A0A087YRQ8_POEFO Loading...

Leucine rich repeat containing 4C, genome duplicate a

AlphaFold DB , UniProt , Accession A0A087YRQ8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 644 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	33.3	Very low	30.4	Very low	235 Å²	235	162.5 Å²	162.5	100%	1.158	83%	0.827	S	S	*	*				0	125.1	0	-113.2	171.7	170.4	0	0	108
2	F	32.4	Very low	30.3	Very low	202 Å²	202	162.6 Å²	162.6	89%	0.886	82%	0.822	S	S	*	*			trans	71.9	102.9	169.3	-81.1	-82.5	0	0	0	122.4
3	N	28.4	Very low	30.2	Very low	150 Å²	150	162.1 Å²	162.1	80%	0.802	82%	0.818	S	S	*	*			trans	-48.3	147.8	153.3	-71.2	-31.8	0	0	0	115.7
4	K	32.5	Very low	30.7	Very low	177 Å²	177	163.3 Å²	163.3	77%	0.77	82%	0.822	S	S	*	*				170.1	118.2	104.1	-101	-177	171.4	176.4	0	110.4
5	M	31.9	Very low	30.8	Very low	161 Å²	161	168.9 Å²	168.9	79%	0.793	83%	0.83	S	S	*	*				66.7	129.9	107.9	-71.5	176.9	161.9	0	0	114.5
6	T	33.2	Very low	31.5	Very low	120 Å²	120	162.6 Å²	162.6	74%	0.736	82%	0.822	S	S	*	*			cis	-176.8	152.4	11.8	15.6	0	0	0	0	110
7	S	28.8	Very low	32	Very low	110 Å²	110	160.2 Å²	160.2	77%	0.769	82%	0.821	S	S	*	*			trans	67.8	121.3	141.3	-168.1	0	0	0	0	118.8
8	S	26.6	Very low	32.4	Very low	99 Å²	99	164.2 Å²	164.2	69%	0.692	82%	0.823	S	S	*	*				175.8	151.7	60.7	39.4	0	0	0	0	111.3
9	Q	29.2	Very low	33.2	Very low	196 Å²	196	168 Å²	168	92%	0.916	83%	0.827	S	S	*	*			trans	74.9	112.5	153.9	-75	-177.1	-13	0	0	122.1
10	Q	28.8	Very low	33.9	Very low	172 Å²	172	166.8 Å²	166.8	80%	0.804	82%	0.824	S	S	*	*			trans	-80.5	150.5	165.3	-109.3	169.5	-33.4	0	0	112.3
11	Q	29.3	Very low	34.7	Very low	165 Å²	165	169 Å²	169	77%	0.771	82%	0.824	S	S	*	*			trans	91	141.3	140.8	-77.9	176.8	-10.1	0	0	122.1
12	Q	28.7	Very low	35.4	Very low	164 Å²	164	161.2 Å²	161.2	77%	0.766	80%	0.796	S	S	*	*			trans	93.9	135	166.9	-61.8	179.6	-7.3	0	0	115.3
13	M	29.7	Very low	36.3	Very low	156 Å²	156	158.4 Å²	158.4	77%	0.768	79%	0.79	S	S	*	*			cis	-166.9	150.7	9.1	-124.5	-172.7	-111.5	0	0	109.4
14	M	36.4	Very low	37.5	Very low	179 Å²	179	155.8 Å²	155.8	88%	0.882	78%	0.783	S	S	*	*			trans	-66.2	135.9	164.5	-70.7	-127.6	-75.5	0	0	111.9
15	R	33.3	Very low	38.9	Very low	247 Å²	247	151.6 Å²	151.6	93%	0.932	77%	0.769	S	S	*	*			trans	179.6	122.3	143.5	-104.9	168.1	-176.3	-165.7	2.8	111.7
16	G	42	Very low	40.4	Very low	69 Å²	69	148.9 Å²	148.9	71%	0.711	76%	0.764	S	S	*	*			trans	-72.2	155.2	171.2	0	0	0	0	0	112.9
17	P	40.3	Very low	42	Very low	122 Å²	122	148.9 Å²	148.9	79%	0.792	76%	0.758	S	S	*	*			trans	-86.1	123.7	178	0.7	18.5	0	0	0	111.2	W19	P17-W19 PolarHBondContact O-N 3.39Å
18	R	39.2	Very low	44	Very low	231 Å²	231	148.6 Å²	148.6	87%	0.872	74%	0.744	S	S	*	*			trans	-60.9	115.3	166.8	-79.2	172.4	157.8	165.9	-7.1	110.5
19	W	46.1	Very low	46.2	Very low	237 Å²	237	147.3 Å²	147.3	90%	0.898	73%	0.731	S	S	*	*			trans	-71.3	148.8	154.3	-72	63	0	0	0	108.6	P17	P17-W19 PolarHBondContact O-N 3.39Å
20	N	48.8	Very low	48.3	Very low	144 Å²	144	143.2 Å²	143.2	77%	0.77	72%	0.715	S	S	*	*			trans	93.3	73	179.6	-57.3	-14.8	0	0	0	117.6
21	R	49.3	Very low	50.5	Low	214 Å²	214	139.4 Å²	139.4	81%	0.808	70%	0.7	S	S	*	*	S	Bend	trans	-143.1	7.1	150.8	-82.4	-161.8	177.6	176.2	-3.7	116
22	A	49.3	Very low	52.6	Low	71 Å²	71	135.4 Å²	135.4	59%	0.587	68%	0.683	S	S	*	*	S	Bend	trans	-91.1	-14.3	178.3	0	0	0	0	0	114.3	F28	A22-F28 WeakPolarHBondContact O-CD1 3.44Å
23	L	50.8	Low	54.5	Low	142 Å²	142	129.6 Å²	129.6	74%	0.743	66%	0.663	S	S	*	*	S	Bend	trans	-98.5	-1.5	-177.4	-77.5	161.3	0	0	0	114.5
24	S	53.1	Low	56.4	Low	96 Å²	96	126.7 Å²	126.7	67%	0.671	65%	0.65	S	S	*	*	S	Bend	trans	-98	0.8	-176.3	65.5	0	0	0	0	114.4	P26	S24-P26 WeakPolarHBondContact O-CD 3.4Å
25	N	62.4	Low	57.8	Low	89 Å²	89	124.2 Å²	124.2	48%	0.476	64%	0.637	S	S	.	*			trans	-96.1	109.6	-179.5	-164.1	-19.3	0	0	0	109.6	L27 F28 V29	N25-L27 PolarHBondContact O-N 2.98Å; N25-L27 VanDerWaalsContact O-N 3.16Å; N25-L27 PolarHBondContact OD1-N 3Å; N25-F28 HydrophobicContact CB-CB 4.04Å; N25-F28 WeakPolarHBondContact O-CB 3.47Å; N25-F28 PolarHBondContact O-N 3Å; N25-V29 PolarHBondContact O-N 3.47Å; N25-V29 VanDerWaalsContact O-N 3.16Å
26	P	64.2	Low	59.1	Low	103 Å²	103	117.8 Å²	117.8	67%	0.669	62%	0.62	S	S	*	*	H	α-helix	trans	-61.3	-27.8	-175.2	24	-33.1	0	0	0	112.2	S24 L30	S24-P26 WeakPolarHBondContact O-CD 3.4Å; P26-L30 VanDerWaalsContact O-CB 3.27Å; P26-L30 WeakPolarHBondContact O-CB 3.24Å; P26-L30 PolarHBondContact O-N 3.49Å
27	L	66.8	Low	59.9	Low	120 Å²	120	120.4 Å²	120.4	63%	0.628	62%	0.617	S	S	*	*	H	α-helix	trans	-70.3	-34.1	176.6	-132.4	117.5	0	0	0	112.3	N25 L31	N25-L27 PolarHBondContact O-N 2.98Å; N25-L27 VanDerWaalsContact O-N 3.16Å; N25-L27 PolarHBondContact OD1-N 3Å; L27-L31 HydrophobicContact CD2-CD1 4.32Å; L27-L31 WeakPolarHBondContact O-CB 3.48Å; L27-L31 PolarHBondContact O-N 3.4Å
28	F	70.6	Confident	60.7	Low	105 Å²	105	118.5 Å²	118.5	46%	0.461	60%	0.603	S	S	.	*	H	α-helix	trans	-74.5	-38.8	178.1	-169.5	-104.5	0	0	0	111.4	A22 N25 L31 L32	A22-F28 WeakPolarHBondContact O-CD1 3.44Å; N25-F28 HydrophobicContact CB-CB 4.04Å; N25-F28 WeakPolarHBondContact O-CB 3.47Å; N25-F28 PolarHBondContact O-N 3Å; F28-L31 PolarHBondContact O-N 2.73Å; F28-L32 HydrophobicContact CD1-CD1 3.66Å; F28-L32 HydrophobicContact CE1-CD1 3.32Å; F28-L32 HydrophobicContact CG-CD1 4.49Å; F28-L32 HydrophobicContact CZ-CD1 3.91Å; F28-L32 WeakPolarHBondContact O-CB 3.5Å; F28-L32 PolarHBondContact O-N 3.35Å
29	V	73	Confident	61.4	Low	72 Å²	72	111.2 Å²	111.2	44%	0.436	58%	0.584	S	S	.	*	H	α-helix	trans	-66.9	-39.6	173	179.4	0	0	0	0	110.9	N25 L32 A33	N25-V29 PolarHBondContact O-N 3.47Å; N25-V29 VanDerWaalsContact O-N 3.16Å; V29-L32 PolarHBondContact O-N 3Å; V29-A33 VanDerWaalsContact O-CB 3.24Å; V29-A33 WeakPolarHBondContact O-CB 3.27Å; V29-A33 PolarHBondContact O-N 2.93Å
30	L	72.9	Confident	61.7	Low	110 Å²	110	103.1 Å²	103.1	58%	0.576	57%	0.568	S	S	*	*	H	α-helix	trans	-65.7	-41.4	174.9	-163.4	86.8	0	0	0	111.6	P26 A33 L34	P26-L30 VanDerWaalsContact O-CB 3.27Å; P26-L30 WeakPolarHBondContact O-CB 3.24Å; P26-L30 PolarHBondContact O-N 3.49Å; L30-A33 PolarHBondContact O-N 2.92Å; L30-L34 HydrophobicContact CD2-CD1 4.15Å; L30-L34 HydrophobicContact CG-CD1 4.05Å; L30-L34 VanDerWaalsContact O-CB 3.29Å; L30-L34 WeakPolarHBondContact O-CB 3.3Å; L30-L34 PolarHBondContact O-N 2.92Å
31	L	74.4	Confident	61.7	Low	92 Å²	92	99 Å²	99	48%	0.482	56%	0.56	S	S	.	*	H	α-helix	trans	-64.7	-42.7	174.6	-104.1	145	0	0	0	112	L27 F28 L34 Q35	L27-L31 HydrophobicContact CD2-CD1 4.32Å; L27-L31 WeakPolarHBondContact O-CB 3.48Å; L27-L31 PolarHBondContact O-N 3.4Å; F28-L31 PolarHBondContact O-N 2.73Å; L31-L34 PolarHBondContact O-N 3.06Å; L31-Q35 VanDerWaalsContact O-CB 3.25Å; L31-Q35 WeakPolarHBondContact O-CB 3.5Å; L31-Q35 WeakPolarHBondContact O-CG 3.48Å; L31-Q35 PolarHBondContact O-N 3.28Å
32	L	73.4	Confident	61.4	Low	81 Å²	81	95.3 Å²	95.3	42%	0.424	56%	0.555	S	S	.	*	H	α-helix	trans	-64.3	-39	173.1	-98.5	149	0	0	0	112.1	F28 V29 Q35 L36	F28-L32 HydrophobicContact CD1-CD1 3.66Å; F28-L32 HydrophobicContact CE1-CD1 3.32Å; F28-L32 HydrophobicContact CG-CD1 4.49Å; F28-L32 HydrophobicContact CZ-CD1 3.91Å; F28-L32 WeakPolarHBondContact O-CB 3.5Å; F28-L32 PolarHBondContact O-N 3.35Å; V29-L32 PolarHBondContact O-N 3Å; L32-Q35 PolarHBondContact O-N 3.16Å; L32-L36 VanDerWaalsContact O-CB 3.23Å; L32-L36 WeakPolarHBondContact O-CB 3.23Å; L32-L36 WeakPolarHBondContact O-CD1 3.44Å; L32-L36 WeakPolarHBondContact O-CG 3.35Å; L32-L36 PolarHBondContact O-N 3.16Å
33	A	69.4	Low	61.1	Low	42 Å²	42	96.6 Å²	96.6	35%	0.347	56%	0.556	S	S	.	*	H	α-helix	trans	-68.7	-39.4	175.5	0	0	0	0	0	111.9	V29 L30 L36 L37	V29-A33 VanDerWaalsContact O-CB 3.24Å; V29-A33 WeakPolarHBondContact O-CB 3.27Å; V29-A33 PolarHBondContact O-N 2.93Å; L30-A33 PolarHBondContact O-N 2.92Å; A33-L36 CarbonylContact O-C 3.6Å; A33-L36 PolarHBondContact O-N 3.36Å; A33-L37 VanDerWaalsContact O-CB 3.25Å; A33-L37 WeakPolarHBondContact O-CB 3.23Å; A33-L37 WeakPolarHBondContact O-CD1 3.39Å; A33-L37 VanDerWaalsContact O-CG 3.31Å; A33-L37 WeakPolarHBondContact O-CG 3.46Å; A33-L37 PolarHBondContact O-N 3.27Å
34	L	68.8	Low	60.8	Low	94 Å²	94	100.9 Å²	100.9	49%	0.492	56%	0.562	S	S	.	*	H	α-helix	trans	-66.9	-40.4	172.4	-92.1	149.5	0	0	0	111.3	L30 L31 L37 V38	L30-L34 HydrophobicContact CD2-CD1 4.15Å; L30-L34 HydrophobicContact CG-CD1 4.05Å; L30-L34 VanDerWaalsContact O-CB 3.29Å; L30-L34 WeakPolarHBondContact O-CB 3.3Å; L30-L34 PolarHBondContact O-N 2.92Å; L31-L34 PolarHBondContact O-N 3.06Å; L34-L37 PolarHBondContact O-N 2.97Å; L34-V38 VanDerWaalsContact O-CB 3.3Å; L34-V38 WeakPolarHBondContact O-CB 3.48Å; L34-V38 WeakPolarHBondContact O-CG2 3.33Å; L34-V38 PolarHBondContact O-N 2.93Å
35	Q	65.7	Low	60.6	Low	127 Å²	127	99.4 Å²	99.4	59%	0.593	56%	0.555	S	S	*	*	H	α-helix	trans	-66.5	-39.8	173.7	-69.6	-115.8	-33.8	0	0	111	L31 L32 V38 V39	L31-Q35 VanDerWaalsContact O-CB 3.25Å; L31-Q35 WeakPolarHBondContact O-CB 3.5Å; L31-Q35 WeakPolarHBondContact O-CG 3.48Å; L31-Q35 PolarHBondContact O-N 3.28Å; L32-Q35 PolarHBondContact O-N 3.16Å; Q35-V38 PolarHBondContact O-N 2.91Å; Q35-V39 VanDerWaalsContact O-CB 3.29Å; Q35-V39 WeakPolarHBondContact O-CB 3.46Å; Q35-V39 WeakPolarHBondContact O-CG2 3.26Å; Q35-V39 PolarHBondContact O-N 3.33Å
36	L	61.1	Low	60.5	Low	112 Å²	112	99.8 Å²	99.8	59%	0.586	55%	0.554	S	S	*	*	H	α-helix	trans	-68.3	-34	173	-84.2	158.8	0	0	0	112.4	L32 A33 A40	L32-L36 VanDerWaalsContact O-CB 3.23Å; L32-L36 WeakPolarHBondContact O-CB 3.23Å; L32-L36 WeakPolarHBondContact O-CD1 3.44Å; L32-L36 WeakPolarHBondContact O-CG 3.35Å; L32-L36 PolarHBondContact O-N 3.16Å; A33-L36 CarbonylContact O-C 3.6Å; A33-L36 PolarHBondContact O-N 3.36Å; L36-A40 WeakPolarHBondContact O-CA 3.36Å; L36-A40 WeakPolarHBondContact O-CB 3.23Å; L36-A40 PolarHBondContact O-N 2.64Å
37	L	59	Low	60.9	Low	124 Å²	124	98.6 Å²	98.6	65%	0.649	55%	0.545	S	S	*	.	H	α-helix	trans	-72.2	-34.9	173	-84.4	158	0	0	0	111.9	A33 L34 G41	A33-L37 VanDerWaalsContact O-CB 3.25Å; A33-L37 WeakPolarHBondContact O-CB 3.23Å; A33-L37 WeakPolarHBondContact O-CD1 3.39Å; A33-L37 VanDerWaalsContact O-CG 3.31Å; A33-L37 WeakPolarHBondContact O-CG 3.46Å; A33-L37 PolarHBondContact O-N 3.27Å; L34-L37 PolarHBondContact O-N 2.97Å; L37-G41 WeakPolarHBondContact O-CA 3.4Å; L37-G41 PolarHBondContact O-N 2.82Å
38	V	56	Low	61.8	Low	82 Å²	82	95 Å²	95	50%	0.497	53%	0.53	S	S	.	.	H	α-helix	trans	-71.9	-40.1	173.2	168.8	0	0	0	0	110.4	L34 Q35 G41 L42	L34-V38 VanDerWaalsContact O-CB 3.3Å; L34-V38 WeakPolarHBondContact O-CB 3.48Å; L34-V38 WeakPolarHBondContact O-CG2 3.33Å; L34-V38 PolarHBondContact O-N 2.93Å; Q35-V38 PolarHBondContact O-N 2.91Å; V38-G41 CarbonylContact O-C 3.58Å; V38-G41 PolarHBondContact O-N 3.34Å; V38-L42 HydrophobicContact CG1-CD1 3.73Å; V38-L42 VanDerWaalsContact O-CB 3.25Å; V38-L42 WeakPolarHBondContact O-CB 3.24Å; V38-L42 WeakPolarHBondContact O-CD1 3.31Å; V38-L42 VanDerWaalsContact O-CG 3.23Å; V38-L42 WeakPolarHBondContact O-CG 3.42Å; V38-L42 PolarHBondContact O-N 3.45Å
39	V	54.7	Low	62.7	Low	79 Å²	79	90.6 Å²	90.6	48%	0.479	51%	0.512	S	S	.	.	H	α-helix	trans	-70	-38.9	173.4	172.4	0	0	0	0	111.1	Q35 G41 L42 V43	Q35-V39 VanDerWaalsContact O-CB 3.29Å; Q35-V39 WeakPolarHBondContact O-CB 3.46Å; Q35-V39 WeakPolarHBondContact O-CG2 3.26Å; Q35-V39 PolarHBondContact O-N 3.33Å; V39-G41 VanDerWaalsContact C-N 3.31Å; V39-G41 PolarHBondContact O-N 2.71Å; V39-L42 PolarHBondContact O-N 3.11Å; V39-V43 HydrophobicContact CG1-CG2 4.4Å; V39-V43 WeakPolarHBondContact O-CB 3.25Å; V39-V43 VanDerWaalsContact O-CG2 3.31Å; V39-V43 WeakPolarHBondContact O-CG2 3.29Å; V39-V43 PolarHBondContact O-N 3.17Å
40	A	52	Low	63.5	Low	67 Å²	67	93.3 Å²	93.3	55%	0.554	53%	0.533	S	S	*	.	H	α-helix	trans	-69.7	-28	172.2	0	0	0	0	0	112.4	L36	L36-A40 WeakPolarHBondContact O-CA 3.36Å; L36-A40 WeakPolarHBondContact O-CB 3.23Å; L36-A40 PolarHBondContact O-N 2.64Å
41	G	47.9	Very low	64.4	Low	58 Å²	58	90.8 Å²	90.8	60%	0.598	52%	0.523	S	S	*	.	H	α-helix	trans	-77.3	-27.6	170.9	0	0	0	0	0	113.7	L37 V38 V39	L37-G41 WeakPolarHBondContact O-CA 3.4Å; L37-G41 PolarHBondContact O-N 2.82Å; V38-G41 CarbonylContact O-C 3.58Å; V38-G41 PolarHBondContact O-N 3.34Å; V39-G41 VanDerWaalsContact C-N 3.31Å; V39-G41 PolarHBondContact O-N 2.71Å
42	L	43.1	Very low	65.3	Low	136 Å²	136	87 Å²	87	71%	0.712	50%	0.504	S	S	*	.	H	α-helix	trans	-86.7	-30.3	177.2	-80.3	162	0	0	0	112.9	V38 V39 R44	V38-L42 HydrophobicContact CG1-CD1 3.73Å; V38-L42 VanDerWaalsContact O-CB 3.25Å; V38-L42 WeakPolarHBondContact O-CB 3.24Å; V38-L42 WeakPolarHBondContact O-CD1 3.31Å; V38-L42 VanDerWaalsContact O-CG 3.23Å; V38-L42 WeakPolarHBondContact O-CG 3.42Å; V38-L42 PolarHBondContact O-N 3.45Å; V39-L42 PolarHBondContact O-N 3.11Å; L42-R44 PolarHBondContact O-N 3.44Å
43	V	43.8	Very low	66.3	Low	98 Å²	98	86.5 Å²	86.5	59%	0.594	51%	0.507	S	S	*	.	S	Bend	trans	-80	78.2	166.2	-176.3	0	0	0	0	106.8	V39 A45	V39-V43 HydrophobicContact CG1-CG2 4.4Å; V39-V43 WeakPolarHBondContact O-CB 3.25Å; V39-V43 VanDerWaalsContact O-CG2 3.31Å; V39-V43 WeakPolarHBondContact O-CG2 3.29Å; V39-V43 PolarHBondContact O-N 3.17Å; V43-A45 PolarHBondContact O-N 2.77Å
44	R	44.8	Very low	67.4	Low	232 Å²	232	85.9 Å²	85.9	88%	0.875	50%	0.5	S	S	*	.			trans	-54.2	98.7	156.8	-109.2	178.2	175.4	164.1	-1.6	105.6	L42 Q46	L42-R44 PolarHBondContact O-N 3.44Å; R44-Q46 PolarHBondContact O-N 2.9Å
45	A	48.8	Very low	68.6	Low	64 Å²	64	83.1 Å²	83.1	53%	0.529	49%	0.488	S	S	.	.			trans	-48.2	119.5	173.6	0	0	0	0	0	106.4	V43 T47	V43-A45 PolarHBondContact O-N 2.77Å; A45-T47 HydrophobicContact CB-CG2 4.17Å; A45-T47 WeakPolarHBondContact O-CB 3.42Å; A45-T47 VanDerWaalsContact O-CG2 3.29Å; A45-T47 WeakPolarHBondContact O-CG2 3.34Å; A45-T47 PolarHBondContact O-N 3.43Å; A45-T47 PolarHBondContact O-OG1 3.41Å
46	Q	60.9	Low	69.3	Low	97 Å²	97	85 Å²	85	45%	0.453	50%	0.502	S	S	.	.			trans	-63.6	96.4	179.1	-143.7	144.7	23.1	0	0	105.3	R44 F58 N78	R44-Q46 PolarHBondContact O-N 2.9Å; Q46-F58 HydrophobicContact CB-CD2 4.32Å; Q46-F58 HydrophobicContact CB-CE2 4.05Å; Q46-F58 HydrophobicContact CB-CZ 4.41Å; Q46-F58 HydrophobicContact CG-CD2 4.14Å; Q46-F58 HydrophobicContact CG-CE2 4.38Å; Q46-F58 WeakPolarHBondContact O-CE1 3.35Å; Q46-F58 VanDerWaalsContact O-CZ 3.24Å; Q46-F58 WeakPolarHBondContact O-CZ 3.24Å; Q46-N78 PolarHBondContact NE2-ND2 2.88Å; Q46-N78 VanDerWaalsContact NE2-ND2 3.11Å
47	T	71.8	Confident	70.4	Confident	79 Å²	79	87.1 Å²	87.1	49%	0.485	51%	0.509	S	S	.	.	P	Polyproline II helix	trans	-94.2	129.5	-158.9	21.1	0	0	0	0	108	A45	A45-T47 HydrophobicContact CB-CG2 4.17Å; A45-T47 WeakPolarHBondContact O-CB 3.42Å; A45-T47 VanDerWaalsContact O-CG2 3.29Å; A45-T47 WeakPolarHBondContact O-CG2 3.34Å; A45-T47 PolarHBondContact O-N 3.43Å; A45-T47 PolarHBondContact O-OG1 3.41Å
48	C	86.4	Confident	71.7	Confident	45 Å²	45	83.6 Å²	83.6	30%	0.304	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-83.9	131.1	160.5	-172.1	0	0	0	0	107.1	S50 C54 F58	C48-S50 PolarHBondContact O-N 3.33Å; C48-C54 WeakPolarHBondContact CA-SG 3.18Å; C48-C54 HydrophobicContact CB-CB 3.69Å; C48-C54 WeakPolarHBondContact CB-SG 3.45Å; C48-C54 WeakPolarHBondContact SG-CB 3.4Å; C48-C54 PolarHBondContact SG-N 3.41Å; C48-C54 VanDerWaalsContact SG-N 3.37Å; C48-C54 CovalentContact SG-SG 2.03Å; C48-C54 PolarHBondContact SG-SG 2.77Å; C48-F58 HydrophobicContact CB-CE1 4.16Å
49	P	89.6	Confident	73.5	Confident	12 Å²	12	81.6 Å²	81.6	8%	0.078	48%	0.478	C	S	.	.	P	Polyproline II helix	trans	-56	135.5	171.8	-21.3	30.6	0	0	0	109.9	V51 C52 P72 I75	P49-V51 HydrophobicContact CB-CG2 4.29Å; P49-V51 PolarHBondContact O-N 2.78Å; P49-V51 VanDerWaalsContact O-N 3.11Å; P49-C52 HydrophobicContact CB-CB 4.06Å; P49-C52 HydrophobicContact CG-CB 4.32Å; P49-C52 PolarHBondContact O-N 3.41Å; P49-P72 HydrophobicContact CB-CB 4.35Å; P49-I75 HydrophobicContact CG-CG1 4.15Å
50	S	88.8	Confident	75.4	Confident	128 Å²	128	82.3 Å²	82.3	90%	0.895	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-27.1	-175.6	56.9	0	0	0	0	113.7	C48 C52	C48-S50 PolarHBondContact O-N 3.33Å; S50-C52 VanDerWaalsContact C-N 3.31Å
51	V	91.6	Very high	77.5	Confident	58 Å²	58	79.1 Å²	79.1	35%	0.352	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-10.9	177.2	-65.9	0	0	0	0	113.3	P49 R66 L68 P72	P49-V51 HydrophobicContact CB-CG2 4.29Å; P49-V51 PolarHBondContact O-N 2.78Å; P49-V51 VanDerWaalsContact O-N 3.11Å; V51-R66 WeakPolarHBondContact O-CD 3.33Å; V51-R66 WeakPolarHBondContact O-CG 3.25Å; V51-R66 PolarHBondContact O-NE 3.35Å; V51-L68 HydrophobicContact CB-CD2 4.29Å; V51-L68 HydrophobicContact CG2-CD2 3.97Å; V51-P72 HydrophobicContact CG2-CB 4.14Å
52	C	94.1	Very high	79.9	Confident	13 Å²	13	79 Å²	79	9%	0.088	43%	0.434	C	S	.	.	S	Bend	trans	-113.6	162.4	-174.2	-60.7	0	0	0	0	112.1	P49 S50 V61 I62 C63	P49-C52 HydrophobicContact CB-CB 4.06Å; P49-C52 HydrophobicContact CG-CB 4.32Å; P49-C52 PolarHBondContact O-N 3.41Å; S50-C52 VanDerWaalsContact C-N 3.31Å; C52-V61 HydrophobicContact CB-CG1 4.13Å; C52-I62 WeakPolarHBondContact CA-O 3.43Å; C52-C63 HydrophobicContact CB-CB 4.14Å; C52-C63 WeakPolarHBondContact CB-SG 3.38Å; C52-C63 WeakPolarHBondContact SG-CB 3.34Å; C52-C63 CovalentContact SG-SG 2.04Å; C52-C63 PolarHBondContact SG-SG 2.93Å
53	S	93.9	Very high	82.4	Confident	69 Å²	69	72.6 Å²	72.6	48%	0.483	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	124.6	171.9	-174.2	0	0	0	0	109.2	I62	S53-I62 PolarHBondContact N-O 3.22Å; S53-I62 PolarHBondContact O-N 2.93Å
54	C	93.7	Very high	84.9	Confident	29 Å²	29	69.6 Å²	69.6	20%	0.196	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	147.4	-178.9	-54.3	0	0	0	0	111.5	C48 F58 K60	C48-C54 WeakPolarHBondContact CA-SG 3.18Å; C48-C54 HydrophobicContact CB-CB 3.69Å; C48-C54 WeakPolarHBondContact CB-SG 3.45Å; C48-C54 WeakPolarHBondContact SG-CB 3.4Å; C48-C54 PolarHBondContact SG-N 3.41Å; C48-C54 VanDerWaalsContact SG-N 3.37Å; C48-C54 CovalentContact SG-SG 2.03Å; C48-C54 PolarHBondContact SG-SG 2.77Å; C54-F58 HydrophobicContact CB-CD1 3.95Å; C54-F58 HydrophobicContact CB-CE1 4.41Å; C54-K60 WeakPolarHBondContact CA-O 3.24Å
55	S	92.4	Very high	87.3	Confident	37 Å²	37	67.2 Å²	67.2	26%	0.259	37%	0.373	S	S	.	.			trans	-69.6	160.4	169	61	0	0	0	0	112	Q57 F58 S59 K60	S55-Q57 PolarHBondContact O-N 2.79Å; S55-Q57 VanDerWaalsContact O-N 3.09Å; S55-F58 WeakPolarHBondContact O-CA 3.5Å; S55-F58 PolarHBondContact O-N 3.33Å; S55-F58 PolarHBondContact OG-N 2.88Å; S55-S59 PolarHBondContact OG-N 2.85Å; S55-K60 PolarHBondContact N-O 2.97Å; S55-K60 PolarHBondContact OG-N 3.44Å; S55-K60 VanDerWaalsContact OG-N 3.09Å; S55-K60 PolarHBondContact OG-O 2.95Å
56	N	81.6	Confident	89.5	Confident	165 Å²	165	70.9 Å²	70.9	88%	0.882	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-29.8	-179.8	-62.9	-7.3	0	0	0	114.8
57	Q	84.4	Confident	91.1	Very high	157 Å²	157	70.3 Å²	70.3	73%	0.734	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	5.7	176.5	-65.4	-179.8	-6.1	0	0	113.6	S55 S59	S55-Q57 PolarHBondContact O-N 2.79Å; S55-Q57 VanDerWaalsContact O-N 3.09Å; Q57-S59 PolarHBondContact O-N 3.45Å
58	F	86	Confident	92.3	Very high	51 Å²	51	67.6 Å²	67.6	22%	0.224	36%	0.362	C	S	.	.	S	Bend	trans	54.8	19.1	-174.2	-52	-84.8	0	0	0	115	Q46 C48 C54 S55 T79	Q46-F58 HydrophobicContact CB-CD2 4.32Å; Q46-F58 HydrophobicContact CB-CE2 4.05Å; Q46-F58 HydrophobicContact CB-CZ 4.41Å; Q46-F58 HydrophobicContact CG-CD2 4.14Å; Q46-F58 HydrophobicContact CG-CE2 4.38Å; Q46-F58 WeakPolarHBondContact O-CE1 3.35Å; Q46-F58 VanDerWaalsContact O-CZ 3.24Å; Q46-F58 WeakPolarHBondContact O-CZ 3.24Å; C48-F58 HydrophobicContact CB-CE1 4.16Å; C54-F58 HydrophobicContact CB-CD1 3.95Å; C54-F58 HydrophobicContact CB-CE1 4.41Å; S55-F58 WeakPolarHBondContact O-CA 3.5Å; S55-F58 PolarHBondContact O-N 3.33Å; S55-F58 PolarHBondContact OG-N 2.88Å; F58-T79 WeakPolarHBondContact O-CA 3.05Å; F58-T79 PolarHBondContact O-N 2.83Å; F58-T79 PolarHBondContact O-OG1 2.89Å
59	S	92.7	Very high	92.7	Very high	39 Å²	39	74.6 Å²	74.6	27%	0.273	38%	0.382	S	S	.	.	S	Bend	trans	-76.3	-29.6	177.5	59.8	0	0	0	0	112.4	S55 Q57 R80 Y81	S55-S59 PolarHBondContact OG-N 2.85Å; Q57-S59 PolarHBondContact O-N 3.45Å; S59-R80 PolarHBondContact O-N 2.03Å; S59-Y81 PolarHBondContact O-N 2.73Å
60	K	95.9	Very high	93	Very high	95 Å²	95	79.3 Å²	79.3	41%	0.413	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	122.7	177.8	-161.1	-179.2	-174.8	173	0	110.3	C54 S55 I62 Y81	C54-K60 WeakPolarHBondContact CA-O 3.24Å; S55-K60 PolarHBondContact N-O 2.97Å; S55-K60 PolarHBondContact OG-N 3.44Å; S55-K60 VanDerWaalsContact OG-N 3.09Å; S55-K60 PolarHBondContact OG-O 2.95Å; K60-I62 HydrophobicContact CD-CD1 4.25Å; K60-I62 HydrophobicContact CG-CG1 4.32Å; K60-Y81 HydrophobicContact CD-CD1 4.11Å; K60-Y81 HydrophobicContact CD-CE1 4.34Å; K60-Y81 HydrophobicContact CG-CD1 3.35Å; K60-Y81 HydrophobicContact CG-CE1 3.97Å; K60-Y81 HydrophobicContact CG-CG 4.06Å
61	V	96.1	Very high	93.3	Very high	0 Å²	0	74.3 Å²	74.3	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	121.3	177.8	-179.2	0	0	0	0	109.4	C52 I75 T79 Y81 L82 N83	C52-V61 HydrophobicContact CB-CG1 4.13Å; V61-I75 HydrophobicContact CG2-CG2 4.46Å; V61-T79 HydrophobicContact CB-CG2 4.07Å; V61-T79 HydrophobicContact CG2-CG2 3.69Å; V61-T79 WeakPolarHBondContact CG2-OG1 3.47Å; V61-Y81 PolarHBondContact N-O 3.17Å; V61-L82 HydrophobicContact CB-CD1 3.89Å; V61-L82 HydrophobicContact CG1-CD1 3.8Å; V61-N83 PolarHBondContact O-N 2.9Å
62	I	96.9	Very high	93.3	Very high	56 Å²	56	72.3 Å²	72.3	29%	0.287	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	117.5	-174.7	-54.2	175.8	0	0	0	109.6	C52 S53 K60 T64	C52-I62 WeakPolarHBondContact CA-O 3.43Å; S53-I62 PolarHBondContact N-O 3.22Å; S53-I62 PolarHBondContact O-N 2.93Å; K60-I62 HydrophobicContact CD-CD1 4.25Å; K60-I62 HydrophobicContact CG-CG1 4.32Å; I62-T64 HydrophobicContact CG2-CG2 3.99Å
63	C	96.1	Very high	93.1	Very high	0 Å²	0	79 Å²	79	0%	0	39%	0.391	C	S	.	.			trans	-127.3	28.5	-176.5	-51.6	0	0	0	0	111.6	C52 L68 N83 L84 N87	C52-C63 HydrophobicContact CB-CB 4.14Å; C52-C63 WeakPolarHBondContact CB-SG 3.38Å; C52-C63 WeakPolarHBondContact SG-CB 3.34Å; C52-C63 CovalentContact SG-SG 2.04Å; C52-C63 PolarHBondContact SG-SG 2.93Å; C63-L68 HydrophobicContact CB-CD1 3.95Å; C63-N83 WeakPolarHBondContact CA-O 3.49Å; C63-N83 WeakPolarHBondContact CB-O 3.04Å; C63-N83 PolarHBondContact N-O 2.87Å; C63-L84 HydrophobicContact CB-CD2 3.64Å; C63-N87 PolarHBondContact O-ND2 3.33Å
64	T	96.1	Very high	92.8	Very high	36 Å²	36	77.8 Å²	77.8	22%	0.221	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	146.3	-175.3	-169.9	0	0	0	0	113.3	I62 R66 Q85	I62-T64 HydrophobicContact CG2-CG2 3.99Å; T64-R66 VanDerWaalsContact C-N 3.31Å; T64-R66 WeakPolarHBondContact O-CG 3.29Å; T64-R66 PolarHBondContact O-N 3.41Å; T64-Q85 VanDerWaalsContact CA-O 3.24Å; T64-Q85 WeakPolarHBondContact CA-O 3.24Å; T64-Q85 WeakPolarHBondContact CB-O 3.41Å; T64-Q85 WeakPolarHBondContact OG1-CG 3.15Å; T64-Q85 PolarHBondContact OG1-O 2.85Å
