498 CarbonylContact C-O 3.59Å; T484-T498 WeakPolarHBondContact CA-O 3.1Å; G485-T498 PolarHBondContact N-O 2.82Å; G485-T498 PolarHBondContact O-N 3.17Å; G485-T498 PolarHBondContact O-OG1 3.23Å; I487-T498 HydrophobicContact CD1-CG2 3.38Å; I487-T498 HydrophobicContact CG1-CG2 3.76Å; E496-T498 HydrophobicContact CG-CG2 4.41Å; T498-E516 HydrophobicContact CG2-CG 4.37Å; T498-E516 WeakPolarHBondContact CG2-OE1 3.49Å; T498-E516 WeakPolarHBondContact CG2-OE2 3.47Å
499	P	98.3	Very high	97.3	Very high	3 Å²	3	45.7 Å²	45.7	2%	0.019	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	149.4	-179	28.4	-33.7	0	0	0	112.1	I396 L397 H400 Y482	I396-P499 HydrophobicContact CG2-CB 4.06Å; L397-P499 HydrophobicContact CD2-CG 3.8Å; H400-P499 HydrophobicContact CB-CB 4.27Å; Y482-P499 HydrophobicContact CE2-CB 4.12Å
500	G	98.3	Very high	97.4	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.7	177.2	179.5	0	0	0	0	0	113.7	G483 I513	G483-G500 PolarHBondContact N-O 2.92Å; G483-G500 VanDerWaalsContact N-O 3.14Å; G483-G500 PolarHBondContact O-N 3.1Å; G483-G500 VanDerWaalsContact O-O 3.08Å; G500-I513 WeakPolarHBondContact CA-O 3.42Å
501	L	98.6	Very high	97.5	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.005	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	117.9	178.6	-178.5	79.6	0	0	0	109.7	V378 L380 L392 I396 C480 V503 F512 I513	V378-L501 HydrophobicContact CB-CD1 3.83Å; V378-L501 HydrophobicContact CG1-CD1 3.78Å; V378-L501 HydrophobicContact CG2-CD1 3.96Å; L380-L501 HydrophobicContact CD2-CD2 4.03Å; L392-L501 HydrophobicContact CD1-CD1 4.46Å; L392-L501 HydrophobicContact CD1-CD2 4.02Å; L392-L501 HydrophobicContact CD2-CD2 4.19Å; I396-L501 HydrophobicContact CD1-CB 4.39Å; I396-L501 HydrophobicContact CD1-CD1 3.78Å; C480-L501 HydrophobicContact CB-CD1 4.05Å; L501-V503 HydrophobicContact CD2-CG2 3.58Å; L501-V503 HydrophobicContact CG-CG2 3.89Å; L501-F512 CarbonylContact O-C 3.52Å; L501-F512 WeakPolarHBondContact O-CA 3.3Å; L501-I513 HydrophobicContact CB-CB 4.21Å; L501-I513 HydrophobicContact CB-CD1 4.49Å; L501-I513 HydrophobicContact CD2-CD1 3.9Å; L501-I513 PolarHBondContact N-O 2.97Å; L501-I513 VanDerWaalsContact N-O 3.1Å; L501-I513 PolarHBondContact O-N 3.07Å
502	F	98.8	Very high	97.7	Very high	2 Å²	2	36.5 Å²	36.5	1%	0.009	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	133.2	165.5	177.2	-90.4	0	0	0	110.1	L325 V372 C480 F481 L504 F510 F512	L325-F502 HydrophobicContact CD2-CE1 4.29Å; V372-F502 HydrophobicContact CB-CB 4.43Å; V372-F502 HydrophobicContact CB-CG 4.45Å; V372-F502 HydrophobicContact CG1-CB 3.64Å; V372-F502 HydrophobicContact CG1-CD1 4.02Å; V372-F502 HydrophobicContact CG1-CD2 4.33Å; V372-F502 HydrophobicContact CG1-CG 3.76Å; V372-F502 HydrophobicContact CG2-CB 3.87Å; V372-F502 HydrophobicContact CG2-CD2 3.6Å; V372-F502 HydrophobicContact CG2-CE2 4.31Å; V372-F502 HydrophobicContact CG2-CG 3.84Å; C480-F502 VanDerWaalsContact CA-O 3.25Å; C480-F502 WeakPolarHBondContact CA-O 3.36Å; F481-F502 HydrophobicContact CB-CB 4.44Å; F481-F502 HydrophobicContact CB-CD1 4.39Å; F481-F502 HydrophobicContact CD2-CD1 4.03Å; F481-F502 HydrophobicContact CD2-CE1 4.41Å; F481-F502 PolarHBondContact N-O 3.28Å; F481-F502 PolarHBondContact O-N 3.29Å; F502-L504 HydrophobicContact CE1-CB 4.03Å; F502-F510 HydrophobicContact CD2-CD2 4.01Å; F502-F510 HydrophobicContact CE2-CB 3.84Å; F502-F510 HydrophobicContact CE2-CD1 4.43Å; F502-F510 AromaticContact CE2-CD2 3.33Å; F502-F510 HydrophobicContact CE2-CD2 3.33Å; F502-F510 AromaticContact CE2-CE2 3.92Å; F502-F510 HydrophobicContact CE2-CE2 3.92Å; F502-F510 AromaticContact CE2-CG 3.63Å; F502-F510 HydrophobicContact CE2-CG 3.63Å; F502-F510 HydrophobicContact CZ-CB 3.72Å; F502-F510 HydrophobicContact CZ-CD2 4.09Å; F502-F510 AromaticContact CZ-CG 3.91Å; F502-F510 HydrophobicContact CZ-CG 3.91Å; F502-F512 HydrophobicContact CB-CD2 4.22Å
503	V	98.5	Very high	97.8	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	114.7	-177.5	-175.2	0	0	0	0	109.3	F460 C477 L501 F505 F510 G511	F460-V503 HydrophobicContact CD2-CG1 4.13Å; F460-V503 HydrophobicContact CE2-CG1 3.94Å; F460-V503 HydrophobicContact CE2-CG2 3.85Å; F460-V503 HydrophobicContact CZ-CG1 4.15Å; F460-V503 HydrophobicContact CZ-CG2 4.01Å; C477-V503 HydrophobicContact CB-CG1 3.52Å; L501-V503 HydrophobicContact CD2-CG2 3.58Å; L501-V503 HydrophobicContact CG-CG2 3.89Å; V503-F505 HydrophobicContact CB-CZ 4.28Å; V503-F505 HydrophobicContact CG1-CD1 4.06Å; V503-F505 HydrophobicContact CG1-CE1 3.59Å; V503-F505 HydrophobicContact CG1-CE2 4.4Å; V503-F505 HydrophobicContact CG1-CZ 3.78Å; V503-F510 CarbonylContact O-C 3.55Å; V503-F510 WeakPolarHBondContact O-CA 3.21Å; V503-F510 WeakPolarHBondContact O-CB 3.14Å; V503-G511 PolarHBondContact N-O 2.66Å; V503-G511 PolarHBondContact O-N 3.4Å
504	L	98.3	Very high	97.8	Very high	8 Å²	8	31.9 Å²	31.9	4%	0.042	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	116	173.8	-178.4	61.4	0	0	0	110	L325 L326 C477 R478 K479 F502 D506 F510	L325-L504 HydrophobicContact CD1-CD2 4.05Å; L325-L504 HydrophobicContact CD2-CD2 4Å; L325-L504 HydrophobicContact CG-CD2 3.88Å; L326-L504 HydrophobicContact CD2-CD1 3.75Å; C477-L504 CarbonylContact C-O 3.54Å; C477-L504 WeakPolarHBondContact CA-O 3.35Å; C477-L504 WeakPolarHBondContact CB-O 3.02Å; R478-L504 PolarHBondContact N-O 3.23Å; K479-L504 WeakPolarHBondContact O-CB 3.15Å; K479-L504 PolarHBondContact O-N 3.33Å; F502-L504 HydrophobicContact CE1-CB 4.03Å; L504-D506 WeakPolarHBondContact CD1-O 3.23Å; L504-F510 HydrophobicContact CD1-CB 4.36Å
