A0A087Y7R8_POEFO Loading...

Gamma-aminobutyric acid type A receptor subunit gamma3

AlphaFold DB , UniProt , Accession A0A087Y7R8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 474 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	39.5	Very low	32.7	Very low	234 Å²	234	137.9 Å²	137.9	100%	1.153	84%	0.837	S	S	*	*				0	82.3	0	-66.3	159.6	165.9	0	0	107.3
2	T	32.2	Very low	32.6	Very low	123 Å²	123	139.1 Å²	139.1	76%	0.755	83%	0.833	S	S	*	*				58.1	106.6	74.9	61.2	0	0	0	0	112.2
3	R	35.4	Very low	32.3	Very low	246 Å²	246	136.1 Å²	136.1	93%	0.928	82%	0.823	S	S	*	*				71.5	140.9	74.3	-82.3	-172.9	169.6	-172.1	-2.8	112.3
4	A	37.2	Very low	32.3	Very low	88 Å²	88	135.4 Å²	135.4	73%	0.727	82%	0.819	S	S	*	*			cis	-150.7	-170.5	-9.3	0	0	0	0	0	107.2
5	S	31.8	Very low	32.1	Very low	111 Å²	111	137.3 Å²	137.3	78%	0.776	82%	0.821	S	S	*	*			cis	-156.5	-168.3	17.4	-93.4	0	0	0	0	107.6
6	L	35.5	Very low	31.9	Very low	160 Å²	160	140 Å²	140	84%	0.838	82%	0.82	S	S	*	*			cis	161	140.5	-35.9	-154	98.3	0	0	0	107.1
7	A	30.8	Very low	31.6	Very low	102 Å²	102	139.1 Å²	139.1	84%	0.843	82%	0.817	S	S	*	*			trans	68.1	146.3	169.2	0	0	0	0	0	120.2
8	G	27.8	Very low	31.2	Very low	68 Å²	68	138.1 Å²	138.1	70%	0.701	82%	0.816	S	S	*	*			cis	157.9	162.2	-17.5	0	0	0	0	0	117.9
9	V	31.9	Very low	31.2	Very low	148 Å²	148	136.5 Å²	136.5	90%	0.897	81%	0.813	S	S	*	*			trans	79.7	122.9	153.6	-170.6	0	0	0	0	120.8
10	G	27.7	Very low	31	Very low	68 Å²	68	138 Å²	138	70%	0.701	82%	0.816	S	S	*	*			trans	94.5	149.7	145.8	0	0	0	0	0	117.8
11	L	30.3	Very low	30.8	Very low	169 Å²	169	135.7 Å²	135.7	89%	0.885	81%	0.813	S	S	*	*			cis	-159.8	169.4	-16.6	-136.3	141.1	0	0	0	109.6
12	L	31.4	Very low	30.3	Very low	152 Å²	152	130.8 Å²	130.8	80%	0.796	80%	0.796	S	S	*	*			trans	-83.4	161.5	-175.9	-92.7	92.8	0	0	0	115.6
13	S	28.9	Very low	30	Very low	100 Å²	100	133.1 Å²	133.1	70%	0.699	80%	0.798	S	S	*	*			trans	75.9	119	141.2	59	0	0	0	0	122.7
14	V	32.1	Very low	29.5	Very low	127 Å²	127	132 Å²	132	77%	0.77	80%	0.796	S	S	*	*				60.7	114.5	127.2	-176.3	0	0	0	0	120.1
15	L	29.2	Very low	29	Very low	163 Å²	163	136.6 Å²	136.6	85%	0.853	80%	0.802	S	S	*	*			trans	177.4	101.3	135.1	-95.5	162.2	0	0	0	106.7
16	F	28.1	Very low	28.9	Very low	181 Å²	181	140.2 Å²	140.2	79%	0.794	81%	0.806	S	S	*	*				72.2	125.7	76.7	-136.6	-93.8	0	0	0	115
17	T	27.2	Very low	28.5	Very low	125 Å²	125	140.4 Å²	140.4	77%	0.767	81%	0.808	S	S	*	*			trans	68.2	154.3	-173.7	79.3	0	0	0	0	115.7
18	C	25.2	Very low	28.5	Very low	120 Å²	120	146.3 Å²	146.3	81%	0.811	81%	0.81	S	S	*	*			cis	-142.8	168.3	-2.9	-149.5	0	0	0	0	112.3
19	S	30.5	Very low	28.7	Very low	109 Å²	109	151.6 Å²	151.6	76%	0.762	82%	0.817	S	S	*	*			trans	-70.9	147.2	-175.1	-46	0	0	0	0	114.7
20	L	27.2	Very low	28.5	Very low	165 Å²	165	151.5 Å²	151.5	86%	0.864	81%	0.811	S	S	*	*			trans	-167.1	115.6	136	-108.6	165.1	0	0	0	109.8
21	A	27.1	Very low	29	Very low	91 Å²	91	153.9 Å²	153.9	75%	0.752	81%	0.812	S	S	*	*			trans	-117.4	132.4	167.1	0	0	0	0	0	107.6
22	V	27.9	Very low	29.1	Very low	131 Å²	131	151 Å²	151	79%	0.794	80%	0.802	S	S	*	*			trans	-106.4	116.3	175.1	177.7	0	0	0	0	107.3
23	Q	26.1	Very low	29.5	Very low	172 Å²	172	149.8 Å²	149.8	80%	0.804	80%	0.8	S	S	*	*			trans	-83	147.6	170.5	-74.8	165.7	-119.7	0	0	109.6
24	Y	25.6	Very low	29.9	Very low	223 Å²	223	152 Å²	152	88%	0.875	80%	0.804	S	S	*	*			trans	-89.5	134.2	160.6	-107	-111.3	0	0	0	107.9
25	E	27.2	Very low	30.6	Very low	184 Å²	184	153.5 Å²	153.5	86%	0.86	80%	0.803	S	S	*	*			trans	-104.4	130.4	165.8	-78.8	172.4	139.2	0	0	108.2
26	E	29.2	Very low	31.1	Very low	186 Å²	186	154.6 Å²	154.6	87%	0.869	81%	0.806	S	S	*	*			trans	-113.2	113.2	162.9	-73.4	-171.1	139.7	0	0	107
27	D	27.7	Very low	32.2	Very low	164 Å²	164	152.6 Å²	152.6	88%	0.877	80%	0.802	S	S	*	*			trans	-65.1	138.7	174.5	-85.3	-50.2	0	0	0	110.9
28	Y	30	Very low	33	Very low	226 Å²	226	149.4 Å²	149.4	89%	0.886	79%	0.789	S	S	*	*			trans	-126.8	116.9	170.3	-141.4	-90.1	0	0	0	108.7	D30	Y28-D30 PolarHBondContact O-N 3.44Å
29	E	31.3	Very low	34.1	Very low	179 Å²	179	147.4 Å²	147.4	84%	0.836	77%	0.774	S	S	*	*			trans	-66.9	120	-177.9	-67.9	-171.5	131.9	0	0	111	V31	E29-V31 PolarHBondContact O-N 3.34Å
30	D	29.3	Very low	35	Very low	146 Å²	146	150.7 Å²	150.7	78%	0.781	78%	0.775	S	S	*	*			trans	-78.2	89	-177.5	-166.9	12.5	0	0	0	111.1	Y28 T32	Y28-D30 PolarHBondContact O-N 3.44Å; D30-T32 PolarHBondContact O-N 2.87Å
31	V	37.1	Very low	36.3	Very low	119 Å²	119	146.9 Å²	146.9	72%	0.721	76%	0.762	S	S	*	*			trans	-67.1	97	173.9	179.5	0	0	0	0	108.8	E29 V33	E29-V31 PolarHBondContact O-N 3.34Å; V31-V33 VanDerWaalsContact C-N 3.35Å; V31-V33 PolarHBondContact O-N 3.47Å
32	T	33.5	Very low	37.7	Very low	108 Å²	108	147.2 Å²	147.2	66%	0.663	75%	0.748	S	S	*	*			trans	-57.7	90.3	179.9	43.3	0	0	0	0	112.6	D30 N34	D30-T32 PolarHBondContact O-N 2.87Å; T32-N34 PolarHBondContact O-N 3.46Å
33	V	38.1	Very low	39.1	Very low	126 Å²	126	146.3 Å²	146.3	76%	0.764	74%	0.735	S	S	*	*			trans	-61.7	108.6	166.7	177.3	0	0	0	0	107.1	V31 Q35	V31-V33 VanDerWaalsContact C-N 3.35Å; V31-V33 PolarHBondContact O-N 3.47Å; V33-Q35 PolarHBondContact O-N 2.96Å
34	N	38.4	Very low	40.8	Very low	146 Å²	146	142.1 Å²	142.1	78%	0.781	72%	0.722	S	S	*	*			trans	-67.3	76.1	172.2	-81.4	-60.7	0	0	0	109.9	T32 M36	T32-N34 PolarHBondContact O-N 3.46Å; N34-M36 PolarHBondContact O-N 3.19Å
35	Q	45.8	Very low	43.3	Very low	160 Å²	160	135.4 Å²	135.4	75%	0.748	70%	0.701	S	S	*	*			trans	-62.2	108	170.6	-167.1	171.9	26.2	0	0	107	V33 L37	V33-Q35 PolarHBondContact O-N 2.96Å; Q35-L37 VanDerWaalsContact C-N 3.26Å; Q35-L37 HydrophobicContact CB-CD1 4.49Å; Q35-L37 WeakPolarHBondContact O-CD1 3.48Å; Q35-L37 PolarHBondContact O-N 3.13Å
36	M	40.9	Very low	45.9	Very low	186 Å²	186	128.6 Å²	128.6	92%	0.916	67%	0.672	S	S	*	*			trans	-69.3	84.1	-178.2	-68.2	-176.2	177.6	0	0	110	N34	N34-M36 PolarHBondContact O-N 3.19Å
37	L	50	Low	48.6	Very low	138 Å²	138	123.4 Å²	123.4	72%	0.723	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-55.4	144.7	163.4	-87	71.4	0	0	0	108.8	Q35	Q35-L37 VanDerWaalsContact C-N 3.26Å; Q35-L37 HydrophobicContact CB-CD1 4.49Å; Q35-L37 WeakPolarHBondContact O-CD1 3.48Å; Q35-L37 PolarHBondContact O-N 3.13Å
38	A	45.4	Very low	51.5	Low	59 Å²	59	121.7 Å²	121.7	49%	0.488	64%	0.64	S	S	.	*	P	Polyproline II helix	trans	-56.1	147.9	172.6	0	0	0	0	0	110.4	K40	A38-K40 PolarHBondContact O-N 3.45Å; A38-K40 VanDerWaalsContact O-N 3.16Å
39	P	47.5	Very low	54.2	Low	77 Å²	77	112.1 Å²	112.1	50%	0.5	60%	0.604	S	S	.	*	P	Polyproline II helix	trans	-59.3	123.8	-179.3	23.6	-32.8	0	0	0	110.2	S41 Q42	P39-S41 PolarHBondContact O-N 2.9Å; P39-Q42 HydrophobicContact CG-CB 4.14Å; P39-Q42 VanDerWaalsContact O-CB 3.23Å; P39-Q42 WeakPolarHBondContact O-CB 3.07Å; P39-Q42 PolarHBondContact O-N 3.22Å
40	K	50.7	Low	56.9	Low	179 Å²	179	105.3 Å²	105.3	78%	0.778	57%	0.573	S	S	*	*	H	α-helix	trans	-59.8	-18.4	-166.7	-159	171.4	-173.8	174.1	0	115.3	A38 Q42	A38-K40 PolarHBondContact O-N 3.45Å; A38-K40 VanDerWaalsContact O-N 3.16Å; K40-Q42 VanDerWaalsContact C-N 3.31Å
41	S	54	Low	59.8	Low	85 Å²	85	103.1 Å²	103.1	59%	0.594	56%	0.561	S	S	*	*	H	α-helix	trans	-74.7	-17.3	172	52.7	0	0	0	0	114	P39 T44	P39-S41 PolarHBondContact O-N 2.9Å; S41-T44 PolarHBondContact O-OG1 3.4Å
42	Q	55.2	Low	62.3	Low	97 Å²	97	102.4 Å²	102.4	45%	0.453	55%	0.553	S	S	.	*	H	α-helix	trans	-87.8	-28.7	-175.2	-159.4	162.5	31.1	0	0	111.9	P39 K40 T46 M112	P39-Q42 HydrophobicContact CG-CB 4.14Å; P39-Q42 VanDerWaalsContact O-CB 3.23Å; P39-Q42 WeakPolarHBondContact O-CB 3.07Å; P39-Q42 PolarHBondContact O-N 3.22Å; K40-Q42 VanDerWaalsContact C-N 3.31Å; Q42-T46 PolarHBondContact O-N 3.03Å; Q42-T46 PolarHBondContact O-OG1 3.38Å; Q42-M112 HydrophobicContact CG-CE 3.34Å
43	E	58.1	Low	65	Low	113 Å²	113	98.2 Å²	98.2	53%	0.528	53%	0.527	S	S	.	.	H	α-helix	trans	-71	-37.9	172	-65.4	-174.9	125.4	0	0	112.1	T46 T47	E43-T46 WeakPolarHBondContact CA-OG1 3.45Å; E43-T46 PolarHBondContact O-N 3.2Å; E43-T46 PolarHBondContact O-OG1 2.87Å; E43-T47 PolarHBondContact O-N 2.97Å; E43-T47 PolarHBondContact O-OG1 2.97Å
44	T	62.4	Low	67.6	Low	84 Å²	84	94.3 Å²	94.3	52%	0.515	50%	0.501	S	S	.	.	H	α-helix	trans	-61.3	-48	178.5	44.6	0	0	0	0	111.6	S41 T46 T47 E48	S41-T44 PolarHBondContact O-OG1 3.4Å; T44-T46 PolarHBondContact O-N 2.81Å; T44-T47 PolarHBondContact O-N 3.37Å; T44-E48 PolarHBondContact O-N 3.4Å
45	D	77.4	Confident	70	Confident	81 Å²	81	94.9 Å²	94.9	43%	0.433	50%	0.497	S	S	.	.	H	α-helix	trans	-58.6	-46.1	176.4	-77.2	13.9	0	0	0	111.5	T47 E48 I49	D45-T47 VanDerWaalsContact C-N 3.3Å; D45-T47 PolarHBondContact O-N 3.34Å; D45-E48 PolarHBondContact O-N 3.43Å; D45-I49 WeakPolarHBondContact O-CB 3.46Å; D45-I49 WeakPolarHBondContact O-CD1 3.42Å; D45-I49 VanDerWaalsContact O-CG1 3.23Å; D45-I49 WeakPolarHBondContact O-CG1 3.19Å; D45-I49 PolarHBondContact O-N 3.46Å
46	T	81.8	Confident	72	Confident	42 Å²	42	95.4 Å²	95.4	26%	0.258	50%	0.499	S	S	.	.	H	α-helix	trans	-63.2	-36.4	178.8	54.2	0	0	0	0	112.9	Q42 E43 T44 L50 M112 L115	Q42-T46 PolarHBondContact O-N 3.03Å; Q42-T46 PolarHBondContact O-OG1 3.38Å; E43-T46 WeakPolarHBondContact CA-OG1 3.45Å; E43-T46 PolarHBondContact O-N 3.2Å; E43-T46 PolarHBondContact O-OG1 2.87Å; T44-T46 PolarHBondContact O-N 2.81Å; T46-L50 VanDerWaalsContact O-CB 3.24Å; T46-L50 WeakPolarHBondContact O-CB 3.11Å; T46-L50 PolarHBondContact O-N 2.7Å; T46-M112 HydrophobicContact CG2-CE 3.59Å; T46-M112 HydrophobicContact CG2-SD 3.54Å; T46-M112 VanDerWaalsContact CG2-SD 3.54Å; T46-L115 HydrophobicContact CG2-CD2 4.09Å
47	T	86.4	Confident	74.5	Confident	77 Å²	77	87.9 Å²	87.9	47%	0.472	46%	0.461	S	S	.	.	H	α-helix	trans	-69.8	-41.1	-179.9	-55	0	0	0	0	110.9	E43 T44 D45 L50 N51	E43-T47 PolarHBondContact O-N 2.97Å; E43-T47 PolarHBondContact O-OG1 2.97Å; T44-T47 PolarHBondContact O-N 3.37Å; D45-T47 VanDerWaalsContact C-N 3.3Å; D45-T47 PolarHBondContact O-N 3.34Å; T47-L50 PolarHBondContact O-N 2.7Å; T47-N51 WeakPolarHBondContact O-CB 3.33Å; T47-N51 VanDerWaalsContact O-CG 3.26Å; T47-N51 PolarHBondContact O-N 3Å; T47-N51 PolarHBondContact O-ND2 3.16Å
48	E	87.5	Confident	76.6	Confident	127 Å²	127	84.3 Å²	84.3	59%	0.593	44%	0.443	S	S	*	.	H	α-helix	trans	-66.4	-45.8	175.6	-174.1	174.8	162.2	0	0	111.9	T44 D45 L50 N51 N52	T44-E48 PolarHBondContact O-N 3.4Å; D45-E48 PolarHBondContact O-N 3.43Å; E48-L50 VanDerWaalsContact C-N 3.3Å; E48-L50 PolarHBondContact O-N 2.86Å; E48-N51 PolarHBondContact O-N 3.16Å; E48-N52 WeakPolarHBondContact O-CB 3.48Å; E48-N52 PolarHBondContact O-N 2.83Å; E48-N52 PolarHBondContact O-ND2 3.16Å
49	I	87.8	Confident	78.8	Confident	25 Å²	25	86.2 Å²	86.2	13%	0.128	44%	0.44	C	S	.	.	H	α-helix	trans	-55.5	-47.1	175	-69.2	163.2	0	0	0	110.4	D45 N52 L53 Y108 L115	D45-I49 WeakPolarHBondContact O-CB 3.46Å; D45-I49 WeakPolarHBondContact O-CD1 3.42Å; D45-I49 VanDerWaalsContact O-CG1 3.23Å; D45-I49 WeakPolarHBondContact O-CG1 3.19Å; D45-I49 PolarHBondContact O-N 3.46Å; I49-N52 PolarHBondContact O-N 2.85Å; I49-L53 HydrophobicContact CG2-CD1 4.14Å; I49-L53 HydrophobicContact CG2-CG 4.43Å; I49-L53 WeakPolarHBondContact O-CB 3.23Å; I49-L53 WeakPolarHBondContact O-CG 2.77Å; I49-L53 PolarHBondContact O-N 3.45Å; I49-Y108 HydrophobicContact CD1-CD2 4.47Å; I49-Y108 HydrophobicContact CG2-CD2 3.8Å; I49-Y108 HydrophobicContact CG2-CG 3.82Å; I49-L115 HydrophobicContact CG2-CD1 4.07Å
50	L	88.4	Confident	81	Confident	36 Å²	36	90.5 Å²	90.5	19%	0.188	45%	0.451	C	S	.	.	H	α-helix	trans	-68.1	-40.1	-175.8	-161.1	62.9	0	0	0	112.6	T46 T47 E48 L53 L54 L117 M121	T46-L50 VanDerWaalsContact O-CB 3.24Å; T46-L50 WeakPolarHBondContact O-CB 3.11Å; T46-L50 PolarHBondContact O-N 2.7Å; T47-L50 PolarHBondContact O-N 2.7Å; E48-L50 VanDerWaalsContact C-N 3.3Å; E48-L50 PolarHBondContact O-N 2.86Å; L50-L53 PolarHBondContact O-N 2.83Å; L50-L54 WeakPolarHBondContact O-CG 3.41Å; L50-L54 PolarHBondContact O-N 2.93Å; L50-L54 VanDerWaalsContact O-N 3.11Å; L50-L117 HydrophobicContact CD1-CD1 4.16Å; L50-L117 HydrophobicContact CD1-CD2 4.46Å; L50-L117 HydrophobicContact CD2-CD2 4.46Å; L50-M121 HydrophobicContact CD1-CE 3.61Å; L50-M121 HydrophobicContact CD2-CE 3.81Å; L50-M121 HydrophobicContact CD2-SD 3.81Å; L50-M121 HydrophobicContact CG-CE 3.8Å; L50-M121 HydrophobicContact CG-SD 4.45Å
51	N	89.9	Confident	83	Confident	101 Å²	101	85.7 Å²	85.7	54%	0.54	43%	0.433	S	S	.	.	H	α-helix	trans	-64.3	-43	173.9	-74.1	-28.2	0	0	0	111.6	T47 E48 L53 L54 K55	T47-N51 WeakPolarHBondContact O-CB 3.33Å; T47-N51 VanDerWaalsContact O-CG 3.26Å; T47-N51 PolarHBondContact O-N 3Å; T47-N51 PolarHBondContact O-ND2 3.16Å; E48-N51 PolarHBondContact O-N 3.16Å; N51-L53 PolarHBondContact O-N 2.95Å; N51-L54 PolarHBondContact O-N 3.49Å; N51-K55 WeakPolarHBondContact O-CB 3.23Å; N51-K55 PolarHBondContact O-N 3.42Å
52	N	90	Very high	85	Confident	103 Å²	103	82.3 Å²	82.3	55%	0.551	41%	0.407	S	S	*	.	H	α-helix	trans	-64.5	-37.7	176.8	-76.3	-33.8	0	0	0	112.3	E48 I49	E48-N52 WeakPolarHBondContact O-CB 3.48Å; E48-N52 PolarHBondContact O-N 2.83Å; E48-N52 PolarHBondContact O-ND2 3.16Å; I49-N52 PolarHBondContact O-N 2.85Å
53	L	90.4	Very high	86.8	Confident	20 Å²	20	77.8 Å²	77.8	11%	0.105	39%	0.386	C	S	.	.	H	α-helix	trans	-67.1	-34.1	175.3	-76.9	-177.9	0	0	0	113.7	I49 L50 N51 L106 Y108 L115	I49-L53 HydrophobicContact CG2-CD1 4.14Å; I49-L53 HydrophobicContact CG2-CG 4.43Å; I49-L53 WeakPolarHBondContact O-CB 3.23Å; I49-L53 WeakPolarHBondContact O-CG 2.77Å; I49-L53 PolarHBondContact O-N 3.45Å; L50-L53 PolarHBondContact O-N 2.83Å; N51-L53 PolarHBondContact O-N 2.95Å; L53-L106 HydrophobicContact CB-CD2 4.12Å; L53-Y108 HydrophobicContact CD1-CD1 3.99Å; L53-Y108 HydrophobicContact CD1-CG 4.37Å; L53-L115 HydrophobicContact CD1-CD1 4.5Å
54	L	91.3	Very high	88.5	Confident	44 Å²	44	74.2 Å²	74.2	23%	0.23	37%	0.371	C	S	.	.	H	α-helix	trans	-91	-20.5	-176.4	-70.5	177.6	0	0	0	115	L50 N51 E56 Y57 M121 L124	L50-L54 WeakPolarHBondContact O-CG 3.41Å; L50-L54 PolarHBondContact O-N 2.93Å; L50-L54 VanDerWaalsContact O-N 3.11Å; N51-L54 PolarHBondContact O-N 3.49Å; L54-E56 PolarHBondContact O-N 3.35Å; L54-Y57 PolarHBondContact O-N 3.38Å; L54-Y57 VanDerWaalsContact O-N 3.1Å; L54-M121 HydrophobicContact CD1-CE 3.71Å; L54-M121 HydrophobicContact CG-CE 4.46Å; L54-L124 HydrophobicContact CD1-CB 4.47Å; L54-L124 HydrophobicContact CD1-CD1 3.85Å; L54-L124 HydrophobicContact CD2-CB 4.17Å
55	K	88.3	Confident	89.9	Confident	158 Å²	158	74.7 Å²	74.7	69%	0.687	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.5	-37.2	-167.6	-173.2	-176.8	163.3	-169	0	115	N51	N51-K55 WeakPolarHBondContact O-CB 3.23Å; N51-K55 PolarHBondContact O-N 3.42Å
56	E	88.6	Confident	90.5	Very high	172 Å²	172	74.6 Å²	74.6	80%	0.804	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127	20.2	-177	-64.5	175	-159.4	0	0	112	L54 D58	L54-E56 PolarHBondContact O-N 3.35Å; E56-D58 PolarHBondContact O-N 2.95Å
57	Y	93.9	Very high	91.1	Very high	27 Å²	27	78.2 Å²	78.2	11%	0.106	41%	0.409	C	S	.	.			trans	-87.2	104.5	-173.7	-172	-85.6	0	0	0	112.6	L54 K59 D103 R105 L106 I125 W126	L54-Y57 PolarHBondContact O-N 3.38Å; L54-Y57 VanDerWaalsContact O-N 3.1Å; Y57-K59 HydrophobicContact CD1-CB 4.19Å; Y57-K59 HydrophobicContact CE1-CB 3.86Å; Y57-K59 PolarHBondContact O-N 3.37Å; Y57-D103 WeakPolarHBondContact CE2-OD2 3.46Å; Y57-D103 PolarHBondContact OH-OD2 3.27Å; Y57-R105 HydrophobicContact CD2-CB 3.99Å; Y57-R105 HydrophobicContact CE2-CB 3.94Å; Y57-R105 PolarHBondContact OH-NH2 3.19Å; Y57-R105 VanDerWaalsContact OH-NH2 3.16Å; Y57-L106 HydrophobicContact CD2-CD1 4.47Å; Y57-L106 HydrophobicContact CD2-CD2 3.95Å; Y57-L106 HydrophobicContact CD2-CG 4.05Å; Y57-L106 HydrophobicContact CE2-CD1 3.67Å; Y57-L106 HydrophobicContact CE2-CD2 3.97Å; Y57-L106 HydrophobicContact CE2-CG 3.6Å; Y57-I125 HydrophobicContact CE1-CB 4.29Å; Y57-W126 HydrophobicContact CE1-CB 4.5Å; Y57-W126 WeakPolarHBondContact OH-CB 3.47Å; Y57-W126 PolarHBondContact OH-N 2.94Å; Y57-W126 VanDerWaalsContact OH-N 3.11Å
58	D	93.1	Very high	91.5	Very high	64 Å²	64	79.7 Å²	79.7	34%	0.342	41%	0.409	S	S	.	.			trans	-83.2	103.9	168	-167.6	-2.8	0	0	0	112	E56 K60 L61 R105	E56-D58 PolarHBondContact O-N 2.95Å; D58-K60 PolarHBondContact O-N 2.99Å; D58-K60 VanDerWaalsContact OD1-CB 3.27Å; D58-K60 WeakPolarHBondContact OD1-CB 3.4Å; D58-K60 VanDerWaalsContact OD1-CG 3.25Å; D58-K60 WeakPolarHBondContact OD1-CG 3.44Å; D58-K60 PolarHBondContact OD1-N 3.46Å; D58-L61 HydrophobicContact CB-CD1 4.34Å; D58-L61 HydrophobicContact CB-CG 4.41Å; D58-L61 PolarHBondContact O-N 3.38Å; D58-R105 PolarHBondContact O-NH1 2.93Å
59	K	92.8	Very high	91.9	Very high	99 Å²	99	75.7 Å²	75.7	43%	0.43	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-9.9	175.1	71.5	-177.1	-170.1	-173.8	0	115.5	Y57 L61 G123 W126	Y57-K59 HydrophobicContact CD1-CB 4.19Å; Y57-K59 HydrophobicContact CE1-CB 3.86Å; Y57-K59 PolarHBondContact O-N 3.37Å; K59-L61 VanDerWaalsContact C-N 3.31Å; K59-G123 PolarHBondContact NZ-O 2.94Å; K59-W126 WeakPolarHBondContact O-CB 3.48Å
60	K	92.1	Very high	92.3	Very high	167 Å²	167	74.8 Å²	74.8	73%	0.726	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-24.4	173.7	-60.1	167	-170.2	165.1	0	112.1	D58	D58-K60 PolarHBondContact O-N 2.99Å; D58-K60 VanDerWaalsContact OD1-CB 3.27Å; D58-K60 WeakPolarHBondContact OD1-CB 3.4Å; D58-K60 VanDerWaalsContact OD1-CG 3.25Å; D58-K60 WeakPolarHBondContact OD1-CG 3.44Å; D58-K60 PolarHBondContact OD1-N 3.46Å
61	L	93.9	Very high	92.7	Very high	78 Å²	78	76.8 Å²	76.8	41%	0.408	40%	0.399	S	S	.	.	S	Bend	trans	-95.5	127	-175.7	-58.2	179	0	0	0	110.4	D58 K59 I65 R105	D58-L61 HydrophobicContact CB-CD1 4.34Å; D58-L61 HydrophobicContact CB-CG 4.41Å; D58-L61 PolarHBondContact O-N 3.38Å; K59-L61 VanDerWaalsContact C-N 3.31Å; L61-I65 HydrophobicContact CD2-CD1 4.21Å; L61-R105 PolarHBondContact O-NH1 2.96Å; L61-R105 VanDerWaalsContact O-NH1 3.07Å; L61-R105 PolarHBondContact O-NH2 3.47Å
62	R	94.9	Very high	93	Very high	14 Å²	14	72 Å²	72	5%	0.053	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-66.2	151	174.9	73.1	174.2	-178.1	81.5	-3.6	111.4	D64 I65 K68 T70 W126 Y193 E197	R62-D64 PolarHBondContact O-N 3.18Å; R62-I65 HydrophobicContact CG-CB 4.03Å; R62-I65 HydrophobicContact CG-CG1 4.37Å; R62-I65 PolarHBondContact O-N 2.84Å; R62-K68 PolarHBondContact NH1-O 2.76Å; R62-K68 PolarHBondContact NH2-O 2.93Å; R62-T70 PolarHBondContact NH1-OG1 2.83Å; R62-W126 HydrophobicContact CB-CD2 4.4Å; R62-W126 HydrophobicContact CB-CH2 4.48Å; R62-W126 HydrophobicContact CB-CZ2 3.66Å; R62-Y193 HydrophobicContact CB-CE1 4.33Å; R62-Y193 HydrophobicContact CG-CE1 4.44Å; R62-E197 PolarHBondContact NE-O 3.49Å; R62-E197 PolarHBondContact NH1-O 2.54Å
63	P	94.6	Very high	93.4	Very high	1 Å²	1	69.8 Å²	69.8	1%	0.006	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	137.4	174.2	-22.7	31.6	0	0	0	112	I65 T70 D103 W126	P63-I65 PolarHBondContact O-N 3.05Å; P63-T70 HydrophobicContact CB-CG2 4.31Å; P63-T70 HydrophobicContact CG-CG2 4.22Å; P63-T70 PolarHBondContact O-OG1 3.02Å; P63-D103 HydrophobicContact CB-CB 4.26Å; P63-D103 HydrophobicContact CG-CB 3.96Å; P63-W126 VanDerWaalsContact CD-CE3 3.42Å; P63-W126 HydrophobicContact CG-CD2 4.46Å; P63-W126 HydrophobicContact CG-CE3 3.89Å; P63-W126 HydrophobicContact CG-CZ3 4.09Å
64	D	92.5	Very high	93.6	Very high	38 Å²	38	68.8 Å²	68.8	20%	0.203	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.3	34.7	176.3	-52.9	-27.6	0	0	0	114.2	R62 G66 V67 K68 S104	R62-D64 PolarHBondContact O-N 3.18Å; D64-G66 PolarHBondContact O-N 3.01Å; D64-V67 HydrophobicContact CB-CB 4.45Å; D64-V67 WeakPolarHBondContact O-CB 3.49Å; D64-V67 PolarHBondContact O-N 2.79Å; D64-K68 HydrophobicContact CB-CD 4.48Å; D64-K68 VanDerWaalsContact CB-CE 3.47Å; D64-K68 HydrophobicContact CB-CG 4.04Å; D64-K68 VanDerWaalsContact CG-CE 3.48Å; D64-K68 PolarHBondContact O-N 3.02Å; D64-K68 WeakPolarHBondContact OD2-CE 3.38Å; D64-K68 IonicContact OD2-NZ 2.7Å; D64-K68 PolarHBondContact OD2-NZ 3Å; D64-S104 PolarHBondContact OD1-OG 2.81Å
65	I	93.1	Very high	93.8	Very high	95 Å²	95	68.3 Å²	68.3	49%	0.487	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	133.2	173.8	-171.4	171.9	0	0	0	111.9	L61 R62 P63 V67	L61-I65 HydrophobicContact CD2-CD1 4.21Å; R62-I65 HydrophobicContact CG-CB 4.03Å; R62-I65 HydrophobicContact CG-CG1 4.37Å; R62-I65 PolarHBondContact O-N 2.84Å; P63-I65 PolarHBondContact O-N 3.05Å; I65-V67 PolarHBondContact O-N 2.72Å
66	G	89.9	Confident	94.1	Very high	79 Å²	79	61 Å²	61	81%	0.814	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	73	-3.6	-177.4	0	0	0	0	0	115.6	D64	D64-G66 PolarHBondContact O-N 3.01Å
67	V	93.8	Very high	94.4	Very high	118 Å²	118	56.5 Å²	56.5	72%	0.715	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.1	-45	-178.9	-177	0	0	0	0	112.2	D64 I65	D64-V67 HydrophobicContact CB-CB 4.45Å; D64-V67 WeakPolarHBondContact O-CB 3.49Å; D64-V67 PolarHBondContact O-N 2.79Å; I65-V67 PolarHBondContact O-N 2.72Å
68	K	94.8	Very high	94.5	Very high	108 Å²	108	55.2 Å²	55.2	47%	0.47	30%	0.296	S	S	.	.	S	Bend	trans	-162.1	165.6	-178.2	59.6	-179.6	179.4	-172.1	0	111.1	R62 D64	R62-K68 PolarHBondContact NH1-O 2.76Å; R62-K68 PolarHBondContact NH2-O 2.93Å; D64-K68 HydrophobicContact CB-CD 4.48Å; D64-K68 VanDerWaalsContact CB-CE 3.47Å; D64-K68 HydrophobicContact CB-CG 4.04Å; D64-K68 VanDerWaalsContact CG-CE 3.48Å; D64-K68 PolarHBondContact O-N 3.02Å; D64-K68 WeakPolarHBondContact OD2-CE 3.38Å; D64-K68 IonicContact OD2-NZ 2.7Å; D64-K68 PolarHBondContact OD2-NZ 3Å
69	P	95.7	Very high	94.4	Very high	42 Å²	42	53.7 Å²	53.7	27%	0.273	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-63.8	139.2	165	23.6	-33.1	0	0	0	111.6	I71 E197 I199	P69-I71 PolarHBondContact O-N 3.34Å; P69-E197 CarbonylContact C-O 3.59Å; P69-E197 WeakPolarHBondContact CA-O 3.35Å; P69-I199 HydrophobicContact CB-CD1 3.83Å; P69-I199 HydrophobicContact CB-CG1 3.96Å; P69-I199 HydrophobicContact CG-CD1 3.76Å; P69-I199 HydrophobicContact CG-CG1 4.44Å
70	T	96.4	Very high	94.5	Very high	7 Å²	7	50.1 Å²	50.1	4%	0.043	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	117.4	171.9	-49.1	0	0	0	0	108.5	R62 P63 W126 E197 M198 I199	R62-T70 PolarHBondContact NH1-OG1 2.83Å; P63-T70 HydrophobicContact CB-CG2 4.31Å; P63-T70 HydrophobicContact CG-CG2 4.22Å; P63-T70 PolarHBondContact O-OG1 3.02Å; T70-W126 HydrophobicContact CG2-CH2 4.16Å; T70-W126 HydrophobicContact CG2-CZ3 4.34Å; T70-E197 PolarHBondContact N-O 3.28Å; T70-M198 WeakPolarHBondContact O-CA 3.46Å; T70-M198 WeakPolarHBondContact O-CG 3.34Å; T70-I199 PolarHBondContact O-N 2.99Å
71	I	96.5	Very high	94.6	Very high	77 Å²	77	42.1 Å²	42.1	40%	0.395	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	132.7	-179.9	-59.2	173.6	0	0	0	109.2	P69 I199 K201	P69-I71 PolarHBondContact O-N 3.34Å; I71-I199 WeakPolarHBondContact CA-O 3.48Å; I71-K201 HydrophobicContact CG2-CD 3.79Å; I71-K201 HydrophobicContact CG2-CG 4.19Å
72	I	97.2	Very high	94.4	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	110.3	178.8	-53.4	-170.2	0	0	0	109.6	V74 Q99 T100 W101 W126 P128 M198 I199 Y200 K201	I72-V74 HydrophobicContact CG2-CG2 4.08Å; I72-Q99 HydrophobicContact CG2-CB 4.08Å; I72-T100 CarbonylContact C-O 3.6Å; I72-T100 WeakPolarHBondContact CA-O 3.26Å; I72-W101 HydrophobicContact CG1-CB 4.25Å; I72-W126 HydrophobicContact CD1-CH2 4.44Å; I72-P128 HydrophobicContact CD1-CB 3.42Å; I72-P128 VanDerWaalsContact CD1-CB 3.42Å; I72-P128 HydrophobicContact CD1-CG 3.84Å; I72-M198 HydrophobicContact CD1-CE 4.2Å; I72-M198 HydrophobicContact CD1-CG 3.87Å; I72-M198 HydrophobicContact CD1-SD 3.44Å; I72-M198 WeakPolarHBondContact CD1-SD 3.39Å; I72-M198 HydrophobicContact CG1-CG 4.21Å; I72-M198 HydrophobicContact CG1-SD 4.36Å; I72-I199 PolarHBondContact N-O 2.76Å; I72-Y200 HydrophobicContact CB-CD1 4.06Å; I72-Y200 HydrophobicContact CB-CE1 4.42Å; I72-Y200 HydrophobicContact CD1-CE1 4.28Å; I72-Y200 HydrophobicContact CG2-CD1 4.18Å; I72-Y200 HydrophobicContact CG2-CE1 4.37Å; I72-Y200 CarbonylContact O-C 3.57Å; I72-Y200 WeakPolarHBondContact O-CA 3.28Å; I72-K201 PolarHBondContact O-N 3.06Å
73	D	96.6	Very high	94.3	Very high	57 Å²	57	40.7 Å²	40.7	31%	0.305	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	128.6	168.1	-60.9	-35.3	0	0	0	108.5	T100 K201	D73-T100 PolarHBondContact N-O 3.04Å; D73-T100 PolarHBondContact O-N 3.07Å; D73-K201 CarbonylContact C-O 3.54Å; D73-K201 WeakPolarHBondContact CA-O 3.35Å
74	V	96.2	Very high	94.2	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	137.5	-178	-177.4	0	0	0	0	111.2	I72 I76 F97 F188 Y200 K201 W202 R203	I72-V74 HydrophobicContact CG2-CG2 4.08Å; V74-I76 HydrophobicContact CG1-CG1 4.24Å; V74-F97 HydrophobicContact CG1-CD2 4.43Å; V74-F97 HydrophobicContact CG1-CE2 3.62Å; V74-F97 HydrophobicContact CG1-CZ 3.87Å; V74-F188 HydrophobicContact CG1-CE2 3.96Å; V74-F188 HydrophobicContact CG1-CZ 3.83Å; V74-F188 HydrophobicContact CG2-CE2 4.26Å; V74-Y200 HydrophobicContact CG2-CD1 3.68Å; V74-Y200 HydrophobicContact CG2-CE1 4.46Å; V74-K201 PolarHBondContact N-O 2.79Å; V74-W202 HydrophobicContact CB-CE3 4.44Å; V74-W202 HydrophobicContact CB-CZ3 4.46Å; V74-W202 HydrophobicContact CG1-CZ3 4.17Å; V74-R203 PolarHBondContact O-N 2.82Å
75	D	94.9	Very high	94.2	Very high	34 Å²	34	41.6 Å²	41.6	18%	0.182	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	142.6	171.4	-94.8	-33.8	0	0	0	109.3	A98 R203 S206	D75-A98 HydrophobicContact CB-CB 3.86Å; D75-A98 PolarHBondContact N-O 3.02Å; D75-A98 PolarHBondContact O-N 3.2Å; D75-A98 VanDerWaalsContact O-O 3.13Å; D75-R203 VanDerWaalsContact CG-CD 3.48Å; D75-R203 WeakPolarHBondContact OD1-CD 3.3Å; D75-R203 WeakPolarHBondContact OD2-CD 3.04Å; D75-R203 IonicContact OD2-CZ 3.54Å; D75-R203 IonicContact OD2-NE 3.64Å; D75-R203 IonicContact OD2-NH1 3.38Å; D75-R203 PolarHBondContact OD2-NH1 2.97Å; D75-S206 WeakPolarHBondContact OD1-CA 3.38Å
76	I	95.4	Very high	93.9	Very high	4 Å²	4	37.3 Å²	37.3	2%	0.021	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	121.5	174.9	-52.5	-174.1	0	0	0	108.6	V74 V78 I95 F97 F188 W202 S206 V207 E208 V244	V74-I76 HydrophobicContact CG1-CG1 4.24Å; I76-V78 HydrophobicContact CG2-CG2 4.33Å; I76-I95 HydrophobicContact CG2-CB 4.18Å; I76-I95 HydrophobicContact CG2-CD1 4.27Å; I76-I95 HydrophobicContact CG2-CG2 4.14Å; I76-F97 HydrophobicContact CD1-CD2 4.17Å; I76-F97 HydrophobicContact CD1-CE2 4.04Å; I76-F97 HydrophobicContact CG1-CD2 3.91Å; I76-F97 HydrophobicContact CG1-CE2 4.07Å; I76-F188 HydrophobicContact CD1-CE1 3.69Å; I76-F188 HydrophobicContact CD1-CZ 4.05Å; I76-W202 HydrophobicContact CD1-CH2 3.87Å; I76-W202 HydrophobicContact CD1-CZ3 3.91Å; I76-W202 HydrophobicContact CG1-CZ3 4.15Å; I76-S206 PolarHBondContact N-O 2.86Å; I76-V207 WeakPolarHBondContact O-CA 3.45Å; I76-E208 PolarHBondContact O-N 2.79Å; I76-V244 HydrophobicContact CD1-CG2 4.16Å
77	F	94.5	Very high	93.8	Very high	77 Å²	77	37.3 Å²	37.3	34%	0.338	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	116	169.9	-179.9	-88.8	0	0	0	109.4	N79 I95 I96 E208 A210	F77-N79 WeakPolarHBondContact CD1-OD1 3.24Å; F77-N79 WeakPolarHBondContact CE1-OD1 3.42Å; F77-N79 PolarHBondContact O-N 3.45Å; F77-I95 CarbonylContact O-C 3.6Å; F77-I95 WeakPolarHBondContact O-CA 3.28Å; F77-I96 HydrophobicContact CB-CB 4.27Å; F77-I96 HydrophobicContact CD1-CD1 4.21Å; F77-I96 HydrophobicContact CD1-CG1 4.49Å; F77-I96 PolarHBondContact N-O 3.49Å; F77-I96 PolarHBondContact O-N 2.82Å; F77-E208 CarbonylContact C-O 3.58Å; F77-E208 WeakPolarHBondContact CA-O 3.37Å; F77-E208 HydrophobicContact CD2-CB 3.96Å; F77-A210 HydrophobicContact CE1-CB 4.26Å; F77-A210 HydrophobicContact CZ-CB 3.96Å
78	V	94.9	Very high	93.6	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	109.8	-179.4	-178.4	0	0	0	0	109.5	I76 I81 I93 I95 V207 E208 A209 A210 W215 F246	I76-V78 HydrophobicContact CG2-CG2 4.33Å; V78-I81 HydrophobicContact CG1-CG1 4.17Å; V78-I93 HydrophobicContact CG1-CD1 3.98Å; V78-I93 HydrophobicContact CG1-CG1 4.08Å; V78-I93 HydrophobicContact CG2-CD1 4.26Å; V78-I95 HydrophobicContact CG2-CG2 4.2Å; V78-V207 HydrophobicContact CG2-CG1 4.49Å; V78-E208 PolarHBondContact N-O 2.8Å; V78-A209 HydrophobicContact CB-CB 4.45Å; V78-A210 WeakPolarHBondContact O-CB 3.24Å; V78-A210 PolarHBondContact O-N 2.86Å; V78-W215 HydrophobicContact CG1-CZ2 4.37Å; V78-F246 HydrophobicContact CG2-CE1 4.02Å; V78-F246 HydrophobicContact CG2-CZ 4.18Å
79	N	92.7	Very high	93.5	Very high	32 Å²	32	32 Å²	32	17%	0.171	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	-50	175.7	-64.9	-44.3	0	0	0	110.4	F77 D94 R163 A210	F77-N79 WeakPolarHBondContact CD1-OD1 3.24Å; F77-N79 WeakPolarHBondContact CE1-OD1 3.42Å; F77-N79 PolarHBondContact O-N 3.45Å; N79-D94 HydrophobicContact CB-CB 4.21Å; N79-D94 WeakPolarHBondContact CB-O 3.42Å; N79-D94 PolarHBondContact N-O 2.83Å; N79-D94 PolarHBondContact ND2-OD1 3.23Å; N79-R163 PolarHBondContact ND2-NE 3.46Å; N79-A210 WeakPolarHBondContact O-CB 3.3Å
80	S	93.7	Very high	93.4	Very high	24 Å²	24	31.9 Å²	31.9	17%	0.168	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161	148.8	174	64.5	0	0	0	0	112	D94	S80-D94 PolarHBondContact N-O 3.48Å; S80-D94 PolarHBondContact O-N 2.94Å
81	I	93.9	Very high	93.4	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	129.5	159.8	-50.1	-175.9	0	0	0	107.7	V78 Y91 I93 W215 R216 L217 F222 F246	V78-I81 HydrophobicContact CG1-CG1 4.17Å; I81-Y91 HydrophobicContact CG2-CD2 4.26Å; I81-I93 HydrophobicContact CG1-CD1 4.34Å; I81-I93 HydrophobicContact CG1-CG1 4.31Å; I81-W215 HydrophobicContact CB-CD2 4.42Å; I81-W215 HydrophobicContact CB-CE3 3.96Å; I81-W215 HydrophobicContact CB-CZ3 4.41Å; I81-W215 HydrophobicContact CD1-CE3 3.92Å; I81-W215 HydrophobicContact CD1-CH2 4.17Å; I81-W215 HydrophobicContact CD1-CZ3 3.48Å; I81-W215 VanDerWaalsContact CD1-CZ3 3.48Å; I81-W215 HydrophobicContact CG1-CD2 4.3Å; I81-W215 HydrophobicContact CG1-CE3 3.73Å; I81-W215 HydrophobicContact CG1-CH2 4.26Å; I81-W215 HydrophobicContact CG1-CZ3 3.7Å; I81-R216 PolarHBondContact O-N 3.28Å; I81-L217 HydrophobicContact CB-CD1 4.49Å; I81-L217 HydrophobicContact CB-CD2 4.27Å; I81-L217 HydrophobicContact CB-CG 4.41Å; I81-L217 HydrophobicContact CG2-CD2 3.83Å; I81-L217 HydrophobicContact CG2-CG 4.49Å; I81-F222 HydrophobicContact CD1-CD2 4.2Å; I81-F246 HydrophobicContact CD1-CB 4.34Å; I81-F246 HydrophobicContact CD1-CD1 3.9Å; I81-F246 HydrophobicContact CD1-CG 4.2Å
82	G	91.3	Very high	93.3	Very high	2 Å²	2	31.1 Å²	31.1	2%	0.021	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	-163.5	179.3	0	0	0	0	0	112.7	Q92 L217	G82-Q92 WeakPolarHBondContact CA-O 3.41Å; G82-Q92 PolarHBondContact N-O 2.89Å; G82-L217 WeakPolarHBondContact O-CD2 3.4Å
83	P	92.2	Very high	93.2	Very high	60 Å²	60	31.1 Å²	31.1	39%	0.39	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	143.3	173.7	28.7	-34.9	0	0	0	111.6	Q92	P83-Q92 PolarHBondContact O-N 3.16Å
84	V	92.8	Very high	93.2	Very high	19 Å²	19	29.3 Å²	29.3	12%	0.115	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	121.7	168.4	-178.4	0	0	0	0	108	L172 L217 F220 L248	V84-L172 HydrophobicContact CG1-CD1 4.24Å; V84-L217 HydrophobicContact CG2-CD2 4.03Å; V84-F220 HydrophobicContact CB-CD2 3.87Å; V84-F220 HydrophobicContact CB-CE2 3.63Å; V84-F220 HydrophobicContact CB-CZ 4.5Å; V84-F220 HydrophobicContact CG1-CD2 4.37Å; V84-F220 HydrophobicContact CG1-CE2 3.73Å; V84-F220 HydrophobicContact CG1-CZ 4.14Å; V84-F220 HydrophobicContact CG2-CD2 3.95Å; V84-F220 HydrophobicContact CG2-CE2 4.16Å; V84-L248 HydrophobicContact CG2-CD1 4.05Å
85	S	90.9	Very high	93.1	Very high	39 Å²	39	29.3 Å²	29.3	27%	0.273	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	98.2	177.6	-179.9	0	0	0	0	109.9	I87 N88 M89 E90	S85-I87 PolarHBondContact O-N 3.44Å; S85-N88 PolarHBondContact O-N 3.27Å; S85-N88 PolarHBondContact OG-N 2.84Å; S85-M89 PolarHBondContact O-N 2.77Å; S85-M89 VanDerWaalsContact O-N 3.08Å; S85-E90 PolarHBondContact N-O 3.2Å; S85-E90 PolarHBondContact O-N 2.9Å