65	R	94.7	Very high	92.8	Very high	182 Å²	182	77.6 Å²	77.6	69%	0.687	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	38.2	176.5	-58	179.3	177.9	178.9	-2.1	114.1	Q85 E86	R65-Q85 PolarHBondContact N-O 3.48Å; R65-E86 VanDerWaalsContact CA-O 3.3Å; R65-E86 WeakPolarHBondContact CA-O 3.42Å; R65-E86 HydrophobicContact CG-CB 3.95Å; R65-E86 WeakPolarHBondContact CG-OE2 3.37Å; R65-E86 IonicContact CZ-OE2 3.29Å; R65-E86 VanDerWaalsContact CZ-OE2 3.29Å; R65-E86 PolarHBondContact N-O 3.42Å; R65-E86 IonicContact NE-OE2 2.67Å; R65-E86 PolarHBondContact NE-OE2 2.84Å; R65-E86 IonicContact NH2-OE1 3.86Å; R65-E86 IonicContact NH2-OE2 3.03Å; R65-E86 PolarHBondContact NH2-OE2 3.37Å
66	R	94.9	Very high	92.8	Very high	141 Å²	141	76.3 Å²	76.3	53%	0.532	38%	0.376	S	S	.	.	S	Bend	trans	-106.7	7.2	-177.9	-62.3	-59.9	-178.2	157.7	3.7	113.2	V51 T64 L68 N87	V51-R66 WeakPolarHBondContact O-CD 3.33Å; V51-R66 WeakPolarHBondContact O-CG 3.25Å; V51-R66 PolarHBondContact O-NE 3.35Å; T64-R66 VanDerWaalsContact C-N 3.31Å; T64-R66 WeakPolarHBondContact O-CG 3.29Å; T64-R66 PolarHBondContact O-N 3.41Å; R66-L68 HydrophobicContact CB-CD1 4.14Å; R66-L68 HydrophobicContact CB-CD2 4.2Å; R66-L68 HydrophobicContact CB-CG 3.79Å; R66-L68 PolarHBondContact O-N 3.39Å; R66-L68 VanDerWaalsContact O-N 3.17Å; R66-N87 WeakPolarHBondContact CA-OD1 3.03Å; R66-N87 PolarHBondContact N-OD1 2.77Å
67	S	95.9	Very high	93.3	Very high	84 Å²	84	71.7 Å²	71.7	59%	0.587	35%	0.354	S	S	*	.			trans	54.3	31.1	-178.1	-59.3	0	0	0	0	113.3	R69 N87	S67-R69 PolarHBondContact O-N 2.96Å; S67-N87 PolarHBondContact N-OD1 3.09Å; S67-N87 VanDerWaalsContact N-OD1 3.11Å
68	L	95.9	Very high	93.6	Very high	22 Å²	22	67.3 Å²	67.3	12%	0.115	34%	0.336	C	S	.	.			trans	-67.1	130	-177.9	-60.9	171.1	0	0	0	110	V51 C63 R66 P72 L84 N87 L88 I89	V51-L68 HydrophobicContact CB-CD2 4.29Å; V51-L68 HydrophobicContact CG2-CD2 3.97Å; C63-L68 HydrophobicContact CB-CD1 3.95Å; R66-L68 HydrophobicContact CB-CD1 4.14Å; R66-L68 HydrophobicContact CB-CD2 4.2Å; R66-L68 HydrophobicContact CB-CG 3.79Å; R66-L68 PolarHBondContact O-N 3.39Å; R66-L68 VanDerWaalsContact O-N 3.17Å; L68-P72 HydrophobicContact CD1-CG 4.26Å; L68-L84 HydrophobicContact CD1-CD2 3.97Å; L68-N87 HydrophobicContact CB-CB 4.08Å; L68-N87 PolarHBondContact N-OD1 3.11Å; L68-N87 VanDerWaalsContact N-OD1 3.09Å; L68-L88 CarbonylContact O-C 3.11Å; L68-L88 VanDerWaalsContact O-CA 3.23Å; L68-L88 WeakPolarHBondContact O-CA 3.28Å; L68-L88 PolarHBondContact O-N 3.12Å; L68-I89 HydrophobicContact CB-CG1 4.45Å; L68-I89 WeakPolarHBondContact O-CG1 3.13Å; L68-I89 PolarHBondContact O-N 2.98Å; L68-I89 VanDerWaalsContact O-N 3.12Å
69	R	95.4	Very high	94.1	Very high	192 Å²	192	64.9 Å²	64.9	73%	0.725	33%	0.325	S	S	*	.	S	Bend	trans	-91.8	-19.3	176.2	-63.7	-176.1	-179.9	-156.9	0.1	113	S67 L88 I89	S67-R69 PolarHBondContact O-N 2.96Å; R69-L88 HydrophobicContact CG-CB 4.47Å; R69-I89 WeakPolarHBondContact O-CA 3.29Å
70	E	94.9	Very high	94.3	Very high	112 Å²	112	69.3 Å²	69.3	52%	0.523	34%	0.336	S	S	.	.	S	Bend	trans	-139.4	166.2	-179.7	-57.3	-163.7	163.7	0	0	109.4	K93	E70-K93 IonicContact OE1-NZ 2.73Å; E70-K93 PolarHBondContact OE1-NZ 3.21Å; E70-K93 IonicContact OE2-NZ 3.9Å; E70-K93 PolarHBondContact OE2-NZ 3.31Å
71	V	95.1	Very high	94.4	Very high	22 Å²	22	67.3 Å²	67.3	13%	0.133	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-67.4	129.9	173.3	179.6	0	0	0	0	108.4	I75 L84 I92 F97	V71-I75 HydrophobicContact CG1-CD1 4.23Å; V71-L84 HydrophobicContact CG1-CD1 4.2Å; V71-I92 HydrophobicContact CG2-CD1 4.01Å; V71-F97 HydrophobicContact CG1-CD1 4.44Å; V71-F97 HydrophobicContact CG1-CE1 3.67Å; V71-F97 HydrophobicContact CG1-CZ 4.18Å; V71-F97 HydrophobicContact CG2-CE1 4.26Å; V71-F97 HydrophobicContact CG2-CZ 3.91Å
72	P	93.1	Very high	94.4	Very high	17 Å²	17	67.3 Å²	67.3	11%	0.11	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-70.7	137.3	-177.9	27	-31.9	0	0	0	111.4	P49 V51 L68 I75 L84	P49-P72 HydrophobicContact CB-CB 4.35Å; V51-P72 HydrophobicContact CG2-CB 4.14Å; L68-P72 HydrophobicContact CD1-CG 4.26Å; P72-I75 HydrophobicContact CG-CD1 4.37Å; P72-I75 WeakPolarHBondContact O-CD1 3.46Å; P72-I75 WeakPolarHBondContact O-CG1 3.49Å; P72-L84 HydrophobicContact CG-CD2 3.95Å
73	D	89.5	Confident	94.5	Very high	154 Å²	154	64.9 Å²	64.9	82%	0.824	31%	0.314	S	S	*	.	S	Bend	trans	-73.3	161.9	171.9	-66.2	-48	0	0	0	111.7
74	G	88.5	Confident	94.5	Very high	42 Å²	42	64.9 Å²	64.9	43%	0.433	31%	0.314	S	S	.	.			trans	79.9	24.9	174.8	0	0	0	0	0	114.6
75	I	92.4	Very high	94.6	Very high	26 Å²	26	65.5 Å²	65.5	13%	0.133	31%	0.314	C	S	.	.			trans	-72.6	129.3	172.4	-57.3	167.2	0	0	0	109.3	P49 V61 V71 P72 T79 L82 L100	P49-I75 HydrophobicContact CG-CG1 4.15Å; V61-I75 HydrophobicContact CG2-CG2 4.46Å; V71-I75 HydrophobicContact CG1-CD1 4.23Å; P72-I75 HydrophobicContact CG-CD1 4.37Å; P72-I75 WeakPolarHBondContact O-CD1 3.46Å; P72-I75 WeakPolarHBondContact O-CG1 3.49Å; I75-T79 HydrophobicContact CG2-CG2 4.38Å; I75-T79 WeakPolarHBondContact CG2-OG1 3.49Å; I75-L82 HydrophobicContact CD1-CD1 4.17Å; I75-L82 HydrophobicContact CD1-CD2 3.77Å; I75-L100 HydrophobicContact CB-CD2 4.24Å; I75-L100 HydrophobicContact CG2-CD1 4.1Å; I75-L100 HydrophobicContact CG2-CD2 3.75Å
76	S	92	Very high	94.7	Very high	9 Å²	9	59.4 Å²	59.4	6%	0.063	29%	0.293	C	S	.	.			trans	-60.2	140.9	179.7	179.9	0	0	0	0	112.8	N78 T79 L100	S76-N78 PolarHBondContact O-N 3.03Å; S76-N78 PolarHBondContact OG-N 2.67Å; S76-T79 VanDerWaalsContact O-CB 3.29Å; S76-T79 WeakPolarHBondContact O-CB 2.99Å; S76-T79 PolarHBondContact O-N 2.88Å; S76-T79 VanDerWaalsContact O-N 3.16Å; S76-T79 PolarHBondContact O-OG1 3.11Å; S76-L100 VanDerWaalsContact O-CD2 3.3Å; S76-L100 WeakPolarHBondContact O-CD2 3.36Å
77	T	91.8	Very high	94.9	Very high	68 Å²	68	52.9 Å²	52.9	42%	0.417	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-15.6	177.1	52.3	0	0	0	0	114.2	T79 H99 H102	T77-T79 VanDerWaalsContact C-N 3.28Å; T77-H99 HydrophobicContact CG2-CB 4.2Å; T77-H102 PolarHBondContact O-ND1 2.98Å; T77-H102 VanDerWaalsContact O-ND1 3.09Å
78	N	92.1	Very high	94.9	Very high	65 Å²	65	52 Å²	52	35%	0.348	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-3.4	176.5	-69.1	-10.4	0	0	0	113	Q46 S76 R80	Q46-N78 PolarHBondContact NE2-ND2 2.88Å; Q46-N78 VanDerWaalsContact NE2-ND2 3.11Å; S76-N78 PolarHBondContact O-N 3.03Å; S76-N78 PolarHBondContact OG-N 2.67Å; N78-R80 PolarHBondContact O-N 3.38Å
79	T	95.4	Very high	95	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.252	C	S	.	.			trans	-63.2	125.8	-178.1	-53.1	0	0	0	0	110.7	F58 V61 I75 S76 T77 Y81 L82 H102 L103	F58-T79 WeakPolarHBondContact O-CA 3.05Å; F58-T79 PolarHBondContact O-N 2.83Å; F58-T79 PolarHBondContact O-OG1 2.89Å; V61-T79 HydrophobicContact CB-CG2 4.07Å; V61-T79 HydrophobicContact CG2-CG2 3.69Å; V61-T79 WeakPolarHBondContact CG2-OG1 3.47Å; I75-T79 HydrophobicContact CG2-CG2 4.38Å; I75-T79 WeakPolarHBondContact CG2-OG1 3.49Å; S76-T79 VanDerWaalsContact O-CB 3.29Å; S76-T79 WeakPolarHBondContact O-CB 2.99Å; S76-T79 PolarHBondContact O-N 2.88Å; S76-T79 VanDerWaalsContact O-N 3.16Å; S76-T79 PolarHBondContact O-OG1 3.11Å; T77-T79 VanDerWaalsContact C-N 3.28Å; T79-Y81 WeakPolarHBondContact CG2-O 3.43Å; T79-L82 HydrophobicContact CG2-CB 4.18Å; T79-H102 CarbonylContact O-C 3.26Å; T79-L103 HydrophobicContact CG2-CD1 3.79Å; T79-L103 WeakPolarHBondContact O-CA 3.44Å; T79-L103 PolarHBondContact O-N 2.81Å
80	R	96.8	Very high	95.1	Very high	132 Å²	132	45.8 Å²	45.8	50%	0.498	24%	0.236	S	C	.	.	S	Bend	trans	-106.1	-29.5	172.9	-63.6	-171.7	178.3	-149.8	10.2	112.6	S59 N78 H102 E104 I105	S59-R80 PolarHBondContact O-N 2.03Å; N78-R80 PolarHBondContact O-N 3.38Å; R80-H102 HydrophobicContact CG-CB 4.44Å; R80-E104 WeakPolarHBondContact CD-OE1 3.29Å; R80-E104 IonicContact CZ-OE1 3.69Å; R80-E104 IonicContact NE-OE1 2.97Å; R80-E104 IonicContact NH1-OE1 3.76Å; R80-E104 PolarHBondContact NH1-OE1 2.79Å; R80-E104 PolarHBondContact O-N 2.77Å; R80-I105 PolarHBondContact O-N 3.34Å
81	Y	97.9	Very high	95.2	Very high	53 Å²	53	42.3 Å²	42.3	21%	0.208	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	119	178.4	175.1	-83.1	0	0	0	109.6	S59 K60 V61 T79 N83 I105 Q107	S59-Y81 PolarHBondContact O-N 2.73Å; K60-Y81 HydrophobicContact CD-CD1 4.11Å; K60-Y81 HydrophobicContact CD-CE1 4.34Å; K60-Y81 HydrophobicContact CG-CD1 3.35Å; K60-Y81 HydrophobicContact CG-CE1 3.97Å; K60-Y81 HydrophobicContact CG-CG 4.06Å; V61-Y81 PolarHBondContact N-O 3.17Å; T79-Y81 WeakPolarHBondContact CG2-O 3.43Å; Y81-N83 HydrophobicContact CD1-CB 4.4Å; Y81-N83 HydrophobicContact CE1-CB 3.58Å; Y81-N83 PolarHBondContact OH-ND2 2.79Å; Y81-N83 VanDerWaalsContact OH-ND2 3.15Å; Y81-I105 HydrophobicContact CD2-CB 3.86Å; Y81-I105 HydrophobicContact CD2-CD1 4.14Å; Y81-I105 HydrophobicContact CD2-CG2 3.83Å; Y81-I105 HydrophobicContact CE2-CG2 4Å; Y81-Q107 VanDerWaalsContact CZ-OE1 3.32Å; Y81-Q107 PolarHBondContact OH-OE1 3.34Å
82	L	97.7	Very high	95.3	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	120.7	176.9	177.9	59.6	0	0	0	110	V61 I75 T79 L84 F97 L100 L103 I105 L106 Q107	V61-L82 HydrophobicContact CB-CD1 3.89Å; V61-L82 HydrophobicContact CG1-CD1 3.8Å; I75-L82 HydrophobicContact CD1-CD1 4.17Å; I75-L82 HydrophobicContact CD1-CD2 3.77Å; T79-L82 HydrophobicContact CG2-CB 4.18Å; L82-L84 HydrophobicContact CD1-CD1 4.41Å; L82-L84 HydrophobicContact CD1-CG 4.24Å; L82-L84 HydrophobicContact CD2-CD1 3.89Å; L82-L84 HydrophobicContact CG-CD1 4.04Å; L82-L84 HydrophobicContact CG-CG 4.19Å; L82-F97 HydrophobicContact CD2-CD1 4.27Å; L82-F97 HydrophobicContact CD2-CE1 4.01Å; L82-L100 HydrophobicContact CD2-CD1 4.12Å; L82-L103 HydrophobicContact CB-CD1 3.67Å; L82-L103 HydrophobicContact CB-CD2 4.42Å; L82-I105 PolarHBondContact N-O 2.76Å; L82-L106 HydrophobicContact CB-CD1 4.16Å; L82-L106 HydrophobicContact CD2-CD1 3.82Å; L82-L106 HydrophobicContact CG-CD1 4.06Å; L82-Q107 PolarHBondContact O-N 3.45Å
83	N	97.9	Very high	95.4	Very high	6 Å²	6	45.1 Å²	45.1	3%	0.032	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	111	179.8	-177.4	-24.3	0	0	0	111.3	V61 C63 Y81 Q85 Q107	V61-N83 PolarHBondContact O-N 2.9Å; C63-N83 WeakPolarHBondContact CA-O 3.49Å; C63-N83 WeakPolarHBondContact CB-O 3.04Å; C63-N83 PolarHBondContact N-O 2.87Å; Y81-N83 HydrophobicContact CD1-CB 4.4Å; Y81-N83 HydrophobicContact CE1-CB 3.58Å; Y81-N83 PolarHBondContact OH-ND2 2.79Å; Y81-N83 VanDerWaalsContact OH-ND2 3.15Å; N83-Q85 PolarHBondContact ND2-NE2 3.29Å; N83-Q85 WeakPolarHBondContact OD1-CB 3.47Å; N83-Q85 WeakPolarHBondContact OD1-CG 3.14Å; N83-Q85 PolarHBondContact OD1-N 2.9Å; N83-Q85 PolarHBondContact OD1-NE2 3.36Å; N83-Q107 VanDerWaalsContact CG-OE1 3.25Å; N83-Q107 PolarHBondContact ND2-OE1 3.46Å
84	L	97.5	Very high	95.7	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.213	C	C	.	.			trans	-116	21.6	178.4	-72	162.6	0	0	0	111.7	C63 L68 V71 P72 L82 N87 I89 F97 Q107 L108 N111	C63-L84 HydrophobicContact CB-CD2 3.64Å; L68-L84 HydrophobicContact CD1-CD2 3.97Å; V71-L84 HydrophobicContact CG1-CD1 4.2Å; P72-L84 HydrophobicContact CG-CD2 3.95Å; L82-L84 HydrophobicContact CD1-CD1 4.41Å; L82-L84 HydrophobicContact CD1-CG 4.24Å; L82-L84 HydrophobicContact CD2-CD1 3.89Å; L82-L84 HydrophobicContact CG-CD1 4.04Å; L82-L84 HydrophobicContact CG-CG 4.19Å; L84-N87 PolarHBondContact O-ND2 2.04Å; L84-I89 HydrophobicContact CB-CD1 4.28Å; L84-I89 HydrophobicContact CD2-CD1 4.46Å; L84-F97 HydrophobicContact CD1-CE1 4.37Å; L84-Q107 WeakPolarHBondContact CA-O 3.3Å; L84-Q107 WeakPolarHBondContact CB-O 3.23Å; L84-Q107 PolarHBondContact N-O 3.32Å; L84-L108 HydrophobicContact CB-CD2 3.98Å; L84-L108 HydrophobicContact CD1-CD2 3.82Å; L84-N111 PolarHBondContact O-ND2 2.94Å
85	Q	97.3	Very high	95.9	Very high	49 Å²	49	41.7 Å²	41.7	23%	0.229	21%	0.205	C	C	.	.			trans	-68	154.8	-175.7	80	-168.4	-40.3	0	0	113.1	T64 R65 N83 N87 S109	T64-Q85 VanDerWaalsContact CA-O 3.24Å; T64-Q85 WeakPolarHBondContact CA-O 3.24Å; T64-Q85 WeakPolarHBondContact CB-O 3.41Å; T64-Q85 WeakPolarHBondContact OG1-CG 3.15Å; T64-Q85 PolarHBondContact OG1-O 2.85Å; R65-Q85 PolarHBondContact N-O 3.48Å; N83-Q85 PolarHBondContact ND2-NE2 3.29Å; N83-Q85 WeakPolarHBondContact OD1-CB 3.47Å; N83-Q85 WeakPolarHBondContact OD1-CG 3.14Å; N83-Q85 PolarHBondContact OD1-N 2.9Å; N83-Q85 PolarHBondContact OD1-NE2 3.36Å; Q85-N87 PolarHBondContact O-ND2 2.8Å; Q85-S109 VanDerWaalsContact CA-O 3.26Å; Q85-S109 WeakPolarHBondContact CA-O 3.49Å
86	E	97.1	Very high	96	Very high	53 Å²	53	42.5 Å²	42.5	25%	0.248	21%	0.213	C	C	.	.	S	Bend	trans	58.3	49.8	176.7	-60.6	-174	-176.7	0	0	112.4	R65 S109 K110	R65-E86 VanDerWaalsContact CA-O 3.3Å; R65-E86 WeakPolarHBondContact CA-O 3.42Å; R65-E86 HydrophobicContact CG-CB 3.95Å; R65-E86 WeakPolarHBondContact CG-OE2 3.37Å; R65-E86 IonicContact CZ-OE2 3.29Å; R65-E86 VanDerWaalsContact CZ-OE2 3.29Å; R65-E86 PolarHBondContact N-O 3.42Å; R65-E86 IonicContact NE-OE2 2.67Å; R65-E86 PolarHBondContact NE-OE2 2.84Å; R65-E86 IonicContact NH2-OE1 3.86Å; R65-E86 IonicContact NH2-OE2 3.03Å; R65-E86 PolarHBondContact NH2-OE2 3.37Å; E86-S109 PolarHBondContact N-O 3.22Å; E86-K110 VanDerWaalsContact CA-O 3.3Å; E86-K110 WeakPolarHBondContact CA-O 3.26Å; E86-K110 HydrophobicContact CG-CB 3.92Å; E86-K110 HydrophobicContact CG-CD 3.58Å; E86-K110 HydrophobicContact CG-CG 4.46Å; E86-K110 PolarHBondContact N-O 3.01Å; E86-K110 WeakPolarHBondContact OE1-CD 3.49Å; E86-K110 IonicContact OE1-NZ 2.86Å; E86-K110 PolarHBondContact OE1-NZ 2.84Å
87	N	97.9	Very high	96.1	Very high	4 Å²	4	42.1 Å²	42.1	2%	0.021	21%	0.21	C	C	.	.	S	Bend	trans	-123.2	-171.9	174.3	-76.9	-62.7	0	0	0	110.8	C63 R66 S67 L68 L84 Q85 I89 N111	C63-N87 PolarHBondContact O-ND2 3.33Å; R66-N87 WeakPolarHBondContact CA-OD1 3.03Å; R66-N87 PolarHBondContact N-OD1 2.77Å; S67-N87 PolarHBondContact N-OD1 3.09Å; S67-N87 VanDerWaalsContact N-OD1 3.11Å; L68-N87 HydrophobicContact CB-CB 4.08Å; L68-N87 PolarHBondContact N-OD1 3.11Å; L68-N87 VanDerWaalsContact N-OD1 3.09Å; L84-N87 PolarHBondContact O-ND2 2.04Å; Q85-N87 PolarHBondContact O-ND2 2.8Å; N87-I89 HydrophobicContact CB-CD1 4.43Å; N87-I89 HydrophobicContact CB-CG1 4.2Å; N87-N111 WeakPolarHBondContact CA-OD1 3.43Å; N87-N111 WeakPolarHBondContact CB-OD1 3.43Å; N87-N111 PolarHBondContact O-OD1 2.84Å
88	L	97.8	Very high	96.2	Very high	67 Å²	67	43.6 Å²	43.6	35%	0.351	21%	0.211	S	C	.	.			trans	-112.5	25.3	-175.9	-57.8	177.2	0	0	0	111.9	L68 R69 Q90 H112	L68-L88 CarbonylContact O-C 3.11Å; L68-L88 VanDerWaalsContact O-CA 3.23Å; L68-L88 WeakPolarHBondContact O-CA 3.28Å; L68-L88 PolarHBondContact O-N 3.12Å; R69-L88 HydrophobicContact CG-CB 4.47Å; L88-Q90 PolarHBondContact O-N 3.09Å; L88-H112 VanDerWaalsContact CD2-CE1 3.48Å; L88-H112 WeakPolarHBondContact CD2-CE1 3.34Å
89	I	97.9	Very high	96.2	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.225	C	C	.	.			trans	-68.8	128.6	-175.4	-56.2	171.9	0	0	0	109.1	L68 R69 L84 N87 I92 L108 N111 H112 I113	L68-I89 HydrophobicContact CB-CG1 4.45Å; L68-I89 WeakPolarHBondContact O-CG1 3.13Å; L68-I89 PolarHBondContact O-N 2.98Å; L68-I89 VanDerWaalsContact O-N 3.12Å; R69-I89 WeakPolarHBondContact O-CA 3.29Å; L84-I89 HydrophobicContact CB-CD1 4.28Å; L84-I89 HydrophobicContact CD2-CD1 4.46Å; N87-I89 HydrophobicContact CB-CD1 4.43Å; N87-I89 HydrophobicContact CB-CG1 4.2Å; I89-I92 HydrophobicContact CG2-CD1 3.72Å; I89-L108 HydrophobicContact CD1-CD2 4.5Å; I89-N111 HydrophobicContact CB-CB 4.4Å; I89-N111 WeakPolarHBondContact CB-OD1 3.47Å; I89-N111 WeakPolarHBondContact CG1-OD1 3.45Å; I89-N111 PolarHBondContact N-OD1 3.04Å; I89-H112 CarbonylContact O-C 3.56Å; I89-H112 VanDerWaalsContact O-CA 3.27Å; I89-H112 WeakPolarHBondContact O-CA 3.44Å; I89-H112 PolarHBondContact O-N 2.91Å; I89-I113 HydrophobicContact CB-CG1 4.48Å; I89-I113 HydrophobicContact CG2-CG1 4.34Å; I89-I113 WeakPolarHBondContact O-CG1 3.44Å; I89-I113 PolarHBondContact O-N 3.45Å
90	Q	97	Very high	96.1	Very high	83 Å²	83	47.4 Å²	47.4	39%	0.388	23%	0.227	S	C	.	.			trans	-107.8	-33.7	-176.8	-64.6	-179	27.9	0	0	114.3	L88 H112 I113 R114	L88-Q90 PolarHBondContact O-N 3.09Å; Q90-H112 WeakPolarHBondContact CA-O 3.3Å; Q90-H112 HydrophobicContact CG-CB 4.06Å; Q90-I113 WeakPolarHBondContact O-CA 3.23Å; Q90-R114 VanDerWaalsContact O-CG 3.31Å; Q90-R114 WeakPolarHBondContact O-CG 3.25Å; Q90-R114 PolarHBondContact O-N 3Å
91	V	97.2	Very high	95.9	Very high	39 Å²	39	49.3 Å²	49.3	24%	0.236	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	132.1	-174.8	-177.1	0	0	0	0	108.5	K115 E117	V91-K115 WeakPolarHBondContact CA-O 3.49Å; V91-K115 HydrophobicContact CG1-CB 4.49Å; V91-K115 HydrophobicContact CG2-CB 4.48Å; V91-E117 HydrophobicContact CG1-CG 4.41Å
92	I	97.3	Very high	95.8	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	112.5	168.5	-50.3	-59.4	0	0	0	107.5	V71 I89 F97 L108 I113 K115 I116 E117 A120	V71-I92 HydrophobicContact CG2-CD1 4.01Å; I89-I92 HydrophobicContact CG2-CD1 3.72Å; I92-F97 HydrophobicContact CG2-CE2 3.67Å; I92-F97 HydrophobicContact CG2-CZ 4.35Å; I92-L108 HydrophobicContact CD1-CD1 4.3Å; I92-L108 HydrophobicContact CD1-CD2 4.15Å; I92-I113 HydrophobicContact CD1-CD1 3.99Å; I92-I113 HydrophobicContact CD1-CG1 4.37Å; I92-I113 HydrophobicContact CG1-CD1 4.17Å; I92-I113 HydrophobicContact CG1-CG2 4.19Å; I92-K115 PolarHBondContact N-O 3.09Å; I92-K115 VanDerWaalsContact N-O 3.16Å; I92-I116 HydrophobicContact CB-CG1 4.3Å; I92-I116 HydrophobicContact CB-CG2 4.44Å; I92-I116 HydrophobicContact CG1-CG1 4.12Å; I92-E117 PolarHBondContact O-N 2.77Å; I92-E117 VanDerWaalsContact O-N 3.07Å; I92-A120 HydrophobicContact CB-CB 4.34Å; I92-A120 HydrophobicContact CG2-CB 3.77Å
93	K	95.5	Very high	95.8	Very high	97 Å²	97	51.3 Å²	51.3	42%	0.422	25%	0.245	S	C	.	.			trans	-75.8	157.2	-175.9	-61.6	174.3	-176.9	167.5	0	110.9	E70 S96 E117	E70-K93 IonicContact OE1-NZ 2.73Å; E70-K93 PolarHBondContact OE1-NZ 3.21Å; E70-K93 IonicContact OE2-NZ 3.9Å; E70-K93 PolarHBondContact OE2-NZ 3.31Å; K93-S96 PolarHBondContact N-OG 2.89Å; K93-S96 WeakPolarHBondContact O-CB 3.24Å; K93-S96 PolarHBondContact O-N 2.82Å; K93-S96 PolarHBondContact O-OG 3.43Å; K93-E117 VanDerWaalsContact CA-OE2 3.3Å; K93-E117 WeakPolarHBondContact CA-OE2 3.44Å
94	V	94.9	Very high	95.8	Very high	73 Å²	73	54.4 Å²	54.4	44%	0.442	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.5	140.4	171.1	-173.6	0	0	0	0	110.8	S96 E117 L118	V94-S96 PolarHBondContact O-N 3.2Å; V94-E117 HydrophobicContact CG2-CB 3.74Å; V94-E117 WeakPolarHBondContact CG2-OE2 3.4Å; V94-E117 PolarHBondContact N-OE2 3.42Å; V94-L118 WeakPolarHBondContact CG2-O 3.45Å
95	D	93.3	Very high	95.8	Very high	51 Å²	51	57 Å²	57	27%	0.273	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.3	14.4	174.1	-73.5	-6	0	0	0	115.7	F97 K98 G119 N122	D95-F97 PolarHBondContact O-N 3.38Å; D95-K98 HydrophobicContact CB-CB 4.04Å; D95-K98 HydrophobicContact CB-CD 4.07Å; D95-K98 WeakPolarHBondContact O-CB 3.1Å; D95-K98 PolarHBondContact O-N 3.35Å; D95-K98 WeakPolarHBondContact OD2-CD 3.36Å; D95-K98 WeakPolarHBondContact OD2-CE 3.48Å; D95-K98 IonicContact OD2-NZ 3.91Å; D95-K98 PolarHBondContact OD2-NZ 2.92Å; D95-G119 PolarHBondContact N-O 3.44Å; D95-N122 VanDerWaalsContact OD1-CB 3.27Å; D95-N122 WeakPolarHBondContact OD1-CB 3.45Å; D95-N122 PolarHBondContact OD1-ND2 3.35Å
96	S	94	Very high	95.9	Very high	43 Å²	43	54.6 Å²	54.6	30%	0.301	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-29	179.8	-64.8	0	0	0	0	113.2	K93 V94	K93-S96 PolarHBondContact N-OG 2.89Å; K93-S96 WeakPolarHBondContact O-CB 3.24Å; K93-S96 PolarHBondContact O-N 2.82Å; K93-S96 PolarHBondContact O-OG 3.43Å; V94-S96 PolarHBondContact O-N 3.2Å
97	F	94.5	Very high	95.9	Very high	1 Å²	1	53.1 Å²	53.1	0%	0.004	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.3	14.6	-177.4	-51.2	-70.4	0	0	0	114.2	V71 L82 L84 I92 D95 H99 L100 L106 L108 F121 L124	V71-F97 HydrophobicContact CG1-CD1 4.44Å; V71-F97 HydrophobicContact CG1-CE1 3.67Å; V71-F97 HydrophobicContact CG1-CZ 4.18Å; V71-F97 HydrophobicContact CG2-CE1 4.26Å; V71-F97 HydrophobicContact CG2-CZ 3.91Å; L82-F97 HydrophobicContact CD2-CD1 4.27Å; L82-F97 HydrophobicContact CD2-CE1 4.01Å; L84-F97 HydrophobicContact CD1-CE1 4.37Å; I92-F97 HydrophobicContact CG2-CE2 3.67Å; I92-F97 HydrophobicContact CG2-CZ 4.35Å; D95-F97 PolarHBondContact O-N 3.38Å; F97-H99 PolarHBondContact O-N 2.84Å; F97-L100 HydrophobicContact CB-CD1 4.23Å; F97-L100 HydrophobicContact CD1-CD1 3.94Å; F97-L100 WeakPolarHBondContact O-CB 3.23Å; F97-L100 PolarHBondContact O-N 2.84Å; F97-L106 HydrophobicContact CD2-CD2 4.16Å; F97-L106 HydrophobicContact CE1-CD1 4.17Å; F97-L106 HydrophobicContact CE1-CD2 4.36Å; F97-L106 HydrophobicContact CE2-CD2 3.91Å; F97-L106 HydrophobicContact CG-CD2 4.49Å; F97-L106 HydrophobicContact CZ-CD1 4.29Å; F97-L106 HydrophobicContact CZ-CD2 4.02Å; F97-L108 HydrophobicContact CE2-CD1 4.4Å; F97-L108 HydrophobicContact CZ-CD1 4.22Å; F97-L108 HydrophobicContact CZ-CD2 4.45Å; F97-F121 AromaticContact CD2-CD1 3.93Å; F97-F121 HydrophobicContact CD2-CD1 3.93Å; F97-F121 HydrophobicContact CD2-CE1 4.31Å; F97-F121 HydrophobicContact CE2-CD1 4.06Å; F97-F121 AromaticContact CE2-CE1 3.96Å; F97-F121 HydrophobicContact CE2-CE1 3.96Å; F97-L124 HydrophobicContact CB-CD1 3.93Å; F97-L124 HydrophobicContact CB-CD2 3.73Å; F97-L124 HydrophobicContact CB-CG 3.91Å; F97-L124 HydrophobicContact CD2-CD1 4.26Å; F97-L124 HydrophobicContact CG-CD1 4.3Å
98	K	92.8	Very high	96	Very high	100 Å²	100	53 Å²	53	44%	0.435	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.1	-35.4	-169.3	-170.4	-180	-161.8	153.8	0	115.4	D95 N122	D95-K98 HydrophobicContact CB-CB 4.04Å; D95-K98 HydrophobicContact CB-CD 4.07Å; D95-K98 WeakPolarHBondContact O-CB 3.1Å; D95-K98 PolarHBondContact O-N 3.35Å; D95-K98 WeakPolarHBondContact OD2-CD 3.36Å; D95-K98 WeakPolarHBondContact OD2-CE 3.48Å; D95-K98 IonicContact OD2-NZ 3.91Å; D95-K98 PolarHBondContact OD2-NZ 2.92Å; K98-N122 VanDerWaalsContact CA-O 3.3Å; K98-N122 WeakPolarHBondContact CA-O 3.38Å
99	H	91.7	Very high	96	Very high	138 Å²	138	49.8 Å²	49.8	64%	0.639	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-10.1	-174.6	-51.4	97.8	0	0	0	113.4	T77 F97 R101	T77-H99 HydrophobicContact CG2-CB 4.2Å; F97-H99 PolarHBondContact O-N 2.84Å; H99-R101 VanDerWaalsContact C-N 3.34Å; H99-R101 PolarHBondContact O-N 3.47Å; H99-R101 VanDerWaalsContact O-N 3.11Å