505	F	97.8	Very high	97.7	Very high	5 Å²	5	27.4 Å²	27.4	2%	0.022	13%	0.131	C	C	.	.			trans	-86.7	-51.8	178	-61.9	-65.6	0	0	0	111.6	F460 P474 T476 C477 V503 R509 F520 L522	F460-F505 AromaticContact CD1-CE1 3.57Å; F460-F505 HydrophobicContact CD1-CE1 3.57Å; F460-F505 HydrophobicContact CD1-CZ 4.12Å; F460-F505 AromaticContact CE1-CE1 3.79Å; F460-F505 HydrophobicContact CE1-CE1 3.79Å; F460-F505 AromaticContact CE1-CZ 3.84Å; F460-F505 HydrophobicContact CE1-CZ 3.84Å; F460-F505 HydrophobicContact CG-CE1 4.17Å; F460-F505 HydrophobicContact CZ-CZ 4.49Å; P474-F505 HydrophobicContact CB-CB 3.94Å; P474-F505 HydrophobicContact CB-CD1 3.7Å; P474-F505 HydrophobicContact CB-CE1 4.33Å; P474-F505 HydrophobicContact CB-CG 3.82Å; P474-F505 HydrophobicContact CG-CB 3.91Å; P474-F505 HydrophobicContact CG-CD1 4.16Å; P474-F505 HydrophobicContact CG-CD2 4.14Å; P474-F505 HydrophobicContact CG-CG 3.81Å; T476-F505 WeakPolarHBondContact O-CD1 3.32Å; C477-F505 HydrophobicContact CB-CD1 4.01Å; C477-F505 HydrophobicContact CB-CE1 4.35Å; V503-F505 HydrophobicContact CB-CZ 4.28Å; V503-F505 HydrophobicContact CG1-CD1 4.06Å; V503-F505 HydrophobicContact CG1-CE1 3.59Å; V503-F505 HydrophobicContact CG1-CE2 4.4Å; V503-F505 HydrophobicContact CG1-CZ 3.78Å; F505-R509 HydrophobicContact CB-CB 4.23Å; F505-R509 WeakPolarHBondContact CB-O 3.47Å; F505-R509 HydrophobicContact CD2-CB 4.38Å; F505-R509 PolarHBondContact N-O 2.65Å; F505-F520 AromaticContact CE2-CZ 3.95Å; F505-F520 HydrophobicContact CE2-CZ 3.95Å; F505-F520 HydrophobicContact CZ-CE2 4.48Å; F505-F520 AromaticContact CZ-CZ 3.85Å; F505-F520 HydrophobicContact CZ-CZ 3.85Å; F505-L522 HydrophobicContact CD2-CD1 4.12Å; F505-L522 HydrophobicContact CE2-CD1 3.71Å
506	D	96.1	Very high	97.6	Very high	30 Å²	30	29.8 Å²	29.8	16%	0.16	14%	0.136	C	C	.	.	S	Bend	trans	-157.6	-166.9	-178.8	55	52.2	0	0	0	110.7	L504 D508 R509	L504-D506 WeakPolarHBondContact CD1-O 3.23Å; D506-D508 PolarHBondContact O-N 3.47Å; D506-D508 PolarHBondContact OD1-N 3.23Å; D506-R509 PolarHBondContact N-O 2.96Å; D506-R509 WeakPolarHBondContact OD1-CB 3.48Å; D506-R509 PolarHBondContact OD1-N 2.84Å; D506-R509 IonicContact OD1-NE 3.65Å; D506-R509 IonicContact OD2-CZ 3.16Å; D506-R509 IonicContact OD2-NE 2.8Å; D506-R509 PolarHBondContact OD2-NE 3.26Å; D506-R509 IonicContact OD2-NH2 2.68Å; D506-R509 PolarHBondContact OD2-NH2 2.98Å
507	E	95	Very high	97.6	Very high	90 Å²	90	29 Å²	29	42%	0.421	14%	0.135	S	C	.	.	S	Bend	trans	-63.3	-23.8	-178	-60.4	-57.3	149.3	0	0	113.7	R478 R525	R478-E507 IonicContact CZ-OE1 2.78Å; R478-E507 IonicContact NH1-OE1 3.54Å; R478-E507 PolarHBondContact NH1-OE1 3.31Å; E507-R525 PolarHBondContact O-NH2 2.81Å
508	D	96.2	Very high	97.5	Very high	70 Å²	70	30 Å²	30	37%	0.374	14%	0.141	S	C	.	.	S	Bend	trans	-120.3	-6.5	-169.4	-65.6	-37.2	0	0	0	113.1	F331 D506 S524 R525	F331-D508 WeakPolarHBondContact CE1-O 3.29Å; D506-D508 PolarHBondContact O-N 3.47Å; D506-D508 PolarHBondContact OD1-N 3.23Å; D508-S524 CarbonylContact O-C 3.58Å; D508-S524 WeakPolarHBondContact O-CA 3.44Å; D508-R525 HydrophobicContact CB-CB 3.92Å; D508-R525 PolarHBondContact O-N 3.14Å; D508-R525 WeakPolarHBondContact OD1-CD 3.33Å; D508-R525 IonicContact OD1-CZ 3.32Å; D508-R525 IonicContact OD1-NE 3.37Å; D508-R525 PolarHBondContact OD1-NE 3.04Å; D508-R525 IonicContact OD1-NH2 3.65Å
509	R	97.8	Very high	97.5	Very high	73 Å²	73	31.4 Å²	31.4	28%	0.275	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	134.1	-176	-62.9	178.6	-67.3	-166.3	-4	112.6	E209 F505 D506 Y523	E209-R509 WeakPolarHBondContact OE1-CD 3.2Å; E209-R509 IonicContact OE1-CZ 3.65Å; E209-R509 IonicContact OE1-NE 3.77Å; E209-R509 IonicContact OE1-NH1 2.74Å; E209-R509 PolarHBondContact OE1-NH1 2.78Å; E209-R509 IonicContact OE2-NH1 3.85Å; F505-R509 HydrophobicContact CB-CB 4.23Å; F505-R509 WeakPolarHBondContact CB-O 3.47Å; F505-R509 HydrophobicContact CD2-CB 4.38Å; F505-R509 PolarHBondContact N-O 2.65Å; D506-R509 PolarHBondContact N-O 2.96Å; D506-R509 WeakPolarHBondContact OD1-CB 3.48Å; D506-R509 PolarHBondContact OD1-N 2.84Å; D506-R509 IonicContact OD1-NE 3.65Å; D506-R509 IonicContact OD2-CZ 3.16Å; D506-R509 IonicContact OD2-NE 2.8Å; D506-R509 PolarHBondContact OD2-NE 3.26Å; D506-R509 IonicContact OD2-NH2 2.68Å; D506-R509 PolarHBondContact OD2-NH2 2.98Å; R509-Y523 VanDerWaalsContact CA-O 3.3Å; R509-Y523 WeakPolarHBondContact CA-O 3.48Å
510	F	98.6	Very high	97.5	Very high	1 Å²	1	31.4 Å²	31.4	0%	0.004	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	167.3	169.9	68.4	-95.7	0	0	0	110.2	F331 L345 L370 F502 V503 L504 Y523	F331-F510 HydrophobicContact CB-CE1 4.24Å; F331-F510 AromaticContact CD1-CD1 3.92Å; F331-F510 HydrophobicContact CD1-CD1 3.92Å; F331-F510 AromaticContact CD1-CE1 3.49Å; F331-F510 HydrophobicContact CD1-CE1 3.49Å; F331-F510 VanDerWaalsContact CD1-CE1 3.49Å; F331-F510 AromaticContact CD2-CE1 3.96Å; F331-F510 HydrophobicContact CD2-CE1 3.96Å; F331-F510 AromaticContact CE1-CD1 3.82Å; F331-F510 HydrophobicContact CE1-CD1 3.82Å; F331-F510 AromaticContact CE1-CE1 3.72Å; F331-F510 HydrophobicContact CE1-CE1 3.72Å; F331-F510 HydrophobicContact CE2-CE1 4.18Å; F331-F510 HydrophobicContact CG-CD1 4.5Å; F331-F510 AromaticContact CG-CE1 3.63Å; F331-F510 HydrophobicContact CG-CE1 3.63Å; F331-F510 HydrophobicContact CG-CZ 4.36Å; F331-F510 HydrophobicContact CZ-CD1 4.31Å; F331-F510 HydrophobicContact CZ-CE1 4.06Å; L345-F510 HydrophobicContact