86	S	88.6	Confident	93.2	Very high	4 Å²	4	30.4 Å²	30.4	3%	0.028	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-24.4	175.9	-61.6	0	0	0	0	113	L172 P334	S86-L172 VanDerWaalsContact OG-CD1 3.26Å; S86-L172 WeakPolarHBondContact OG-CD1 3.27Å; S86-P334 WeakPolarHBondContact O-CB 3.48Å; S86-P334 VanDerWaalsContact O-CD 3.23Å; S86-P334 WeakPolarHBondContact O-CD 3.33Å; S86-P334 WeakPolarHBondContact O-CG 3.5Å
87	I	87	Confident	93.2	Very high	80 Å²	80	30.4 Å²	30.4	41%	0.41	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-44.5	175.2	-67	170.8	0	0	0	111.2	S85 T331	S85-I87 PolarHBondContact O-N 3.44Å; I87-T331 WeakPolarHBondContact CD1-O 3.36Å
88	N	89.7	Confident	93.3	Very high	85 Å²	85	27.3 Å²	27.3	46%	0.455	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-8	-173.3	-63.1	-7.7	0	0	0	113.2	S85 E90 K136	S85-N88 PolarHBondContact O-N 3.27Å; S85-N88 PolarHBondContact OG-N 2.84Å; N88-E90 HydrophobicContact CB-CG 3.76Å; N88-E90 VanDerWaalsContact CB-OE1 3.26Å; N88-E90 WeakPolarHBondContact CB-OE1 3.32Å; N88-E90 WeakPolarHBondContact CB-OE2 3.43Å; N88-E90 PolarHBondContact ND2-OE1 2.66Å; N88-K136 PolarHBondContact O-NZ 2.87Å
89	M	91.8	Very high	93.3	Very high	28 Å²	28	27.6 Å²	27.6	14%	0.138	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.8	55.7	-169.4	-60.1	-56.7	-166.2	0	0	111.9	S85 K136 E169 C170 L172 L174 P334	S85-M89 PolarHBondContact O-N 2.77Å; S85-M89 VanDerWaalsContact O-N 3.08Å; M89-K136 PolarHBondContact O-NZ 3.25Å; M89-E169 WeakPolarHBondContact O-CA 3.46Å; M89-E169 WeakPolarHBondContact O-CG 3.35Å; M89-C170 CarbonylContact C-O 3.4Å; M89-C170 WeakPolarHBondContact CA-O 3.37Å; M89-C170 WeakPolarHBondContact CB-O 3.25Å; M89-C170 PolarHBondContact O-N 2.87Å; M89-L172 HydrophobicContact CE-CB 4.36Å; M89-L172 HydrophobicContact SD-CB 3.71Å; M89-L172 HydrophobicContact SD-CD1 4.23Å; M89-L172 HydrophobicContact SD-CG 3.92Å; M89-L174 HydrophobicContact CE-CD1 4.44Å; M89-P334 HydrophobicContact CE-CB 4.39Å; M89-P334 HydrophobicContact CE-CG 3.85Å
90	E	94.6	Very high	93.5	Very high	40 Å²	40	26.4 Å²	26.4	19%	0.187	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	160.9	178.9	68.1	-153.2	-170.1	0	0	112.9	S85 N88 K136 A168	S85-E90 PolarHBondContact N-O 3.2Å; S85-E90 PolarHBondContact O-N 2.9Å; N88-E90 HydrophobicContact CB-CG 3.76Å; N88-E90 VanDerWaalsContact CB-OE1 3.26Å; N88-E90 WeakPolarHBondContact CB-OE1 3.32Å; N88-E90 WeakPolarHBondContact CB-OE2 3.43Å; N88-E90 PolarHBondContact ND2-OE1 2.66Å; E90-K136 HydrophobicContact CB-CD 4.29Å; E90-K136 WeakPolarHBondContact OE2-CD 3.38Å; E90-K136 IonicContact OE2-NZ 2.76Å; E90-K136 PolarHBondContact OE2-NZ 2.9Å; E90-A168 CarbonylContact C-O 3.13Å; E90-A168 WeakPolarHBondContact CA-O 3.45Å; E90-A168 WeakPolarHBondContact CB-O 3.37Å
91	Y	95.4	Very high	93.7	Very high	2 Å²	2	25.5 Å²	25.5	1%	0.008	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	147.7	171.6	70.8	-75.1	0	0	0	110.4	I81 I93 N167 A168 C170 C184 P185 F246	I81-Y91 HydrophobicContact CG2-CD2 4.26Å; Y91-I93 HydrophobicContact CD2-CB 4.38Å; Y91-I93 HydrophobicContact CE2-CB 4.11Å; Y91-I93 HydrophobicContact CE2-CD1 4.47Å; Y91-I93 HydrophobicContact CE2-CG2 4.25Å; Y91-N167 WeakPolarHBondContact O-CA 3.33Å; Y91-A168 HydrophobicContact CD1-CB 4.16Å; Y91-A168 WeakPolarHBondContact CD1-O 3.25Å; Y91-A168 HydrophobicContact CE1-CB 3.58Å; Y91-A168 PolarHBondContact N-O 2.85Å; Y91-A168 PolarHBondContact O-N 2.79Å; Y91-C170 HydrophobicContact CD1-CB 3.74Å; Y91-C170 HydrophobicContact CE1-CB 4.06Å; Y91-C184 HydrophobicContact CD1-CB 3.98Å; Y91-C184 HydrophobicContact CE1-CB 3.73Å; Y91-P185 VanDerWaalsContact OH-C 3.3Å; Y91-P185 PolarHBondContact OH-O 2.69Å; Y91-F246 HydrophobicContact CE2-CD2 4.28Å
92	Q	95.4	Very high	93.8	Very high	66 Å²	66	28.9 Å²	28.9	31%	0.308	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	141	172.8	-179.8	164.1	88.4	0	0	110.4	G82 P83 T165 I166 N167	G82-Q92 WeakPolarHBondContact CA-O 3.41Å; G82-Q92 PolarHBondContact N-O 2.89Å; P83-Q92 PolarHBondContact O-N 3.16Å; Q92-T165 HydrophobicContact CG-CG2 3.87Å; Q92-I166 CarbonylContact C-O 3.44Å; Q92-I166 WeakPolarHBondContact CA-O 3.46Å; Q92-N167 WeakPolarHBondContact CB-OD1 3.34Å; Q92-N167 WeakPolarHBondContact CG-OD1 3.28Å; Q92-N167 PolarHBondContact NE2-OD1 2.92Å
93	I	95.4	Very high	94	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	140.2	172.1	-165.7	174.6	0	0	0	110.8	V78 I81 Y91 I95 T165 I166 F246	V78-I93 HydrophobicContact CG1-CD1 3.98Å; V78-I93 HydrophobicContact CG1-CG1 4.08Å; V78-I93 HydrophobicContact CG2-CD1 4.26Å; I81-I93 HydrophobicContact CG1-CD1 4.34Å; I81-I93 HydrophobicContact CG1-CG1 4.31Å; Y91-I93 HydrophobicContact CD2-CB 4.38Å; Y91-I93 HydrophobicContact CE2-CB 4.11Å; Y91-I93 HydrophobicContact CE2-CD1 4.47Å; Y91-I93 HydrophobicContact CE2-CG2 4.25Å; I93-I95 HydrophobicContact CD1-CG2 3.81Å; I93-I95 HydrophobicContact CG1-CG2 3.78Å; I93-I95 HydrophobicContact CG2-CG2 4.43Å; I93-T165 CarbonylContact O-C 3.59Å; I93-T165 WeakPolarHBondContact O-CA 3.33Å; I93-I166 HydrophobicContact CG2-CB 4.03Å; I93-I166 PolarHBondContact N-O 2.76Å; I93-I166 PolarHBondContact O-N 2.7Å; I93-F246 HydrophobicContact CD1-CD2 4.47Å; I93-F246 HydrophobicContact CD1-CE1 4.12Å; I93-F246 HydrophobicContact CD1-CE2 3.75Å; I93-F246 HydrophobicContact CD1-CZ 3.54Å
94	D	95.1	Very high	94	Very high	19 Å²	19	28.7 Å²	28.7	10%	0.102	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	116.4	174	-175.7	-23.7	0	0	0	108.3	N79 S80 R163	N79-D94 HydrophobicContact CB-CB 4.21Å; N79-D94 WeakPolarHBondContact CB-O 3.42Å; N79-D94 PolarHBondContact N-O 2.83Å; N79-D94 PolarHBondContact ND2-OD1 3.23Å; S80-D94 PolarHBondContact N-O 3.48Å; S80-D94 PolarHBondContact O-N 2.94Å; D94-R163 IonicContact OD1-CZ 3.89Å; D94-R163 IonicContact OD1-NE 2.76Å; D94-R163 PolarHBondContact OD1-NE 3.1Å; D94-R163 IonicContact OD1-NH2 3.76Å; D94-R163 IonicContact OD2-CZ 2.66Å; D94-R163 IonicContact OD2-NE 3.31Å; D94-R163 PolarHBondContact OD2-NE 2.66Å; D94-R163 IonicContact OD2-NH2 2.79Å; D94-R163 PolarHBondContact OD2-NH2 3.22Å
95	I	95.6	Very high	94.1	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	148.6	-176.5	66.8	175.5	0	0	0	111.7	I76 F77 V78 I93 F97 F132 R163 L164 I166 L186	I76-I95 HydrophobicContact CG2-CB 4.18Å; I76-I95 HydrophobicContact CG2-CD1 4.27Å; I76-I95 HydrophobicContact CG2-CG2 4.14Å; F77-I95 CarbonylContact O-C 3.6Å; F77-I95 WeakPolarHBondContact O-CA 3.28Å; V78-I95 HydrophobicContact CG2-CG2 4.2Å; I93-I95 HydrophobicContact CD1-CG2 3.81Å; I93-I95 HydrophobicContact CG1-CG2 3.78Å; I93-I95 HydrophobicContact CG2-CG2 4.43Å; I95-F97 HydrophobicContact CD1-CB 4.18Å; I95-F97 HydrophobicContact CD1-CD2 4.28Å; I95-F97 HydrophobicContact CG1-CB 4.49Å; I95-F132 HydrophobicContact CD1-CE1 4.26Å; I95-F132 HydrophobicContact CD1-CZ 4.03Å; I95-R163 WeakPolarHBondContact O-CA 3.15Å; I95-L164 HydrophobicContact CG1-CB 4.16Å; I95-L164 PolarHBondContact N-O 2.9Å; I95-L164 PolarHBondContact O-N 3.1Å; I95-I166 HydrophobicContact CD1-CD1 3.79Å; I95-I166 HydrophobicContact CG1-CD1 4.32Å; I95-L186 HydrophobicContact CD1-CD2 4.25Å
96	I	95.6	Very high	94.1	Very high	58 Å²	58	30 Å²	30	30%	0.297	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	111.5	155.4	-58.2	177.8	0	0	0	106.3	F77 T161	F77-I96 HydrophobicContact CB-CB 4.27Å; F77-I96 HydrophobicContact CD1-CD1 4.21Å; F77-I96 HydrophobicContact CD1-CG1 4.49Å; F77-I96 PolarHBondContact N-O 3.49Å; F77-I96 PolarHBondContact O-N 2.82Å; I96-T161 HydrophobicContact CG2-CG2 3.24Å
97	F	96.4	Very high	94.4	Very high	4 Å²	4	37.4 Å²	37.4	2%	0.018	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	127.6	177.7	-169.6	-114.5	0	0	0	108.8	V74 I76 I95 Q99 T130 F132 T161 L162 L164 F188	V74-F97 HydrophobicContact CG1-CD2 4.43Å; V74-F97 HydrophobicContact CG1-CE2 3.62Å; V74-F97 HydrophobicContact CG1-CZ 3.87Å; I76-F97 HydrophobicContact CD1-CD2 4.17Å; I76-F97 HydrophobicContact CD1-CE2 4.04Å; I76-F97 HydrophobicContact CG1-CD2 3.91Å; I76-F97 HydrophobicContact CG1-CE2 4.07Å; I95-F97 HydrophobicContact CD1-CB 4.18Å; I95-F97 HydrophobicContact CD1-CD2 4.28Å; I95-F97 HydrophobicContact CG1-CB 4.49Å; F97-Q99 HydrophobicContact CD1-CG 3.95Å; F97-Q99 VanDerWaalsContact CE1-CD 3.48Å; F97-Q99 HydrophobicContact CE1-CG 3.6Å; F97-Q99 HydrophobicContact CZ-CG 4.3Å; F97-T130 HydrophobicContact CE1-CG2 3.91Å; F97-T130 HydrophobicContact CZ-CG2 3.93Å; F97-F132 HydrophobicContact CD2-CZ 4.03Å; F97-F132 HydrophobicContact CE2-CZ 4.08Å; F97-F132 HydrophobicContact CG-CZ 4.28Å; F97-F132 HydrophobicContact CZ-CZ 4.34Å; F97-T161 WeakPolarHBondContact O-CA 3.45Å; F97-L162 HydrophobicContact CB-CD2 4.18Å; F97-L162 HydrophobicContact CD1-CD2 4.04Å; F97-L162 PolarHBondContact N-O 3.21Å; F97-L162 PolarHBondContact O-N 3.42Å; F97-L164 HydrophobicContact CB-CD1 4.3Å; F97-F188 HydrophobicContact CE2-CD2 4.2Å; F97-F188 HydrophobicContact CE2-CE1 4.26Å; F97-F188 AromaticContact CE2-CE2 3.91Å; F97-F188 HydrophobicContact CE2-CE2 3.91Å; F97-F188 HydrophobicContact CE2-CG 4.48Å; F97-F188 AromaticContact CE2-CZ 3.95Å; F97-F188 HydrophobicContact CE2-CZ 3.95Å; F97-F188 AromaticContact CZ-CD2 3.84Å; F97-F188 HydrophobicContact CZ-CD2 3.84Å; F97-F188 AromaticContact CZ-CE2 3.76Å; F97-F188 HydrophobicContact CZ-CE2 3.76Å; F97-F188 HydrophobicContact CZ-CG 4.41Å; F97-F188 HydrophobicContact CZ-CZ 4.27Å
98	A	95.6	Very high	94.6	Very high	12 Å²	12	34.6 Å²	34.6	10%	0.099	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	135.8	-176.2	0	0	0	0	0	111.3	D75 L159 Y160 T161	D75-A98 HydrophobicContact CB-CB 3.86Å; D75-A98 PolarHBondContact N-O 3.02Å; D75-A98 PolarHBondContact O-N 3.2Å; D75-A98 VanDerWaalsContact O-O 3.13Å; A98-L159 HydrophobicContact CB-CD1 4.24Å; A98-Y160 WeakPolarHBondContact CA-O 3.47Å; A98-T161 HydrophobicContact CB-CG2 4.18Å
99	Q	96.5	Very high	94.6	Very high	5 Å²	5	38.4 Å²	38.4	2%	0.023	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	133.6	-173.6	-57	-169.9	-71.4	0	0	109.8	I72 F97 W101 P128 T130 L159 Y160	I72-Q99 HydrophobicContact CG2-CB 4.08Å; F97-Q99 HydrophobicContact CD1-CG 3.95Å; F97-Q99 VanDerWaalsContact CE1-CD 3.48Å; F97-Q99 HydrophobicContact CE1-CG 3.6Å; F97-Q99 HydrophobicContact CZ-CG 4.3Å; Q99-W101 HydrophobicContact CB-CE3 4.38Å; Q99-W101 HydrophobicContact CB-CZ3 4.12Å; Q99-P128 VanDerWaalsContact OE1-CG 3.31Å; Q99-T130 PolarHBondContact NE2-OG1 3.26Å; Q99-L159 WeakPolarHBondContact O-CA 2.92Å; Q99-Y160 PolarHBondContact N-O 2.87Å; Q99-Y160 PolarHBondContact O-N 2.87Å
100	T	96.6	Very high	94.3	Very high	8 Å²	8	38.4 Å²	38.4	5%	0.049	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	123.3	-176.1	-61.1	0	0	0	0	110.6	I72 D73 K157 I158 L159	I72-T100 CarbonylContact C-O 3.6Å; I72-T100 WeakPolarHBondContact CA-O 3.26Å; D73-T100 PolarHBondContact N-O 3.04Å; D73-T100 PolarHBondContact O-N 3.07Å; T100-K157 HydrophobicContact CG2-CD 4.26Å; T100-K157 HydrophobicContact CG2-CG 4.12Å; T100-I158 VanDerWaalsContact CA-O 3.26Å; T100-I158 WeakPolarHBondContact CA-O 3.38Å; T100-L159 WeakPolarHBondContact OG1-CD1 3.48Å
101	W	96.6	Very high	93.9	Very high	4 Å²	4	42.7 Å²	42.7	2%	0.015	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	-178.1	174.8	68.6	97.4	0	0	0	110.7	I72 Q99 I125 W126 L127 P128 K157 I158 Y160	I72-W101 HydrophobicContact CG1-CB 4.25Å; Q99-W101 HydrophobicContact CB-CE3 4.38Å; Q99-W101 HydrophobicContact CB-CZ3 4.12Å; W101-I125 HydrophobicContact CZ2-CD1 4.42Å; W101-W126 HydrophobicContact CD2-CZ3 4.38Å; W101-W126 HydrophobicContact CG-CZ3 4.46Å; W101-W126 HydrophobicContact CZ2-CE3 4.35Å; W101-W126 HydrophobicContact CZ2-CZ3 4.49Å; W101-W126 WeakPolarHBondContact CZ2-O 3.38Å; W101-W126 AromaticContact NE1-CE3 3.86Å; W101-W126 AromaticContact NE1-CZ3 3.83Å; W101-L127 HydrophobicContact CH2-CD2 3.9Å; W101-L127 HydrophobicContact CZ2-CD2 4.31Å; W101-P128 HydrophobicContact CZ3-CG 4.33Å; W101-K157 WeakPolarHBondContact O-CA 3.48Å; W101-I158 HydrophobicContact CD2-CB 4.32Å; W101-I158 HydrophobicContact CH2-CG2 3.94Å; W101-I158 HydrophobicContact CZ2-CB 4.25Å; W101-I158 HydrophobicContact CZ2-CD1 4.29Å; W101-I158 HydrophobicContact CZ2-CG2 3.75Å; W101-I158 HydrophobicContact CZ3-CG2 4.41Å; W101-I158 PolarHBondContact N-O 3.33Å; W101-I158 VanDerWaalsContact N-O 3.1Å; W101-I158 PolarHBondContact O-N 2.77Å; W101-Y160 HydrophobicContact CH2-CG 4.48Å
102	T	96.1	Very high	93.4	Very high	72 Å²	72	44.3 Å²	44.3	44%	0.442	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	129.2	172.2	-55.5	0	0	0	0	109.1	G156	T102-G156 CarbonylContact C-O 3.6Å; T102-G156 WeakPolarHBondContact CA-O 3.47Å
103	D	95.8	Very high	93.1	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.246	C	C	.	.			trans	-112.5	113.7	168.2	-167	-24.2	0	0	0	109.3	Y57 P63 R105 L106 G156 I158	Y57-D103 WeakPolarHBondContact CE2-OD2 3.46Å; Y57-D103 PolarHBondContact OH-OD2 3.27Å; P63-D103 HydrophobicContact CB-CB 4.26Å; P63-D103 HydrophobicContact CG-CB 3.96Å; D103-R105 PolarHBondContact O-N 3.24Å; D103-R105 VanDerWaalsContact O-N 3.16Å; D103-R105 VanDerWaalsContact OD1-CB 3.28Å; D103-R105 WeakPolarHBondContact OD1-CB 3.45Å; D103-R105 WeakPolarHBondContact OD1-CG 3.23Å; D103-R105 IonicContact OD1-CZ 2.67Å; D103-R105 PolarHBondContact OD1-N 2.84Å; D103-R105 IonicContact OD1-NE 3.63Å; D103-R105 PolarHBondContact OD1-NE 3.27Å; D103-R105 IonicContact OD1-NH2 3.12Å; D103-R105 IonicContact OD2-CZ 3.76Å; D103-R105 IonicContact OD2-NE 3.29Å; D103-R105 PolarHBondContact OD2-NE 3.36Å; D103-R105 IonicContact OD2-NH2 2.79Å; D103-R105 PolarHBondContact OD2-NH2 2.93Å; D103-L106 HydrophobicContact CB-CB 4.39Å; D103-L106 HydrophobicContact CB-CD1 4.22Å; D103-L106 PolarHBondContact O-N 2.83Å; D103-L106 VanDerWaalsContact O-N 3.16Å; D103-G156 PolarHBondContact N-O 3.11Å; D103-I158 HydrophobicContact CB-CD1 3.81Å
104	S	92.7	Very high	92.9	Very high	57 Å²	57	52 Å²	52	40%	0.399	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-60.1	-23.3	-179.5	51.5	0	0	0	0	113	D64 R107	D64-S104 PolarHBondContact OD1-OG 2.81Å; S104-R107 WeakPolarHBondContact O-CD 3.37Å; S104-R107 WeakPolarHBondContact O-CG 3.47Å
105	R	93.9	Very high	92.7	Very high	83 Å²	83	51.5 Å²	51.5	31%	0.313	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-79.6	-25.5	179.3	-56.4	170.6	-70.5	-176.5	-2.8	113.6	Y57 D58 L61 D103 R107	Y57-R105 HydrophobicContact CD2-CB 3.99Å; Y57-R105 HydrophobicContact CE2-CB 3.94Å; Y57-R105 PolarHBondContact OH-NH2 3.19Å; Y57-R105 VanDerWaalsContact OH-NH2 3.16Å; D58-R105 PolarHBondContact O-NH1 2.93Å; L61-R105 PolarHBondContact O-NH1 2.96Å; L61-R105 VanDerWaalsContact O-NH1 3.07Å; L61-R105 PolarHBondContact O-NH2 3.47Å; D103-R105 PolarHBondContact O-N 3.24Å; D103-R105 VanDerWaalsContact O-N 3.16Å; D103-R105 VanDerWaalsContact OD1-CB 3.28Å; D103-R105 WeakPolarHBondContact OD1-CB 3.45Å; D103-R105 WeakPolarHBondContact OD1-CG 3.23Å; D103-R105 IonicContact OD1-CZ 2.67Å; D103-R105 PolarHBondContact OD1-N 2.84Å; D103-R105 IonicContact OD1-NE 3.63Å; D103-R105 PolarHBondContact OD1-NE 3.27Å; D103-R105 IonicContact OD1-NH2 3.12Å; D103-R105 IonicContact OD2-CZ 3.76Å; D103-R105 IonicContact OD2-NE 3.29Å; D103-R105 PolarHBondContact OD2-NE 3.36Å; D103-R105 IonicContact OD2-NH2 2.79Å; D103-R105 PolarHBondContact OD2-NH2 2.93Å; R105-R107 VanDerWaalsContact C-N 3.3Å; R105-R107 PolarHBondContact O-N 3.01Å
106	L	92.8	Very high	92.5	Very high	2 Å²	2	55.2 Å²	55.2	1%	0.01	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-95.6	21.9	-175.2	-69.7	168	0	0	0	113	L53 Y57 D103 I125 I152 I158	L53-L106 HydrophobicContact CB-CD2 4.12Å; Y57-L106 HydrophobicContact CD2-CD1 4.47Å; Y57-L106 HydrophobicContact CD2-CD2 3.95Å; Y57-L106 HydrophobicContact CD2-CG 4.05Å; Y57-L106 HydrophobicContact CE2-CD1 3.67Å; Y57-L106 HydrophobicContact CE2-CD2 3.97Å; Y57-L106 HydrophobicContact CE2-CG 3.6Å; D103-L106 HydrophobicContact CB-CB 4.39Å; D103-L106 HydrophobicContact CB-CD1 4.22Å; D103-L106 PolarHBondContact O-N 2.83Å; D103-L106 VanDerWaalsContact O-N 3.16Å; L106-I125 HydrophobicContact CD1-CB 4.35Å; L106-I125 HydrophobicContact CD1-CG2 3.85Å; L106-I152 HydrophobicContact CB-CG2 4.41Å; L106-I158 HydrophobicContact CB-CD1 4.43Å; L106-I158 HydrophobicContact CD1-CD1 3.55Å
107	R	93.1	Very high	92.2	Very high	161 Å²	161	53.5 Å²	53.5	61%	0.608	28%	0.276	S	S	*	.			trans	-81.2	130	175.2	-64.4	-177	65.8	-153	-3.2	110.5	S104 R105 D155	S104-R107 WeakPolarHBondContact O-CD 3.37Å; S104-R107 WeakPolarHBondContact O-CG 3.47Å; R105-R107 VanDerWaalsContact C-N 3.3Å; R105-R107 PolarHBondContact O-N 3.01Å; R107-D155 WeakPolarHBondContact CG-O 3.35Å
108	Y	91.3	Very high	91.7	Very high	20 Å²	20	58.5 Å²	58.5	8%	0.078	30%	0.303	C	S	.	.			trans	-132.6	148.1	178.1	65.7	-83.6	0	0	0	110.7	I49 L53 M112 K113 I114 L115 I152 N154	I49-Y108 HydrophobicContact CD1-CD2 4.47Å; I49-Y108 HydrophobicContact CG2-CD2 3.8Å; I49-Y108 HydrophobicContact CG2-CG 3.82Å; L53-Y108 HydrophobicContact CD1-CD1 3.99Å; L53-Y108 HydrophobicContact CD1-CG 4.37Å; Y108-M112 WeakPolarHBondContact CE2-O 3.4Å; Y108-M112 PolarHBondContact OH-O 3.11Å; Y108-K113 PolarHBondContact OH-O 3.25Å; Y108-I114 PolarHBondContact OH-N 3.01Å; Y108-L115 HydrophobicContact CD1-CD1 4.36Å; Y108-L115 HydrophobicContact CE1-CD1 3.95Å; Y108-L115 HydrophobicContact CE1-CG 4.13Å; Y108-L115 HydrophobicContact CE2-CG 4.43Å; Y108-I152 HydrophobicContact CE1-CG2 4.37Å; Y108-N154 HydrophobicContact CD2-CB 4.42Å; Y108-N154 HydrophobicContact CE1-CB 4.09Å; Y108-N154 HydrophobicContact CE2-CB 3.96Å; Y108-N154 WeakPolarHBondContact O-CB 3.45Å
109	N	89.4	Confident	91.2	Very high	166 Å²	166	58.6 Å²	58.6	89%	0.888	30%	0.303	S	S	*	.			trans	-105.1	108.4	177.3	-169.7	15.9	0	0	0	109.5
110	S	86.3	Confident	90.7	Very high	28 Å²	28	64.2 Å²	64.2	20%	0.196	33%	0.333	C	S	.	.	S	Bend	trans	-155.4	165.7	-178.7	178.6	0	0	0	0	110.3	M112	S110-M112 PolarHBondContact O-N 3.03Å; S110-M112 PolarHBondContact OG-N 3.26Å
111	T	86.3	Confident	90.2	Very high	130 Å²	130	65.1 Å²	65.1	80%	0.798	34%	0.337	S	S	*	.	S	Bend	trans	-64.6	-26.5	169.8	55.7	0	0	0	0	112.2	K113	T111-K113 PolarHBondContact O-N 3.07Å
112	M	85.1	Confident	89.8	Confident	35 Å²	35	65.1 Å²	65.1	17%	0.172	34%	0.338	C	S	.	.			trans	-77.3	117.4	176.5	-60.7	-164.8	-165	0	0	111.9	Q42 T46 Y108 S110 L115	Q42-M112 HydrophobicContact CG-CE 3.34Å; T46-M112 HydrophobicContact CG2-CE 3.59Å; T46-M112 HydrophobicContact CG2-SD 3.54Å; T46-M112 VanDerWaalsContact CG2-SD 3.54Å; Y108-M112 WeakPolarHBondContact CE2-O 3.4Å; Y108-M112 PolarHBondContact OH-O 3.11Å; S110-M112 PolarHBondContact O-N 3.03Å; S110-M112 PolarHBondContact OG-N 3.26Å; M112-L115 HydrophobicContact SD-CD2 4.31Å
113	K	88.1	Confident	89.4	Confident	153 Å²	153	63.9 Å²	63.9	67%	0.665	34%	0.339	S	S	*	.	S	Bend	trans	-78.4	-24.4	179.9	-63.6	-174.5	-178.9	-179.1	0	114.7	Y108 T111 W153 N154	Y108-K113 PolarHBondContact OH-O 3.25Å; T111-K113 PolarHBondContact O-N 3.07Å; K113-W153 WeakPolarHBondContact O-CA 3.33Å; K113-N154 PolarHBondContact O-N 2.85Å; K113-N154 VanDerWaalsContact O-N 3.13Å
114	I	92.1	Very high	89.2	Confident	74 Å²	74	67.6 Å²	67.6	38%	0.379	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	125.2	-175.6	-46.8	179.4	0	0	0	109.3	Y108 R151 I152 W153	Y108-I114 PolarHBondContact OH-N 3.01Å; I114-R151 HydrophobicContact CG2-CB 4.11Å; I114-R151 HydrophobicContact CG2-CG 4.44Å; I114-I152 CarbonylContact C-O 3.57Å; I114-I152 WeakPolarHBondContact CA-O 3.42Å; I114-W153 HydrophobicContact CD1-CZ2 4.15Å; I114-W153 HydrophobicContact CG1-CD2 4.37Å; I114-W153 HydrophobicContact CG1-CG 4.17Å; I114-W153 HydrophobicContact CG2-CD2 4.4Å
115	L	90.8	Very high	89.2	Confident	10 Å²	10	65.2 Å²	65.2	5%	0.052	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	121.1	162.8	-60.8	174.4	0	0	0	108.2	T46 I49 L53 Y108 M112 L117 R151 I152	T46-L115 HydrophobicContact CG2-CD2 4.09Å; I49-L115 HydrophobicContact CG2-CD1 4.07Å; L53-L115 HydrophobicContact CD1-CD1 4.5Å; Y108-L115 HydrophobicContact CD1-CD1 4.36Å; Y108-L115 HydrophobicContact CE1-CD1 3.95Å; Y108-L115 HydrophobicContact CE1-CG 4.13Å; Y108-L115 HydrophobicContact CE2-CG 4.43Å; M112-L115 HydrophobicContact SD-CD2 4.31Å; L115-L117 HydrophobicContact CB-CD2 4.39Å; L115-L117 HydrophobicContact CB-CG 4.3Å; L115-R151 VanDerWaalsContact O-CA 3.3Å; L115-R151 WeakPolarHBondContact O-CA 3.44Å; L115-I152 PolarHBondContact N-O 2.89Å; L115-I152 PolarHBondContact O-N 2.59Å
116	T	91.4	Very high	89.3	Confident	78 Å²	78	61.6 Å²	61.6	48%	0.479	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	124.7	169.3	-62.1	0	0	0	0	108.3	L149 R151	T116-L149 HydrophobicContact CG2-CD1 3.76Å; T116-R151 HydrophobicContact CG2-CG 4.13Å; T116-R151 PolarHBondContact OG1-NE 3.43Å
117	L	88.6	Confident	89.4	Confident	22 Å²	22	64 Å²	64	12%	0.115	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	145.3	-166.2	-60.5	174.1	0	0	0	111.3	L50 L115 M121 L150 I152	L50-L117 HydrophobicContact CD1-CD1 4.16Å; L50-L117 HydrophobicContact CD1-CD2 4.46Å; L50-L117 HydrophobicContact CD2-CD2 4.46Å; L115-L117 HydrophobicContact CB-CD2 4.39Å; L115-L117 HydrophobicContact CB-CG 4.3Å; L117-M121 HydrophobicContact CB-CB 4.07Å; L117-M121 HydrophobicContact CB-CG 3.98Å; L117-M121 HydrophobicContact CD1-CB 4.2Å; L117-M121 HydrophobicContact CD1-CG 4.13Å; L117-M121 HydrophobicContact CD2-CG 4.3Å; L117-M121 HydrophobicContact CG-CG 4.36Å; L117-L150 HydrophobicContact CB-CB 4.21Å; L117-L150 HydrophobicContact CB-CD2 4.31Å; L117-L150 HydrophobicContact CB-CG 4.42Å; L117-L150 HydrophobicContact CD1-CD2 4.09Å; L117-L150 PolarHBondContact N-O 3.24Å; L117-L150 PolarHBondContact O-N 2.95Å; L117-I152 HydrophobicContact CD1-CD1 3.78Å; L117-I152 HydrophobicContact CD1-CG1 4.2Å
118	N	85.9	Confident	89.6	Confident	108 Å²	108	56.9 Å²	56.9	58%	0.578	32%	0.315	S	S	*	.			trans	-80.3	167.6	178.3	-65.5	-8	0	0	0	112	N120 M121	N118-N120 PolarHBondContact O-N 2.89Å; N118-M121 PolarHBondContact O-N 2.86Å
119	S	85.8	Confident	89.8	Confident	14 Å²	14	58.1 Å²	58.1	10%	0.098	32%	0.323	C	S	.	.	H	α-helix	trans	-44.5	-33.2	178.4	57.1	0	0	0	0	115.5	M121 V122	S119-M121 PolarHBondContact O-N 3.11Å; S119-M121 VanDerWaalsContact O-N 3.1Å; S119-V122 VanDerWaalsContact O-CB 3.29Å; S119-V122 WeakPolarHBondContact O-CB 3.32Å; S119-V122 PolarHBondContact O-N 2.99Å
120	N	85.3	Confident	90.1	Very high	124 Å²	124	51.6 Å²	51.6	66%	0.663	29%	0.289	S	S	*	.	H	α-helix	trans	-57.5	-28.1	-179.7	-61.9	1.3	0	0	0	113	N118	N118-N120 PolarHBondContact O-N 2.89Å
121	M	86.6	Confident	90.5	Very high	26 Å²	26	53 Å²	53	13%	0.128	29%	0.294	C	S	.	.	H	α-helix	trans	-82.9	-24.7	178.8	-65.3	-55.4	-54.9	0	0	113.6	L50 L54 L117 N118 S119 G123 L124 L150	L50-M121 HydrophobicContact CD1-CE 3.61Å; L50-M121 HydrophobicContact CD2-CE 3.81Å; L50-M121 HydrophobicContact CD2-SD 3.81Å; L50-M121 HydrophobicContact CG-CE 3.8Å; L50-M121 HydrophobicContact CG-SD 4.45Å; L54-M121 HydrophobicContact CD1-CE 3.71Å; L54-M121 HydrophobicContact CG-CE 4.46Å; L117-M121 HydrophobicContact CB-CB 4.07Å; L117-M121 HydrophobicContact CB-CG 3.98Å; L117-M121 HydrophobicContact CD1-CB 4.2Å; L117-M121 HydrophobicContact CD1-CG 4.13Å; L117-M121 HydrophobicContact CD2-CG 4.3Å; L117-M121 HydrophobicContact CG-CG 4.36Å; N118-M121 PolarHBondContact O-N 2.86Å; S119-M121 PolarHBondContact O-N 3.11Å; S119-M121 VanDerWaalsContact O-N 3.1Å; M121-G123 PolarHBondContact O-N 3.35Å; M121-L124 HydrophobicContact CE-CD1 4.12Å; M121-L124 PolarHBondContact O-N 2.86Å; M121-L124 HydrophobicContact SD-CD1 4.1Å; M121-L150 HydrophobicContact CB-CD2 3.9Å
122	V	88.3	Confident	91.1	Very high	5 Å²	5	47.8 Å²	47.8	3%	0.03	26%	0.26	C	S	.	.	H	α-helix	trans	-59.4	-39.1	-178.9	176.1	0	0	0	0	110.3	S119 L124 L127 Q148 L150 Y160	S119-V122 VanDerWaalsContact O-CB 3.29Å; S119-V122 WeakPolarHBondContact O-CB 3.32Å; S119-V122 PolarHBondContact O-N 2.99Å; V122-L124 PolarHBondContact O-N 2.96Å; V122-L127 HydrophobicContact CG1-CD1 3.54Å; V122-L127 HydrophobicContact CG1-CD2 4.28Å; V122-Q148 HydrophobicContact CG2-CB 4.35Å; V122-L150 HydrophobicContact CG2-CB 4.11Å; V122-L150 HydrophobicContact CG2-CD2 4.46Å; V122-Y160 HydrophobicContact CB-CE2 4.48Å; V122-Y160 HydrophobicContact CG1-CD2 4.35Å; V122-Y160 HydrophobicContact CG1-CE2 3.59Å; V122-Y160 HydrophobicContact CG2-CD2 4.34Å; V122-Y160 HydrophobicContact CG2-CE2 3.97Å
123	G	87.5	Confident	91.5	Very high	46 Å²	46	50.7 Å²	50.7	47%	0.474	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-4.2	177.1	0	0	0	0	0	115.9	K59 M121	K59-G123 PolarHBondContact NZ-O 2.94Å; M121-G123 PolarHBondContact O-N 3.35Å
124	L	91.6	Very high	91.9	Very high	77 Å²	77	44.4 Å²	44.4	40%	0.403	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.1	-20.5	-177.6	-61	179	0	0	0	113.8	L54 M121 V122	L54-L124 HydrophobicContact CD1-CB 4.47Å; L54-L124 HydrophobicContact CD1-CD1 3.85Å; L54-L124 HydrophobicContact CD2-CB 4.17Å; M121-L124 HydrophobicContact CE-CD1 4.12Å; M121-L124 PolarHBondContact O-N 2.86Å; M121-L124 HydrophobicContact SD-CD1 4.1Å; V122-L124 PolarHBondContact O-N 2.96Å
125	I	94.1	Very high	92.1	Very high	8 Å²	8	42.7 Å²	42.7	4%	0.041	24%	0.237	C	C	.	.	S	Bend	trans	-96	167.7	176.9	61.3	162.8	0	0	0	112.2	Y57 W101 L106 L127 L150	Y57-I125 HydrophobicContact CE1-CB 4.29Å; W101-I125 HydrophobicContact CZ2-CD1 4.42Å; L106-I125 HydrophobicContact CD1-CB 4.35Å; L106-I125 HydrophobicContact CD1-CG2 3.85Å; I125-L127 HydrophobicContact CD1-CD2 3.83Å; I125-L127 HydrophobicContact CG1-CD2 3.96Å; I125-L127 HydrophobicContact CG1-CG 4.47Å; I125-L150 HydrophobicContact CD1-CD1 3.61Å; I125-L150 HydrophobicContact CD1-CD2 3.76Å; I125-L150 HydrophobicContact CD1-CG 4.36Å; I125-L150 HydrophobicContact CG1-CD2 4.39Å
126	W	95.5	Very high	92.3	Very high	6 Å²	6	46.4 Å²	46.4	2%	0.023	25%	0.253	C	S	.	.			trans	-72.2	143	166.1	175.8	90.6	0	0	0	109.5	Y57 K59 R62 P63 T70 I72 W101 P128 Y193 M198	Y57-W126 HydrophobicContact CE1-CB 4.5Å; Y57-W126 WeakPolarHBondContact OH-CB 3.47Å; Y57-W126 PolarHBondContact OH-N 2.94Å; Y57-W126 VanDerWaalsContact OH-N 3.11Å; K59-W126 WeakPolarHBondContact O-CB 3.48Å; R62-W126 HydrophobicContact CB-CD2 4.4Å; R62-W126 HydrophobicContact CB-CH2 4.48Å; R62-W126 HydrophobicContact CB-CZ2 3.66Å; P63-W126 VanDerWaalsContact CD-CE3 3.42Å; P63-W126 HydrophobicContact CG-CD2 4.46Å; P63-W126 HydrophobicContact CG-CE3 3.89Å; P63-W126 HydrophobicContact CG-CZ3 4.09Å; T70-W126 HydrophobicContact CG2-CH2 4.16Å; T70-W126 HydrophobicContact CG2-CZ3 4.34Å; I72-W126 HydrophobicContact CD1-CH2 4.44Å; W101-W126 HydrophobicContact CD2-CZ3 4.38Å; W101-W126 HydrophobicContact CG-CZ3 4.46Å; W101-W126 HydrophobicContact CZ2-CE3 4.35Å; W101-W126 HydrophobicContact CZ2-CZ3 4.49Å; W101-W126 WeakPolarHBondContact CZ2-O 3.38Å; W101-W126 AromaticContact NE1-CE3 3.86Å; W101-W126 AromaticContact NE1-CZ3 3.83Å; W126-P128 HydrophobicContact CH2-CB 4.05Å; W126-P128 HydrophobicContact CZ3-CB 4.49Å; W126-Y193 HydrophobicContact CZ2-CD2 4.38Å; W126-Y193 AromaticContact CZ2-CE2 3.71Å; W126-Y193 HydrophobicContact CZ2-CE2 3.71Å; W126-Y193 AromaticContact NE1-CE2 3.99Å; W126-Y193 AromaticContact NE1-CZ 3.79Å; W126-Y193 PolarHBondContact NE1-OH 3.31Å; W126-M198 HydrophobicContact CH2-SD 3.67Å; W126-M198 HydrophobicContact CZ2-SD 3.98Å
127	L	95.1	Very high	92.4	Very high	52 Å²	52	45.8 Å²	45.8	27%	0.272	25%	0.249	S	C	.	.			trans	-133	148.9	176.5	-59.3	172.2	0	0	0	109.2	W101 V122 I125 Y160	W101-L127 HydrophobicContact CH2-CD2 3.9Å; W101-L127 HydrophobicContact CZ2-CD2 4.31Å; V122-L127 HydrophobicContact CG1-CD1 3.54Å; V122-L127 HydrophobicContact CG1-CD2 4.28Å; I125-L127 HydrophobicContact CD1-CD2 3.83Å; I125-L127 HydrophobicContact CG1-CD2 3.96Å; I125-L127 HydrophobicContact CG1-CG 4.47Å; L127-Y160 HydrophobicContact CD2-CD1 4.27Å; L127-Y160 HydrophobicContact CD2-CE1 4.47Å; L127-Y160 HydrophobicContact CD2-CG 4.34Å
128	P	96.3	Very high	92.7	Very high	13 Å²	13	47 Å²	47	8%	0.084	26%	0.262	C	S	.	.			trans	-69.2	143.1	172.5	31.5	-37.1	0	0	0	112	I72 Q99 W101 W126 T130 M198	I72-P128 HydrophobicContact CD1-CB 3.42Å; I72-P128 VanDerWaalsContact CD1-CB 3.42Å; I72-P128 HydrophobicContact CD1-CG 3.84Å; Q99-P128 VanDerWaalsContact OE1-CG 3.31Å; W101-P128 HydrophobicContact CZ3-CG 4.33Å; W126-P128 HydrophobicContact CH2-CB 4.05Å; W126-P128 HydrophobicContact CZ3-CB 4.49Å; P128-T130 PolarHBondContact O-N 3.02Å; P128-M198 HydrophobicContact CB-CE 3.9Å; P128-M198 HydrophobicContact CB-SD 3.93Å
129	D	95.1	Very high	93.1	Very high	45 Å²	45	45.7 Å²	45.7	24%	0.241	26%	0.255	C	S	.	.			trans	-81.6	46.3	-177.1	66.9	-18.5	0	0	0	113	I131 S190 Y191 G192 Y193 M198	D129-I131 PolarHBondContact O-N 3.42Å; D129-S190 WeakPolarHBondContact OD1-CA 3.26Å; D129-S190 WeakPolarHBondContact OD1-CB 3.5Å; D129-Y191 PolarHBondContact O-N 2.75Å; D129-Y191 PolarHBondContact OD1-N 3.18Å; D129-Y191 PolarHBondContact OD2-N 3.38Å; D129-Y191 VanDerWaalsContact OD2-N 3.08Å; D129-G192 PolarHBondContact OD2-N 3.04Å; D129-Y193 WeakPolarHBondContact OD1-CD2 3.35Å; D129-Y193 PolarHBondContact OD2-N 2.89Å; D129-M198 WeakPolarHBondContact OD1-CE 3.26Å
130	T	96.3	Very high	93.4	Very high	29 Å²	29	47.7 Å²	47.7	18%	0.178	27%	0.269	C	S	.	.			trans	-74.5	118.2	-168	-48.1	0	0	0	0	111.7	F97 Q99 P128 F188 S189 Y200	F97-T130 HydrophobicContact CE1-CG2 3.91Å; F97-T130 HydrophobicContact CZ-CG2 3.93Å; Q99-T130 PolarHBondContact NE2-OG1 3.26Å; P128-T130 PolarHBondContact O-N 3.02Å; T130-F188 HydrophobicContact CG2-CB 4.39Å; T130-F188 HydrophobicContact CG2-CD2 3.91Å; T130-S189 CarbonylContact C-O 3.58Å; T130-S189 WeakPolarHBondContact CA-O 3.4Å; T130-Y200 HydrophobicContact CG2-CE1 4.13Å; T130-Y200 PolarHBondContact OG1-OH 2.94Å
131	I	95.9	Very high	93.7	Very high	58 Å²	58	44 Å²	44	30%	0.297	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	147.9	177.6	56.3	144.1	0	0	0	111.6	D129 R133 F188 S189 Y191	D129-I131 PolarHBondContact O-N 3.42Å; I131-R133 HydrophobicContact CD1-CG 4.04Å; I131-F188 WeakPolarHBondContact O-CA 3.45Å; I131-F188 VanDerWaalsContact O-CB 3.26Å; I131-F188 WeakPolarHBondContact O-CB 3.27Å; I131-S189 PolarHBondContact N-O 2.85Å; I131-S189 PolarHBondContact O-N 3.09Å; I131-Y191 HydrophobicContact CD1-CD2 3.97Å; I131-Y191 HydrophobicContact CG2-CD2 4.45Å
132	F	97.3	Very high	93.8	Very high	20 Å²	20	50.8 Å²	50.8	9%	0.088	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	113.1	168.3	-67.6	-88.5	0	0	0	108.6	I95 F97 N134 S135 L164 I166 L186 I187 F188	I95-F132 HydrophobicContact CD1-CE1 4.26Å; I95-F132 HydrophobicContact CD1-CZ 4.03Å; F97-F132 HydrophobicContact CD2-CZ 4.03Å; F97-F132 HydrophobicContact CE2-CZ 4.08Å; F97-F132 HydrophobicContact CG-CZ 4.28Å; F97-F132 HydrophobicContact CZ-CZ 4.34Å; F132-N134 VanDerWaalsContact C-N 3.32Å; F132-N134 PolarHBondContact O-N 3.03Å; F132-S135 PolarHBondContact O-N 3.11Å; F132-S135 PolarHBondContact O-OG 2.96Å; F132-L164 HydrophobicContact CE2-CD1 3.57Å; F132-L164 HydrophobicContact CZ-CD1 4.11Å; F132-I166 HydrophobicContact CD1-CD1 3.79Å; F132-I166 HydrophobicContact CD2-CD1 3.77Å; F132-I166 HydrophobicContact CE1-CD1 3.7Å; F132-I166 HydrophobicContact CE2-CD1 3.7Å; F132-I166 HydrophobicContact CG-CD1 3.82Å; F132-I166 HydrophobicContact CZ-CD1 3.67Å; F132-L186 HydrophobicContact CD1-CD1 3.65Å; F132-L186 HydrophobicContact CD1-CD2 4.44Å; F132-L186 HydrophobicContact CD1-CG 3.97Å; F132-L186 HydrophobicContact CE1-CD1 4.12Å; F132-L186 HydrophobicContact CE1-CD2 4.09Å; F132-L186 HydrophobicContact CE1-CG 4.07Å; F132-I187 CarbonylContact C-O 3.55Å; F132-I187 VanDerWaalsContact CA-O 3.28Å; F132-I187 WeakPolarHBondContact CA-O 3.48Å; F132-F188 HydrophobicContact CD1-CB 3.78Å; F132-F188 HydrophobicContact CD1-CD1 4.46Å; F132-F188 HydrophobicContact CD1-CG 4.48Å; F132-F188 HydrophobicContact CE1-CB 3.93Å; F132-F188 HydrophobicContact CE1-CD1 4.05Å; F132-F188 HydrophobicContact CE1-CG 4.18Å; F132-F188 HydrophobicContact CG-CB 4.31Å