100	L	93.9	Very high	96	Very high	6 Å²	6	54.2 Å²	54.2	3%	0.031	26%	0.256	C	S	.	.			trans	-90.6	58.9	-170.9	-55.4	-178.5	0	0	0	112.5	I75 S76 L82 F97 H102 L103 L124	I75-L100 HydrophobicContact CB-CD2 4.24Å; I75-L100 HydrophobicContact CG2-CD1 4.1Å; I75-L100 HydrophobicContact CG2-CD2 3.75Å; S76-L100 VanDerWaalsContact O-CD2 3.3Å; S76-L100 WeakPolarHBondContact O-CD2 3.36Å; L82-L100 HydrophobicContact CD2-CD1 4.12Å; F97-L100 HydrophobicContact CB-CD1 4.23Å; F97-L100 HydrophobicContact CD1-CD1 3.94Å; F97-L100 WeakPolarHBondContact O-CB 3.23Å; F97-L100 PolarHBondContact O-N 2.84Å; L100-H102 PolarHBondContact O-N 2.91Å; L100-L103 HydrophobicContact CB-CB 4.01Å; L100-L103 HydrophobicContact CB-CD2 4.45Å; L100-L103 HydrophobicContact CD1-CD2 4.16Å; L100-L103 WeakPolarHBondContact O-CB 3.31Å; L100-L103 PolarHBondContact O-N 3.28Å; L100-L103 VanDerWaalsContact O-N 3.14Å; L100-L124 HydrophobicContact CB-CD2 3.93Å; L100-L124 WeakPolarHBondContact O-CD2 3.48Å
101	R	93.4	Very high	96	Very high	173 Å²	173	50.5 Å²	50.5	65%	0.653	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65	-24	-174.6	-61.7	-176.8	-178.5	180	-0.1	114.6	H99 S126	H99-R101 VanDerWaalsContact C-N 3.34Å; H99-R101 PolarHBondContact O-N 3.47Å; H99-R101 VanDerWaalsContact O-N 3.11Å; R101-S126 VanDerWaalsContact O-CB 3.22Å; R101-S126 WeakPolarHBondContact O-CB 3.43Å; R101-S126 PolarHBondContact O-N 2.87Å; R101-S126 PolarHBondContact O-OG 3.48Å
102	H	95.6	Very high	96	Very high	94 Å²	94	52.2 Å²	52.2	44%	0.435	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-0.1	179.6	-55.8	106.3	0	0	0	113.3	T77 T79 R80 L100 E104	T77-H102 PolarHBondContact O-ND1 2.98Å; T77-H102 VanDerWaalsContact O-ND1 3.09Å; T79-H102 CarbonylContact O-C 3.26Å; R80-H102 HydrophobicContact CG-CB 4.44Å; L100-H102 PolarHBondContact O-N 2.91Å; H102-E104 PolarHBondContact O-N 2.97Å
103	L	97.2	Very high	96.1	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	24%	0.244	C	C	.	.			trans	-67.3	123.6	-177.1	-165.6	72.6	0	0	0	110.1	T79 L82 L100 L106 L124 S126 L127	T79-L103 HydrophobicContact CG2-CD1 3.79Å; T79-L103 WeakPolarHBondContact O-CA 3.44Å; T79-L103 PolarHBondContact O-N 2.81Å; L82-L103 HydrophobicContact CB-CD1 3.67Å; L82-L103 HydrophobicContact CB-CD2 4.42Å; L100-L103 HydrophobicContact CB-CB 4.01Å; L100-L103 HydrophobicContact CB-CD2 4.45Å; L100-L103 HydrophobicContact CD1-CD2 4.16Å; L100-L103 WeakPolarHBondContact O-CB 3.31Å; L100-L103 PolarHBondContact O-N 3.28Å; L100-L103 VanDerWaalsContact O-N 3.14Å; L103-L106 HydrophobicContact CD2-CB 3.97Å; L103-L106 HydrophobicContact CD2-CD1 4.25Å; L103-L106 HydrophobicContact CD2-CD2 4.39Å; L103-L106 HydrophobicContact CD2-CG 4.44Å; L103-L124 HydrophobicContact CB-CD2 3.97Å; L103-L124 HydrophobicContact CD2-CD2 3.77Å; L103-S126 CarbonylContact O-C 3.56Å; L103-L127 HydrophobicContact CD2-CD1 4.12Å; L103-L127 HydrophobicContact CG-CD1 4.18Å; L103-L127 WeakPolarHBondContact O-CA 3.42Å; L103-L127 PolarHBondContact O-N 3.3Å
104	E	97.8	Very high	96.2	Very high	72 Å²	72	54.8 Å²	54.8	34%	0.336	25%	0.251	S	S	.	.			trans	-103.8	-38.4	-179.5	-65.7	173.2	-157.7	0	0	110.8	R80 H102 N128 T129	R80-E104 WeakPolarHBondContact CD-OE1 3.29Å; R80-E104 IonicContact CZ-OE1 3.69Å; R80-E104 IonicContact NE-OE1 2.97Å; R80-E104 IonicContact NH1-OE1 3.76Å; R80-E104 PolarHBondContact NH1-OE1 2.79Å; R80-E104 PolarHBondContact O-N 2.77Å; H102-E104 PolarHBondContact O-N 2.97Å; E104-N128 WeakPolarHBondContact O-CA 3.27Å; E104-N128 WeakPolarHBondContact O-CB 3.4Å; E104-N128 PolarHBondContact O-N 2.93Å; E104-T129 PolarHBondContact O-N 2.88Å
105	I	98.5	Very high	96.2	Very high	53 Å²	53	57 Å²	57	27%	0.272	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	122.2	-176.7	-57.1	175.2	0	0	0	109.7	R80 Y81 L82 Q107	R80-I105 PolarHBondContact O-N 3.34Å; Y81-I105 HydrophobicContact CD2-CB 3.86Å; Y81-I105 HydrophobicContact CD2-CD1 4.14Å; Y81-I105 HydrophobicContact CD2-CG2 3.83Å; Y81-I105 HydrophobicContact CE2-CG2 4Å; L82-I105 PolarHBondContact N-O 2.76Å; I105-Q107 HydrophobicContact CG2-CG 4.04Å
106	L	98.3	Very high	96.4	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	113.5	175.6	178.1	54.8	0	0	0	110.3	L82 F97 L103 L108 F121 L124 L127 T129 L130 E131	L82-L106 HydrophobicContact CB-CD1 4.16Å; L82-L106 HydrophobicContact CD2-CD1 3.82Å; L82-L106 HydrophobicContact CG-CD1 4.06Å; F97-L106 HydrophobicContact CD2-CD2 4.16Å; F97-L106 HydrophobicContact CE1-CD1 4.17Å; F97-L106 HydrophobicContact CE1-CD2 4.36Å; F97-L106 HydrophobicContact CE2-CD2 3.91Å; F97-L106 HydrophobicContact CG-CD2 4.49Å; F97-L106 HydrophobicContact CZ-CD1 4.29Å; F97-L106 HydrophobicContact CZ-CD2 4.02Å; L103-L106 HydrophobicContact CD2-CB 3.97Å; L103-L106 HydrophobicContact CD2-CD1 4.25Å; L103-L106 HydrophobicContact CD2-CD2 4.39Å; L103-L106 HydrophobicContact CD2-CG 4.44Å; L106-L108 HydrophobicContact CD1-CD1 4.31Å; L106-L108 HydrophobicContact CD1-CG 4.08Å; L106-L108 HydrophobicContact CD2-CD1 3.89Å; L106-L108 HydrophobicContact CG-CD1 3.96Å; L106-L108 HydrophobicContact CG-CG 4.07Å; L106-F121 HydrophobicContact CD2-CD1 4.23Å; L106-F121 HydrophobicContact CD2-CE1 4.03Å; L106-L124 HydrophobicContact CD2-CD1 4.1Å; L106-L127 HydrophobicContact CB-CD1 3.74Å; L106-T129 PolarHBondContact N-O 3.29Å; L106-L130 HydrophobicContact CB-CD1 4.11Å; L106-L130 HydrophobicContact CD2-CD1 3.92Å; L106-L130 HydrophobicContact CG-CD1 4Å; L106-E131 PolarHBondContact O-N 2.99Å
107	Q	98.5	Very high	96.5	Very high	22 Å²	22	56 Å²	56	10%	0.103	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	109.5	178	-54.2	-172.7	-56.2	0	0	111.2	Y81 L82 N83 L84 I105 E131	Y81-Q107 VanDerWaalsContact CZ-OE1 3.32Å; Y81-Q107 PolarHBondContact OH-OE1 3.34Å; L82-Q107 PolarHBondContact O-N 3.45Å; N83-Q107 VanDerWaalsContact CG-OE1 3.25Å; N83-Q107 PolarHBondContact ND2-OE1 3.46Å; L84-Q107 WeakPolarHBondContact CA-O 3.3Å; L84-Q107 WeakPolarHBondContact CB-O 3.23Å; L84-Q107 PolarHBondContact N-O 3.32Å; I105-Q107 HydrophobicContact CG2-CG 4.04Å; Q107-E131 HydrophobicContact CG-CG 4.49Å; Q107-E131 WeakPolarHBondContact CG-OE2 3.29Å; Q107-E131 VanDerWaalsContact NE2-CD 3.29Å; Q107-E131 PolarHBondContact NE2-OE1 3.5Å; Q107-E131 PolarHBondContact NE2-OE2 3.38Å
108	L	98.1	Very high	96.4	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	28%	0.276	C	S	.	.			trans	-117.7	16.8	177.8	-73.3	167.8	0	0	0	111.6	L84 I89 I92 F97 L106 N111 I113 F121 L130 E131 L132 N135	L84-L108 HydrophobicContact CB-CD2 3.98Å; L84-L108 HydrophobicContact CD1-CD2 3.82Å; I89-L108 HydrophobicContact CD1-CD2 4.5Å; I92-L108 HydrophobicContact CD1-CD1 4.3Å; I92-L108 HydrophobicContact CD1-CD2 4.15Å; F97-L108 HydrophobicContact CE2-CD1 4.4Å; F97-L108 HydrophobicContact CZ-CD1 4.22Å; F97-L108 HydrophobicContact CZ-CD2 4.45Å; L106-L108 HydrophobicContact CD1-CD1 4.31Å; L106-L108 HydrophobicContact CD1-CG 4.08Å; L106-L108 HydrophobicContact CD2-CD1 3.89Å; L106-L108 HydrophobicContact CG-CD1 3.96Å; L106-L108 HydrophobicContact CG-CG 4.07Å; L108-N111 PolarHBondContact O-ND2 2.89Å; L108-N111 VanDerWaalsContact O-ND2 3.1Å; L108-I113 HydrophobicContact CB-CD1 3.9Å; L108-I113 HydrophobicContact CD2-CD1 4.4Å; L108-F121 HydrophobicContact CD1-CE1 4.15Å; L108-L130 HydrophobicContact CD1-CD1 4.5Å; L108-E131 CarbonylContact C-O 3.57Å; L108-E131 WeakPolarHBondContact CA-O 3.47Å; L108-E131 WeakPolarHBondContact CB-O 3.44Å; L108-E131 PolarHBondContact N-O 2.88Å; L108-L132 HydrophobicContact CB-CD2 3.84Å; L108-L132 HydrophobicContact CD1-CD2 4.03Å; L108-N135 PolarHBondContact O-ND2 3.45Å
109	S	97.9	Very high	96.4	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	26%	0.26	C	S	.	.			trans	-68.3	158.7	-177.6	49.7	0	0	0	0	113.7	Q85 E86 N111 E131 F133	Q85-S109 VanDerWaalsContact CA-O 3.26Å; Q85-S109 WeakPolarHBondContact CA-O 3.49Å; E86-S109 PolarHBondContact N-O 3.22Å; S109-N111 VanDerWaalsContact C-N 3.28Å; S109-N111 PolarHBondContact O-N 3.46Å; S109-N111 PolarHBondContact O-ND2 3.44Å; S109-N111 VanDerWaalsContact O-ND2 3.12Å; S109-E131 PolarHBondContact N-O 3.38Å; S109-F133 CarbonylContact C-O 3.45Å; S109-F133 WeakPolarHBondContact CA-O 3.28Å; S109-F133 VanDerWaalsContact CB-CD2 3.41Å; S109-F133 WeakPolarHBondContact CB-O 3Å; S109-F133 WeakPolarHBondContact OG-CZ 3.34Å
110	K	97.9	Very high	96.6	Very high	93 Å²	93	51.2 Å²	51.2	40%	0.404	23%	0.229	S	C	.	.	S	Bend	trans	51.8	45.7	179.8	-63.4	176.3	173	173.5	0	112.7	E86 F133 D134	E86-K110 VanDerWaalsContact CA-O 3.3Å; E86-K110 WeakPolarHBondContact CA-O 3.26Å; E86-K110 HydrophobicContact CG-CB 3.92Å; E86-K110 HydrophobicContact CG-CD 3.58Å; E86-K110 HydrophobicContact CG-CG 4.46Å; E86-K110 PolarHBondContact N-O 3.01Å; E86-K110 WeakPolarHBondContact OE1-CD 3.49Å; E86-K110 IonicContact OE1-NZ 2.86Å; E86-K110 PolarHBondContact OE1-NZ 2.84Å; K110-F133 PolarHBondContact N-O 2.92Å; K110-D134 VanDerWaalsContact CA-O 3.23Å; K110-D134 WeakPolarHBondContact CA-O 3.31Å; K110-D134 HydrophobicContact CB-CB 4.39Å; K110-D134 HydrophobicContact CG-CB 3.72Å; K110-D134 PolarHBondContact N-O 3.49Å
111	N	98.3	Very high	96.7	Very high	5 Å²	5	51 Å²	51	3%	0.027	23%	0.228	C	C	.	.	S	Bend	trans	-112.8	-170.8	173.2	-86.4	-81.2	0	0	0	109.9	L84 N87 I89 L108 S109 I113 D134 N135	L84-N111 PolarHBondContact O-ND2 2.94Å; N87-N111 WeakPolarHBondContact CA-OD1 3.43Å; N87-N111 WeakPolarHBondContact CB-OD1 3.43Å; N87-N111 PolarHBondContact O-OD1 2.84Å; I89-N111 HydrophobicContact CB-CB 4.4Å; I89-N111 WeakPolarHBondContact CB-OD1 3.47Å; I89-N111 WeakPolarHBondContact CG1-OD1 3.45Å; I89-N111 PolarHBondContact N-OD1 3.04Å; L108-N111 PolarHBondContact O-ND2 2.89Å; L108-N111 VanDerWaalsContact O-ND2 3.1Å; S109-N111 VanDerWaalsContact C-N 3.28Å; S109-N111 PolarHBondContact O-N 3.46Å; S109-N111 PolarHBondContact O-ND2 3.44Å; S109-N111 VanDerWaalsContact O-ND2 3.12Å; N111-I113 HydrophobicContact CB-CD1 4.03Å; N111-I113 HydrophobicContact CB-CG1 3.82Å; N111-D134 PolarHBondContact N-O 2.91Å; N111-N135 WeakPolarHBondContact CA-OD1 3.33Å; N111-N135 WeakPolarHBondContact CB-OD1 3.11Å; N111-N135 PolarHBondContact N-OD1 3.36Å; N111-N135 PolarHBondContact O-OD1 2.93Å
112	H	97.8	Very high	96.7	Very high	75 Å²	75	44.6 Å²	44.6	35%	0.347	21%	0.207	S	C	.	.			trans	-108.1	28.1	176.4	-68.3	76.6	0	0	0	111.3	L88 I89 Q90 R114	L88-H112 VanDerWaalsContact CD2-CE1 3.48Å; L88-H112 WeakPolarHBondContact CD2-CE1 3.34Å; I89-H112 CarbonylContact O-C 3.56Å; I89-H112 VanDerWaalsContact O-CA 3.27Å; I89-H112 WeakPolarHBondContact O-CA 3.44Å; I89-H112 PolarHBondContact O-N 2.91Å; Q90-H112 WeakPolarHBondContact CA-O 3.3Å; Q90-H112 HydrophobicContact CG-CB 4.06Å; H112-R114 PolarHBondContact O-N 2.8Å; H112-R114 VanDerWaalsContact O-N 3.1Å
113	I	98.4	Very high	96.4	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.202	C	C	.	.			trans	-67.2	114.8	-169.9	-58.1	167.3	0	0	0	108.8	I89 Q90 I92 L108 N111 I116 L132 N135 R136 L137	I89-I113 HydrophobicContact CB-CG1 4.48Å; I89-I113 HydrophobicContact CG2-CG1 4.34Å; I89-I113 WeakPolarHBondContact O-CG1 3.44Å; I89-I113 PolarHBondContact O-N 3.45Å; Q90-I113 WeakPolarHBondContact O-CA 3.23Å; I92-I113 HydrophobicContact CD1-CD1 3.99Å; I92-I113 HydrophobicContact CD1-CG1 4.37Å; I92-I113 HydrophobicContact CG1-CD1 4.17Å; I92-I113 HydrophobicContact CG1-CG2 4.19Å; L108-I113 HydrophobicContact CB-CD1 3.9Å; L108-I113 HydrophobicContact CD2-CD1 4.4Å; N111-I113 HydrophobicContact CB-CD1 4.03Å; N111-I113 HydrophobicContact CB-CG1 3.82Å; I113-I116 HydrophobicContact CG2-CD1 4.24Å; I113-I116 HydrophobicContact CG2-CG1 3.8Å; I113-L132 HydrophobicContact CD1-CD2 4.15Å; I113-N135 HydrophobicContact CB-CB 4.27Å; I113-N135 VanDerWaalsContact CB-OD1 3.27Å; I113-N135 WeakPolarHBondContact CB-OD1 3.34Å; I113-N135 VanDerWaalsContact CG1-OD1 3.29Å; I113-N135 WeakPolarHBondContact CG1-OD1 3.41Å; I113-N135 PolarHBondContact N-OD1 3Å; I113-R136 CarbonylContact O-C 3.23Å; I113-R136 VanDerWaalsContact O-CA 3.26Å; I113-R136 WeakPolarHBondContact O-CA 3.17Å; I113-R136 PolarHBondContact O-N 3.04Å; I113-L137 HydrophobicContact CG2-CD2 4.04Å; I113-L137 PolarHBondContact O-N 2.94Å
114	R	97	Very high	96.4	Very high	152 Å²	152	41.8 Å²	41.8	57%	0.574	20%	0.202	S	C	*	.			trans	-107	-22.8	178.4	57.1	174	175.7	175.8	-1.9	113	Q90 H112 R136	Q90-R114 VanDerWaalsContact O-CG 3.31Å; Q90-R114 WeakPolarHBondContact O-CG 3.25Å; Q90-R114 PolarHBondContact O-N 3Å; H112-R114 PolarHBondContact O-N 2.8Å; H112-R114 VanDerWaalsContact O-N 3.1Å; R114-R136 HydrophobicContact CB-CB 4.35Å
115	K	96.3	Very high	96.1	Very high	118 Å²	118	40.8 Å²	40.8	51%	0.513	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	134.8	-177.8	-172.2	-178.3	179.4	-166.3	0	110.3	V91 I92	V91-K115 WeakPolarHBondContact CA-O 3.49Å; V91-K115 HydrophobicContact CG1-CB 4.49Å; V91-K115 HydrophobicContact CG2-CB 4.48Å; I92-K115 PolarHBondContact N-O 3.09Å; I92-K115 VanDerWaalsContact N-O 3.16Å
116	I	97.2	Very high	96	Very high	17 Å²	17	39.8 Å²	39.8	9%	0.087	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	122.1	169.6	-64.5	169.4	0	0	0	106	I92 I113 A120 F121 L132 L137 P141 A144	I92-I116 HydrophobicContact CB-CG1 4.3Å; I92-I116 HydrophobicContact CB-CG2 4.44Å; I92-I116 HydrophobicContact CG1-CG1 4.12Å; I113-I116 HydrophobicContact CG2-CD1 4.24Å; I113-I116 HydrophobicContact CG2-CG1 3.8Å; I116-A120 HydrophobicContact CG2-CB 3.6Å; I116-F121 HydrophobicContact CD1-CE2 4.38Å; I116-F121 HydrophobicContact CD1-CZ 4.19Å; I116-F121 HydrophobicContact CG2-CD2 4.46Å; I116-F121 HydrophobicContact CG2-CE2 3.74Å; I116-F121 HydrophobicContact CG2-CZ 4.05Å; I116-L132 HydrophobicContact CD1-CD1 3.88Å; I116-L132 HydrophobicContact CD1-CD2 3.96Å; I116-L137 HydrophobicContact CD1-CD1 4.14Å; I116-L137 HydrophobicContact CD1-CD2 4.07Å; I116-L137 HydrophobicContact CG1-CD2 4.21Å; I116-P141 HydrophobicContact CB-CB 4.1Å; I116-P141 HydrophobicContact CB-CG 4.37Å; I116-P141 HydrophobicContact CD1-CG 4.02Å; I116-P141 HydrophobicContact CG2-CB 4.48Å; I116-A144 HydrophobicContact CG2-CB 3.59Å
117	E	95	Very high	96	Very high	58 Å²	58	39.8 Å²	39.8	27%	0.271	20%	0.204	S	C	.	.			trans	-76.2	157.8	-178	-63.2	-174	153.3	0	0	111.9	V91 I92 K93 V94 G119 A120	V91-E117 HydrophobicContact CG1-CG 4.41Å; I92-E117 PolarHBondContact O-N 2.77Å; I92-E117 VanDerWaalsContact O-N 3.07Å; K93-E117 VanDerWaalsContact CA-OE2 3.3Å; K93-E117 WeakPolarHBondContact CA-OE2 3.44Å; V94-E117 HydrophobicContact CG2-CB 3.74Å; V94-E117 WeakPolarHBondContact CG2-OE2 3.4Å; V94-E117 PolarHBondContact N-OE2 3.42Å; E117-G119 PolarHBondContact O-N 2.99Å; E117-A120 WeakPolarHBondContact O-CB 3.3Å; E117-A120 PolarHBondContact O-N 2.81Å
118	L	93.6	Very high	95.9	Very high	128 Å²	128	41.1 Å²	41.1	67%	0.67	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.9	128.9	175.5	-62.6	171.4	0	0	0	109.3	V94 A120	V94-L118 WeakPolarHBondContact CG2-O 3.45Å; L118-A120 VanDerWaalsContact C-N 3.27Å; L118-A120 PolarHBondContact O-N 3.31Å
119	G	91.9	Very high	96	Very high	9 Å²	9	41.6 Å²	41.6	9%	0.093	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.1	14.9	-175.7	0	0	0	0	0	115.5	D95 E117 F121 N122	D95-G119 PolarHBondContact N-O 3.44Å; E117-G119 PolarHBondContact O-N 2.99Å; G119-F121 PolarHBondContact O-N 3.29Å; G119-F121 VanDerWaalsContact O-N 3.17Å; G119-N122 VanDerWaalsContact CA-CG 3.48Å; G119-N122 WeakPolarHBondContact CA-ND2 3.26Å; G119-N122 VanDerWaalsContact CA-OD1 3.25Å; G119-N122 WeakPolarHBondContact CA-OD1 3.44Å; G119-N122 VanDerWaalsContact O-CB 3.32Å; G119-N122 WeakPolarHBondContact O-CB 3.49Å; G119-N122 PolarHBondContact O-N 3.12Å; G119-N122 VanDerWaalsContact O-N 3.11Å; G119-N122 PolarHBondContact O-ND2 2.86Å
120	A	95.8	Very high	96	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-33.2	172.3	0	0	0	0	0	113.3	I92 I116 E117 L118	I92-A120 HydrophobicContact CB-CB 4.34Å; I92-A120 HydrophobicContact CG2-CB 3.77Å; I116-A120 HydrophobicContact CG2-CB 3.6Å; E117-A120 WeakPolarHBondContact O-CB 3.3Å; E117-A120 PolarHBondContact O-N 2.81Å; L118-A120 VanDerWaalsContact C-N 3.27Å; L118-A120 PolarHBondContact O-N 3.31Å
121	F	96.1	Very high	96	Very high	3 Å²	3	38.6 Å²	38.6	1%	0.013	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	17.8	-178.8	-57.8	-56.2	0	0	0	113.7	F97 L106 L108 I116 G119 L124 L130 L132 A144 F145 L148	F97-F121 AromaticContact CD2-CD1 3.93Å; F97-F121 HydrophobicContact CD2-CD1 3.93Å; F97-F121 HydrophobicContact CD2-CE1 4.31Å; F97-F121 HydrophobicContact CE2-CD1 4.06Å; F97-F121 AromaticContact CE2-CE1 3.96Å; F97-F121 HydrophobicContact CE2-CE1 3.96Å; L106-F121 HydrophobicContact CD2-CD1 4.23Å; L106-F121 HydrophobicContact CD2-CE1 4.03Å; L108-F121 HydrophobicContact CD1-CE1 4.15Å; I116-F121 HydrophobicContact CD1-CE2 4.38Å; I116-F121 HydrophobicContact CD1-CZ 4.19Å; I116-F121 HydrophobicContact CG2-CD2 4.46Å; I116-F121 HydrophobicContact CG2-CE2 3.74Å; I116-F121 HydrophobicContact CG2-CZ 4.05Å; G119-F121 PolarHBondContact O-N 3.29Å; G119-F121 VanDerWaalsContact O-N 3.17Å; F121-L124 HydrophobicContact CB-CD1 4Å; F121-L124 HydrophobicContact CD1-CD1 3.95Å; F121-L124 HydrophobicContact CG-CD1 4.42Å; F121-L124 WeakPolarHBondContact O-CB 3.32Å; F121-L124 WeakPolarHBondContact O-CG 3.23Å; F121-L124 PolarHBondContact O-N 3.42Å; F121-L130 HydrophobicContact CD2-CD2 4.43Å; F121-L130 HydrophobicContact CE1-CD1 4.23Å; F121-L130 HydrophobicContact CE1-CD2 4.43Å; F121-L130 HydrophobicContact CE2-CD2 3.99Å; F121-L130 HydrophobicContact CZ-CD1 4.32Å; F121-L130 HydrophobicContact CZ-CD2 4Å; F121-L132 HydrophobicContact CZ-CD1 4.41Å; F121-A144 HydrophobicContact CD2-CB 3.87Å; F121-A144 WeakPolarHBondContact CD2-O 3.29Å; F121-A144 HydrophobicContact CE2-CB 4.02Å; F121-F145 HydrophobicContact CD2-CD1 4.42Å; F121-F145 HydrophobicContact CE2-CE1 4.26Å; F121-L148 HydrophobicContact CB-CD1 4.2Å; F121-L148 HydrophobicContact CB-CD2 4.15Å; F121-L148 HydrophobicContact CB-CG 4.46Å; F121-L148 HydrophobicContact CD2-CD1 4.36Å; F121-L148 HydrophobicContact CG-CD1 4.49Å
122	N	93.1	Very high	96	Very high	38 Å²	38	38.3 Å²	38.3	20%	0.203	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	146.6	176.1	-74.8	-12.8	0	0	0	111.7	D95 K98 G119 L124 Y147	D95-N122 VanDerWaalsContact OD1-CB 3.27Å; D95-N122 WeakPolarHBondContact OD1-CB 3.45Å; D95-N122 PolarHBondContact OD1-ND2 3.35Å; K98-N122 VanDerWaalsContact CA-O 3.3Å; K98-N122 WeakPolarHBondContact CA-O 3.38Å; G119-N122 VanDerWaalsContact CA-CG 3.48Å; G119-N122 WeakPolarHBondContact CA-ND2 3.26Å; G119-N122 VanDerWaalsContact CA-OD1 3.25Å; G119-N122 WeakPolarHBondContact CA-OD1 3.44Å; G119-N122 VanDerWaalsContact O-CB 3.32Å; G119-N122 WeakPolarHBondContact O-CB 3.49Å; G119-N122 PolarHBondContact O-N 3.12Å; G119-N122 VanDerWaalsContact O-N 3.11Å; G119-N122 PolarHBondContact O-ND2 2.86Å; N122-L124 PolarHBondContact O-N 2.93Å; N122-Y147 WeakPolarHBondContact OD1-CD2 3.35Å
123	G	90.8	Very high	96	Very high	31 Å²	31	36.2 Å²	36.2	32%	0.32	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.3	-9.1	177.9	0	0	0	0	0	115.4	A125	G123-A125 PolarHBondContact O-N 2.92Å
124	L	95.4	Very high	96	Very high	3 Å²	3	37.9 Å²	37.9	2%	0.016	20%	0.2	C	C	.	.			trans	-78.6	56.5	179.7	-66.6	-173.7	0	0	0	113.3	F97 L100 L103 L106 F121 N122 S126 L127 L148	F97-L124 HydrophobicContact CB-CD1 3.93Å; F97-L124 HydrophobicContact CB-CD2 3.73Å; F97-L124 HydrophobicContact CB-CG 3.91Å; F97-L124 HydrophobicContact CD2-CD1 4.26Å; F97-L124 HydrophobicContact CG-CD1 4.3Å; L100-L124 HydrophobicContact CB-CD2 3.93Å; L100-L124 WeakPolarHBondContact O-CD2 3.48Å; L103-L124 HydrophobicContact CB-CD2 3.97Å; L103-L124 HydrophobicContact CD2-CD2 3.77Å; L106-L124 HydrophobicContact CD2-CD1 4.1Å; F121-L124 HydrophobicContact CB-CD1 4Å; F121-L124 HydrophobicContact CD1-CD1 3.95Å; F121-L124 HydrophobicContact CG-CD1 4.42Å; F121-L124 WeakPolarHBondContact O-CB 3.32Å; F121-L124 WeakPolarHBondContact O-CG 3.23Å; F121-L124 PolarHBondContact O-N 3.42Å; N122-L124 PolarHBondContact O-N 2.93Å; L124-S126 PolarHBondContact O-N 3.38Å; L124-L127 HydrophobicContact CB-CB 4.03Å; L124-L127 HydrophobicContact CB-CD2 4.45Å; L124-L127 HydrophobicContact CD1-CD1 4.47Å; L124-L127 HydrophobicContact CD1-CD2 3.93Å; L124-L127 WeakPolarHBondContact O-CB 3.12Å; L124-L127 PolarHBondContact O-N 3.21Å; L124-L148 HydrophobicContact CB-CD2 3.92Å
125	A	92.4	Very high	96.1	Very high	52 Å²	52	30.9 Å²	30.9	43%	0.43	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-18.1	-173.6	0	0	0	0	0	115	G123 K150	G123-A125 PolarHBondContact O-N 2.92Å; A125-K150 WeakPolarHBondContact O-CD 3.27Å
126	S	96	Very high	96.2	Very high	31 Å²	31	32.3 Å²	32.3	22%	0.217	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.4	1.8	179.6	-56.4	0	0	0	0	113.9	R101 L103 L124 N128	R101-S126 VanDerWaalsContact O-CB 3.22Å; R101-S126 WeakPolarHBondContact O-CB 3.43Å; R101-S126 PolarHBondContact O-N 2.87Å; R101-S126 PolarHBondContact O-OG 3.48Å; L103-S126 CarbonylContact O-C 3.56Å; L124-S126 PolarHBondContact O-N 3.38Å; S126-N128 PolarHBondContact O-N 3.42Å
127	L	97.7	Very high	96.2	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.173	C	C	.	.			trans	-66.9	124.8	-171.7	-165.2	75.5	0	0	0	110.6	L103 L106 L124 L130 L148 K150 L151	L103-L127 HydrophobicContact CD2-CD1 4.12Å; L103-L127 HydrophobicContact CG-CD1 4.18Å; L103-L127 WeakPolarHBondContact O-CA 3.42Å; L103-L127 PolarHBondContact O-N 3.3Å; L106-L127 HydrophobicContact CB-CD1 3.74Å; L124-L127 HydrophobicContact CB-CB 4.03Å; L124-L127 HydrophobicContact CB-CD2 4.45Å; L124-L127 HydrophobicContact CD1-CD1 4.47Å; L124-L127 HydrophobicContact CD1-CD2 3.93Å; L124-L127 WeakPolarHBondContact O-CB 3.12Å; L124-L127 PolarHBondContact O-N 3.21Å; L127-L130 HydrophobicContact CD2-CB 4.19Å; L127-L148 HydrophobicContact CB-CD2 4.33Å; L127-L148 HydrophobicContact CD2-CD1 4.47Å; L127-L148 HydrophobicContact CD2-CD2 3.97Å; L127-K150 CarbonylContact O-C 3.58Å; L127-L151 HydrophobicContact CD2-CD1 4.03Å; L127-L151 HydrophobicContact CG-CD1 4.16Å; L127-L151 VanDerWaalsContact O-CA 3.28Å; L127-L151 WeakPolarHBondContact O-CA 3.14Å; L127-L151 PolarHBondContact O-N 3.1Å; L127-L151 VanDerWaalsContact O-N 3.12Å
128	N	98	Very high	96.3	Very high	51 Å²	51	31.8 Å²	31.8	27%	0.273	18%	0.177	S	C	.	.			trans	-109.7	-42.1	-176.7	-175	26.5	0	0	0	111.1	E104 S126 K152 E153	E104-N128 WeakPolarHBondContact O-CA 3.27Å; E104-N128 WeakPolarHBondContact O-CB 3.4Å; E104-N128 PolarHBondContact O-N 2.93Å; S126-N128 PolarHBondContact O-N 3.42Å; N128-K152 PolarHBondContact O-N 3.02Å; N128-K152 VanDerWaalsContact OD1-CB 3.25Å; N128-K152 WeakPolarHBondContact OD1-CB 3.48Å; N128-K152 VanDerWaalsContact OD1-CD 3.22Å; N128-K152 WeakPolarHBondContact OD1-CD 3.26Å; N128-K152 WeakPolarHBondContact OD1-CG 3.45Å; N128-E153 PolarHBondContact O-N 2.73Å