CD2-CD1 4.43Å; L345-F510 HydrophobicContact CD2-CE1 4.05Å; L370-F510 HydrophobicContact CD1-CE2 4.24Å; F502-F510 HydrophobicContact CD2-CD2 4.01Å; F502-F510 HydrophobicContact CE2-CB 3.84Å; F502-F510 HydrophobicContact CE2-CD1 4.43Å; F502-F510 AromaticContact CE2-CD2 3.33Å; F502-F510 HydrophobicContact CE2-CD2 3.33Å; F502-F510 AromaticContact CE2-CE2 3.92Å; F502-F510 HydrophobicContact CE2-CE2 3.92Å; F502-F510 AromaticContact CE2-CG 3.63Å; F502-F510 HydrophobicContact CE2-CG 3.63Å; F502-F510 HydrophobicContact CZ-CB 3.72Å; F502-F510 HydrophobicContact CZ-CD2 4.09Å; F502-F510 AromaticContact CZ-CG 3.91Å; F502-F510 HydrophobicContact CZ-CG 3.91Å; V503-F510 CarbonylContact O-C 3.55Å; V503-F510 WeakPolarHBondContact O-CA 3.21Å; V503-F510 WeakPolarHBondContact O-CB 3.14Å; L504-F510 HydrophobicContact CD1-CB 4.36Å; F510-Y523 AromaticContact CD2-CD2 3.54Å; F510-Y523 HydrophobicContact CD2-CD2 3.54Å; F510-Y523 HydrophobicContact CD2-CE2 4.32Å; F510-Y523 AromaticContact CD2-CG 3.88Å; F510-Y523 HydrophobicContact CD2-CG 3.88Å; F510-Y523 HydrophobicContact CE1-CG 4.2Å; F510-Y523 AromaticContact CE2-CD1 3.92Å; F510-Y523 HydrophobicContact CE2-CD1 3.92Å; F510-Y523 AromaticContact CE2-CD2 3.17Å; F510-Y523 HydrophobicContact CE2-CD2 3.17Å; F510-Y523 HydrophobicContact CE2-CE1 4.42Å; F510-Y523 AromaticContact CE2-CE2 3.75Å; F510-Y523 HydrophobicContact CE2-CE2 3.75Å; F510-Y523 AromaticContact CE2-CG 3.27Å; F510-Y523 HydrophobicContact CE2-CG 3.27Å; F510-Y523 HydrophobicContact CG-CD2 4.5Å; F510-Y523 VanDerWaalsContact CZ-CB 3.47Å; F510-Y523 AromaticContact CZ-CD1 3.82Å; F510-Y523 HydrophobicContact CZ-CD1 3.82Å; F510-Y523 AromaticContact CZ-CD2 3.89Å; F510-Y523 HydrophobicContact CZ-CD2 3.89Å; F510-Y523 AromaticContact CZ-CG 3.45Å; F510-Y523 HydrophobicContact CZ-CG 3.45Å; F510-Y523 VanDerWaalsContact CZ-CG 3.45Å; F510-Y523 PolarHBondContact N-O 3.32Å; F510-Y523 WeakPolarHBondContact O-CA 3.44Å; F510-Y523 WeakPolarHBondContact O-CB 3.26Å; F510-Y523 PolarHBondContact O-N 2.9Å
511	G	98.4	Very high	97.5	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	163.3	175.9	0	0	0	0	0	112	V503 S521	V503-G511 PolarHBondContact N-O 2.66Å; V503-G511 PolarHBondContact O-N 3.4Å; G511-S521 CarbonylContact C-O 3.57Å; G511-S521 WeakPolarHBondContact CA-O 3.37Å
512	F	98.8	Very high	97.5	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	125.6	173.2	-168.5	-95.8	0	0	0	110.2	L370 L501 F502 W514 F520 S521 Y523	L370-F512 HydrophobicContact CD1-CB 4.05Å; L370-F512 HydrophobicContact CD1-CD2 4.3Å; L370-F512 HydrophobicContact CD1-CG 4.19Å; L370-F512 HydrophobicContact CD2-CB 4.19Å; L370-F512 HydrophobicContact CD2-CD1 3.6Å; L370-F512 HydrophobicContact CD2-CD2 3.84Å; L370-F512 HydrophobicContact CD2-CE1 3.82Å; L370-F512 HydrophobicContact CD2-CE2 4.06Å; L370-F512 HydrophobicContact CD2-CG 3.59Å; L370-F512 HydrophobicContact CD2-CZ 4.04Å; L501-F512 CarbonylContact O-C 3.52Å; L501-F512 WeakPolarHBondContact O-CA 3.3Å; F502-F512 HydrophobicContact CB-CD2 4.22Å; F512-W514 AromaticContact CD1-CD1 3.95Å; F512-W514 AromaticContact CD1-CD2 3.74Å; F512-W514 HydrophobicContact CD1-CD2 3.74Å; F512-W514 AromaticContact CD1-CE2 3.65Å; F512-W514 HydrophobicContact CD1-CE3 4.33Å; F512-W514 AromaticContact CD1-CG 3.93Å; F512-W514 HydrophobicContact CD1-CG 3.93Å; F512-W514 HydrophobicContact CD1-CZ2 4.15Å; F512-W514 AromaticContact CD1-NE1 3.79Å; F512-W514 AromaticContact CE1-CD2 3.84Å; F512-W514 HydrophobicContact CE1-CD2 3.84Å; F512-W514 HydrophobicContact CE1-CE3 4.01Å; F512-W514 HydrophobicContact CE1-CG 4.18Å; F512-W514 HydrophobicContact CE1-CZ3 4.46Å; F512-F520 WeakPolarHBondContact O-CA 3.49Å; F512-F520 WeakPolarHBondContact O-CD2 3.3Å; F512-S521 PolarHBondContact N-O 2.74Å; F512-S521 PolarHBondContact O-N 3.24Å; F512-Y523 HydrophobicContact CB-CE2 4.23Å
513	I	98.5	Very high	97.5	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.005	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	115.6	173.3	-56.2	176.6	0	0	0	108.4	L392 F460 L462 V466 G500 L501 L515 F520	L392-I513 HydrophobicContact CD2-CD1 3.81Å; L392-I513 HydrophobicContact CD2-CG2 4.49Å; F460-I513 HydrophobicContact CZ-CD1 4.25Å; L462-I513 HydrophobicContact CD2-CD1 3.95Å; L462-I513 HydrophobicContact CD2-CG1 4.1Å; V466-I513 HydrophobicContact CG1-CG2 4.42Å; V466-I513 HydrophobicContact CG2-CG2 4.49Å; G500-I513 WeakPolarHBondContact CA-O 3.42Å; L501-I513 HydrophobicContact CB-CB 4.21Å; L501-I513 HydrophobicContact CB-CD1 4.49Å; L501-I513 HydrophobicContact CD2-CD1 3.9Å; L501-I513 PolarHBondContact N-O 2.97Å; L501-I513 VanDerWaalsContact N-O 3.1Å; L501-I513 PolarHBondContact O-N 3.07Å; I513-L515 HydrophobicContact CG2-CD2 4.33Å; I513-L515 PolarHBondContact O-N 2.86Å; I513-F520 HydrophobicContact CG1-CD2 3.76Å; I513-F520 HydrophobicContact CG1-CE2 4.31Å