133	R	94.8	Very high	93.9	Very high	97 Å²	97	56.5 Å²	56.5	37%	0.366	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-26.7	-171.3	-73.6	-169.6	177.1	-105.4	-6.4	113.6	I131 I187 S189	I131-R133 HydrophobicContact CD1-CG 4.04Å; R133-I187 HydrophobicContact CB-CB 4.33Å; R133-I187 HydrophobicContact CB-CG2 4.04Å; R133-I187 PolarHBondContact N-O 3.36Å; R133-S189 VanDerWaalsContact CZ-OG 3.29Å; R133-S189 PolarHBondContact NE-OG 2.82Å; R133-S189 PolarHBondContact NH2-OG 3.11Å
134	N	96.5	Very high	93.9	Very high	21 Å²	21	60.9 Å²	60.9	11%	0.112	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.1	15.7	177.7	73	-49.5	0	0	0	113.8	F132 A168 E169 P185 I187	F132-N134 VanDerWaalsContact C-N 3.32Å; F132-N134 PolarHBondContact O-N 3.03Å; N134-A168 CarbonylContact O-C 3.33Å; N134-A168 WeakPolarHBondContact O-CA 3.43Å; N134-E169 HydrophobicContact CB-CB 4.49Å; N134-E169 PolarHBondContact ND2-O 2.88Å; N134-E169 PolarHBondContact O-N 2.95Å; N134-P185 PolarHBondContact ND2-O 3Å; N134-I187 HydrophobicContact CB-CD1 4.49Å; N134-I187 PolarHBondContact OD1-N 3Å
135	S	96.4	Very high	93.7	Very high	37 Å²	37	61.9 Å²	61.9	26%	0.259	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	126.2	171.8	63.3	0	0	0	0	111.4	F132	F132-S135 PolarHBondContact O-N 3.11Å; F132-S135 PolarHBondContact O-OG 2.96Å
136	K	94.3	Very high	93.4	Very high	89 Å²	89	64.2 Å²	64.2	39%	0.387	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	-41.4	168.9	-71	166.9	170.2	168.5	0	111.4	N88 M89 E90 N167	N88-K136 PolarHBondContact O-NZ 2.87Å; M89-K136 PolarHBondContact O-NZ 3.25Å; E90-K136 HydrophobicContact CB-CD 4.29Å; E90-K136 WeakPolarHBondContact OE2-CD 3.38Å; E90-K136 IonicContact OE2-NZ 2.76Å; E90-K136 PolarHBondContact OE2-NZ 2.9Å; K136-N167 PolarHBondContact N-O 2.84Å
137	T	93.7	Very high	93.2	Very high	64 Å²	64	67.2 Å²	67.2	39%	0.393	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	148.7	165.4	75.3	0	0	0	0	109.3	N167	T137-N167 PolarHBondContact O-N 3.11Å; T137-N167 PolarHBondContact OG1-ND2 3.03Å
138	A	94.7	Very high	93.1	Very high	48 Å²	48	67.3 Å²	67.3	40%	0.397	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	112.5	177.2	0	0	0	0	0	108.9	I166	A138-I166 HydrophobicContact CB-CG1 4.31Å; A138-I166 HydrophobicContact CB-CG2 4.39Å
139	D	93.9	Very high	92.8	Very high	80 Å²	80	69.4 Å²	69.4	43%	0.428	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	125.7	-170.9	-62.4	-69	0	0	0	109.9	L164 T165	D139-L164 WeakPolarHBondContact O-CA 3.36Å; D139-T165 PolarHBondContact N-O 2.79Å; D139-T165 PolarHBondContact O-N 3.48Å
140	S	92.4	Very high	92.8	Very high	56 Å²	56	67.3 Å²	67.3	39%	0.392	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	145.2	172.7	60.6	0	0	0	0	110.7	W142	S140-W142 WeakPolarHBondContact O-CZ3 3.44Å
141	H	91.8	Very high	92.7	Very high	48 Å²	48	70.5 Å²	70.5	22%	0.222	36%	0.362	C	S	.	.			trans	-85.8	124.7	-174.4	-69.2	-129.7	0	0	0	111.1	N147 R163 T165	H141-N147 HydrophobicContact CB-CB 4.04Å; H141-N147 WeakPolarHBondContact CB-ND2 3.49Å; H141-N147 WeakPolarHBondContact O-CB 3.34Å; H141-N147 PolarHBondContact O-N 3.1Å; H141-R163 HydrophobicContact CB-CB 4.49Å; H141-R163 PolarHBondContact N-O 2.88Å; H141-T165 PolarHBondContact NE2-OG1 3.05Å
142	W	89.2	Confident	92.7	Very high	167 Å²	167	67.9 Å²	67.9	63%	0.633	35%	0.348	S	S	*	.			trans	-115.3	6.5	-174.7	60.2	74.6	0	0	0	116.1	S140 M145	S140-W142 WeakPolarHBondContact O-CZ3 3.44Å; W142-M145 CarbonylContact C-O 3.53Å; W142-M145 CarbonylContact O-C 3.56Å; W142-M145 VanDerWaalsContact O-C 3.32Å
143	I	89.3	Confident	92.6	Very high	125 Å²	125	70.2 Å²	70.2	64%	0.641	36%	0.357	S	S	*	.	S	Bend	trans	-111	132.2	-176.8	-55.6	-179.6	0	0	0	109.8	M145 N147	I143-M145 VanDerWaalsContact C-N 3.35Å; I143-M145 PolarHBondContact N-O 3.01Å; I143-N147 PolarHBondContact O-ND2 2.66Å; I143-N147 VanDerWaalsContact O-ND2 3.09Å
144	T	87.8	Confident	92.5	Very high	138 Å²	138	68.4 Å²	68.4	85%	0.847	35%	0.354	S	S	*	.	S	Bend	cis	-79.9	-13	-8.1	48.8	0	0	0	0	113.6
145	M	87.1	Confident	92.4	Very high	99 Å²	99	71.3 Å²	71.3	49%	0.488	37%	0.37	S	S	.	.	S	Bend	trans	-132.4	168.6	169.9	-66.4	-171.4	73.3	0	0	108.3	W142 I143 N147	W142-M145 CarbonylContact C-O 3.53Å; W142-M145 CarbonylContact O-C 3.56Å; W142-M145 VanDerWaalsContact O-C 3.32Å; I143-M145 VanDerWaalsContact C-N 3.35Å; I143-M145 PolarHBondContact N-O 3.01Å; M145-N147 PolarHBondContact O-N 2.96Å; M145-N147 VanDerWaalsContact O-N 3.11Å
146	P	89.1	Confident	92.3	Very high	57 Å²	57	69.5 Å²	69.5	37%	0.37	36%	0.357	S	S	.	.			trans	-54.4	118.7	169	-23.8	34.6	0	0	0	110.5	Q148	P146-Q148 HydrophobicContact CB-CG 4.46Å; P146-Q148 PolarHBondContact O-N 3.31Å
147	N	90.4	Very high	92.3	Very high	68 Å²	68	68.5 Å²	68.5	36%	0.364	35%	0.353	S	S	.	.			trans	-78.5	66.2	-177.3	-72.6	-45.9	0	0	0	110.3	H141 I143 M145 L162 R163	H141-N147 HydrophobicContact CB-CB 4.04Å; H141-N147 WeakPolarHBondContact CB-ND2 3.49Å; H141-N147 WeakPolarHBondContact O-CB 3.34Å; H141-N147 PolarHBondContact O-N 3.1Å; I143-N147 PolarHBondContact O-ND2 2.66Å; I143-N147 VanDerWaalsContact O-ND2 3.09Å; M145-N147 PolarHBondContact O-N 2.96Å; M145-N147 VanDerWaalsContact O-N 3.11Å; N147-L162 WeakPolarHBondContact O-CA 3.23Å; N147-R163 HydrophobicContact CB-CB 4.34Å; N147-R163 PolarHBondContact O-N 3.04Å; N147-R163 VanDerWaalsContact O-N 3.16Å
148	Q	92.3	Very high	92.4	Very high	54 Å²	54	65.4 Å²	65.4	25%	0.252	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	131.5	-178.9	-68.3	175.3	-10	0	0	108.6	V122 P146 Y160 T161 L162	V122-Q148 HydrophobicContact CG2-CB 4.35Å; P146-Q148 HydrophobicContact CB-CG 4.46Å; P146-Q148 PolarHBondContact O-N 3.31Å; Q148-Y160 HydrophobicContact CB-CE2 4.24Å; Q148-Y160 HydrophobicContact CG-CE2 4.31Å; Q148-Y160 PolarHBondContact NE2-OH 3.37Å; Q148-T161 CarbonylContact C-O 3.6Å; Q148-T161 WeakPolarHBondContact CA-O 3.4Å; Q148-L162 HydrophobicContact CG-CB 4.1Å
149	L	91.2	Very high	92.5	Very high	58 Å²	58	64.4 Å²	64.4	30%	0.304	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	131.9	176.5	178.3	65.4	0	0	0	109.1	T116 T161	T116-L149 HydrophobicContact CG2-CD1 3.76Å; L149-T161 PolarHBondContact N-O 2.85Å; L149-T161 PolarHBondContact O-N 2.87Å
150	L	94.4	Very high	92.6	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	130.9	173.8	-179.3	64	0	0	0	109.4	L117 M121 V122 I125 I152 I158	L117-L150 HydrophobicContact CB-CB 4.21Å; L117-L150 HydrophobicContact CB-CD2 4.31Å; L117-L150 HydrophobicContact CB-CG 4.42Å; L117-L150 HydrophobicContact CD1-CD2 4.09Å; L117-L150 PolarHBondContact N-O 3.24Å; L117-L150 PolarHBondContact O-N 2.95Å; M121-L150 HydrophobicContact CB-CD2 3.9Å; V122-L150 HydrophobicContact CG2-CB 4.11Å; V122-L150 HydrophobicContact CG2-CD2 4.46Å; I125-L150 HydrophobicContact CD1-CD1 3.61Å; I125-L150 HydrophobicContact CD1-CD2 3.76Å; I125-L150 HydrophobicContact CD1-CG 4.36Å; I125-L150 HydrophobicContact CG1-CD2 4.39Å; L150-I152 HydrophobicContact CD2-CD1 4.42Å; L150-I152 HydrophobicContact CG-CG1 4.31Å; L150-I158 HydrophobicContact CD1-CG2 3.61Å
151	R	94.8	Very high	92.7	Very high	96 Å²	96	59.8 Å²	59.8	36%	0.362	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	129.8	170.2	-68	-176	174.1	150.3	3.6	110.2	I114 L115 T116 W153 I158 L159	I114-R151 HydrophobicContact CG2-CB 4.11Å; I114-R151 HydrophobicContact CG2-CG 4.44Å; L115-R151 VanDerWaalsContact O-CA 3.3Å; L115-R151 WeakPolarHBondContact O-CA 3.44Å; T116-R151 HydrophobicContact CG2-CG 4.13Å; T116-R151 PolarHBondContact OG1-NE 3.43Å; R151-W153 HydrophobicContact CB-CE3 4.34Å; R151-W153 HydrophobicContact CB-CH2 4.01Å; R151-W153 HydrophobicContact CB-CZ3 3.65Å; R151-W153 WeakPolarHBondContact O-CZ3 3.38Å; R151-I158 CarbonylContact O-C 3.53Å; R151-I158 WeakPolarHBondContact O-CA 3.43Å; R151-L159 HydrophobicContact CB-CB 4.37Å; R151-L159 PolarHBondContact N-O 2.88Å; R151-L159 PolarHBondContact O-N 2.98Å
152	I	94.9	Very high	92.8	Very high	3 Å²	3	58.6 Å²	58.6	2%	0.015	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	125.5	178.1	-52.2	-178.8	0	0	0	107.9	L106 Y108 I114 L115 L117 L150 I158	L106-I152 HydrophobicContact CB-CG2 4.41Å; Y108-I152 HydrophobicContact CE1-CG2 4.37Å; I114-I152 CarbonylContact C-O 3.57Å; I114-I152 WeakPolarHBondContact CA-O 3.42Å; L115-I152 PolarHBondContact N-O 2.89Å; L115-I152 PolarHBondContact O-N 2.59Å; L117-I152 HydrophobicContact CD1-CD1 3.78Å; L117-I152 HydrophobicContact CD1-CG1 4.2Å; L150-I152 HydrophobicContact CD2-CD1 4.42Å; L150-I152 HydrophobicContact CG-CG1 4.31Å; I152-I158 HydrophobicContact CG1-CG1 4.37Å; I152-I158 HydrophobicContact CG2-CG1 4.37Å
153	W	95.9	Very high	93.1	Very high	70 Å²	70	55.1 Å²	55.1	27%	0.265	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	155.6	174.5	-76.6	-110.3	0	0	0	110.6	K113 I114 R151 D155 G156 K157 L159	K113-W153 WeakPolarHBondContact O-CA 3.33Å; I114-W153 HydrophobicContact CD1-CZ2 4.15Å; I114-W153 HydrophobicContact CG1-CD2 4.37Å; I114-W153 HydrophobicContact CG1-CG 4.17Å; I114-W153 HydrophobicContact CG2-CD2 4.4Å; R151-W153 HydrophobicContact CB-CE3 4.34Å; R151-W153 HydrophobicContact CB-CH2 4.01Å; R151-W153 HydrophobicContact CB-CZ3 3.65Å; R151-W153 WeakPolarHBondContact O-CZ3 3.38Å; W153-D155 WeakPolarHBondContact CB-OD1 3.37Å; W153-D155 PolarHBondContact O-N 2.93Å; W153-G156 PolarHBondContact O-N 2.83Å; W153-K157 HydrophobicContact CB-CB 4.17Å; W153-K157 PolarHBondContact N-O 2.88Å; W153-L159 HydrophobicContact CH2-CB 3.74Å; W153-L159 HydrophobicContact CH2-CD2 4.17Å; W153-L159 HydrophobicContact CZ3-CB 3.49Å; W153-L159 VanDerWaalsContact CZ3-CB 3.49Å
154	N	93.3	Very high	93.4	Very high	58 Å²	58	50 Å²	50	31%	0.31	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-18.9	179.1	68.4	-23.6	0	0	0	114.6	Y108 K113 G156	Y108-N154 HydrophobicContact CD2-CB 4.42Å; Y108-N154 HydrophobicContact CE1-CB 4.09Å; Y108-N154 HydrophobicContact CE2-CB 3.96Å; Y108-N154 WeakPolarHBondContact O-CB 3.45Å; K113-N154 PolarHBondContact O-N 2.85Å; K113-N154 VanDerWaalsContact O-N 3.13Å; N154-G156 PolarHBondContact O-N 2.94Å
155	D	94.2	Very high	93.8	Very high	82 Å²	82	44.6 Å²	44.6	44%	0.439	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-5.8	171.4	69.7	-10.2	0	0	0	113.9	R107 W153 K157	R107-D155 WeakPolarHBondContact CG-O 3.35Å; W153-D155 WeakPolarHBondContact CB-OD1 3.37Å; W153-D155 PolarHBondContact O-N 2.93Å; D155-K157 WeakPolarHBondContact OD1-CB 3.36Å; D155-K157 PolarHBondContact OD1-N 3.48Å
156	G	93.1	Very high	94.3	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.192	C	C	.	.	S	Bend	trans	88.6	5	-176	0	0	0	0	0	113.7	T102 D103 W153 N154	T102-G156 CarbonylContact C-O 3.6Å; T102-G156 WeakPolarHBondContact CA-O 3.47Å; D103-G156 PolarHBondContact N-O 3.11Å; W153-G156 PolarHBondContact O-N 2.83Å; N154-G156 PolarHBondContact O-N 2.94Å
157	K	95.6	Very high	94.7	Very high	67 Å²	67	38.9 Å²	38.9	29%	0.291	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	140.2	171.3	-170.4	169.8	-173.3	159.3	0	110.2	T100 W101 W153 D155	T100-K157 HydrophobicContact CG2-CD 4.26Å; T100-K157 HydrophobicContact CG2-CG 4.12Å; W101-K157 WeakPolarHBondContact O-CA 3.48Å; W153-K157 HydrophobicContact CB-CB 4.17Å; W153-K157 PolarHBondContact N-O 2.88Å; D155-K157 WeakPolarHBondContact OD1-CB 3.36Å; D155-K157 PolarHBondContact OD1-N 3.48Å
158	I	96.1	Very high	95	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	133.2	-178.6	-59.7	175.1	0	0	0	108.2	T100 W101 D103 L106 L150 R151 I152	T100-I158 VanDerWaalsContact CA-O 3.26Å; T100-I158 WeakPolarHBondContact CA-O 3.38Å; W101-I158 HydrophobicContact CD2-CB 4.32Å; W101-I158 HydrophobicContact CH2-CG2 3.94Å; W101-I158 HydrophobicContact CZ2-CB 4.25Å; W101-I158 HydrophobicContact CZ2-CD1 4.29Å; W101-I158 HydrophobicContact CZ2-CG2 3.75Å; W101-I158 HydrophobicContact CZ3-CG2 4.41Å; W101-I158 PolarHBondContact N-O 3.33Å; W101-I158 VanDerWaalsContact N-O 3.1Å; W101-I158 PolarHBondContact O-N 2.77Å; D103-I158 HydrophobicContact CB-CD1 3.81Å; L106-I158 HydrophobicContact CB-CD1 4.43Å; L106-I158 HydrophobicContact CD1-CD1 3.55Å; L150-I158 HydrophobicContact CD1-CG2 3.61Å; R151-I158 CarbonylContact O-C 3.53Å; R151-I158 WeakPolarHBondContact O-CA 3.43Å; I152-I158 HydrophobicContact CG1-CG1 4.37Å; I152-I158 HydrophobicContact CG2-CG1 4.37Å
159	L	95.6	Very high	95.2	Very high	26 Å²	26	36.7 Å²	36.7	14%	0.136	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	119	163.9	173.1	67.9	0	0	0	107.3	A98 Q99 T100 R151 W153	A98-L159 HydrophobicContact CB-CD1 4.24Å; Q99-L159 WeakPolarHBondContact O-CA 2.92Å; T100-L159 WeakPolarHBondContact OG1-CD1 3.48Å; R151-L159 HydrophobicContact CB-CB 4.37Å; R151-L159 PolarHBondContact N-O 2.88Å; R151-L159 PolarHBondContact O-N 2.98Å; W153-L159 HydrophobicContact CH2-CB 3.74Å; W153-L159 HydrophobicContact CH2-CD2 4.17Å; W153-L159 HydrophobicContact CZ3-CB 3.49Å; W153-L159 VanDerWaalsContact CZ3-CB 3.49Å
160	Y	95.9	Very high	95.4	Very high	17 Å²	17	34.2 Å²	34.2	7%	0.067	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	140.5	166.1	176.6	-130	0	0	0	108.6	A98 Q99 W101 V122 L127 Q148 L162	A98-Y160 WeakPolarHBondContact CA-O 3.47Å; Q99-Y160 PolarHBondContact N-O 2.87Å; Q99-Y160 PolarHBondContact O-N 2.87Å; W101-Y160 HydrophobicContact CH2-CG 4.48Å; V122-Y160 HydrophobicContact CB-CE2 4.48Å; V122-Y160 HydrophobicContact CG1-CD2 4.35Å; V122-Y160 HydrophobicContact CG1-CE2 3.59Å; V122-Y160 HydrophobicContact CG2-CD2 4.34Å; V122-Y160 HydrophobicContact CG2-CE2 3.97Å; L127-Y160 HydrophobicContact CD2-CD1 4.27Å; L127-Y160 HydrophobicContact CD2-CE1 4.47Å; L127-Y160 HydrophobicContact CD2-CG 4.34Å; Q148-Y160 HydrophobicContact CB-CE2 4.24Å; Q148-Y160 HydrophobicContact CG-CE2 4.31Å; Q148-Y160 PolarHBondContact NE2-OH 3.37Å; Y160-L162 HydrophobicContact CD1-CD2 4.31Å; Y160-L162 HydrophobicContact CE1-CD2 3.75Å
161	T	94.9	Very high	95.3	Very high	23 Å²	23	40.2 Å²	40.2	14%	0.141	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	133.7	-179.6	-59.2	0	0	0	0	109.6	I96 F97 A98 Q148 L149	I96-T161 HydrophobicContact CG2-CG2 3.24Å; F97-T161 WeakPolarHBondContact O-CA 3.45Å; A98-T161 HydrophobicContact CB-CG2 4.18Å; Q148-T161 CarbonylContact C-O 3.6Å; Q148-T161 WeakPolarHBondContact CA-O 3.4Å; L149-T161 PolarHBondContact N-O 2.85Å; L149-T161 PolarHBondContact O-N 2.87Å
162	L	94.8	Very high	95.2	Very high	22 Å²	22	35.9 Å²	35.9	12%	0.115	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	148.9	177.8	70.3	165.9	0	0	0	112	F97 N147 Q148 Y160 L164	F97-L162 HydrophobicContact CB-CD2 4.18Å; F97-L162 HydrophobicContact CD1-CD2 4.04Å; F97-L162 PolarHBondContact N-O 3.21Å; F97-L162 PolarHBondContact O-N 3.42Å; N147-L162 WeakPolarHBondContact O-CA 3.23Å; Q148-L162 HydrophobicContact CG-CB 4.1Å; Y160-L162 HydrophobicContact CD1-CD2 4.31Å; Y160-L162 HydrophobicContact CE1-CD2 3.75Å; L162-L164 HydrophobicContact CD1-CD1 4.26Å; L162-L164 HydrophobicContact CD1-CD2 3.76Å; L162-L164 HydrophobicContact CD1-CG 4.07Å; L162-L164 HydrophobicContact CG-CD1 4.35Å; L162-L164 HydrophobicContact CG-CD2 4.31Å; L162-L164 HydrophobicContact CG-CG 4.1Å
163	R	95.3	Very high	95	Very high	94 Å²	94	42.3 Å²	42.3	36%	0.355	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	130	171.8	-170.4	-179.1	-179.6	179.7	-2.1	111.2	N79 D94 I95 H141 N147	N79-R163 PolarHBondContact ND2-NE 3.46Å; D94-R163 IonicContact OD1-CZ 3.89Å; D94-R163 IonicContact OD1-NE 2.76Å; D94-R163 PolarHBondContact OD1-NE 3.1Å; D94-R163 IonicContact OD1-NH2 3.76Å; D94-R163 IonicContact OD2-CZ 2.66Å; D94-R163 IonicContact OD2-NE 3.31Å; D94-R163 PolarHBondContact OD2-NE 2.66Å; D94-R163 IonicContact OD2-NH2 2.79Å; D94-R163 PolarHBondContact OD2-NH2 3.22Å; I95-R163 WeakPolarHBondContact O-CA 3.15Å; H141-R163 HydrophobicContact CB-CB 4.49Å; H141-R163 PolarHBondContact N-O 2.88Å; N147-R163 HydrophobicContact CB-CB 4.34Å; N147-R163 PolarHBondContact O-N 3.04Å; N147-R163 VanDerWaalsContact O-N 3.16Å
164	L	95.6	Very high	94.6	Very high	17 Å²	17	39.1 Å²	39.1	9%	0.089	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	138	-178.5	-63.5	174.6	0	0	0	110.5	I95 F97 F132 D139 L162 I166	I95-L164 HydrophobicContact CG1-CB 4.16Å; I95-L164 PolarHBondContact N-O 2.9Å; I95-L164 PolarHBondContact O-N 3.1Å; F97-L164 HydrophobicContact CB-CD1 4.3Å; F132-L164 HydrophobicContact CE2-CD1 3.57Å; F132-L164 HydrophobicContact CZ-CD1 4.11Å; D139-L164 WeakPolarHBondContact O-CA 3.36Å; L162-L164 HydrophobicContact CD1-CD1 4.26Å; L162-L164 HydrophobicContact CD1-CD2 3.76Å; L162-L164 HydrophobicContact CD1-CG 4.07Å; L162-L164 HydrophobicContact CG-CD1 4.35Å; L162-L164 HydrophobicContact CG-CD2 4.31Å; L162-L164 HydrophobicContact CG-CG 4.1Å; L164-I166 HydrophobicContact CB-CD1 4.27Å; L164-I166 HydrophobicContact CB-CG1 4.05Å; L164-I166 HydrophobicContact CD1-CD1 4.35Å
165	T	96.3	Very high	94.4	Very high	25 Å²	25	40.6 Å²	40.6	15%	0.153	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	125.3	159.4	-64.5	0	0	0	0	108.2	Q92 I93 D139 H141	Q92-T165 HydrophobicContact CG-CG2 3.87Å; I93-T165 CarbonylContact O-C 3.59Å; I93-T165 WeakPolarHBondContact O-CA 3.33Å; D139-T165 PolarHBondContact N-O 2.79Å; D139-T165 PolarHBondContact O-N 3.48Å; H141-T165 PolarHBondContact NE2-OG1 3.05Å
166	I	97	Very high	94.2	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	129.1	-173.5	-52.3	176	0	0	0	108.4	Q92 I93 I95 F132 A138 L164 A168 L186	Q92-I166 CarbonylContact C-O 3.44Å; Q92-I166 WeakPolarHBondContact CA-O 3.46Å; I93-I166 HydrophobicContact CG2-CB 4.03Å; I93-I166 PolarHBondContact N-O 2.76Å; I93-I166 PolarHBondContact O-N 2.7Å; I95-I166 HydrophobicContact CD1-CD1 3.79Å; I95-I166 HydrophobicContact CG1-CD1 4.32Å; F132-I166 HydrophobicContact CD1-CD1 3.79Å; F132-I166 HydrophobicContact CD2-CD1 3.77Å; F132-I166 HydrophobicContact CE1-CD1 3.7Å; F132-I166 HydrophobicContact CE2-CD1 3.7Å; F132-I166 HydrophobicContact CG-CD1 3.82Å; F132-I166 HydrophobicContact CZ-CD1 3.67Å; A138-I166 HydrophobicContact CB-CG1 4.31Å; A138-I166 HydrophobicContact CB-CG2 4.39Å; L164-I166 HydrophobicContact CB-CD1 4.27Å; L164-I166 HydrophobicContact CB-CG1 4.05Å; L164-I166 HydrophobicContact CD1-CD1 4.35Å; I166-A168 HydrophobicContact CG2-CB 4.26Å; I166-L186 HydrophobicContact CD1-CD1 4.31Å; I166-L186 HydrophobicContact CG2-CD1 4.36Å
167	N	96.8	Very high	94	Very high	37 Å²	37	39.7 Å²	39.7	20%	0.198	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	98.4	166.9	-63.5	-34	0	0	0	107.3	Y91 Q92 K136 T137	Y91-N167 WeakPolarHBondContact O-CA 3.33Å; Q92-N167 WeakPolarHBondContact CB-OD1 3.34Å; Q92-N167 WeakPolarHBondContact CG-OD1 3.28Å; Q92-N167 PolarHBondContact NE2-OD1 2.92Å; K136-N167 PolarHBondContact N-O 2.84Å; T137-N167 PolarHBondContact O-N 3.11Å; T137-N167 PolarHBondContact OG1-ND2 3.03Å
168	A	97.1	Very high	93.7	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	138.7	-173.2	0	0	0	0	0	111.5	E90 Y91 N134 I166 L186	E90-A168 CarbonylContact C-O 3.13Å; E90-A168 WeakPolarHBondContact CA-O 3.45Å; E90-A168 WeakPolarHBondContact CB-O 3.37Å; Y91-A168 HydrophobicContact CD1-CB 4.16Å; Y91-A168 WeakPolarHBondContact CD1-O 3.25Å; Y91-A168 HydrophobicContact CE1-CB 3.58Å; Y91-A168 PolarHBondContact N-O 2.85Å; Y91-A168 PolarHBondContact O-N 2.79Å; N134-A168 CarbonylContact O-C 3.33Å; N134-A168 WeakPolarHBondContact O-CA 3.43Å; I166-A168 HydrophobicContact CG2-CB 4.26Å; A168-L186 HydrophobicContact CB-CD1 4.18Å
169	E	96.3	Very high	93.4	Very high	76 Å²	76	38 Å²	38	36%	0.355	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	132.2	176.4	-170.2	178.7	133.9	0	0	111	M89 N134 Q171	M89-E169 WeakPolarHBondContact O-CA 3.46Å; M89-E169 WeakPolarHBondContact O-CG 3.35Å; N134-E169 HydrophobicContact CB-CB 4.49Å; N134-E169 PolarHBondContact ND2-O 2.88Å; N134-E169 PolarHBondContact O-N 2.95Å; E169-Q171 PolarHBondContact OE1-NE2 2.86Å
170	C	95.6	Very high	93.2	Very high	6 Å²	6	37 Å²	37	4%	0.041	18%	0.177	C	C	.	.			trans	-139.7	111.6	174	178.5	0	0	0	0	109	M89 Y91 L172 C184	M89-C170 CarbonylContact C-O 3.4Å; M89-C170 WeakPolarHBondContact CA-O 3.37Å; M89-C170 WeakPolarHBondContact CB-O 3.25Å; M89-C170 PolarHBondContact O-N 2.87Å; Y91-C170 HydrophobicContact CD1-CB 3.74Å; Y91-C170 HydrophobicContact CE1-CB 4.06Å; C170-L172 PolarHBondContact O-N 3.45Å; C170-L172 VanDerWaalsContact O-N 3.14Å; C170-C184 HydrophobicContact CB-CB 3.75Å; C170-C184 WeakPolarHBondContact CB-SG 3.45Å; C170-C184 WeakPolarHBondContact SG-CA 3.2Å; C170-C184 WeakPolarHBondContact SG-CB 3.38Å; C170-C184 CovalentContact SG-SG 2.04Å; C170-C184 PolarHBondContact SG-SG 2.78Å
171	Q	93.1	Very high	93.1	Very high	125 Å²	125	42.4 Å²	42.4	58%	0.584	20%	0.203	S	C	*	.			trans	-78.9	93	-178.4	-68.8	-68	-16.2	0	0	110.3	E169	E169-Q171 PolarHBondContact OE1-NE2 2.86Å
172	L	91.5	Very high	93.1	Very high	6 Å²	6	42 Å²	42	3%	0.031	20%	0.199	C	C	.	.			trans	-74.1	128.2	-176.4	-54.1	176.3	0	0	0	111.4	V84 S86 M89 C170 L174 H182	V84-L172 HydrophobicContact CG1-CD1 4.24Å; S86-L172 VanDerWaalsContact OG-CD1 3.26Å; S86-L172 WeakPolarHBondContact OG-CD1 3.27Å; M89-L172 HydrophobicContact CE-CB 4.36Å; M89-L172 HydrophobicContact SD-CB 3.71Å; M89-L172 HydrophobicContact SD-CD1 4.23Å; M89-L172 HydrophobicContact SD-CG 3.92Å; C170-L172 PolarHBondContact O-N 3.45Å; C170-L172 VanDerWaalsContact O-N 3.14Å; L172-L174 HydrophobicContact CB-CD2 3.91Å; L172-L174 HydrophobicContact CB-CG 4.25Å; L172-L174 HydrophobicContact CD1-CD2 4.49Å; L172-L174 PolarHBondContact O-N 2.88Å; L172-H182 WeakPolarHBondContact CA-ND1 3.4Å; L172-H182 HydrophobicContact CD2-CB 3.89Å
173	Q	90.6	Very high	93.2	Very high	138 Å²	138	43.3 Å²	43.3	65%	0.645	21%	0.211	S	C	*	.			trans	-94.6	91.3	177	-63.3	-167.1	12.3	0	0	110.7	H175 H182	Q173-H175 PolarHBondContact O-N 2.83Å; Q173-H175 VanDerWaalsContact O-N 3.13Å; Q173-H182 PolarHBondContact N-CE1 3.48Å; Q173-H182 PolarHBondContact N-ND1 2.76Å
174	L	88.6	Confident	93.2	Very high	3 Å²	3	38.9 Å²	38.9	2%	0.016	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-83.2	21.1	-168	-57.3	176.2	0	0	0	114.5	M89 L172 N176 F177 D180 L333 P334 V336 Y338 T340	M89-L174 HydrophobicContact CE-CD1 4.44Å; L172-L174 HydrophobicContact CB-CD2 3.91Å; L172-L174 HydrophobicContact CB-CG 4.25Å; L172-L174 HydrophobicContact CD1-CD2 4.49Å; L172-L174 PolarHBondContact O-N 2.88Å; L174-N176 PolarHBondContact O-N 2.69Å; L174-F177 HydrophobicContact CB-CB 4.15Å; L174-F177 HydrophobicContact CD2-CD2 4.45Å; L174-F177 WeakPolarHBondContact O-CB 3.41Å; L174-F177 PolarHBondContact O-N 3.07Å; L174-D180 WeakPolarHBondContact CD2-OD2 3.41Å; L174-L333 HydrophobicContact CD1-CD2 4.38Å; L174-P334 HydrophobicContact CD1-CG 3.43Å; L174-P334 VanDerWaalsContact CD1-CG 3.43Å; L174-V336 HydrophobicContact CD1-CG1 4.35Å; L174-Y338 HydrophobicContact CB-CE2 4.28Å; L174-Y338 PolarHBondContact N-OH 3.47Å; L174-T340 WeakPolarHBondContact O-CG2 3.28Å
175	H	87.5	Confident	93.3	Very high	88 Å²	88	39.3 Å²	39.3	41%	0.407	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-58	-50.1	-176.7	-59.5	112.4	0	0	0	112.1	Q173 F177 Y338 T340 A341	Q173-H175 PolarHBondContact O-N 2.83Å; Q173-H175 VanDerWaalsContact O-N 3.13Å; H175-F177 VanDerWaalsContact C-N 3.26Å; H175-F177 PolarHBondContact O-N 3.3Å; H175-Y338 AromaticContact CD2-CD2 3.57Å; H175-Y338 AromaticContact CD2-CE2 3.64Å; H175-Y338 AromaticContact CD2-CG 3.78Å; H175-Y338 AromaticContact CD2-CZ 3.9Å; H175-Y338 AromaticContact NE2-CD1 3.81Å; H175-Y338 AromaticContact NE2-CE1 3.76Å; H175-Y338 AromaticContact NE2-CZ 3.91Å; H175-T340 WeakPolarHBondContact O-CA 3.34Å; H175-A341 PolarHBondContact O-N 3.28Å
176	N	90.5	Very high	93.3	Very high	63 Å²	63	38.1 Å²	38.1	34%	0.337	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-86.2	11.1	-179.1	-69.2	11.7	0	0	0	113.2	L174 M179 Y471	L174-N176 PolarHBondContact O-N 2.69Å; N176-M179 CarbonylContact O-C 3.48Å; N176-M179 WeakPolarHBondContact O-CA 3.01Å; N176-M179 WeakPolarHBondContact O-CB 3.39Å; N176-M179 PolarHBondContact O-N 3.04Å; N176-Y471 HydrophobicContact CB-CD1 4.44Å
177	F	88.3	Confident	93.3	Very high	1 Å²	1	40.1 Å²	40.1	0%	0.004	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	128.8	-175.2	174	-93.7	0	0	0	112.4	L174 H175 D180 R250 F255 L333 T340 M342	L174-F177 HydrophobicContact CB-CB 4.15Å; L174-F177 HydrophobicContact CD2-CD2 4.45Å; L174-F177 WeakPolarHBondContact O-CB 3.41Å; L174-F177 PolarHBondContact O-N 3.07Å; H175-F177 VanDerWaalsContact C-N 3.26Å; H175-F177 PolarHBondContact O-N 3.3Å; F177-D180 WeakPolarHBondContact CA-OD1 3.29Å; F177-D180 WeakPolarHBondContact CD2-OD1 3.44Å; F177-R250 VanDerWaalsContact CE2-CZ 3.5Å; F177-F255 HydrophobicContact CE1-CE1 4.42Å; F177-F255 HydrophobicContact CE2-CE1 4.42Å; F177-F255 HydrophobicContact CE2-CE2 4.32Å; F177-F255 HydrophobicContact CE2-CZ 4.03Å; F177-F255 HydrophobicContact CZ-CD1 4.09Å; F177-F255 AromaticContact CZ-CE1 3.59Å; F177-F255 HydrophobicContact CZ-CE1 3.59Å; F177-F255 HydrophobicContact CZ-CE2 4.2Å; F177-F255 AromaticContact CZ-CZ 3.65Å; F177-F255 HydrophobicContact CZ-CZ 3.65Å; F177-L333 HydrophobicContact CD1-CD1 4.27Å; F177-L333 HydrophobicContact CD1-CD2 4.43Å; F177-L333 HydrophobicContact CD2-CD2 4.13Å; F177-L333 HydrophobicContact CE1-CD1 3.47Å; F177-L333 VanDerWaalsContact CE1-CD1 3.47Å; F177-L333 HydrophobicContact CE1-CD2 4Å; F177-L333 HydrophobicContact CE1-CG 4.33Å; F177-L333 HydrophobicContact CE2-CD2 3.69Å; F177-L333 HydrophobicContact CZ-CD1 3.66Å; F177-L333 HydrophobicContact CZ-CD2 3.62Å; F177-L333 HydrophobicContact CZ-CG 4.11Å; F177-T340 HydrophobicContact CB-CG2 4.4Å; F177-M342 HydrophobicContact CD1-CB 4.17Å; F177-M342 HydrophobicContact CD1-SD 4.2Å; F177-M342 HydrophobicContact CE1-CB 4.43Å; F177-M342 HydrophobicContact CE1-SD 3.55Å; F177-M342 VanDerWaalsContact CE1-SD 3.55Å; F177-M342 PolarHBondContact O-N 2.62Å
178	P	89.5	Confident	93.3	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	cis	-102.4	26.1	14.6	41.5	-35.2	0	0	0	114.8	D180 M252 F255 Y260	P178-D180 VanDerWaalsContact CA-OD1 3.27Å; P178-D180 WeakPolarHBondContact CA-OD1 3.39Å; P178-M252 HydrophobicContact CG-CG 4.24Å; P178-F255 HydrophobicContact CB-CB 4.23Å; P178-F255 HydrophobicContact CB-CD2 3.54Å; P178-F255 HydrophobicContact CB-CE2 4.06Å; P178-F255 HydrophobicContact CB-CG 3.85Å; P178-F255 HydrophobicContact CG-CB 3.88Å; P178-F255 HydrophobicContact CG-CD2 4.13Å; P178-F255 HydrophobicContact CG-CG 4.07Å; P178-Y260 VanDerWaalsContact CD-OH 3.23Å; P178-Y260 WeakPolarHBondContact CD-OH 3.42Å; P178-Y260 HydrophobicContact CG-CE2 4.01Å
179	M	90.6	Very high	93.3	Very high	32 Å²	32	38.3 Å²	38.3	16%	0.158	19%	0.191	C	C	.	.	S	Bend	trans	-106.6	43.9	178.1	-51.2	179.3	-143.2	0	0	109.5	N176 M252 Y467 W468 L472	N176-M179 CarbonylContact O-C 3.48Å; N176-M179 WeakPolarHBondContact O-CA 3.01Å; N176-M179 WeakPolarHBondContact O-CB 3.39Å; N176-M179 PolarHBondContact O-N 3.04Å; M179-M252 HydrophobicContact CE-CE 4.36Å; M179-M252 HydrophobicContact CG-CG 4.47Å; M179-Y467 HydrophobicContact CE-CE1 3.8Å; M179-W468 HydrophobicContact CE-CE3 3.97Å; M179-W468 HydrophobicContact CE-CH2 4.21Å; M179-W468 HydrophobicContact CE-CZ3 3.44Å; M179-W468 VanDerWaalsContact CE-CZ3 3.44Å; M179-W468 HydrophobicContact SD-CZ3 4.42Å; M179-L472 HydrophobicContact CE-CD1 4.36Å; M179-L472 HydrophobicContact SD-CD1 3.4Å; M179-L472 WeakPolarHBondContact SD-CD1 3.15Å; M179-L472 HydrophobicContact SD-CG 3.96Å
180	D	91.8	Very high	93.3	Very high	4 Å²	4	34.7 Å²	34.7	2%	0.021	17%	0.174	C	C	.	.			trans	-109	128.6	-168	54.2	-55.4	0	0	0	112.6	L174 F177 P178 H182 R250	L174-D180 WeakPolarHBondContact CD2-OD2 3.41Å; F177-D180 WeakPolarHBondContact CA-OD1 3.29Å; F177-D180 WeakPolarHBondContact CD2-OD1 3.44Å; P178-D180 VanDerWaalsContact CA-OD1 3.27Å; P178-D180 WeakPolarHBondContact CA-OD1 3.39Å; D180-H182 IonicContact OD2-CD2 3.68Å; D180-H182 IonicContact OD2-CE1 2.76Å; D180-H182 IonicContact OD2-NE2 3.7Å; D180-H182 PolarHBondContact OD2-NE2 2.91Å; D180-R250 VanDerWaalsContact CG-NE 3.28Å; D180-R250 PolarHBondContact O-N 3.46Å; D180-R250 VanDerWaalsContact OD1-CD 3.27Å; D180-R250 WeakPolarHBondContact OD1-CD 3.4Å; D180-R250 IonicContact OD1-CZ 2.74Å; D180-R250 IonicContact OD1-NE 2.74Å; D180-R250 PolarHBondContact OD1-NE 2.93Å; D180-R250 IonicContact OD1-NH2 3.03Å; D180-R250 IonicContact OD2-CZ 3.32Å; D180-R250 VanDerWaalsContact OD2-CZ 3.32Å; D180-R250 IonicContact OD2-NE 3.36Å; D180-R250 PolarHBondContact OD2-NE 3.4Å; D180-R250 IonicContact OD2-NH2 3.42Å; D180-R250 PolarHBondContact OD2-NH2 3.4Å
181	E	93.5	Very high	93.3	Very high	130 Å²	130	42.7 Å²	42.7	61%	0.607	21%	0.205	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-108.2	142.5	175.6	-51.6	-153.9	131.2	0	0	111.1	L248 S249	E181-L248 CarbonylContact C-O 3.52Å; E181-L248 WeakPolarHBondContact CA-O 3.49Å; E181-S249 VanDerWaalsContact OE1-CB 3.23Å; E181-S249 WeakPolarHBondContact OE1-CB 3.26Å; E181-S249 PolarHBondContact OE1-OG 2.81Å
182	H	94.9	Very high	93.3	Very high	15 Å²	15	38.5 Å²	38.5	7%	0.069	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	132.8	-174.1	-54.1	-88.1	0	0	0	112.1	L172 Q173 D180 F220 L248	L172-H182 WeakPolarHBondContact CA-ND1 3.4Å; L172-H182 HydrophobicContact CD2-CB 3.89Å; Q173-H182 PolarHBondContact N-CE1 3.48Å; Q173-H182 PolarHBondContact N-ND1 2.76Å; D180-H182 IonicContact OD2-CD2 3.68Å; D180-H182 IonicContact OD2-CE1 2.76Å; D180-H182 IonicContact OD2-NE2 3.7Å; D180-H182 PolarHBondContact OD2-NE2 2.91Å; H182-F220 AromaticContact CD2-CE1 3.99Å; H182-L248 PolarHBondContact N-O 2.88Å; H182-L248 PolarHBondContact O-N 3.35Å
183	S	95.9	Very high	93.5	Very high	50 Å²	50	40.5 Å²	40.5	35%	0.35	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	88.1	168.4	-61.1	0	0	0	0	110.6	P185 R226 D247	S183-P185 WeakPolarHBondContact O-CD 3.43Å; S183-R226 PolarHBondContact OG-NH1 3Å; S183-R226 VanDerWaalsContact OG-NH1 3.11Å; S183-R226 PolarHBondContact OG-NH2 3.33Å; S183-D247 WeakPolarHBondContact CA-OD1 3.44Å; S183-D247 WeakPolarHBondContact CB-OD1 3.27Å; S183-D247 PolarHBondContact OG-OD1 3.08Å
184	C	96.5	Very high	93.7	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	120.9	-179.6	-74.4	0	0	0	0	111.8	Y91 C170 Y245 F246	Y91-C184 HydrophobicContact CD1-CB 3.98Å; Y91-C184 HydrophobicContact CE1-CB 3.73Å; C170-C184 HydrophobicContact CB-CB 3.75Å; C170-C184 WeakPolarHBondContact CB-SG 3.45Å; C170-C184 WeakPolarHBondContact SG-CA 3.2Å; C170-C184 WeakPolarHBondContact SG-CB 3.38Å; C170-C184 CovalentContact SG-SG 2.04Å; C170-C184 PolarHBondContact SG-SG 2.78Å; C184-Y245 WeakPolarHBondContact O-CA 3.27Å; C184-F246 PolarHBondContact N-O 3.16Å; C184-F246 PolarHBondContact O-N 2.96Å
185	P	97.1	Very high	94	Very high	26 Å²	26	38.1 Å²	38.1	17%	0.169	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	146.8	-177.6	34.9	-34.3	0	0	0	112.4	Y91 N134 S183 I187 T243 V244 Y245	Y91-P185 VanDerWaalsContact OH-C 3.3Å; Y91-P185 PolarHBondContact OH-O 2.69Å; N134-P185 PolarHBondContact ND2-O 3Å; S183-P185 WeakPolarHBondContact O-CD 3.43Å; P185-I187 HydrophobicContact CB-CD1 4.25Å; P185-I187 HydrophobicContact CB-CG1 3.95Å; P185-I187 HydrophobicContact CG-CD1 4.39Å; P185-T243 HydrophobicContact CB-CG2 3.99Å; P185-V244 CarbonylContact C-O 3.59Å; P185-V244 WeakPolarHBondContact CA-O 3.43Å; P185-Y245 HydrophobicContact CB-CD1 3.91Å; P185-Y245 HydrophobicContact CB-CE1 3.89Å
186	L	97.1	Very high	94.3	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	111.9	159.9	-176.3	65.8	0	0	0	107.7	I95 F132 I166 A168 T243 V244 F246	I95-L186 HydrophobicContact CD1-CD2 4.25Å; F132-L186 HydrophobicContact CD1-CD1 3.65Å; F132-L186 HydrophobicContact CD1-CD2 4.44Å; F132-L186 HydrophobicContact CD1-CG 3.97Å; F132-L186 HydrophobicContact CE1-CD1 4.12Å; F132-L186 HydrophobicContact CE1-CD2 4.09Å; F132-L186 HydrophobicContact CE1-CG 4.07Å; I166-L186 HydrophobicContact CD1-CD1 4.31Å; I166-L186 HydrophobicContact CG2-CD1 4.36Å; A168-L186 HydrophobicContact CB-CD1 4.18Å; L186-T243 WeakPolarHBondContact O-CA 3.49Å; L186-V244 PolarHBondContact N-O 2.99Å; L186-V244 PolarHBondContact O-N 3.36Å; L186-F246 HydrophobicContact CB-CE2 3.91Å; L186-F246 HydrophobicContact CD2-CE2 4.41Å