129	T	98.6	Very high	96.4	Very high	10 Å²	10	29.5 Å²	29.5	6%	0.061	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	125.5	-177.8	-57.1	0	0	0	0	110.8	E104 L106 E131 E153	E104-T129 PolarHBondContact O-N 2.88Å; L106-T129 PolarHBondContact N-O 3.29Å; T129-E131 HydrophobicContact CG2-CG 4.33Å; T129-E153 WeakPolarHBondContact CA-O 3.49Å; T129-E153 HydrophobicContact CG2-CB 4Å; T129-E153 PolarHBondContact OG1-OE2 3.47Å; T129-E153 VanDerWaalsContact OG1-OE2 3.1Å
130	L	98.3	Very high	96.7	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	115.9	174.8	177.9	58.2	0	0	0	110.4	L106 L108 F121 L127 L132 F145 L151 E153 L154 W155	L106-L130 HydrophobicContact CB-CD1 4.11Å; L106-L130 HydrophobicContact CD2-CD1 3.92Å; L106-L130 HydrophobicContact CG-CD1 4Å; L108-L130 HydrophobicContact CD1-CD1 4.5Å; F121-L130 HydrophobicContact CD2-CD2 4.43Å; F121-L130 HydrophobicContact CE1-CD1 4.23Å; F121-L130 HydrophobicContact CE1-CD2 4.43Å; F121-L130 HydrophobicContact CE2-CD2 3.99Å; F121-L130 HydrophobicContact CZ-CD1 4.32Å; F121-L130 HydrophobicContact CZ-CD2 4Å; L127-L130 HydrophobicContact CD2-CB 4.19Å; L130-L132 HydrophobicContact CD1-CD1 4.44Å; L130-L132 HydrophobicContact CD1-CG 4.22Å; L130-L132 HydrophobicContact CD2-CD1 3.93Å; L130-L132 HydrophobicContact CG-CD1 4.04Å; L130-L132 HydrophobicContact CG-CG 4.13Å; L130-F145 HydrophobicContact CD2-CE1 4.25Å; L130-L151 HydrophobicContact CB-CD1 3.86Å; L130-E153 PolarHBondContact N-O 2.65Å; L130-L154 HydrophobicContact CB-CD1 4.19Å; L130-L154 HydrophobicContact CD2-CD1 3.98Å; L130-L154 HydrophobicContact CG-CD1 4.09Å; L130-W155 PolarHBondContact O-N 3.38Å
131	E	98.6	Very high	96.5	Very high	29 Å²	29	30.2 Å²	30.2	14%	0.136	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	116.2	177.1	-65.7	172.8	-154	0	0	111.4	L106 Q107 L108 S109 T129 F133 W155	L106-E131 PolarHBondContact O-N 2.99Å; Q107-E131 HydrophobicContact CG-CG 4.49Å; Q107-E131 WeakPolarHBondContact CG-OE2 3.29Å; Q107-E131 VanDerWaalsContact NE2-CD 3.29Å; Q107-E131 PolarHBondContact NE2-OE1 3.5Å; Q107-E131 PolarHBondContact NE2-OE2 3.38Å; L108-E131 CarbonylContact C-O 3.57Å; L108-E131 WeakPolarHBondContact CA-O 3.47Å; L108-E131 WeakPolarHBondContact CB-O 3.44Å; L108-E131 PolarHBondContact N-O 2.88Å; S109-E131 PolarHBondContact N-O 3.38Å; T129-E131 HydrophobicContact CG2-CG 4.33Å; E131-F133 HydrophobicContact CB-CD1 3.96Å; E131-F133 HydrophobicContact CB-CE1 3.87Å; E131-F133 HydrophobicContact CG-CD1 4.26Å; E131-F133 HydrophobicContact CG-CE1 3.92Å; E131-F133 VanDerWaalsContact OE2-CE1 3.24Å; E131-F133 WeakPolarHBondContact OE2-CE1 3.35Å; E131-W155 HydrophobicContact CG-CB 4.4Å; E131-W155 HydrophobicContact CG-CG 4.14Å
132	L	98.1	Very high	96.2	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.191	C	C	.	.			trans	-124.9	14.9	178.9	-74.2	168.9	0	0	0	112.3	L108 I113 I116 F121 L130 N135 W155 L156 N159	L108-L132 HydrophobicContact CB-CD2 3.84Å; L108-L132 HydrophobicContact CD1-CD2 4.03Å; I113-L132 HydrophobicContact CD1-CD2 4.15Å; I116-L132 HydrophobicContact CD1-CD1 3.88Å; I116-L132 HydrophobicContact CD1-CD2 3.96Å; F121-L132 HydrophobicContact CZ-CD1 4.41Å; L130-L132 HydrophobicContact CD1-CD1 4.44Å; L130-L132 HydrophobicContact CD1-CG 4.22Å; L130-L132 HydrophobicContact CD2-CD1 3.93Å; L130-L132 HydrophobicContact CG-CD1 4.04Å; L130-L132 HydrophobicContact CG-CG 4.13Å; L132-N135 WeakPolarHBondContact O-CB 3.24Å; L132-N135 PolarHBondContact O-ND2 3.45Å; L132-W155 CarbonylContact C-O 2.99Å; L132-W155 WeakPolarHBondContact CA-O 3.25Å; L132-W155 PolarHBondContact N-O 2.89Å; L132-L156 HydrophobicContact CB-CD2 3.83Å; L132-L156 HydrophobicContact CD1-CD2 4.04Å; L132-N159 PolarHBondContact O-ND2 2.96Å
133	F	98.3	Very high	95.9	Very high	31 Å²	31	32.8 Å²	32.8	14%	0.136	19%	0.188	C	C	.	.			trans	-69.5	158.9	-177.9	64.3	-104.9	0	0	0	113.7	S109 K110 E131 N135 W155 R157	S109-F133 CarbonylContact C-O 3.45Å; S109-F133 WeakPolarHBondContact CA-O 3.28Å; S109-F133 VanDerWaalsContact CB-CD2 3.41Å; S109-F133 WeakPolarHBondContact CB-O 3Å; S109-F133 WeakPolarHBondContact OG-CZ 3.34Å; K110-F133 PolarHBondContact N-O 2.92Å; E131-F133 HydrophobicContact CB-CD1 3.96Å; E131-F133 HydrophobicContact CB-CE1 3.87Å; E131-F133 HydrophobicContact CG-CD1 4.26Å; E131-F133 HydrophobicContact CG-CE1 3.92Å; E131-F133 VanDerWaalsContact OE2-CE1 3.24Å; E131-F133 WeakPolarHBondContact OE2-CE1 3.35Å; F133-N135 PolarHBondContact O-ND2 3.26Å; F133-W155 HydrophobicContact CD1-CB 3.98Å; F133-W155 PolarHBondContact N-O 2.69Å; F133-R157 CarbonylContact C-O 3.55Å; F133-R157 WeakPolarHBondContact CA-O 3.38Å; F133-R157 HydrophobicContact CB-CB 4.44Å; F133-R157 HydrophobicContact CB-CG 3.37Å; F133-R157 WeakPolarHBondContact CB-O 3.48Å; F133-R157 HydrophobicContact CG-CG 4.18Å
134	D	98.3	Very high	96	Very high	34 Å²	34	31.5 Å²	31.5	18%	0.182	17%	0.174	C	C	.	.	S	Bend	trans	54.6	50	-177.3	-57.9	-40.9	0	0	0	111.9	K110 N111 R157 N158	K110-D134 VanDerWaalsContact CA-O 3.23Å; K110-D134 WeakPolarHBondContact CA-O 3.31Å; K110-D134 HydrophobicContact CB-CB 4.39Å; K110-D134 HydrophobicContact CG-CB 3.72Å; K110-D134 PolarHBondContact N-O 3.49Å; N111-D134 PolarHBondContact N-O 2.91Å; D134-R157 PolarHBondContact N-O 3.26Å; D134-R157 IonicContact OD1-CZ 3.55Å; D134-R157 IonicContact OD1-NH1 3.55Å; D134-R157 PolarHBondContact OD1-NH1 3.04Å; D134-R157 IonicContact OD1-NH2 2.79Å; D134-R157 IonicContact OD2-CZ 3.47Å; D134-R157 IonicContact OD2-NH1 2.91Å; D134-R157 PolarHBondContact OD2-NH1 3.25Å; D134-R157 IonicContact OD2-NH2 3.7Å; D134-R157 PolarHBondContact OD2-NH2 3.36Å; D134-N158 WeakPolarHBondContact CA-O 3.3Å; D134-N158 VanDerWaalsContact OD1-CB 3.29Å; D134-N158 WeakPolarHBondContact OD1-CB 3.49Å; D134-N158 PolarHBondContact OD1-ND2 2.92Å
135	N	98.5	Very high	95.7	Very high	5 Å²	5	31.4 Å²	31.4	3%	0.027	17%	0.174	C	C	.	.	S	Bend	trans	-119.7	-164.2	177.8	-88.7	-69.2	0	0	0	111.2	L108 N111 I113 L132 F133 N159	L108-N135 PolarHBondContact O-ND2 3.45Å; N111-N135 WeakPolarHBondContact CA-OD1 3.33Å; N111-N135 WeakPolarHBondContact CB-OD1 3.11Å; N111-N135 PolarHBondContact N-OD1 3.36Å; N111-N135 PolarHBondContact O-OD1 2.93Å; I113-N135 HydrophobicContact CB-CB 4.27Å; I113-N135 VanDerWaalsContact CB-OD1 3.27Å; I113-N135 WeakPolarHBondContact CB-OD1 3.34Å; I113-N135 VanDerWaalsContact CG1-OD1 3.29Å; I113-N135 WeakPolarHBondContact CG1-OD1 3.41Å; I113-N135 PolarHBondContact N-OD1 3Å; L132-N135 WeakPolarHBondContact O-CB 3.24Å; L132-N135 PolarHBondContact O-ND2 3.45Å; F133-N135 PolarHBondContact O-ND2 3.26Å; N135-N159 VanDerWaalsContact CA-OD1 3.25Å; N135-N159 WeakPolarHBondContact CA-OD1 3.29Å; N135-N159 WeakPolarHBondContact CB-OD1 3.3Å; N135-N159 PolarHBondContact N-OD1 2.94Å; N135-N159 PolarHBondContact O-OD1 3.32Å
136	R	98.1	Very high	95.2	Very high	149 Å²	149	33.4 Å²	33.4	56%	0.562	18%	0.175	S	C	*	.			trans	-120.1	27.1	-176.8	-56.3	-62.9	-173.5	-174	1.8	112.2	I113 R114 T138 N159	I113-R136 CarbonylContact O-C 3.23Å; I113-R136 VanDerWaalsContact O-CA 3.26Å; I113-R136 WeakPolarHBondContact O-CA 3.17Å; I113-R136 PolarHBondContact O-N 3.04Å; R114-R136 HydrophobicContact CB-CB 4.35Å; R136-T138 PolarHBondContact O-N 2.89Å; R136-N159 PolarHBondContact N-OD1 3.46Å
137	L	98	Very high	94.4	Very high	4 Å²	4	38.9 Å²	38.9	2%	0.021	19%	0.192	C	C	.	.			trans	-71.3	124.9	179.7	-64.6	172.2	0	0	0	110.5	I113 I116 L156 N159 P160 I161	I113-L137 HydrophobicContact CG2-CD2 4.04Å; I113-L137 PolarHBondContact O-N 2.94Å; I116-L137 HydrophobicContact CD1-CD1 4.14Å; I116-L137 HydrophobicContact CD1-CD2 4.07Å; I116-L137 HydrophobicContact CG1-CD2 4.21Å; L137-L156 HydrophobicContact CD1-CD2 4.01Å; L137-N159 HydrophobicContact CB-CB 4.29Å; L137-N159 WeakPolarHBondContact CB-OD1 3.48Å; L137-N159 PolarHBondContact N-OD1 3.35Å; L137-N159 VanDerWaalsContact N-OD1 3.12Å; L137-P160 CarbonylContact O-C 3.44Å; L137-P160 VanDerWaalsContact O-C 3.23Å; L137-P160 WeakPolarHBondContact O-CD 3.32Å; L137-P160 WeakPolarHBondContact O-CG 3.39Å; L137-I161 WeakPolarHBondContact O-CG1 3.46Å; L137-I161 PolarHBondContact O-N 3.36Å
138	T	97.1	Very high	94.2	Very high	59 Å²	59	39 Å²	39	36%	0.362	19%	0.192	S	C	.	.	S	Bend	trans	-92.2	-19.1	176.5	55.2	0	0	0	0	113.1	R136 P160 I161 E162	R136-T138 PolarHBondContact O-N 2.89Å; T138-P160 WeakPolarHBondContact CA-O 3.47Å; T138-I161 WeakPolarHBondContact O-CA 3.39Å; T138-E162 PolarHBondContact O-N 3.1Å
139	T	96.4	Very high	93.7	Very high	80 Å²	80	40.8 Å²	40.8	49%	0.491	21%	0.208	S	C	.	.	S	Bend	trans	-140.2	159.8	178.9	59.9	0	0	0	0	110.7
140	I	96.3	Very high	93.6	Very high	8 Å²	8	46 Å²	46	4%	0.041	23%	0.23	C	C	.	.			trans	-77.3	125.2	173.7	-64.4	162.8	0	0	0	109.1	N142 F145 I161 I164 A168 F169	I140-N142 VanDerWaalsContact C-N 3.27Å; I140-N142 PolarHBondContact O-N 3Å; I140-F145 HydrophobicContact CG2-CE2 3.96Å; I140-I161 HydrophobicContact CG1-CD1 4.08Å; I140-I161 HydrophobicContact CG1-CG2 4.29Å; I140-I164 HydrophobicContact CD1-CB 4.1Å; I140-I164 HydrophobicContact CD1-CG1 3.85Å; I140-I164 HydrophobicContact CD1-CG2 3.71Å; I140-A168 HydrophobicContact CD1-CB 4.19Å; I140-A168 HydrophobicContact CG2-CB 4.48Å; I140-F169 HydrophobicContact CD1-CE1 4.22Å; I140-F169 HydrophobicContact CD1-CE2 4.17Å; I140-F169 HydrophobicContact CD1-CZ 3.54Å; I140-F169 HydrophobicContact CG1-CZ 4.37Å; I140-F169 HydrophobicContact CG2-CD1 4.45Å; I140-F169 HydrophobicContact CG2-CE1 3.82Å; I140-F169 HydrophobicContact CG2-CZ 4.25Å
141	P	93.3	Very high	93.5	Very high	17 Å²	17	46 Å²	46	11%	0.11	23%	0.23	C	C	.	.			trans	-83.5	66.3	-177.5	36	-37.3	0	0	0	111.4	I116 G143 A144 F145	I116-P141 HydrophobicContact CB-CB 4.1Å; I116-P141 HydrophobicContact CB-CG 4.37Å; I116-P141 HydrophobicContact CD1-CG 4.02Å; I116-P141 HydrophobicContact CG2-CB 4.48Å; P141-G143 VanDerWaalsContact C-N 3.29Å; P141-G143 PolarHBondContact O-N 2.65Å; P141-A144 HydrophobicContact CB-CB 4.04Å; P141-A144 HydrophobicContact CG-CB 4.49Å; P141-A144 WeakPolarHBondContact O-CB 3.29Å; P141-A144 PolarHBondContact O-N 3.15Å; P141-F145 HydrophobicContact CG-CE1 4.26Å; P141-F145 HydrophobicContact CG-CE2 4.25Å; P141-F145 HydrophobicContact CG-CZ 3.72Å
142	N	88.1	Confident	93.5	Very high	81 Å²	81	48.9 Å²	48.9	43%	0.433	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-50.9	-42.1	-177.1	62.6	-24.7	0	0	0	113.9	I140 A144 F145 A168	I140-N142 VanDerWaalsContact C-N 3.27Å; I140-N142 PolarHBondContact O-N 3Å; N142-A144 VanDerWaalsContact C-N 3.25Å; N142-A144 PolarHBondContact O-N 3.32Å; N142-F145 PolarHBondContact O-N 2.81Å; N142-A168 WeakPolarHBondContact CB-O 3.25Å
143	G	88.1	Confident	93.6	Very high	13 Å²	13	50.7 Å²	50.7	13%	0.134	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-71.9	-11.2	178.1	0	0	0	0	0	115.2	P141 F145	P141-G143 VanDerWaalsContact C-N 3.29Å; P141-G143 PolarHBondContact O-N 2.65Å; G143-F145 VanDerWaalsContact C-N 3.29Å
144	A	91.7	Very high	93.6	Very high	4 Å²	4	49.2 Å²	49.2	3%	0.033	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-78.5	-15.9	172.6	0	0	0	0	0	112.4	I116 F121 P141 N142	I116-A144 HydrophobicContact CG2-CB 3.59Å; F121-A144 HydrophobicContact CD2-CB 3.87Å; F121-A144 WeakPolarHBondContact CD2-O 3.29Å; F121-A144 HydrophobicContact CE2-CB 4.02Å; P141-A144 HydrophobicContact CB-CB 4.04Å; P141-A144 HydrophobicContact CG-CB 4.49Å; P141-A144 WeakPolarHBondContact O-CB 3.29Å; P141-A144 PolarHBondContact O-N 3.15Å; N142-A144 VanDerWaalsContact C-N 3.25Å; N142-A144 PolarHBondContact O-N 3.32Å
145	F	90.1	Very high	93.6	Very high	1 Å²	1	50.2 Å²	50.2	0%	0.004	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-96.2	5.7	-172.5	-52.7	-42.6	0	0	0	114.6	F121 L130 I140 P141 N142 G143 Y147 L148 L154 R171 V172	F121-F145 HydrophobicContact CD2-CD1 4.42Å; F121-F145 HydrophobicContact CE2-CE1 4.26Å; L130-F145 HydrophobicContact CD2-CE1 4.25Å; I140-F145 HydrophobicContact CG2-CE2 3.96Å; P141-F145 HydrophobicContact CG-CE1 4.26Å; P141-F145 HydrophobicContact CG-CE2 4.25Å; P141-F145 HydrophobicContact CG-CZ 3.72Å; N142-F145 PolarHBondContact O-N 2.81Å; G143-F145 VanDerWaalsContact C-N 3.29Å; F145-Y147 PolarHBondContact O-N 3.46Å; F145-L148 HydrophobicContact CB-CD1 4.47Å; F145-L148 HydrophobicContact CD1-CD1 3.97Å; F145-L148 PolarHBondContact O-N 3.16Å; F145-L154 HydrophobicContact CE2-CD2 4.35Å; F145-L154 HydrophobicContact CZ-CD2 4.11Å; F145-R171 HydrophobicContact CB-CB 4.48Å; F145-V172 HydrophobicContact CB-CG1 3.81Å
146	E	82.8	Confident	93.6	Very high	95 Å²	95	50 Å²	50	44%	0.444	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-18.6	-165.4	-165.3	160.1	178.3	0	0	115.9
147	Y	78.8	Confident	93.6	Very high	146 Å²	146	45.5 Å²	45.5	57%	0.573	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-130.3	17.2	-176.5	-53.8	-63.7	0	0	0	114.9	N122 F145 S149	N122-Y147 WeakPolarHBondContact OD1-CD2 3.35Å; F145-Y147 PolarHBondContact O-N 3.46Å; Y147-S149 VanDerWaalsContact C-N 3.31Å; Y147-S149 PolarHBondContact O-N 3.4Å; Y147-S149 VanDerWaalsContact O-N 3.12Å
148	L	91.9	Very high	93.6	Very high	3 Å²	3	47.8 Å²	47.8	2%	0.016	24%	0.24	C	C	.	.			trans	-89.9	57.2	-175.8	-64.8	179.3	0	0	0	112.5	F121 L124 L127 F145 K150 L151 V172	F121-L148 HydrophobicContact CB-CD1 4.2Å; F121-L148 HydrophobicContact CB-CD2 4.15Å; F121-L148 HydrophobicContact CB-CG 4.46Å; F121-L148 HydrophobicContact CD2-CD1 4.36Å; F121-L148 HydrophobicContact CG-CD1 4.49Å; L124-L148 HydrophobicContact CB-CD2 3.92Å; L127-L148 HydrophobicContact CB-CD2 4.33Å; L127-L148 HydrophobicContact CD2-CD1 4.47Å; L127-L148 HydrophobicContact CD2-CD2 3.97Å; F145-L148 HydrophobicContact CB-CD1 4.47Å; F145-L148 HydrophobicContact CD1-CD1 3.97Å; F145-L148 PolarHBondContact O-N 3.16Å; L148-K150 VanDerWaalsContact C-N 3.26Å; L148-K150 PolarHBondContact O-N 3.43Å; L148-L151 HydrophobicContact CB-CB 4.02Å; L148-L151 HydrophobicContact CB-CD2 4.31Å; L148-L151 HydrophobicContact CD1-CD2 4.03Å; L148-L151 WeakPolarHBondContact O-CB 3.45Å; L148-L151 PolarHBondContact O-N 3.22Å; L148-L151 VanDerWaalsContact O-N 3.16Å; L148-V172 HydrophobicContact CB-CG1 3.89Å
149	S	89.4	Confident	93.6	Very high	87 Å²	87	45.1 Å²	45.1	61%	0.608	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-24.2	-171.9	61.5	0	0	0	0	114.9	Y147 S174	Y147-S149 VanDerWaalsContact C-N 3.31Å; Y147-S149 PolarHBondContact O-N 3.4Å; Y147-S149 VanDerWaalsContact O-N 3.12Å; S149-S174 WeakPolarHBondContact O-CB 3.35Å; S149-S174 PolarHBondContact O-OG 3.11Å
150	K	95.3	Very high	93.7	Very high	119 Å²	119	42.4 Å²	42.4	52%	0.517	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-0.7	178.2	-67	-164.4	-170.9	172.1	0	114.8	A125 L127 L148 K152	A125-K150 WeakPolarHBondContact O-CD 3.27Å; L127-K150 CarbonylContact O-C 3.58Å; L148-K150 VanDerWaalsContact C-N 3.26Å; L148-K150 PolarHBondContact O-N 3.43Å; K150-K152 PolarHBondContact O-N 2.92Å
151	L	97.5	Very high	93.8	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.205	C	C	.	.			trans	-65.6	122.2	-176.2	-168	69.1	0	0	0	110.4	L127 L130 L148 V172 S174 L175	L127-L151 HydrophobicContact CD2-CD1 4.03Å; L127-L151 HydrophobicContact CG-CD1 4.16Å; L127-L151 VanDerWaalsContact O-CA 3.28Å; L127-L151 WeakPolarHBondContact O-CA 3.14Å; L127-L151 PolarHBondContact O-N 3.1Å; L127-L151 VanDerWaalsContact O-N 3.12Å; L130-L151 HydrophobicContact CB-CD1 3.86Å; L148-L151 HydrophobicContact CB-CB 4.02Å; L148-L151 HydrophobicContact CB-CD2 4.31Å; L148-L151 HydrophobicContact CD1-CD2 4.03Å; L148-L151 WeakPolarHBondContact O-CB 3.45Å; L148-L151 PolarHBondContact O-N 3.22Å; L148-L151 VanDerWaalsContact O-N 3.16Å; L151-V172 HydrophobicContact CD2-CG1 4.15Å; L151-S174 CarbonylContact O-C 3.06Å; L151-S174 VanDerWaalsContact O-C 3.24Å; L151-S174 PolarHBondContact O-OG 3.06Å; L151-S174 VanDerWaalsContact O-OG 3.08Å; L151-L175 HydrophobicContact CD2-CD2 4.03Å; L151-L175 HydrophobicContact CG-CD2 3.96Å; L151-L175 PolarHBondContact O-N 2.84Å
152	K	98.2	Very high	94	Very high	90 Å²	90	45.8 Å²	45.8	39%	0.391	22%	0.221	S	C	.	.			trans	-109.8	-27.5	177.2	-60.2	-178.2	-169.2	168.1	0	112.4	N128 K150 R176 R177	N128-K152 PolarHBondContact O-N 3.02Å; N128-K152 VanDerWaalsContact OD1-CB 3.25Å; N128-K152 WeakPolarHBondContact OD1-CB 3.48Å; N128-K152 VanDerWaalsContact OD1-CD 3.22Å; N128-K152 WeakPolarHBondContact OD1-CD 3.26Å; N128-K152 WeakPolarHBondContact OD1-CG 3.45Å; K150-K152 PolarHBondContact O-N 2.92Å; K152-R176 HydrophobicContact CB-CB 4.4Å; K152-R176 HydrophobicContact CB-CG 4.38Å; K152-R176 PolarHBondContact O-N 3Å; K152-R177 PolarHBondContact O-N 3.23Å
153	E	98.7	Very high	94.4	Very high	38 Å²	38	43.9 Å²	43.9	18%	0.178	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	124.3	-173.9	-54.9	-173.5	164.7	0	0	111.2	N128 T129 L130 W155 R177	N128-E153 PolarHBondContact O-N 2.73Å; T129-E153 WeakPolarHBondContact CA-O 3.49Å; T129-E153 HydrophobicContact CG2-CB 4Å; T129-E153 PolarHBondContact OG1-OE2 3.47Å; T129-E153 VanDerWaalsContact OG1-OE2 3.1Å; L130-E153 PolarHBondContact N-O 2.65Å; E153-W155 HydrophobicContact CB-CZ2 4.48Å; E153-R177 WeakPolarHBondContact CA-O 3.07Å; E153-R177 HydrophobicContact CB-CB 4.47Å; E153-R177 HydrophobicContact CG-CB 4.11Å; E153-R177 HydrophobicContact CG-CG 4.25Å; E153-R177 IonicContact OE1-CZ 2.85Å; E153-R177 IonicContact OE1-NH1 3.06Å; E153-R177 PolarHBondContact OE1-NH1 2.91Å
154	L	98.5	Very high	94.8	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	119.7	177.5	177.6	60.4	0	0	0	110.1	L130 F145 L156 F169 L175 R177 L178 D179	L130-L154 HydrophobicContact CB-CD1 4.19Å; L130-L154 HydrophobicContact CD2-CD1 3.98Å; L130-L154 HydrophobicContact CG-CD1 4.09Å; F145-L154 HydrophobicContact CE2-CD2 4.35Å; F145-L154 HydrophobicContact CZ-CD2 4.11Å; L154-L156 HydrophobicContact CD1-CD1 4.45Å; L154-L156 HydrophobicContact CD1-CG 4.23Å; L154-L156 HydrophobicContact CD2-CD1 3.92Å; L154-L156 HydrophobicContact CG-CD1 4.06Å; L154-L156 HydrophobicContact CG-CG 4.15Å; L154-F169 HydrophobicContact CD2-CD1 4.2Å; L154-F169 HydrophobicContact CD2-CE1 4.14Å; L154-L175 HydrophobicContact CB-CD1 4.35Å; L154-L175 HydrophobicContact CB-CD2 3.81Å; L154-L175 HydrophobicContact CD2-CD1 4.29Å; L154-R177 PolarHBondContact N-O 2.79Å; L154-L178 HydrophobicContact CB-CD1 4.13Å; L154-L178 HydrophobicContact CD2-CD1 4.01Å; L154-L178 HydrophobicContact CG-CD1 4.11Å; L154-D179 PolarHBondContact O-N 3.32Å
155	W	98.6	Very high	95.1	Very high	56 Å²	56	45.5 Å²	45.5	21%	0.212	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	109	-177.6	-49.2	90	0	0	0	110.4	L130 E131 L132 F133 E153 D179 Y202	L130-W155 PolarHBondContact O-N 3.38Å; E131-W155 HydrophobicContact CG-CB 4.4Å; E131-W155 HydrophobicContact CG-CG 4.14Å; L132-W155 CarbonylContact C-O 2.99Å; L132-W155 WeakPolarHBondContact CA-O 3.25Å; L132-W155 PolarHBondContact N-O 2.89Å; F133-W155 HydrophobicContact CD1-CB 3.98Å; F133-W155 PolarHBondContact N-O 2.69Å; E153-W155 HydrophobicContact CB-CZ2 4.48Å; W155-D179 HydrophobicContact CD2-CB 4.14Å; W155-D179 HydrophobicContact CE3-CB 3.22Å; W155-D179 VanDerWaalsContact CE3-OD2 3.29Å; W155-D179 HydrophobicContact CZ3-CB 3.61Å; W155-Y202 HydrophobicContact CZ3-CE1 4.46Å
156	L	98.2	Very high	95.4	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.241	C	C	.	.			trans	-117.1	7	-178.6	-75.1	167.3	0	0	0	112.8	L132 L137 L154 N159 F169 D179 L180	L132-L156 HydrophobicContact CB-CD2 3.83Å; L132-L156 HydrophobicContact CD1-CD2 4.04Å; L137-L156 HydrophobicContact CD1-CD2 4.01Å; L154-L156 HydrophobicContact CD1-CD1 4.45Å; L154-L156 HydrophobicContact CD1-CG 4.23Å; L154-L156 HydrophobicContact CD2-CD1 3.92Å; L154-L156 HydrophobicContact CG-CD1 4.06Å; L154-L156 HydrophobicContact CG-CG 4.15Å; L156-N159 PolarHBondContact O-ND2 3.39Å; L156-F169 HydrophobicContact CD1-CE1 4.12Å; L156-D179 CarbonylContact C-O 3.52Å; L156-D179 WeakPolarHBondContact CA-O 3.46Å; L156-D179 PolarHBondContact N-O 3.46Å; L156-L180 HydrophobicContact CB-CD2 3.9Å; L156-L180 HydrophobicContact CD1-CD2 3.93Å
157	R	98.1	Very high	96	Very high	54 Å²	54	49.7 Å²	49.7	20%	0.204	24%	0.243	C	C	.	.			trans	-53.6	152.9	-176.3	73	166.5	-170.1	73.4	10.9	113.9	F133 D134 N159 D179 G181 E182	F133-R157 CarbonylContact C-O 3.55Å; F133-R157 WeakPolarHBondContact CA-O 3.38Å; F133-R157 HydrophobicContact CB-CB 4.44Å; F133-R157 HydrophobicContact CB-CG 3.37Å; F133-R157 WeakPolarHBondContact CB-O 3.48Å; F133-R157 HydrophobicContact CG-CG 4.18Å; D134-R157 PolarHBondContact N-O 3.26Å; D134-R157 IonicContact OD1-CZ 3.55Å; D134-R157 IonicContact OD1-NH1 3.55Å; D134-R157 PolarHBondContact OD1-NH1 3.04Å; D134-R157 IonicContact OD1-NH2 2.79Å; D134-R157 IonicContact OD2-CZ 3.47Å; D134-R157 IonicContact OD2-NH1 2.91Å; D134-R157 PolarHBondContact OD2-NH1 3.25Å; D134-R157 IonicContact OD2-NH2 3.7Å; D134-R157 PolarHBondContact OD2-NH2 3.36Å; R157-N159 VanDerWaalsContact C-N 3.31Å; R157-N159 PolarHBondContact O-N 3.01Å; R157-N159 PolarHBondContact O-ND2 2.96Å; R157-D179 PolarHBondContact N-O 3.42Å; R157-G181 CarbonylContact C-O 3.54Å; R157-G181 WeakPolarHBondContact CA-O 3.19Å; R157-G181 VanDerWaalsContact CB-O 3.29Å; R157-G181 WeakPolarHBondContact CB-O 3.38Å; R157-E182 IonicContact NH1-OE1 2.88Å
158	N	97.9	Very high	96.9	Very high	53 Å²	53	42.8 Å²	42.8	28%	0.283	22%	0.216	S	C	.	.	S	Bend	trans	50.8	49.1	178	-166.8	30.8	0	0	0	112.8	D134 G181 E182	D134-N158 WeakPolarHBondContact CA-O 3.3Å; D134-N158 VanDerWaalsContact OD1-CB 3.29Å; D134-N158 WeakPolarHBondContact OD1-CB 3.49Å; D134-N158 PolarHBondContact OD1-ND2 2.92Å; N158-G181 PolarHBondContact N-O 3.14Å; N158-E182 HydrophobicContact CB-CB 3.97Å
159	N	98.5	Very high	97	Very high	3 Å²	3	42.7 Å²	42.7	2%	0.016	22%	0.216	C	C	.	.			trans	-112	150.8	166.1	-84.3	-81.7	0	0	0	109.7	L132 N135 R136 L137 L156 R157 I161 L183	L132-N159 PolarHBondContact O-ND2 2.96Å; N135-N159 VanDerWaalsContact CA-OD1 3.25Å; N135-N159 WeakPolarHBondContact CA-OD1 3.29Å; N135-N159 WeakPolarHBondContact CB-OD1 3.3Å; N135-N159 PolarHBondContact N-OD1 2.94Å; N135-N159 PolarHBondContact O-OD1 3.32Å; R136-N159 PolarHBondContact N-OD1 3.46Å; L137-N159 HydrophobicContact CB-CB 4.29Å; L137-N159 WeakPolarHBondContact CB-OD1 3.48Å; L137-N159 PolarHBondContact N-OD1 3.35Å; L137-N159 VanDerWaalsContact N-OD1 3.12Å; L156-N159 PolarHBondContact O-ND2 3.39Å; R157-N159 VanDerWaalsContact C-N 3.31Å; R157-N159 PolarHBondContact O-N 3.01Å; R157-N159 PolarHBondContact O-ND2 2.96Å; N159-I161 HydrophobicContact CB-CD1 4.04Å; N159-I161 HydrophobicContact CB-CG1 3.85Å; N159-I161 PolarHBondContact O-N 3.19Å; N159-L183 HydrophobicContact CB-CD2 4.16Å; N159-L183 VanDerWaalsContact O-CD2 3.25Å; N159-L183 WeakPolarHBondContact O-CD2 3.31Å