514	W	98.3	Very high	97.5	Very high	11 Å²	11	32 Å²	32	4%	0.042	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	105.1	173.8	-52.9	82	0	0	0	108.5	Y335 L370 G485 I487 F512 L517 K518 S519 S521	Y335-W514 HydrophobicContact CE1-CZ2 4.3Å; L370-W514 HydrophobicContact CD2-CH2 3.83Å; L370-W514 HydrophobicContact CD2-CZ2 3.81Å; G485-W514 VanDerWaalsContact CA-CZ3 3.47Å; I487-W514 HydrophobicContact CG2-CE3 3.97Å; I487-W514 HydrophobicContact CG2-CZ3 3.76Å; F512-W514 AromaticContact CD1-CD1 3.95Å; F512-W514 AromaticContact CD1-CD2 3.74Å; F512-W514 HydrophobicContact CD1-CD2 3.74Å; F512-W514 AromaticContact CD1-CE2 3.65Å; F512-W514 HydrophobicContact CD1-CE3 4.33Å; F512-W514 AromaticContact CD1-CG 3.93Å; F512-W514 HydrophobicContact CD1-CG 3.93Å; F512-W514 HydrophobicContact CD1-CZ2 4.15Å; F512-W514 AromaticContact CD1-NE1 3.79Å; F512-W514 AromaticContact CE1-CD2 3.84Å; F512-W514 HydrophobicContact CE1-CD2 3.84Å; F512-W514 HydrophobicContact CE1-CE3 4.01Å; F512-W514 HydrophobicContact CE1-CG 4.18Å; F512-W514 HydrophobicContact CE1-CZ3 4.46Å; W514-L517 HydrophobicContact CB-CB 3.98Å; W514-L517 HydrophobicContact CB-CD1 4.24Å; W514-L517 HydrophobicContact CB-CG 4.3Å; W514-L517 HydrophobicContact CD2-CD1 4.48Å; W514-L517 HydrophobicContact CE3-CD1 4.32Å; W514-L517 HydrophobicContact CG-CD1 4.48Å; W514-K518 WeakPolarHBondContact O-CA 3.25Å; W514-K518 PolarHBondContact O-N 3.41Å; W514-S519 PolarHBondContact N-O 3.36Å; W514-S519 PolarHBondContact O-N 3.46Å; W514-S519 VanDerWaalsContact O-N 3.15Å; W514-S521 PolarHBondContact NE1-OG 2.73Å
515	L	96.1	Very high	97.5	Very high	14 Å²	14	32.6 Å²	32.6	7%	0.073	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-50.8	-170.8	-70	176	0	0	0	112.5	L392 I396 I513 L517 K518	L392-L515 HydrophobicContact CD2-CD2 4.35Å; L392-L515 HydrophobicContact CG-CD2 4.36Å; I396-L515 HydrophobicContact CB-CD1 3.56Å; I396-L515 HydrophobicContact CG1-CD1 4.16Å; I396-L515 HydrophobicContact CG2-CD1 3.34Å; I513-L515 HydrophobicContact CG2-CD2 4.33Å; I513-L515 PolarHBondContact O-N 2.86Å; L515-L517 VanDerWaalsContact C-N 3.29Å; L515-L517 PolarHBondContact O-N 2.89Å; L515-K518 PolarHBondContact O-N 3.27Å; L515-K518 VanDerWaalsContact O-N 3.14Å
516	E	94.9	Very high	97.5	Very high	116 Å²	116	33 Å²	33	54%	0.542	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-36.3	-177.7	-66.5	-177.5	-155.8	0	0	112.4	T498 K518	T498-E516 HydrophobicContact CG2-CG 4.37Å; T498-E516 WeakPolarHBondContact CG2-OE1 3.49Å; T498-E516 WeakPolarHBondContact CG2-OE2 3.47Å; E516-K518 VanDerWaalsContact C-N 3.32Å
517	L	95.8	Very high	97.3	Very high	94 Å²	94	36.8 Å²	36.8	49%	0.492	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-9.3	179.5	-55.5	-176.2	0	0	0	113.3	I487 W514 L515 S519	I487-L517 HydrophobicContact CG2-CD1 4.06Å; W514-L517 HydrophobicContact CB-CB 3.98Å; W514-L517 HydrophobicContact CB-CD1 4.24Å; W514-L517 HydrophobicContact CB-CG 4.3Å; W514-L517 HydrophobicContact CD2-CD1 4.48Å; W514-L517 HydrophobicContact CE3-CD1 4.32Å; W514-L517 HydrophobicContact CG-CD1 4.48Å; L515-L517 VanDerWaalsContact C-N 3.29Å; L515-L517 PolarHBondContact O-N 2.89Å; L517-S519 PolarHBondContact O-N 2.72Å
518	K	96.9	Very high	97.3	Very high	110 Å²	110	34.2 Å²	34.2	48%	0.478	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	45.1	49.3	-168.9	-55	-171.8	178.1	-177.8	0	111.3	I389 V466 M467 W514 L515 E516	I389-K518 HydrophobicContact CD1-CB 4.19Å; I389-K518 HydrophobicContact CD1-CD 4.1Å; I389-K518 HydrophobicContact CD1-CG 3.75Å; V466-K518 CarbonylContact C-O 3.58Å; V466-K518 WeakPolarHBondContact CA-O 3.45Å; M467-K518 PolarHBondContact N-O 3.23Å; W514-K518 WeakPolarHBondContact O-CA 3.25Å; W514-K518 PolarHBondContact O-N 3.41Å; L515-K518 PolarHBondContact O-N 3.27Å; L515-K518 VanDerWaalsContact O-N 3.14Å; E516-K518 VanDerWaalsContact C-N 3.32Å
519	S	97.3	Very high	97.1	Very high	30 Å²	30	37.3 Å²	37.3	21%	0.21	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	151.5	-173	-175.4	0	0	0	0	111	M467 W514 L517	M467-S519 CarbonylContact O-C 3.59Å; M467-S519 WeakPolarHBondContact O-CA 3.04Å; W514-S519 PolarHBondContact N-O 3.36Å; W514-S519 PolarHBondContact O-N 3.46Å; W514-S519 VanDerWaalsContact O-N 3.15Å; L517-S519 PolarHBondContact O-N 2.72Å
520	F	98.4	Very high	96.9	Very high	4 Å²	4	34.3 Å²	34.3	2%	0.018	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	126	176	177.1	-113.1	0	0	0	111	L462 V466 M467 A468 Y473 F505 F512 I513 L522	L462-F520 HydrophobicContact CD1-CB 4.06Å; L462-F520 HydrophobicContact CD1-CD1 3.67Å; L462-F520 HydrophobicContact CD1-CE1 4.25Å; L462-F520 HydrophobicContact CD1-CG 3.87Å; L462-F520 HydrophobicContact CD2-CB 4.02Å; L462-F520 HydrophobicContact CD2-CD1 4.11Å; L462-F520 HydrophobicContact CD2-CD2 3.61Å; L462-F520 HydrophobicContact CD2-CE1 4.48Å; L462-F520 HydrophobicContact CD2-CE2 4.02Å; L462-F520 HydrophobicContact CD2-CG 3.64Å; L462-F520 HydrophobicContact CD2-CZ 4.43Å; L462-F520 HydrophobicContact CG-CD1 4.48Å; L462-F520 HydrophobicContact CG-CG 4.42Å; V466-F520 HydrophobicContact CG1-CB 3.76Å; M467-F520 PolarHBondContact O-N 3.11Å; A468-F520 HydrophobicContact CB-CB 4.2Å; A468-F520 HydrophobicContact CB-CD1 4Å; Y473-F520 HydrophobicContact CG-CE1 4.49Å; F505-F520 AromaticContact CE2-CZ 3.95Å; F505-F520 HydrophobicContact CE2-CZ 3.95Å; F505-F520 HydrophobicContact CZ-CE2 4.48Å; F505-F520 AromaticContact CZ-CZ 3.85Å; F505-F520 HydrophobicContact CZ-CZ 3.85Å; F512-F520 WeakPolarHBondContact O-CA 3.49Å; F512-F520 WeakPolarHBondContact O-CD2 3.3Å; I513-F520 HydrophobicContact CG1-CD2 3.76Å; I513-F520 HydrophobicContact CG1-CE2 4.31Å; F520-L522 HydrophobicContact CE1-CB 3.89Å; F520-L522 HydrophobicContact CE1-CD1 4.26Å; F520-L522 HydrophobicContact CZ-CB 4.4Å; F520-L522 HydrophobicContact CZ-CD1 4.21Å
521	S	98.5	Very high	96.6	Very high	3 Å²	3	36.1 Å²	36.1	2%	0.021	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	124.5	170.8	-68.1	0	0	0	0	110.4	T334 G511 F512 W514 Y523	T334-S521 VanDerWaalsContact O-CB 3.3Å; T334-S521 WeakPolarHBondContact O-CB 3.37Å; T334-S521 PolarHBondContact O-OG 2.99Å; T334-S521 WeakPolarHBondContact OG1-CA 3.25Å; G511-S521 CarbonylContact C-O 3.57Å; G511-S521 WeakPolarHBondContact CA-O 3.37Å; F512-S521 PolarHBondContact N-O 2.74Å; F512-S521 PolarHBondContact O-N 3.24Å; W514-S521 PolarHBondContact NE1-OG 2.73Å; S521-Y523 VanDerWaalsContact CB-CE2 3.44Å