187	I	97.1	Very high	94.5	Very high	42 Å²	42	40.3 Å²	40.3	22%	0.215	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	127.4	-170.1	-51.2	177.7	0	0	0	109	F132 R133 N134 P185 V241 T243	F132-I187 CarbonylContact C-O 3.55Å; F132-I187 VanDerWaalsContact CA-O 3.28Å; F132-I187 WeakPolarHBondContact CA-O 3.48Å; R133-I187 HydrophobicContact CB-CB 4.33Å; R133-I187 HydrophobicContact CB-CG2 4.04Å; R133-I187 PolarHBondContact N-O 3.36Å; N134-I187 HydrophobicContact CB-CD1 4.49Å; N134-I187 PolarHBondContact OD1-N 3Å; P185-I187 HydrophobicContact CB-CD1 4.25Å; P185-I187 HydrophobicContact CB-CG1 3.95Å; P185-I187 HydrophobicContact CG-CD1 4.39Å; I187-V241 HydrophobicContact CG2-CG1 3.36Å; I187-T243 HydrophobicContact CG1-CG2 4.03Å
188	F	97.1	Very high	94.9	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	155.1	174.9	63.5	-84.5	0	0	0	113.7	V74 I76 F97 T130 I131 F132 W202 M242	V74-F188 HydrophobicContact CG1-CE2 3.96Å; V74-F188 HydrophobicContact CG1-CZ 3.83Å; V74-F188 HydrophobicContact CG2-CE2 4.26Å; I76-F188 HydrophobicContact CD1-CE1 3.69Å; I76-F188 HydrophobicContact CD1-CZ 4.05Å; F97-F188 HydrophobicContact CE2-CD2 4.2Å; F97-F188 HydrophobicContact CE2-CE1 4.26Å; F97-F188 AromaticContact CE2-CE2 3.91Å; F97-F188 HydrophobicContact CE2-CE2 3.91Å; F97-F188 HydrophobicContact CE2-CG 4.48Å; F97-F188 AromaticContact CE2-CZ 3.95Å; F97-F188 HydrophobicContact CE2-CZ 3.95Å; F97-F188 AromaticContact CZ-CD2 3.84Å; F97-F188 HydrophobicContact CZ-CD2 3.84Å; F97-F188 AromaticContact CZ-CE2 3.76Å; F97-F188 HydrophobicContact CZ-CE2 3.76Å; F97-F188 HydrophobicContact CZ-CG 4.41Å; F97-F188 HydrophobicContact CZ-CZ 4.27Å; T130-F188 HydrophobicContact CG2-CB 4.39Å; T130-F188 HydrophobicContact CG2-CD2 3.91Å; I131-F188 WeakPolarHBondContact O-CA 3.45Å; I131-F188 VanDerWaalsContact O-CB 3.26Å; I131-F188 WeakPolarHBondContact O-CB 3.27Å; F132-F188 HydrophobicContact CD1-CB 3.78Å; F132-F188 HydrophobicContact CD1-CD1 4.46Å; F132-F188 HydrophobicContact CD1-CG 4.48Å; F132-F188 HydrophobicContact CE1-CB 3.93Å; F132-F188 HydrophobicContact CE1-CD1 4.05Å; F132-F188 HydrophobicContact CE1-CG 4.18Å; F132-F188 HydrophobicContact CG-CB 4.31Å; F188-W202 AromaticContact CE1-CH2 3.65Å; F188-W202 HydrophobicContact CE1-CH2 3.65Å; F188-W202 HydrophobicContact CE1-CZ2 4.35Å; F188-W202 HydrophobicContact CE1-CZ3 4.36Å; F188-W202 AromaticContact CZ-CH2 3.54Å; F188-W202 HydrophobicContact CZ-CH2 3.54Å; F188-W202 HydrophobicContact CZ-CZ2 4.27Å; F188-W202 AromaticContact CZ-CZ3 3.88Å; F188-W202 HydrophobicContact CZ-CZ3 3.88Å; F188-M242 HydrophobicContact CD1-CB 4.1Å; F188-M242 HydrophobicContact CD2-CB 3.91Å; F188-M242 HydrophobicContact CD2-CG 4.24Å; F188-M242 HydrophobicContact CE1-CB 3.65Å; F188-M242 HydrophobicContact CE2-CB 3.44Å; F188-M242 VanDerWaalsContact CE2-CB 3.44Å; F188-M242 HydrophobicContact CE2-CG 3.66Å; F188-M242 HydrophobicContact CG-CB 4.22Å; F188-M242 HydrophobicContact CZ-CB 3.3Å; F188-M242 HydrophobicContact CZ-CG 3.93Å; F188-M242 PolarHBondContact N-O 3.44Å; F188-M242 PolarHBondContact O-N 2.9Å
189	S	96.7	Very high	95.2	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	-175.6	174.7	71.1	0	0	0	0	110.5	T130 I131 R133 V240	T130-S189 CarbonylContact C-O 3.58Å; T130-S189 WeakPolarHBondContact CA-O 3.4Å; I131-S189 PolarHBondContact N-O 2.85Å; I131-S189 PolarHBondContact O-N 3.09Å; R133-S189 VanDerWaalsContact CZ-OG 3.29Å; R133-S189 PolarHBondContact NE-OG 2.82Å; R133-S189 PolarHBondContact NH2-OG 3.11Å; S189-V240 VanDerWaalsContact CB-O 3.23Å; S189-V240 WeakPolarHBondContact CB-O 3.4Å
190	S	96.6	Very high	95.5	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.209	C	C	.	.			trans	-65.2	160.6	159.7	41.8	0	0	0	0	111.2	D129 Y193 Y200 Y239	D129-S190 WeakPolarHBondContact OD1-CA 3.26Å; D129-S190 WeakPolarHBondContact OD1-CB 3.5Å; S190-Y193 WeakPolarHBondContact CB-O 3.49Å; S190-Y193 PolarHBondContact OG-O 2.88Å; S190-Y200 VanDerWaalsContact N-CE2 3.26Å; S190-Y200 PolarHBondContact N-OH 3.46Å; S190-Y239 WeakPolarHBondContact OG-CD1 3.4Å
191	Y	94.6	Very high	95.7	Very high	174 Å²	174	45.3 Å²	45.3	68%	0.682	23%	0.228	S	C	*	.	S	Bend	trans	-94.7	-48.7	173.8	-179.2	-105.1	0	0	0	111.9	D129 I131	D129-Y191 PolarHBondContact O-N 2.75Å; D129-Y191 PolarHBondContact OD1-N 3.18Å; D129-Y191 PolarHBondContact OD2-N 3.38Å; D129-Y191 VanDerWaalsContact OD2-N 3.08Å; I131-Y191 HydrophobicContact CD1-CD2 3.97Å; I131-Y191 HydrophobicContact CG2-CD2 4.45Å
192	G	93.8	Very high	95.7	Very high	37 Å²	37	41.2 Å²	41.2	38%	0.381	21%	0.208	S	C	.	.	S	Bend	trans	-112.7	-33	-178.5	0	0	0	0	0	115	D129 S194 Y239	D129-G192 PolarHBondContact OD2-N 3.04Å; G192-S194 PolarHBondContact O-N 2.78Å; G192-Y239 PolarHBondContact O-OH 2.84Å; G192-Y239 VanDerWaalsContact O-OH 3.04Å
193	Y	95.5	Very high	95.5	Very high	47 Å²	47	46.1 Å²	46.1	18%	0.184	23%	0.225	C	C	.	.			trans	-73.4	123.4	-178.4	-61.9	-60.5	0	0	0	112.5	R62 W126 D129 S190 E197 M198 Y239	R62-Y193 HydrophobicContact CB-CE1 4.33Å; R62-Y193 HydrophobicContact CG-CE1 4.44Å; W126-Y193 HydrophobicContact CZ2-CD2 4.38Å; W126-Y193 AromaticContact CZ2-CE2 3.71Å; W126-Y193 HydrophobicContact CZ2-CE2 3.71Å; W126-Y193 AromaticContact NE1-CE2 3.99Å; W126-Y193 AromaticContact NE1-CZ 3.79Å; W126-Y193 PolarHBondContact NE1-OH 3.31Å; D129-Y193 WeakPolarHBondContact OD1-CD2 3.35Å; D129-Y193 PolarHBondContact OD2-N 2.89Å; S190-Y193 WeakPolarHBondContact CB-O 3.49Å; S190-Y193 PolarHBondContact OG-O 2.88Å; Y193-E197 HydrophobicContact CD1-CB 4.32Å; Y193-M198 HydrophobicContact CD2-CE 3.71Å; Y193-M198 HydrophobicContact CD2-SD 3.92Å; Y193-M198 HydrophobicContact CG-CB 4.44Å; Y193-M198 HydrophobicContact CG-CE 4.36Å; Y193-M198 HydrophobicContact CG-SD 4.49Å; Y193-Y239 WeakPolarHBondContact O-CD1 3.44Å; Y193-Y239 VanDerWaalsContact O-CE1 3.28Å; Y193-Y239 WeakPolarHBondContact O-CE1 3.47Å
194	S	95.4	Very high	94.8	Very high	23 Å²	23	53.1 Å²	53.1	16%	0.161	25%	0.249	C	C	.	.			trans	-75.8	170.3	177.4	61.9	0	0	0	0	113.4	G192 D196 E197 M198	G192-S194 PolarHBondContact O-N 2.78Å; S194-D196 PolarHBondContact O-N 3.08Å; S194-E197 PolarHBondContact N-OE2 2.88Å; S194-E197 WeakPolarHBondContact O-CA 3.2Å; S194-E197 WeakPolarHBondContact O-CB 3.39Å; S194-E197 PolarHBondContact O-N 3.23Å; S194-E197 WeakPolarHBondContact OG-CG 3.28Å; S194-E197 PolarHBondContact OG-OE2 2.77Å; S194-M198 PolarHBondContact O-N 2.95Å
195	Q	94.8	Very high	93.9	Very high	69 Å²	69	58.9 Å²	58.9	32%	0.322	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-34	177.7	176.5	173	-5.1	0	0	113.8	E197 I199 V231 D238 V240	Q195-E197 PolarHBondContact O-N 2.73Å; Q195-I199 HydrophobicContact CG-CG1 4.5Å; Q195-I199 VanDerWaalsContact O-CG1 3.23Å; Q195-I199 WeakPolarHBondContact O-CG1 3.17Å; Q195-V231 VanDerWaalsContact OE1-CG1 3.31Å; Q195-D238 PolarHBondContact N-O 3.06Å; Q195-V240 HydrophobicContact CB-CG2 4Å; Q195-V240 HydrophobicContact CG-CG2 3.76Å
196	D	93.7	Very high	92.9	Very high	134 Å²	134	58 Å²	58	72%	0.717	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-13.3	177.2	-65.2	-45	0	0	0	112.7	S194	S194-D196 PolarHBondContact O-N 3.08Å
197	E	94.9	Very high	92.2	Very high	63 Å²	63	58.9 Å²	58.9	29%	0.294	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.8	-35.8	-178	-66	177	98.4	0	0	114	R62 P69 T70 Y193 S194 Q195	R62-E197 PolarHBondContact NE-O 3.49Å; R62-E197 PolarHBondContact NH1-O 2.54Å; P69-E197 CarbonylContact C-O 3.59Å; P69-E197 WeakPolarHBondContact CA-O 3.35Å; T70-E197 PolarHBondContact N-O 3.28Å; Y193-E197 HydrophobicContact CD1-CB 4.32Å; S194-E197 PolarHBondContact N-OE2 2.88Å; S194-E197 WeakPolarHBondContact O-CA 3.2Å; S194-E197 WeakPolarHBondContact O-CB 3.39Å; S194-E197 PolarHBondContact O-N 3.23Å; S194-E197 WeakPolarHBondContact OG-CG 3.28Å; S194-E197 PolarHBondContact OG-OE2 2.77Å; Q195-E197 PolarHBondContact O-N 2.73Å
198	M	95.4	Very high	91.6	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	132.4	-176.8	-159.4	161.8	73.3	0	0	111.9	T70 I72 W126 P128 D129 Y193 S194 Y200	T70-M198 WeakPolarHBondContact O-CA 3.46Å; T70-M198 WeakPolarHBondContact O-CG 3.34Å; I72-M198 HydrophobicContact CD1-CE 4.2Å; I72-M198 HydrophobicContact CD1-CG 3.87Å; I72-M198 HydrophobicContact CD1-SD 3.44Å; I72-M198 WeakPolarHBondContact CD1-SD 3.39Å; I72-M198 HydrophobicContact CG1-CG 4.21Å; I72-M198 HydrophobicContact CG1-SD 4.36Å; W126-M198 HydrophobicContact CH2-SD 3.67Å; W126-M198 HydrophobicContact CZ2-SD 3.98Å; P128-M198 HydrophobicContact CB-CE 3.9Å; P128-M198 HydrophobicContact CB-SD 3.93Å; D129-M198 WeakPolarHBondContact OD1-CE 3.26Å; Y193-M198 HydrophobicContact CD2-CE 3.71Å; Y193-M198 HydrophobicContact CD2-SD 3.92Å; Y193-M198 HydrophobicContact CG-CB 4.44Å; Y193-M198 HydrophobicContact CG-CE 4.36Å; Y193-M198 HydrophobicContact CG-SD 4.49Å; S194-M198 PolarHBondContact O-N 2.95Å; M198-Y200 HydrophobicContact CE-CE2 4.15Å; M198-Y200 WeakPolarHBondContact CE-OH 3.23Å
199	I	96.4	Very high	90.9	Very high	40 Å²	40	63.9 Å²	63.9	21%	0.205	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	115.6	-176	-61.1	174.7	0	0	0	109.3	P69 T70 I71 I72 Q195 K201 V240	P69-I199 HydrophobicContact CB-CD1 3.83Å; P69-I199 HydrophobicContact CB-CG1 3.96Å; P69-I199 HydrophobicContact CG-CD1 3.76Å; P69-I199 HydrophobicContact CG-CG1 4.44Å; T70-I199 PolarHBondContact O-N 2.99Å; I71-I199 WeakPolarHBondContact CA-O 3.48Å; I72-I199 PolarHBondContact N-O 2.76Å; Q195-I199 HydrophobicContact CG-CG1 4.5Å; Q195-I199 VanDerWaalsContact O-CG1 3.23Å; Q195-I199 WeakPolarHBondContact O-CG1 3.17Å; I199-K201 HydrophobicContact CG2-CG 4.31Å; I199-V240 HydrophobicContact CG1-CG2 4.42Å; I199-V240 HydrophobicContact CG2-CG2 4.46Å
200	Y	96.9	Very high	90.2	Very high	5 Å²	5	65 Å²	65	2%	0.02	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	146.6	169.5	-62	-82.6	0	0	0	111.2	I72 V74 T130 S190 M198 M242	I72-Y200 HydrophobicContact CB-CD1 4.06Å; I72-Y200 HydrophobicContact CB-CE1 4.42Å; I72-Y200 HydrophobicContact CD1-CE1 4.28Å; I72-Y200 HydrophobicContact CG2-CD1 4.18Å; I72-Y200 HydrophobicContact CG2-CE1 4.37Å; I72-Y200 CarbonylContact O-C 3.57Å; I72-Y200 WeakPolarHBondContact O-CA 3.28Å; V74-Y200 HydrophobicContact CG2-CD1 3.68Å; V74-Y200 HydrophobicContact CG2-CE1 4.46Å; T130-Y200 HydrophobicContact CG2-CE1 4.13Å; T130-Y200 PolarHBondContact OG1-OH 2.94Å; S190-Y200 VanDerWaalsContact N-CE2 3.26Å; S190-Y200 PolarHBondContact N-OH 3.46Å; M198-Y200 HydrophobicContact CE-CE2 4.15Å; M198-Y200 WeakPolarHBondContact CE-OH 3.23Å; Y200-M242 VanDerWaalsContact CB-CG 3.48Å; Y200-M242 VanDerWaalsContact CB-SD 3.56Å; Y200-M242 HydrophobicContact CD2-CG 4.47Å; Y200-M242 HydrophobicContact CG-CG 4.05Å
201	K	95.4	Very high	89.5	Confident	96 Å²	96	69.4 Å²	69.4	42%	0.417	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	145.7	174.1	-64.3	-171.7	-178.4	-178.8	0	110.5	I71 I72 D73 V74 I199	I71-K201 HydrophobicContact CG2-CD 3.79Å; I71-K201 HydrophobicContact CG2-CG 4.19Å; I72-K201 PolarHBondContact O-N 3.06Å; D73-K201 CarbonylContact C-O 3.54Å; D73-K201 WeakPolarHBondContact CA-O 3.35Å; V74-K201 PolarHBondContact N-O 2.79Å; I199-K201 HydrophobicContact CG2-CG 4.31Å
202	W	94.6	Very high	88.7	Confident	45 Å²	45	66.6 Å²	66.6	17%	0.17	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	132.3	170.8	-69.2	125.8	0	0	0	110.6	V74 I76 F188 S206 V207 N227 T228 T229 M242 V244	V74-W202 HydrophobicContact CB-CE3 4.44Å; V74-W202 HydrophobicContact CB-CZ3 4.46Å; V74-W202 HydrophobicContact CG1-CZ3 4.17Å; I76-W202 HydrophobicContact CD1-CH2 3.87Å; I76-W202 HydrophobicContact CD1-CZ3 3.91Å; I76-W202 HydrophobicContact CG1-CZ3 4.15Å; F188-W202 AromaticContact CE1-CH2 3.65Å; F188-W202 HydrophobicContact CE1-CH2 3.65Å; F188-W202 HydrophobicContact CE1-CZ2 4.35Å; F188-W202 HydrophobicContact CE1-CZ3 4.36Å; F188-W202 AromaticContact CZ-CH2 3.54Å; F188-W202 HydrophobicContact CZ-CH2 3.54Å; F188-W202 HydrophobicContact CZ-CZ2 4.27Å; F188-W202 AromaticContact CZ-CZ3 3.88Å; F188-W202 HydrophobicContact CZ-CZ3 3.88Å; W202-S206 VanDerWaalsContact CE3-CB 3.49Å; W202-V207 HydrophobicContact CH2-CG2 4.45Å; W202-V207 HydrophobicContact CZ3-CG2 4.31Å; W202-N227 HydrophobicContact CD2-CB 4.39Å; W202-N227 HydrophobicContact CZ2-CB 3.95Å; W202-T228 PolarHBondContact NE1-O 2.91Å; W202-T229 HydrophobicContact CG-CG2 4.39Å; W202-T229 VanDerWaalsContact NE1-CG2 3.34Å; W202-M242 HydrophobicContact CD2-CE 3.4Å; W202-M242 VanDerWaalsContact CD2-CE 3.4Å; W202-M242 VanDerWaalsContact CE2-CE 3.46Å; W202-M242 HydrophobicContact CE3-CE 3.88Å; W202-M242 HydrophobicContact CG-CE 3.67Å; W202-M242 HydrophobicContact CH2-CB 4.44Å; W202-M242 HydrophobicContact CZ2-CB 4.05Å; W202-M242 HydrophobicContact CZ2-CE 4.05Å; W202-M242 HydrophobicContact CZ3-CE 4.42Å; W202-V244 HydrophobicContact CH2-CG2 3.41Å; W202-V244 VanDerWaalsContact CH2-CG2 3.41Å; W202-V244 HydrophobicContact CZ2-CG2 3.74Å; W202-V244 HydrophobicContact CZ3-CG2 4.45Å
203	R	90.3	Very high	87.9	Confident	118 Å²	118	73.4 Å²	73.4	45%	0.445	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	164.3	167	-154.5	-179.5	-174	163.6	-0.1	111.2	V74 D75 N205 S206	V74-R203 PolarHBondContact O-N 2.82Å; D75-R203 VanDerWaalsContact CG-CD 3.48Å; D75-R203 WeakPolarHBondContact OD1-CD 3.3Å; D75-R203 WeakPolarHBondContact OD2-CD 3.04Å; D75-R203 IonicContact OD2-CZ 3.54Å; D75-R203 IonicContact OD2-NE 3.64Å; D75-R203 IonicContact OD2-NH1 3.38Å; D75-R203 PolarHBondContact OD2-NH1 2.97Å; R203-N205 PolarHBondContact O-N 3.29Å; R203-S206 VanDerWaalsContact O-CB 3.25Å; R203-S206 WeakPolarHBondContact O-CB 3.5Å; R203-S206 PolarHBondContact O-N 2.69Å
204	K	81.5	Confident	87.1	Confident	196 Å²	196	74.5 Å²	74.5	85%	0.852	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.9	131.4	161.3	-64.3	-175.6	178.3	-175.7	0	108.3
205	N	78.3	Confident	86.8	Confident	122 Å²	122	74.8 Å²	74.8	65%	0.652	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	61.3	31.9	-169.6	-60.2	16.9	0	0	0	114.7	R203 V207	R203-N205 PolarHBondContact O-N 3.29Å; N205-V207 PolarHBondContact O-N 2.88Å
206	S	75.5	Confident	86.4	Confident	6 Å²	6	78 Å²	78	4%	0.042	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.8	-12.3	-170.7	61.3	0	0	0	0	118.6	D75 I76 W202 R203 N227	D75-S206 WeakPolarHBondContact OD1-CA 3.38Å; I76-S206 PolarHBondContact N-O 2.86Å; W202-S206 VanDerWaalsContact CE3-CB 3.49Å; R203-S206 VanDerWaalsContact O-CB 3.25Å; R203-S206 WeakPolarHBondContact O-CB 3.5Å; R203-S206 PolarHBondContact O-N 2.69Å; S206-N227 PolarHBondContact OG-ND2 2.04Å; S206-N227 VanDerWaalsContact OG-ND2 3.11Å
207	V	81.4	Confident	86	Confident	20 Å²	20	72.6 Å²	72.6	12%	0.121	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	101	177.1	-170.2	0	0	0	0	108.6	I76 V78 W202 N205 L225 V244	I76-V207 WeakPolarHBondContact O-CA 3.45Å; V78-V207 HydrophobicContact CG2-CG1 4.49Å; W202-V207 HydrophobicContact CH2-CG2 4.45Å; W202-V207 HydrophobicContact CZ3-CG2 4.31Å; N205-V207 PolarHBondContact O-N 2.88Å; V207-L225 HydrophobicContact CB-CD1 3.84Å; V207-L225 HydrophobicContact CB-CD2 4.38Å; V207-L225 HydrophobicContact CG1-CD1 3.91Å; V207-L225 HydrophobicContact CG1-CD2 3.72Å; V207-L225 HydrophobicContact CG1-CG 4.45Å; V207-V244 HydrophobicContact CG1-CG1 4.38Å; V207-V244 HydrophobicContact CG2-CG1 4.41Å; V207-V244 HydrophobicContact CG2-CG2 3.94Å
208	E	85.1	Confident	85.5	Confident	101 Å²	101	77.3 Å²	77.3	47%	0.472	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	151.5	173.4	-67.7	-171.2	168.9	0	0	109.8	I76 F77 V78	I76-E208 PolarHBondContact O-N 2.79Å; F77-E208 CarbonylContact C-O 3.58Å; F77-E208 WeakPolarHBondContact CA-O 3.37Å; F77-E208 HydrophobicContact CD2-CB 3.96Å; V78-E208 PolarHBondContact N-O 2.8Å
209	A	82.8	Confident	85	Confident	45 Å²	45	80.4 Å²	80.4	37%	0.372	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	131.1	-170.5	0	0	0	0	0	110.4	V78 W215	V78-A209 HydrophobicContact CB-CB 4.45Å; A209-W215 HydrophobicContact CB-CH2 4.22Å; A209-W215 HydrophobicContact CB-CZ2 3.98Å
210	A	82.3	Confident	84.7	Confident	25 Å²	25	78.7 Å²	78.7	21%	0.207	37%	0.369	C	S	.	.			trans	-68.1	166.4	177.9	0	0	0	0	0	112.6	F77 V78 N79 Q212 W215	F77-A210 HydrophobicContact CE1-CB 4.26Å; F77-A210 HydrophobicContact CZ-CB 3.96Å; V78-A210 WeakPolarHBondContact O-CB 3.24Å; V78-A210 PolarHBondContact O-N 2.86Å; N79-A210 WeakPolarHBondContact O-CB 3.3Å; A210-Q212 PolarHBondContact O-N 2.67Å; A210-Q212 VanDerWaalsContact O-N 3.11Å; A210-W215 PolarHBondContact O-NE1 3.12Å
211	D	81.4	Confident	84.4	Confident	92 Å²	92	81.6 Å²	81.6	49%	0.492	39%	0.385	S	S	.	.			trans	-53.9	118.6	-179.7	-174.6	-4.8	0	0	0	111.4	K213 S214	D211-K213 PolarHBondContact O-N 2.85Å; D211-K213 WeakPolarHBondContact OD1-CG 3.22Å; D211-K213 PolarHBondContact OD1-N 2.93Å; D211-K213 IonicContact OD1-NZ 3.25Å; D211-K213 PolarHBondContact OD1-NZ 2.88Å; D211-K213 IonicContact OD2-NZ 2.77Å; D211-K213 PolarHBondContact OD2-NZ 3.3Å; D211-S214 WeakPolarHBondContact O-CB 3.33Å; D211-S214 PolarHBondContact O-N 2.68Å; D211-S214 PolarHBondContact O-OG 3.24Å
212	Q	78.3	Confident	84.3	Confident	114 Å²	114	78.6 Å²	78.6	53%	0.533	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-53.1	-26.3	-175.5	-63.1	169.2	-4.5	0	0	113.1	A210 S214 W215 F222	A210-Q212 PolarHBondContact O-N 2.67Å; A210-Q212 VanDerWaalsContact O-N 3.11Å; Q212-S214 PolarHBondContact O-N 2.91Å; Q212-S214 VanDerWaalsContact O-N 3.07Å; Q212-W215 WeakPolarHBondContact O-CB 3.41Å; Q212-W215 PolarHBondContact O-N 2.92Å; Q212-F222 HydrophobicContact CG-CD1 4.48Å
213	K	76.2	Confident	84.1	Confident	180 Å²	180	82.2 Å²	82.2	78%	0.783	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-57.3	-21.2	175.7	-62.6	-178.4	-154.8	98.8	0	114	D211	D211-K213 PolarHBondContact O-N 2.85Å; D211-K213 WeakPolarHBondContact OD1-CG 3.22Å; D211-K213 PolarHBondContact OD1-N 2.93Å; D211-K213 IonicContact OD1-NZ 3.25Å; D211-K213 PolarHBondContact OD1-NZ 2.88Å; D211-K213 IonicContact OD2-NZ 2.77Å; D211-K213 PolarHBondContact OD2-NZ 3.3Å
214	S	79.6	Confident	84.2	Confident	71 Å²	71	77.6 Å²	77.6	50%	0.497	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-87.9	-8.6	179.5	63.5	0	0	0	0	114.1	D211 Q212	D211-S214 WeakPolarHBondContact O-CB 3.33Å; D211-S214 PolarHBondContact O-N 2.68Å; D211-S214 PolarHBondContact O-OG 3.24Å; Q212-S214 PolarHBondContact O-N 2.91Å; Q212-S214 VanDerWaalsContact O-N 3.07Å
215	W	87.2	Confident	84.6	Confident	28 Å²	28	71.1 Å²	71.1	11%	0.106	36%	0.356	C	S	.	.			trans	-84.7	155.7	-171	-60.3	7.5	0	0	0	112	V78 I81 A209 A210 Q212 L217 F222	V78-W215 HydrophobicContact CG1-CZ2 4.37Å; I81-W215 HydrophobicContact CB-CD2 4.42Å; I81-W215 HydrophobicContact CB-CE3 3.96Å; I81-W215 HydrophobicContact CB-CZ3 4.41Å; I81-W215 HydrophobicContact CD1-CE3 3.92Å; I81-W215 HydrophobicContact CD1-CH2 4.17Å; I81-W215 HydrophobicContact CD1-CZ3 3.48Å; I81-W215 VanDerWaalsContact CD1-CZ3 3.48Å; I81-W215 HydrophobicContact CG1-CD2 4.3Å; I81-W215 HydrophobicContact CG1-CE3 3.73Å; I81-W215 HydrophobicContact CG1-CH2 4.26Å; I81-W215 HydrophobicContact CG1-CZ3 3.7Å; A209-W215 HydrophobicContact CB-CH2 4.22Å; A209-W215 HydrophobicContact CB-CZ2 3.98Å; A210-W215 PolarHBondContact O-NE1 3.12Å; Q212-W215 WeakPolarHBondContact O-CB 3.41Å; Q212-W215 PolarHBondContact O-N 2.92Å; W215-L217 HydrophobicContact CE3-CD1 3.97Å; W215-L217 PolarHBondContact O-N 3.12Å; W215-F222 HydrophobicContact CE3-CB 4.28Å; W215-F222 HydrophobicContact CE3-CG 4.45Å; W215-F222 HydrophobicContact CH2-CD1 4.08Å; W215-F222 HydrophobicContact CH2-CD2 4.27Å; W215-F222 HydrophobicContact CH2-CE1 4.16Å; W215-F222 HydrophobicContact CH2-CE2 4.34Å; W215-F222 HydrophobicContact CH2-CG 4.12Å; W215-F222 HydrophobicContact CH2-CZ 4.28Å; W215-F222 HydrophobicContact CZ3-CB 3.78Å; W215-F222 AromaticContact CZ3-CD1 3.87Å; W215-F222 HydrophobicContact CZ3-CD1 3.87Å; W215-F222 AromaticContact CZ3-CD2 3.71Å; W215-F222 HydrophobicContact CZ3-CD2 3.71Å; W215-F222 HydrophobicContact CZ3-CE1 4.36Å; W215-F222 HydrophobicContact CZ3-CE2 4.21Å; W215-F222 AromaticContact CZ3-CG 3.5Å; W215-F222 HydrophobicContact CZ3-CG 3.5Å; W215-F222 VanDerWaalsContact CZ3-CG 3.5Å
216	R	86.9	Confident	85.4	Confident	137 Å²	137	70.3 Å²	70.3	52%	0.517	34%	0.344	S	S	.	.			trans	-104.3	32.5	-169.5	-49.4	-177.9	75.9	171.2	5.1	112.2	I81 Y218	I81-R216 PolarHBondContact O-N 3.28Å; R216-Y218 HydrophobicContact CB-CE2 4.49Å; R216-Y218 WeakPolarHBondContact O-CD2 3.38Å; R216-Y218 PolarHBondContact O-N 3.41Å; R216-Y218 VanDerWaalsContact O-N 3.14Å
217	L	86.6	Confident	86.2	Confident	20 Å²	20	73.3 Å²	73.3	11%	0.105	36%	0.36	C	S	.	.			trans	-79.8	86.2	178.2	-64.6	176.2	0	0	0	110.5	I81 G82 V84 W215 F220 F222 L248	I81-L217 HydrophobicContact CB-CD1 4.49Å; I81-L217 HydrophobicContact CB-CD2 4.27Å; I81-L217 HydrophobicContact CB-CG 4.41Å; I81-L217 HydrophobicContact CG2-CD2 3.83Å; I81-L217 HydrophobicContact CG2-CG 4.49Å; G82-L217 WeakPolarHBondContact O-CD2 3.4Å; V84-L217 HydrophobicContact CG2-CD2 4.03Å; W215-L217 HydrophobicContact CE3-CD1 3.97Å; W215-L217 PolarHBondContact O-N 3.12Å; L217-F220 WeakPolarHBondContact CB-O 3.05Å; L217-F220 HydrophobicContact CD2-CB 4.46Å; L217-F222 HydrophobicContact CD1-CB 4.13Å; L217-L248 HydrophobicContact CD1-CD2 4.19Å
218	Y	82.8	Confident	86.8	Confident	163 Å²	163	74.6 Å²	74.6	64%	0.639	37%	0.367	S	S	*	.	S	Bend	trans	-73.3	-35.3	-179.5	-56.8	-64.9	0	0	0	113.7	R216	R216-Y218 HydrophobicContact CB-CE2 4.49Å; R216-Y218 WeakPolarHBondContact O-CD2 3.38Å; R216-Y218 PolarHBondContact O-N 3.41Å; R216-Y218 VanDerWaalsContact O-N 3.14Å
219	Q	85.4	Confident	87.3	Confident	64 Å²	64	73.8 Å²	73.8	30%	0.299	37%	0.369	S	S	.	.	S	Bend	trans	-109.8	-4.4	-173.8	-63.1	-175.2	18.8	0	0	114.1	R250 R251	Q219-R250 VanDerWaalsContact O-CG 3.32Å; Q219-R250 WeakPolarHBondContact O-CG 3.06Å; Q219-R251 PolarHBondContact O-N 3.03Å
220	F	91.1	Very high	87.9	Confident	4 Å²	4	75.4 Å²	75.4	2%	0.018	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	154.3	-172.3	-67.3	-87.8	0	0	0	110.6	V84 H182 L217 L248 S249 R250	V84-F220 HydrophobicContact CB-CD2 3.87Å; V84-F220 HydrophobicContact CB-CE2 3.63Å; V84-F220 HydrophobicContact CB-CZ 4.5Å; V84-F220 HydrophobicContact CG1-CD2 4.37Å; V84-F220 HydrophobicContact CG1-CE2 3.73Å; V84-F220 HydrophobicContact CG1-CZ 4.14Å; V84-F220 HydrophobicContact CG2-CD2 3.95Å; V84-F220 HydrophobicContact CG2-CE2 4.16Å; H182-F220 AromaticContact CD2-CE1 3.99Å; L217-F220 WeakPolarHBondContact CB-O 3.05Å; L217-F220 HydrophobicContact CD2-CB 4.46Å; F220-L248 HydrophobicContact CD1-CB 4.23Å; F220-S249 CarbonylContact C-O 3.32Å; F220-S249 VanDerWaalsContact CA-O 3.26Å; F220-S249 WeakPolarHBondContact CA-O 3.43Å; F220-R250 HydrophobicContact CD1-CB 4.21Å; F220-R250 HydrophobicContact CD1-CG 4.49Å; F220-R250 HydrophobicContact CE1-CB 4.16Å; F220-R250 HydrophobicContact CE1-CG 4.34Å; F220-R250 VanDerWaalsContact CZ-CZ 3.42Å
221	D	90.8	Very high	88.6	Confident	66 Å²	66	77.7 Å²	77.7	35%	0.353	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	146.9	164.5	-80.6	-62.2	0	0	0	109.8	L248 S249 R251	D221-L248 WeakPolarHBondContact O-CA 3.38Å; D221-S249 PolarHBondContact N-O 3.36Å; D221-S249 PolarHBondContact O-N 3.21Å; D221-R251 IonicContact OD1-CZ 3.43Å; D221-R251 VanDerWaalsContact OD1-CZ 3.29Å; D221-R251 IonicContact OD1-NE 3.86Å; D221-R251 PolarHBondContact OD1-NE 3.13Å; D221-R251 VanDerWaalsContact OD1-NE 3.12Å; D221-R251 IonicContact OD1-NH2 2.59Å; D221-R251 PolarHBondContact OD1-NH2 3.14Å; D221-R251 WeakPolarHBondContact OD2-CD 3.33Å; D221-R251 WeakPolarHBondContact OD2-CG 3.34Å; D221-R251 IonicContact OD2-CZ 2.68Å; D221-R251 IonicContact OD2-NE 3.57Å; D221-R251 PolarHBondContact OD2-NE 2.85Å; D221-R251 IonicContact OD2-NH2 3.81Å
222	F	91.9	Very high	89.2	Confident	34 Å²	34	76.9 Å²	76.9	15%	0.149	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	117.4	175.6	171	-100.5	0	0	0	109.9	I81 Q212 W215 L217 G224 L225 F246 L248	I81-F222 HydrophobicContact CD1-CD2 4.2Å; Q212-F222 HydrophobicContact CG-CD1 4.48Å; W215-F222 HydrophobicContact CE3-CB 4.28Å; W215-F222 HydrophobicContact CE3-CG 4.45Å; W215-F222 HydrophobicContact CH2-CD1 4.08Å; W215-F222 HydrophobicContact CH2-CD2 4.27Å; W215-F222 HydrophobicContact CH2-CE1 4.16Å; W215-F222 HydrophobicContact CH2-CE2 4.34Å; W215-F222 HydrophobicContact CH2-CG 4.12Å; W215-F222 HydrophobicContact CH2-CZ 4.28Å; W215-F222 HydrophobicContact CZ3-CB 3.78Å; W215-F222 AromaticContact CZ3-CD1 3.87Å; W215-F222 HydrophobicContact CZ3-CD1 3.87Å; W215-F222 AromaticContact CZ3-CD2 3.71Å; W215-F222 HydrophobicContact CZ3-CD2 3.71Å; W215-F222 HydrophobicContact CZ3-CE1 4.36Å; W215-F222 HydrophobicContact CZ3-CE2 4.21Å; W215-F222 AromaticContact CZ3-CG 3.5Å; W215-F222 HydrophobicContact CZ3-CG 3.5Å; W215-F222 VanDerWaalsContact CZ3-CG 3.5Å; L217-F222 HydrophobicContact CD1-CB 4.13Å; F222-G224 VanDerWaalsContact CE2-C 3.45Å; F222-G224 WeakPolarHBondContact CE2-O 3.17Å; F222-G224 WeakPolarHBondContact CZ-O 3.42Å; F222-L225 HydrophobicContact CE2-CB 4.32Å; F222-L225 HydrophobicContact CZ-CB 4.08Å; F222-L225 HydrophobicContact CZ-CD2 4.23Å; F222-L225 HydrophobicContact CZ-CG 4.49Å; F222-F246 HydrophobicContact CE2-CD1 4.14Å; F222-L248 HydrophobicContact CB-CD2 4.3Å; F222-L248 HydrophobicContact CD2-CD2 4.14Å
223	M	91.3	Very high	90	Very high	121 Å²	121	78.8 Å²	78.8	60%	0.596	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.1	-37.1	-176.8	-59.1	-62.2	-78.9	0	0	111.8	D247	M223-D247 HydrophobicContact CB-CB 4.32Å; M223-D247 PolarHBondContact N-O 2.91Å
224	G	91.4	Very high	90.7	Very high	21 Å²	21	72.7 Å²	72.7	22%	0.216	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.2	179.6	-178.6	0	0	0	0	0	113.6	F222 D247	F222-G224 VanDerWaalsContact CE2-C 3.45Å; F222-G224 WeakPolarHBondContact CE2-O 3.17Å; F222-G224 WeakPolarHBondContact CZ-O 3.42Å; G224-D247 PolarHBondContact O-N 3.4Å
225	L	91.5	Very high	91.3	Very high	60 Å²	60	77 Å²	77	31%	0.314	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	150.7	173	69.4	88.1	0	0	0	110.5	V207 F222 Y245 F246	V207-L225 HydrophobicContact CB-CD1 3.84Å; V207-L225 HydrophobicContact CB-CD2 4.38Å; V207-L225 HydrophobicContact CG1-CD1 3.91Å; V207-L225 HydrophobicContact CG1-CD2 3.72Å; V207-L225 HydrophobicContact CG1-CG 4.45Å; F222-L225 HydrophobicContact CE2-CB 4.32Å; F222-L225 HydrophobicContact CZ-CB 4.08Å; F222-L225 HydrophobicContact CZ-CD2 4.23Å; F222-L225 HydrophobicContact CZ-CG 4.49Å; L225-Y245 VanDerWaalsContact CA-O 3.28Å; L225-Y245 WeakPolarHBondContact CA-O 3.49Å; L225-F246 HydrophobicContact CB-CD1 4.33Å
226	R	93.1	Very high	91.5	Very high	104 Å²	104	79.3 Å²	79.3	39%	0.392	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	143.6	172.4	59.3	176.3	-171.2	-99.8	3.9	110.4	S183 V244 Y245 D247	S183-R226 PolarHBondContact OG-NH1 3Å; S183-R226 VanDerWaalsContact OG-NH1 3.11Å; S183-R226 PolarHBondContact OG-NH2 3.33Å; R226-V244 CarbonylContact O-C 3.5Å; R226-V244 WeakPolarHBondContact O-CA 3.5Å; R226-Y245 HydrophobicContact CG-CD2 4.03Å; R226-Y245 HydrophobicContact CG-CG 4.3Å; R226-Y245 PolarHBondContact N-O 3.25Å; R226-Y245 PolarHBondContact O-N 3.49Å; R226-D247 IonicContact CZ-OD1 2.9Å; R226-D247 IonicContact CZ-OD2 3.7Å; R226-D247 IonicContact NH1-OD1 2.7Å; R226-D247 PolarHBondContact NH1-OD1 3.42Å; R226-D247 IonicContact NH1-OD2 2.92Å; R226-D247 PolarHBondContact NH1-OD2 3.35Å
227	N	93.6	Very high	91.8	Very high	70 Å²	70	74 Å²	74	37%	0.374	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	151.9	176.9	65	-17	0	0	0	111.6	W202 S206	W202-N227 HydrophobicContact CD2-CB 4.39Å; W202-N227 HydrophobicContact CZ2-CB 3.95Å; S206-N227 PolarHBondContact OG-ND2 2.04Å; S206-N227 VanDerWaalsContact OG-ND2 3.11Å
228	T	94.3	Very high	92.3	Very high	46 Å²	46	75.5 Å²	75.5	28%	0.282	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	159.3	-173.7	35.3	0	0	0	0	109.9	W202 T243 Y245	W202-T228 PolarHBondContact NE1-O 2.91Å; T228-T243 PolarHBondContact N-O 2.8Å; T228-T243 PolarHBondContact O-N 2.88Å; T228-T243 WeakPolarHBondContact OG1-CB 3.26Å; T228-T243 PolarHBondContact OG1-O 2.87Å; T228-Y245 HydrophobicContact CG2-CE2 4.32Å; T228-Y245 WeakPolarHBondContact OG1-CE2 3.32Å
229	T	95.6	Very high	92.9	Very high	84 Å²	84	68.3 Å²	68.3	52%	0.515	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	113.1	-180	59	0	0	0	0	109.3	W202 M242	W202-T229 HydrophobicContact CG-CG2 4.39Å; W202-T229 VanDerWaalsContact NE1-CG2 3.34Å; T229-M242 HydrophobicContact CG2-CE 3.98Å; T229-M242 HydrophobicContact CG2-SD 3.66Å
230	D	95.4	Very high	93.4	Very high	80 Å²	80	65.8 Å²	65.8	43%	0.428	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	167.3	-174.2	-61.4	-64.9	0	0	0	110.8	V241	D230-V241 PolarHBondContact N-O 3.02Å; D230-V241 PolarHBondContact O-N 2.84Å
231	V	95.8	Very high	93.7	Very high	72 Å²	72	65.7 Å²	65.7	44%	0.436	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	117.2	171.3	178.8	0	0	0	0	108.7	Q195 D238 Y239	Q195-V231 VanDerWaalsContact OE1-CG1 3.31Å; V231-D238 HydrophobicContact CG1-CB 3.99Å; V231-Y239 WeakPolarHBondContact CA-O 3.35Å
232	I	94.1	Very high	94	Very high	76 Å²	76	62.5 Å²	62.5	39%	0.39	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	123.6	178.3	-59.9	-170.8	0	0	0	109.1	T234 Y239 V241	I232-T234 HydrophobicContact CG2-CG2 4.22Å; I232-Y239 PolarHBondContact N-O 3.5Å; I232-Y239 PolarHBondContact O-N 2.86Å; I232-V241 HydrophobicContact CB-CG2 3.95Å; I232-V241 HydrophobicContact CD1-CB 4.24Å; I232-V241 HydrophobicContact CD1-CG1 4.2Å; I232-V241 HydrophobicContact CD1-CG2 3.84Å; I232-V241 HydrophobicContact CG1-CB 4.19Å; I232-V241 HydrophobicContact CG1-CG2 3.7Å
233	K	94.6	Very high	94.2	Very high	154 Å²	154	61.2 Å²	61.2	67%	0.67	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.1	131.4	173.6	-53	-162	166.3	-89.2	0	110	D238	K233-D238 WeakPolarHBondContact CA-OD1 3.48Å; K233-D238 WeakPolarHBondContact CB-OD1 3.41Å; K233-D238 WeakPolarHBondContact CG-OD1 3.4Å; K233-D238 IonicContact NZ-OD1 3.74Å; K233-D238 PolarHBondContact NZ-OD1 2.78Å; K233-D238 IonicContact NZ-OD2 3.71Å; K233-D238 PolarHBondContact NZ-OD2 3.21Å
234	T	92.5	Very high	94.4	Very high	51 Å²	51	55.4 Å²	55.4	31%	0.313	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	170.5	179.2	76.3	0	0	0	0	110.8	I232 A236 G237 Y239	I232-T234 HydrophobicContact CG2-CG2 4.22Å; T234-A236 PolarHBondContact O-N 2.94Å; T234-A236 PolarHBondContact OG1-N 2.91Å; T234-G237 WeakPolarHBondContact CA-O 3.45Å; T234-G237 PolarHBondContact N-O 3.14Å; T234-G237 PolarHBondContact O-N 2.89Å; T234-G237 PolarHBondContact OG1-N 2.83Å; T234-G237 PolarHBondContact OG1-O 3.49Å; T234-Y239 HydrophobicContact CG2-CD2 3.97Å; T234-Y239 HydrophobicContact CG2-CE2 4.45Å; T234-Y239 WeakPolarHBondContact OG1-CD2 3.38Å; T234-Y239 VanDerWaalsContact OG1-CE2 3.26Å; T234-Y239 WeakPolarHBondContact OG1-CE2 3.49Å
235	T	92.1	Very high	94.6	Very high	163 Å²	163	57.6 Å²	57.6	100%	1	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-20.6	174.8	45.8	0	0	0	0	114
236	A	90.7	Very high	94.8	Very high	75 Å²	75	54.8 Å²	54.8	62%	0.62	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-10.9	177.5	0	0	0	0	0	113.5	T234 Y239	T234-A236 PolarHBondContact O-N 2.94Å; T234-A236 PolarHBondContact OG1-N 2.91Å; A236-Y239 HydrophobicContact CB-CE2 4.23Å