160	P	97.9	Very high	97.2	Very high	22 Å²	22	41.2 Å²	41.2	14%	0.143	20%	0.201	C	C	.	.			trans	-76.2	42.8	176.1	33.7	-36.5	0	0	0	112.8	L137 T138 E162 R185	L137-P160 CarbonylContact O-C 3.44Å; L137-P160 VanDerWaalsContact O-C 3.23Å; L137-P160 WeakPolarHBondContact O-CD 3.32Å; L137-P160 WeakPolarHBondContact O-CG 3.39Å; T138-P160 WeakPolarHBondContact CA-O 3.47Å; P160-E162 PolarHBondContact O-N 2.89Å; P160-R185 HydrophobicContact CB-CG 4.48Å
161	I	98.1	Very high	97.1	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.201	C	C	.	.			trans	-67.9	127.7	-179.5	-63.4	171.4	0	0	0	109.3	L137 T138 I140 N159 S163 L183 R185 L186	L137-I161 WeakPolarHBondContact O-CG1 3.46Å; L137-I161 PolarHBondContact O-N 3.36Å; T138-I161 WeakPolarHBondContact O-CA 3.39Å; I140-I161 HydrophobicContact CG1-CD1 4.08Å; I140-I161 HydrophobicContact CG1-CG2 4.29Å; N159-I161 HydrophobicContact CB-CD1 4.04Å; N159-I161 HydrophobicContact CB-CG1 3.85Å; N159-I161 PolarHBondContact O-N 3.19Å; I161-S163 WeakPolarHBondContact CG2-O 3.4Å; I161-L183 HydrophobicContact CB-CD1 4.36Å; I161-L183 HydrophobicContact CB-CD2 4.14Å; I161-L183 HydrophobicContact CD1-CD1 4.41Å; I161-L183 HydrophobicContact CD1-CD2 3.97Å; I161-L183 HydrophobicContact CG1-CD2 4.23Å; I161-R185 CarbonylContact O-C 3.59Å; I161-R185 VanDerWaalsContact O-C 3.32Å; I161-L186 WeakPolarHBondContact O-CA 3.47Å; I161-L186 PolarHBondContact O-N 3.18Å
162	E	96.9	Very high	97	Very high	97 Å²	97	42.1 Å²	42.1	45%	0.453	20%	0.201	S	C	.	.			trans	-91.3	-31.9	-175	-64.9	177.9	-173.2	0	0	112.8	T138 P160 S187	T138-E162 PolarHBondContact O-N 3.1Å; P160-E162 PolarHBondContact O-N 2.89Å; E162-S187 PolarHBondContact O-N 3Å; E162-S187 PolarHBondContact O-OG 2.88Å
163	S	96.8	Very high	96.8	Very high	40 Å²	40	40.8 Å²	40.8	28%	0.28	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	153.6	-179.2	63.2	0	0	0	0	113.7	I161 Y188	I161-S163 WeakPolarHBondContact CG2-O 3.4Å; S163-Y188 CarbonylContact C-O 3.32Å; S163-Y188 VanDerWaalsContact CA-O 3.22Å; S163-Y188 WeakPolarHBondContact CA-O 3.3Å
164	I	97.8	Very high	96.6	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	102.1	170.8	-52.5	179.4	0	0	0	108.1	I140 A168 F169 L180 L186 Y188 I189 S190 A193	I140-I164 HydrophobicContact CD1-CB 4.1Å; I140-I164 HydrophobicContact CD1-CG1 3.85Å; I140-I164 HydrophobicContact CD1-CG2 3.71Å; I164-A168 HydrophobicContact CG2-CB 3.98Å; I164-F169 HydrophobicContact CG2-CE2 4.16Å; I164-L180 HydrophobicContact CD1-CD1 3.99Å; I164-L186 HydrophobicContact CD1-CD1 4.37Å; I164-L186 HydrophobicContact CD1-CD2 4.22Å; I164-L186 HydrophobicContact CG1-CD1 3.9Å; I164-Y188 PolarHBondContact N-O 3Å; I164-I189 HydrophobicContact CB-CG1 4.49Å; I164-I189 HydrophobicContact CB-CG2 4.31Å; I164-I189 HydrophobicContact CD1-CD1 4.26Å; I164-I189 HydrophobicContact CD1-CG1 4.1Å; I164-I189 HydrophobicContact CG1-CG1 4.4Å; I164-S190 WeakPolarHBondContact O-CB 3.19Å; I164-S190 PolarHBondContact O-N 3.13Å; I164-A193 HydrophobicContact CB-CB 4.34Å; I164-A193 HydrophobicContact CG2-CB 3.6Å
165	P	96.9	Very high	96.6	Very high	52 Å²	52	40.3 Å²	40.3	34%	0.338	20%	0.203	S	C	.	.			trans	-73.1	167.2	-177.3	31	-35.5	0	0	0	112	A168 A193	P165-A168 HydrophobicContact CG-CB 4.16Å; P165-A168 WeakPolarHBondContact O-CB 3.48Å; P165-A168 PolarHBondContact O-N 3.25Å; P165-A193 WeakPolarHBondContact O-CA 3.25Å
166	S	96.5	Very high	96.6	Very high	57 Å²	57	42.8 Å²	42.8	40%	0.399	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	142.8	173.8	-37.7	0	0	0	0	111	A168 S190	S166-A168 PolarHBondContact O-N 2.65Å; S166-S190 PolarHBondContact OG-OG 2.87Å
167	Y	95.7	Very high	96.6	Very high	127 Å²	127	48.4 Å²	48.4	50%	0.498	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.3	26.7	179.2	-53.7	-80.7	0	0	0	114.2	F169 N170 G192 E195	Y167-F169 PolarHBondContact O-N 3.46Å; Y167-N170 HydrophobicContact CD1-CB 4.34Å; Y167-N170 PolarHBondContact O-N 3.42Å; Y167-N170 PolarHBondContact O-OD1 3.38Å; Y167-G192 PolarHBondContact N-O 3.16Å; Y167-E195 HydrophobicContact CD1-CB 3.56Å; Y167-E195 HydrophobicContact CD1-CG 4.4Å; Y167-E195 HydrophobicContact CE1-CB 3.65Å; Y167-E195 HydrophobicContact CE1-CG 4.04Å; Y167-E195 HydrophobicContact CG-CB 4.48Å
168	A	96.4	Very high	96.6	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.008	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-31.8	-174.4	0	0	0	0	0	113.8	I140 N142 I164 P165 S166	I140-A168 HydrophobicContact CD1-CB 4.19Å; I140-A168 HydrophobicContact CG2-CB 4.48Å; N142-A168 WeakPolarHBondContact CB-O 3.25Å; I164-A168 HydrophobicContact CG2-CB 3.98Å; P165-A168 HydrophobicContact CG-CB 4.16Å; P165-A168 WeakPolarHBondContact O-CB 3.48Å; P165-A168 PolarHBondContact O-N 3.25Å; S166-A168 PolarHBondContact O-N 2.65Å
169	F	95.9	Very high	96.7	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.8	12	-176	-50.4	-76.3	0	0	0	113.7	I140 L154 L156 I164 Y167 R171 V172 L178 L180 F194 L197	I140-F169 HydrophobicContact CD1-CE1 4.22Å; I140-F169 HydrophobicContact CD1-CE2 4.17Å; I140-F169 HydrophobicContact CD1-CZ 3.54Å; I140-F169 HydrophobicContact CG1-CZ 4.37Å; I140-F169 HydrophobicContact CG2-CD1 4.45Å; I140-F169 HydrophobicContact CG2-CE1 3.82Å; I140-F169 HydrophobicContact CG2-CZ 4.25Å; L154-F169 HydrophobicContact CD2-CD1 4.2Å; L154-F169 HydrophobicContact CD2-CE1 4.14Å; L156-F169 HydrophobicContact CD1-CE1 4.12Å; I164-F169 HydrophobicContact CG2-CE2 4.16Å; Y167-F169 PolarHBondContact O-N 3.46Å; F169-R171 PolarHBondContact O-N 3.07Å; F169-V172 HydrophobicContact CB-CG2 4.19Å; F169-V172 VanDerWaalsContact O-CG2 3.27Å; F169-V172 WeakPolarHBondContact O-CG2 3.37Å; F169-V172 PolarHBondContact O-N 3.21Å; F169-L178 HydrophobicContact CD2-CD2 4.04Å; F169-L178 HydrophobicContact CE1-CD1 4.09Å; F169-L178 HydrophobicContact CE1-CD2 4.36Å; F169-L178 HydrophobicContact CE2-CD2 3.85Å; F169-L178 HydrophobicContact CG-CD2 4.37Å; F169-L178 HydrophobicContact CZ-CD1 4.28Å; F169-L178 HydrophobicContact CZ-CD2 4.02Å; F169-L180 HydrophobicContact CE2-CD1 4.08Å; F169-L180 HydrophobicContact CZ-CD1 3.91Å; F169-L180 HydrophobicContact CZ-CD2 4.05Å; F169-L180 HydrophobicContact CZ-CG 4.49Å; F169-F194 HydrophobicContact CD2-CD1 4.46Å; F169-F194 HydrophobicContact CE2-CD1 4.41Å; F169-F194 HydrophobicContact CE2-CE1 4.32Å; F169-L197 HydrophobicContact CB-CD1 3.86Å; F169-L197 HydrophobicContact CB-CD2 3.77Å; F169-L197 HydrophobicContact CB-CG 3.99Å; F169-L197 HydrophobicContact CD2-CD1 3.95Å; F169-L197 HydrophobicContact CG-CD1 4.16Å
170	N	93.4	Very high	96.7	Very high	56 Å²	56	43.5 Å²	43.5	30%	0.299	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-20.5	-173.7	77	-17.8	0	0	0	114	Y167 V172	Y167-N170 HydrophobicContact CD1-CB 4.34Å; Y167-N170 PolarHBondContact O-N 3.42Å; Y167-N170 PolarHBondContact O-OD1 3.38Å; N170-V172 VanDerWaalsContact C-N 3.27Å; N170-V172 PolarHBondContact O-N 2.97Å
171	R	92.1	Very high	96.7	Very high	139 Å²	139	42.6 Å²	42.6	53%	0.525	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-11.3	177.2	-58.5	-51.6	-175.9	178.4	0.5	113.5	F145 F169 P173	F145-R171 HydrophobicContact CB-CB 4.48Å; F169-R171 PolarHBondContact O-N 3.07Å; R171-P173 WeakPolarHBondContact O-CD 3.29Å
172	V	94.8	Very high	96.6	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.218	C	C	.	.			trans	-126.3	62.5	-179.8	-75	0	0	0	0	111.8	F145 L148 L151 F169 N170 S174 L175	F145-V172 HydrophobicContact CB-CG1 3.81Å; L148-V172 HydrophobicContact CB-CG1 3.89Å; L151-V172 HydrophobicContact CD2-CG1 4.15Å; F169-V172 HydrophobicContact CB-CG2 4.19Å; F169-V172 VanDerWaalsContact O-CG2 3.27Å; F169-V172 WeakPolarHBondContact O-CG2 3.37Å; F169-V172 PolarHBondContact O-N 3.21Å; N170-V172 VanDerWaalsContact C-N 3.27Å; N170-V172 PolarHBondContact O-N 2.97Å; V172-S174 PolarHBondContact O-N 3.02Å; V172-S174 VanDerWaalsContact O-N 3.12Å; V172-L175 HydrophobicContact CB-CD1 4.18Å; V172-L175 HydrophobicContact CB-CG 4.08Å; V172-L175 HydrophobicContact CG2-CD1 3.51Å; V172-L175 HydrophobicContact CG2-CG 3.97Å; V172-L175 WeakPolarHBondContact O-CG 3.34Å; V172-L175 PolarHBondContact O-N 2.81Å
173	P	94.4	Very high	96.7	Very high	61 Å²	61	40.7 Å²	40.7	40%	0.396	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-7.7	-178.6	31.7	-37.8	0	0	0	113.8	R171 L175 G196 N199	R171-P173 WeakPolarHBondContact O-CD 3.29Å; P173-L175 VanDerWaalsContact C-N 3.31Å; P173-G196 WeakPolarHBondContact CB-O 3.47Å; P173-N199 PolarHBondContact O-ND2 2.92Å; P173-N199 VanDerWaalsContact O-ND2 3.1Å
174	S	95.8	Very high	96.6	Very high	29 Å²	29	45 Å²	45	20%	0.203	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-9.2	175.7	46.9	0	0	0	0	113.9	S149 L151 V172 R176	S149-S174 WeakPolarHBondContact O-CB 3.35Å; S149-S174 PolarHBondContact O-OG 3.11Å; L151-S174 CarbonylContact O-C 3.06Å; L151-S174 VanDerWaalsContact O-C 3.24Å; L151-S174 PolarHBondContact O-OG 3.06Å; L151-S174 VanDerWaalsContact O-OG 3.08Å; V172-S174 PolarHBondContact O-N 3.02Å; V172-S174 VanDerWaalsContact O-N 3.12Å; S174-R176 PolarHBondContact O-N 3.27Å
175	L	97.7	Very high	96.6	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	24%	0.239	C	C	.	.			trans	-56.3	138.3	178.9	-81.2	178.4	0	0	0	111.8	L151 L154 V172 P173 L197 N199 L200	L151-L175 HydrophobicContact CD2-CD2 4.03Å; L151-L175 HydrophobicContact CG-CD2 3.96Å; L151-L175 PolarHBondContact O-N 2.84Å; L154-L175 HydrophobicContact CB-CD1 4.35Å; L154-L175 HydrophobicContact CB-CD2 3.81Å; L154-L175 HydrophobicContact CD2-CD1 4.29Å; V172-L175 HydrophobicContact CB-CD1 4.18Å; V172-L175 HydrophobicContact CB-CG 4.08Å; V172-L175 HydrophobicContact CG2-CD1 3.51Å; V172-L175 HydrophobicContact CG2-CG 3.97Å; V172-L175 WeakPolarHBondContact O-CG 3.34Å; V172-L175 PolarHBondContact O-N 2.81Å; P173-L175 VanDerWaalsContact C-N 3.31Å; L175-L197 HydrophobicContact CB-CD2 4.09Å; L175-L197 HydrophobicContact CD1-CD2 4.04Å; L175-N199 CarbonylContact O-C 3.32Å; L175-N199 VanDerWaalsContact O-C 3.28Å; L175-L200 HydrophobicContact CB-CD1 3.98Å; L175-L200 WeakPolarHBondContact O-CA 3.44Å; L175-L200 PolarHBondContact O-N 2.88Å
176	R	98.3	Very high	96.6	Very high	107 Å²	107	51.2 Å²	51.2	40%	0.404	23%	0.228	S	C	.	.			trans	-119.1	-31.1	175.6	-63.6	-169.4	178.2	-146.5	-2	112.1	K152 S174 R201 Y202	K152-R176 HydrophobicContact CB-CB 4.4Å; K152-R176 HydrophobicContact CB-CG 4.38Å; K152-R176 PolarHBondContact O-N 3Å; S174-R176 PolarHBondContact O-N 3.27Å; R176-R201 WeakPolarHBondContact O-CA 3.45Å; R176-R201 PolarHBondContact O-N 3.09Å; R176-Y202 PolarHBondContact O-N 3.38Å
177	R	98.8	Very high	96.5	Very high	118 Å²	118	53.3 Å²	53.3	45%	0.445	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	125.2	178.3	-52.5	-166.4	166.3	96.5	2.3	110	K152 E153 L154 Y202	K152-R177 PolarHBondContact O-N 3.23Å; E153-R177 WeakPolarHBondContact CA-O 3.07Å; E153-R177 HydrophobicContact CB-CB 4.47Å; E153-R177 HydrophobicContact CG-CB 4.11Å; E153-R177 HydrophobicContact CG-CG 4.25Å; E153-R177 IonicContact OE1-CZ 2.85Å; E153-R177 IonicContact OE1-NH1 3.06Å; E153-R177 PolarHBondContact OE1-NH1 2.91Å; L154-R177 PolarHBondContact N-O 2.79Å; R177-Y202 WeakPolarHBondContact CA-O 3.49Å; R177-Y202 HydrophobicContact CB-CD1 4.15Å
178	L	98.8	Very high	96.5	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	120.3	177.3	177.6	59.3	0	0	0	109.1	L154 F169 L180 F194 L197 L200 Y202 L203 N204	L154-L178 HydrophobicContact CB-CD1 4.13Å; L154-L178 HydrophobicContact CD2-CD1 4.01Å; L154-L178 HydrophobicContact CG-CD1 4.11Å; F169-L178 HydrophobicContact CD2-CD2 4.04Å; F169-L178 HydrophobicContact CE1-CD1 4.09Å; F169-L178 HydrophobicContact CE1-CD2 4.36Å; F169-L178 HydrophobicContact CE2-CD2 3.85Å; F169-L178 HydrophobicContact CG-CD2 4.37Å; F169-L178 HydrophobicContact CZ-CD1 4.28Å; F169-L178 HydrophobicContact CZ-CD2 4.02Å; L178-L180 HydrophobicContact CD1-CD1 4.39Å; L178-L180 HydrophobicContact CD1-CD2 4.45Å; L178-L180 HydrophobicContact CD1-CG 4.09Å; L178-L180 HydrophobicContact CD2-CD1 3.81Å; L178-L180 HydrophobicContact CD2-CG 4.37Å; L178-L180 HydrophobicContact CG-CD1 3.98Å; L178-L180 HydrophobicContact CG-CG 3.99Å; L178-F194 HydrophobicContact CD2-CE1 4.44Å; L178-L197 HydrophobicContact CD2-CD1 3.95Å; L178-L200 HydrophobicContact CB-CD1 3.77Å; L178-L200 HydrophobicContact CB-CD2 4.22Å; L178-Y202 PolarHBondContact N-O 3.07Å; L178-L203 HydrophobicContact CB-CD1 4.23Å; L178-L203 HydrophobicContact CD2-CD1 4.06Å; L178-L203 HydrophobicContact CG-CD1 4.13Å; L178-L203 WeakPolarHBondContact O-CA 3.43Å; L178-N204 PolarHBondContact O-N 3.22Å
179	D	98.7	Very high	96.5	Very high	8 Å²	8	54.9 Å²	54.9	4%	0.043	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	108.5	176.5	-175.2	6.1	0	0	0	111.1	L154 W155 L156 R157 G181 N204	L154-D179 PolarHBondContact O-N 3.32Å; W155-D179 HydrophobicContact CD2-CB 4.14Å; W155-D179 HydrophobicContact CE3-CB 3.22Å; W155-D179 VanDerWaalsContact CE3-OD2 3.29Å; W155-D179 HydrophobicContact CZ3-CB 3.61Å; L156-D179 CarbonylContact C-O 3.52Å; L156-D179 WeakPolarHBondContact CA-O 3.46Å; L156-D179 PolarHBondContact N-O 3.46Å; R157-D179 PolarHBondContact N-O 3.42Å; D179-G181 PolarHBondContact OD1-N 3.03Å; D179-N204 HydrophobicContact CB-CB 4.42Å; D179-N204 WeakPolarHBondContact OD1-CB 3.27Å; D179-N204 PolarHBondContact OD1-ND2 3.09Å
180	L	98.3	Very high	96.6	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	25%	0.254	C	S	.	.			trans	-116.4	29.6	176.2	-66.9	167	0	0	0	110.3	L156 I164 F169 L178 L183 F194 L203 N204 L205 C208	L156-L180 HydrophobicContact CB-CD2 3.9Å; L156-L180 HydrophobicContact CD1-CD2 3.93Å; I164-L180 HydrophobicContact CD1-CD1 3.99Å; F169-L180 HydrophobicContact CE2-CD1 4.08Å; F169-L180 HydrophobicContact CZ-CD1 3.91Å; F169-L180 HydrophobicContact CZ-CD2 4.05Å; F169-L180 HydrophobicContact CZ-CG 4.49Å; L178-L180 HydrophobicContact CD1-CD1 4.39Å; L178-L180 HydrophobicContact CD1-CD2 4.45Å; L178-L180 HydrophobicContact CD1-CG 4.09Å; L178-L180 HydrophobicContact CD2-CD1 3.81Å; L178-L180 HydrophobicContact CD2-CG 4.37Å; L178-L180 HydrophobicContact CG-CD1 3.98Å; L178-L180 HydrophobicContact CG-CG 3.99Å; L180-L183 HydrophobicContact CB-CD1 3.93Å; L180-L183 HydrophobicContact CD2-CD1 4.13Å; L180-L183 WeakPolarHBondContact O-CD1 3.08Å; L180-L183 VanDerWaalsContact O-CG 3.24Å; L180-L183 WeakPolarHBondContact O-CG 3.42Å; L180-F194 HydrophobicContact CD1-CE1 3.95Å; L180-L203 HydrophobicContact CD1-CD1 4.47Å; L180-N204 CarbonylContact C-O 3.18Å; L180-N204 VanDerWaalsContact C-O 3.23Å; L180-N204 VanDerWaalsContact CA-O 3.31Å; L180-N204 WeakPolarHBondContact CA-O 3.36Å; L180-N204 WeakPolarHBondContact CB-O 3.13Å; L180-N204 PolarHBondContact N-O 3.03Å; L180-L205 HydrophobicContact CB-CD2 3.9Å; L180-L205 HydrophobicContact CD1-CD2 4.15Å; L180-C208 PolarHBondContact O-SG 3.41Å
181	G	97.7	Very high	96.6	Very high	2 Å²	2	58.6 Å²	58.6	2%	0.021	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	163.3	178.8	0	0	0	0	0	113.8	R157 N158 D179 L183 N204 G206	R157-G181 CarbonylContact C-O 3.54Å; R157-G181 WeakPolarHBondContact CA-O 3.19Å; R157-G181 VanDerWaalsContact CB-O 3.29Å; R157-G181 WeakPolarHBondContact CB-O 3.38Å; N158-G181 PolarHBondContact N-O 3.14Å; D179-G181 PolarHBondContact OD1-N 3.03Å; G181-L183 PolarHBondContact O-N 3.33Å; G181-L183 VanDerWaalsContact O-N 3.13Å; G181-N204 PolarHBondContact N-O 3.44Å; G181-G206 CarbonylContact C-O 3.48Å; G181-G206 VanDerWaalsContact CA-O 3.24Å; G181-G206 WeakPolarHBondContact CA-O 3.19Å
182	E	97.7	Very high	96.9	Very high	57 Å²	57	52.6 Å²	52.6	27%	0.266	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.7	28.1	175	-59.2	-176	-110.7	0	0	114.8	R157 N158 K184 G206 M207	R157-E182 IonicContact NH1-OE1 2.88Å; N158-E182 HydrophobicContact CB-CB 3.97Å; E182-K184 PolarHBondContact O-N 2.81Å; E182-G206 PolarHBondContact N-O 3.07Å; E182-M207 WeakPolarHBondContact CA-O 3.48Å; E182-M207 HydrophobicContact CG-CB 4.08Å; E182-M207 HydrophobicContact CG-SD 4.05Å
183	L	97.9	Very high	97	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	25%	0.249	C	C	.	.			trans	-79.3	73.6	175.5	-58.3	179.5	0	0	0	110.6	N159 I161 L180 G181 R185 L186 C208	N159-L183 HydrophobicContact CB-CD2 4.16Å; N159-L183 VanDerWaalsContact O-CD2 3.25Å; N159-L183 WeakPolarHBondContact O-CD2 3.31Å; I161-L183 HydrophobicContact CB-CD1 4.36Å; I161-L183 HydrophobicContact CB-CD2 4.14Å; I161-L183 HydrophobicContact CD1-CD1 4.41Å; I161-L183 HydrophobicContact CD1-CD2 3.97Å; I161-L183 HydrophobicContact CG1-CD2 4.23Å; L180-L183 HydrophobicContact CB-CD1 3.93Å; L180-L183 HydrophobicContact CD2-CD1 4.13Å; L180-L183 WeakPolarHBondContact O-CD1 3.08Å; L180-L183 VanDerWaalsContact O-CG 3.24Å; L180-L183 WeakPolarHBondContact O-CG 3.42Å; G181-L183 PolarHBondContact O-N 3.33Å; G181-L183 VanDerWaalsContact O-N 3.13Å; L183-R185 PolarHBondContact O-N 3.22Å; L183-L186 HydrophobicContact CB-CB 3.9Å; L183-L186 HydrophobicContact CB-CD2 4.35Å; L183-L186 HydrophobicContact CD1-CD2 4.26Å; L183-L186 WeakPolarHBondContact O-CB 3.34Å; L183-L186 PolarHBondContact O-N 3.11Å; L183-C208 PolarHBondContact N-SG 3.02Å
184	K	95.8	Very high	97.1	Very high	131 Å²	131	49.8 Å²	49.8	57%	0.57	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-18.6	-171.9	-66.3	174.5	-175.9	169.5	0	115.2	E182	E182-K184 PolarHBondContact O-N 2.81Å
185	R	96.2	Very high	97.2	Very high	163 Å²	163	52 Å²	52	62%	0.615	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.8	4.7	178.2	-68.2	-166.5	178.2	172	-3.1	113.4	P160 I161 L183 S187	P160-R185 HydrophobicContact CB-CG 4.48Å; I161-R185 CarbonylContact O-C 3.59Å; I161-R185 VanDerWaalsContact O-C 3.32Å; L183-R185 PolarHBondContact O-N 3.22Å; R185-S187 PolarHBondContact O-N 2.96Å
186	L	97.1	Very high	97	Very high	19 Å²	19	53.5 Å²	53.5	10%	0.099	25%	0.253	C	S	.	.			trans	-66.2	123.7	-179	-174.4	60.3	0	0	0	109.7	I161 I164 L183 I189 C208 L210	I161-L186 WeakPolarHBondContact O-CA 3.47Å; I161-L186 PolarHBondContact O-N 3.18Å; I164-L186 HydrophobicContact CD1-CD1 4.37Å; I164-L186 HydrophobicContact CD1-CD2 4.22Å; I164-L186 HydrophobicContact CG1-CD1 3.9Å; L183-L186 HydrophobicContact CB-CB 3.9Å; L183-L186 HydrophobicContact CB-CD2 4.35Å; L183-L186 HydrophobicContact CD1-CD2 4.26Å; L183-L186 WeakPolarHBondContact O-CB 3.34Å; L183-L186 PolarHBondContact O-N 3.11Å; L186-I189 HydrophobicContact CD1-CG1 4.38Å; L186-I189 HydrophobicContact CD2-CD1 3.9Å; L186-I189 HydrophobicContact CD2-CG1 3.96Å; L186-I189 HydrophobicContact CG-CG1 4.35Å; L186-C208 HydrophobicContact CD2-CB 4.22Å; L186-L210 HydrophobicContact CD2-CD2 4.08Å
187	S	94.5	Very high	96.9	Very high	101 Å²	101	48.4 Å²	48.4	71%	0.706	23%	0.234	S	C	*	.			trans	-116.5	-26.4	-176.3	65.4	0	0	0	0	112.8	E162 R185	E162-S187 PolarHBondContact O-N 3Å; E162-S187 PolarHBondContact O-OG 2.88Å; R185-S187 PolarHBondContact O-N 2.96Å
188	Y	95.4	Very high	96.7	Very high	132 Å²	132	45.3 Å²	45.3	52%	0.518	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	132.6	-172.9	178.2	-106	0	0	0	111.9	S163 I164	S163-Y188 CarbonylContact C-O 3.32Å; S163-Y188 VanDerWaalsContact CA-O 3.22Å; S163-Y188 WeakPolarHBondContact CA-O 3.3Å; I164-Y188 PolarHBondContact N-O 3Å
189	I	97.6	Very high	96.6	Very high	29 Å²	29	48 Å²	48	15%	0.149	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	126.2	167.8	-56.7	-179.3	0	0	0	106.8	I164 L186 A193 F194 L210 P214	I164-I189 HydrophobicContact CB-CG1 4.49Å; I164-I189 HydrophobicContact CB-CG2 4.31Å; I164-I189 HydrophobicContact CD1-CD1 4.26Å; I164-I189 HydrophobicContact CD1-CG1 4.1Å; I164-I189 HydrophobicContact CG1-CG1 4.4Å; L186-I189 HydrophobicContact CD1-CG1 4.38Å; L186-I189 HydrophobicContact CD2-CD1 3.9Å; L186-I189 HydrophobicContact CD2-CG1 3.96Å; L186-I189 HydrophobicContact CG-CG1 4.35Å; I189-A193 HydrophobicContact CG2-CB 3.67Å; I189-F194 HydrophobicContact CG2-CE2 4.12Å; I189-L210 HydrophobicContact CD1-CD1 4.37Å; I189-L210 HydrophobicContact CD1-CD2 3.73Å; I189-P214 HydrophobicContact CB-CB 4.35Å; I189-P214 HydrophobicContact CD1-CB 4.13Å; I189-P214 HydrophobicContact CD1-CG 4.15Å; I189-P214 HydrophobicContact CG2-CB 3.89Å
190	S	97.3	Very high	96.6	Very high	11 Å²	11	47.6 Å²	47.6	8%	0.077	24%	0.242	C	C	.	.			trans	-72.1	147.3	175.8	-173.2	0	0	0	0	111.9	I164 S166 G192 A193	I164-S190 WeakPolarHBondContact O-CB 3.19Å; I164-S190 PolarHBondContact O-N 3.13Å; S166-S190 PolarHBondContact OG-OG 2.87Å; S190-G192 PolarHBondContact O-N 2.91Å; S190-A193 WeakPolarHBondContact O-CB 3.46Å; S190-A193 PolarHBondContact O-N 3.45Å
191	E	94.9	Very high	96.6	Very high	123 Å²	123	53 Å²	53	58%	0.575	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	-38.4	171.4	-73.3	-62	132.9	0	0	113.1	N215	E191-N215 PolarHBondContact O-ND2 2.98Å; E191-N215 VanDerWaalsContact OE2-CB 3.25Å; E191-N215 WeakPolarHBondContact OE2-CB 3.33Å; E191-N215 PolarHBondContact OE2-ND2 3.36Å; E191-N215 VanDerWaalsContact OE2-ND2 3.09Å
192	G	96.6	Very high	96.6	Very high	14 Å²	14	54.9 Å²	54.9	14%	0.144	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	17.4	177.3	0	0	0	0	0	114.2	Y167 S190 F194 E195	Y167-G192 PolarHBondContact N-O 3.16Å; S190-G192 PolarHBondContact O-N 2.91Å; G192-F194 VanDerWaalsContact C-N 3.31Å; G192-F194 PolarHBondContact O-N 3.26Å; G192-E195 WeakPolarHBondContact O-CB 3.35Å; G192-E195 PolarHBondContact O-N 2.98Å
193	A	97.8	Very high	96.7	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-40.5	-172.4	0	0	0	0	0	113.5	I164 P165 I189 S190	I164-A193 HydrophobicContact CB-CB 4.34Å; I164-A193 HydrophobicContact CG2-CB 3.6Å; P165-A193 WeakPolarHBondContact O-CA 3.25Å; I189-A193 HydrophobicContact CG2-CB 3.67Å; S190-A193 WeakPolarHBondContact O-CB 3.46Å; S190-A193 PolarHBondContact O-N 3.45Å
194	F	97.4	Very high	96.7	Very high	1 Å²	1	53.2 Å²	53.2	0%	0.004	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	13	-174.3	-56.9	-67.8	0	0	0	113.6	F169 L178 L180 I189 G192 L197 L203 L205 P214 L216 L219	F169-F194 HydrophobicContact CD2-CD1 4.46Å; F169-F194 HydrophobicContact CE2-CD1 4.41Å; F169-F194 HydrophobicContact CE2-CE1 4.32Å; L178-F194 HydrophobicContact CD2-CE1 4.44Å; L180-F194 HydrophobicContact CD1-CE1 3.95Å; I189-F194 HydrophobicContact CG2-CE2 4.12Å; G192-F194 VanDerWaalsContact C-N 3.31Å; G192-F194 PolarHBondContact O-N 3.26Å; F194-L197 HydrophobicContact CB-CD1 4.41Å; F194-L197 HydrophobicContact CD1-CD1 4.18Å; F194-L197 WeakPolarHBondContact O-CB 3.14Å; F194-L197 PolarHBondContact O-N 3Å; F194-L203 HydrophobicContact CE1-CD1 4.22Å; F194-L203 HydrophobicContact CE1-CD2 4.4Å; F194-L203 HydrophobicContact CZ-CD2 4.42Å; F194-L205 HydrophobicContact CE2-CD1 4.47Å; F194-L205 HydrophobicContact CZ-CD1 4.1Å; F194-L205 HydrophobicContact CZ-CD2 4.23Å; F194-P214 HydrophobicContact CE2-CB 4.32Å; F194-P214 HydrophobicContact CE2-CG 4.17Å; F194-L216 HydrophobicContact CD2-CD2 4.15Å; F194-L216 HydrophobicContact CE2-CD2 4.11Å; F194-L219 HydrophobicContact CB-CD1 4.4Å; F194-L219 HydrophobicContact CB-CD2 3.98Å; F194-L219 HydrophobicContact CB-CG 4.25Å; F194-L219 HydrophobicContact CG-CD1 4.45Å