522	L	98.7	Very high	96.3	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.005	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	138	172.3	-177.3	63.4	0	0	0	109.6	V208 G333 T334 N470 F505 F520	V208-L522 HydrophobicContact CG1-CD2 3.75Å; V208-L522 HydrophobicContact CG1-CG 3.98Å; G333-L522 VanDerWaalsContact CA-O 3.32Å; G333-L522 WeakPolarHBondContact CA-O 3.14Å; T334-L522 PolarHBondContact N-O 3.02Å; T334-L522 VanDerWaalsContact N-O 3.14Å; T334-L522 PolarHBondContact OG1-N 3.33Å; N470-L522 HydrophobicContact CB-CD2 4.01Å; F505-L522 HydrophobicContact CD2-CD1 4.12Å; F505-L522 HydrophobicContact CE2-CD1 3.71Å; F520-L522 HydrophobicContact CE1-CB 3.89Å; F520-L522 HydrophobicContact CE1-CD1 4.26Å; F520-L522 HydrophobicContact CZ-CB 4.4Å; F520-L522 HydrophobicContact CZ-CD1 4.21Å
523	Y	98.6	Very high	96.1	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	138.1	-179.9	-59.8	-96.6	0	0	0	111.4	K332 Y335 V343 L370 R509 F510 F512 S521	K332-Y523 CarbonylContact O-C 3.58Å; K332-Y523 WeakPolarHBondContact O-CA 3.33Å; Y335-Y523 AromaticContact CE2-CE1 3.88Å; Y335-Y523 HydrophobicContact CE2-CE1 3.88Å; Y335-Y523 VanDerWaalsContact CZ-OH 3.29Å; Y335-Y523 PolarHBondContact OH-OH 3.24Å; V343-Y523 HydrophobicContact CG1-CE1 4.12Å; V343-Y523 HydrophobicContact CG2-CD1 3.58Å; V343-Y523 HydrophobicContact CG2-CE1 3.69Å; L370-Y523 HydrophobicContact CD1-CE2 4.05Å; R509-Y523 VanDerWaalsContact CA-O 3.3Å; R509-Y523 WeakPolarHBondContact CA-O 3.48Å; F510-Y523 AromaticContact CD2-CD2 3.54Å; F510-Y523 HydrophobicContact CD2-CD2 3.54Å; F510-Y523 HydrophobicContact CD2-CE2 4.32Å; F510-Y523 AromaticContact CD2-CG 3.88Å; F510-Y523 HydrophobicContact CD2-CG 3.88Å; F510-Y523 HydrophobicContact CE1-CG 4.2Å; F510-Y523 AromaticContact CE2-CD1 3.92Å; F510-Y523 HydrophobicContact CE2-CD1 3.92Å; F510-Y523 AromaticContact CE2-CD2 3.17Å; F510-Y523 HydrophobicContact CE2-CD2 3.17Å; F510-Y523 HydrophobicContact CE2-CE1 4.42Å; F510-Y523 AromaticContact CE2-CE2 3.75Å; F510-Y523 HydrophobicContact CE2-CE2 3.75Å; F510-Y523 AromaticContact CE2-CG 3.27Å; F510-Y523 HydrophobicContact CE2-CG 3.27Å; F510-Y523 HydrophobicContact CG-CD2 4.5Å; F510-Y523 VanDerWaalsContact CZ-CB 3.47Å; F510-Y523 AromaticContact CZ-CD1 3.82Å; F510-Y523 HydrophobicContact CZ-CD1 3.82Å; F510-Y523 AromaticContact CZ-CD2 3.89Å; F510-Y523 HydrophobicContact CZ-CD2 3.89Å; F510-Y523 AromaticContact CZ-CG 3.45Å; F510-Y523 HydrophobicContact CZ-CG 3.45Å; F510-Y523 VanDerWaalsContact CZ-CG 3.45Å; F510-Y523 PolarHBondContact N-O 3.32Å; F510-Y523 WeakPolarHBondContact O-CA 3.44Å; F510-Y523 WeakPolarHBondContact O-CB 3.26Å; F510-Y523 PolarHBondContact O-N 2.9Å; F512-Y523 HydrophobicContact CB-CE2 4.23Å; S521-Y523 VanDerWaalsContact CB-CE2 3.44Å
524	S	98.3	Very high	95.9	Very high	12 Å²	12	46.1 Å²	46.1	8%	0.084	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	135.1	177.8	178	0	0	0	0	111.9	V208 F331 K332 D508	V208-S524 WeakPolarHBondContact O-CB 3.35Å; F331-S524 WeakPolarHBondContact CA-O 3.44Å; K332-S524 PolarHBondContact N-O 2.87Å; K332-S524 PolarHBondContact NZ-O 3.06Å; K332-S524 PolarHBondContact O-N 3.16Å; D508-S524 CarbonylContact O-C 3.58Å; D508-S524 WeakPolarHBondContact O-CA 3.44Å
525	R	98.4	Very high	95.7	Very high	19 Å²	19	46.5 Å²	46.5	7%	0.072	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	137.2	-172.5	-176.2	-179.8	-59.9	-78.5	0.2	112.5	Q327 F331 K332 E507 D508	Q327-R525 PolarHBondContact O-NH1 3.19Å; Q327-R525 PolarHBondContact O-NH2 2.82Å; F331-R525 HydrophobicContact CD1-CB 4.08Å; F331-R525 HydrophobicContact CE1-CB 3.78Å; F331-R525 HydrophobicContact CE1-CG 4.47Å; F331-R525 HydrophobicContact CZ-CB 4.24Å; F331-R525 HydrophobicContact CZ-CG 4.48Å; K332-R525 VanDerWaalsContact NZ-C 3.3Å; K332-R525 PolarHBondContact NZ-O 2.74Å; E507-R525 PolarHBondContact O-NH2 2.81Å; D508-R525 HydrophobicContact CB-CB 3.92Å; D508-R525 PolarHBondContact O-N 3.14Å; D508-R525 WeakPolarHBondContact OD1-CD 3.33Å; D508-R525 IonicContact OD1-CZ 3.32Å; D508-R525 IonicContact OD1-NE 3.37Å; D508-R525 PolarHBondContact OD1-NE 3.04Å; D508-R525 IonicContact OD1-NH2 3.65Å
526	L	97.1	Very high	95.4	Very high	13 Å²	13	49.1 Å²	49.1	7%	0.068	26%	0.256	C	S	.	.			trans	-78.9	119.4	164.2	-179.9	161	0	0	0	109.2	L185 M212 L330 D528 L530	L185-L526 HydrophobicContact CD2-CD1 4.08Å; M212-L526 HydrophobicContact CE-CD1 3.91Å; M212-L526 HydrophobicContact CG-CD1 3.57Å; M212-L526 HydrophobicContact CG-CG 3.71Å; M212-L526 HydrophobicContact SD-CD1 3.84Å; M212-L526 HydrophobicContact SD-CG 4.38Å; L330-L526 HydrophobicContact CB-CB 4.01Å; L330-L526 HydrophobicContact CB-CD1 4.2Å; L330-L526 HydrophobicContact CD1-CD1 4.29Å; L330-L526 WeakPolarHBondContact O-CB 3.16Å; L330-L526 PolarHBondContact O-N 3.25Å; L526-D528 HydrophobicContact CD2-CB 3.81Å; L526-L530 HydrophobicContact CD2-CD1 4.16Å
527	T	93.5	Very high	95.4	Very high	110 Å²	110	45.3 Å²	45.3	68%	0.675	24%	0.242	S	C	*	.			trans	-101.9	-4.8	-172.8	53.2	0	0	0	0	113.9	H529	T527-H529 PolarHBondContact O-N 2.8Å
528	D	93.3	Very high	95.3	Very high	36 Å²	36	43.8 Å²	43.8	19%	0.193	23%	0.233	C	C	.	.			trans	-57.9	137.2	174.9	-67.4	-107.1	0	0	0	111.9	Y200 R214 L526 L530	Y200-D528 HydrophobicContact CE1-CB 3.71Å; R214-D528 IonicContact CZ-OD1 3.8Å; R214-D528 IonicContact NE-OD1 2.76Å; R214-D528 IonicContact NH1-OD1 3.97Å; L526-D528 HydrophobicContact CD2-CB 3.81Å; D528-L530 PolarHBondContact O-N 3.2Å