237	G	93.3	Very high	94.9	Very high	25 Å²	25	51.6 Å²	51.6	26%	0.258	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	140.1	-176.5	-174.9	0	0	0	0	0	113.1	T234 Y239	T234-G237 WeakPolarHBondContact CA-O 3.45Å; T234-G237 PolarHBondContact N-O 3.14Å; T234-G237 PolarHBondContact O-N 2.89Å; T234-G237 PolarHBondContact OG1-N 2.83Å; T234-G237 PolarHBondContact OG1-O 3.49Å; G237-Y239 VanDerWaalsContact O-CD2 3.27Å; G237-Y239 WeakPolarHBondContact O-CD2 3.45Å; G237-Y239 WeakPolarHBondContact O-CE2 3.48Å
238	D	96.4	Very high	94.9	Very high	53 Å²	53	48.5 Å²	48.5	28%	0.283	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	131	175	-70.8	-3	0	0	0	110.3	Q195 V231 K233	Q195-D238 PolarHBondContact N-O 3.06Å; V231-D238 HydrophobicContact CG1-CB 3.99Å; K233-D238 WeakPolarHBondContact CA-OD1 3.48Å; K233-D238 WeakPolarHBondContact CB-OD1 3.41Å; K233-D238 WeakPolarHBondContact CG-OD1 3.4Å; K233-D238 IonicContact NZ-OD1 3.74Å; K233-D238 PolarHBondContact NZ-OD1 2.78Å; K233-D238 IonicContact NZ-OD2 3.71Å; K233-D238 PolarHBondContact NZ-OD2 3.21Å
239	Y	96.1	Very high	94.9	Very high	11 Å²	11	47.5 Å²	47.5	4%	0.043	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	134	-174.6	-72	-99.9	0	0	0	111	S190 G192 Y193 V231 I232 T234 A236 G237 V241	S190-Y239 WeakPolarHBondContact OG-CD1 3.4Å; G192-Y239 PolarHBondContact O-OH 2.84Å; G192-Y239 VanDerWaalsContact O-OH 3.04Å; Y193-Y239 WeakPolarHBondContact O-CD1 3.44Å; Y193-Y239 VanDerWaalsContact O-CE1 3.28Å; Y193-Y239 WeakPolarHBondContact O-CE1 3.47Å; V231-Y239 WeakPolarHBondContact CA-O 3.35Å; I232-Y239 PolarHBondContact N-O 3.5Å; I232-Y239 PolarHBondContact O-N 2.86Å; T234-Y239 HydrophobicContact CG2-CD2 3.97Å; T234-Y239 HydrophobicContact CG2-CE2 4.45Å; T234-Y239 WeakPolarHBondContact OG1-CD2 3.38Å; T234-Y239 VanDerWaalsContact OG1-CE2 3.26Å; T234-Y239 WeakPolarHBondContact OG1-CE2 3.49Å; A236-Y239 HydrophobicContact CB-CE2 4.23Å; G237-Y239 VanDerWaalsContact O-CD2 3.27Å; G237-Y239 WeakPolarHBondContact O-CD2 3.45Å; G237-Y239 WeakPolarHBondContact O-CE2 3.48Å; Y239-V241 PolarHBondContact O-N 3.27Å
240	V	96.3	Very high	94.7	Very high	12 Å²	12	44.1 Å²	44.1	7%	0.073	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	123.3	169.7	-178.2	0	0	0	0	108.8	S189 Q195 I199 M242	S189-V240 VanDerWaalsContact CB-O 3.23Å; S189-V240 WeakPolarHBondContact CB-O 3.4Å; Q195-V240 HydrophobicContact CB-CG2 4Å; Q195-V240 HydrophobicContact CG-CG2 3.76Å; I199-V240 HydrophobicContact CG1-CG2 4.42Å; I199-V240 HydrophobicContact CG2-CG2 4.46Å; V240-M242 HydrophobicContact CG1-SD 4.4Å
241	V	97.1	Very high	94.4	Very high	1 Å²	1	46 Å²	46	1%	0.006	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	130.5	-176.8	-178.2	0	0	0	0	109.7	I187 D230 I232 Y239	I187-V241 HydrophobicContact CG2-CG1 3.36Å; D230-V241 PolarHBondContact N-O 3.02Å; D230-V241 PolarHBondContact O-N 2.84Å; I232-V241 HydrophobicContact CB-CG2 3.95Å; I232-V241 HydrophobicContact CD1-CB 4.24Å; I232-V241 HydrophobicContact CD1-CG1 4.2Å; I232-V241 HydrophobicContact CD1-CG2 3.84Å; I232-V241 HydrophobicContact CG1-CB 4.19Å; I232-V241 HydrophobicContact CG1-CG2 3.7Å; Y239-V241 PolarHBondContact O-N 3.27Å
242	M	96.3	Very high	94.1	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	126.3	-177.8	-55.8	-67.4	-81.4	0	0	108.2	F188 Y200 W202 T229 V240	F188-M242 HydrophobicContact CD1-CB 4.1Å; F188-M242 HydrophobicContact CD2-CB 3.91Å; F188-M242 HydrophobicContact CD2-CG 4.24Å; F188-M242 HydrophobicContact CE1-CB 3.65Å; F188-M242 HydrophobicContact CE2-CB 3.44Å; F188-M242 VanDerWaalsContact CE2-CB 3.44Å; F188-M242 HydrophobicContact CE2-CG 3.66Å; F188-M242 HydrophobicContact CG-CB 4.22Å; F188-M242 HydrophobicContact CZ-CB 3.3Å; F188-M242 HydrophobicContact CZ-CG 3.93Å; F188-M242 PolarHBondContact N-O 3.44Å; F188-M242 PolarHBondContact O-N 2.9Å; Y200-M242 VanDerWaalsContact CB-CG 3.48Å; Y200-M242 VanDerWaalsContact CB-SD 3.56Å; Y200-M242 HydrophobicContact CD2-CG 4.47Å; Y200-M242 HydrophobicContact CG-CG 4.05Å; W202-M242 HydrophobicContact CD2-CE 3.4Å; W202-M242 VanDerWaalsContact CD2-CE 3.4Å; W202-M242 VanDerWaalsContact CE2-CE 3.46Å; W202-M242 HydrophobicContact CE3-CE 3.88Å; W202-M242 HydrophobicContact CG-CE 3.67Å; W202-M242 HydrophobicContact CH2-CB 4.44Å; W202-M242 HydrophobicContact CZ2-CB 4.05Å; W202-M242 HydrophobicContact CZ2-CE 4.05Å; W202-M242 HydrophobicContact CZ3-CE 4.42Å; T229-M242 HydrophobicContact CG2-CE 3.98Å; T229-M242 HydrophobicContact CG2-SD 3.66Å; V240-M242 HydrophobicContact CG1-SD 4.4Å
243	T	96.6	Very high	93.7	Very high	6 Å²	6	43.2 Å²	43.2	4%	0.037	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	129.1	-178.5	-57.2	0	0	0	0	110.3	P185 L186 I187 T228 Y245	P185-T243 HydrophobicContact CB-CG2 3.99Å; L186-T243 WeakPolarHBondContact O-CA 3.49Å; I187-T243 HydrophobicContact CG1-CG2 4.03Å; T228-T243 PolarHBondContact N-O 2.8Å; T228-T243 PolarHBondContact O-N 2.88Å; T228-T243 WeakPolarHBondContact OG1-CB 3.26Å; T228-T243 PolarHBondContact OG1-O 2.87Å; T243-Y245 HydrophobicContact CG2-CD2 4Å; T243-Y245 HydrophobicContact CG2-CE1 4.25Å; T243-Y245 HydrophobicContact CG2-CE2 3.58Å
244	V	96	Very high	93.2	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	129.3	165.4	-174.6	0	0	0	0	107.7	I76 P185 L186 W202 V207 R226 F246	I76-V244 HydrophobicContact CD1-CG2 4.16Å; P185-V244 CarbonylContact C-O 3.59Å; P185-V244 WeakPolarHBondContact CA-O 3.43Å; L186-V244 PolarHBondContact N-O 2.99Å; L186-V244 PolarHBondContact O-N 3.36Å; W202-V244 HydrophobicContact CH2-CG2 3.41Å; W202-V244 VanDerWaalsContact CH2-CG2 3.41Å; W202-V244 HydrophobicContact CZ2-CG2 3.74Å; W202-V244 HydrophobicContact CZ3-CG2 4.45Å; V207-V244 HydrophobicContact CG1-CG1 4.38Å; V207-V244 HydrophobicContact CG2-CG1 4.41Å; V207-V244 HydrophobicContact CG2-CG2 3.94Å; R226-V244 CarbonylContact O-C 3.5Å; R226-V244 WeakPolarHBondContact O-CA 3.5Å; V244-F246 HydrophobicContact CB-CE2 4.28Å; V244-F246 HydrophobicContact CB-CZ 4.35Å; V244-F246 HydrophobicContact CG1-CE1 4.08Å; V244-F246 HydrophobicContact CG1-CE2 3.98Å; V244-F246 HydrophobicContact CG1-CZ 3.73Å
245	Y	95.8	Very high	92.8	Very high	66 Å²	66	40.4 Å²	40.4	26%	0.259	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	135	167.8	-59.3	-94.9	0	0	0	109.4	C184 P185 L225 R226 T228 T243	C184-Y245 WeakPolarHBondContact O-CA 3.27Å; P185-Y245 HydrophobicContact CB-CD1 3.91Å; P185-Y245 HydrophobicContact CB-CE1 3.89Å; L225-Y245 VanDerWaalsContact CA-O 3.28Å; L225-Y245 WeakPolarHBondContact CA-O 3.49Å; R226-Y245 HydrophobicContact CG-CD2 4.03Å; R226-Y245 HydrophobicContact CG-CG 4.3Å; R226-Y245 PolarHBondContact N-O 3.25Å; R226-Y245 PolarHBondContact O-N 3.49Å; T228-Y245 HydrophobicContact CG2-CE2 4.32Å; T228-Y245 WeakPolarHBondContact OG1-CE2 3.32Å; T243-Y245 HydrophobicContact CG2-CD2 4Å; T243-Y245 HydrophobicContact CG2-CE1 4.25Å; T243-Y245 HydrophobicContact CG2-CE2 3.58Å
246	F	95.1	Very high	92.5	Very high	2 Å²	2	34.5 Å²	34.5	1%	0.009	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	115.8	169.4	-59	-81.4	0	0	0	108	V78 I81 Y91 I93 C184 L186 F222 L225 V244	V78-F246 HydrophobicContact CG2-CE1 4.02Å; V78-F246 HydrophobicContact CG2-CZ 4.18Å; I81-F246 HydrophobicContact CD1-CB 4.34Å; I81-F246 HydrophobicContact CD1-CD1 3.9Å; I81-F246 HydrophobicContact CD1-CG 4.2Å; Y91-F246 HydrophobicContact CE2-CD2 4.28Å; I93-F246 HydrophobicContact CD1-CD2 4.47Å; I93-F246 HydrophobicContact CD1-CE1 4.12Å; I93-F246 HydrophobicContact CD1-CE2 3.75Å; I93-F246 HydrophobicContact CD1-CZ 3.54Å; C184-F246 PolarHBondContact N-O 3.16Å; C184-F246 PolarHBondContact O-N 2.96Å; L186-F246 HydrophobicContact CB-CE2 3.91Å; L186-F246 HydrophobicContact CD2-CE2 4.41Å; F222-F246 HydrophobicContact CE2-CD1 4.14Å; L225-F246 HydrophobicContact CB-CD1 4.33Å; V244-F246 HydrophobicContact CB-CE2 4.28Å; V244-F246 HydrophobicContact CB-CZ 4.35Å; V244-F246 HydrophobicContact CG1-CE1 4.08Å; V244-F246 HydrophobicContact CG1-CE2 3.98Å; V244-F246 HydrophobicContact CG1-CZ 3.73Å
247	D	94.9	Very high	92.2	Very high	36 Å²	36	36.9 Å²	36.9	19%	0.193	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	117.6	-178.1	-68.4	-46.2	0	0	0	109.6	S183 M223 G224 R226	S183-D247 WeakPolarHBondContact CA-OD1 3.44Å; S183-D247 WeakPolarHBondContact CB-OD1 3.27Å; S183-D247 PolarHBondContact OG-OD1 3.08Å; M223-D247 HydrophobicContact CB-CB 4.32Å; M223-D247 PolarHBondContact N-O 2.91Å; G224-D247 PolarHBondContact O-N 3.4Å; R226-D247 IonicContact CZ-OD1 2.9Å; R226-D247 IonicContact CZ-OD2 3.7Å; R226-D247 IonicContact NH1-OD1 2.7Å; R226-D247 PolarHBondContact NH1-OD1 3.42Å; R226-D247 IonicContact NH1-OD2 2.92Å; R226-D247 PolarHBondContact NH1-OD2 3.35Å
248	L	93.9	Very high	91.4	Very high	5 Å²	5	39.8 Å²	39.8	3%	0.026	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	127.2	-170.7	-59.2	177	0	0	0	110.4	V84 E181 H182 L217 F220 D221 F222	V84-L248 HydrophobicContact CG2-CD1 4.05Å; E181-L248 CarbonylContact C-O 3.52Å; E181-L248 WeakPolarHBondContact CA-O 3.49Å; H182-L248 PolarHBondContact N-O 2.88Å; H182-L248 PolarHBondContact O-N 3.35Å; L217-L248 HydrophobicContact CD1-CD2 4.19Å; F220-L248 HydrophobicContact CD1-CB 4.23Å; D221-L248 WeakPolarHBondContact O-CA 3.38Å; F222-L248 HydrophobicContact CB-CD2 4.3Å; F222-L248 HydrophobicContact CD2-CD2 4.14Å
249	S	93.3	Very high	90.6	Very high	25 Å²	25	38.2 Å²	38.2	18%	0.175	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	145.4	177.6	-166.7	0	0	0	0	110.4	E181 F220 D221	E181-S249 VanDerWaalsContact OE1-CB 3.23Å; E181-S249 WeakPolarHBondContact OE1-CB 3.26Å; E181-S249 PolarHBondContact OE1-OG 2.81Å; F220-S249 CarbonylContact C-O 3.32Å; F220-S249 VanDerWaalsContact CA-O 3.26Å; F220-S249 WeakPolarHBondContact CA-O 3.43Å; D221-S249 PolarHBondContact N-O 3.36Å; D221-S249 PolarHBondContact O-N 3.21Å
250	R	91.7	Very high	90.1	Very high	14 Å²	14	37.9 Å²	37.9	5%	0.053	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	135.3	-172.5	-166.2	179.7	-62.7	-95.2	6.7	113.6	F177 D180 Q219 F220 M252	F177-R250 VanDerWaalsContact CE2-CZ 3.5Å; D180-R250 VanDerWaalsContact CG-NE 3.28Å; D180-R250 PolarHBondContact O-N 3.46Å; D180-R250 VanDerWaalsContact OD1-CD 3.27Å; D180-R250 WeakPolarHBondContact OD1-CD 3.4Å; D180-R250 IonicContact OD1-CZ 2.74Å; D180-R250 IonicContact OD1-NE 2.74Å; D180-R250 PolarHBondContact OD1-NE 2.93Å; D180-R250 IonicContact OD1-NH2 3.03Å; D180-R250 IonicContact OD2-CZ 3.32Å; D180-R250 VanDerWaalsContact OD2-CZ 3.32Å; D180-R250 IonicContact OD2-NE 3.36Å; D180-R250 PolarHBondContact OD2-NE 3.4Å; D180-R250 IonicContact OD2-NH2 3.42Å; D180-R250 PolarHBondContact OD2-NH2 3.4Å; Q219-R250 VanDerWaalsContact O-CG 3.32Å; Q219-R250 WeakPolarHBondContact O-CG 3.06Å; F220-R250 HydrophobicContact CD1-CB 4.21Å; F220-R250 HydrophobicContact CD1-CG 4.49Å; F220-R250 HydrophobicContact CE1-CB 4.16Å; F220-R250 HydrophobicContact CE1-CG 4.34Å; F220-R250 VanDerWaalsContact CZ-CZ 3.42Å; R250-M252 PolarHBondContact O-N 2.76Å
251	R	90.3	Very high	89.5	Confident	120 Å²	120	41.1 Å²	41.1	45%	0.453	20%	0.204	S	C	.	.			trans	-71.9	93.6	171.4	-74	-177.2	170.5	-177	2.6	111.6	Q219 D221 G253	Q219-R251 PolarHBondContact O-N 3.03Å; D221-R251 IonicContact OD1-CZ 3.43Å; D221-R251 VanDerWaalsContact OD1-CZ 3.29Å; D221-R251 IonicContact OD1-NE 3.86Å; D221-R251 PolarHBondContact OD1-NE 3.13Å; D221-R251 VanDerWaalsContact OD1-NE 3.12Å; D221-R251 IonicContact OD1-NH2 2.59Å; D221-R251 PolarHBondContact OD1-NH2 3.14Å; D221-R251 WeakPolarHBondContact OD2-CD 3.33Å; D221-R251 WeakPolarHBondContact OD2-CG 3.34Å; D221-R251 IonicContact OD2-CZ 2.68Å; D221-R251 IonicContact OD2-NE 3.57Å; D221-R251 PolarHBondContact OD2-NE 2.85Å; D221-R251 IonicContact OD2-NH2 3.81Å; R251-G253 VanDerWaalsContact C-N 3.3Å; R251-G253 PolarHBondContact O-N 3.43Å
252	M	88.6	Confident	88.8	Confident	45 Å²	45	43.3 Å²	43.3	22%	0.222	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-30.9	-176.2	-163.8	-138.1	156.2	0	0	114.7	P178 M179 R250 Y254 F255 T256 Y260 W468	P178-M252 HydrophobicContact CG-CG 4.24Å; M179-M252 HydrophobicContact CE-CE 4.36Å; M179-M252 HydrophobicContact CG-CG 4.47Å; R250-M252 PolarHBondContact O-N 2.76Å; M252-Y254 VanDerWaalsContact C-N 3.3Å; M252-Y254 PolarHBondContact O-N 3.03Å; M252-F255 PolarHBondContact O-N 2.76Å; M252-T256 HydrophobicContact CE-CG2 4.46Å; M252-T256 WeakPolarHBondContact CE-OG1 3.12Å; M252-T256 PolarHBondContact O-N 2.74Å; M252-T256 VanDerWaalsContact O-N 3.16Å; M252-T256 PolarHBondContact O-OG1 3.3Å; M252-T256 PolarHBondContact SD-OG1 2.76Å; M252-Y260 HydrophobicContact CE-CD2 3.8Å; M252-Y260 HydrophobicContact CE-CE2 3.72Å; M252-Y260 HydrophobicContact CE-CG 4.43Å; M252-W468 HydrophobicContact CE-CH2 3.44Å; M252-W468 VanDerWaalsContact CE-CH2 3.44Å; M252-W468 HydrophobicContact CE-CZ3 3.42Å; M252-W468 VanDerWaalsContact CE-CZ3 3.42Å; M252-W468 HydrophobicContact SD-CZ3 4.23Å
253	G	85.8	Confident	88.1	Confident	44 Å²	44	43.4 Å²	43.4	45%	0.454	22%	0.219	S	C	.	.	H	α-helix	trans	-56.4	-30.3	-165.6	0	0	0	0	0	117	R251 T256 I257	R251-G253 VanDerWaalsContact C-N 3.3Å; R251-G253 PolarHBondContact O-N 3.43Å; G253-T256 WeakPolarHBondContact O-CB 3.45Å; G253-T256 PolarHBondContact O-N 3Å; G253-I257 WeakPolarHBondContact O-CG1 3.39Å; G253-I257 PolarHBondContact O-N 3.03Å
254	Y	84.3	Confident	87.7	Confident	139 Å²	139	45.5 Å²	45.5	55%	0.545	23%	0.23	S	C	.	.	H	α-helix	trans	-63.1	-48.3	174.7	176.1	-105.7	0	0	0	111.4	M252 T256 I257 Q258	M252-Y254 VanDerWaalsContact C-N 3.3Å; M252-Y254 PolarHBondContact O-N 3.03Å; Y254-T256 VanDerWaalsContact C-N 3.33Å; Y254-T256 PolarHBondContact O-N 3.29Å; Y254-I257 PolarHBondContact O-N 3.48Å; Y254-Q258 VanDerWaalsContact CZ-OE1 3.25Å; Y254-Q258 WeakPolarHBondContact O-CB 3.22Å; Y254-Q258 PolarHBondContact O-N 3.16Å; Y254-Q258 PolarHBondContact OH-NE2 2.74Å; Y254-Q258 PolarHBondContact OH-OE1 3Å
255	F	84.4	Confident	87.2	Confident	6 Å²	6	50 Å²	50	3%	0.026	25%	0.253	C	S	.	.	H	α-helix	trans	-69.3	-32.4	179.5	-54.6	-76.1	0	0	0	111.7	F177 P178 M252 I257 T259 Y260 M342	F177-F255 HydrophobicContact CE1-CE1 4.42Å; F177-F255 HydrophobicContact CE2-CE1 4.42Å; F177-F255 HydrophobicContact CE2-CE2 4.32Å; F177-F255 HydrophobicContact CE2-CZ 4.03Å; F177-F255 HydrophobicContact CZ-CD1 4.09Å; F177-F255 AromaticContact CZ-CE1 3.59Å; F177-F255 HydrophobicContact CZ-CE1 3.59Å; F177-F255 HydrophobicContact CZ-CE2 4.2Å; F177-F255 AromaticContact CZ-CZ 3.65Å; F177-F255 HydrophobicContact CZ-CZ 3.65Å; P178-F255 HydrophobicContact CB-CB 4.23Å; P178-F255 HydrophobicContact CB-CD2 3.54Å; P178-F255 HydrophobicContact CB-CE2 4.06Å; P178-F255 HydrophobicContact CB-CG 3.85Å; P178-F255 HydrophobicContact CG-CB 3.88Å; P178-F255 HydrophobicContact CG-CD2 4.13Å; P178-F255 HydrophobicContact CG-CG 4.07Å; M252-F255 PolarHBondContact O-N 2.76Å; F255-I257 PolarHBondContact O-N 3.2Å; F255-T259 PolarHBondContact O-N 3.06Å; F255-Y260 HydrophobicContact CB-CE2 4.35Å; F255-Y260 WeakPolarHBondContact O-CD2 3.49Å; F255-Y260 PolarHBondContact O-N 3.34Å; F255-M342 HydrophobicContact CD1-CE 4.49Å
256	T	86.6	Confident	86.5	Confident	40 Å²	40	47.8 Å²	47.8	25%	0.245	25%	0.246	C	C	.	.	I	π-helix	trans	-55.2	-50.1	171.8	-45.9	0	0	0	0	111.6	M252 G253 Y254 Y260 I261	M252-T256 HydrophobicContact CE-CG2 4.46Å; M252-T256 WeakPolarHBondContact CE-OG1 3.12Å; M252-T256 PolarHBondContact O-N 2.74Å; M252-T256 VanDerWaalsContact O-N 3.16Å; M252-T256 PolarHBondContact O-OG1 3.3Å; M252-T256 PolarHBondContact SD-OG1 2.76Å; G253-T256 WeakPolarHBondContact O-CB 3.45Å; G253-T256 PolarHBondContact O-N 3Å; Y254-T256 VanDerWaalsContact C-N 3.33Å; Y254-T256 PolarHBondContact O-N 3.29Å; T256-Y260 PolarHBondContact O-N 2.86Å; T256-I261 HydrophobicContact CG2-CD1 4.32Å; T256-I261 HydrophobicContact CG2-CG1 4.49Å; T256-I261 WeakPolarHBondContact O-CG1 3.3Å; T256-I261 PolarHBondContact O-N 3.26Å
257	I	82.8	Confident	86.1	Confident	124 Å²	124	47.7 Å²	47.7	64%	0.636	25%	0.246	S	C	*	.	I	π-helix	trans	-76.5	-41	-176.9	-62.9	168.9	0	0	0	111.4	G253 Y254 F255 P262	G253-I257 WeakPolarHBondContact O-CG1 3.39Å; G253-I257 PolarHBondContact O-N 3.03Å; Y254-I257 PolarHBondContact O-N 3.48Å; F255-I257 PolarHBondContact O-N 3.2Å; I257-P262 VanDerWaalsContact O-CD 3.24Å; I257-P262 WeakPolarHBondContact O-CD 3.42Å
258	Q	76.6	Confident	85.7	Confident	87 Å²	87	48.9 Å²	48.9	41%	0.407	26%	0.255	S	S	.	.	I	π-helix	trans	-80	-27.9	-174.4	-163.6	-174.6	29.1	0	0	113.8	Y254	Y254-Q258 VanDerWaalsContact CZ-OE1 3.25Å; Y254-Q258 WeakPolarHBondContact O-CB 3.22Å; Y254-Q258 PolarHBondContact O-N 3.16Å; Y254-Q258 PolarHBondContact OH-NE2 2.74Å; Y254-Q258 PolarHBondContact OH-OE1 3Å
259	T	79.4	Confident	85.1	Confident	20 Å²	20	52.6 Å²	52.6	12%	0.123	27%	0.274	C	S	.	.	I	π-helix	trans	-128.5	-57	-173	-50.9	0	0	0	0	113.6	F255 I261 P262 C263 M342 V346	F255-T259 PolarHBondContact O-N 3.06Å; T259-I261 PolarHBondContact O-N 3.26Å; T259-P262 WeakPolarHBondContact O-CD 3.47Å; T259-C263 WeakPolarHBondContact O-CB 3.18Å; T259-C263 PolarHBondContact O-N 2.8Å; T259-C263 PolarHBondContact O-SG 3.44Å; T259-M342 HydrophobicContact CG2-CE 3.63Å; T259-M342 WeakPolarHBondContact OG1-CE 3.28Å; T259-V346 HydrophobicContact CG2-CG2 3.8Å
260	Y	85.8	Confident	84.6	Confident	3 Å²	3	51.6 Å²	51.6	1%	0.012	27%	0.267	C	S	.	.	I	π-helix	trans	-62.7	-48	-172.6	-69.9	-86.2	0	0	0	112.1	P178 M252 F255 T256 C263 I264 F345 Y467 W468	P178-Y260 VanDerWaalsContact CD-OH 3.23Å; P178-Y260 WeakPolarHBondContact CD-OH 3.42Å; P178-Y260 HydrophobicContact CG-CE2 4.01Å; M252-Y260 HydrophobicContact CE-CD2 3.8Å; M252-Y260 HydrophobicContact CE-CE2 3.72Å; M252-Y260 HydrophobicContact CE-CG 4.43Å; F255-Y260 HydrophobicContact CB-CE2 4.35Å; F255-Y260 WeakPolarHBondContact O-CD2 3.49Å; F255-Y260 PolarHBondContact O-N 3.34Å; T256-Y260 PolarHBondContact O-N 2.86Å; Y260-C263 PolarHBondContact O-N 3.47Å; Y260-I264 VanDerWaalsContact O-CG1 3.29Å; Y260-I264 WeakPolarHBondContact O-CG1 3.39Å; Y260-I264 PolarHBondContact O-N 3.48Å; Y260-F345 AromaticContact CD1-CD1 3.54Å; Y260-F345 HydrophobicContact CD1-CD1 3.54Å; Y260-F345 HydrophobicContact CD1-CD2 4.05Å; Y260-F345 AromaticContact CD1-CE1 3.6Å; Y260-F345 HydrophobicContact CD1-CE1 3.6Å; Y260-F345 HydrophobicContact CD1-CE2 4.1Å; Y260-F345 AromaticContact CD1-CG 3.78Å; Y260-F345 HydrophobicContact CD1-CG 3.78Å; Y260-F345 AromaticContact CD1-CZ 3.9Å; Y260-F345 HydrophobicContact CD1-CZ 3.9Å; Y260-F345 HydrophobicContact CE1-CB 3.93Å; Y260-F345 AromaticContact CE1-CD1 3.81Å; Y260-F345 HydrophobicContact CE1-CD1 3.81Å; Y260-F345 AromaticContact CE1-CD2 3.93Å; Y260-F345 HydrophobicContact CE1-CD2 3.93Å; Y260-F345 HydrophobicContact CE1-CE1 4.3Å; Y260-F345 HydrophobicContact CE1-CE2 4.41Å; Y260-F345 AromaticContact CE1-CG 3.61Å; Y260-F345 HydrophobicContact CE1-CG 3.61Å; Y260-F345 HydrophobicContact CG-CE1 4.48Å; Y260-Y467 AromaticContact CE1-CE1 3.81Å; Y260-Y467 HydrophobicContact CE1-CE1 3.81Å; Y260-Y467 PolarHBondContact OH-OH 2.86Å; Y260-W468 AromaticContact CD1-CH2 3.55Å; Y260-W468 HydrophobicContact CD1-CH2 3.55Å; Y260-W468 AromaticContact CD1-CZ2 3.67Å; Y260-W468 HydrophobicContact CD1-CZ2 3.67Å; Y260-W468 HydrophobicContact CD2-CH2 4.39Å; Y260-W468 AromaticContact CE1-CH2 3.72Å; Y260-W468 HydrophobicContact CE1-CH2 3.72Å; Y260-W468 HydrophobicContact CE1-CZ2 4.1Å; Y260-W468 AromaticContact CG-CH2 3.92Å; Y260-W468 HydrophobicContact CG-CH2 3.92Å; Y260-W468 HydrophobicContact CG-CZ2 4.25Å
261	I	84.7	Confident	84.3	Confident	81 Å²	81	52.8 Å²	52.8	42%	0.415	27%	0.272	S	S	.	.	H	α-helix	trans	-61.4	-51.1	178.3	-71.5	171.4	0	0	0	111.5	T256 T259 C263 I264 L265	T256-I261 HydrophobicContact CG2-CD1 4.32Å; T256-I261 HydrophobicContact CG2-CG1 4.49Å; T256-I261 WeakPolarHBondContact O-CG1 3.3Å; T256-I261 PolarHBondContact O-N 3.26Å; T259-I261 PolarHBondContact O-N 3.26Å; I261-C263 VanDerWaalsContact C-N 3.34Å; I261-C263 PolarHBondContact O-N 3.42Å; I261-I264 PolarHBondContact O-N 3.43Å; I261-L265 HydrophobicContact CG2-CD1 3.82Å; I261-L265 HydrophobicContact CG2-CG 4.4Å; I261-L265 WeakPolarHBondContact O-CB 3.44Å; I261-L265 VanDerWaalsContact O-CG 3.3Å; I261-L265 WeakPolarHBondContact O-CG 3.15Å; I261-L265 PolarHBondContact O-N 2.97Å
262	P	82.9	Confident	84	Confident	46 Å²	46	50.3 Å²	50.3	30%	0.299	27%	0.27	S	S	.	.	H	α-helix	trans	-56.1	-39.5	173.1	-31.3	37.9	0	0	0	115	I257 T259 L265 T266	I257-P262 VanDerWaalsContact O-CD 3.24Å; I257-P262 WeakPolarHBondContact O-CD 3.42Å; T259-P262 WeakPolarHBondContact O-CD 3.47Å; P262-L265 PolarHBondContact O-N 3.05Å; P262-T266 WeakPolarHBondContact O-CG2 3.44Å; P262-T266 PolarHBondContact O-N 2.96Å; P262-T266 PolarHBondContact O-OG1 2.73Å
263	C	81.2	Confident	83.5	Confident	2 Å²	2	48.3 Å²	48.3	1%	0.014	26%	0.26	C	S	.	.	H	α-helix	trans	-69.2	-40.3	178.5	-66.7	0	0	0	0	112.5	T259 Y260 I261 L265 T266 V267 F345 C349	T259-C263 WeakPolarHBondContact O-CB 3.18Å; T259-C263 PolarHBondContact O-N 2.8Å; T259-C263 PolarHBondContact O-SG 3.44Å; Y260-C263 PolarHBondContact O-N 3.47Å; I261-C263 VanDerWaalsContact C-N 3.34Å; I261-C263 PolarHBondContact O-N 3.42Å; C263-L265 VanDerWaalsContact C-N 3.34Å; C263-T266 PolarHBondContact O-N 3.49Å; C263-T266 PolarHBondContact O-OG1 2.93Å; C263-T266 VanDerWaalsContact O-OG1 3.09Å; C263-V267 WeakPolarHBondContact O-CG2 3.48Å; C263-V267 PolarHBondContact O-N 3.47Å; C263-V267 VanDerWaalsContact O-N 3.13Å; C263-F345 HydrophobicContact CB-CD1 4.43Å; C263-F345 HydrophobicContact CB-CE1 3.99Å; C263-C349 HydrophobicContact CB-CB 4.22Å
264	I	88	Confident	83.4	Confident	50 Å²	50	46.2 Å²	46.2	26%	0.256	24%	0.238	S	C	.	.	H	α-helix	trans	-62.7	-44	173.3	-69.4	164	0	0	0	109.8	Y260 I261 V267 V268 F345 F460	Y260-I264 VanDerWaalsContact O-CG1 3.29Å; Y260-I264 WeakPolarHBondContact O-CG1 3.39Å; Y260-I264 PolarHBondContact O-N 3.48Å; I261-I264 PolarHBondContact O-N 3.43Å; I264-V267 PolarHBondContact O-N 3.25Å; I264-V268 HydrophobicContact CG2-CG2 4.38Å; I264-V268 VanDerWaalsContact O-CG2 3.3Å; I264-V268 WeakPolarHBondContact O-CG2 3.29Å; I264-V268 PolarHBondContact O-N 3.13Å; I264-F345 HydrophobicContact CD1-CZ 4.17Å; I264-F345 HydrophobicContact CG1-CE1 4.3Å; I264-F345 HydrophobicContact CG1-CZ 3.87Å; I264-F460 HydrophobicContact CG1-CE1 4.28Å; I264-F460 HydrophobicContact CG1-CZ 4.1Å; I264-F460 HydrophobicContact CG2-CE1 4.35Å
265	L	84.6	Confident	83.2	Confident	95 Å²	95	48.2 Å²	48.2	50%	0.497	25%	0.245	S	C	.	.	H	α-helix	trans	-64.7	-40.8	178.8	-70.9	171.9	0	0	0	112.8	I261 P262 C263 V268 L269	I261-L265 HydrophobicContact CG2-CD1 3.82Å; I261-L265 HydrophobicContact CG2-CG 4.4Å; I261-L265 WeakPolarHBondContact O-CB 3.44Å; I261-L265 VanDerWaalsContact O-CG 3.3Å; I261-L265 WeakPolarHBondContact O-CG 3.15Å; I261-L265 PolarHBondContact O-N 2.97Å; P262-L265 PolarHBondContact O-N 3.05Å; C263-L265 VanDerWaalsContact C-N 3.34Å; L265-V268 PolarHBondContact O-N 3.08Å; L265-L269 VanDerWaalsContact O-CB 3.29Å; L265-L269 WeakPolarHBondContact O-CB 3.49Å; L265-L269 WeakPolarHBondContact O-CD1 3.48Å; L265-L269 WeakPolarHBondContact O-CG 3.42Å; L265-L269 PolarHBondContact O-N 2.92Å
266	T	81.1	Confident	83	Confident	19 Å²	19	50.1 Å²	50.1	12%	0.117	26%	0.255	C	S	.	.	H	α-helix	trans	-68.1	-35.4	176.7	53.6	0	0	0	0	112.6	P262 C263 S270 I298	P262-T266 WeakPolarHBondContact O-CG2 3.44Å; P262-T266 PolarHBondContact O-N 2.96Å; P262-T266 PolarHBondContact O-OG1 2.73Å; C263-T266 PolarHBondContact O-N 3.49Å; C263-T266 PolarHBondContact O-OG1 2.93Å; C263-T266 VanDerWaalsContact O-OG1 3.09Å; T266-S270 PolarHBondContact O-N 2.84Å; T266-S270 VanDerWaalsContact O-N 3.1Å; T266-I298 HydrophobicContact CG2-CD1 4.01Å
267	V	86.6	Confident	82.3	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-63.8	-50.4	171.4	172	0	0	0	0	110.8	C263 I264 L269 S270 W271 C349 F352 V353 F460	C263-V267 WeakPolarHBondContact O-CG2 3.48Å; C263-V267 PolarHBondContact O-N 3.47Å; C263-V267 VanDerWaalsContact O-N 3.13Å; I264-V267 PolarHBondContact O-N 3.25Å; V267-L269 VanDerWaalsContact C-N 3.33Å; V267-L269 PolarHBondContact O-N 2.92Å; V267-S270 WeakPolarHBondContact O-CB 3.26Å; V267-S270 PolarHBondContact O-N 3.04Å; V267-S270 PolarHBondContact O-OG 3.3Å; V267-W271 HydrophobicContact CG1-CZ2 3.57Å; V267-W271 PolarHBondContact O-NE1 2.95Å; V267-C349 HydrophobicContact CG2-CB 3.7Å; V267-F352 HydrophobicContact CG1-CB 4.17Å; V267-F352 HydrophobicContact CG2-CB 4.34Å; V267-V353 HydrophobicContact CG2-CG2 4.09Å; V267-F460 HydrophobicContact CB-CE1 4.49Å; V267-F460 HydrophobicContact CB-CE2 4.37Å; V267-F460 HydrophobicContact CB-CZ 4.19Å; V267-F460 HydrophobicContact CG1-CD1 4.12Å; V267-F460 HydrophobicContact CG1-CD2 3.96Å; V267-F460 HydrophobicContact CG1-CE1 4.13Å; V267-F460 HydrophobicContact CG1-CE2 3.98Å; V267-F460 HydrophobicContact CG1-CG 4.02Å; V267-F460 HydrophobicContact CG1-CZ 4.06Å; V267-F460 HydrophobicContact CG2-CE2 4.17Å; V267-F460 HydrophobicContact CG2-CZ 4.3Å
268	V	88.1	Confident	81.4	Confident	62 Å²	62	55.8 Å²	55.8	38%	0.376	27%	0.272	S	S	.	.	H	α-helix	trans	-60.9	-40.8	178.4	172	0	0	0	0	111.9	I264 L265 S270 W271	I264-V268 HydrophobicContact CG2-CG2 4.38Å; I264-V268 VanDerWaalsContact O-CG2 3.3Å; I264-V268 WeakPolarHBondContact O-CG2 3.29Å; I264-V268 PolarHBondContact O-N 3.13Å; L265-V268 PolarHBondContact O-N 3.08Å; V268-S270 VanDerWaalsContact C-N 3.26Å; V268-S270 PolarHBondContact O-N 2.7Å; V268-W271 HydrophobicContact CB-CE3 4.38Å; V268-W271 HydrophobicContact CB-CZ3 4.44Å; V268-W271 HydrophobicContact CG1-CE3 4.39Å; V268-W271 HydrophobicContact CG2-CE3 4.2Å; V268-W271 HydrophobicContact CG2-CH2 4.06Å; V268-W271 HydrophobicContact CG2-CZ3 3.77Å; V268-W271 WeakPolarHBondContact O-CB 3.49Å; V268-W271 PolarHBondContact O-N 2.93Å
269	L	81.3	Confident	80.9	Confident	82 Å²	82	57.4 Å²	57.4	43%	0.429	28%	0.283	S	S	.	.	H	α-helix	trans	-63.6	-30.9	175.5	-75.2	166.3	0	0	0	112.4	L265 V267 W271 V272 L291	L265-L269 VanDerWaalsContact O-CB 3.29Å; L265-L269 WeakPolarHBondContact O-CB 3.49Å; L265-L269 WeakPolarHBondContact O-CD1 3.48Å; L265-L269 WeakPolarHBondContact O-CG 3.42Å; L265-L269 PolarHBondContact O-N 2.92Å; V267-L269 VanDerWaalsContact C-N 3.33Å; V267-L269 PolarHBondContact O-N 2.92Å; L269-W271 VanDerWaalsContact C-N 3.26Å; L269-W271 PolarHBondContact O-N 3.43Å; L269-V272 WeakPolarHBondContact O-CB 3.23Å; L269-V272 WeakPolarHBondContact O-CG2 3.23Å; L269-V272 PolarHBondContact O-N 2.91Å; L269-L291 VanDerWaalsContact C-CD1 3.45Å; L269-L291 HydrophobicContact CB-CD1 3.87Å; L269-L291 HydrophobicContact CB-CD2 3.71Å; L269-L291 HydrophobicContact CB-CG 4.48Å; L269-L291 HydrophobicContact CD1-CD2 4.17Å; L269-L291 WeakPolarHBondContact O-CD1 3.33Å
270	S	82.6	Confident	80.4	Confident	5 Å²	5	58.3 Å²	58.3	4%	0.035	29%	0.292	C	S	.	.	H	α-helix	trans	-63.6	-33.6	176.2	78.8	0	0	0	0	112.1	T266 V267 V268 V272 S273	T266-S270 PolarHBondContact O-N 2.84Å; T266-S270 VanDerWaalsContact O-N 3.1Å; V267-S270 WeakPolarHBondContact O-CB 3.26Å; V267-S270 PolarHBondContact O-N 3.04Å; V267-S270 PolarHBondContact O-OG 3.3Å; V268-S270 VanDerWaalsContact C-N 3.26Å; V268-S270 PolarHBondContact O-N 2.7Å; S270-V272 VanDerWaalsContact C-N 3.25Å; S270-V272 PolarHBondContact O-N 3.43Å; S270-S273 VanDerWaalsContact O-CB 3.31Å; S270-S273 WeakPolarHBondContact O-CB 3.17Å; S270-S273 PolarHBondContact O-N 3.33Å; S270-S273 PolarHBondContact O-OG 3.29Å
271	W	85.3	Confident	79.4	Confident	39 Å²	39	61 Å²	61	15%	0.148	31%	0.309	C	S	.	.	H	α-helix	trans	-71.2	-18.1	179.5	-49.1	-22.2	0	0	0	113.6	V267 V268 L269 S273 F274 P457 F460	V267-W271 HydrophobicContact CG1-CZ2 3.57Å; V267-W271 PolarHBondContact O-NE1 2.95Å; V268-W271 HydrophobicContact CB-CE3 4.38Å; V268-W271 HydrophobicContact CB-CZ3 4.44Å; V268-W271 HydrophobicContact CG1-CE3 4.39Å; V268-W271 HydrophobicContact CG2-CE3 4.2Å; V268-W271 HydrophobicContact CG2-CH2 4.06Å; V268-W271 HydrophobicContact CG2-CZ3 3.77Å; V268-W271 WeakPolarHBondContact O-CB 3.49Å; V268-W271 PolarHBondContact O-N 2.93Å; L269-W271 VanDerWaalsContact C-N 3.26Å; L269-W271 PolarHBondContact O-N 3.43Å; W271-S273 PolarHBondContact O-N 3.2Å; W271-F274 HydrophobicContact CB-CD2 3.96Å; W271-F274 HydrophobicContact CB-CE2 4.04Å; W271-F274 AromaticContact CD1-CE2 3.86Å; W271-F274 HydrophobicContact CG-CE2 4.2Å; W271-F274 WeakPolarHBondContact O-CD2 3.48Å; W271-F274 PolarHBondContact O-N 2.76Å; W271-F274 VanDerWaalsContact O-N 3.11Å; W271-P457 HydrophobicContact CD2-CG 4.06Å; W271-P457 HydrophobicContact CE3-CB 4.19Å; W271-P457 HydrophobicContact CE3-CG 3.78Å; W271-P457 HydrophobicContact CH2-CB 3.94Å; W271-P457 HydrophobicContact CH2-CG 4.31Å; W271-P457 HydrophobicContact CZ2-CB 4.46Å; W271-P457 HydrophobicContact CZ3-CB 3.78Å; W271-P457 HydrophobicContact CZ3-CG 3.91Å; W271-F460 HydrophobicContact CH2-CB 4.16Å; W271-F460 AromaticContact CH2-CD1 3.85Å; W271-F460 HydrophobicContact CH2-CD1 3.85Å; W271-F460 HydrophobicContact CH2-CG 4.34Å; W271-F460 HydrophobicContact CZ2-CB 3.72Å; W271-F460 AromaticContact CZ2-CD1 3.87Å; W271-F460 HydrophobicContact CZ2-CD1 3.87Å; W271-F460 AromaticContact CZ2-CG 3.97Å; W271-F460 HydrophobicContact CZ2-CG 3.97Å
272	V	83.4	Confident	78.4	Confident	67 Å²	67	61.5 Å²	61.5	41%	0.406	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-60.1	-28.7	172.5	-179.1	0	0	0	0	110.5	L269 S270 F274 W275 L287	L269-V272 WeakPolarHBondContact O-CB 3.23Å; L269-V272 WeakPolarHBondContact O-CG2 3.23Å; L269-V272 PolarHBondContact O-N 2.91Å; S270-V272 VanDerWaalsContact C-N 3.25Å; S270-V272 PolarHBondContact O-N 3.43Å; V272-F274 PolarHBondContact O-N 3.26Å; V272-W275 PolarHBondContact O-N 2.97Å; V272-W275 VanDerWaalsContact O-N 3.1Å; V272-L287 HydrophobicContact CB-CD2 4.23Å; V272-L287 HydrophobicContact CG1-CD2 4.18Å
273	S	79.1	Confident	77.5	Confident	3 Å²	3	61.6 Å²	61.6	2%	0.021	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-59.5	-31.3	175.6	71	0	0	0	0	113.5	S270 W271 W275 R284	S270-S273 VanDerWaalsContact O-CB 3.31Å; S270-S273 WeakPolarHBondContact O-CB 3.17Å; S270-S273 PolarHBondContact O-N 3.33Å; S270-S273 PolarHBondContact O-OG 3.29Å; W271-S273 PolarHBondContact O-N 3.2Å; S273-W275 VanDerWaalsContact C-N 3.27Å; S273-W275 PolarHBondContact O-N 2.94Å; S273-R284 PolarHBondContact O-NE 3.48Å; S273-R284 PolarHBondContact O-NH1 3.33Å; S273-R284 VanDerWaalsContact O-NH1 3.12Å
274	F	82.2	Confident	76.8	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-73.1	-14.7	178	-49	-46.3	0	0	0	113.6	W271 V272 A356 E359 D449 R453 F456	W271-F274 HydrophobicContact CB-CD2 3.96Å; W271-F274 HydrophobicContact CB-CE2 4.04Å; W271-F274 AromaticContact CD1-CE2 3.86Å; W271-F274 HydrophobicContact CG-CE2 4.2Å; W271-F274 WeakPolarHBondContact O-CD2 3.48Å; W271-F274 PolarHBondContact O-N 2.76Å; W271-F274 VanDerWaalsContact O-N 3.11Å; V272-F274 PolarHBondContact O-N 3.26Å; F274-A356 HydrophobicContact CE1-CB 4.29Å; F274-A356 HydrophobicContact CZ-CB 3.91Å; F274-E359 HydrophobicContact CE1-CG 4.31Å; F274-D449 WeakPolarHBondContact CA-OD1 3.33Å; F274-R453 HydrophobicContact CB-CG 3.82Å; F274-R453 VanDerWaalsContact O-CZ 3.22Å; F274-R453 PolarHBondContact O-NE 3.4Å; F274-R453 PolarHBondContact O-NH2 3.45Å; F274-F456 HydrophobicContact CE1-CE2 4.49Å; F274-F456 HydrophobicContact CE2-CB 3.97Å; F274-F456 HydrophobicContact CE2-CD1 4.25Å; F274-F456 AromaticContact CE2-CD2 3.91Å; F274-F456 HydrophobicContact CE2-CD2 3.91Å; F274-F456 HydrophobicContact CE2-CE2 4.43Å; F274-F456 AromaticContact CE2-CG 3.8Å; F274-F456 HydrophobicContact CE2-CG 3.8Å; F274-F456 HydrophobicContact CZ-CD1 4.01Å; F274-F456 AromaticContact CZ-CD2 3.72Å; F274-F456 HydrophobicContact CZ-CD2 3.72Å; F274-F456 HydrophobicContact CZ-CE1 4.07Å; F274-F456 AromaticContact CZ-CE2 3.78Å; F274-F456 HydrophobicContact CZ-CE2 3.78Å; F274-F456 AromaticContact CZ-CG 3.84Å; F274-F456 HydrophobicContact CZ-CG 3.84Å; F274-F456 AromaticContact CZ-CZ 3.95Å; F274-F456 HydrophobicContact CZ-CZ 3.95Å