195	E	96.3	Very high	96.8	Very high	77 Å²	77	47 Å²	47	36%	0.36	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	138.7	177.7	-83.3	-69.1	-177.5	0	0	112.7	Y167 G192 P218	Y167-E195 HydrophobicContact CD1-CB 3.56Å; Y167-E195 HydrophobicContact CD1-CG 4.4Å; Y167-E195 HydrophobicContact CE1-CB 3.65Å; Y167-E195 HydrophobicContact CE1-CG 4.04Å; Y167-E195 HydrophobicContact CG-CB 4.48Å; G192-E195 WeakPolarHBondContact O-CB 3.35Å; G192-E195 PolarHBondContact O-N 2.98Å; E195-P218 HydrophobicContact CG-CG 4.27Å
196	G	94.1	Very high	96.9	Very high	31 Å²	31	39.4 Å²	39.4	32%	0.32	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.4	-6	-176.1	0	0	0	0	0	115.8	P173 S198	P173-G196 WeakPolarHBondContact CB-O 3.47Å; G196-S198 VanDerWaalsContact C-N 3.3Å; G196-S198 PolarHBondContact O-N 3.36Å
197	L	96.4	Very high	96.9	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.228	C	C	.	.			trans	-88.7	46.2	-179.7	-65.5	-178.2	0	0	0	113.9	F169 L175 L178 F194 N199 L200 L219	F169-L197 HydrophobicContact CB-CD1 3.86Å; F169-L197 HydrophobicContact CB-CD2 3.77Å; F169-L197 HydrophobicContact CB-CG 3.99Å; F169-L197 HydrophobicContact CD2-CD1 3.95Å; F169-L197 HydrophobicContact CG-CD1 4.16Å; L175-L197 HydrophobicContact CB-CD2 4.09Å; L175-L197 HydrophobicContact CD1-CD2 4.04Å; L178-L197 HydrophobicContact CD2-CD1 3.95Å; F194-L197 HydrophobicContact CB-CD1 4.41Å; F194-L197 HydrophobicContact CD1-CD1 4.18Å; F194-L197 WeakPolarHBondContact O-CB 3.14Å; F194-L197 PolarHBondContact O-N 3Å; L197-N199 PolarHBondContact O-N 3.06Å; L197-N199 VanDerWaalsContact O-N 3.16Å; L197-L200 HydrophobicContact CB-CB 4.21Å; L197-L200 HydrophobicContact CD1-CD2 4.27Å; L197-L200 WeakPolarHBondContact O-CB 3.44Å; L197-L200 PolarHBondContact O-N 3.25Å; L197-L219 HydrophobicContact CB-CD2 3.68Å
198	S	94.6	Very high	97	Very high	53 Å²	53	38.7 Å²	38.7	37%	0.371	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-12.7	-174.5	60.7	0	0	0	0	115.3	G196 K221	G196-S198 VanDerWaalsContact C-N 3.3Å; G196-S198 PolarHBondContact O-N 3.36Å; S198-K221 WeakPolarHBondContact O-CD 3.48Å; S198-K221 WeakPolarHBondContact O-CG 3.47Å
199	N	96.5	Very high	97	Very high	55 Å²	55	35.9 Å²	35.9	29%	0.294	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.3	2.7	177.4	-64.4	-58.9	0	0	0	113.9	P173 L175 L197 K221	P173-N199 PolarHBondContact O-ND2 2.92Å; P173-N199 VanDerWaalsContact O-ND2 3.1Å; L175-N199 CarbonylContact O-C 3.32Å; L175-N199 VanDerWaalsContact O-C 3.28Å; L197-N199 PolarHBondContact O-N 3.06Å; L197-N199 VanDerWaalsContact O-N 3.16Å; N199-K221 PolarHBondContact OD1-NZ 3.4Å
200	L	98.3	Very high	97	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.186	C	C	.	.			trans	-67.5	133.5	-179.2	-159.5	76.6	0	0	0	110.1	L175 L178 L197 L203 L219 K221 L222	L175-L200 HydrophobicContact CB-CD1 3.98Å; L175-L200 WeakPolarHBondContact O-CA 3.44Å; L175-L200 PolarHBondContact O-N 2.88Å; L178-L200 HydrophobicContact CB-CD1 3.77Å; L178-L200 HydrophobicContact CB-CD2 4.22Å; L197-L200 HydrophobicContact CB-CB 4.21Å; L197-L200 HydrophobicContact CD1-CD2 4.27Å; L197-L200 WeakPolarHBondContact O-CB 3.44Å; L197-L200 PolarHBondContact O-N 3.25Å; L200-L203 HydrophobicContact CD2-CB 4.06Å; L200-L203 HydrophobicContact CD2-CD1 4.33Å; L200-L219 HydrophobicContact CB-CD2 4.15Å; L200-L219 HydrophobicContact CD2-CD1 4.33Å; L200-L219 HydrophobicContact CD2-CD2 3.86Å; L200-K221 CarbonylContact O-C 3.58Å; L200-K221 VanDerWaalsContact O-O 3.06Å; L200-L222 HydrophobicContact CD2-CD1 4.21Å; L200-L222 HydrophobicContact CG-CD1 4.38Å; L200-L222 WeakPolarHBondContact O-CA 3.46Å; L200-L222 PolarHBondContact O-N 3.12Å
201	R	98.3	Very high	96.8	Very high	115 Å²	115	42.7 Å²	42.7	43%	0.434	22%	0.217	S	C	.	.			trans	-116.1	-30.4	-179	-69.3	-177.8	176.5	-142.1	0.2	112.7	R176 D223 E224	R176-R201 WeakPolarHBondContact O-CA 3.45Å; R176-R201 PolarHBondContact O-N 3.09Å; R201-D223 HydrophobicContact CB-CB 4.37Å; R201-D223 WeakPolarHBondContact CB-OD2 3.22Å; R201-D223 VanDerWaalsContact CD-OD2 3.25Å; R201-D223 WeakPolarHBondContact CD-OD2 3.31Å; R201-D223 VanDerWaalsContact CG-OD2 3.31Å; R201-D223 WeakPolarHBondContact CG-OD2 3.23Å; R201-D223 IonicContact NE-OD2 2.92Å; R201-D223 IonicContact NH1-OD2 2.88Å; R201-D223 WeakPolarHBondContact O-CA 3.48Å; R201-D223 WeakPolarHBondContact O-CB 3.19Å; R201-D223 PolarHBondContact O-N 3.49Å; R201-E224 PolarHBondContact O-N 3.01Å
202	Y	98.8	Very high	96.8	Very high	40 Å²	40	43.6 Å²	43.6	16%	0.157	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	126.9	179.1	174	-88.1	0	0	0	109.7	W155 R176 R177 L178 N204 E224 W250	W155-Y202 HydrophobicContact CZ3-CE1 4.46Å; R176-Y202 PolarHBondContact O-N 3.38Å; R177-Y202 WeakPolarHBondContact CA-O 3.49Å; R177-Y202 HydrophobicContact CB-CD1 4.15Å; L178-Y202 PolarHBondContact N-O 3.07Å; Y202-N204 HydrophobicContact CE1-CB 3.77Å; Y202-E224 WeakPolarHBondContact CA-O 3.5Å; Y202-E224 HydrophobicContact CD2-CB 3.84Å; Y202-E224 WeakPolarHBondContact CD2-OE2 3.27Å; Y202-W250 HydrophobicContact CE2-CZ3 4.38Å
203	L	98.8	Very high	96.7	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	127.8	172.2	178.6	61.5	0	0	0	109.9	L178 L180 F194 L200 L205 L216 L219 L222 E224 L225 E226	L178-L203 HydrophobicContact CB-CD1 4.23Å; L178-L203 HydrophobicContact CD2-CD1 4.06Å; L178-L203 HydrophobicContact CG-CD1 4.13Å; L178-L203 WeakPolarHBondContact O-CA 3.43Å; L180-L203 HydrophobicContact CD1-CD1 4.47Å; F194-L203 HydrophobicContact CE1-CD1 4.22Å; F194-L203 HydrophobicContact CE1-CD2 4.4Å; F194-L203 HydrophobicContact CZ-CD2 4.42Å; L200-L203 HydrophobicContact CD2-CB 4.06Å; L200-L203 HydrophobicContact CD2-CD1 4.33Å; L203-L205 HydrophobicContact CD1-CG 4.25Å; L203-L205 HydrophobicContact CD2-CD1 3.86Å; L203-L205 HydrophobicContact CD2-CG 4.26Å; L203-L205 HydrophobicContact CG-CD1 4.25Å; L203-L205 HydrophobicContact CG-CG 4.1Å; L203-L216 HydrophobicContact CD2-CD2 3.86Å; L203-L219 HydrophobicContact CD2-CD1 3.58Å; L203-L222 HydrophobicContact CB-CD1 3.81Å; L203-L222 HydrophobicContact CB-CD2 4.42Å; L203-E224 PolarHBondContact N-O 2.99Å; L203-L225 HydrophobicContact CB-CD1 4.17Å; L203-L225 HydrophobicContact CD2-CD1 4.13Å; L203-L225 HydrophobicContact CG-CD1 4.2Å; L203-E226 PolarHBondContact O-N 2.85Å
204	N	98.7	Very high	96.7	Very high	22 Å²	22	44.8 Å²	44.8	12%	0.118	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	119.5	171	-177.8	10.1	0	0	0	111.1	L178 D179 L180 G181 Y202 G206 E226	L178-N204 PolarHBondContact O-N 3.22Å; D179-N204 HydrophobicContact CB-CB 4.42Å; D179-N204 WeakPolarHBondContact OD1-CB 3.27Å; D179-N204 PolarHBondContact OD1-ND2 3.09Å; L180-N204 CarbonylContact C-O 3.18Å; L180-N204 VanDerWaalsContact C-O 3.23Å; L180-N204 VanDerWaalsContact CA-O 3.31Å; L180-N204 WeakPolarHBondContact CA-O 3.36Å; L180-N204 WeakPolarHBondContact CB-O 3.13Å; L180-N204 PolarHBondContact N-O 3.03Å; G181-N204 PolarHBondContact N-O 3.44Å; Y202-N204 HydrophobicContact CE1-CB 3.77Å; N204-G206 PolarHBondContact OD1-N 3.18Å; N204-E226 HydrophobicContact CB-CB 4.15Å; N204-E226 VanDerWaalsContact OD1-CG 3.24Å; N204-E226 WeakPolarHBondContact OD1-CG 3.12Å
205	L	97.9	Very high	96.6	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.236	C	C	.	.			trans	-124.7	23.3	173	-68.8	171.7	0	0	0	111	L180 F194 L203 L210 P214 E226 N230	L180-L205 HydrophobicContact CB-CD2 3.9Å; L180-L205 HydrophobicContact CD1-CD2 4.15Å; F194-L205 HydrophobicContact CE2-CD1 4.47Å; F194-L205 HydrophobicContact CZ-CD1 4.1Å; F194-L205 HydrophobicContact CZ-CD2 4.23Å; L203-L205 HydrophobicContact CD1-CG 4.25Å; L203-L205 HydrophobicContact CD2-CD1 3.86Å; L203-L205 HydrophobicContact CD2-CG 4.26Å; L203-L205 HydrophobicContact CG-CD1 4.25Å; L203-L205 HydrophobicContact CG-CG 4.1Å; L205-L210 HydrophobicContact CB-CD1 4.11Å; L205-P214 HydrophobicContact CD1-CG 3.86Å; L205-E226 CarbonylContact C-O 3.38Å; L205-E226 PolarHBondContact N-O 3.27Å; L205-N230 PolarHBondContact O-ND2 3.48Å
206	G	97.8	Very high	96.6	Very high	5 Å²	5	43.5 Å²	43.5	5%	0.052	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	148.2	179.8	0	0	0	0	0	112.9	G181 E182 N204 C208 E226 S228	G181-G206 CarbonylContact C-O 3.48Å; G181-G206 VanDerWaalsContact CA-O 3.24Å; G181-G206 WeakPolarHBondContact CA-O 3.19Å; E182-G206 PolarHBondContact N-O 3.07Å; N204-G206 PolarHBondContact OD1-N 3.18Å; G206-C208 VanDerWaalsContact C-N 3.26Å; G206-C208 PolarHBondContact O-N 2.81Å; G206-C208 PolarHBondContact O-SG 3.07Å; G206-E226 PolarHBondContact N-O 2.8Å; G206-S228 CarbonylContact C-O 3.48Å; G206-S228 WeakPolarHBondContact CA-O 3.08Å
207	M	97.3	Very high	96.6	Very high	105 Å²	105	45 Å²	45	52%	0.517	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	34.5	178	-54.7	-175.7	-173.7	0	0	114.3	E182 S228 G229	E182-M207 WeakPolarHBondContact CA-O 3.48Å; E182-M207 HydrophobicContact CG-CB 4.08Å; E182-M207 HydrophobicContact CG-SD 4.05Å; M207-S228 PolarHBondContact N-O 3.27Å; M207-G229 WeakPolarHBondContact CA-O 3.24Å
208	C	97.3	Very high	96.6	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.229	C	C	.	.	S	Bend	trans	-101.3	5.1	179.8	-70.4	0	0	0	0	113.4	L180 L183 L186 G206 L210 N230	L180-C208 PolarHBondContact O-SG 3.41Å; L183-C208 PolarHBondContact N-SG 3.02Å; L186-C208 HydrophobicContact CD2-CB 4.22Å; G206-C208 VanDerWaalsContact C-N 3.26Å; G206-C208 PolarHBondContact O-N 2.81Å; G206-C208 PolarHBondContact O-SG 3.07Å; C208-L210 HydrophobicContact CB-CD1 4.3Å; C208-L210 HydrophobicContact CB-CD2 4.16Å; C208-L210 HydrophobicContact CB-CG 3.83Å; C208-L210 PolarHBondContact O-N 3.18Å; C208-N230 PolarHBondContact N-OD1 3.15Å; C208-N230 VanDerWaalsContact N-OD1 3.1Å
209	N	95.4	Very high	96.7	Very high	73 Å²	73	43.3 Å²	43.3	39%	0.39	21%	0.211	S	C	.	.			trans	56.9	30.5	-176.7	-57.6	-40.4	0	0	0	113.7	N230	N209-N230 PolarHBondContact N-OD1 3.03Å; N209-N230 VanDerWaalsContact N-OD1 3.12Å
210	L	95.7	Very high	96.6	Very high	19 Å²	19	44 Å²	44	10%	0.099	22%	0.217	C	C	.	.			trans	-67.4	134.1	-179.1	-59.1	177.8	0	0	0	110.8	L186 I189 L205 C208 N230 Q231 L232	L186-L210 HydrophobicContact CD2-CD2 4.08Å; I189-L210 HydrophobicContact CD1-CD1 4.37Å; I189-L210 HydrophobicContact CD1-CD2 3.73Å; L205-L210 HydrophobicContact CB-CD1 4.11Å; C208-L210 HydrophobicContact CB-CD1 4.3Å; C208-L210 HydrophobicContact CB-CD2 4.16Å; C208-L210 HydrophobicContact CB-CG 3.83Å; C208-L210 PolarHBondContact O-N 3.18Å; L210-N230 HydrophobicContact CB-CB 4.16Å; L210-N230 PolarHBondContact N-OD1 3.22Å; L210-Q231 CarbonylContact O-C 3.19Å; L210-Q231 VanDerWaalsContact O-C 3.23Å; L210-Q231 VanDerWaalsContact O-CA 3.28Å; L210-Q231 WeakPolarHBondContact O-CA 3.49Å; L210-Q231 PolarHBondContact O-N 3.35Å; L210-L232 HydrophobicContact CB-CD2 4.24Å
211	K	94.3	Very high	96.5	Very high	164 Å²	164	48.6 Å²	48.6	71%	0.713	24%	0.237	S	C	*	.	S	Bend	trans	-89.7	-24.9	175.3	-65.6	-177.9	179.5	179	0	112.9	Q231	K211-Q231 WeakPolarHBondContact CA-O 3.37Å
212	E	94.1	Very high	96.5	Very high	142 Å²	142	43.1 Å²	43.1	66%	0.664	22%	0.216	S	C	*	.	S	Bend	trans	-140.9	157.4	-179	64.3	-168.3	172.6	0	0	110
213	I	95.6	Very high	96.5	Very high	24 Å²	24	43 Å²	43	12%	0.123	22%	0.219	C	C	.	.			trans	-77.9	125.8	176.9	-62.8	165.4	0	0	0	107.3	L216 M227 L232 I235 F240	I213-L216 HydrophobicContact CG2-CD1 4.07Å; I213-L216 HydrophobicContact CG2-CG 4.5Å; I213-M227 HydrophobicContact CD1-CE 4Å; I213-M227 HydrophobicContact CG1-CE 4Å; I213-M227 HydrophobicContact CG1-SD 4.17Å; I213-M227 HydrophobicContact CG2-CE 4.49Å; I213-M227 HydrophobicContact CG2-SD 4.16Å; I213-L232 HydrophobicContact CD1-CD1 4.47Å; I213-L232 HydrophobicContact CG1-CD1 3.96Å; I213-L232 HydrophobicContact CG1-CD2 4.03Å; I213-I235 HydrophobicContact CD1-CD1 3.97Å; I213-F240 HydrophobicContact CD1-CE1 3.94Å; I213-F240 HydrophobicContact CD1-CE2 3.86Å; I213-F240 HydrophobicContact CD1-CZ 3.4Å; I213-F240 VanDerWaalsContact CD1-CZ 3.4Å
214	P	96.3	Very high	96.5	Very high	15 Å²	15	45.4 Å²	45.4	10%	0.097	23%	0.229	C	C	.	.			trans	-69.8	170.7	179.2	30.3	-35.4	0	0	0	111.1	I189 F194 L205 L216	I189-P214 HydrophobicContact CB-CB 4.35Å; I189-P214 HydrophobicContact CD1-CB 4.13Å; I189-P214 HydrophobicContact CD1-CG 4.15Å; I189-P214 HydrophobicContact CG2-CB 3.89Å; F194-P214 HydrophobicContact CE2-CB 4.32Å; F194-P214 HydrophobicContact CE2-CG 4.17Å; L205-P214 HydrophobicContact CD1-CG 3.86Å; P214-L216 HydrophobicContact CG-CD2 4.07Å; P214-L216 WeakPolarHBondContact O-CG 3.39Å; P214-L216 PolarHBondContact O-N 3.42Å; P214-L216 VanDerWaalsContact O-N 3.1Å
215	N	95.7	Very high	96.4	Very high	46 Å²	46	44.3 Å²	44.3	25%	0.246	22%	0.224	C	C	.	.			trans	-68.2	111	175.6	-174.7	-4.8	0	0	0	111.6	E191 T217	E191-N215 PolarHBondContact O-ND2 2.98Å; E191-N215 VanDerWaalsContact OE2-CB 3.25Å; E191-N215 WeakPolarHBondContact OE2-CB 3.33Å; E191-N215 PolarHBondContact OE2-ND2 3.36Å; E191-N215 VanDerWaalsContact OE2-ND2 3.09Å; N215-T217 WeakPolarHBondContact OD1-CB 3.41Å; N215-T217 WeakPolarHBondContact OD1-CG2 3.49Å; N215-T217 PolarHBondContact OD1-N 2.76Å; N215-T217 VanDerWaalsContact OD1-N 3.08Å; N215-T217 PolarHBondContact OD1-OG1 3.46Å
216	L	96.4	Very high	96.5	Very high	4 Å²	4	46 Å²	46	2%	0.021	23%	0.232	C	C	.	.			trans	-105.3	3.5	179.8	-57.5	179.1	0	0	0	113.1	F194 L203 I213 P214 P218 L219 L225 L243	F194-L216 HydrophobicContact CD2-CD2 4.15Å; F194-L216 HydrophobicContact CE2-CD2 4.11Å; L203-L216 HydrophobicContact CD2-CD2 3.86Å; I213-L216 HydrophobicContact CG2-CD1 4.07Å; I213-L216 HydrophobicContact CG2-CG 4.5Å; P214-L216 HydrophobicContact CG-CD2 4.07Å; P214-L216 WeakPolarHBondContact O-CG 3.39Å; P214-L216 PolarHBondContact O-N 3.42Å; P214-L216 VanDerWaalsContact O-N 3.1Å; L216-P218 VanDerWaalsContact C-N 3.29Å; L216-P218 VanDerWaalsContact O-N 3.16Å; L216-L219 HydrophobicContact CB-CD1 4.35Å; L216-L219 HydrophobicContact CD2-CD1 3.86Å; L216-L219 WeakPolarHBondContact O-CB 3.44Å; L216-L219 PolarHBondContact O-N 3.37Å; L216-L225 HydrophobicContact CD1-CD1 4.3Å; L216-L225 HydrophobicContact CD1-CD2 3.53Å; L216-L243 HydrophobicContact CB-CD1 4.13Å; L216-L243 HydrophobicContact CB-CD2 4.22Å; L216-L243 HydrophobicContact CD1-CD1 4.02Å
217	T	94.5	Very high	96.5	Very high	62 Å²	62	45.8 Å²	45.8	38%	0.38	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-31.3	-176.8	60.3	0	0	0	0	115.1	N215 L219 K241	N215-T217 WeakPolarHBondContact OD1-CB 3.41Å; N215-T217 WeakPolarHBondContact OD1-CG2 3.49Å; N215-T217 PolarHBondContact OD1-N 2.76Å; N215-T217 VanDerWaalsContact OD1-N 3.08Å; N215-T217 PolarHBondContact OD1-OG1 3.46Å; T217-L219 PolarHBondContact O-N 3.37Å; T217-K241 HydrophobicContact CG2-CB 4.33Å
218	P	96	Very high	96.5	Very high	19 Å²	19	41.7 Å²	41.7	12%	0.123	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-17	176.6	-20.9	35.3	0	0	0	114.3	E195 L216 V220	E195-P218 HydrophobicContact CG-CG 4.27Å; L216-P218 VanDerWaalsContact C-N 3.29Å; L216-P218 VanDerWaalsContact O-N 3.16Å; P218-V220 PolarHBondContact O-N 2.78Å
219	L	96.6	Very high	96.5	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.222	C	C	.	.			trans	-87.5	55.4	-171.7	-55.8	180	0	0	0	112	F194 L197 L200 L203 L216 T217 K221 L222 L243	F194-L219 HydrophobicContact CB-CD1 4.4Å; F194-L219 HydrophobicContact CB-CD2 3.98Å; F194-L219 HydrophobicContact CB-CG 4.25Å; F194-L219 HydrophobicContact CG-CD1 4.45Å; L197-L219 HydrophobicContact CB-CD2 3.68Å; L200-L219 HydrophobicContact CB-CD2 4.15Å; L200-L219 HydrophobicContact CD2-CD1 4.33Å; L200-L219 HydrophobicContact CD2-CD2 3.86Å; L203-L219 HydrophobicContact CD2-CD1 3.58Å; L216-L219 HydrophobicContact CB-CD1 4.35Å; L216-L219 HydrophobicContact CD2-CD1 3.86Å; L216-L219 WeakPolarHBondContact O-CB 3.44Å; L216-L219 PolarHBondContact O-N 3.37Å; T217-L219 PolarHBondContact O-N 3.37Å; L219-K221 PolarHBondContact O-N 3.44Å; L219-K221 VanDerWaalsContact O-N 3.11Å; L219-L222 HydrophobicContact CB-CB 4.14Å; L219-L222 HydrophobicContact CB-CD2 4.38Å; L219-L222 HydrophobicContact CD1-CD1 4.5Å; L219-L222 HydrophobicContact CD1-CD2 4.17Å; L219-L222 VanDerWaalsContact O-CB 3.28Å; L219-L222 WeakPolarHBondContact O-CB 3.28Å; L219-L222 PolarHBondContact O-N 2.99Å; L219-L222 VanDerWaalsContact O-N 3.11Å; L219-L243 HydrophobicContact CB-CD2 4.31Å
220	V	94.4	Very high	96.6	Very high	70 Å²	70	39.4 Å²	39.4	42%	0.424	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-21.4	-170.2	-62.1	0	0	0	0	114.9	P218 H245	P218-V220 PolarHBondContact O-N 2.78Å; V220-H245 PolarHBondContact O-CD2 2.97Å; V220-H245 VanDerWaalsContact O-CD2 3.23Å
221	K	96.6	Very high	96.6	Very high	95 Å²	95	42.6 Å²	42.6	41%	0.413	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.2	17.3	178.7	-65.1	-173.9	-170.9	166.6	0	113.7	S198 N199 L200 L219 D223	S198-K221 WeakPolarHBondContact O-CD 3.48Å; S198-K221 WeakPolarHBondContact O-CG 3.47Å; N199-K221 PolarHBondContact OD1-NZ 3.4Å; L200-K221 CarbonylContact O-C 3.58Å; L200-K221 VanDerWaalsContact O-O 3.06Å; L219-K221 PolarHBondContact O-N 3.44Å; L219-K221 VanDerWaalsContact O-N 3.11Å; K221-D223 PolarHBondContact O-N 3.48Å
222	L	98.3	Very high	96.7	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.005	19%	0.185	C	C	.	.			trans	-67.4	124	-177.4	-161.9	69.6	0	0	0	109.9	L200 L203 L219 L225 L243 H245 L246	L200-L222 HydrophobicContact CD2-CD1 4.21Å; L200-L222 HydrophobicContact CG-CD1 4.38Å; L200-L222 WeakPolarHBondContact O-CA 3.46Å; L200-L222 PolarHBondContact O-N 3.12Å; L203-L222 HydrophobicContact CB-CD1 3.81Å; L203-L222 HydrophobicContact CB-CD2 4.42Å; L219-L222 HydrophobicContact CB-CB 4.14Å; L219-L222 HydrophobicContact CB-CD2 4.38Å; L219-L222 HydrophobicContact CD1-CD1 4.5Å; L219-L222 HydrophobicContact CD1-CD2 4.17Å; L219-L222 VanDerWaalsContact O-CB 3.28Å; L219-L222 WeakPolarHBondContact O-CB 3.28Å; L219-L222 PolarHBondContact O-N 2.99Å; L219-L222 VanDerWaalsContact O-N 3.11Å; L222-L225 HydrophobicContact CD2-CB 4.09Å; L222-L225 HydrophobicContact CD2-CD1 4.3Å; L222-L243 HydrophobicContact CB-CD2 4.27Å; L222-L243 HydrophobicContact CD2-CD2 4.23Å; L222-H245 CarbonylContact O-C 3.59Å; L222-L246 HydrophobicContact CB-CD1 4.23Å; L222-L246 HydrophobicContact CD2-CD1 3.95Å; L222-L246 HydrophobicContact CG-CD1 3.89Å; L222-L246 WeakPolarHBondContact O-CA 3.4Å; L222-L246 PolarHBondContact O-N 3.01Å
223	D	97.9	Very high	96.7	Very high	38 Å²	38	30.6 Å²	30.6	20%	0.203	17%	0.171	C	C	.	.			trans	-98.9	-38.3	179.7	-62	-33.9	0	0	0	110.4	R201 K221 Q247 K248	R201-D223 HydrophobicContact CB-CB 4.37Å; R201-D223 WeakPolarHBondContact CB-OD2 3.22Å; R201-D223 VanDerWaalsContact CD-OD2 3.25Å; R201-D223 WeakPolarHBondContact CD-OD2 3.31Å; R201-D223 VanDerWaalsContact CG-OD2 3.31Å; R201-D223 WeakPolarHBondContact CG-OD2 3.23Å; R201-D223 IonicContact NE-OD2 2.92Å; R201-D223 IonicContact NH1-OD2 2.88Å; R201-D223 WeakPolarHBondContact O-CA 3.48Å; R201-D223 WeakPolarHBondContact O-CB 3.19Å; R201-D223 PolarHBondContact O-N 3.49Å; K221-D223 PolarHBondContact O-N 3.48Å; D223-Q247 PolarHBondContact O-N 3.1Å; D223-K248 PolarHBondContact O-N 3.3Å
224	E	98.6	Very high	96.7	Very high	49 Å²	49	31.4 Å²	31.4	23%	0.229	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	127.6	-172.6	-58.4	-172.5	170.2	0	0	111.3	R201 Y202 L203 K248	R201-E224 PolarHBondContact O-N 3.01Å; Y202-E224 WeakPolarHBondContact CA-O 3.5Å; Y202-E224 HydrophobicContact CD2-CB 3.84Å; Y202-E224 WeakPolarHBondContact CD2-OE2 3.27Å; L203-E224 PolarHBondContact N-O 2.99Å; E224-K248 HydrophobicContact CB-CB 4.47Å; E224-K248 HydrophobicContact CG-CB 4.15Å; E224-K248 HydrophobicContact CG-CD 4.06Å; E224-K248 HydrophobicContact CG-CG 4.25Å; E224-K248 WeakPolarHBondContact OE1-CE 3.32Å; E224-K248 IonicContact OE1-NZ 2.97Å; E224-K248 PolarHBondContact OE1-NZ 3.29Å
225	L	98.6	Very high	96.6	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	119	178.7	178.4	59	0	0	0	111.1	L203 L216 L222 M227 F240 L243 L246 K248 L249 W250	L203-L225 HydrophobicContact CB-CD1 4.17Å; L203-L225 HydrophobicContact CD2-CD1 4.13Å; L203-L225 HydrophobicContact CG-CD1 4.2Å; L216-L225 HydrophobicContact CD1-CD1 4.3Å; L216-L225 HydrophobicContact CD1-CD2 3.53Å; L222-L225 HydrophobicContact CD2-CB 4.09Å; L222-L225 HydrophobicContact CD2-CD1 4.3Å; L225-M227 HydrophobicContact CD1-CG 3.91Å; L225-M227 HydrophobicContact CD1-SD 4.35Å; L225-M227 HydrophobicContact CD2-CE 4.01Å; L225-M227 HydrophobicContact CD2-CG 4.34Å; L225-M227 HydrophobicContact CD2-SD 4.03Å; L225-M227 HydrophobicContact CG-CE 4.47Å; L225-M227 HydrophobicContact CG-CG 3.93Å; L225-M227 HydrophobicContact CG-SD 4.27Å; L225-F240 HydrophobicContact CD2-CD1 4.34Å; L225-F240 HydrophobicContact CD2-CE1 4.08Å; L225-L243 HydrophobicContact CD2-CD1 4.35Å; L225-L246 HydrophobicContact CB-CD1 3.79Å; L225-L246 HydrophobicContact CB-CD2 4.28Å; L225-K248 PolarHBondContact N-O 3.44Å; L225-L249 HydrophobicContact CB-CD1 4.13Å; L225-L249 HydrophobicContact CD2-CD1 3.87Å; L225-L249 HydrophobicContact CG-CD1 4.04Å; L225-W250 PolarHBondContact O-N 3.1Å
226	E	98.6	Very high	96.4	Very high	36 Å²	36	34.5 Å²	34.5	17%	0.168	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	117.3	175.7	-179.9	56.4	-95.2	0	0	110.5	L203 N204 L205 G206 S228 W250	L203-E226 PolarHBondContact O-N 2.85Å; N204-E226 HydrophobicContact CB-CB 4.15Å; N204-E226 VanDerWaalsContact OD1-CG 3.24Å; N204-E226 WeakPolarHBondContact OD1-CG 3.12Å; L205-E226 CarbonylContact C-O 3.38Å; L205-E226 PolarHBondContact N-O 3.27Å; G206-E226 PolarHBondContact N-O 2.8Å; E226-S228 WeakPolarHBondContact OE1-CA 2.95Å; E226-S228 WeakPolarHBondContact OE1-CB 3.43Å; E226-S228 PolarHBondContact OE1-N 3.12Å; E226-S228 PolarHBondContact OE1-OG 3.04Å; E226-W250 HydrophobicContact CB-CE3 3.94Å; E226-W250 HydrophobicContact CG-CE3 4.41Å; E226-W250 WeakPolarHBondContact OE1-CB 3.27Å; E226-W250 WeakPolarHBondContact OE2-CB 3.07Å
227	M	97.3	Very high	96.1	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.191	C	C	.	.			trans	-132.8	17.7	177.9	-63.2	-166.9	-57.5	0	0	112.7	I213 L225 N230 L232 F240 L249 W250 M251	I213-M227 HydrophobicContact CD1-CE 4Å; I213-M227 HydrophobicContact CG1-CE 4Å; I213-M227 HydrophobicContact CG1-SD 4.17Å; I213-M227 HydrophobicContact CG2-CE 4.49Å; I213-M227 HydrophobicContact CG2-SD 4.16Å; L225-M227 HydrophobicContact CD1-CG 3.91Å; L225-M227 HydrophobicContact CD1-SD 4.35Å; L225-M227 HydrophobicContact CD2-CE 4.01Å; L225-M227 HydrophobicContact CD2-CG 4.34Å; L225-M227 HydrophobicContact CD2-SD 4.03Å; L225-M227 HydrophobicContact CG-CE 4.47Å; L225-M227 HydrophobicContact CG-CG 3.93Å; L225-M227 HydrophobicContact CG-SD 4.27Å; M227-N230 PolarHBondContact O-ND2 3.21Å; M227-L232 HydrophobicContact CB-CD1 4.38Å; M227-L232 HydrophobicContact CE-CD1 4.21Å; M227-L232 HydrophobicContact SD-CD1 4.49Å; M227-F240 HydrophobicContact CE-CE1 3.46Å; M227-F240 VanDerWaalsContact CE-CE1 3.46Å; M227-F240 HydrophobicContact CE-CZ 3.7Å; M227-L249 HydrophobicContact CE-CD1 4.09Å; M227-W250 CarbonylContact C-O 3.4Å; M227-W250 WeakPolarHBondContact CA-O 3.49Å; M227-W250 PolarHBondContact N-O 3.46Å; M227-M251 HydrophobicContact CB-CG 4.36Å; M227-M251 HydrophobicContact CE-CG 3.93Å; M227-M251 HydrophobicContact CE-SD 3.86Å