529	H	92.2	Very high	95.2	Very high	135 Å²	135	45.2 Å²	45.2	63%	0.625	24%	0.242	S	C	*	.			trans	-72.9	124.8	171.2	-176.8	59.5	0	0	0	110.1	T527 P531	T527-H529 PolarHBondContact O-N 2.8Å; H529-P531 VanDerWaalsContact O-CD 3.32Å; H529-P531 WeakPolarHBondContact O-CD 3.35Å
530	L	94.7	Very high	95.1	Very high	10 Å²	10	48.7 Å²	48.7	5%	0.052	25%	0.25	C	C	.	.			trans	-114.7	91.3	-179.5	-60.4	173.8	0	0	0	110.3	L174 N187 Y200 L317 L330 L526 D528 A533	L174-L530 HydrophobicContact CD1-CD1 4.06Å; L174-L530 HydrophobicContact CD1-CD2 4.35Å; L174-L530 HydrophobicContact CD2-CD1 4.39Å; N187-L530 HydrophobicContact CB-CD2 4.1Å; N187-L530 WeakPolarHBondContact ND2-CA 3.45Å; Y200-L530 HydrophobicContact CE1-CD2 3.93Å; Y200-L530 HydrophobicContact CE2-CD2 3.97Å; L317-L530 HydrophobicContact CD1-CB 4.46Å; L317-L530 HydrophobicContact CD2-CD1 4.35Å; L330-L530 HydrophobicContact CD1-CD1 3.78Å; L526-L530 HydrophobicContact CD2-CD1 4.16Å; D528-L530 PolarHBondContact O-N 3.2Å; L530-A533 HydrophobicContact CB-CB 3.92Å; L530-A533 VanDerWaalsContact O-CB 3.24Å; L530-A533 WeakPolarHBondContact O-CB 3.42Å
531	P	91.1	Very high	95.1	Very high	39 Å²	39	48.5 Å²	48.5	25%	0.253	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	150.4	176.4	-27.4	34	0	0	0	113.1	N187 V189 H529 A533	N187-P531 WeakPolarHBondContact ND2-CD 3.23Å; N187-P531 PolarHBondContact OD1-O 3.25Å; V189-P531 HydrophobicContact CG1-CB 4.1Å; V189-P531 HydrophobicContact CG1-CG 4.03Å; H529-P531 VanDerWaalsContact O-CD 3.32Å; H529-P531 WeakPolarHBondContact O-CD 3.35Å; P531-A533 PolarHBondContact O-N 2.99Å; P531-A533 VanDerWaalsContact O-N 3.09Å
532	H	92.4	Very high	95	Very high	77 Å²	77	51.3 Å²	51.3	36%	0.356	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.8	23.2	175.4	-46.1	-73.4	0	0	0	114.8	G173	G173-H532 VanDerWaalsContact CA-O 3.32Å; G173-H532 WeakPolarHBondContact CA-O 3.46Å
533	A	95.6	Very high	94.9	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.274	C	S	.	.			trans	-97.3	-14.2	-173.8	0	0	0	0	0	114.4	L174 Y316 L317 L530 P531	L174-A533 HydrophobicContact CB-CB 3.85Å; L174-A533 HydrophobicContact CD2-CB 4.1Å; L174-A533 HydrophobicContact CG-CB 4.42Å; Y316-A533 CarbonylContact C-O 3.49Å; Y316-A533 VanDerWaalsContact CA-O 3.23Å; Y316-A533 WeakPolarHBondContact CA-O 3.45Å; L317-A533 HydrophobicContact CD1-CB 3.77Å; L317-A533 HydrophobicContact CG-CB 3.78Å; L317-A533 PolarHBondContact N-O 3.43Å; L530-A533 HydrophobicContact CB-CB 3.92Å; L530-A533 VanDerWaalsContact O-CB 3.24Å; L530-A533 WeakPolarHBondContact O-CB 3.42Å; P531-A533 PolarHBondContact O-N 2.99Å; P531-A533 VanDerWaalsContact O-N 3.09Å
534	H	94.1	Very high	94.8	Very high	134 Å²	134	53.2 Å²	53.2	62%	0.62	28%	0.277	S	S	*	.	B	Isolated β-bridge	trans	-74.6	140.7	-175.9	-68.3	-72.6	0	0	0	112.5
535	A	92.8	Very high	94.7	Very high	19 Å²	19	53.2 Å²	53.2	16%	0.157	28%	0.276	C	S	.	.			trans	-66	142.2	173.2	0	0	0	0	0	110.9	Y316 P319 S537 F541	Y316-A535 HydrophobicContact CD1-CB 4.35Å; Y316-A535 HydrophobicContact CD2-CB 4.27Å; Y316-A535 HydrophobicContact CG-CB 3.88Å; P319-A535 HydrophobicContact CG-CB 4.45Å; A535-S537 VanDerWaalsContact C-N 3.29Å; A535-S537 PolarHBondContact O-N 2.89Å; A535-F541 HydrophobicContact CB-CB 3.8Å; A535-F541 HydrophobicContact CB-CD2 4.43Å
536	P	91.6	Very high	94.6	Very high	70 Å²	70	58.7 Å²	58.7	46%	0.455	30%	0.296	S	S	.	.	S	Bend	trans	-63	-34.6	174.2	-22.9	32.8	0	0	0	113.3	R540	P536-R540 HydrophobicContact CB-CG 4.38Å; P536-R540 HydrophobicContact CG-CG 4.42Å
537	S	93.7	Very high	94.5	Very high	36 Å²	36	62.2 Å²	62.2	25%	0.252	32%	0.315	S	S	.	.	S	Bend	trans	-152.2	167.7	177.8	80	0	0	0	0	111.1	A535 E539 R540 F541	A535-S537 VanDerWaalsContact C-N 3.29Å; A535-S537 PolarHBondContact O-N 2.89Å; S537-E539 VanDerWaalsContact C-N 3.32Å; S537-E539 WeakPolarHBondContact CB-OE2 3.44Å; S537-E539 PolarHBondContact OG-N 3.23Å; S537-E539 PolarHBondContact OG-OE2 2.95Å; S537-R540 PolarHBondContact O-N 3.48Å; S537-R540 PolarHBondContact OG-N 3.19Å; S537-F541 PolarHBondContact O-N 3.21Å; S537-F541 VanDerWaalsContact O-N 3.11Å
538	M	93.6	Very high	94.5	Very high	61 Å²	61	57 Å²	57	30%	0.3	28%	0.283	S	S	.	.	H	α-helix	trans	-63.9	-37.1	173.1	-173.7	61.6	94.8	0	0	111.5	P319 M321 R540 F541 E542	P319-M538 HydrophobicContact CB-CE 4.29Å; P319-M538 HydrophobicContact CG-CE 4.25Å; P319-M538 HydrophobicContact CG-SD 4Å; M321-M538 HydrophobicContact CG-CE 4.14Å; M321-M538 HydrophobicContact SD-CE 4.42Å; M538-R540 VanDerWaalsContact C-N 3.3Å; M538-R540 PolarHBondContact O-N 3.45Å; M538-F541 WeakPolarHBondContact O-CB 3.45Å; M538-F541 PolarHBondContact O-N 3.43Å; M538-F541 HydrophobicContact SD-CB 4.48Å; M538-F541 HydrophobicContact SD-CD1 4Å; M538-E542 HydrophobicContact CG-CG 4.48Å; M538-E542 WeakPolarHBondContact O-CG 3.5Å; M538-E542 PolarHBondContact O-N 3.26Å
539	E	95.5	Very high	94.4	Very high	141 Å²	141	58.2 Å²	58.2	66%	0.659	29%	0.288	S	S	*	.	H	α-helix	trans	-63.6	-38.4	177.5	-53	92.1	-175.3	0	0	111.7	S537 E542 A543	S537-E539 VanDerWaalsContact C-N 3.32Å; S537-E539 WeakPolarHBondContact CB-OE2 3.44Å; S537-E539 PolarHBondContact OG-N 3.23Å; S537-E539 PolarHBondContact OG-OE2 2.95Å; E539-E542 PolarHBondContact O-N 3.49Å; E539-A543 WeakPolarHBondContact O-CB 3.46Å; E539-A543 PolarHBondContact O-N 3.13Å