275	W	81.7	Confident	75.7	Confident	182 Å²	182	62 Å²	62	69%	0.689	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-96.7	-13.1	-179.1	-72.9	95.3	0	0	0	113.6	V272 S273 R453	V272-W275 PolarHBondContact O-N 2.97Å; V272-W275 VanDerWaalsContact O-N 3.1Å; S273-W275 VanDerWaalsContact C-N 3.27Å; S273-W275 PolarHBondContact O-N 2.94Å; W275-R453 HydrophobicContact CZ2-CG 4.34Å
276	I	79.9	Confident	74.9	Confident	46 Å²	46	59.8 Å²	59.8	24%	0.236	32%	0.323	C	S	.	.	S	Bend	trans	-79.4	139.3	176.8	-59.1	170.7	0	0	0	109.2	A280 R284 L287	I276-A280 HydrophobicContact CG2-CB 3.89Å; I276-R284 HydrophobicContact CB-CG 3.7Å; I276-R284 HydrophobicContact CD1-CG 4.19Å; I276-R284 HydrophobicContact CG2-CG 3.56Å; I276-R284 PolarHBondContact O-NH2 3.04Å; I276-L287 HydrophobicContact CD1-CD2 3.92Å
277	K	70.2	Confident	74.3	Confident	167 Å²	167	61.2 Å²	61.2	73%	0.726	33%	0.33	S	S	*	.			trans	-59.2	140.6	177.3	-66.2	-172.8	176.7	-173.7	0	111.6	D279 A280	K277-D279 PolarHBondContact O-N 3.22Å; K277-D279 VanDerWaalsContact O-N 3.11Å; K277-A280 PolarHBondContact O-N 2.69Å; K277-A280 VanDerWaalsContact O-N 3.08Å
278	K	65.9	Low	73.2	Confident	115 Å²	115	61.7 Å²	61.7	50%	0.5	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-29.7	-176.5	66.2	-177.1	-178.5	179.7	0	113.8	A280 T281	K278-A280 VanDerWaalsContact C-N 3.28Å; K278-A280 PolarHBondContact O-N 2.93Å; K278-T281 WeakPolarHBondContact O-CG2 3.29Å
279	D	65.9	Low	72	Confident	122 Å²	122	63.7 Å²	63.7	65%	0.652	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-18.2	-175.8	-33.6	-78.4	0	0	0	112.2	K277 T281	K277-D279 PolarHBondContact O-N 3.22Å; K277-D279 VanDerWaalsContact O-N 3.11Å; D279-T281 PolarHBondContact O-N 2.97Å; D279-T281 VanDerWaalsContact O-N 3.07Å
280	A	68.9	Low	71.3	Confident	38 Å²	38	65.3 Å²	65.3	31%	0.314	35%	0.35	S	S	.	.			trans	-85.9	49.2	178	0	0	0	0	0	112.5	I276 K277 K278 P282 A283 R284	I276-A280 HydrophobicContact CG2-CB 3.89Å; K277-A280 PolarHBondContact O-N 2.69Å; K277-A280 VanDerWaalsContact O-N 3.08Å; K278-A280 VanDerWaalsContact C-N 3.28Å; K278-A280 PolarHBondContact O-N 2.93Å; A280-P282 VanDerWaalsContact C-CD 3.46Å; A280-A283 HydrophobicContact CB-CB 4.46Å; A280-A283 PolarHBondContact O-N 3.34Å; A280-A283 VanDerWaalsContact O-N 3.08Å; A280-R284 PolarHBondContact O-N 3.11Å
281	T	64.5	Low	70.4	Confident	60 Å²	60	65.8 Å²	65.8	37%	0.368	35%	0.352	S	S	.	.	H	α-helix	trans	-53.1	-39.5	-175.5	58.1	0	0	0	0	115.8	K278 D279 A283 R284 T285 Y360	K278-T281 WeakPolarHBondContact O-CG2 3.29Å; D279-T281 PolarHBondContact O-N 2.97Å; D279-T281 VanDerWaalsContact O-N 3.07Å; T281-A283 VanDerWaalsContact C-N 3.32Å; T281-A283 PolarHBondContact O-N 3.37Å; T281-R284 PolarHBondContact O-N 3.27Å; T281-T285 PolarHBondContact O-N 3.18Å; T281-T285 PolarHBondContact O-OG1 3.14Å; T281-T285 VanDerWaalsContact O-OG1 3.08Å; T281-Y360 WeakPolarHBondContact CA-OH 3.31Å; T281-Y360 PolarHBondContact O-OH 2.78Å
282	P	64.1	Low	69.2	Low	91 Å²	91	64.8 Å²	64.8	59%	0.591	35%	0.351	S	S	*	.	H	α-helix	trans	-69.2	-27.5	178.2	27.2	-35.7	0	0	0	113.4	A280 T285 A286	A280-P282 VanDerWaalsContact C-CD 3.46Å; P282-T285 WeakPolarHBondContact CA-OG1 3.24Å; P282-T285 PolarHBondContact O-OG1 2.96Å; P282-A286 WeakPolarHBondContact O-CB 3.34Å; P282-A286 PolarHBondContact O-N 3.48Å
283	A	63.8	Low	68	Low	49 Å²	49	64.7 Å²	64.7	41%	0.405	35%	0.353	S	S	.	.	H	α-helix	trans	-75	-42.7	175.5	0	0	0	0	0	111	A280 T281 A286 L287	A280-A283 HydrophobicContact CB-CB 4.46Å; A280-A283 PolarHBondContact O-N 3.34Å; A280-A283 VanDerWaalsContact O-N 3.08Å; T281-A283 VanDerWaalsContact C-N 3.32Å; T281-A283 PolarHBondContact O-N 3.37Å; A283-A286 PolarHBondContact O-N 3.25Å; A283-L287 VanDerWaalsContact O-CB 3.3Å; A283-L287 WeakPolarHBondContact O-CB 3.43Å; A283-L287 PolarHBondContact O-N 3.23Å
284	R	66	Low	67.1	Low	1 Å²	1	67.4 Å²	67.4	0%	0.004	37%	0.371	C	S	.	.	H	α-helix	trans	-67	-41.2	176.5	-65.5	-178.9	80	164.4	172.5	111.4	S273 I276 A280 T281 A288 Y360 D449	S273-R284 PolarHBondContact O-NE 3.48Å; S273-R284 PolarHBondContact O-NH1 3.33Å; S273-R284 VanDerWaalsContact O-NH1 3.12Å; I276-R284 HydrophobicContact CB-CG 3.7Å; I276-R284 HydrophobicContact CD1-CG 4.19Å; I276-R284 HydrophobicContact CG2-CG 3.56Å; I276-R284 PolarHBondContact O-NH2 3.04Å; A280-R284 PolarHBondContact O-N 3.11Å; T281-R284 PolarHBondContact O-N 3.27Å; R284-A288 WeakPolarHBondContact O-CB 3.29Å; R284-A288 PolarHBondContact O-N 2.61Å; R284-A288 VanDerWaalsContact O-N 3.09Å; R284-Y360 HydrophobicContact CB-CD2 4.04Å; R284-Y360 HydrophobicContact CB-CE1 3.97Å; R284-Y360 HydrophobicContact CB-CE2 3.38Å; R284-Y360 WeakPolarHBondContact CB-OH 3.44Å; R284-Y360 HydrophobicContact CG-CE2 4.21Å; R284-D449 IonicContact CZ-OD1 3.61Å; R284-D449 IonicContact CZ-OD2 3.57Å; R284-D449 IonicContact NH1-OD1 2.73Å; R284-D449 PolarHBondContact NH1-OD1 3.48Å; R284-D449 IonicContact NH1-OD2 3.33Å; R284-D449 PolarHBondContact NH1-OD2 3.32Å; R284-D449 IonicContact NH2-OD1 3.59Å; R284-D449 IonicContact NH2-OD2 2.83Å; R284-D449 PolarHBondContact NH2-OD2 2.99Å
285	T	64.6	Low	65.9	Low	59 Å²	59	67.5 Å²	67.5	36%	0.362	37%	0.372	S	S	.	.	H	α-helix	trans	-64.5	-46.9	172.5	51.4	0	0	0	0	112.3	T281 P282 A288 L289 Y360	T281-T285 PolarHBondContact O-N 3.18Å; T281-T285 PolarHBondContact O-OG1 3.14Å; T281-T285 VanDerWaalsContact O-OG1 3.08Å; P282-T285 WeakPolarHBondContact CA-OG1 3.24Å; P282-T285 PolarHBondContact O-OG1 2.96Å; T285-A288 PolarHBondContact O-N 3.42Å; T285-L289 WeakPolarHBondContact O-CB 3.26Å; T285-L289 WeakPolarHBondContact O-CG 3.41Å; T285-L289 PolarHBondContact O-N 3.02Å; T285-Y360 HydrophobicContact CG2-CE1 3.69Å; T285-Y360 PolarHBondContact N-OH 3.25Å
286	A	68.3	Low	64.7	Low	49 Å²	49	61.4 Å²	61.4	41%	0.405	35%	0.354	S	S	.	.	H	α-helix	trans	-66	-44.3	-175.8	0	0	0	0	0	112.4	P282 A283 L290	P282-A286 WeakPolarHBondContact O-CB 3.34Å; P282-A286 PolarHBondContact O-N 3.48Å; A283-A286 PolarHBondContact O-N 3.25Å; A286-L290 WeakPolarHBondContact O-CB 3.42Å; A286-L290 PolarHBondContact O-N 3.21Å
287	L	67.6	Low	63.6	Low	49 Å²	49	63.7 Å²	63.7	26%	0.257	36%	0.363	S	S	.	.	H	α-helix	trans	-62.1	-49.6	175.7	179.4	65.3	0	0	0	110.9	V272 I276 A283 L290 L291	V272-L287 HydrophobicContact CB-CD2 4.23Å; V272-L287 HydrophobicContact CG1-CD2 4.18Å; I276-L287 HydrophobicContact CD1-CD2 3.92Å; A283-L287 VanDerWaalsContact O-CB 3.3Å; A283-L287 WeakPolarHBondContact O-CB 3.43Å; A283-L287 PolarHBondContact O-N 3.23Å; L287-L290 PolarHBondContact O-N 2.9Å; L287-L291 HydrophobicContact CD1-CD1 3.84Å; L287-L291 HydrophobicContact CD1-CG 4.26Å; L287-L291 HydrophobicContact CG-CD1 3.92Å; L287-L291 WeakPolarHBondContact O-CB 3.14Å; L287-L291 VanDerWaalsContact O-CG 3.31Å; L287-L291 WeakPolarHBondContact O-CG 3.39Å; L287-L291 PolarHBondContact O-N 3.1Å
288	A	64.4	Low	62.9	Low	10 Å²	10	58 Å²	58	8%	0.083	34%	0.34	C	S	.	.	H	α-helix	trans	-66.3	-40	-178.5	0	0	0	0	0	111.4	R284 T285 L291 S292 L357	R284-A288 WeakPolarHBondContact O-CB 3.29Å; R284-A288 PolarHBondContact O-N 2.61Å; R284-A288 VanDerWaalsContact O-N 3.09Å; T285-A288 PolarHBondContact O-N 3.42Å; A288-L291 PolarHBondContact O-N 3.49Å; A288-S292 VanDerWaalsContact O-CB 3.23Å; A288-S292 WeakPolarHBondContact O-CB 3.38Å; A288-S292 PolarHBondContact O-N 2.93Å; A288-L357 HydrophobicContact CB-CD2 3.63Å
289	L	62.7	Low	62.2	Low	103 Å²	103	52.8 Å²	52.8	54%	0.539	32%	0.318	S	S	.	.	H	α-helix	trans	-65	-43.4	174.7	-80.9	166.3	0	0	0	112.2	T285 S292 C293	T285-L289 WeakPolarHBondContact O-CB 3.26Å; T285-L289 WeakPolarHBondContact O-CG 3.41Å; T285-L289 PolarHBondContact O-N 3.02Å; L289-S292 WeakPolarHBondContact CA-OG 3.3Å; L289-S292 PolarHBondContact O-N 3.47Å; L289-S292 PolarHBondContact O-OG 2.93Å; L289-C293 WeakPolarHBondContact O-CB 3.35Å; L289-C293 PolarHBondContact O-N 2.92Å; L289-C293 PolarHBondContact O-SG 3.38Å; L289-C293 VanDerWaalsContact O-SG 3.37Å
290	L	65.8	Low	61.5	Low	116 Å²	116	47.9 Å²	47.9	61%	0.607	29%	0.292	S	S	*	.	H	α-helix	trans	-59.9	-48.3	174.8	-90.1	164.2	0	0	0	111.6	A286 L287 S292 C293 C294	A286-L290 WeakPolarHBondContact O-CB 3.42Å; A286-L290 PolarHBondContact O-N 3.21Å; L287-L290 PolarHBondContact O-N 2.9Å; L290-S292 VanDerWaalsContact C-N 3.31Å; L290-S292 PolarHBondContact O-N 3.26Å; L290-C293 PolarHBondContact O-N 3.31Å; L290-C294 PolarHBondContact O-N 3.13Å; L290-C294 PolarHBondContact O-SG 3.09Å; L290-C294 VanDerWaalsContact O-SG 3.38Å
291	L	63.3	Low	60.7	Low	15 Å²	15	47.8 Å²	47.8	8%	0.079	29%	0.285	C	S	.	.	H	α-helix	trans	-66.8	-33.3	177.4	-66.8	172.1	0	0	0	112	L269 L287 A288 A295	L269-L291 VanDerWaalsContact C-CD1 3.45Å; L269-L291 HydrophobicContact CB-CD1 3.87Å; L269-L291 HydrophobicContact CB-CD2 3.71Å; L269-L291 HydrophobicContact CB-CG 4.48Å; L269-L291 HydrophobicContact CD1-CD2 4.17Å; L269-L291 WeakPolarHBondContact O-CD1 3.33Å; L287-L291 HydrophobicContact CD1-CD1 3.84Å; L287-L291 HydrophobicContact CD1-CG 4.26Å; L287-L291 HydrophobicContact CG-CD1 3.92Å; L287-L291 WeakPolarHBondContact O-CB 3.14Å; L287-L291 VanDerWaalsContact O-CG 3.31Å; L287-L291 WeakPolarHBondContact O-CG 3.39Å; L287-L291 PolarHBondContact O-N 3.1Å; A288-L291 PolarHBondContact O-N 3.49Å; L291-A295 WeakPolarHBondContact O-CB 3.37Å; L291-A295 PolarHBondContact O-N 3.12Å
292	S	60.3	Low	59.8	Low	19 Å²	19	45.2 Å²	45.2	13%	0.133	27%	0.27	C	S	.	.	H	α-helix	trans	-64.3	-42.1	171	85.2	0	0	0	0	111.4	A288 L289 L290 A295 V296	A288-S292 VanDerWaalsContact O-CB 3.23Å; A288-S292 WeakPolarHBondContact O-CB 3.38Å; A288-S292 PolarHBondContact O-N 2.93Å; L289-S292 WeakPolarHBondContact CA-OG 3.3Å; L289-S292 PolarHBondContact O-N 3.47Å; L289-S292 PolarHBondContact O-OG 2.93Å; L290-S292 VanDerWaalsContact C-N 3.31Å; L290-S292 PolarHBondContact O-N 3.26Å; S292-A295 PolarHBondContact O-N 2.87Å; S292-V296 WeakPolarHBondContact O-CB 3.43Å; S292-V296 WeakPolarHBondContact O-CG2 3.44Å; S292-V296 PolarHBondContact O-N 2.94Å
293	C	58.1	Low	58.8	Low	65 Å²	65	44.6 Å²	44.6	44%	0.439	26%	0.261	S	S	.	.	H	α-helix	trans	-68.3	-43.9	177.7	-75.8	0	0	0	0	110.9	L289 L290 V296 F297	L289-C293 WeakPolarHBondContact O-CB 3.35Å; L289-C293 PolarHBondContact O-N 2.92Å; L289-C293 PolarHBondContact O-SG 3.38Å; L289-C293 VanDerWaalsContact O-SG 3.37Å; L290-C293 PolarHBondContact O-N 3.31Å; C293-V296 CarbonylContact O-C 3.58Å; C293-V296 PolarHBondContact O-N 2.89Å; C293-F297 WeakPolarHBondContact O-CD2 3.34Å; C293-F297 PolarHBondContact O-N 2.88Å
294	C	60.5	Low	58.1	Low	59 Å²	59	42.9 Å²	42.9	40%	0.399	25%	0.246	S	C	.	.	H	α-helix	trans	-61.9	-45.1	173.7	-69.3	0	0	0	0	111.6	L290 V296 F297 I298	L290-C294 PolarHBondContact O-N 3.13Å; L290-C294 PolarHBondContact O-SG 3.09Å; L290-C294 VanDerWaalsContact O-SG 3.38Å; C294-V296 VanDerWaalsContact C-N 3.34Å; C294-V296 PolarHBondContact O-N 3.36Å; C294-F297 PolarHBondContact O-N 3.46Å; C294-I298 WeakPolarHBondContact O-CB 3.18Å; C294-I298 WeakPolarHBondContact O-CD1 3.3Å; C294-I298 VanDerWaalsContact O-CG1 3.28Å; C294-I298 WeakPolarHBondContact O-CG1 3.33Å; C294-I298 PolarHBondContact O-N 3.17Å
295	A	58.5	Low	57.1	Low	3 Å²	3	44 Å²	44	3%	0.025	25%	0.253	C	S	.	.	H	α-helix	trans	-63.6	-37.9	174.1	0	0	0	0	0	111.6	L291 S292 I298 S299 F350 V353	L291-A295 WeakPolarHBondContact O-CB 3.37Å; L291-A295 PolarHBondContact O-N 3.12Å; S292-A295 PolarHBondContact O-N 2.87Å; A295-I298 CarbonylContact O-C 3.56Å; A295-I298 PolarHBondContact O-N 3.4Å; A295-S299 WeakPolarHBondContact O-CA 3.44Å; A295-S299 WeakPolarHBondContact O-CB 3.44Å; A295-S299 PolarHBondContact O-N 3.35Å; A295-S299 PolarHBondContact O-OG 2.69Å; A295-F350 HydrophobicContact CB-CD2 4.31Å; A295-V353 HydrophobicContact CB-CB 4.17Å; A295-V353 HydrophobicContact CB-CG1 3.87Å; A295-V353 HydrophobicContact CB-CG2 4.31Å
296	V	55.2	Low	56.1	Low	53 Å²	53	44.6 Å²	44.6	32%	0.321	26%	0.257	S	S	.	.	H	α-helix	trans	-70.1	-34.9	174.7	165.8	0	0	0	0	111.7	S292 C293 C294 S299 V300 M322 F350	S292-V296 WeakPolarHBondContact O-CB 3.43Å; S292-V296 WeakPolarHBondContact O-CG2 3.44Å; S292-V296 PolarHBondContact O-N 2.94Å; C293-V296 CarbonylContact O-C 3.58Å; C293-V296 PolarHBondContact O-N 2.89Å; C294-V296 VanDerWaalsContact C-N 3.34Å; C294-V296 PolarHBondContact O-N 3.36Å; V296-S299 PolarHBondContact O-N 3.42Å; V296-V300 HydrophobicContact CG1-CG2 3.88Å; V296-V300 VanDerWaalsContact O-CB 3.26Å; V296-V300 WeakPolarHBondContact O-CB 3.18Å; V296-V300 WeakPolarHBondContact O-CG2 3.29Å; V296-V300 PolarHBondContact O-N 3.21Å; V296-M322 HydrophobicContact CG1-CE 4.49Å; V296-F350 HydrophobicContact CG2-CE2 3.84Å; V296-F350 HydrophobicContact CG2-CZ 4.43Å
297	F	57	Low	55.1	Low	94 Å²	94	45.5 Å²	45.5	41%	0.412	26%	0.257	S	S	.	.	H	α-helix	trans	-62.3	-44.5	168.4	-87.1	-71.6	0	0	0	110.9	C293 C294 S299 M322 L325	C293-F297 WeakPolarHBondContact O-CD2 3.34Å; C293-F297 PolarHBondContact O-N 2.88Å; C294-F297 PolarHBondContact O-N 3.46Å; F297-S299 VanDerWaalsContact C-N 3.28Å; F297-S299 PolarHBondContact O-N 3.37Å; F297-M322 HydrophobicContact CD1-CE 3.64Å; F297-M322 HydrophobicContact CD1-SD 4.24Å; F297-M322 HydrophobicContact CD2-CE 4.17Å; F297-M322 HydrophobicContact CE1-CE 3.42Å; F297-M322 VanDerWaalsContact CE1-CE 3.42Å; F297-M322 HydrophobicContact CE1-SD 3.5Å; F297-M322 VanDerWaalsContact CE1-SD 3.5Å; F297-M322 HydrophobicContact CE2-CE 3.96Å; F297-M322 HydrophobicContact CG-CE 4.02Å; F297-M322 HydrophobicContact CZ-CE 3.59Å; F297-M322 HydrophobicContact CZ-SD 3.73Å; F297-L325 HydrophobicContact CE1-CD2 4.09Å
298	I	55.1	Low	54.1	Low	49 Å²	49	48.7 Å²	48.7	25%	0.251	27%	0.271	S	S	.	.	H	α-helix	trans	-68.5	-24.5	175.9	-67.9	165	0	0	0	112.1	T266 C294 A295 H301 V346	T266-I298 HydrophobicContact CG2-CD1 4.01Å; C294-I298 WeakPolarHBondContact O-CB 3.18Å; C294-I298 WeakPolarHBondContact O-CD1 3.3Å; C294-I298 VanDerWaalsContact O-CG1 3.28Å; C294-I298 WeakPolarHBondContact O-CG1 3.33Å; C294-I298 PolarHBondContact O-N 3.17Å; A295-I298 CarbonylContact O-C 3.56Å; A295-I298 PolarHBondContact O-N 3.4Å; I298-H301 WeakPolarHBondContact O-CB 3.25Å; I298-V346 HydrophobicContact CG2-CG1 4.07Å
299	S	52	Low	53.1	Low	4 Å²	4	52.4 Å²	52.4	3%	0.028	29%	0.292	C	S	.	.	H	α-helix	trans	-110.9	-16.2	-171	-51.5	0	0	0	0	114.3	A295 V296 F297 H301 A302 L303 F350	A295-S299 WeakPolarHBondContact O-CA 3.44Å; A295-S299 WeakPolarHBondContact O-CB 3.44Å; A295-S299 PolarHBondContact O-N 3.35Å; A295-S299 PolarHBondContact O-OG 2.69Å; V296-S299 PolarHBondContact O-N 3.42Å; F297-S299 VanDerWaalsContact C-N 3.28Å; F297-S299 PolarHBondContact O-N 3.37Å; S299-H301 PolarHBondContact O-N 3.41Å; S299-A302 PolarHBondContact O-N 3.17Å; S299-L303 VanDerWaalsContact O-CB 3.3Å; S299-L303 WeakPolarHBondContact O-CB 3.19Å; S299-L303 PolarHBondContact O-N 3.05Å; S299-F350 VanDerWaalsContact CB-CD2 3.48Å; S299-F350 WeakPolarHBondContact OG-CB 3.34Å; S299-F350 WeakPolarHBondContact OG-CD2 3.38Å; S299-F350 WeakPolarHBondContact OG-CG 3.37Å
300	V	51.8	Low	52.1	Low	20 Å²	20	51.2 Å²	51.2	12%	0.121	29%	0.29	C	S	.	.	H	α-helix	trans	-62.3	-26.8	157.9	167.1	0	0	0	0	109.6	V296 A302 S304 M322	V296-V300 HydrophobicContact CG1-CG2 3.88Å; V296-V300 VanDerWaalsContact O-CB 3.26Å; V296-V300 WeakPolarHBondContact O-CB 3.18Å; V296-V300 WeakPolarHBondContact O-CG2 3.29Å; V296-V300 PolarHBondContact O-N 3.21Å; V300-A302 VanDerWaalsContact C-N 3.32Å; V300-A302 PolarHBondContact O-N 3.11Å; V300-S304 WeakPolarHBondContact O-CB 3.34Å; V300-S304 PolarHBondContact O-N 3.26Å; V300-S304 PolarHBondContact O-OG 3.32Å; V300-M322 HydrophobicContact CG1-CB 4.1Å
301	H	50.2	Low	51.3	Low	35 Å²	35	48.1 Å²	48.1	16%	0.162	29%	0.286	C	S	.	.	H	α-helix	trans	-54.6	-42.9	166	-151.3	77.7	0	0	0	112.9	I298 S299 S304 S326 R330	I298-H301 WeakPolarHBondContact O-CB 3.25Å; S299-H301 PolarHBondContact O-N 3.41Å; H301-S304 PolarHBondContact O-OG 3.43Å; H301-S326 PolarHBondContact ND1-O 3.14Å; H301-R330 WeakPolarHBondContact CE1-CG 3.46Å; H301-R330 WeakPolarHBondContact NE2-CG 3.45Å; H301-R330 PolarHBondContact O-NE 3.48Å; H301-R330 PolarHBondContact O-NH2 2.86Å
302	A	45.8	Very low	50.5	Low	6 Å²	6	52.7 Å²	52.7	5%	0.05	31%	0.314	C	S	.	.	H	α-helix	trans	-89.2	-45.3	178.7	0	0	0	0	0	113.1	S299 V300 S304 V305 V346	S299-A302 PolarHBondContact O-N 3.17Å; V300-A302 VanDerWaalsContact C-N 3.32Å; V300-A302 PolarHBondContact O-N 3.11Å; A302-S304 PolarHBondContact O-N 3.13Å; A302-V305 VanDerWaalsContact O-CB 3.24Å; A302-V305 WeakPolarHBondContact O-CB 3.35Å; A302-V305 WeakPolarHBondContact O-CG2 3.45Å; A302-V305 PolarHBondContact O-N 3.03Å; A302-V346 HydrophobicContact CB-CG1 4.07Å
303	L	44.4	Very low	50.1	Low	78 Å²	78	60.7 Å²	60.7	41%	0.408	34%	0.343	S	S	.	.	H	α-helix	trans	-59.4	-26.3	176.4	-82.6	158.1	0	0	0	112.8	S299 V305 V306 V307	S299-L303 VanDerWaalsContact O-CB 3.3Å; S299-L303 WeakPolarHBondContact O-CB 3.19Å; S299-L303 PolarHBondContact O-N 3.05Å; L303-V305 PolarHBondContact O-N 3.42Å; L303-V306 PolarHBondContact O-N 3.13Å; L303-V306 VanDerWaalsContact O-N 3.17Å; L303-V307 WeakPolarHBondContact O-CB 3.24Å; L303-V307 WeakPolarHBondContact O-CG2 3.24Å; L303-V307 PolarHBondContact O-N 3.34Å
304	S	49.5	Very low	49.3	Very low	13 Å²	13	67.9 Å²	67.9	9%	0.091	37%	0.367	C	S	.	.	H	α-helix	trans	-65.8	-20.8	171.1	53.3	0	0	0	0	113.5	V300 H301 A302 Q308 R330	V300-S304 WeakPolarHBondContact O-CB 3.34Å; V300-S304 PolarHBondContact O-N 3.26Å; V300-S304 PolarHBondContact O-OG 3.32Å; H301-S304 PolarHBondContact O-OG 3.43Å; A302-S304 PolarHBondContact O-N 3.13Å; S304-Q308 WeakPolarHBondContact O-CB 3.39Å; S304-Q308 VanDerWaalsContact O-CG 3.28Å; S304-Q308 WeakPolarHBondContact O-CG 3.43Å; S304-Q308 PolarHBondContact O-N 3.35Å; S304-Q308 PolarHBondContact O-OE1 3.43Å; S304-R330 PolarHBondContact OG-NH2 3.17Å
305	V	43.8	Very low	48.7	Very low	24 Å²	24	67.1 Å²	67.1	15%	0.145	37%	0.369	C	S	.	.	H	α-helix	trans	-66.8	-57.4	164.3	-174	0	0	0	0	109.7	A302 L303 V307 Q308 T309 R330	A302-V305 VanDerWaalsContact O-CB 3.24Å; A302-V305 WeakPolarHBondContact O-CB 3.35Å; A302-V305 WeakPolarHBondContact O-CG2 3.45Å; A302-V305 PolarHBondContact O-N 3.03Å; L303-V305 PolarHBondContact O-N 3.42Å; V305-V307 VanDerWaalsContact C-N 3.34Å; V305-V307 PolarHBondContact O-N 2.86Å; V305-Q308 PolarHBondContact O-N 3.17Å; V305-T309 PolarHBondContact O-N 3.05Å; V305-T309 VanDerWaalsContact O-N 3.1Å; V305-R330 VanDerWaalsContact CG2-NH2 3.28Å
306	V	44.3	Very low	48.5	Very low	72 Å²	72	71.9 Å²	71.9	44%	0.436	39%	0.393	S	S	.	.	H	α-helix	trans	-60.9	-41.7	-173	-173.9	0	0	0	0	111.7	L303 Q308 T309 T310	L303-V306 PolarHBondContact O-N 3.13Å; L303-V306 VanDerWaalsContact O-N 3.17Å; V306-Q308 VanDerWaalsContact C-N 3.32Å; V306-Q308 PolarHBondContact O-N 3.36Å; V306-T309 PolarHBondContact O-N 2.92Å; V306-T309 PolarHBondContact O-OG1 3.03Å; V306-T310 HydrophobicContact CG1-CG2 4.32Å; V306-T310 WeakPolarHBondContact O-CG2 3.35Å; V306-T310 PolarHBondContact O-N 3.37Å; V306-T310 PolarHBondContact O-OG1 2.96Å; V306-T310 VanDerWaalsContact O-OG1 3.07Å
307	V	46.9	Very low	48.2	Very low	69 Å²	69	74.8 Å²	74.8	42%	0.418	41%	0.411	S	S	.	.	H	α-helix	trans	-69.5	-29.6	178.2	174.3	0	0	0	0	112	L303 V305 G311	L303-V307 WeakPolarHBondContact O-CB 3.24Å; L303-V307 WeakPolarHBondContact O-CG2 3.24Å; L303-V307 PolarHBondContact O-N 3.34Å; V305-V307 VanDerWaalsContact C-N 3.34Å; V305-V307 PolarHBondContact O-N 2.86Å; V307-G311 PolarHBondContact O-N 2.93Å
308	Q	45.6	Very low	47.8	Very low	116 Å²	116	75.1 Å²	75.1	54%	0.542	42%	0.421	S	S	.	.	H	α-helix	trans	-75.4	-22.3	172.9	-74.6	-169.1	-73.9	0	0	113.2	S304 V305 V306	S304-Q308 WeakPolarHBondContact O-CB 3.39Å; S304-Q308 VanDerWaalsContact O-CG 3.28Å; S304-Q308 WeakPolarHBondContact O-CG 3.43Å; S304-Q308 PolarHBondContact O-N 3.35Å; S304-Q308 PolarHBondContact O-OE1 3.43Å; V305-Q308 PolarHBondContact O-N 3.17Å; V306-Q308 VanDerWaalsContact C-N 3.32Å; V306-Q308 PolarHBondContact O-N 3.36Å
309	T	44.4	Very low	47.5	Very low	87 Å²	87	76 Å²	76	53%	0.534	43%	0.428	S	S	.	.	H	α-helix	trans	-89.2	-23.8	174	59.3	0	0	0	0	114	V305 V306	V305-T309 PolarHBondContact O-N 3.05Å; V305-T309 VanDerWaalsContact O-N 3.1Å; V306-T309 PolarHBondContact O-N 2.92Å; V306-T309 PolarHBondContact O-OG1 3.03Å
310	T	41.6	Very low	47.1	Very low	78 Å²	78	80.4 Å²	80.4	48%	0.479	45%	0.451	S	S	.	.	H	α-helix	trans	-97.3	-11.5	-176.1	60.5	0	0	0	0	116	V306 T312	V306-T310 HydrophobicContact CG1-CG2 4.32Å; V306-T310 WeakPolarHBondContact O-CG2 3.35Å; V306-T310 PolarHBondContact O-N 3.37Å; V306-T310 PolarHBondContact O-OG1 2.96Å; V306-T310 VanDerWaalsContact O-OG1 3.07Å; T310-T312 VanDerWaalsContact C-N 3.28Å; T310-T312 PolarHBondContact O-N 3.11Å; T310-T312 VanDerWaalsContact O-N 3.1Å
311	G	49.7	Very low	46.8	Very low	51 Å²	51	83.7 Å²	83.7	53%	0.526	47%	0.471	S	S	.	.			trans	65.8	13.8	167	0	0	0	0	0	117.4	V307 Y313	V307-G311 PolarHBondContact O-N 2.93Å; G311-Y313 WeakPolarHBondContact O-CD1 3.5Å; G311-Y313 PolarHBondContact O-N 2.87Å
312	T	46.2	Very low	46.5	Very low	111 Å²	111	84.7 Å²	84.7	68%	0.681	48%	0.477	S	S	*	.			trans	-88.3	93.6	-173.4	38.9	0	0	0	0	113.6	T310 K314	T310-T312 VanDerWaalsContact C-N 3.28Å; T310-T312 PolarHBondContact O-N 3.11Å; T310-T312 VanDerWaalsContact O-N 3.1Å; T312-K314 PolarHBondContact O-N 3.24Å
313	Y	51.3	Low	46.6	Very low	188 Å²	188	86.1 Å²	86.1	74%	0.737	49%	0.485	S	S	*	.			trans	-82.6	94	-178	44.3	-87.1	0	0	0	113.7	G311	G311-Y313 WeakPolarHBondContact O-CD1 3.5Å; G311-Y313 PolarHBondContact O-N 2.87Å
314	K	42	Very low	46.6	Very low	216 Å²	216	86.4 Å²	86.4	94%	0.939	49%	0.49	S	S	*	.	S	Bend	trans	-151.1	12.9	167.6	-124.5	169.3	-172.8	176.8	0	118.6	T312	T312-K314 PolarHBondContact O-N 3.24Å
315	G	47.7	Very low	46.2	Very low	43 Å²	43	91.4 Å²	91.4	44%	0.443	52%	0.515	S	S	.	.	S	Bend	trans	-145.9	34.7	179.7	0	0	0	0	0	114	V319	G315-V319 WeakPolarHBondContact O-CG2 3.41Å
316	I	54.4	Low	46.2	Very low	103 Å²	103	90.8 Å²	90.8	53%	0.528	51%	0.512	S	S	.	.	H	α-helix	trans	-67	-45.9	-156.9	-67.9	174.1	0	0	0	114.2	T318 V319 L320	I316-T318 PolarHBondContact O-N 3.19Å; I316-V319 PolarHBondContact O-N 3.39Å; I316-L320 HydrophobicContact CG2-CB 4.41Å; I316-L320 HydrophobicContact CG2-CD2 4.44Å; I316-L320 WeakPolarHBondContact O-CB 3.42Å; I316-L320 PolarHBondContact O-N 3.41Å
317	T	49.1	Very low	46.1	Very low	114 Å²	114	90.5 Å²	90.5	70%	0.699	51%	0.513	S	S	*	.	H	α-helix	trans	-68.1	-40.4	-163.4	44.9	0	0	0	0	115.2	T321	T317-T321 PolarHBondContact O-N 3.38Å; T317-T321 PolarHBondContact O-OG1 3.37Å
318	T	48.5	Very low	46	Very low	101 Å²	101	92.1 Å²	92.1	62%	0.62	52%	0.523	S	S	*	.	H	α-helix	trans	-81	-31.7	177.7	48.4	0	0	0	0	112.8	I316 L320 T321 M322	I316-T318 PolarHBondContact O-N 3.19Å; T318-L320 VanDerWaalsContact C-N 3.35Å; T318-T321 PolarHBondContact O-OG1 2.62Å; T318-T321 VanDerWaalsContact O-OG1 3.13Å; T318-M322 WeakPolarHBondContact O-CG 3.34Å; T318-M322 PolarHBondContact O-N 3.05Å
319	V	48.8	Very low	45.8	Very low	67 Å²	67	89 Å²	89	41%	0.406	52%	0.517	S	S	.	.	H	α-helix	trans	-68.6	-38.1	171.4	177.7	0	0	0	0	110	G315 I316 T321 M322 T323	G315-V319 WeakPolarHBondContact O-CG2 3.41Å; I316-V319 PolarHBondContact O-N 3.39Å; V319-T321 PolarHBondContact O-N 3.26Å; V319-M322 PolarHBondContact O-N 3.1Å; V319-T323 WeakPolarHBondContact O-CB 3.48Å; V319-T323 PolarHBondContact O-N 3.31Å; V319-T323 PolarHBondContact O-OG1 2.62Å
320	L	43	Very low	46.2	Very low	97 Å²	97	88 Å²	88	51%	0.508	50%	0.503	S	S	.	.	H	α-helix	trans	-65.8	-38	-178.9	-174.8	66	0	0	0	112.4	I316 T318 T323 T324	I316-L320 HydrophobicContact CG2-CB 4.41Å; I316-L320 HydrophobicContact CG2-CD2 4.44Å; I316-L320 WeakPolarHBondContact O-CB 3.42Å; I316-L320 PolarHBondContact O-N 3.41Å; T318-L320 VanDerWaalsContact C-N 3.35Å; L320-T323 CarbonylContact O-C 3.58Å; L320-T323 PolarHBondContact O-N 3.42Å; L320-T324 PolarHBondContact O-N 3.23Å; L320-T324 PolarHBondContact O-OG1 3.37Å
321	T	44.6	Very low	46.9	Very low	89 Å²	89	89.1 Å²	89.1	55%	0.546	51%	0.51	S	S	.	.	H	α-helix	trans	-71.9	-36.6	176.1	49.8	0	0	0	0	113.1	T317 T318 V319 T323 T324 L325	T317-T321 PolarHBondContact O-N 3.38Å; T317-T321 PolarHBondContact O-OG1 3.37Å; T318-T321 PolarHBondContact O-OG1 2.62Å; T318-T321 VanDerWaalsContact O-OG1 3.13Å; V319-T321 PolarHBondContact O-N 3.26Å; T321-T323 VanDerWaalsContact C-N 3.28Å; T321-T324 WeakPolarHBondContact CA-OG1 3.06Å; T321-T324 PolarHBondContact O-OG1 3.24Å; T321-T324 VanDerWaalsContact O-OG1 3.07Å; T321-L325 PolarHBondContact O-N 2.93Å
322	M	44.3	Very low	47.6	Very low	55 Å²	55	88.2 Å²	88.2	27%	0.271	50%	0.496	S	S	.	.	H	α-helix	trans	-68.1	-31.4	170.2	-63.6	-72.5	-78.5	0	0	111.5	V296 F297 V300 T318 V319 S326	V296-M322 HydrophobicContact CG1-CE 4.49Å; F297-M322 HydrophobicContact CD1-CE 3.64Å; F297-M322 HydrophobicContact CD1-SD 4.24Å; F297-M322 HydrophobicContact CD2-CE 4.17Å; F297-M322 HydrophobicContact CE1-CE 3.42Å; F297-M322 VanDerWaalsContact CE1-CE 3.42Å; F297-M322 HydrophobicContact CE1-SD 3.5Å; F297-M322 VanDerWaalsContact CE1-SD 3.5Å; F297-M322 HydrophobicContact CE2-CE 3.96Å; F297-M322 HydrophobicContact CG-CE 4.02Å; F297-M322 HydrophobicContact CZ-CE 3.59Å; F297-M322 HydrophobicContact CZ-SD 3.73Å; V300-M322 HydrophobicContact CG1-CB 4.1Å; T318-M322 WeakPolarHBondContact O-CG 3.34Å; T318-M322 PolarHBondContact O-N 3.05Å; V319-M322 PolarHBondContact O-N 3.1Å; M322-S326 WeakPolarHBondContact O-CB 3.46Å; M322-S326 PolarHBondContact O-N 3.1Å; M322-S326 PolarHBondContact O-OG 2.99Å
323	T	48.5	Very low	48.7	Very low	36 Å²	36	84.8 Å²	84.8	22%	0.221	47%	0.473	C	S	.	.	H	α-helix	trans	-74.7	-39.3	177.4	-59.3	0	0	0	0	112	V319 L320 T321 L325 S326 S327	V319-T323 WeakPolarHBondContact O-CB 3.48Å; V319-T323 PolarHBondContact O-N 3.31Å; V319-T323 PolarHBondContact O-OG1 2.62Å; L320-T323 CarbonylContact O-C 3.58Å; L320-T323 PolarHBondContact O-N 3.42Å; T321-T323 VanDerWaalsContact C-N 3.28Å; T323-L325 VanDerWaalsContact C-N 3.33Å; T323-L325 PolarHBondContact O-N 3.34Å; T323-S326 CarbonylContact O-C 3.55Å; T323-S326 PolarHBondContact O-N 3.46Å; T323-S327 VanDerWaalsContact O-CB 3.29Å; T323-S327 WeakPolarHBondContact O-CB 3.38Å; T323-S327 PolarHBondContact O-N 3.34Å
324	T	43.3	Very low	49.7	Very low	85 Å²	85	77 Å²	77	52%	0.521	45%	0.446	S	S	.	.	H	α-helix	trans	-66	-36.1	175.1	46.3	0	0	0	0	111.7	L320 T321 S327	L320-T324 PolarHBondContact O-N 3.23Å; L320-T324 PolarHBondContact O-OG1 3.37Å; T321-T324 WeakPolarHBondContact CA-OG1 3.06Å; T321-T324 PolarHBondContact O-OG1 3.24Å; T321-T324 VanDerWaalsContact O-OG1 3.07Å; T324-S327 PolarHBondContact O-N 3.11Å
325	L	42.4	Very low	50.9	Low	117 Å²	117	76.9 Å²	76.9	61%	0.613	44%	0.439	S	S	*	.	H	α-helix	trans	-65.7	-45.4	170.8	-137.3	75	0	0	0	111.6	F297 T321 T323 S327 V328	F297-L325 HydrophobicContact CE1-CD2 4.09Å; T321-L325 PolarHBondContact O-N 2.93Å; T323-L325 VanDerWaalsContact C-N 3.33Å; T323-L325 PolarHBondContact O-N 3.34Å; L325-S327 VanDerWaalsContact C-N 3.27Å; L325-S327 PolarHBondContact O-N 2.84Å; L325-V328 PolarHBondContact O-N 3.35Å
326	S	44	Very low	52.2	Low	12 Å²	12	76.5 Å²	76.5	8%	0.084	43%	0.428	C	S	.	.	H	α-helix	trans	-63.9	-29.9	176.8	-59.5	0	0	0	0	113.3	H301 M322 T323 V328 A329	H301-S326 PolarHBondContact ND1-O 3.14Å; M322-S326 WeakPolarHBondContact O-CB 3.46Å; M322-S326 PolarHBondContact O-N 3.1Å; M322-S326 PolarHBondContact O-OG 2.99Å; T323-S326 CarbonylContact O-C 3.55Å; T323-S326 PolarHBondContact O-N 3.46Å; S326-V328 PolarHBondContact O-N 3.08Å; S326-A329 PolarHBondContact O-N 3.03Å
327	S	42.7	Very low	53	Low	66 Å²	66	76.6 Å²	76.6	46%	0.462	44%	0.438	S	S	.	.	H	α-helix	trans	-66.8	-21.8	-179.2	-169.7	0	0	0	0	113.2	T323 T324 L325 A329 R330	T323-S327 VanDerWaalsContact O-CB 3.29Å; T323-S327 WeakPolarHBondContact O-CB 3.38Å; T323-S327 PolarHBondContact O-N 3.34Å; T324-S327 PolarHBondContact O-N 3.11Å; L325-S327 VanDerWaalsContact C-N 3.27Å; L325-S327 PolarHBondContact O-N 2.84Å; S327-A329 PolarHBondContact O-N 3.2Å; S327-R330 PolarHBondContact O-N 3.45Å
328	V	44.9	Very low	54.5	Low	103 Å²	103	74.1 Å²	74.1	62%	0.624	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-65.9	-31.1	176.6	-176.8	0	0	0	0	111.3	L325 S326 T331	L325-V328 PolarHBondContact O-N 3.35Å; S326-V328 PolarHBondContact O-N 3.08Å; V328-T331 WeakPolarHBondContact O-CG2 3.19Å; V328-T331 PolarHBondContact O-OG1 3.1Å
329	A	40.7	Very low	56	Low	50 Å²	50	75.1 Å²	75.1	41%	0.413	42%	0.416	S	S	.	.	G	3₁₀ helix	trans	-91.4	-2.7	-179.9	0	0	0	0	0	114.2	S326 S327	S326-A329 PolarHBondContact O-N 3.03Å; S327-A329 PolarHBondContact O-N 3.2Å
330	R	52.7	Low	57.8	Low	65 Å²	65	72.3 Å²	72.3	25%	0.245	40%	0.4	C	S	.	.	G	3₁₀ helix	trans	-107.8	31.7	171.3	-59.7	-142.6	-81.7	176	-5.5	113.1	H301 S304 V305 S327 S332	H301-R330 WeakPolarHBondContact CE1-CG 3.46Å; H301-R330 WeakPolarHBondContact NE2-CG 3.45Å; H301-R330 PolarHBondContact O-NE 3.48Å; H301-R330 PolarHBondContact O-NH2 2.86Å; S304-R330 PolarHBondContact OG-NH2 3.17Å; V305-R330 VanDerWaalsContact CG2-NH2 3.28Å; S327-R330 PolarHBondContact O-N 3.45Å; R330-S332 PolarHBondContact O-N 3.06Å
331	T	57	Low	60	Low	103 Å²	103	67.7 Å²	67.7	63%	0.632	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	4.9	-179.7	39.6	0	0	0	0	114.5	I87 V328	I87-T331 WeakPolarHBondContact CD1-O 3.36Å; V328-T331 WeakPolarHBondContact O-CG2 3.19Å; V328-T331 PolarHBondContact O-OG1 3.1Å
332	S	63.2	Low	61.9	Low	31 Å²	31	64.4 Å²	64.4	22%	0.217	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.7	-6.4	-175	54.1	0	0	0	0	115.2	R330	R330-S332 PolarHBondContact O-N 3.06Å
333	L	69.5	Low	63.7	Low	40 Å²	40	62.8 Å²	62.8	21%	0.209	35%	0.347	C	S	.	.			trans	-126.8	143.3	-169.5	-71.7	167.7	0	0	0	113.4	L174 F177	L174-L333 HydrophobicContact CD1-CD2 4.38Å; F177-L333 HydrophobicContact CD1-CD1 4.27Å; F177-L333 HydrophobicContact CD1-CD2 4.43Å; F177-L333 HydrophobicContact CD2-CD2 4.13Å; F177-L333 HydrophobicContact CE1-CD1 3.47Å; F177-L333 VanDerWaalsContact CE1-CD1 3.47Å; F177-L333 HydrophobicContact CE1-CD2 4Å; F177-L333 HydrophobicContact CE1-CG 4.33Å; F177-L333 HydrophobicContact CE2-CD2 3.69Å; F177-L333 HydrophobicContact CZ-CD1 3.66Å; F177-L333 HydrophobicContact CZ-CD2 3.62Å; F177-L333 HydrophobicContact CZ-CG 4.11Å
334	P	72.9	Confident	65.6	Low	25 Å²	25	64 Å²	64	16%	0.162	35%	0.351	C	S	.	.			trans	-73.4	159.5	174.1	33.6	-34.1	0	0	0	110.7	S86 M89 L174 V336	S86-P334 WeakPolarHBondContact O-CB 3.48Å; S86-P334 VanDerWaalsContact O-CD 3.23Å; S86-P334 WeakPolarHBondContact O-CD 3.33Å; S86-P334 WeakPolarHBondContact O-CG 3.5Å; M89-P334 HydrophobicContact CE-CB 4.39Å; M89-P334 HydrophobicContact CE-CG 3.85Å; L174-P334 HydrophobicContact CD1-CG 3.43Å; L174-P334 VanDerWaalsContact CD1-CG 3.43Å; P334-V336 HydrophobicContact CG-CG1 4.22Å; P334-V336 PolarHBondContact O-N 3.43Å; P334-V336 VanDerWaalsContact O-N 3.11Å
335	R	66.3	Low	67.7	Low	213 Å²	213	60 Å²	60	80%	0.804	33%	0.327	S	S	*	.			trans	-80.2	90	171.5	-67.6	-175.5	-176	154.8	3.7	110.3
336	V	74.6	Confident	69.6	Low	35 Å²	35	54.7 Å²	54.7	21%	0.212	30%	0.299	C	S	.	.			trans	-81.1	154.2	169.2	-65	0	0	0	0	111.2	L174 P334 Y338 T340	L174-V336 HydrophobicContact CD1-CG1 4.35Å; P334-V336 HydrophobicContact CG-CG1 4.22Å; P334-V336 PolarHBondContact O-N 3.43Å; P334-V336 VanDerWaalsContact O-N 3.11Å; V336-Y338 HydrophobicContact CB-CD1 4.24Å; V336-Y338 HydrophobicContact CB-CD2 4.25Å; V336-Y338 HydrophobicContact CB-CE1 3.93Å; V336-Y338 HydrophobicContact CB-CE2 3.93Å; V336-Y338 HydrophobicContact CB-CG 4.41Å; V336-Y338 HydrophobicContact CG1-CE1 4.05Å; V336-Y338 HydrophobicContact CG1-CE2 4.12Å; V336-Y338 HydrophobicContact CG2-CD2 4.1Å; V336-Y338 HydrophobicContact CG2-CE2 3.89Å; V336-T340 HydrophobicContact CG2-CG2 4.23Å
337	S	72.8	Confident	71.3	Confident	104 Å²	104	57 Å²	57	73%	0.727	31%	0.313	S	S	*	.	S	Bend	trans	-92.7	-12.3	179.9	52.1	0	0	0	0	114