228	S	98.2	Very high	95.6	Very high	19 Å²	19	34.6 Å²	34.6	13%	0.133	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	148.9	179.8	-58.9	0	0	0	0	112.3	G206 M207 E226 W250 M252	G206-S228 CarbonylContact C-O 3.48Å; G206-S228 WeakPolarHBondContact CA-O 3.08Å; M207-S228 PolarHBondContact N-O 3.27Å; E226-S228 WeakPolarHBondContact OE1-CA 2.95Å; E226-S228 WeakPolarHBondContact OE1-CB 3.43Å; E226-S228 PolarHBondContact OE1-N 3.12Å; E226-S228 PolarHBondContact OE1-OG 3.04Å; S228-W250 PolarHBondContact N-O 2.79Å; S228-M252 CarbonylContact C-O 3.12Å; S228-M252 WeakPolarHBondContact CA-O 3.39Å; S228-M252 WeakPolarHBondContact CB-O 3.33Å; S228-M252 WeakPolarHBondContact OG-CB 3.2Å; S228-M252 PolarHBondContact OG-N 2.74Å
229	G	97	Very high	95.4	Very high	22 Å²	22	35.2 Å²	35.2	23%	0.227	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.7	22.7	178.6	0	0	0	0	0	114.7	M207 M252 H253	M207-G229 WeakPolarHBondContact CA-O 3.24Å; G229-M252 PolarHBondContact N-O 3.09Å; G229-H253 WeakPolarHBondContact CA-O 3.32Å
230	N	97.6	Very high	95.3	Very high	3 Å²	3	35.3 Å²	35.3	2%	0.016	20%	0.197	C	C	.	.	S	Bend	trans	-96.1	-170.7	171.6	-74.9	-52.7	0	0	0	111.9	L205 C208 N209 L210 M227 L232 A254	L205-N230 PolarHBondContact O-ND2 3.48Å; C208-N230 PolarHBondContact N-OD1 3.15Å; C208-N230 VanDerWaalsContact N-OD1 3.1Å; N209-N230 PolarHBondContact N-OD1 3.03Å; N209-N230 VanDerWaalsContact N-OD1 3.12Å; L210-N230 HydrophobicContact CB-CB 4.16Å; L210-N230 PolarHBondContact N-OD1 3.22Å; M227-N230 PolarHBondContact O-ND2 3.21Å; N230-L232 HydrophobicContact CB-CD1 4.33Å; N230-L232 HydrophobicContact CB-CD2 4.45Å; N230-L232 HydrophobicContact CB-CG 3.91Å; N230-A254 CarbonylContact O-C 3.35Å; N230-A254 VanDerWaalsContact O-CA 3.25Å; N230-A254 WeakPolarHBondContact O-CA 3.39Å
231	Q	96.1	Very high	95.1	Very high	85 Å²	85	35.6 Å²	35.6	40%	0.397	19%	0.193	S	C	.	.			trans	-123.7	47.3	-177.5	-59.8	176.6	26.2	0	0	110.7	L210 K211 S233 A254	L210-Q231 CarbonylContact O-C 3.19Å; L210-Q231 VanDerWaalsContact O-C 3.23Å; L210-Q231 VanDerWaalsContact O-CA 3.28Å; L210-Q231 WeakPolarHBondContact O-CA 3.49Å; L210-Q231 PolarHBondContact O-N 3.35Å; K211-Q231 WeakPolarHBondContact CA-O 3.37Å; Q231-S233 PolarHBondContact O-N 3.47Å; Q231-A254 CarbonylContact C-O 3.47Å
232	L	95.2	Very high	94.7	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.005	19%	0.187	C	C	.	.			trans	-82.9	52.3	-171.8	-58.4	177.4	0	0	0	112.1	L210 I213 M227 N230 V234 I235 A254 I256	L210-L232 HydrophobicContact CB-CD2 4.24Å; I213-L232 HydrophobicContact CD1-CD1 4.47Å; I213-L232 HydrophobicContact CG1-CD1 3.96Å; I213-L232 HydrophobicContact CG1-CD2 4.03Å; M227-L232 HydrophobicContact CB-CD1 4.38Å; M227-L232 HydrophobicContact CE-CD1 4.21Å; M227-L232 HydrophobicContact SD-CD1 4.49Å; N230-L232 HydrophobicContact CB-CD1 4.33Å; N230-L232 HydrophobicContact CB-CD2 4.45Å; N230-L232 HydrophobicContact CB-CG 3.91Å; L232-V234 PolarHBondContact O-N 3.15Å; L232-I235 HydrophobicContact CB-CD1 4.06Å; L232-I235 HydrophobicContact CD1-CD1 4.47Å; L232-A254 HydrophobicContact CD1-CB 4.48Å; L232-A254 PolarHBondContact N-O 2.81Å; L232-I256 HydrophobicContact CB-CG1 4.43Å
233	S	95	Very high	94.6	Very high	54 Å²	54	32.5 Å²	32.5	38%	0.378	19%	0.187	S	C	.	.			trans	-40.4	-36.2	-169.2	59.4	0	0	0	0	116.1	Q231 Q257 T258	Q231-S233 PolarHBondContact O-N 3.47Å; S233-Q257 PolarHBondContact O-N 2.75Å; S233-T258 PolarHBondContact O-N 3.27Å
234	V	94.9	Very high	94.3	Very high	40 Å²	40	34.5 Å²	34.5	24%	0.242	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	131.7	175.7	-176.5	0	0	0	0	110.5	L232 R236 T258 E260	L232-V234 PolarHBondContact O-N 3.15Å; V234-R236 HydrophobicContact CG1-CG 4.16Å; V234-T258 WeakPolarHBondContact CA-O 3.39Å; V234-E260 HydrophobicContact CG1-CG 4.11Å
235	I	95.7	Very high	94.2	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	124.2	168.4	-52.6	-56.8	0	0	0	108.7	I213 L232 F240 M251 I256 T258 I259 E260 S263 F264	I213-I235 HydrophobicContact CD1-CD1 3.97Å; L232-I235 HydrophobicContact CB-CD1 4.06Å; L232-I235 HydrophobicContact CD1-CD1 4.47Å; I235-F240 HydrophobicContact CG2-CE2 3.74Å; I235-M251 HydrophobicContact CD1-SD 4.04Å; I235-I256 HydrophobicContact CD1-CD1 3.99Å; I235-I256 HydrophobicContact CD1-CG1 4.17Å; I235-I256 HydrophobicContact CG1-CD1 4.03Å; I235-I256 HydrophobicContact CG1-CG1 4.29Å; I235-I256 HydrophobicContact CG1-CG2 3.93Å; I235-T258 PolarHBondContact N-O 3Å; I235-I259 HydrophobicContact CB-CG1 4.13Å; I235-I259 HydrophobicContact CB-CG2 4.36Å; I235-I259 HydrophobicContact CG1-CG1 4.06Å; I235-E260 PolarHBondContact O-N 3.06Å; I235-S263 PolarHBondContact O-OG 3.04Å; I235-F264 HydrophobicContact CG2-CE1 4.15Å
236	R	91.8	Very high	94.2	Very high	127 Å²	127	36.7 Å²	36.7	48%	0.479	21%	0.207	S	C	.	.			trans	-107.1	157.9	-176.3	-65.5	-170.8	178.2	83.9	1.5	112.1	V234 S239	V234-R236 HydrophobicContact CG1-CG 4.16Å; R236-S239 VanDerWaalsContact O-CB 3.29Å; R236-S239 WeakPolarHBondContact O-CB 3.34Å; R236-S239 PolarHBondContact O-N 3.39Å; R236-S239 PolarHBondContact O-OG 3.12Å
237	P	88.2	Confident	94.1	Very high	29 Å²	29	39.1 Å²	39.1	19%	0.188	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	140.3	173.8	-23.2	42.6	0	0	0	109.9	S239 E260 R261 H396	P237-S239 VanDerWaalsContact C-N 3.29Å; P237-S239 PolarHBondContact O-N 2.83Å; P237-E260 WeakPolarHBondContact CD-OE2 3.24Å; P237-E260 HydrophobicContact CG-CB 4.04Å; P237-R261 WeakPolarHBondContact CG-O 3.44Å; P237-H396 VanDerWaalsContact CB-CE1 3.44Å; P237-H396 WeakPolarHBondContact CB-CE1 3.25Å; P237-H396 WeakPolarHBondContact CB-ND1 3.32Å; P237-H396 WeakPolarHBondContact CG-CE1 3.24Å; P237-H396 WeakPolarHBondContact CG-ND1 3.46Å
238	G	85.8	Confident	94.2	Very high	39 Å²	39	41.8 Å²	41.8	40%	0.402	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	82	-7	-172.2	0	0	0	0	0	115.3	F240 K241	G238-F240 PolarHBondContact O-N 2.97Å; G238-F240 VanDerWaalsContact O-N 3.15Å; G238-K241 VanDerWaalsContact O-CB 3.28Å; G238-K241 WeakPolarHBondContact O-CB 3.44Å; G238-K241 PolarHBondContact O-N 2.78Å; G238-K241 VanDerWaalsContact O-N 3.11Å
239	S	91.6	Very high	94.2	Very high	31 Å²	31	40.9 Å²	40.9	22%	0.217	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-26.4	172.4	-68	0	0	0	0	113	R236 P237	R236-S239 VanDerWaalsContact O-CB 3.29Å; R236-S239 WeakPolarHBondContact O-CB 3.34Å; R236-S239 PolarHBondContact O-N 3.39Å; R236-S239 PolarHBondContact O-OG 3.12Å; P237-S239 VanDerWaalsContact C-N 3.29Å; P237-S239 PolarHBondContact O-N 2.83Å
240	F	94.1	Very high	94.2	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.009	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.5	22.3	178.4	-58.6	-72.1	0	0	0	113.3	I213 L225 M227 I235 G238 G242 L243 L249 M251 F264 L267	I213-F240 HydrophobicContact CD1-CE1 3.94Å; I213-F240 HydrophobicContact CD1-CE2 3.86Å; I213-F240 HydrophobicContact CD1-CZ 3.4Å; I213-F240 VanDerWaalsContact CD1-CZ 3.4Å; L225-F240 HydrophobicContact CD2-CD1 4.34Å; L225-F240 HydrophobicContact CD2-CE1 4.08Å; M227-F240 HydrophobicContact CE-CE1 3.46Å; M227-F240 VanDerWaalsContact CE-CE1 3.46Å; M227-F240 HydrophobicContact CE-CZ 3.7Å; I235-F240 HydrophobicContact CG2-CE2 3.74Å; G238-F240 PolarHBondContact O-N 2.97Å; G238-F240 VanDerWaalsContact O-N 3.15Å; F240-G242 PolarHBondContact O-N 2.54Å; F240-L243 HydrophobicContact CB-CD1 4.2Å; F240-L243 HydrophobicContact CD1-CD1 4.02Å; F240-L243 WeakPolarHBondContact O-CB 3.46Å; F240-L243 PolarHBondContact O-N 2.79Å; F240-L249 HydrophobicContact CD1-CD2 4.4Å; F240-L249 HydrophobicContact CE1-CD1 3.91Å; F240-L249 HydrophobicContact CE1-CD2 3.94Å; F240-L249 HydrophobicContact CE2-CD2 4.3Å; F240-L249 HydrophobicContact CZ-CD1 4.31Å; F240-L249 HydrophobicContact CZ-CD2 3.88Å; F240-M251 HydrophobicContact CZ-CE 4.18Å; F240-M251 HydrophobicContact CZ-SD 3.78Å; F240-F264 HydrophobicContact CD2-CD1 4.05Å; F240-F264 HydrophobicContact CD2-CE1 4.19Å; F240-F264 HydrophobicContact CE2-CD1 4.05Å; F240-F264 AromaticContact CE2-CE1 3.7Å; F240-F264 HydrophobicContact CE2-CE1 3.7Å; F240-L267 HydrophobicContact CB-CD1 4.32Å; F240-L267 HydrophobicContact CB-CD2 3.82Å; F240-L267 HydrophobicContact CB-CG 4.15Å; F240-L267 HydrophobicContact CD2-CD1 4.36Å; F240-L267 HydrophobicContact CG-CD1 4.26Å; F240-L267 HydrophobicContact CG-CD2 4.42Å
241	K	90.4	Very high	94.2	Very high	77 Å²	77	42 Å²	42	34%	0.335	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	132.6	-175	-175.5	175.4	-179.5	175.7	0	111.8	T217 G238 L243 D266 Y399	T217-K241 HydrophobicContact CG2-CB 4.33Å; G238-K241 VanDerWaalsContact O-CB 3.28Å; G238-K241 WeakPolarHBondContact O-CB 3.44Å; G238-K241 PolarHBondContact O-N 2.78Å; G238-K241 VanDerWaalsContact O-N 3.11Å; K241-L243 VanDerWaalsContact C-N 3.28Å; K241-L243 PolarHBondContact O-N 2.85Å; K241-D266 WeakPolarHBondContact CA-OD2 3.03Å; K241-Y399 VanDerWaalsContact NZ-CD1 3.28Å
242	G	88.8	Confident	94.2	Very high	29 Å²	29	40.5 Å²	40.5	30%	0.299	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	82	-3.6	176.5	0	0	0	0	0	115.1	F240 I244	F240-G242 PolarHBondContact O-N 2.54Å; G242-I244 PolarHBondContact O-N 2.94Å
243	L	94.8	Very high	94.3	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.005	24%	0.236	C	C	.	.			trans	-83	49.9	178.8	-58.8	-178.1	0	0	0	112.5	L216 L219 L222 L225 F240 K241 H245 L246 L267	L216-L243 HydrophobicContact CB-CD1 4.13Å; L216-L243 HydrophobicContact CB-CD2 4.22Å; L216-L243 HydrophobicContact CD1-CD1 4.02Å; L219-L243 HydrophobicContact CB-CD2 4.31Å; L222-L243 HydrophobicContact CB-CD2 4.27Å; L222-L243 HydrophobicContact CD2-CD2 4.23Å; L225-L243 HydrophobicContact CD2-CD1 4.35Å; F240-L243 HydrophobicContact CB-CD1 4.2Å; F240-L243 HydrophobicContact CD1-CD1 4.02Å; F240-L243 WeakPolarHBondContact O-CB 3.46Å; F240-L243 PolarHBondContact O-N 2.79Å; K241-L243 VanDerWaalsContact C-N 3.28Å; K241-L243 PolarHBondContact O-N 2.85Å; L243-H245 PolarHBondContact O-N 2.79Å; L243-L246 HydrophobicContact CB-CB 4.15Å; L243-L246 HydrophobicContact CD1-CD2 4.37Å; L243-L246 WeakPolarHBondContact O-CB 3.25Å; L243-L246 PolarHBondContact O-N 3.02Å; L243-L246 VanDerWaalsContact O-N 3.17Å; L243-L267 HydrophobicContact CB-CD2 3.91Å
244	I	92.7	Very high	94.4	Very high	80 Å²	80	42.6 Å²	42.6	41%	0.41	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-22	-173.7	61.3	171.1	0	0	0	113.9	G242 S269	G242-I244 PolarHBondContact O-N 2.94Å; I244-S269 VanDerWaalsContact O-CB 3.22Å; I244-S269 WeakPolarHBondContact O-CB 3.49Å; I244-S269 PolarHBondContact O-OG 3.07Å
245	H	95.9	Very high	94.4	Very high	95 Å²	95	46.9 Å²	46.9	44%	0.44	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-3.4	-179.8	-73	-67.8	0	0	0	113.5	V220 L222 L243 Q247	V220-H245 PolarHBondContact O-CD2 2.97Å; V220-H245 VanDerWaalsContact O-CD2 3.23Å; L222-H245 CarbonylContact O-C 3.59Å; L243-H245 PolarHBondContact O-N 2.79Å; H245-Q247 PolarHBondContact O-N 2.93Å
246	L	98	Very high	94.5	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.236	C	C	.	.			trans	-66.3	124.6	-175.3	-165.6	75.6	0	0	0	110.6	L222 L225 L243 L249 L267 S269 L270	L222-L246 HydrophobicContact CB-CD1 4.23Å; L222-L246 HydrophobicContact CD2-CD1 3.95Å; L222-L246 HydrophobicContact CG-CD1 3.89Å; L222-L246 WeakPolarHBondContact O-CA 3.4Å; L222-L246 PolarHBondContact O-N 3.01Å; L225-L246 HydrophobicContact CB-CD1 3.79Å; L225-L246 HydrophobicContact CB-CD2 4.28Å; L243-L246 HydrophobicContact CB-CB 4.15Å; L243-L246 HydrophobicContact CD1-CD2 4.37Å; L243-L246 WeakPolarHBondContact O-CB 3.25Å; L243-L246 PolarHBondContact O-N 3.02Å; L243-L246 VanDerWaalsContact O-N 3.17Å; L246-L249 HydrophobicContact CD2-CB 4.11Å; L246-L249 HydrophobicContact CD2-CD1 4.32Å; L246-L249 HydrophobicContact CD2-CD2 4.45Å; L246-L267 HydrophobicContact CB-CD2 4.09Å; L246-L267 HydrophobicContact CD2-CD2 3.77Å; L246-S269 CarbonylContact O-C 3.55Å; L246-L270 HydrophobicContact CD2-CD1 4.35Å; L246-L270 HydrophobicContact CG-CD1 4.42Å; L246-L270 VanDerWaalsContact O-CA 3.25Å; L246-L270 WeakPolarHBondContact O-CA 3.45Å; L246-L270 PolarHBondContact O-N 2.85Å
247	Q	97.8	Very high	94.7	Very high	88 Å²	88	45.7 Å²	45.7	41%	0.411	24%	0.236	S	C	.	.			trans	-104.1	-34.7	-178.7	-63.6	-173.5	-12.9	0	0	112.3	D223 H245 V271 E272	D223-Q247 PolarHBondContact O-N 3.1Å; H245-Q247 PolarHBondContact O-N 2.93Å; Q247-V271 HydrophobicContact CB-CG2 4.41Å; Q247-V271 PolarHBondContact O-N 2.91Å; Q247-E272 PolarHBondContact O-N 3.45Å
248	K	98.4	Very high	95.1	Very high	55 Å²	55	47.7 Å²	47.7	24%	0.239	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	125.2	-177.4	-53.4	-175	-169.1	154.1	0	111	D223 E224 L225 W250 E272	D223-K248 PolarHBondContact O-N 3.3Å; E224-K248 HydrophobicContact CB-CB 4.47Å; E224-K248 HydrophobicContact CG-CB 4.15Å; E224-K248 HydrophobicContact CG-CD 4.06Å; E224-K248 HydrophobicContact CG-CG 4.25Å; E224-K248 WeakPolarHBondContact OE1-CE 3.32Å; E224-K248 IonicContact OE1-NZ 2.97Å; E224-K248 PolarHBondContact OE1-NZ 3.29Å; L225-K248 PolarHBondContact N-O 3.44Å; K248-W250 HydrophobicContact CB-CH2 4.49Å; K248-W250 HydrophobicContact CB-CZ2 4.14Å; K248-W250 HydrophobicContact CD-CH2 4.11Å; K248-W250 HydrophobicContact CD-CZ2 3.76Å; K248-E272 WeakPolarHBondContact CA-O 3.19Å; K248-E272 HydrophobicContact CG-CB 4.24Å
249	L	98.3	Very high	95.5	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	115.9	178.1	179.4	54.8	0	0	0	110.2	L225 M227 F240 L246 M251 F264 L267 L270 E272 L273 N274	L225-L249 HydrophobicContact CB-CD1 4.13Å; L225-L249 HydrophobicContact CD2-CD1 3.87Å; L225-L249 HydrophobicContact CG-CD1 4.04Å; M227-L249 HydrophobicContact CE-CD1 4.09Å; F240-L249 HydrophobicContact CD1-CD2 4.4Å; F240-L249 HydrophobicContact CE1-CD1 3.91Å; F240-L249 HydrophobicContact CE1-CD2 3.94Å; F240-L249 HydrophobicContact CE2-CD2 4.3Å; F240-L249 HydrophobicContact CZ-CD1 4.31Å; F240-L249 HydrophobicContact CZ-CD2 3.88Å; L246-L249 HydrophobicContact CD2-CB 4.11Å; L246-L249 HydrophobicContact CD2-CD1 4.32Å; L246-L249 HydrophobicContact CD2-CD2 4.45Å; L249-M251 HydrophobicContact CD1-CE 4.43Å; L249-M251 HydrophobicContact CD1-CG 4.17Å; L249-M251 HydrophobicContact CD1-SD 4.47Å; L249-M251 HydrophobicContact CD2-CE 3.7Å; L249-M251 HydrophobicContact CG-CE 3.88Å; L249-M251 HydrophobicContact CG-CG 4.38Å; L249-F264 HydrophobicContact CD2-CE1 4.38Å; L249-L267 HydrophobicContact CD2-CD1 3.7Å; L249-L270 HydrophobicContact CB-CD1 3.78Å; L249-E272 PolarHBondContact N-O 3.17Å; L249-L273 HydrophobicContact CB-CD1 4.12Å; L249-L273 HydrophobicContact CD2-CD1 3.99Å; L249-L273 HydrophobicContact CG-CD1 4.03Å; L249-N274 PolarHBondContact O-N 2.72Å
250	W	98.3	Very high	95.6	Very high	48 Å²	48	46 Å²	46	18%	0.182	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	119.9	179.3	-59.1	-46.8	0	0	0	111.3	Y202 L225 E226 M227 S228 K248 N274	Y202-W250 HydrophobicContact CE2-CZ3 4.38Å; L225-W250 PolarHBondContact O-N 3.1Å; E226-W250 HydrophobicContact CB-CE3 3.94Å; E226-W250 HydrophobicContact CG-CE3 4.41Å; E226-W250 WeakPolarHBondContact OE1-CB 3.27Å; E226-W250 WeakPolarHBondContact OE2-CB 3.07Å; M227-W250 CarbonylContact C-O 3.4Å; M227-W250 WeakPolarHBondContact CA-O 3.49Å; M227-W250 PolarHBondContact N-O 3.46Å; S228-W250 PolarHBondContact N-O 2.79Å; K248-W250 HydrophobicContact CB-CH2 4.49Å; K248-W250 HydrophobicContact CB-CZ2 4.14Å; K248-W250 HydrophobicContact CD-CH2 4.11Å; K248-W250 HydrophobicContact CD-CZ2 3.76Å; W250-N274 HydrophobicContact CG-CB 4.41Å
251	M	96.9	Very high	95.3	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.227	C	C	.	.			trans	-135.5	43.6	177.9	-63.6	-176.2	-75.7	0	0	110.3	M227 I235 F240 L249 A254 I256 F264 L273 N274 L275 N278	M227-M251 HydrophobicContact CB-CG 4.36Å; M227-M251 HydrophobicContact CE-CG 3.93Å; M227-M251 HydrophobicContact CE-SD 3.86Å; I235-M251 HydrophobicContact CD1-SD 4.04Å; F240-M251 HydrophobicContact CZ-CE 4.18Å; F240-M251 HydrophobicContact CZ-SD 3.78Å; L249-M251 HydrophobicContact CD1-CE 4.43Å; L249-M251 HydrophobicContact CD1-CG 4.17Å; L249-M251 HydrophobicContact CD1-SD 4.47Å; L249-M251 HydrophobicContact CD2-CE 3.7Å; L249-M251 HydrophobicContact CG-CE 3.88Å; L249-M251 HydrophobicContact CG-CG 4.38Å; M251-A254 HydrophobicContact CB-CB 4.33Å; M251-I256 HydrophobicContact CB-CD1 3.9Å; M251-I256 HydrophobicContact SD-CD1 4.15Å; M251-F264 HydrophobicContact CE-CE1 3.9Å; M251-F264 HydrophobicContact CE-CZ 3.93Å; M251-L273 HydrophobicContact CE-CD1 4.03Å; M251-N274 CarbonylContact C-O 3.12Å; M251-N274 WeakPolarHBondContact CA-O 3.25Å; M251-N274 PolarHBondContact N-O 2.78Å; M251-L275 HydrophobicContact CB-CD2 4.32Å; M251-L275 HydrophobicContact CE-CD2 3.62Å; M251-N278 PolarHBondContact O-ND2 3.13Å
252	M	96.4	Very high	95.2	Very high	54 Å²	54	44.1 Å²	44.1	27%	0.266	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	142	178.5	-170.6	-167.2	-176.5	0	0	109.9	S228 G229 A254 A276 H277	S228-M252 CarbonylContact C-O 3.12Å; S228-M252 WeakPolarHBondContact CA-O 3.39Å; S228-M252 WeakPolarHBondContact CB-O 3.33Å; S228-M252 WeakPolarHBondContact OG-CB 3.2Å; S228-M252 PolarHBondContact OG-N 2.74Å; G229-M252 PolarHBondContact N-O 3.09Å; M252-A254 PolarHBondContact O-N 3.49Å; M252-A254 VanDerWaalsContact O-N 3.12Å; M252-A276 VanDerWaalsContact CA-O 3.27Å; M252-A276 WeakPolarHBondContact CA-O 2.97Å; M252-A276 HydrophobicContact CG-CB 4.34Å; M252-A276 WeakPolarHBondContact CG-O 3.47Å; M252-H277 WeakPolarHBondContact CE-CD2 3.4Å; M252-H277 HydrophobicContact CG-CB 4.35Å
253	H	96.6	Very high	95.4	Very high	99 Å²	99	43 Å²	43	46%	0.458	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.4	31.9	178.4	-69.4	-75.5	0	0	0	114.2	G229 Q255 A276 H277	G229-H253 WeakPolarHBondContact CA-O 3.32Å; H253-Q255 VanDerWaalsContact C-N 3.33Å; H253-A276 PolarHBondContact N-O 2.02Å; H253-A276 VanDerWaalsContact N-O 3.15Å; H253-H277 VanDerWaalsContact CA-O 3.31Å; H253-H277 WeakPolarHBondContact CA-O 3.48Å; H253-H277 WeakPolarHBondContact CE1-CB 3.34Å; H253-H277 AromaticContact CE1-CG 3.47Å; H253-H277 VanDerWaalsContact CE1-CG 3.47Å; H253-H277 AromaticContact CE1-ND1 3.46Å; H253-H277 PolarHBondContact CE1-ND1 2.73Å; H253-H277 PolarHBondContact N-O 2.97Å; H253-H277 WeakPolarHBondContact ND1-CB 3.34Å; H253-H277 WeakPolarHBondContact NE2-CB 2.97Å; H253-H277 AromaticContact NE2-CG 3.43Å; H253-H277 AromaticContact NE2-ND1 3.6Å
254	A	96.8	Very high	95.4	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.206	C	C	.	.	S	Bend	trans	-91	6.2	-178.1	0	0	0	0	0	113.7	N230 Q231 L232 M251 M252 I256 N278	N230-A254 CarbonylContact O-C 3.35Å; N230-A254 VanDerWaalsContact O-CA 3.25Å; N230-A254 WeakPolarHBondContact O-CA 3.39Å; Q231-A254 CarbonylContact C-O 3.47Å; L232-A254 HydrophobicContact CD1-CB 4.48Å; L232-A254 PolarHBondContact N-O 2.81Å; M251-A254 HydrophobicContact CB-CB 4.33Å; M252-A254 PolarHBondContact O-N 3.49Å; M252-A254 VanDerWaalsContact O-N 3.12Å; A254-I256 HydrophobicContact CB-CD1 4Å; A254-I256 HydrophobicContact CB-CG1 3.89Å; A254-I256 PolarHBondContact O-N 3.17Å; A254-N278 WeakPolarHBondContact CA-OD1 3.46Å; A254-N278 PolarHBondContact N-OD1 2.92Å
255	Q	96.3	Very high	95.3	Very high	131 Å²	131	40.3 Å²	40.3	61%	0.612	19%	0.193	S	C	*	.			trans	57.3	28.8	-176.7	-56.3	-130	-40.7	0	0	114.2	H253 Q257 N278	H253-Q255 VanDerWaalsContact C-N 3.33Å; Q255-Q257 PolarHBondContact O-N 3.11Å; Q255-N278 PolarHBondContact N-OD1 2.9Å; Q255-N278 VanDerWaalsContact N-OD1 3.07Å
256	I	97.6	Very high	94.9	Very high	0 Å²	0	38 Å²	38	0%	0	18%	0.184	C	C	.	.			trans	-67	126.9	179.8	-56.4	166.6	0	0	0	108.8	L232 I235 M251 A254 I259 L275 N278 N279 L280	L232-I256 HydrophobicContact CB-CG1 4.43Å; I235-I256 HydrophobicContact CD1-CD1 3.99Å; I235-I256 HydrophobicContact CD1-CG1 4.17Å; I235-I256 HydrophobicContact CG1-CD1 4.03Å; I235-I256 HydrophobicContact CG1-CG1 4.29Å; I235-I256 HydrophobicContact CG1-CG2 3.93Å; M251-I256 HydrophobicContact CB-CD1 3.9Å; M251-I256 HydrophobicContact SD-CD1 4.15Å; A254-I256 HydrophobicContact CB-CD1 4Å; A254-I256 HydrophobicContact CB-CG1 3.89Å; A254-I256 PolarHBondContact O-N 3.17Å; I256-I259 HydrophobicContact CG2-CD1 4.49Å; I256-I259 HydrophobicContact CG2-CG1 3.92Å; I256-L275 HydrophobicContact CD1-CD2 3.87Å; I256-N278 HydrophobicContact CB-CB 4.12Å; I256-N278 PolarHBondContact N-OD1 3.15Å; I256-N279 CarbonylContact O-C 3.59Å; I256-N279 VanDerWaalsContact O-C 3.26Å; I256-N279 WeakPolarHBondContact O-CA 3.4Å; I256-N279 PolarHBondContact O-N 2.92Å; I256-L280 HydrophobicContact CB-CD2 4.44Å; I256-L280 HydrophobicContact CG2-CD2 3.75Å; I256-L280 HydrophobicContact CG2-CG 4.45Å; I256-L280 PolarHBondContact O-N 3.1Å
257	Q	96.1	Very high	94.7	Very high	102 Å²	102	38 Å²	38	48%	0.477	18%	0.184	S	C	.	.			trans	-104.6	-40.1	176.4	-58.7	-176.3	14.6	0	0	111.1	S233 Q255 N279	S233-Q257 PolarHBondContact O-N 2.75Å; Q255-Q257 PolarHBondContact O-N 3.11Å; Q257-N279 HydrophobicContact CG-CB 4.23Å
258	T	94.7	Very high	94.4	Very high	71 Å²	71	39.2 Å²	39.2	44%	0.436	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	135.8	-175.1	-51.9	0	0	0	0	110.3	S233 V234 I235	S233-T258 PolarHBondContact O-N 3.27Å; V234-T258 WeakPolarHBondContact CA-O 3.39Å; I235-T258 PolarHBondContact N-O 3Å
259	I	95.6	Very high	94.3	Very high	4 Å²	4	38.4 Å²	38.4	2%	0.021	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	124	166	-63.1	171.7	0	0	0	106.2	I235 I256 F264 L275 L280 L283 P284 L287	I235-I259 HydrophobicContact CB-CG1 4.13Å; I235-I259 HydrophobicContact CB-CG2 4.36Å; I235-I259 HydrophobicContact CG1-CG1 4.06Å; I256-I259 HydrophobicContact CG2-CD1 4.49Å; I256-I259 HydrophobicContact CG2-CG1 3.92Å; I259-F264 HydrophobicContact CD1-CE2 4.08Å; I259-F264 HydrophobicContact CD1-CZ 4.01Å; I259-F264 HydrophobicContact CG2-CE2 4.08Å; I259-F264 HydrophobicContact CG2-CZ 4.2Å; I259-L275 HydrophobicContact CD1-CD1 3.79Å; I259-L275 HydrophobicContact CD1-CD2 4.06Å; I259-L280 HydrophobicContact CD1-CD1 4.19Å; I259-L280 HydrophobicContact CD1-CD2 3.97Å; I259-L280 HydrophobicContact CG1-CD2 3.98Å; I259-L283 HydrophobicContact CB-CD2 4.49Å; I259-L283 HydrophobicContact CD1-CD2 3.75Å; I259-P284 WeakPolarHBondContact O-CD 3.43Å; I259-P284 WeakPolarHBondContact O-CG 3.49Å; I259-L287 HydrophobicContact CG2-CD1 4.21Å; I259-L287 HydrophobicContact CG2-CD2 3.95Å