540	R	95.5	Very high	94.3	Very high	102 Å²	102	55.2 Å²	55.2	39%	0.385	28%	0.282	S	S	.	.	H	α-helix	trans	-65	-40.3	175.1	-73.7	-68.2	-167.2	178.9	-4.1	111.9	E7 P536 S537 M538 M544	E7-R540 IonicContact OE1-NH2 3.24Å; P536-R540 HydrophobicContact CB-CG 4.38Å; P536-R540 HydrophobicContact CG-CG 4.42Å; S537-R540 PolarHBondContact O-N 3.48Å; S537-R540 PolarHBondContact OG-N 3.19Å; M538-R540 VanDerWaalsContact C-N 3.3Å; M538-R540 PolarHBondContact O-N 3.45Å; R540-M544 WeakPolarHBondContact O-CB 3.4Å; R540-M544 PolarHBondContact O-N 3.06Å
541	F	97.3	Very high	93.9	Very high	1 Å²	1	58 Å²	58	0%	0.004	29%	0.291	C	S	.	.	H	α-helix	trans	-62.5	-47.9	175.2	-179.8	-105.2	0	0	0	111.4	Y316 P318 P319 M344 A535 S537 M538 A543 M544 L545	Y316-F541 WeakPolarHBondContact O-CE2 3.39Å; P318-F541 VanDerWaalsContact CA-CE2 3.49Å; P318-F541 HydrophobicContact CB-CE1 4.11Å; P318-F541 HydrophobicContact CB-CE2 3.91Å; P318-F541 HydrophobicContact CB-CZ 3.63Å; P319-F541 HydrophobicContact CG-CB 4.36Å; M344-F541 HydrophobicContact CE-CE2 3.9Å; M344-F541 HydrophobicContact CE-CZ 3.92Å; M344-F541 HydrophobicContact SD-CE2 3.81Å; M344-F541 HydrophobicContact SD-CZ 4.09Å; A535-F541 HydrophobicContact CB-CB 3.8Å; A535-F541 HydrophobicContact CB-CD2 4.43Å; S537-F541 PolarHBondContact O-N 3.21Å; S537-F541 VanDerWaalsContact O-N 3.11Å; M538-F541 WeakPolarHBondContact O-CB 3.45Å; M538-F541 PolarHBondContact O-N 3.43Å; M538-F541 HydrophobicContact SD-CB 4.48Å; M538-F541 HydrophobicContact SD-CD1 4Å; F541-A543 PolarHBondContact O-N 3.23Å; F541-M544 HydrophobicContact CD2-CE 3.47Å; F541-M544 VanDerWaalsContact CD2-CE 3.47Å; F541-M544 HydrophobicContact CE2-CE 3.49Å; F541-M544 VanDerWaalsContact CE2-CE 3.49Å; F541-M544 HydrophobicContact CG-CE 4.38Å; F541-M544 HydrophobicContact CZ-CE 4.42Å; F541-M544 WeakPolarHBondContact O-CB 3.42Å; F541-M544 PolarHBondContact O-N 3.1Å; F541-L545 HydrophobicContact CD1-CD1 4.11Å; F541-L545 HydrophobicContact CE1-CD1 3.51Å; F541-L545 HydrophobicContact CE1-CG 4.1Å; F541-L545 HydrophobicContact CZ-CD1 3.9Å; F541-L545 HydrophobicContact CZ-CD2 4.27Å; F541-L545 HydrophobicContact CZ-CG 4.12Å; F541-L545 PolarHBondContact O-N 3.25Å
542	E	96.4	Very high	93.6	Very high	61 Å²	61	57.5 Å²	57.5	29%	0.285	29%	0.288	S	S	.	.	H	α-helix	trans	-62.9	-40.6	177.2	-76.9	-123.5	167.3	0	0	113.2	H348 M538 E539 M544 L545 R546	H348-E542 IonicContact CE1-OE1 3.51Å; H348-E542 PolarHBondContact CE1-OE1 3.05Å; H348-E542 IonicContact CG-OE1 3.95Å; H348-E542 IonicContact ND1-OE1 2.77Å; H348-E542 PolarHBondContact ND1-OE1 3.07Å; M538-E542 HydrophobicContact CG-CG 4.48Å; M538-E542 WeakPolarHBondContact O-CG 3.5Å; M538-E542 PolarHBondContact O-N 3.26Å; E539-E542 PolarHBondContact O-N 3.49Å; E542-M544 VanDerWaalsContact C-N 3.3Å; E542-M544 PolarHBondContact O-N 2.67Å; E542-L545 PolarHBondContact O-N 3Å; E542-R546 PolarHBondContact O-N 3.05Å; E542-R546 VanDerWaalsContact O-N 3.1Å; E542-R546 IonicContact OE2-NH1 3.6Å; E542-R546 PolarHBondContact OE2-NH1 2.96Å
543	A	96.5	Very high	92.8	Very high	32 Å²	32	60 Å²	60	26%	0.264	31%	0.314	S	S	.	.	H	α-helix	trans	-62.7	-40	175	0	0	0	0	0	111.6	E539 F541 R546 N547	E539-A543 WeakPolarHBondContact O-CB 3.46Å; E539-A543 PolarHBondContact O-N 3.13Å; F541-A543 PolarHBondContact O-N 3.23Å; A543-R546 PolarHBondContact O-N 3.35Å; A543-N547 PolarHBondContact O-N 3.07Å; A543-N547 PolarHBondContact O-ND2 2.99Å
544	M	97	Very high	92.7	Very high	10 Å²	10	63 Å²	63	5%	0.049	33%	0.33	C	S	.	.	H	α-helix	trans	-62.7	-44.7	175.1	177.6	-84.1	-58.5	0	0	111.6	I315 Y316 M344 R540 F541 E542 R546 N547 M548	I315-M544 HydrophobicContact CB-SD 4Å; I315-M544 HydrophobicContact CG2-SD 3.97Å; Y316-M544 HydrophobicContact CD2-CB 4.05Å; Y316-M544 HydrophobicContact CD2-CE 4.41Å; Y316-M544 HydrophobicContact CD2-CG 4.05Å; Y316-M544 HydrophobicContact CE2-CB 4.46Å; M344-M544 HydrophobicContact CE-CE 4.1Å; R540-M544 WeakPolarHBondContact O-CB 3.4Å; R540-M544 PolarHBondContact O-N 3.06Å; F541-M544 HydrophobicContact CD2-CE 3.47Å; F541-M544 VanDerWaalsContact CD2-CE 3.47Å; F541-M544 HydrophobicContact CE2-CE 3.49Å; F541-M544 VanDerWaalsContact CE2-CE 3.49Å; F541-M544 HydrophobicContact CG-CE 4.38Å; F541-M544 HydrophobicContact CZ-CE 4.42Å; F541-M544 WeakPolarHBondContact O-CB 3.42Å; F541-M544 PolarHBondContact O-N 3.1Å; E542-M544 VanDerWaalsContact C-N 3.3Å; E542-M544 PolarHBondContact O-N 2.67Å; M544-R546 PolarHBondContact O-N 3.34Å; M544-N547 WeakPolarHBondContact O-CB 3.48Å; M544-N547 PolarHBondContact O-N 3.38Å; M544-M548 WeakPolarHBondContact O-CG 3.42Å; M544-M548 PolarHBondContact O-N 3.37Å; M544-M548 HydrophobicContact SD-CG 3.84Å; M544-M548 HydrophobicContact SD-SD 3.28Å
545	L	96.8	Very high	92.6	Very high	12 Å²	12	59.2 Å²	59.2	6%	0.063	31%	0.314	C	S	.	.	H	α-helix	trans	-59.1	-44.1	175.9	-73.5	-178.6	0	0	0	113.2	M344 T355 F541 E542 N547 M548 Q549	M344-L545 HydrophobicContact CE-CD2 3.44Å; M344-L545 VanDerWaalsContact CE-CD2 3.44Å; T355-L545 HydrophobicContact CG2-CD2 4.17Å; F541-L545 HydrophobicContact CD1-CD1 4.11Å; F541-L545 HydrophobicContact CE1-CD1 3.51Å; F541-L545 HydrophobicContact CE1-CG 4.1Å; F541-L545 HydrophobicContact CZ-CD1 3.9Å; F541-L545 HydrophobicContact CZ-CD2 4.27Å; F541-L545 HydrophobicContact CZ-CG 4.12Å; F541-L545 PolarHBondContact O-N 3.25Å; E542-L545 PolarHBondContact O-N 3Å; L545-N547 VanDerWaalsContact C-N 3.33Å; L545-N547 PolarHBondContact O-N 3.48Å; L545-M548 HydrophobicContact CD2-SD 4.39Å; L545-M548 PolarHBondContact O-N 3.21Å; L545-Q549 PolarHBondContact O-N 3.22Å; L545-Q549 VanDerWaalsContact O-N 3.15Å