338	Y	80.5	Confident	73.4	Confident	63 Å²	63	55.4 Å²	55.4	25%	0.247	30%	0.3	C	S	.	.	S	Bend	trans	-96.9	158	177.6	50.5	-101.6	0	0	0	111.8	L174 H175 V336 T340	L174-Y338 HydrophobicContact CB-CE2 4.28Å; L174-Y338 PolarHBondContact N-OH 3.47Å; H175-Y338 AromaticContact CD2-CD2 3.57Å; H175-Y338 AromaticContact CD2-CE2 3.64Å; H175-Y338 AromaticContact CD2-CG 3.78Å; H175-Y338 AromaticContact CD2-CZ 3.9Å; H175-Y338 AromaticContact NE2-CD1 3.81Å; H175-Y338 AromaticContact NE2-CE1 3.76Å; H175-Y338 AromaticContact NE2-CZ 3.91Å; V336-Y338 HydrophobicContact CB-CD1 4.24Å; V336-Y338 HydrophobicContact CB-CD2 4.25Å; V336-Y338 HydrophobicContact CB-CE1 3.93Å; V336-Y338 HydrophobicContact CB-CE2 3.93Å; V336-Y338 HydrophobicContact CB-CG 4.41Å; V336-Y338 HydrophobicContact CG1-CE1 4.05Å; V336-Y338 HydrophobicContact CG1-CE2 4.12Å; V336-Y338 HydrophobicContact CG2-CD2 4.1Å; V336-Y338 HydrophobicContact CG2-CE2 3.89Å; Y338-T340 HydrophobicContact CE2-CG2 4.47Å
339	I	80.3	Confident	75.3	Confident	121 Å²	121	50.8 Å²	50.8	62%	0.621	27%	0.272	S	S	*	.	P	Polyproline II helix	trans	-77	129.4	174.8	-63.2	163.7	0	0	0	108.4	D343 L344	I339-D343 HydrophobicContact CG2-CB 4Å; I339-L344 HydrophobicContact CG2-CB 4.14Å
340	T	85.8	Confident	77.2	Confident	9 Å²	9	50.6 Å²	50.6	6%	0.055	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-87.1	162.5	173.1	69	0	0	0	0	111.9	L174 H175 F177 V336 Y338 M342 D343 L344	L174-T340 WeakPolarHBondContact O-CG2 3.28Å; H175-T340 WeakPolarHBondContact O-CA 3.34Å; F177-T340 HydrophobicContact CB-CG2 4.4Å; V336-T340 HydrophobicContact CG2-CG2 4.23Å; Y338-T340 HydrophobicContact CE2-CG2 4.47Å; T340-M342 PolarHBondContact O-N 3.13Å; T340-D343 WeakPolarHBondContact CB-OD2 3.5Å; T340-D343 WeakPolarHBondContact CG2-OD2 3.39Å; T340-D343 PolarHBondContact N-OD2 2.8Å; T340-D343 PolarHBondContact O-N 3.2Å; T340-D343 VanDerWaalsContact O-N 3.14Å; T340-D343 VanDerWaalsContact OG1-CG 3.28Å; T340-D343 PolarHBondContact OG1-N 3.27Å; T340-D343 VanDerWaalsContact OG1-N 3.1Å; T340-D343 PolarHBondContact OG1-OD2 3.47Å; T340-L344 PolarHBondContact O-N 3.08Å
341	A	88.3	Confident	78.7	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-54.8	-36.5	172	0	0	0	0	0	112.5	H175 F345 Y467 Y471	H175-A341 PolarHBondContact O-N 3.28Å; A341-F345 PolarHBondContact O-N 3.03Å; A341-F345 VanDerWaalsContact O-N 3.13Å; A341-Y467 VanDerWaalsContact C-OH 3.24Å; A341-Y467 WeakPolarHBondContact O-CE2 3.43Å; A341-Y467 PolarHBondContact O-OH 2.96Å; A341-Y471 HydrophobicContact CB-CD1 3.79Å; A341-Y471 HydrophobicContact CB-CD2 4.14Å; A341-Y471 HydrophobicContact CB-CE1 3.51Å; A341-Y471 HydrophobicContact CB-CE2 3.89Å; A341-Y471 HydrophobicContact CB-CG 4.1Å
342	M	85.3	Confident	80.1	Confident	19 Å²	19	48.6 Å²	48.6	9%	0.094	25%	0.251	C	S	.	.	H	α-helix	trans	-64.8	-48.9	173.3	-172.4	-176	-178.6	0	0	112.6	F177 F255 T259 T340 L344 F345 V346	F177-M342 HydrophobicContact CD1-CB 4.17Å; F177-M342 HydrophobicContact CD1-SD 4.2Å; F177-M342 HydrophobicContact CE1-CB 4.43Å; F177-M342 HydrophobicContact CE1-SD 3.55Å; F177-M342 VanDerWaalsContact CE1-SD 3.55Å; F177-M342 PolarHBondContact O-N 2.62Å; F255-M342 HydrophobicContact CD1-CE 4.49Å; T259-M342 HydrophobicContact CG2-CE 3.63Å; T259-M342 WeakPolarHBondContact OG1-CE 3.28Å; T340-M342 PolarHBondContact O-N 3.13Å; M342-L344 VanDerWaalsContact C-N 3.27Å; M342-L344 PolarHBondContact O-N 3.38Å; M342-F345 PolarHBondContact O-N 3.34Å; M342-V346 WeakPolarHBondContact O-CG2 3.3Å; M342-V346 PolarHBondContact O-N 3.49Å
343	D	82.8	Confident	81	Confident	22 Å²	22	47.3 Å²	47.3	12%	0.118	24%	0.242	C	C	.	.	H	α-helix	trans	-60.6	-38.6	178.8	-66.7	-63.4	0	0	0	111.2	I339 T340 T347	I339-D343 HydrophobicContact CG2-CB 4Å; T340-D343 WeakPolarHBondContact CB-OD2 3.5Å; T340-D343 WeakPolarHBondContact CG2-OD2 3.39Å; T340-D343 PolarHBondContact N-OD2 2.8Å; T340-D343 PolarHBondContact O-N 3.2Å; T340-D343 VanDerWaalsContact O-N 3.14Å; T340-D343 VanDerWaalsContact OG1-CG 3.28Å; T340-D343 PolarHBondContact OG1-N 3.27Å; T340-D343 VanDerWaalsContact OG1-N 3.1Å; T340-D343 PolarHBondContact OG1-OD2 3.47Å; D343-T347 VanDerWaalsContact O-CB 3.24Å; D343-T347 WeakPolarHBondContact O-CB 3.43Å; D343-T347 PolarHBondContact O-N 3.13Å; D343-T347 PolarHBondContact O-OG1 3.4Å
344	L	87	Confident	81.5	Confident	60 Å²	60	50.1 Å²	50.1	31%	0.314	25%	0.253	S	S	.	.	H	α-helix	trans	-62.3	-47	175.6	-174.9	149.8	0	0	0	111.3	I339 T340 M342 T347 V348 F463 Y467	I339-L344 HydrophobicContact CG2-CB 4.14Å; T340-L344 PolarHBondContact O-N 3.08Å; M342-L344 VanDerWaalsContact C-N 3.27Å; M342-L344 PolarHBondContact O-N 3.38Å; L344-T347 PolarHBondContact O-N 2.91Å; L344-V348 HydrophobicContact CD2-CG2 4.35Å; L344-V348 WeakPolarHBondContact O-CG2 3.4Å; L344-V348 PolarHBondContact O-N 3.33Å; L344-F463 HydrophobicContact CD2-CE2 4.11Å; L344-F463 HydrophobicContact CD2-CZ 4.22Å; L344-Y467 HydrophobicContact CD2-CD2 3.99Å; L344-Y467 HydrophobicContact CD2-CE2 4Å
345	F	87.7	Confident	82.1	Confident	1 Å²	1	50.8 Å²	50.8	0%	0.004	26%	0.26	C	S	.	.	H	α-helix	trans	-61.3	-47.2	178.2	-169.8	-90.2	0	0	0	112.2	Y260 C263 I264 A341 M342 T347 V348 C349 F463 Y467 W468	Y260-F345 AromaticContact CD1-CD1 3.54Å; Y260-F345 HydrophobicContact CD1-CD1 3.54Å; Y260-F345 HydrophobicContact CD1-CD2 4.05Å; Y260-F345 AromaticContact CD1-CE1 3.6Å; Y260-F345 HydrophobicContact CD1-CE1 3.6Å; Y260-F345 HydrophobicContact CD1-CE2 4.1Å; Y260-F345 AromaticContact CD1-CG 3.78Å; Y260-F345 HydrophobicContact CD1-CG 3.78Å; Y260-F345 AromaticContact CD1-CZ 3.9Å; Y260-F345 HydrophobicContact CD1-CZ 3.9Å; Y260-F345 HydrophobicContact CE1-CB 3.93Å; Y260-F345 AromaticContact CE1-CD1 3.81Å; Y260-F345 HydrophobicContact CE1-CD1 3.81Å; Y260-F345 AromaticContact CE1-CD2 3.93Å; Y260-F345 HydrophobicContact CE1-CD2 3.93Å; Y260-F345 HydrophobicContact CE1-CE1 4.3Å; Y260-F345 HydrophobicContact CE1-CE2 4.41Å; Y260-F345 AromaticContact CE1-CG 3.61Å; Y260-F345 HydrophobicContact CE1-CG 3.61Å; Y260-F345 HydrophobicContact CG-CE1 4.48Å; C263-F345 HydrophobicContact CB-CD1 4.43Å; C263-F345 HydrophobicContact CB-CE1 3.99Å; I264-F345 HydrophobicContact CD1-CZ 4.17Å; I264-F345 HydrophobicContact CG1-CE1 4.3Å; I264-F345 HydrophobicContact CG1-CZ 3.87Å; A341-F345 PolarHBondContact O-N 3.03Å; A341-F345 VanDerWaalsContact O-N 3.13Å; M342-F345 PolarHBondContact O-N 3.34Å; F345-T347 VanDerWaalsContact C-N 3.34Å; F345-T347 PolarHBondContact O-N 2.84Å; F345-V348 PolarHBondContact O-N 2.74Å; F345-C349 WeakPolarHBondContact CE1-SG 3.31Å; F345-C349 PolarHBondContact O-N 2.98Å; F345-C349 PolarHBondContact O-SG 3.49Å; F345-F463 AromaticContact CD2-CE1 3.71Å; F345-F463 HydrophobicContact CD2-CE1 3.71Å; F345-F463 AromaticContact CD2-CZ 3.96Å; F345-F463 HydrophobicContact CD2-CZ 3.96Å; F345-F463 AromaticContact CE2-CE1 3.81Å; F345-F463 HydrophobicContact CE2-CE1 3.81Å; F345-F463 HydrophobicContact CE2-CZ 4.49Å; F345-Y467 HydrophobicContact CB-CE1 4.44Å; F345-Y467 HydrophobicContact CB-CE2 3.84Å; F345-Y467 AromaticContact CD2-CD1 3.76Å; F345-Y467 HydrophobicContact CD2-CD1 3.76Å; F345-Y467 HydrophobicContact CD2-CD2 4.1Å; F345-Y467 AromaticContact CD2-CE1 3.65Å; F345-Y467 HydrophobicContact CD2-CE1 3.65Å; F345-Y467 AromaticContact CD2-CE2 4Å; F345-Y467 HydrophobicContact CD2-CE2 4Å; F345-Y467 AromaticContact CD2-CG 4Å; F345-Y467 HydrophobicContact CD2-CG 4Å; F345-Y467 AromaticContact CD2-CZ 3.79Å; F345-Y467 HydrophobicContact CE2-CD1 4.19Å; F345-Y467 HydrophobicContact CE2-CE1 4.34Å; F345-Y467 HydrophobicContact CG-CE1 4.36Å; F345-Y467 HydrophobicContact CG-CE2 4.42Å; F345-W468 HydrophobicContact CE2-CZ2 4.38Å
346	V	81.8	Confident	82.9	Confident	7 Å²	7	40.8 Å²	40.8	4%	0.042	22%	0.223	C	C	.	.	H	α-helix	trans	-61.9	-43.1	177.6	173.3	0	0	0	0	110.9	T259 I298 A302 M342 C349 F350	T259-V346 HydrophobicContact CG2-CG2 3.8Å; I298-V346 HydrophobicContact CG2-CG1 4.07Å; A302-V346 HydrophobicContact CB-CG1 4.07Å; M342-V346 WeakPolarHBondContact O-CG2 3.3Å; M342-V346 PolarHBondContact O-N 3.49Å; V346-C349 PolarHBondContact O-N 2.98Å; V346-F350 WeakPolarHBondContact O-CB 3.2Å; V346-F350 PolarHBondContact O-N 2.75Å
347	T	81.4	Confident	83.2	Confident	60 Å²	60	41.2 Å²	41.2	37%	0.368	22%	0.224	S	C	.	.	H	α-helix	trans	-64.9	-40.3	178.8	-57.9	0	0	0	0	112	D343 L344 F345 F350 L351	D343-T347 VanDerWaalsContact O-CB 3.24Å; D343-T347 WeakPolarHBondContact O-CB 3.43Å; D343-T347 PolarHBondContact O-N 3.13Å; D343-T347 PolarHBondContact O-OG1 3.4Å; L344-T347 PolarHBondContact O-N 2.91Å; F345-T347 VanDerWaalsContact C-N 3.34Å; F345-T347 PolarHBondContact O-N 2.84Å; T347-F350 WeakPolarHBondContact O-CB 3.3Å; T347-F350 PolarHBondContact O-N 3.47Å; T347-L351 HydrophobicContact CG2-CD1 4.48Å; T347-L351 WeakPolarHBondContact O-CG 3.43Å; T347-L351 PolarHBondContact O-N 2.84Å
348	V	86.2	Confident	83.7	Confident	33 Å²	33	40.7 Å²	40.7	20%	0.2	21%	0.211	C	C	.	.	H	α-helix	trans	-67.5	-43	175.3	172.7	0	0	0	0	111.1	L344 F345 F350 L351 F352 F463	L344-V348 HydrophobicContact CD2-CG2 4.35Å; L344-V348 WeakPolarHBondContact O-CG2 3.4Å; L344-V348 PolarHBondContact O-N 3.33Å; F345-V348 PolarHBondContact O-N 2.74Å; V348-F350 VanDerWaalsContact C-N 3.29Å; V348-F350 PolarHBondContact O-N 2.73Å; V348-L351 PolarHBondContact O-N 2.73Å; V348-L351 VanDerWaalsContact O-N 3.13Å; V348-F352 HydrophobicContact CG1-CD2 3.8Å; V348-F352 HydrophobicContact CG1-CE2 3.65Å; V348-F352 WeakPolarHBondContact O-CD2 3.37Å; V348-F352 PolarHBondContact O-N 3.27Å; V348-F463 HydrophobicContact CB-CE1 3.99Å; V348-F463 HydrophobicContact CB-CE2 4.03Å; V348-F463 HydrophobicContact CB-CZ 3.69Å; V348-F463 HydrophobicContact CG1-CD1 3.73Å; V348-F463 HydrophobicContact CG1-CD2 3.9Å; V348-F463 HydrophobicContact CG1-CE1 3.62Å; V348-F463 HydrophobicContact CG1-CE2 3.8Å; V348-F463 HydrophobicContact CG1-CG 3.87Å; V348-F463 HydrophobicContact CG1-CZ 3.67Å; V348-F463 HydrophobicContact CG2-CE2 3.86Å; V348-F463 HydrophobicContact CG2-CZ 3.95Å
349	C	83.9	Confident	83.9	Confident	5 Å²	5	38.3 Å²	38.3	3%	0.034	20%	0.202	C	C	.	.	H	α-helix	trans	-58.6	-41.2	174.6	-67.2	0	0	0	0	112	C263 V267 F345 V346 F352 V353	C263-C349 HydrophobicContact CB-CB 4.22Å; V267-C349 HydrophobicContact CG2-CB 3.7Å; F345-C349 WeakPolarHBondContact CE1-SG 3.31Å; F345-C349 PolarHBondContact O-N 2.98Å; F345-C349 PolarHBondContact O-SG 3.49Å; V346-C349 PolarHBondContact O-N 2.98Å; C349-F352 PolarHBondContact O-N 2.67Å; C349-V353 PolarHBondContact O-N 3.38Å; C349-V353 VanDerWaalsContact O-N 3.13Å
350	F	81.4	Confident	83.8	Confident	47 Å²	47	33.1 Å²	33.1	21%	0.206	18%	0.175	C	C	.	.	H	α-helix	trans	-59.6	-45.7	173.5	-179.5	-111.1	0	0	0	112.5	A295 V296 S299 V346 T347 V348 F352 V353 F354	A295-F350 HydrophobicContact CB-CD2 4.31Å; V296-F350 HydrophobicContact CG2-CE2 3.84Å; V296-F350 HydrophobicContact CG2-CZ 4.43Å; S299-F350 VanDerWaalsContact CB-CD2 3.48Å; S299-F350 WeakPolarHBondContact OG-CB 3.34Å; S299-F350 WeakPolarHBondContact OG-CD2 3.38Å; S299-F350 WeakPolarHBondContact OG-CG 3.37Å; V346-F350 WeakPolarHBondContact O-CB 3.2Å; V346-F350 PolarHBondContact O-N 2.75Å; T347-F350 WeakPolarHBondContact O-CB 3.3Å; T347-F350 PolarHBondContact O-N 3.47Å; V348-F350 VanDerWaalsContact C-N 3.29Å; V348-F350 PolarHBondContact O-N 2.73Å; F350-F352 VanDerWaalsContact C-N 3.32Å; F350-F352 PolarHBondContact O-N 3.12Å; F350-V353 PolarHBondContact O-N 3.17Å; F350-F354 WeakPolarHBondContact O-CB 3.21Å; F350-F354 PolarHBondContact O-N 3.32Å
351	L	83.7	Confident	83.5	Confident	99 Å²	99	35.1 Å²	35.1	52%	0.518	19%	0.192	S	C	.	.	H	α-helix	trans	-63.2	-35.5	178.3	-70.5	170.4	0	0	0	112.4	T347 V348 F354 A355	T347-L351 HydrophobicContact CG2-CD1 4.48Å; T347-L351 WeakPolarHBondContact O-CG 3.43Å; T347-L351 PolarHBondContact O-N 2.84Å; V348-L351 PolarHBondContact O-N 2.73Å; V348-L351 VanDerWaalsContact O-N 3.13Å; L351-F354 PolarHBondContact O-N 3.27Å; L351-A355 VanDerWaalsContact O-CB 3.3Å; L351-A355 WeakPolarHBondContact O-CB 3.3Å; L351-A355 PolarHBondContact O-N 3.45Å
352	F	86.5	Confident	83.1	Confident	26 Å²	26	37.4 Å²	37.4	11%	0.114	21%	0.206	C	C	.	.	H	α-helix	trans	-65.5	-44.9	172.7	-85.8	-77.1	0	0	0	112.6	V267 V348 C349 F350 F354 A355 A356 F456 F460	V267-F352 HydrophobicContact CG1-CB 4.17Å; V267-F352 HydrophobicContact CG2-CB 4.34Å; V348-F352 HydrophobicContact CG1-CD2 3.8Å; V348-F352 HydrophobicContact CG1-CE2 3.65Å; V348-F352 WeakPolarHBondContact O-CD2 3.37Å; V348-F352 PolarHBondContact O-N 3.27Å; C349-F352 PolarHBondContact O-N 2.67Å; F350-F352 VanDerWaalsContact C-N 3.32Å; F350-F352 PolarHBondContact O-N 3.12Å; F352-F354 VanDerWaalsContact C-N 3.33Å; F352-F354 PolarHBondContact O-N 2.95Å; F352-A355 PolarHBondContact O-N 2.73Å; F352-A356 PolarHBondContact O-N 2.73Å; F352-A356 VanDerWaalsContact O-N 3.08Å; F352-F456 HydrophobicContact CD1-CD1 4.07Å; F352-F460 AromaticContact CD2-CD2 3.74Å; F352-F460 HydrophobicContact CD2-CD2 3.74Å; F352-F460 HydrophobicContact CD2-CE2 4.4Å; F352-F460 HydrophobicContact CE1-CB 4.18Å; F352-F460 HydrophobicContact CE2-CB 4.43Å; F352-F460 AromaticContact CE2-CD2 3.79Å; F352-F460 HydrophobicContact CE2-CD2 3.79Å; F352-F460 HydrophobicContact CG-CD2 4.26Å; F352-F460 HydrophobicContact CZ-CB 4.11Å; F352-F460 HydrophobicContact CZ-CD2 4.32Å
353	V	82.1	Confident	82.8	Confident	4 Å²	4	38 Å²	38	2%	0.024	21%	0.209	C	C	.	.	H	α-helix	trans	-65.3	-38	175.7	178	0	0	0	0	111.1	V267 A295 C349 F350 A356 L357	V267-V353 HydrophobicContact CG2-CG2 4.09Å; A295-V353 HydrophobicContact CB-CB 4.17Å; A295-V353 HydrophobicContact CB-CG1 3.87Å; A295-V353 HydrophobicContact CB-CG2 4.31Å; C349-V353 PolarHBondContact O-N 3.38Å; C349-V353 VanDerWaalsContact O-N 3.13Å; F350-V353 PolarHBondContact O-N 3.17Å; V353-A356 PolarHBondContact O-N 3.28Å; V353-L357 PolarHBondContact O-N 2.73Å; V353-L357 VanDerWaalsContact O-N 3.13Å
354	F	80.8	Confident	82.5	Confident	100 Å²	100	39.2 Å²	39.2	44%	0.439	22%	0.216	S	C	.	.	H	α-helix	trans	-66.7	-39.2	175.1	-175	-99.1	0	0	0	112.8	F350 L351 F352 A356 L357 M358	F350-F354 WeakPolarHBondContact O-CB 3.21Å; F350-F354 PolarHBondContact O-N 3.32Å; L351-F354 PolarHBondContact O-N 3.27Å; F352-F354 VanDerWaalsContact C-N 3.33Å; F352-F354 PolarHBondContact O-N 2.95Å; F354-A356 VanDerWaalsContact C-N 3.33Å; F354-A356 PolarHBondContact O-N 3.45Å; F354-L357 WeakPolarHBondContact O-CB 3.46Å; F354-L357 PolarHBondContact O-N 3.42Å; F354-M358 HydrophobicContact CD1-CG 4.05Å; F354-M358 HydrophobicContact CE1-CG 3.55Å; F354-M358 HydrophobicContact CE1-SD 4.18Å; F354-M358 HydrophobicContact CE2-CG 4.44Å; F354-M358 HydrophobicContact CZ-CG 3.77Å; F354-M358 HydrophobicContact CZ-SD 3.86Å; F354-M358 WeakPolarHBondContact O-CG 3.18Å; F354-M358 PolarHBondContact O-N 2.75Å
355	A	85.1	Confident	82.3	Confident	39 Å²	39	43.8 Å²	43.8	32%	0.322	23%	0.23	S	C	.	.	H	α-helix	trans	-63.8	-37.6	174.4	0	0	0	0	0	112	L351 F352 M358 E359 F456	L351-A355 VanDerWaalsContact O-CB 3.3Å; L351-A355 WeakPolarHBondContact O-CB 3.3Å; L351-A355 PolarHBondContact O-N 3.45Å; F352-A355 PolarHBondContact O-N 2.73Å; A355-M358 PolarHBondContact O-N 3.48Å; A355-E359 WeakPolarHBondContact O-CB 3.28Å; A355-E359 PolarHBondContact O-N 3.25Å; A355-F456 HydrophobicContact CB-CE1 3.7Å; A355-F456 HydrophobicContact CB-CZ 3.88Å
356	A	83.8	Confident	81.7	Confident	3 Å²	3	48.4 Å²	48.4	3%	0.025	25%	0.248	C	C	.	.	H	α-helix	trans	-66.5	-35.9	174.7	0	0	0	0	0	112.7	F274 F352 V353 F354 Y360 F456	F274-A356 HydrophobicContact CE1-CB 4.29Å; F274-A356 HydrophobicContact CZ-CB 3.91Å; F352-A356 PolarHBondContact O-N 2.73Å; F352-A356 VanDerWaalsContact O-N 3.08Å; V353-A356 PolarHBondContact O-N 3.28Å; F354-A356 VanDerWaalsContact C-N 3.33Å; F354-A356 PolarHBondContact O-N 3.45Å; A356-Y360 PolarHBondContact O-N 2.78Å; A356-F456 HydrophobicContact CB-CE1 4.06Å
357	L	80.8	Confident	81.3	Confident	43 Å²	43	50.3 Å²	50.3	23%	0.225	26%	0.262	C	S	.	.	H	α-helix	trans	-63.6	-45.2	171.2	-74.6	158.8	0	0	0	112.3	A288 V353 F354 Y360 A361	A288-L357 HydrophobicContact CB-CD2 3.63Å; V353-L357 PolarHBondContact O-N 2.73Å; V353-L357 VanDerWaalsContact O-N 3.13Å; F354-L357 WeakPolarHBondContact O-CB 3.46Å; F354-L357 PolarHBondContact O-N 3.42Å; L357-Y360 PolarHBondContact O-N 3.48Å; L357-A361 WeakPolarHBondContact O-CB 3.06Å; L357-A361 PolarHBondContact O-N 3.1Å
358	M	82	Confident	80.7	Confident	93 Å²	93	53.6 Å²	53.6	46%	0.458	27%	0.269	S	S	.	.	H	α-helix	trans	-65.3	-41.4	179.7	-74.7	-60.1	-55.2	0	0	111.6	F354 A355 A361 T362	F354-M358 HydrophobicContact CD1-CG 4.05Å; F354-M358 HydrophobicContact CE1-CG 3.55Å; F354-M358 HydrophobicContact CE1-SD 4.18Å; F354-M358 HydrophobicContact CE2-CG 4.44Å; F354-M358 HydrophobicContact CZ-CG 3.77Å; F354-M358 HydrophobicContact CZ-SD 3.86Å; F354-M358 WeakPolarHBondContact O-CG 3.18Å; F354-M358 PolarHBondContact O-N 2.75Å; A355-M358 PolarHBondContact O-N 3.48Å; M358-A361 PolarHBondContact O-N 3.38Å; M358-T362 WeakPolarHBondContact O-CB 3.15Å; M358-T362 PolarHBondContact O-N 3.27Å; M358-T362 PolarHBondContact O-OG1 2.8Å
359	E	84.9	Confident	79.8	Confident	14 Å²	14	54.2 Å²	54.2	7%	0.065	27%	0.274	C	S	.	.	H	α-helix	trans	-57.2	-50.7	174.6	-169.3	-93	-166.5	0	0	111.5	F274 A355 A361 T362 L363 L448 S452	F274-E359 HydrophobicContact CE1-CG 4.31Å; A355-E359 WeakPolarHBondContact O-CB 3.28Å; A355-E359 PolarHBondContact O-N 3.25Å; E359-A361 PolarHBondContact O-N 2.94Å; E359-T362 WeakPolarHBondContact O-CB 3.21Å; E359-T362 PolarHBondContact O-N 2.94Å; E359-T362 VanDerWaalsContact O-N 3.17Å; E359-L363 PolarHBondContact O-N 3.3Å; E359-L448 HydrophobicContact CG-CD2 3.9Å; E359-L448 HydrophobicContact CG-CG 4.36Å; E359-S452 WeakPolarHBondContact CG-OG 3.07Å; E359-S452 VanDerWaalsContact OE1-CB 3.31Å; E359-S452 WeakPolarHBondContact OE1-CB 3.43Å; E359-S452 PolarHBondContact OE1-OG 2.77Å
360	Y	78.1	Confident	78.8	Confident	12 Å²	12	59 Å²	59	5%	0.047	30%	0.298	C	S	.	.	H	α-helix	trans	-64.8	-38.9	178.6	174.7	-119.3	0	0	0	112.9	T281 R284 T285 A356 L357 T362 L363 N364	T281-Y360 WeakPolarHBondContact CA-OH 3.31Å; T281-Y360 PolarHBondContact O-OH 2.78Å; R284-Y360 HydrophobicContact CB-CD2 4.04Å; R284-Y360 HydrophobicContact CB-CE1 3.97Å; R284-Y360 HydrophobicContact CB-CE2 3.38Å; R284-Y360 WeakPolarHBondContact CB-OH 3.44Å; R284-Y360 HydrophobicContact CG-CE2 4.21Å; T285-Y360 HydrophobicContact CG2-CE1 3.69Å; T285-Y360 PolarHBondContact N-OH 3.25Å; A356-Y360 PolarHBondContact O-N 2.78Å; L357-Y360 PolarHBondContact O-N 3.48Å; Y360-T362 VanDerWaalsContact C-N 3.34Å; Y360-L363 PolarHBondContact O-N 3.46Å; Y360-N364 WeakPolarHBondContact CE1-ND2 3.2Å; Y360-N364 WeakPolarHBondContact CE2-ND2 3.44Å; Y360-N364 PolarHBondContact O-N 3.38Å; Y360-N364 PolarHBondContact OH-ND2 2.85Å
361	A	79.9	Confident	77.7	Confident	51 Å²	51	63.7 Å²	63.7	42%	0.421	32%	0.321	S	S	.	.	H	α-helix	trans	-63.7	-39.5	174	0	0	0	0	0	111.9	L357 M358 E359 Y365	L357-A361 WeakPolarHBondContact O-CB 3.06Å; L357-A361 PolarHBondContact O-N 3.1Å; M358-A361 PolarHBondContact O-N 3.38Å; E359-A361 PolarHBondContact O-N 2.94Å; A361-Y365 WeakPolarHBondContact O-CB 3.14Å; A361-Y365 PolarHBondContact O-N 3.01Å
362	T	81.1	Confident	75.7	Confident	48 Å²	48	66.5 Å²	66.5	29%	0.294	33%	0.325	S	S	.	.	H	α-helix	trans	-66.1	-45.4	175.9	-65.6	0	0	0	0	111.7	M358 E359 Y360 Y365 Y366	M358-T362 WeakPolarHBondContact O-CB 3.15Å; M358-T362 PolarHBondContact O-N 3.27Å; M358-T362 PolarHBondContact O-OG1 2.8Å; E359-T362 WeakPolarHBondContact O-CB 3.21Å; E359-T362 PolarHBondContact O-N 2.94Å; E359-T362 VanDerWaalsContact O-N 3.17Å; Y360-T362 VanDerWaalsContact C-N 3.34Å; T362-Y365 PolarHBondContact O-N 3.31Å; T362-Y366 HydrophobicContact CG2-CD2 3.6Å; T362-Y366 HydrophobicContact CG2-CE2 3.57Å; T362-Y366 VanDerWaalsContact O-CD2 3.32Å; T362-Y366 WeakPolarHBondContact O-CD2 3.38Å; T362-Y366 PolarHBondContact O-N 3.08Å
363	L	78.5	Confident	73.5	Confident	30 Å²	30	70.9 Å²	70.9	16%	0.157	36%	0.355	C	S	.	.	H	α-helix	trans	-56.8	-49.4	173.9	-85.2	174.1	0	0	0	112.2	E359 Y360 Y365 Y366 S367 L445 L448	E359-L363 PolarHBondContact O-N 3.3Å; Y360-L363 PolarHBondContact O-N 3.46Å; L363-Y365 PolarHBondContact O-N 3.18Å; L363-Y366 PolarHBondContact O-N 3.2Å; L363-S367 VanDerWaalsContact O-CB 3.24Å; L363-S367 WeakPolarHBondContact O-CB 3.29Å; L363-S367 PolarHBondContact O-N 3.16Å; L363-L445 WeakPolarHBondContact CD2-O 3.45Å; L363-L448 HydrophobicContact CD2-CB 3.99Å; L363-L448 HydrophobicContact CD2-CD2 4.28Å; L363-L448 HydrophobicContact CG-CB 4.48Å; L363-L448 HydrophobicContact CG-CD2 4.08Å
364	N	76.6	Confident	71.3	Confident	48 Å²	48	75.9 Å²	75.9	26%	0.257	39%	0.391	S	S	.	.	H	α-helix	trans	-60.1	-45.6	177.3	-86.2	-18.4	0	0	0	112.3	Y360 Y368	Y360-N364 WeakPolarHBondContact CE1-ND2 3.2Å; Y360-N364 WeakPolarHBondContact CE2-ND2 3.44Å; Y360-N364 PolarHBondContact O-N 3.38Å; Y360-N364 PolarHBondContact OH-ND2 2.85Å; N364-Y368 WeakPolarHBondContact O-CB 3.31Å; N364-Y368 PolarHBondContact O-N 3Å
365	Y	81.4	Confident	69.1	Low	157 Å²	157	82.4 Å²	82.4	62%	0.616	41%	0.414	S	S	*	.	H	α-helix	trans	-61.5	-47.5	-179.9	-179.8	-95.2	0	0	0	111.6	A361 T362 L363 S369	A361-Y365 WeakPolarHBondContact O-CB 3.14Å; A361-Y365 PolarHBondContact O-N 3.01Å; T362-Y365 PolarHBondContact O-N 3.31Å; L363-Y365 PolarHBondContact O-N 3.18Å; Y365-S369 WeakPolarHBondContact O-CB 3.44Å; Y365-S369 PolarHBondContact O-N 3.21Å
366	Y	76.7	Confident	66.8	Low	98 Å²	98	89.1 Å²	89.1	38%	0.384	44%	0.441	S	S	.	.	H	α-helix	trans	-67.5	-44.2	179	-79.4	-61.8	0	0	0	112.4	T362 L363 Y368 S369 I370 L445	T362-Y366 HydrophobicContact CG2-CD2 3.6Å; T362-Y366 HydrophobicContact CG2-CE2 3.57Å; T362-Y366 VanDerWaalsContact O-CD2 3.32Å; T362-Y366 WeakPolarHBondContact O-CD2 3.38Å; T362-Y366 PolarHBondContact O-N 3.08Å; L363-Y366 PolarHBondContact O-N 3.2Å; Y366-Y368 PolarHBondContact O-N 3.23Å; Y366-S369 WeakPolarHBondContact CA-OG 3.26Å; Y366-S369 PolarHBondContact O-N 3.19Å; Y366-S369 VanDerWaalsContact O-N 3.09Å; Y366-S369 PolarHBondContact O-OG 3.22Å; Y366-I370 WeakPolarHBondContact O-CG1 3.2Å; Y366-I370 PolarHBondContact O-N 3.39Å; Y366-L445 HydrophobicContact CD1-CD1 3.94Å; Y366-L445 HydrophobicContact CD2-CD1 3.8Å; Y366-L445 HydrophobicContact CD2-CD2 3.97Å; Y366-L445 HydrophobicContact CD2-CG 4.43Å; Y366-L445 HydrophobicContact CE1-CD1 4.01Å; Y366-L445 HydrophobicContact CE2-CD1 3.86Å; Y366-L445 HydrophobicContact CE2-CD2 3.99Å; Y366-L445 HydrophobicContact CG-CD1 3.85Å
367	S	72.4	Confident	64.3	Low	46 Å²	46	97.2 Å²	97.2	32%	0.322	48%	0.478	S	S	.	.	H	α-helix	trans	-54.2	-49.8	174.9	-173.4	0	0	0	0	111.8	L363 S369 I370 Q371	L363-S367 VanDerWaalsContact O-CB 3.24Å; L363-S367 WeakPolarHBondContact O-CB 3.29Å; L363-S367 PolarHBondContact O-N 3.16Å; S367-S369 PolarHBondContact O-N 3.27Å; S367-I370 PolarHBondContact O-N 3.13Å; S367-Q371 WeakPolarHBondContact O-CG 3.19Å; S367-Q371 PolarHBondContact O-N 3.03Å; S367-Q371 VanDerWaalsContact O-N 3.11Å
368	Y	68.5	Low	62	Low	130 Å²	130	100.7 Å²	100.7	51%	0.51	50%	0.504	S	S	.	.	H	α-helix	trans	-65.2	-36.1	175.8	175.9	-101	0	0	0	113.1	N364 Y366 Q371 R372	N364-Y368 WeakPolarHBondContact O-CB 3.31Å; N364-Y368 PolarHBondContact O-N 3Å; Y366-Y368 PolarHBondContact O-N 3.23Å; Y368-Q371 PolarHBondContact O-N 3.07Å; Y368-R372 PolarHBondContact OH-NE 3.46Å; Y368-R372 PolarHBondContact OH-NH2 3.16Å
369	S	67.2	Low	59.7	Low	45 Å²	45	105.4 Å²	105.4	32%	0.315	52%	0.521	S	S	.	.	H	α-helix	trans	-66.9	-38.1	178.4	77.8	0	0	0	0	112.7	Y365 Y366 S367 R372	Y365-S369 WeakPolarHBondContact O-CB 3.44Å; Y365-S369 PolarHBondContact O-N 3.21Å; Y366-S369 WeakPolarHBondContact CA-OG 3.26Å; Y366-S369 PolarHBondContact O-N 3.19Å; Y366-S369 VanDerWaalsContact O-N 3.09Å; Y366-S369 PolarHBondContact O-OG 3.22Å; S367-S369 PolarHBondContact O-N 3.27Å; S369-R372 PolarHBondContact O-N 3.18Å
370	I	63.6	Low	57	Low	106 Å²	106	115.8 Å²	115.8	54%	0.544	56%	0.56	S	S	.	*	H	α-helix	trans	-73.3	-32.6	178.5	-67.1	166.8	0	0	0	110.5	Y366 S367 R372 M446	Y366-I370 WeakPolarHBondContact O-CG1 3.2Å; Y366-I370 PolarHBondContact O-N 3.39Å; S367-I370 PolarHBondContact O-N 3.13Å; I370-R372 PolarHBondContact O-N 3.1Å; I370-M446 HydrophobicContact CD1-CE 3.79Å
371	Q	57.2	Low	54.9	Low	146 Å²	146	122.7 Å²	122.7	68%	0.682	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	-2.2	173.6	-74.4	-178.8	-6.6	0	0	114.6	S367 Y368 P373	S367-Q371 WeakPolarHBondContact O-CG 3.19Å; S367-Q371 PolarHBondContact O-N 3.03Å; S367-Q371 VanDerWaalsContact O-N 3.11Å; Y368-Q371 PolarHBondContact O-N 3.07Å; Q371-P373 WeakPolarHBondContact O-CD 3.16Å
372	R	42.1	Very low	52.4	Low	158 Å²	158	127.4 Å²	127.4	60%	0.596	62%	0.615	S	S	*	*	S	Bend	trans	-83.6	107.2	168.5	-71.7	-173.8	170.2	-158.3	-4.4	109.9	Y368 S369 I370 S374	Y368-R372 PolarHBondContact OH-NE 3.46Å; Y368-R372 PolarHBondContact OH-NH2 3.16Å; S369-R372 PolarHBondContact O-N 3.18Å; I370-R372 PolarHBondContact O-N 3.1Å; R372-S374 PolarHBondContact O-N 3.32Å
373	P	40.4	Very low	49.9	Very low	117 Å²	117	133.3 Å²	133.3	76%	0.76	64%	0.637	S	S	*	*			trans	-60.2	128.4	166.8	27	-33.8	0	0	0	108.5	Q371 Y375	Q371-P373 WeakPolarHBondContact O-CD 3.16Å; P373-Y375 PolarHBondContact O-N 2.88Å
374	S	35.9	Very low	47.5	Very low	109 Å²	109	137.3 Å²	137.3	76%	0.762	67%	0.667	S	S	*	*			trans	-60.6	131.9	166	-71.8	0	0	0	0	108.1	R372 M376	R372-S374 PolarHBondContact O-N 3.32Å; S374-M376 PolarHBondContact O-N 3.06Å
375	Y	35.4	Very low	45.5	Very low	238 Å²	238	141.8 Å²	141.8	93%	0.933	69%	0.691	S	S	*	*			trans	-54.5	109.3	171.7	-112.8	-105.3	0	0	0	108.3	P373 E377	P373-Y375 PolarHBondContact O-N 2.88Å; Y375-E377 PolarHBondContact O-N 3.41Å
376	M	36.1	Very low	43.1	Very low	179 Å²	179	141.5 Å²	141.5	88%	0.882	70%	0.699	S	S	*	*			trans	-69.8	99.4	172.3	-78.3	-174.9	69.2	0	0	108.1	S374	S374-M376 PolarHBondContact O-N 3.06Å
377	E	30.7	Very low	40.8	Very low	173 Å²	173	144.6 Å²	144.6	81%	0.808	72%	0.722	S	S	*	*			trans	-55.6	123.9	165.8	-173.5	177.4	-155.9	0	0	108.3	Y375 K379	Y375-E377 PolarHBondContact O-N 3.41Å; E377-K379 PolarHBondContact O-N 2.96Å
378	P	33.3	Very low	38.9	Very low	117 Å²	117	148 Å²	148	76%	0.76	74%	0.741	S	S	*	*			trans	-72.9	93.7	-170	27.8	-34.6	0	0	0	110.7	R380	P378-R380 PolarHBondContact O-N 3.44Å
379	K	32.7	Very low	36.9	Very low	192 Å²	192	153.3 Å²	153.3	84%	0.835	76%	0.76	S	S	*	*			trans	-53.8	110.5	168.3	-76.9	-176.6	176	177.9	0	109.3	E377 L381	E377-K379 PolarHBondContact O-N 2.96Å; K379-L381 PolarHBondContact O-N 3.34Å; K379-L381 VanDerWaalsContact O-N 3.11Å
380	R	28.4	Very low	35.3	Very low	232 Å²	232	156.7 Å²	156.7	88%	0.875	78%	0.78	S	S	*	*			trans	-59.4	113.5	170.4	-72.2	-177.9	175.4	-179.7	-1.5	109.2	P378 N382	P378-R380 PolarHBondContact O-N 3.44Å; R380-N382 PolarHBondContact O-N 2.94Å
381	L	34.3	Very low	33.9	Very low	157 Å²	157	157.4 Å²	157.4	82%	0.822	79%	0.792	S	S	*	*			trans	-71.8	113.7	160.1	-87.2	78	0	0	0	108	K379 F383	K379-L381 PolarHBondContact O-N 3.34Å; K379-L381 VanDerWaalsContact O-N 3.11Å; L381-F383 PolarHBondContact O-N 3.18Å; L381-F383 VanDerWaalsContact O-N 3.14Å
382	N	28.6	Very low	32.7	Very low	149 Å²	149	155.4 Å²	155.4	80%	0.797	79%	0.792	S	S	*	*			trans	-76.7	93	163.2	-72.9	-11.6	0	0	0	107.8	R380 S384	R380-N382 PolarHBondContact O-N 2.94Å; N382-S384 PolarHBondContact O-N 3.45Å
383	F	28.6	Very low	32	Very low	173 Å²	173	156.5 Å²	156.5	76%	0.759	80%	0.803	S	S	*	*			trans	-76.1	113.1	175.5	-176.3	-96.8	0	0	0	110.4	L381 L385	L381-F383 PolarHBondContact O-N 3.18Å; L381-F383 VanDerWaalsContact O-N 3.14Å; F383-L385 HydrophobicContact CD1-CB 4.43Å; F383-L385 HydrophobicContact CE1-CB 4.44Å; F383-L385 PolarHBondContact O-N 2.89Å
384	S	28.3	Very low	31.6	Very low	114 Å²	114	157 Å²	157	80%	0.797	80%	0.804	S	S	*	*			trans	-73.9	110.5	170.6	-67.5	0	0	0	0	109.9	N382 L386	N382-S384 PolarHBondContact O-N 3.45Å; S384-L386 PolarHBondContact O-N 3.17Å
385	L	34.5	Very low	31.4	Very low	142 Å²	142	158.8 Å²	158.8	74%	0.743	81%	0.81	S	S	*	*			trans	-81.5	105	-175.7	-168.9	176.3	0	0	0	110.7	F383	F383-L385 HydrophobicContact CD1-CB 4.43Å; F383-L385 HydrophobicContact CE1-CB 4.44Å; F383-L385 PolarHBondContact O-N 2.89Å
386	L	31.1	Very low	31.2	Very low	151 Å²	151	154.8 Å²	154.8	79%	0.791	80%	0.803	S	S	*	*			trans	173.4	101	148	-98.7	159.5	0	0	0	112.3	S384	S384-L386 PolarHBondContact O-N 3.17Å
387	D	27.2	Very low	31	Very low	163 Å²	163	151.1 Å²	151.1	87%	0.872	80%	0.802	S	S	*	*				-162.6	168.6	119	-154.5	-4	0	0	0	109.8
388	V	32.1	Very low	30.9	Very low	118 Å²	118	149.5 Å²	149.5	72%	0.715	80%	0.798	S	S	*	*			trans	-126.6	120.2	-159.5	179	0	0	0	0	113.9
389	R	27.3	Very low	30.9	Very low	241 Å²	241	150.5 Å²	150.5	91%	0.909	80%	0.797	S	S	*	*			trans	-158.6	143.4	148.5	-114.9	168.2	179.7	179.1	-0.1	112.5
390	P	32.7	Very low	31.4	Very low	115 Å²	115	149.6 Å²	149.6	75%	0.747	80%	0.801	S	S	*	*			trans	-90.7	159.9	-172.8	35.8	-35.9	0	0	0	114.3
391	P	35.8	Very low	31.3	Very low	121 Å²	121	142.9 Å²	142.9	79%	0.786	80%	0.795	S	S	*	*			trans	-102.9	153.6	-174.9	38.6	-34.9	0	0	0	115.5
392	P	31.1	Very low	31.1	Very low	105 Å²	105	143.6 Å²	143.6	68%	0.682	80%	0.796	S	S	*	*			trans	-112.1	143.7	149.3	33.2	-22.3	0	0	0	110.9
393	H	28.2	Very low	30.8	Very low	180 Å²	180	145.8 Å²	145.8	83%	0.833	80%	0.795	S	S	*	*			cis	-146.6	172.8	-7.9	-90.2	-53.9	0	0	0	110.1
394	T	30.9	Very low	30.6	Very low	127 Å²	127	148.2 Å²	148.2	78%	0.779	80%	0.799	S	S	*	*			trans	-65.9	140.9	-178.1	49.6	0	0	0	0	114.9
395	V	31.7	Very low	30.5	Very low	147 Å²	147	150.4 Å²	150.4	89%	0.891	80%	0.797	S	S	*	*			trans	-130.9	137.4	145.4	-86.9	0	0	0	0	109.5
396	I	32	Very low	30.1	Very low	154 Å²	154	152 Å²	152	79%	0.79	80%	0.8	S	S	*	*			trans	-92.8	121.8	-177.7	-66	165.2	0	0	0	108.3
397	A	30.5	Very low	29.9	Very low	102 Å²	102	155 Å²	155	84%	0.843	81%	0.807	S	S	*	*			trans	-74.3	133.6	172.9	0	0	0	0	0	110.5
398	L	29.5	Very low	29.9	Very low	140 Å²	140	155.5 Å²	155.5	73%	0.733	81%	0.805	S	S	*	*			trans	-141.6	117.9	-178.5	-137.1	165.9	0	0	0	110.1
399	N	32.9	Very low	30	Very low	137 Å²	137	158.1 Å²	158.1	73%	0.733	82%	0.815	S	S	*	*	S	Bend	trans	62.5	110.4	173.4	-66.6	-14.7	0	0	0	119.7	A401	N399-A401 PolarHBondContact O-N 2.87Å
400	N	43.3	Very low	29.9	Very low	174 Å²	174	150.7 Å²	150.7	93%	0.93	80%	0.804	S	S	*	*			trans	10.9	90.2	136.1	-61.7	-0.4	0	0	0	117.9
401	A	26.4	Very low	29.7	Very low	90 Å²	90	150.5 Å²	150.5	74%	0.744	81%	0.805	S	S	*	*			trans	-140.2	103.2	153.2	0	0	0	0	0	109	N399 Y403	N399-A401 PolarHBondContact O-N 2.87Å; A401-Y403 PolarHBondContact O-N 2.83Å
402	M	29.3	Very low	29.3	Very low	172 Å²	172	151 Å²	151	85%	0.847	81%	0.805	S	S	*	*			trans	-76	79.6	167.3	-85.5	-179.5	61.1	0	0	109
403	Y	23.4	Very low	29.5	Very low	196 Å²	196	152.8 Å²	152.8	77%	0.769	80%	0.799	S	S	*	*			trans	-75.6	122.7	164.9	-161.8	-99	0	0	0	108	A401 Q405	A401-Y403 PolarHBondContact O-N 2.83Å; Y403-Q405 VanDerWaalsContact C-N 3.31Å; Y403-Q405 HydrophobicContact CD1-CB 4.43Å; Y403-Q405 PolarHBondContact O-N 3.33Å
404	W	25.1	Very low	29.5	Very low	223 Å²	223	153.5 Å²	153.5	85%	0.845	80%	0.803	S	S	*	*			trans	-73.9	91.1	170.3	-77.7	95.5	0	0	0	107.9	E406	W404-E406 PolarHBondContact O-N 2.77Å
405	Q	26	Very low	29.7	Very low	161 Å²	161	151.7 Å²	151.7	75%	0.752	80%	0.795	S	S	*	*			trans	-73	122.8	177.1	-169.1	160.2	-9.5	0	0	109.4	Y403 F407	Y403-Q405 VanDerWaalsContact C-N 3.31Å; Y403-Q405 HydrophobicContact CD1-CB 4.43Å; Y403-Q405 PolarHBondContact O-N 3.33Å; Q405-F407 PolarHBondContact O-N 2.73Å
406	E	26.4	Very low	29.9	Very low	174 Å²	174	153 Å²	153	81%	0.813	80%	0.796	S	S	*	*			trans	-62.1	130.9	176.4	-66.4	171.1	123	0	0	109.3	W404 E408	W404-E406 PolarHBondContact O-N 2.77Å; E406-E408 PolarHBondContact O-N 2.8Å; E406-E408 VanDerWaalsContact O-N 3.14Å
407	F	26.5	Very low	29.9	Very low	214 Å²	214	153.9 Å²	153.9	94%	0.939	80%	0.802	S	S	*	*			trans	-79.2	92	172.3	-101.5	-93	0	0	0	108.5	Q405	Q405-F407 PolarHBondContact O-N 2.73Å
408	E	27	Very low	30.5	Very low	175 Å²	175	152 Å²	152	82%	0.818	79%	0.793	S	S	*	*			trans	-64.3	151.7	164.2	-72.6	-171.6	119.7	0	0	111	E406 A410	E406-E408 PolarHBondContact O-N 2.8Å; E406-E408 VanDerWaalsContact O-N 3.14Å; E408-A410 PolarHBondContact O-N 3.3Å; E408-A410 VanDerWaalsContact O-N 3.09Å