546	R	95.6	Very high	92.6	Very high	134 Å²	134	61.4 Å²	61.4	51%	0.506	32%	0.323	S	S	.	.	H	α-helix	trans	-62	-41.9	176	-73.2	-173.4	-69	-86.9	1.3	111.8	E542 A543 M544 Q549 S550	E542-R546 PolarHBondContact O-N 3.05Å; E542-R546 VanDerWaalsContact O-N 3.1Å; E542-R546 IonicContact OE2-NH1 3.6Å; E542-R546 PolarHBondContact OE2-NH1 2.96Å; A543-R546 PolarHBondContact O-N 3.35Å; M544-R546 PolarHBondContact O-N 3.34Å; R546-Q549 PolarHBondContact O-N 3.17Å; R546-S550 PolarHBondContact O-N 3.26Å
547	N	94.6	Very high	92.7	Very high	86 Å²	86	60.9 Å²	60.9	46%	0.46	32%	0.315	S	S	.	.	H	α-helix	trans	-62.3	-47.9	176.4	-70.2	-21.1	0	0	0	110.7	A543 M544 L545 Q549 S550 W551	A543-N547 PolarHBondContact O-N 3.07Å; A543-N547 PolarHBondContact O-ND2 2.99Å; M544-N547 WeakPolarHBondContact O-CB 3.48Å; M544-N547 PolarHBondContact O-N 3.38Å; L545-N547 VanDerWaalsContact C-N 3.33Å; L545-N547 PolarHBondContact O-N 3.48Å; N547-Q549 VanDerWaalsContact C-N 3.33Å; N547-Q549 PolarHBondContact O-N 3.49Å; N547-S550 PolarHBondContact O-N 3.37Å; N547-S550 VanDerWaalsContact O-N 3.08Å; N547-S550 PolarHBondContact O-OG 3.26Å; N547-W551 HydrophobicContact CB-CZ2 3.81Å; N547-W551 VanDerWaalsContact O-CG 3.25Å; N547-W551 PolarHBondContact O-N 3.38Å; N547-W551 PolarHBondContact O-NE1 2.93Å
548	M	94	Very high	92.6	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-52.5	-49.6	177.8	-73.7	-177.5	74.6	0	0	112.4	I315 T355 L357 M544 L545 S550 W551	I315-M548 HydrophobicContact CG2-CE 4.17Å; I315-M548 HydrophobicContact CG2-CG 4.23Å; I315-M548 HydrophobicContact CG2-SD 3.81Å; T355-M548 HydrophobicContact CG2-CE 4.24Å; L357-M548 HydrophobicContact CD2-CE 3.5Å; L357-M548 HydrophobicContact CD2-SD 4.47Å; M544-M548 WeakPolarHBondContact O-CG 3.42Å; M544-M548 PolarHBondContact O-N 3.37Å; M544-M548 HydrophobicContact SD-CG 3.84Å; M544-M548 HydrophobicContact SD-SD 3.28Å; L545-M548 HydrophobicContact CD2-SD 4.39Å; L545-M548 PolarHBondContact O-N 3.21Å; M548-S550 VanDerWaalsContact C-N 3.3Å; M548-S550 PolarHBondContact O-N 3.4Å; M548-W551 HydrophobicContact CB-CE3 4.38Å; M548-W551 HydrophobicContact CB-CZ3 4.29Å; M548-W551 HydrophobicContact CG-CE3 4.25Å; M548-W551 HydrophobicContact CG-CH2 3.93Å; M548-W551 HydrophobicContact CG-CZ3 3.68Å; M548-W551 PolarHBondContact O-N 3.29Å
549	Q	91.3	Very high	92.5	Very high	63 Å²	63	62.6 Å²	62.6	29%	0.294	32%	0.32	S	S	.	.	H	α-helix	trans	-59.2	-43.6	179	-71.4	174.4	-7.1	0	0	111.2	G366 Q367 L545 R546 N547 W551 T552 S553	G366-Q549 VanDerWaalsContact O-CG 3.22Å; G366-Q549 WeakPolarHBondContact O-CG 3.22Å; Q367-Q549 PolarHBondContact NE2-O 3.07Å; L545-Q549 PolarHBondContact O-N 3.22Å; L545-Q549 VanDerWaalsContact O-N 3.15Å; R546-Q549 PolarHBondContact O-N 3.17Å; N547-Q549 VanDerWaalsContact C-N 3.33Å; N547-Q549 PolarHBondContact O-N 3.49Å; Q549-W551 PolarHBondContact O-N 3.35Å; Q549-T552 PolarHBondContact O-N 3.41Å; Q549-S553 PolarHBondContact O-N 3.33Å; Q549-S553 PolarHBondContact O-OG 3.01Å
550	S	90.9	Very high	92.3	Very high	72 Å²	72	57 Å²	57	50%	0.503	30%	0.296	S	S	.	.	H	α-helix	trans	-65.5	-21	-178.5	74.6	0	0	0	0	114.6	R546 N547 M548 T552	R546-S550 PolarHBondContact O-N 3.26Å; N547-S550 PolarHBondContact O-N 3.37Å; N547-S550 VanDerWaalsContact O-N 3.08Å; N547-S550 PolarHBondContact O-OG 3.26Å; M548-S550 VanDerWaalsContact C-N 3.3Å; M548-S550 PolarHBondContact O-N 3.4Å; S550-T552 VanDerWaalsContact C-N 3.26Å; S550-T552 PolarHBondContact O-N 2.84Å
551	W	86.8	Confident	92.1	Very high	67 Å²	67	53.5 Å²	53.5	25%	0.254	29%	0.289	S	S	.	.	H	α-helix	trans	-72.7	-24.1	-179.1	-57.3	-17.7	0	0	0	112.9	R313 N547 M548 Q549	R313-W551 HydrophobicContact CB-CE3 4.27Å; R313-W551 HydrophobicContact CB-CH2 3.22Å; R313-W551 HydrophobicContact CB-CZ2 3.72Å; R313-W551 HydrophobicContact CB-CZ3 3.53Å; R313-W551 VanDerWaalsContact CD-CE3 3.47Å; R313-W551 VanDerWaalsContact CD-CZ2 3.48Å; R313-W551 HydrophobicContact CG-CE3 4.48Å; R313-W551 HydrophobicContact CG-CH2 4.09Å; R313-W551 HydrophobicContact CG-CZ2 4.21Å; R313-W551 HydrophobicContact CG-CZ3 4.21Å; N547-W551 HydrophobicContact CB-CZ2 3.81Å; N547-W551 VanDerWaalsContact O-CG 3.25Å; N547-W551 PolarHBondContact O-N 3.38Å; N547-W551 PolarHBondContact O-NE1 2.93Å; M548-W551 HydrophobicContact CB-CE3 4.38Å; M548-W551 HydrophobicContact CB-CZ3 4.29Å; M548-W551 HydrophobicContact CG-CE3 4.25Å; M548-W551 HydrophobicContact CG-CH2 3.93Å; M548-W551 HydrophobicContact CG-CZ3 3.68Å; M548-W551 PolarHBondContact O-N 3.29Å; Q549-W551 PolarHBondContact O-N 3.35Å
552	T	83.1	Confident	91.6	Very high	30 Å²	30	57.9 Å²	57.9	18%	0.184	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.8	19.7	-172.2	57	0	0	0	0	112.2	P364 A365 Q367 Q549 S550	P364-T552 HydrophobicContact CB-CG2 4.23Å; A365-T552 WeakPolarHBondContact O-CB 3.48Å; A365-T552 WeakPolarHBondContact O-CG2 3.26Å; A365-T552 PolarHBondContact O-OG1 3.27Å; Q367-T552 VanDerWaalsContact NE2-C 3.34Å; Q367-T552 PolarHBondContact NE2-O 2.69Å; Q367-T552 PolarHBondContact NE2-OG1 3.47Å; Q549-T552 PolarHBondContact O-N 3.41Å; S550-T552 VanDerWaalsContact C-N 3.26Å; S550-T552 PolarHBondContact O-N 2.84Å
553	S	76.6	Confident	91.2	Very high	128 Å²	128	57.6 Å²	57.6	90%	0.895	32%	0.316	S	S	*	.			trans	-82.2	0	174.5	-64.8	0	0	0	0	112.2	Q549	Q549-S553 PolarHBondContact O-N 3.33Å; Q549-S553 PolarHBondContact O-OG 3.01Å

Retrieved 553 of 553 residues in 163.2 ms (Link to these results)

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