409	D	34.2	Very low	30.7	Very low	173 Å²	173	154.7 Å²	154.7	93%	0.925	80%	0.798	S	S	*	*			trans	-65.8	105.3	-172.8	-69.2	-71.6	0	0	0	113.5
410	A	25.5	Very low	30.7	Very low	84 Å²	84	155.7 Å²	155.7	69%	0.694	80%	0.804	S	S	*	*			trans	-126.4	64.5	174	0	0	0	0	0	111.6	E408 V412	E408-A410 PolarHBondContact O-N 3.3Å; E408-A410 VanDerWaalsContact O-N 3.09Å; A410-V412 VanDerWaalsContact C-N 3.34Å; A410-V412 PolarHBondContact O-N 3.48Å
411	C	27.4	Very low	30.4	Very low	112 Å²	112	153.2 Å²	153.2	76%	0.757	80%	0.798	S	S	*	*			trans	-75.7	80.5	179.8	-158	0	0	0	0	111.8	Y413	C411-Y413 PolarHBondContact O-N 3.39Å
412	V	27.6	Very low	30.8	Very low	131 Å²	131	157.9 Å²	157.9	79%	0.794	81%	0.805	S	S	*	*			trans	-78.2	117.8	176.8	-179.3	0	0	0	0	110.2	A410	A410-V412 VanDerWaalsContact C-N 3.34Å; A410-V412 PolarHBondContact O-N 3.48Å
413	Y	34.7	Very low	31.2	Very low	143 Å²	143	153.6 Å²	153.6	56%	0.561	79%	0.792	S	S	*	*			trans	-88.5	126	174.2	-86.9	-99.5	0	0	0	111.8	C411	C411-Y413 PolarHBondContact O-N 3.39Å
414	E	29.9	Very low	31.9	Very low	194 Å²	194	154.1 Å²	154.1	91%	0.907	80%	0.799	S	S	*	*			trans	-109.4	109.7	144.1	-81.7	-167.6	142.5	0	0	108.4
415	C	34.9	Very low	32.2	Very low	90 Å²	90	150.2 Å²	150.2	61%	0.608	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-83.7	131	165.7	-74.1	0	0	0	0	108.9
416	L	36.1	Very low	32.7	Very low	175 Å²	175	147 Å²	147	92%	0.916	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-66.3	140.9	168.1	-76.5	167.1	0	0	0	110.1
417	D	32.4	Very low	33.3	Very low	172 Å²	172	144.2 Å²	144.2	92%	0.92	78%	0.78	S	S	*	*	S	Bend	trans	-64	145.5	-169.8	-163.3	4.3	0	0	0	113.4
418	G	41.4	Very low	34	Very low	62 Å²	62	140.4 Å²	140.4	64%	0.639	76%	0.764	S	S	*	*	S	Bend	trans	106.6	14.3	162.3	0	0	0	0	0	120.3
419	K	33.8	Very low	35	Very low	196 Å²	196	140.4 Å²	140.4	85%	0.852	76%	0.764	S	S	*	*	S	Bend	trans	-143.4	146	165	-73	-162	176.1	-176.2	0	114.3
420	D	34.3	Very low	35.4	Very low	159 Å²	159	136.4 Å²	136.4	85%	0.85	74%	0.74	S	S	*	*			trans	-69.9	130.4	-163.8	-52.6	-83.5	0	0	0	115.7	Q422	D420-Q422 VanDerWaalsContact C-N 3.27Å; D420-Q422 PolarHBondContact O-N 2.64Å
421	C	35.8	Very low	36.2	Very low	121 Å²	121	136.7 Å²	136.7	82%	0.818	74%	0.736	S	S	*	*			trans	-78	61.2	178.7	-64.6	0	0	0	0	113.2
422	Q	36.3	Very low	37	Very low	188 Å²	188	140.8 Å²	140.8	88%	0.879	74%	0.74	S	S	*	*			trans	-139.7	52.7	179.4	-147.5	175.1	52.9	0	0	114.8	D420	D420-Q422 VanDerWaalsContact C-N 3.27Å; D420-Q422 PolarHBondContact O-N 2.64Å
423	S	36.3	Very low	38	Very low	83 Å²	83	137.4 Å²	137.4	58%	0.58	73%	0.732	S	S	*	*			trans	-137.7	141.5	161.5	84.5	0	0	0	0	112	F425	S423-F425 PolarHBondContact O-N 3.21Å; S423-F425 VanDerWaalsContact O-N 3.1Å
424	F	38.5	Very low	38.2	Very low	206 Å²	206	132.7 Å²	132.7	90%	0.904	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	2.7	-174.6	-113.7	-100.8	0	0	0	114.9
425	F	32.5	Very low	39	Very low	142 Å²	142	125 Å²	125	62%	0.623	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.6	2.5	-162	-78.8	-83.5	0	0	0	116	S423 C427 F428	S423-F425 PolarHBondContact O-N 3.21Å; S423-F425 VanDerWaalsContact O-N 3.1Å; F425-C427 PolarHBondContact O-N 2.81Å; F425-C427 VanDerWaalsContact O-N 3.13Å; F425-F428 PolarHBondContact O-N 2.79Å
426	C	35.9	Very low	39.4	Very low	94 Å²	94	132.1 Å²	132.1	64%	0.635	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	-10.2	179.1	-75.3	0	0	0	0	115.1
427	C	38.3	Very low	39.8	Very low	114 Å²	114	135.5 Å²	135.5	77%	0.77	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.8	-1	178.4	-65.2	0	0	0	0	115	F425	F425-C427 PolarHBondContact O-N 2.81Å; F425-C427 VanDerWaalsContact O-N 3.13Å
428	F	42.3	Very low	40.3	Very low	135 Å²	135	135 Å²	135	59%	0.592	70%	0.696	S	S	*	*			trans	-106.8	119.4	175.7	-94.7	-94.2	0	0	0	112.2	F425 E430 C431	F425-F428 PolarHBondContact O-N 2.79Å; F428-E430 PolarHBondContact O-N 3.08Å; F428-C431 PolarHBondContact O-N 3.4Å
429	E	46.7	Very low	40.3	Very low	175 Å²	175	136 Å²	136	82%	0.818	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-62.3	-27.7	-178.2	-163	167.1	-153.1	0	0	112.7	C431 K432	E429-C431 PolarHBondContact O-N 3.17Å; E429-C431 VanDerWaalsContact O-N 3.16Å; E429-K432 WeakPolarHBondContact O-CB 3.46Å; E429-K432 PolarHBondContact O-N 3Å
430	E	42.8	Very low	40.8	Very low	89 Å²	89	135 Å²	135	42%	0.416	70%	0.698	S	S	.	*	G	3₁₀ helix	trans	-52.2	-35.2	174.5	-66.4	-156.9	103.6	0	0	114.2	F428 K432 G433	F428-E430 PolarHBondContact O-N 3.08Å; E430-K432 PolarHBondContact O-N 3.11Å; E430-G433 PolarHBondContact O-N 2.88Å
431	C	41.8	Very low	41.3	Very low	90 Å²	90	133.7 Å²	133.7	61%	0.608	70%	0.696	S	S	*	*	G	3₁₀ helix	trans	-63.6	-23.2	-178.8	-79.5	0	0	0	0	112.6	F428 E429	F428-C431 PolarHBondContact O-N 3.4Å; E429-C431 PolarHBondContact O-N 3.17Å; E429-C431 VanDerWaalsContact O-N 3.16Å
432	K	44.5	Very low	41.7	Very low	197 Å²	197	133.6 Å²	133.6	86%	0.857	68%	0.683	S	S	*	*	G	3₁₀ helix	trans	-76.5	-22	-179.6	-138.7	170.8	-170.6	171.6	0	113.1	E429 E430	E429-K432 WeakPolarHBondContact O-CB 3.46Å; E429-K432 PolarHBondContact O-N 3Å; E430-K432 PolarHBondContact O-N 3.11Å
433	G	48.1	Very low	42.7	Very low	60 Å²	60	129.5 Å²	129.5	62%	0.619	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.5	-12.8	-174.9	0	0	0	0	0	116	E430 A435	E430-G433 PolarHBondContact O-N 2.88Å; G433-A435 PolarHBondContact O-N 3.47Å
434	G	40.2	Very low	43.8	Very low	44 Å²	44	129.8 Å²	129.8	45%	0.454	66%	0.662	S	S	.	*	T	Hydrogen-bonded Turn	trans	63	22.3	-179.4	0	0	0	0	0	114.8	W436	G434-W436 VanDerWaalsContact C-N 3.28Å; G434-W436 PolarHBondContact O-N 3.5Å
435	A	46.4	Very low	45	Very low	33 Å²	33	123 Å²	123	27%	0.273	63%	0.634	S	S	.	*	G	3₁₀ helix	trans	-60.9	-33.5	-171.2	0	0	0	0	0	113.7	G433 R437 R438	G433-A435 PolarHBondContact O-N 3.47Å; A435-R437 PolarHBondContact O-N 3.09Å; A435-R438 PolarHBondContact O-N 2.92Å; A435-R438 VanDerWaalsContact O-N 3.08Å
436	W	43.7	Very low	46.4	Very low	240 Å²	240	122.3 Å²	122.3	91%	0.909	64%	0.635	S	S	*	*	G	3₁₀ helix	trans	-53.2	-26.1	-176.3	-128.9	72.6	0	0	0	114.7	G434 R438	G434-W436 VanDerWaalsContact C-N 3.28Å; G434-W436 PolarHBondContact O-N 3.5Å; W436-R438 PolarHBondContact O-N 3.05Å
437	R	44.8	Very low	48.2	Very low	245 Å²	245	122.7 Å²	122.7	93%	0.925	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-72.2	-2.7	178.6	-70.2	-168.6	177.5	-163.3	0.2	115.1	A435	A435-R437 PolarHBondContact O-N 3.09Å
438	R	42.2	Very low	50	Low	161 Å²	161	118.7 Å²	118.7	61%	0.608	60%	0.598	S	S	*	*	G	3₁₀ helix	trans	-113	7	-163.8	-139.4	174.2	-64.6	160.7	4.8	116.4	A435 W436 R440	A435-R438 PolarHBondContact O-N 2.92Å; A435-R438 VanDerWaalsContact O-N 3.08Å; W436-R438 PolarHBondContact O-N 3.05Å; R438-R440 PolarHBondContact O-N 2.8Å; R438-R440 VanDerWaalsContact O-N 3.16Å
439	G	42.1	Very low	51.8	Low	85 Å²	85	113.4 Å²	113.4	88%	0.876	58%	0.576	S	S	*	*			trans	60.7	26.4	170.6	0	0	0	0	0	115.2
440	R	44.1	Very low	53.6	Low	173 Å²	173	107.3 Å²	107.3	65%	0.653	56%	0.556	S	S	*	*			trans	-107	125.3	176.8	-63.6	178.9	-172.7	-174.4	-1.9	108.9	R438 H442	R438-R440 PolarHBondContact O-N 2.8Å; R438-R440 VanDerWaalsContact O-N 3.16Å; R440-H442 PolarHBondContact O-N 3.37Å; R440-H442 VanDerWaalsContact O-N 3.08Å
441	V	44.5	Very low	55.7	Low	133 Å²	133	109.2 Å²	109.2	81%	0.806	56%	0.56	S	S	*	*			trans	-58.3	112.6	165	-177.6	0	0	0	0	107.4	I443	V441-I443 HydrophobicContact CG1-CG1 3.99Å
442	H	43.7	Very low	57.9	Low	118 Å²	118	105.3 Å²	105.3	55%	0.546	53%	0.533	S	S	.	.			trans	-79.7	124.1	161.8	-88.1	55.6	0	0	0	107.1	R440	R440-H442 PolarHBondContact O-N 3.37Å; R440-H442 VanDerWaalsContact O-N 3.08Å
443	I	56.5	Low	60.1	Low	103 Å²	103	100 Å²	100	53%	0.528	51%	0.508	S	S	.	.			trans	-104.3	111.3	167.6	-58.5	176.6	0	0	0	104.4	V441 L445 L448	V441-I443 HydrophobicContact CG1-CG1 3.99Å; I443-L445 PolarHBondContact O-N 2.82Å; I443-L448 HydrophobicContact CG2-CD1 3.92Å
444	D	60.7	Low	62.1	Low	89 Å²	89	101.8 Å²	101.8	48%	0.476	51%	0.506	S	S	.	.			trans	-68.2	106.3	175.9	-91.9	-50.4	0	0	0	109.7	M446 E447 L448	D444-M446 PolarHBondContact O-N 3.5Å; D444-E447 HydrophobicContact CB-CB 4.45Å; D444-E447 HydrophobicContact CB-CG 4.48Å; D444-E447 PolarHBondContact O-N 3.07Å; D444-L448 PolarHBondContact O-N 3.04Å
445	L	62.9	Low	64.6	Low	63 Å²	63	106 Å²	106	33%	0.33	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-16.4	-176.5	-68.5	165.5	0	0	0	112.9	L363 Y366 I443	L363-L445 WeakPolarHBondContact CD2-O 3.45Å; Y366-L445 HydrophobicContact CD1-CD1 3.94Å; Y366-L445 HydrophobicContact CD2-CD1 3.8Å; Y366-L445 HydrophobicContact CD2-CD2 3.97Å; Y366-L445 HydrophobicContact CD2-CG 4.43Å; Y366-L445 HydrophobicContact CE1-CD1 4.01Å; Y366-L445 HydrophobicContact CE2-CD1 3.86Å; Y366-L445 HydrophobicContact CE2-CD2 3.99Å; Y366-L445 HydrophobicContact CG-CD1 3.85Å; I443-L445 PolarHBondContact O-N 2.82Å
446	M	61.2	Low	66.7	Low	128 Å²	128	105.1 Å²	105.1	63%	0.631	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-24.9	171.9	-66	-65	177.9	0	0	113.2	I370 D444	I370-M446 HydrophobicContact CD1-CE 3.79Å; D444-M446 PolarHBondContact O-N 3.5Å
447	E	74.2	Confident	69.1	Low	102 Å²	102	95.6 Å²	95.6	48%	0.477	47%	0.472	S	S	.	.	S	Bend	trans	-97.4	2.1	177.4	-69.6	-159.6	146	0	0	113.1	D444 D449 A450 Y451	D444-E447 HydrophobicContact CB-CB 4.45Å; D444-E447 HydrophobicContact CB-CG 4.48Å; D444-E447 PolarHBondContact O-N 3.07Å; E447-D449 VanDerWaalsContact C-N 3.27Å; E447-D449 PolarHBondContact O-N 3.29Å; E447-A450 WeakPolarHBondContact O-CA 3.43Å; E447-A450 VanDerWaalsContact O-CB 3.3Å; E447-A450 WeakPolarHBondContact O-CB 3.36Å; E447-A450 PolarHBondContact O-N 3.04Å; E447-Y451 HydrophobicContact CB-CD2 4.04Å; E447-Y451 HydrophobicContact CB-CE2 3.59Å; E447-Y451 VanDerWaalsContact O-CD2 3.28Å; E447-Y451 WeakPolarHBondContact O-CD2 3.16Å; E447-Y451 PolarHBondContact O-N 3.01Å; E447-Y451 PolarHBondContact OE2-OH 2.93Å; E447-Y451 VanDerWaalsContact OE2-OH 3.11Å
448	L	77.4	Confident	71.5	Confident	30 Å²	30	87.8 Å²	87.8	16%	0.157	45%	0.451	C	S	.	.	H	α-helix	trans	-54.7	-42	-175.8	-159.1	75.3	0	0	0	112.4	E359 L363 I443 D444 A450 Y451 S452	E359-L448 HydrophobicContact CG-CD2 3.9Å; E359-L448 HydrophobicContact CG-CG 4.36Å; L363-L448 HydrophobicContact CD2-CB 3.99Å; L363-L448 HydrophobicContact CD2-CD2 4.28Å; L363-L448 HydrophobicContact CG-CB 4.48Å; L363-L448 HydrophobicContact CG-CD2 4.08Å; I443-L448 HydrophobicContact CG2-CD1 3.92Å; D444-L448 PolarHBondContact O-N 3.04Å; L448-A450 PolarHBondContact O-N 3.47Å; L448-A450 VanDerWaalsContact O-N 3.13Å; L448-Y451 PolarHBondContact O-N 2.87Å; L448-Y451 VanDerWaalsContact O-N 3.14Å; L448-S452 WeakPolarHBondContact O-CB 3.23Å; L448-S452 PolarHBondContact O-N 3.13Å; L448-S452 PolarHBondContact O-OG 3.46Å
449	D	79.7	Confident	74	Confident	23 Å²	23	81.9 Å²	81.9	12%	0.123	44%	0.435	C	S	.	.	H	α-helix	trans	-54	-30.6	173.6	-109.8	-32.5	0	0	0	112.4	F274 R284 E447 R453	F274-D449 WeakPolarHBondContact CA-OD1 3.33Å; R284-D449 IonicContact CZ-OD1 3.61Å; R284-D449 IonicContact CZ-OD2 3.57Å; R284-D449 IonicContact NH1-OD1 2.73Å; R284-D449 PolarHBondContact NH1-OD1 3.48Å; R284-D449 IonicContact NH1-OD2 3.33Å; R284-D449 PolarHBondContact NH1-OD2 3.32Å; R284-D449 IonicContact NH2-OD1 3.59Å; R284-D449 IonicContact NH2-OD2 2.83Å; R284-D449 PolarHBondContact NH2-OD2 2.99Å; E447-D449 VanDerWaalsContact C-N 3.27Å; E447-D449 PolarHBondContact O-N 3.29Å; D449-R453 WeakPolarHBondContact O-CD 3.42Å; D449-R453 WeakPolarHBondContact O-CG 3.35Å; D449-R453 PolarHBondContact O-N 3.37Å; D449-R453 PolarHBondContact O-NE 2.98Å
450	A	83.8	Confident	76.5	Confident	48 Å²	48	78.3 Å²	78.3	40%	0.397	40%	0.395	S	S	.	.	H	α-helix	trans	-81.9	-42.8	177.4	0	0	0	0	0	112.5	E447 L448 S452 R453	E447-A450 WeakPolarHBondContact O-CA 3.43Å; E447-A450 VanDerWaalsContact O-CB 3.3Å; E447-A450 WeakPolarHBondContact O-CB 3.36Å; E447-A450 PolarHBondContact O-N 3.04Å; L448-A450 PolarHBondContact O-N 3.47Å; L448-A450 VanDerWaalsContact O-N 3.13Å; A450-S452 VanDerWaalsContact C-N 3.34Å; A450-R453 PolarHBondContact O-N 3.45Å
451	Y	86.4	Confident	79	Confident	129 Å²	129	75.2 Å²	75.2	51%	0.506	39%	0.391	S	S	.	.	H	α-helix	trans	-62	-42.2	173.6	-67.7	-74.3	0	0	0	111.4	E447 L448 R453 V454 F455	E447-Y451 HydrophobicContact CB-CD2 4.04Å; E447-Y451 HydrophobicContact CB-CE2 3.59Å; E447-Y451 VanDerWaalsContact O-CD2 3.28Å; E447-Y451 WeakPolarHBondContact O-CD2 3.16Å; E447-Y451 PolarHBondContact O-N 3.01Å; E447-Y451 PolarHBondContact OE2-OH 2.93Å; E447-Y451 VanDerWaalsContact OE2-OH 3.11Å; L448-Y451 PolarHBondContact O-N 2.87Å; L448-Y451 VanDerWaalsContact O-N 3.14Å; Y451-R453 PolarHBondContact O-N 3.49Å; Y451-V454 PolarHBondContact O-N 3.45Å; Y451-V454 VanDerWaalsContact O-N 3.17Å; Y451-F455 WeakPolarHBondContact O-CB 3.38Å; Y451-F455 PolarHBondContact O-N 3.41Å
452	S	88.6	Confident	81.4	Confident	7 Å²	7	74.3 Å²	74.3	5%	0.049	38%	0.381	C	S	.	.	H	α-helix	trans	-59.5	-41.7	178.2	-65.1	0	0	0	0	113	E359 L448 A450 V454 F455 F456	E359-S452 WeakPolarHBondContact CG-OG 3.07Å; E359-S452 VanDerWaalsContact OE1-CB 3.31Å; E359-S452 WeakPolarHBondContact OE1-CB 3.43Å; E359-S452 PolarHBondContact OE1-OG 2.77Å; L448-S452 WeakPolarHBondContact O-CB 3.23Å; L448-S452 PolarHBondContact O-N 3.13Å; L448-S452 PolarHBondContact O-OG 3.46Å; A450-S452 VanDerWaalsContact C-N 3.34Å; S452-V454 PolarHBondContact O-N 3.07Å; S452-F455 PolarHBondContact O-N 3.08Å; S452-F456 WeakPolarHBondContact O-CD2 3.44Å; S452-F456 PolarHBondContact O-N 3.08Å; S452-F456 VanDerWaalsContact O-N 3.11Å
453	R	89.8	Confident	83.9	Confident	86 Å²	86	70.4 Å²	70.4	33%	0.325	36%	0.362	S	S	.	.	H	α-helix	trans	-59.5	-27.4	176.8	-74.4	167	-161.1	164.7	9.6	113.8	F274 W275 D449 A450 Y451 P457	F274-R453 HydrophobicContact CB-CG 3.82Å; F274-R453 VanDerWaalsContact O-CZ 3.22Å; F274-R453 PolarHBondContact O-NE 3.4Å; F274-R453 PolarHBondContact O-NH2 3.45Å; W275-R453 HydrophobicContact CZ2-CG 4.34Å; D449-R453 WeakPolarHBondContact O-CD 3.42Å; D449-R453 WeakPolarHBondContact O-CG 3.35Å; D449-R453 PolarHBondContact O-N 3.37Å; D449-R453 PolarHBondContact O-NE 2.98Å; A450-R453 PolarHBondContact O-N 3.45Å; Y451-R453 PolarHBondContact O-N 3.49Å; R453-P457 VanDerWaalsContact O-CD 3.29Å; R453-P457 WeakPolarHBondContact O-CD 3.35Å; R453-P457 WeakPolarHBondContact O-CG 3.3Å
454	V	90.9	Very high	85.8	Confident	97 Å²	97	66.4 Å²	66.4	59%	0.588	34%	0.342	S	S	*	.	H	α-helix	trans	-95.8	-44.8	178.2	-177.2	0	0	0	0	111	Y451 S452 T458	Y451-V454 PolarHBondContact O-N 3.45Å; Y451-V454 VanDerWaalsContact O-N 3.17Å; S452-V454 PolarHBondContact O-N 3.07Å; V454-T458 HydrophobicContact CG1-CG2 4.38Å; V454-T458 WeakPolarHBondContact O-CB 3.48Å; V454-T458 VanDerWaalsContact O-CG2 3.3Å; V454-T458 WeakPolarHBondContact O-CG2 3.35Å; V454-T458 PolarHBondContact O-N 3.4Å; V454-T458 PolarHBondContact O-OG1 2.94Å
455	F	92.3	Very high	87.4	Confident	133 Å²	133	66.8 Å²	66.8	58%	0.583	34%	0.343	S	S	*	.	H	α-helix	trans	-67.7	-45.7	-173.3	-179.1	-102	0	0	0	113.2	Y451 S452 T458 S459	Y451-F455 WeakPolarHBondContact O-CB 3.38Å; Y451-F455 PolarHBondContact O-N 3.41Å; S452-F455 PolarHBondContact O-N 3.08Å; F455-T458 PolarHBondContact O-OG1 2.76Å; F455-S459 WeakPolarHBondContact O-CB 3.37Å; F455-S459 PolarHBondContact O-N 3.11Å
456	F	92.2	Very high	89	Confident	15 Å²	15	68.4 Å²	68.4	7%	0.066	36%	0.355	C	S	.	.	H	α-helix	trans	-65.1	-48.5	-176.1	-80.7	-108.1	0	0	0	112.5	F274 F352 A355 A356 S452 F460	F274-F456 HydrophobicContact CE1-CE2 4.49Å; F274-F456 HydrophobicContact CE2-CB 3.97Å; F274-F456 HydrophobicContact CE2-CD1 4.25Å; F274-F456 AromaticContact CE2-CD2 3.91Å; F274-F456 HydrophobicContact CE2-CD2 3.91Å; F274-F456 HydrophobicContact CE2-CE2 4.43Å; F274-F456 AromaticContact CE2-CG 3.8Å; F274-F456 HydrophobicContact CE2-CG 3.8Å; F274-F456 HydrophobicContact CZ-CD1 4.01Å; F274-F456 AromaticContact CZ-CD2 3.72Å; F274-F456 HydrophobicContact CZ-CD2 3.72Å; F274-F456 HydrophobicContact CZ-CE1 4.07Å; F274-F456 AromaticContact CZ-CE2 3.78Å; F274-F456 HydrophobicContact CZ-CE2 3.78Å; F274-F456 AromaticContact CZ-CG 3.84Å; F274-F456 HydrophobicContact CZ-CG 3.84Å; F274-F456 AromaticContact CZ-CZ 3.95Å; F274-F456 HydrophobicContact CZ-CZ 3.95Å; F352-F456 HydrophobicContact CD1-CD1 4.07Å; A355-F456 HydrophobicContact CB-CE1 3.7Å; A355-F456 HydrophobicContact CB-CZ 3.88Å; A356-F456 HydrophobicContact CB-CE1 4.06Å; S452-F456 WeakPolarHBondContact O-CD2 3.44Å; S452-F456 PolarHBondContact O-N 3.08Å; S452-F456 VanDerWaalsContact O-N 3.11Å; F456-F460 WeakPolarHBondContact O-CB 3.21Å; F456-F460 PolarHBondContact O-N 3.14Å
457	P	94	Very high	90.6	Very high	40 Å²	40	62.6 Å²	62.6	26%	0.26	33%	0.326	S	S	.	.	H	α-helix	trans	-67.3	-39.1	178.3	-22.6	35.3	0	0	0	113.7	W271 R453 L461	W271-P457 HydrophobicContact CD2-CG 4.06Å; W271-P457 HydrophobicContact CE3-CB 4.19Å; W271-P457 HydrophobicContact CE3-CG 3.78Å; W271-P457 HydrophobicContact CH2-CB 3.94Å; W271-P457 HydrophobicContact CH2-CG 4.31Å; W271-P457 HydrophobicContact CZ2-CB 4.46Å; W271-P457 HydrophobicContact CZ3-CB 3.78Å; W271-P457 HydrophobicContact CZ3-CG 3.91Å; R453-P457 VanDerWaalsContact O-CD 3.29Å; R453-P457 WeakPolarHBondContact O-CD 3.35Å; R453-P457 WeakPolarHBondContact O-CG 3.3Å; P457-L461 VanDerWaalsContact O-CB 3.29Å; P457-L461 WeakPolarHBondContact O-CB 3.32Å; P457-L461 PolarHBondContact O-N 3.46Å
458	T	94.1	Very high	91.6	Very high	80 Å²	80	61 Å²	61	49%	0.491	32%	0.316	S	S	.	.	H	α-helix	trans	-69	-41.4	180	53.3	0	0	0	0	112	V454 F455 L461 L462	V454-T458 HydrophobicContact CG1-CG2 4.38Å; V454-T458 WeakPolarHBondContact O-CB 3.48Å; V454-T458 VanDerWaalsContact O-CG2 3.3Å; V454-T458 WeakPolarHBondContact O-CG2 3.35Å; V454-T458 PolarHBondContact O-N 3.4Å; V454-T458 PolarHBondContact O-OG1 2.94Å; F455-T458 PolarHBondContact O-OG1 2.76Å; T458-L461 PolarHBondContact O-N 2.92Å; T458-L462 WeakPolarHBondContact O-CB 3.15Å; T458-L462 PolarHBondContact O-N 3.42Å
459	S	95.2	Very high	92.4	Very high	37 Å²	37	63 Å²	63	26%	0.259	33%	0.329	S	S	.	.	H	α-helix	trans	-65.1	-41.4	175.2	-174	0	0	0	0	112.2	F455 L462 F463	F455-S459 WeakPolarHBondContact O-CB 3.37Å; F455-S459 PolarHBondContact O-N 3.11Å; S459-L462 PolarHBondContact O-N 2.9Å; S459-F463 WeakPolarHBondContact O-CB 3.41Å; S459-F463 PolarHBondContact O-N 2.98Å
460	F	95.1	Very high	93	Very high	10 Å²	10	63.2 Å²	63.2	4%	0.044	34%	0.337	C	S	.	.	H	α-helix	trans	-69.5	-35.4	176.1	-171	-110.7	0	0	0	113	I264 V267 W271 F352 F456 F463 N464	I264-F460 HydrophobicContact CG1-CE1 4.28Å; I264-F460 HydrophobicContact CG1-CZ 4.1Å; I264-F460 HydrophobicContact CG2-CE1 4.35Å; V267-F460 HydrophobicContact CB-CE1 4.49Å; V267-F460 HydrophobicContact CB-CE2 4.37Å; V267-F460 HydrophobicContact CB-CZ 4.19Å; V267-F460 HydrophobicContact CG1-CD1 4.12Å; V267-F460 HydrophobicContact CG1-CD2 3.96Å; V267-F460 HydrophobicContact CG1-CE1 4.13Å; V267-F460 HydrophobicContact CG1-CE2 3.98Å; V267-F460 HydrophobicContact CG1-CG 4.02Å; V267-F460 HydrophobicContact CG1-CZ 4.06Å; V267-F460 HydrophobicContact CG2-CE2 4.17Å; V267-F460 HydrophobicContact CG2-CZ 4.3Å; W271-F460 HydrophobicContact CH2-CB 4.16Å; W271-F460 AromaticContact CH2-CD1 3.85Å; W271-F460 HydrophobicContact CH2-CD1 3.85Å; W271-F460 HydrophobicContact CH2-CG 4.34Å; W271-F460 HydrophobicContact CZ2-CB 3.72Å; W271-F460 AromaticContact CZ2-CD1 3.87Å; W271-F460 HydrophobicContact CZ2-CD1 3.87Å; W271-F460 AromaticContact CZ2-CG 3.97Å; W271-F460 HydrophobicContact CZ2-CG 3.97Å; F352-F460 AromaticContact CD2-CD2 3.74Å; F352-F460 HydrophobicContact CD2-CD2 3.74Å; F352-F460 HydrophobicContact CD2-CE2 4.4Å; F352-F460 HydrophobicContact CE1-CB 4.18Å; F352-F460 HydrophobicContact CE2-CB 4.43Å; F352-F460 AromaticContact CE2-CD2 3.79Å; F352-F460 HydrophobicContact CE2-CD2 3.79Å; F352-F460 HydrophobicContact CG-CD2 4.26Å; F352-F460 HydrophobicContact CZ-CB 4.11Å; F352-F460 HydrophobicContact CZ-CD2 4.32Å; F456-F460 WeakPolarHBondContact O-CB 3.21Å; F456-F460 PolarHBondContact O-N 3.14Å; F460-F463 HydrophobicContact CD2-CD1 4.22Å; F460-F463 HydrophobicContact CE2-CD1 4.18Å; F460-F463 PolarHBondContact O-N 3.09Å; F460-N464 WeakPolarHBondContact CD1-ND2 3.33Å; F460-N464 VanDerWaalsContact CE1-ND2 3.26Å; F460-N464 WeakPolarHBondContact CE1-ND2 3.46Å; F460-N464 VanDerWaalsContact CZ-ND2 3.33Å; F460-N464 WeakPolarHBondContact CZ-ND2 3.39Å; F460-N464 PolarHBondContact O-N 3.46Å; F460-N464 PolarHBondContact O-ND2 3.44Å
461	L	95.3	Very high	93.4	Very high	109 Å²	109	63.7 Å²	63.7	57%	0.571	33%	0.329	S	S	*	.	H	α-helix	trans	-64.1	-45.9	172.9	-176.8	67.8	0	0	0	111.2	P457 T458 F463 N464 I465	P457-L461 VanDerWaalsContact O-CB 3.29Å; P457-L461 WeakPolarHBondContact O-CB 3.32Å; P457-L461 PolarHBondContact O-N 3.46Å; T458-L461 PolarHBondContact O-N 2.92Å; L461-F463 PolarHBondContact O-N 3.14Å; L461-N464 PolarHBondContact O-N 3.09Å; L461-I465 HydrophobicContact CG-CD1 4.13Å; L461-I465 WeakPolarHBondContact O-CG1 3.49Å; L461-I465 PolarHBondContact O-N 3.23Å
462	L	96.3	Very high	93.5	Very high	113 Å²	113	62 Å²	62	59%	0.592	33%	0.328	S	S	*	.	H	α-helix	trans	-58.4	-47.4	174.8	-173.3	80.1	0	0	0	111.2	T458 S459 N464 I465 V466	T458-L462 WeakPolarHBondContact O-CB 3.15Å; T458-L462 PolarHBondContact O-N 3.42Å; S459-L462 PolarHBondContact O-N 2.9Å; L462-N464 VanDerWaalsContact C-N 3.34Å; L462-N464 PolarHBondContact O-N 3.41Å; L462-I465 PolarHBondContact O-N 3.33Å; L462-V466 WeakPolarHBondContact O-CG2 3.34Å; L462-V466 PolarHBondContact O-N 3.4Å
463	F	96	Very high	93.5	Very high	37 Å²	37	70.6 Å²	70.6	16%	0.162	36%	0.361	C	S	.	.	H	α-helix	trans	-56.6	-46.8	175.6	168	-108.6	0	0	0	111.8	L344 F345 V348 S459 F460 L461 I465 V466 Y467	L344-F463 HydrophobicContact CD2-CE2 4.11Å; L344-F463 HydrophobicContact CD2-CZ 4.22Å; F345-F463 AromaticContact CD2-CE1 3.71Å; F345-F463 HydrophobicContact CD2-CE1 3.71Å; F345-F463 AromaticContact CD2-CZ 3.96Å; F345-F463 HydrophobicContact CD2-CZ 3.96Å; F345-F463 AromaticContact CE2-CE1 3.81Å; F345-F463 HydrophobicContact CE2-CE1 3.81Å; F345-F463 HydrophobicContact CE2-CZ 4.49Å; V348-F463 HydrophobicContact CB-CE1 3.99Å; V348-F463 HydrophobicContact CB-CE2 4.03Å; V348-F463 HydrophobicContact CB-CZ 3.69Å; V348-F463 HydrophobicContact CG1-CD1 3.73Å; V348-F463 HydrophobicContact CG1-CD2 3.9Å; V348-F463 HydrophobicContact CG1-CE1 3.62Å; V348-F463 HydrophobicContact CG1-CE2 3.8Å; V348-F463 HydrophobicContact CG1-CG 3.87Å; V348-F463 HydrophobicContact CG1-CZ 3.67Å; V348-F463 HydrophobicContact CG2-CE2 3.86Å; V348-F463 HydrophobicContact CG2-CZ 3.95Å; S459-F463 WeakPolarHBondContact O-CB 3.41Å; S459-F463 PolarHBondContact O-N 2.98Å; F460-F463 HydrophobicContact CD2-CD1 4.22Å; F460-F463 HydrophobicContact CE2-CD1 4.18Å; F460-F463 PolarHBondContact O-N 3.09Å; L461-F463 PolarHBondContact O-N 3.14Å; F463-I465 PolarHBondContact O-N 3.23Å; F463-V466 PolarHBondContact O-N 2.96Å; F463-Y467 HydrophobicContact CE2-CD2 4.21Å; F463-Y467 AromaticContact CZ-CD2 3.88Å; F463-Y467 HydrophobicContact CZ-CD2 3.88Å; F463-Y467 HydrophobicContact CZ-CG 4.21Å; F463-Y467 WeakPolarHBondContact O-CB 3.24Å; F463-Y467 PolarHBondContact O-N 2.94Å
464	N	95.4	Very high	93.3	Very high	19 Å²	19	74.9 Å²	74.9	10%	0.102	39%	0.389	C	S	.	.	H	α-helix	trans	-61.9	-44.7	177.7	-85.6	-93.9	0	0	0	111.6	F460 L461 L462 V466 Y467 W468	F460-N464 WeakPolarHBondContact CD1-ND2 3.33Å; F460-N464 VanDerWaalsContact CE1-ND2 3.26Å; F460-N464 WeakPolarHBondContact CE1-ND2 3.46Å; F460-N464 VanDerWaalsContact CZ-ND2 3.33Å; F460-N464 WeakPolarHBondContact CZ-ND2 3.39Å; F460-N464 PolarHBondContact O-N 3.46Å; F460-N464 PolarHBondContact O-ND2 3.44Å; L461-N464 PolarHBondContact O-N 3.09Å; L462-N464 VanDerWaalsContact C-N 3.34Å; L462-N464 PolarHBondContact O-N 3.41Å; N464-V466 PolarHBondContact O-N 3.41Å; N464-Y467 PolarHBondContact O-N 3.37Å; N464-W468 WeakPolarHBondContact O-CB 3.36Å; N464-W468 PolarHBondContact O-N 3.22Å; N464-W468 PolarHBondContact OD1-NE1 3.37Å
465	I	95.4	Very high	93.4	Very high	96 Å²	96	73.8 Å²	73.8	49%	0.492	38%	0.379	S	S	.	.	H	α-helix	trans	-58.8	-48	177.7	-68.1	165	0	0	0	110.7	L461 L462 F463 Y467 V469	L461-I465 HydrophobicContact CG-CD1 4.13Å; L461-I465 WeakPolarHBondContact O-CG1 3.49Å; L461-I465 PolarHBondContact O-N 3.23Å; L462-I465 PolarHBondContact O-N 3.33Å; F463-I465 PolarHBondContact O-N 3.23Å; I465-Y467 PolarHBondContact O-N 2.96Å; I465-V469 VanDerWaalsContact O-CB 3.3Å; I465-V469 WeakPolarHBondContact O-CB 3.35Å; I465-V469 VanDerWaalsContact O-CG2 3.24Å; I465-V469 WeakPolarHBondContact O-CG2 3.34Å; I465-V469 PolarHBondContact O-N 3.32Å
466	V	96.1	Very high	93.4	Very high	97 Å²	97	70.6 Å²	70.6	59%	0.588	37%	0.368	S	S	*	.	H	α-helix	trans	-63.6	-41.8	178.1	173.9	0	0	0	0	111.5	L462 F463 N464 G470	L462-V466 WeakPolarHBondContact O-CG2 3.34Å; L462-V466 PolarHBondContact O-N 3.4Å; F463-V466 PolarHBondContact O-N 2.96Å; N464-V466 PolarHBondContact O-N 3.41Å; V466-G470 WeakPolarHBondContact O-CA 3.38Å; V466-G470 PolarHBondContact O-N 2.99Å
467	Y	94.6	Very high	93.5	Very high	6 Å²	6	73.7 Å²	73.7	2%	0.024	39%	0.385	C	S	.	.	H	α-helix	trans	-66.1	-52.9	-179.6	-178.1	-90	0	0	0	112.6	M179 Y260 A341 L344 F345 F463 N464 I465 G470 Y471	M179-Y467 HydrophobicContact CE-CE1 3.8Å; Y260-Y467 AromaticContact CE1-CE1 3.81Å; Y260-Y467 HydrophobicContact CE1-CE1 3.81Å; Y260-Y467 PolarHBondContact OH-OH 2.86Å; A341-Y467 VanDerWaalsContact C-OH 3.24Å; A341-Y467 WeakPolarHBondContact O-CE2 3.43Å; A341-Y467 PolarHBondContact O-OH 2.96Å; L344-Y467 HydrophobicContact CD2-CD2 3.99Å; L344-Y467 HydrophobicContact CD2-CE2 4Å; F345-Y467 HydrophobicContact CB-CE1 4.44Å; F345-Y467 HydrophobicContact CB-CE2 3.84Å; F345-Y467 AromaticContact CD2-CD1 3.76Å; F345-Y467 HydrophobicContact CD2-CD1 3.76Å; F345-Y467 HydrophobicContact CD2-CD2 4.1Å; F345-Y467 AromaticContact CD2-CE1 3.65Å; F345-Y467 HydrophobicContact CD2-CE1 3.65Å; F345-Y467 AromaticContact CD2-CE2 4Å; F345-Y467 HydrophobicContact CD2-CE2 4Å; F345-Y467 AromaticContact CD2-CG 4Å; F345-Y467 HydrophobicContact CD2-CG 4Å; F345-Y467 AromaticContact CD2-CZ 3.79Å; F345-Y467 HydrophobicContact CE2-CD1 4.19Å; F345-Y467 HydrophobicContact CE2-CE1 4.34Å; F345-Y467 HydrophobicContact CG-CE1 4.36Å; F345-Y467 HydrophobicContact CG-CE2 4.42Å; F463-Y467 HydrophobicContact CE2-CD2 4.21Å; F463-Y467 AromaticContact CZ-CD2 3.88Å; F463-Y467 HydrophobicContact CZ-CD2 3.88Å; F463-Y467 HydrophobicContact CZ-CG 4.21Å; F463-Y467 WeakPolarHBondContact O-CB 3.24Å; F463-Y467 PolarHBondContact O-N 2.94Å; N464-Y467 PolarHBondContact O-N 3.37Å; I465-Y467 PolarHBondContact O-N 2.96Å; Y467-G470 PolarHBondContact O-N 3Å; Y467-Y471 HydrophobicContact CD1-CD2 4.49Å; Y467-Y471 AromaticContact CD2-CD2 3.68Å; Y467-Y471 HydrophobicContact CD2-CD2 3.68Å; Y467-Y471 AromaticContact CD2-CE2 3.69Å; Y467-Y471 HydrophobicContact CD2-CE2 3.69Å; Y467-Y471 HydrophobicContact CE1-CD2 4.37Å; Y467-Y471 AromaticContact CE2-CD2 3.54Å; Y467-Y471 HydrophobicContact CE2-CD2 3.54Å; Y467-Y471 AromaticContact CE2-CE2 3.46Å; Y467-Y471 HydrophobicContact CE2-CE2 3.46Å; Y467-Y471 VanDerWaalsContact CE2-CE2 3.46Å; Y467-Y471 HydrophobicContact CG-CD2 4.16Å; Y467-Y471 AromaticContact CZ-CD2 3.89Å; Y467-Y471 WeakPolarHBondContact O-CD2 3.37Å; Y467-Y471 PolarHBondContact O-N 3.36Å; Y467-Y471 VanDerWaalsContact O-N 3.08Å
468	W	94.4	Very high	93.5	Very high	68 Å²	68	75.7 Å²	75.7	26%	0.258	39%	0.393	S	S	.	.	H	α-helix	trans	-70.3	-33.8	-177.3	-65.2	113.6	0	0	0	112.3	M179 M252 Y260 F345 N464 L472	M179-W468 HydrophobicContact CE-CE3 3.97Å; M179-W468 HydrophobicContact CE-CH2 4.21Å; M179-W468 HydrophobicContact CE-CZ3 3.44Å; M179-W468 VanDerWaalsContact CE-CZ3 3.44Å; M179-W468 HydrophobicContact SD-CZ3 4.42Å; M252-W468 HydrophobicContact CE-CH2 3.44Å; M252-W468 VanDerWaalsContact CE-CH2 3.44Å; M252-W468 HydrophobicContact CE-CZ3 3.42Å; M252-W468 VanDerWaalsContact CE-CZ3 3.42Å; M252-W468 HydrophobicContact SD-CZ3 4.23Å; Y260-W468 AromaticContact CD1-CH2 3.55Å; Y260-W468 HydrophobicContact CD1-CH2 3.55Å; Y260-W468 AromaticContact CD1-CZ2 3.67Å; Y260-W468 HydrophobicContact CD1-CZ2 3.67Å; Y260-W468 HydrophobicContact CD2-CH2 4.39Å; Y260-W468 AromaticContact CE1-CH2 3.72Å; Y260-W468 HydrophobicContact CE1-CH2 3.72Å; Y260-W468 HydrophobicContact CE1-CZ2 4.1Å; Y260-W468 AromaticContact CG-CH2 3.92Å; Y260-W468 HydrophobicContact CG-CH2 3.92Å; Y260-W468 HydrophobicContact CG-CZ2 4.25Å; F345-W468 HydrophobicContact CE2-CZ2 4.38Å; N464-W468 WeakPolarHBondContact O-CB 3.36Å; N464-W468 PolarHBondContact O-N 3.22Å; N464-W468 PolarHBondContact OD1-NE1 3.37Å; W468-L472 HydrophobicContact CE3-CD1 3.72Å; W468-L472 HydrophobicContact CZ3-CD1 4.39Å; W468-L472 VanDerWaalsContact O-CD1 3.22Å; W468-L472 WeakPolarHBondContact O-CD1 3.38Å; W468-L472 PolarHBondContact O-N 3.31Å
469	V	94.7	Very high	93.4	Very high	73 Å²	73	75.4 Å²	75.4	44%	0.442	39%	0.386	S	S	.	.	H	α-helix	trans	-70.1	-44.9	172	175.2	0	0	0	0	110.6	I465 Y471 Y473	I465-V469 VanDerWaalsContact O-CB 3.3Å; I465-V469 WeakPolarHBondContact O-CB 3.35Å; I465-V469 VanDerWaalsContact O-CG2 3.24Å; I465-V469 WeakPolarHBondContact O-CG2 3.34Å; I465-V469 PolarHBondContact O-N 3.32Å; V469-Y471 VanDerWaalsContact C-N 3.33Å; V469-Y471 PolarHBondContact O-N 3.11Å; V469-Y473 PolarHBondContact O-N 3.14Å; V469-Y473 VanDerWaalsContact O-N 3.12Å
470	G	93.1	Very high	93.3	Very high	27 Å²	27	78 Å²	78	28%	0.278	40%	0.395	S	S	.	.	H	α-helix	trans	-75.5	-8.1	-174.6	0	0	0	0	0	116.9	V466 Y467	V466-G470 WeakPolarHBondContact O-CA 3.38Å; V466-G470 PolarHBondContact O-N 2.99Å; Y467-G470 PolarHBondContact O-N 3Å
471	Y	90.8	Very high	93.2	Very high	58 Å²	58	82.9 Å²	82.9	23%	0.227	42%	0.42	C	S	.	.	H	α-helix	trans	-120.7	-4.3	175.5	-76.4	-66	0	0	0	114.9	N176 A341 Y467 V469	N176-Y471 HydrophobicContact CB-CD1 4.44Å; A341-Y471 HydrophobicContact CB-CD1 3.79Å; A341-Y471 HydrophobicContact CB-CD2 4.14Å; A341-Y471 HydrophobicContact CB-CE1 3.51Å; A341-Y471 HydrophobicContact CB-CE2 3.89Å; A341-Y471 HydrophobicContact CB-CG 4.1Å; Y467-Y471 HydrophobicContact CD1-CD2 4.49Å; Y467-Y471 AromaticContact CD2-CD2 3.68Å; Y467-Y471 HydrophobicContact CD2-CD2 3.68Å; Y467-Y471 AromaticContact CD2-CE2 3.69Å; Y467-Y471 HydrophobicContact CD2-CE2 3.69Å; Y467-Y471 HydrophobicContact CE1-CD2 4.37Å; Y467-Y471 AromaticContact CE2-CD2 3.54Å; Y467-Y471 HydrophobicContact CE2-CD2 3.54Å; Y467-Y471 AromaticContact CE2-CE2 3.46Å; Y467-Y471 HydrophobicContact CE2-CE2 3.46Å; Y467-Y471 VanDerWaalsContact CE2-CE2 3.46Å; Y467-Y471 HydrophobicContact CG-CD2 4.16Å; Y467-Y471 AromaticContact CZ-CD2 3.89Å; Y467-Y471 WeakPolarHBondContact O-CD2 3.37Å; Y467-Y471 PolarHBondContact O-N 3.36Å; Y467-Y471 VanDerWaalsContact O-N 3.08Å; V469-Y471 VanDerWaalsContact C-N 3.33Å; V469-Y471 PolarHBondContact O-N 3.11Å
472	L	89.6	Confident	93	Very high	94 Å²	94	80.8 Å²	80.8	49%	0.492	41%	0.409	S	S	.	.	H	α-helix	trans	-113.3	-20	171.5	-77.1	96.2	0	0	0	114.6	M179 W468	M179-L472 HydrophobicContact CE-CD1 4.36Å; M179-L472 HydrophobicContact SD-CD1 3.4Å; M179-L472 WeakPolarHBondContact SD-CD1 3.15Å; M179-L472 HydrophobicContact SD-CG 3.96Å; W468-L472 HydrophobicContact CE3-CD1 3.72Å; W468-L472 HydrophobicContact CZ3-CD1 4.39Å; W468-L472 VanDerWaalsContact O-CD1 3.22Å; W468-L472 WeakPolarHBondContact O-CD1 3.38Å; W468-L472 PolarHBondContact O-N 3.31Å
473	Y	89.1	Confident	92.8	Very high	188 Å²	188	78.2 Å²	78.2	74%	0.737	39%	0.393	S	S	*	.			trans	-129.1	1.7	-171.9	-59.7	-87.1	0	0	0	114.3	V469	V469-Y473 PolarHBondContact O-N 3.14Å; V469-Y473 VanDerWaalsContact O-N 3.12Å
474	L	84.1	Confident	92.5	Very high	175 Å²	175	81.9 Å²	81.9	92%	0.916	41%	0.414	S	S	*	.			trans	-135.1	0	178.3	-64.7	179.4	0	0	0	110.1

Retrieved 474 of 474 residues in 2827.3 ms (Link to these results)

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