260	E	92.1	Very high	94.2	Very high	31 Å²	31	38.4 Å²	38.4	15%	0.145	19%	0.191	C	C	.	.			trans	-76.5	161.3	179	-70.1	-178	179.5	0	0	111.2	V234 I235 P237 S263 N407	V234-E260 HydrophobicContact CG1-CG 4.11Å; I235-E260 PolarHBondContact O-N 3.06Å; P237-E260 WeakPolarHBondContact CD-OE2 3.24Å; P237-E260 HydrophobicContact CG-CB 4.04Å; E260-S263 PolarHBondContact N-OG 3.35Å; E260-S263 WeakPolarHBondContact O-CB 3.19Å; E260-S263 PolarHBondContact O-N 2.93Å; E260-S263 PolarHBondContact O-OG 3.39Å; E260-N407 PolarHBondContact OE1-ND2 3.48Å; E260-N407 VanDerWaalsContact OE1-ND2 3.14Å
261	R	88.6	Confident	94.1	Very high	8 Å²	8	37.6 Å²	37.6	3%	0.03	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	141.6	-178.3	-49.9	177.4	-152.6	-140.7	12.9	110.3	P237 S263 P284 A378 S379 S380 T382	P237-R261 WeakPolarHBondContact CG-O 3.44Å; R261-S263 PolarHBondContact O-N 3.2Å; R261-S263 VanDerWaalsContact O-N 3.14Å; R261-P284 HydrophobicContact CG-CB 4.32Å; R261-A378 PolarHBondContact NH2-O 3.17Å; R261-S379 PolarHBondContact NH1-O 3.04Å; R261-S379 VanDerWaalsContact NH1-O 3.14Å; R261-S379 VanDerWaalsContact NH2-C 3.35Å; R261-S379 PolarHBondContact NH2-O 3.29Å; R261-S380 WeakPolarHBondContact CG-O 3.25Å; R261-S380 PolarHBondContact NE-O 3.36Å; R261-S380 VanDerWaalsContact NH2-CA 3.34Å; R261-T382 VanDerWaalsContact CD-O 3.26Å; R261-T382 WeakPolarHBondContact CD-O 3.25Å; R261-T382 VanDerWaalsContact NH1-C 3.32Å; R261-T382 PolarHBondContact NH1-O 3.47Å; R261-T382 PolarHBondContact NH1-OG1 3.12Å
262	N	89.4	Confident	94	Very high	30 Å²	30	38.6 Å²	38.6	16%	0.16	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.5	18.7	176.2	-51.5	98	0	0	0	115.1	F264 D265 H396	N262-F264 PolarHBondContact O-N 3.19Å; N262-F264 VanDerWaalsContact O-N 3.17Å; N262-D265 WeakPolarHBondContact CA-OD1 3.24Å; N262-D265 VanDerWaalsContact CB-OD2 3.31Å; N262-D265 WeakPolarHBondContact CB-OD2 3.2Å; N262-D265 PolarHBondContact ND2-OD2 3.2Å; N262-D265 PolarHBondContact O-N 3.27Å; N262-H396 HydrophobicContact CB-CB 4.09Å; N262-H396 WeakPolarHBondContact OD1-CB 3.37Å
263	S	92.9	Very high	94	Very high	5 Å²	5	36 Å²	36	4%	0.035	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-20.4	-177.8	-67.3	0	0	0	0	114.4	I235 E260 R261	I235-S263 PolarHBondContact O-OG 3.04Å; E260-S263 PolarHBondContact N-OG 3.35Å; E260-S263 WeakPolarHBondContact O-CB 3.19Å; E260-S263 PolarHBondContact O-N 2.93Å; E260-S263 PolarHBondContact O-OG 3.39Å; R261-S263 PolarHBondContact O-N 3.2Å; R261-S263 VanDerWaalsContact O-N 3.14Å
264	F	94.2	Very high	94	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.7	1.8	-176.8	-58.7	-43.4	0	0	0	114.1	I235 F240 L249 M251 I259 N262 D266 L267 L273 L275 L287 L291	I235-F264 HydrophobicContact CG2-CE1 4.15Å; F240-F264 HydrophobicContact CD2-CD1 4.05Å; F240-F264 HydrophobicContact CD2-CE1 4.19Å; F240-F264 HydrophobicContact CE2-CD1 4.05Å; F240-F264 AromaticContact CE2-CE1 3.7Å; F240-F264 HydrophobicContact CE2-CE1 3.7Å; L249-F264 HydrophobicContact CD2-CE1 4.38Å; M251-F264 HydrophobicContact CE-CE1 3.9Å; M251-F264 HydrophobicContact CE-CZ 3.93Å; I259-F264 HydrophobicContact CD1-CE2 4.08Å; I259-F264 HydrophobicContact CD1-CZ 4.01Å; I259-F264 HydrophobicContact CG2-CE2 4.08Å; I259-F264 HydrophobicContact CG2-CZ 4.2Å; N262-F264 PolarHBondContact O-N 3.19Å; N262-F264 VanDerWaalsContact O-N 3.17Å; F264-D266 PolarHBondContact O-N 2.82Å; F264-D266 VanDerWaalsContact O-N 3.07Å; F264-L267 HydrophobicContact CB-CD1 4.17Å; F264-L267 HydrophobicContact CD1-CD1 3.81Å; F264-L267 HydrophobicContact CG-CD1 4.33Å; F264-L267 VanDerWaalsContact O-CB 3.3Å; F264-L267 WeakPolarHBondContact O-CB 3.45Å; F264-L267 PolarHBondContact O-N 2.92Å; F264-L273 HydrophobicContact CD2-CD2 4.35Å; F264-L273 HydrophobicContact CE2-CD2 4.02Å; F264-L275 HydrophobicContact CE2-CD1 4.39Å; F264-L287 HydrophobicContact CD2-CD1 3.85Å; F264-L287 HydrophobicContact CD2-CD2 3.88Å; F264-L287 HydrophobicContact CD2-CG 3.82Å; F264-L287 HydrophobicContact CE2-CD1 4.44Å; F264-L287 HydrophobicContact CE2-CD2 3.81Å; F264-L287 HydrophobicContact CE2-CG 4.28Å; F264-L291 HydrophobicContact CB-CD1 4.11Å; F264-L291 HydrophobicContact CB-CD2 4.4Å; F264-L291 WeakPolarHBondContact O-CD2 3.45Å
265	D	89.5	Confident	93.9	Very high	26 Å²	26	32.4 Å²	32.4	14%	0.139	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-31.4	-171.9	-73.6	20.4	0	0	0	114.1	N262 L267	N262-D265 WeakPolarHBondContact CA-OD1 3.24Å; N262-D265 VanDerWaalsContact CB-OD2 3.31Å; N262-D265 WeakPolarHBondContact CB-OD2 3.2Å; N262-D265 PolarHBondContact ND2-OD2 3.2Å; N262-D265 PolarHBondContact O-N 3.27Å; D265-L267 PolarHBondContact O-N 2.85Å
266	D	88.6	Confident	93.9	Very high	47 Å²	47	26.1 Å²	26.1	25%	0.251	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-17.6	178.5	-72	-39.8	0	0	0	113.2	K241 F264 Q268	K241-D266 WeakPolarHBondContact CA-OD2 3.03Å; F264-D266 PolarHBondContact O-N 2.82Å; F264-D266 VanDerWaalsContact O-N 3.07Å; D266-Q268 PolarHBondContact O-N 2.98Å
267	L	94.3	Very high	93.8	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.148	C	C	.	.			trans	-85	51.2	-172.8	-59	179.1	0	0	0	112.7	F240 L243 L246 L249 F264 D265 S269 L270 L291	F240-L267 HydrophobicContact CB-CD1 4.32Å; F240-L267 HydrophobicContact CB-CD2 3.82Å; F240-L267 HydrophobicContact CB-CG 4.15Å; F240-L267 HydrophobicContact CD2-CD1 4.36Å; F240-L267 HydrophobicContact CG-CD1 4.26Å; F240-L267 HydrophobicContact CG-CD2 4.42Å; L243-L267 HydrophobicContact CB-CD2 3.91Å; L246-L267 HydrophobicContact CB-CD2 4.09Å; L246-L267 HydrophobicContact CD2-CD2 3.77Å; L249-L267 HydrophobicContact CD2-CD1 3.7Å; F264-L267 HydrophobicContact CB-CD1 4.17Å; F264-L267 HydrophobicContact CD1-CD1 3.81Å; F264-L267 HydrophobicContact CG-CD1 4.33Å; F264-L267 VanDerWaalsContact O-CB 3.3Å; F264-L267 WeakPolarHBondContact O-CB 3.45Å; F264-L267 PolarHBondContact O-N 2.92Å; D265-L267 PolarHBondContact O-N 2.85Å; L267-S269 PolarHBondContact O-N 2.82Å; L267-S269 VanDerWaalsContact O-N 3.12Å; L267-L270 HydrophobicContact CB-CB 4.06Å; L267-L270 HydrophobicContact CB-CD2 4.36Å; L267-L270 HydrophobicContact CD1-CD2 4.08Å; L267-L270 WeakPolarHBondContact O-CB 3.44Å; L267-L270 PolarHBondContact O-N 3.46Å; L267-L291 HydrophobicContact CB-CD2 3.97Å; L267-L291 WeakPolarHBondContact O-CD2 3.49Å
268	Q	91	Very high	93.9	Very high	113 Å²	113	24.2 Å²	24.2	53%	0.528	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-23.6	-170	-62.4	175.2	22.3	0	0	114.9	D266 H293	D266-Q268 PolarHBondContact O-N 2.98Å; Q268-H293 PolarHBondContact O-ND1 3.08Å
269	S	96.1	Very high	94.1	Very high	38 Å²	38	24.8 Å²	24.8	27%	0.266	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	8.3	178.3	-55.1	0	0	0	0	113.7	I244 L246 L267 V271	I244-S269 VanDerWaalsContact O-CB 3.22Å; I244-S269 WeakPolarHBondContact O-CB 3.49Å; I244-S269 PolarHBondContact O-OG 3.07Å; L246-S269 CarbonylContact O-C 3.55Å; L267-S269 PolarHBondContact O-N 2.82Å; L267-S269 VanDerWaalsContact O-N 3.12Å; S269-V271 PolarHBondContact O-N 3.39Å
270	L	97.1	Very high	94.1	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.128	C	C	.	.			trans	-68.7	124.8	-173.5	-163.3	72.6	0	0	0	111.1	L246 L249 L267 L273 L291 H293 L294	L246-L270 HydrophobicContact CD2-CD1 4.35Å; L246-L270 HydrophobicContact CG-CD1 4.42Å; L246-L270 VanDerWaalsContact O-CA 3.25Å; L246-L270 WeakPolarHBondContact O-CA 3.45Å; L246-L270 PolarHBondContact O-N 2.85Å; L249-L270 HydrophobicContact CB-CD1 3.78Å; L267-L270 HydrophobicContact CB-CB 4.06Å; L267-L270 HydrophobicContact CB-CD2 4.36Å; L267-L270 HydrophobicContact CD1-CD2 4.08Å; L267-L270 WeakPolarHBondContact O-CB 3.44Å; L267-L270 PolarHBondContact O-N 3.46Å; L270-L273 HydrophobicContact CD2-CB 4.03Å; L270-L273 HydrophobicContact CD2-CD1 4.4Å; L270-L291 HydrophobicContact CB-CD2 4.48Å; L270-L291 HydrophobicContact CD2-CD1 4.26Å; L270-H293 CarbonylContact O-C 3.6Å; L270-L294 HydrophobicContact CD2-CD1 4.15Å; L270-L294 HydrophobicContact CG-CD1 4.2Å; L270-L294 VanDerWaalsContact O-CA 3.24Å; L270-L294 WeakPolarHBondContact O-CA 3.42Å; L270-L294 PolarHBondContact O-N 3.16Å; L270-L294 VanDerWaalsContact O-N 3.16Å
271	V	95.5	Very high	94.3	Very high	30 Å²	30	26.2 Å²	26.2	18%	0.182	14%	0.141	C	C	.	.			trans	-106.5	-36.4	-180	179.3	0	0	0	0	111.2	Q247 S269 H293 E295 R296	Q247-V271 HydrophobicContact CB-CG2 4.41Å; Q247-V271 PolarHBondContact O-N 2.91Å; S269-V271 PolarHBondContact O-N 3.39Å; V271-H293 WeakPolarHBondContact CA-O 3.22Å; V271-E295 HydrophobicContact CG1-CB 4.25Å; V271-E295 HydrophobicContact CG1-CG 4.34Å; V271-E295 PolarHBondContact O-N 3.37Å; V271-R296 PolarHBondContact O-N 3.36Å
272	E	95.1	Very high	94.6	Very high	21 Å²	21	26.8 Å²	26.8	10%	0.098	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	124.1	-176.5	-175.8	168.2	-164.4	0	0	112.2	Q247 K248 L249 R296 H298	Q247-E272 PolarHBondContact O-N 3.45Å; K248-E272 WeakPolarHBondContact CA-O 3.19Å; K248-E272 HydrophobicContact CG-CB 4.24Å; L249-E272 PolarHBondContact N-O 3.17Å; E272-R296 CarbonylContact C-O 3.56Å; E272-R296 VanDerWaalsContact CA-O 3.29Å; E272-R296 WeakPolarHBondContact CA-O 3.45Å; E272-R296 HydrophobicContact CB-CB 4.33Å; E272-R296 HydrophobicContact CG-CB 4.1Å; E272-R296 IonicContact OE1-CZ 3.77Å; E272-R296 IonicContact OE1-NH1 2.75Å; E272-R296 PolarHBondContact OE1-NH1 3.41Å; E272-R296 VanDerWaalsContact OE1-NH1 3.17Å; E272-R296 IonicContact OE2-CZ 2.76Å; E272-R296 IonicContact OE2-NH1 3.93Å; E272-R296 PolarHBondContact OE2-NH1 3.03Å; E272-R296 IonicContact OE2-NH2 3.04Å; E272-R296 PolarHBondContact OE2-NH2 3.07Å; E272-H298 IonicContact OE1-CD2 2.78Å; E272-H298 IonicContact OE1-CE1 2.72Å; E272-H298 IonicContact OE1-NE2 3.17Å; E272-H298 PolarHBondContact OE1-NE2 2.85Å
273	L	95.7	Very high	94.9	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	120.5	177	178	59	0	0	0	110.5	L249 M251 F264 L270 L275 F288 L294 R296 V297 H298	L249-L273 HydrophobicContact CB-CD1 4.12Å; L249-L273 HydrophobicContact CD2-CD1 3.99Å; L249-L273 HydrophobicContact CG-CD1 4.03Å; M251-L273 HydrophobicContact CE-CD1 4.03Å; F264-L273 HydrophobicContact CD2-CD2 4.35Å; F264-L273 HydrophobicContact CE2-CD2 4.02Å; L270-L273 HydrophobicContact CD2-CB 4.03Å; L270-L273 HydrophobicContact CD2-CD1 4.4Å; L273-L275 HydrophobicContact CD1-CD1 4.47Å; L273-L275 HydrophobicContact CD1-CG 4.11Å; L273-L275 HydrophobicContact CD2-CD1 3.87Å; L273-L275 HydrophobicContact CD2-CG 4.35Å; L273-L275 HydrophobicContact CG-CD1 4.13Å; L273-L275 HydrophobicContact CG-CG 4.06Å; L273-F288 HydrophobicContact CD2-CE1 3.81Å; L273-F288 HydrophobicContact CD2-CZ 4.38Å; L273-L294 HydrophobicContact CB-CD1 4.04Å; L273-R296 PolarHBondContact N-O 3.11Å; L273-V297 HydrophobicContact CB-CG1 4.43Å; L273-V297 CarbonylContact O-C 3.16Å; L273-V297 VanDerWaalsContact O-CA 3.3Å; L273-V297 WeakPolarHBondContact O-CA 3.47Å; L273-H298 PolarHBondContact O-N 2.98Å
274	N	95.8	Very high	94.9	Very high	23 Å²	23	25.3 Å²	25.3	12%	0.123	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	109.3	174.5	-170.3	-14.5	0	0	0	111.5	L249 W250 M251 A276 H298	L249-N274 PolarHBondContact O-N 2.72Å; W250-N274 HydrophobicContact CG-CB 4.41Å; M251-N274 CarbonylContact C-O 3.12Å; M251-N274 WeakPolarHBondContact CA-O 3.25Å; M251-N274 PolarHBondContact N-O 2.78Å; N274-A276 WeakPolarHBondContact OD1-CB 3.48Å; N274-A276 PolarHBondContact OD1-N 2.95Å; N274-H298 HydrophobicContact CB-CB 4.21Å; N274-H298 WeakPolarHBondContact OD1-CB 3.34Å
275	L	96.3	Very high	94.9	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.141	C	C	.	.			trans	-114.7	18.4	175.2	-71.6	170.7	0	0	0	111.4	M251 I256 I259 F264 L273 N278 L280 H298 L299 N302	M251-L275 HydrophobicContact CB-CD2 4.32Å; M251-L275 HydrophobicContact CE-CD2 3.62Å; I256-L275 HydrophobicContact CD1-CD2 3.87Å; I259-L275 HydrophobicContact CD1-CD1 3.79Å; I259-L275 HydrophobicContact CD1-CD2 4.06Å; F264-L275 HydrophobicContact CE2-CD1 4.39Å; L273-L275 HydrophobicContact CD1-CD1 4.47Å; L273-L275 HydrophobicContact CD1-CG 4.11Å; L273-L275 HydrophobicContact CD2-CD1 3.87Å; L273-L275 HydrophobicContact CD2-CG 4.35Å; L273-L275 HydrophobicContact CG-CD1 4.13Å; L273-L275 HydrophobicContact CG-CG 4.06Å; L275-N278 VanDerWaalsContact C-ND2 3.29Å; L275-N278 PolarHBondContact O-ND2 3.31Å; L275-L280 HydrophobicContact CB-CD1 4.11Å; L275-L280 HydrophobicContact CD1-CD1 4.34Å; L275-H298 CarbonylContact C-O 3.58Å; L275-H298 WeakPolarHBondContact CA-O 3.35Å; L275-H298 PolarHBondContact N-O 2.82Å; L275-L299 HydrophobicContact CB-CD2 4.06Å; L275-L299 HydrophobicContact CD1-CD2 4.11Å; L275-N302 PolarHBondContact O-ND2 3.12Å
276	A	95.8	Very high	95	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	154.1	-174.9	0	0	0	0	0	112.5	M252 H253 N274 N278 H298 H300	M252-A276 VanDerWaalsContact CA-O 3.27Å; M252-A276 WeakPolarHBondContact CA-O 2.97Å; M252-A276 HydrophobicContact CG-CB 4.34Å; M252-A276 WeakPolarHBondContact CG-O 3.47Å; H253-A276 PolarHBondContact N-O 2.02Å; H253-A276 VanDerWaalsContact N-O 3.15Å; N274-A276 WeakPolarHBondContact OD1-CB 3.48Å; N274-A276 PolarHBondContact OD1-N 2.95Å; A276-N278 VanDerWaalsContact C-N 3.29Å; A276-N278 PolarHBondContact O-N 3Å; A276-N278 PolarHBondContact O-ND2 3.07Å; A276-H298 HydrophobicContact CB-CB 4.18Å; A276-H298 PolarHBondContact N-O 3.42Å; A276-H298 VanDerWaalsContact N-O 3.1Å; A276-H300 VanDerWaalsContact CA-O 3.27Å; A276-H300 WeakPolarHBondContact CA-O 3.27Å; A276-H300 WeakPolarHBondContact CB-CE1 3.49Å; A276-H300 WeakPolarHBondContact CB-NE2 3.28Å
277	H	96.4	Very high	95.2	Very high	49 Å²	49	26.1 Å²	26.1	23%	0.227	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.6	39.9	179.2	-58.7	-102.4	0	0	0	114.1	M252 H253 H300 H301	M252-H277 WeakPolarHBondContact CE-CD2 3.4Å; M252-H277 HydrophobicContact CG-CB 4.35Å; H253-H277 VanDerWaalsContact CA-O 3.31Å; H253-H277 WeakPolarHBondContact CA-O 3.48Å; H253-H277 WeakPolarHBondContact CE1-CB 3.34Å; H253-H277 AromaticContact CE1-CG 3.47Å; H253-H277 VanDerWaalsContact CE1-CG 3.47Å; H253-H277 AromaticContact CE1-ND1 3.46Å; H253-H277 PolarHBondContact CE1-ND1 2.73Å; H253-H277 PolarHBondContact N-O 2.97Å; H253-H277 WeakPolarHBondContact ND1-CB 3.34Å; H253-H277 WeakPolarHBondContact NE2-CB 2.97Å; H253-H277 AromaticContact NE2-CG 3.43Å; H253-H277 AromaticContact NE2-ND1 3.6Å; H277-H300 AromaticContact CD2-CE1 3.49Å; H277-H300 PolarHBondContact CD2-CE1 2.97Å; H277-H300 VanDerWaalsContact CD2-CE1 3.49Å; H277-H300 AromaticContact CD2-ND1 3.58Å; H277-H300 PolarHBondContact N-O 3.34Å; H277-H300 AromaticContact NE2-CE1 3.23Å; H277-H300 PolarHBondContact NE2-CE1 3.17Å; H277-H300 AromaticContact NE2-ND1 3.32Å; H277-H300 PolarHBondContact NE2-ND1 3.08Å; H277-H301 VanDerWaalsContact CA-O 3.23Å; H277-H301 WeakPolarHBondContact CA-O 3.41Å; H277-H301 HydrophobicContact CB-CB 4.31Å; H277-H301 AromaticContact CE1-CD2 3.38Å; H277-H301 PolarHBondContact CE1-CD2 3.39Å; H277-H301 AromaticContact CE1-CE1 3.83Å; H277-H301 AromaticContact CE1-CG 3.28Å; H277-H301 AromaticContact CE1-ND1 3.61Å; H277-H301 AromaticContact CE1-NE2 3.74Å; H277-H301 PolarHBondContact N-O 2.89Å; H277-H301 WeakPolarHBondContact ND1-CB 3.46Å; H277-H301 AromaticContact ND1-CD2 3.77Å; H277-H301 AromaticContact ND1-CG 3.62Å; H277-H301 AromaticContact NE2-CE1 3.99Å; H277-H301 AromaticContact NE2-CG 3.61Å; H277-H301 AromaticContact NE2-ND1 3.56Å
278	N	97.8	Very high	95.2	Very high	13 Å²	13	26.2 Å²	26.2	7%	0.07	14%	0.14	C	C	.	.	S	Bend	trans	-104.7	-171	169.8	-76.2	-67.9	0	0	0	110.3	M251 A254 Q255 I256 L275 A276 L280 N302	M251-N278 PolarHBondContact O-ND2 3.13Å; A254-N278 WeakPolarHBondContact CA-OD1 3.46Å; A254-N278 PolarHBondContact N-OD1 2.92Å; Q255-N278 PolarHBondContact N-OD1 2.9Å; Q255-N278 VanDerWaalsContact N-OD1 3.07Å; I256-N278 HydrophobicContact CB-CB 4.12Å; I256-N278 PolarHBondContact N-OD1 3.15Å; L275-N278 VanDerWaalsContact C-ND2 3.29Å; L275-N278 PolarHBondContact O-ND2 3.31Å; A276-N278 VanDerWaalsContact C-N 3.29Å; A276-N278 PolarHBondContact O-N 3Å; A276-N278 PolarHBondContact O-ND2 3.07Å; N278-L280 HydrophobicContact CB-CD1 4.33Å; N278-L280 HydrophobicContact CB-CG 4.17Å; N278-N302 WeakPolarHBondContact CA-OD1 3.22Å; N278-N302 WeakPolarHBondContact CB-OD1 3.43Å; N278-N302 PolarHBondContact N-OD1 2.75Å; N278-N302 PolarHBondContact O-OD1 2.79Å
279	N	97.4	Very high	95.1	Very high	83 Å²	83	24.2 Å²	24.2	44%	0.444	14%	0.136	S	C	.	.			trans	-110.1	33.3	177.8	-162.9	49	0	0	0	111.1	I256 Q257	I256-N279 CarbonylContact O-C 3.59Å; I256-N279 VanDerWaalsContact O-C 3.26Å; I256-N279 WeakPolarHBondContact O-CA 3.4Å; I256-N279 PolarHBondContact O-N 2.92Å; Q257-N279 HydrophobicContact CG-CB 4.23Å
280	L	96.6	Very high	94.7	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.134	C	C	.	.			trans	-72.2	130.9	-179.7	-65.1	166.4	0	0	0	110.3	I256 I259 L275 N278 L283 N302 P303 W304	I256-L280 HydrophobicContact CB-CD2 4.44Å; I256-L280 HydrophobicContact CG2-CD2 3.75Å; I256-L280 HydrophobicContact CG2-CG 4.45Å; I256-L280 PolarHBondContact O-N 3.1Å; I259-L280 HydrophobicContact CD1-CD1 4.19Å; I259-L280 HydrophobicContact CD1-CD2 3.97Å; I259-L280 HydrophobicContact CG1-CD2 3.98Å; L275-L280 HydrophobicContact CB-CD1 4.11Å; L275-L280 HydrophobicContact CD1-CD1 4.34Å; N278-L280 HydrophobicContact CB-CD1 4.33Å; N278-L280 HydrophobicContact CB-CG 4.17Å; L280-L283 HydrophobicContact CD1-CD2 4.37Å; L280-L283 HydrophobicContact CD2-CD2 4.43Å; L280-N302 HydrophobicContact CB-CB 4.18Å; L280-N302 WeakPolarHBondContact CB-OD1 3.26Å; L280-N302 PolarHBondContact N-OD1 2.86Å; L280-N302 VanDerWaalsContact N-OD1 3.11Å; L280-P303 CarbonylContact O-C 3.18Å; L280-P303 WeakPolarHBondContact O-CD 3.36Å; L280-W304 HydrophobicContact CB-CH2 3.72Å; L280-W304 HydrophobicContact CB-CZ2 4.29Å; L280-W304 HydrophobicContact CB-CZ3 3.92Å; L280-W304 HydrophobicContact CD1-CH2 4.01Å; L280-W304 HydrophobicContact CD1-CZ2 4.5Å; L280-W304 HydrophobicContact CG-CH2 4.49Å
281	T	95.8	Very high	94.5	Very high	65 Å²	65	24.5 Å²	24.5	40%	0.399	14%	0.136	S	C	.	.			trans	-102.8	-37.9	174.6	55.5	0	0	0	0	111.7	P303 W304 N305	T281-P303 HydrophobicContact CG2-CG 4.25Å; T281-W304 CarbonylContact O-C 3.28Å; T281-W304 WeakPolarHBondContact O-CA 3.45Å; T281-N305 PolarHBondContact O-N 3.01Å
282	L	94.8	Very high	94.3	Very high	20 Å²	20	30.7 Å²	30.7	11%	0.105	16%	0.163	C	C	.	.			trans	-146.6	162.6	-177.7	-71.7	165.5	0	0	0	109.1	N305 N307 D309 I310 L381	L282-N305 HydrophobicContact CD2-CB 4.49Å; L282-N305 WeakPolarHBondContact CD2-O 3.35Å; L282-N305 HydrophobicContact CG-CB 4.34Å; L282-N307 WeakPolarHBondContact CD2-OD1 3.3Å; L282-D309 HydrophobicContact CD2-CB 4.09Å; L282-I310 HydrophobicContact CD2-CD1 4.2Å; L282-L381 HydrophobicContact CB-CD1 4.04Å; L282-L381 HydrophobicContact CB-CD2 3.79Å; L282-L381 HydrophobicContact CD1-CD1 3.39Å; L282-L381 HydrophobicContact CG-CD1 4.24Å
283	L	95.4	Very high	94.2	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	18%	0.183	C	C	.	.			trans	-122.2	144.7	171.4	-69.2	178.5	0	0	0	109.3	I259 L280 L287 F288 L299 W304 W312 L313	I259-L283 HydrophobicContact CB-CD2 4.49Å; I259-L283 HydrophobicContact CD1-CD2 3.75Å; L280-L283 HydrophobicContact CD1-CD2 4.37Å; L280-L283 HydrophobicContact CD2-CD2 4.43Å; L283-L287 HydrophobicContact CB-CD2 4.35Å; L283-L287 HydrophobicContact CD1-CD2 4.44Å; L283-L287 HydrophobicContact CD2-CD2 4.01Å; L283-L287 HydrophobicContact CG-CD2 4.49Å; L283-F288 HydrophobicContact CD1-CE2 4.11Å; L283-F288 HydrophobicContact CD1-CZ 3.69Å; L283-L299 HydrophobicContact CD1-CD2 4.42Å; L283-W304 HydrophobicContact CD1-CH2 3.99Å; L283-W304 HydrophobicContact CD1-CZ3 4.35Å; L283-W304 HydrophobicContact CD2-CH2 4.21Å; L283-W304 HydrophobicContact CD2-CZ3 4.43Å; L283-W304 HydrophobicContact CG-CH2 3.81Å; L283-W304 HydrophobicContact CG-CZ3 3.81Å; L283-W312 HydrophobicContact CB-CH2 4.43Å; L283-W312 HydrophobicContact CB-CZ2 3.69Å; L283-L313 HydrophobicContact CD1-CD1 4.49Å; L283-L313 HydrophobicContact CD1-CD2 4.18Å
284	P	94.3	Very high	94	Very high	3 Å²	3	35.4 Å²	35.4	2%	0.019	18%	0.184	C	C	.	.			trans	-54.1	144.7	171.4	-24.9	32.6	0	0	0	112.7	I259 R261 L287 W312	I259-P284 WeakPolarHBondContact O-CD 3.43Å; I259-P284 WeakPolarHBondContact O-CG 3.49Å; R261-P284 HydrophobicContact CG-CB 4.32Å; P284-L287 WeakPolarHBondContact O-CB 3.36Å; P284-L287 PolarHBondContact O-N 2.9Å; P284-W312 WeakPolarHBondContact O-CZ2 3.29Å
285	H	94	Very high	93.6	Very high	23 Å²	23	40.4 Å²	40.4	11%	0.106	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	136.9	176.9	-173	-97.9	0	0	0	111.3	L287 W312 L381 S383 S431	H285-L287 PolarHBondContact O-N 2.86Å; H285-L287 VanDerWaalsContact O-N 3.13Å; H285-W312 AromaticContact CD2-CD1 3.8Å; H285-W312 AromaticContact CD2-CG 3.88Å; H285-L381 WeakPolarHBondContact CB-O 3.48Å; H285-L381 PolarHBondContact N-O 2.9Å; H285-S383 PolarHBondContact ND1-OG 3.22Å; H285-S431 PolarHBondContact CD2-N 3.03Å; H285-S431 PolarHBondContact NE2-N 3.18Å
286	D	90.7	Very high	93.3	Very high	62 Å²	62	45.7 Å²	45.7	33%	0.332	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	56	24	178.4	-69	-23.2	0	0	0	115.5	F288 T289 P290	D286-F288 PolarHBondContact O-N 2.96Å; D286-F288 VanDerWaalsContact O-N 3.08Å; D286-T289 WeakPolarHBondContact CA-OG1 3.18Å; D286-T289 WeakPolarHBondContact CB-OG1 3.37Å; D286-T289 WeakPolarHBondContact O-CB 3.19Å; D286-T289 PolarHBondContact O-N 2.96Å; D286-T289 PolarHBondContact O-OG1 2.87Å; D286-T289 PolarHBondContact OD1-OG1 2.95Å; D286-P290 WeakPolarHBondContact O-CD 3.13Å
287	L	93.6	Very high	93.1	Very high	4 Å²	4	46.5 Å²	46.5	2%	0.021	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-29.8	-179.5	-178.9	67.7	0	0	0	113.3	I259 F264 L283 P284 H285 W312	I259-L287 HydrophobicContact CG2-CD1 4.21Å; I259-L287 HydrophobicContact CG2-CD2 3.95Å; F264-L287 HydrophobicContact CD2-CD1 3.85Å; F264-L287 HydrophobicContact CD2-CD2 3.88Å; F264-L287 HydrophobicContact CD2-CG 3.82Å; F264-L287 HydrophobicContact CE2-CD1 4.44Å; F264-L287 HydrophobicContact CE2-CD2 3.81Å; F264-L287 HydrophobicContact CE2-CG 4.28Å; L283-L287 HydrophobicContact CB-CD2 4.35Å; L283-L287 HydrophobicContact CD1-CD2 4.44Å; L283-L287 HydrophobicContact CD2-CD2 4.01Å; L283-L287 HydrophobicContact CG-CD2 4.49Å; P284-L287 WeakPolarHBondContact O-CB 3.36Å; P284-L287 PolarHBondContact O-N 2.9Å; H285-L287 PolarHBondContact O-N 2.86Å; H285-L287 VanDerWaalsContact O-N 3.13Å; L287-W312 HydrophobicContact CB-CH2 3.95Å; L287-W312 HydrophobicContact CB-CZ2 4.29Å
288	F	93	Very high	92.9	Very high	2 Å²	2	46.1 Å²	46.1	1%	0.009	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-6.8	-179.2	-56.1	-30.4	0	0	0	114	L273 L283 D286 L291 L294 V297 L299 W312 L313 W316	L273-F288 HydrophobicContact CD2-CE1 3.81Å; L273-F288 HydrophobicContact CD2-CZ 4.38Å; L283-F288 HydrophobicContact CD1-CE2 4.11Å; L283-F288 HydrophobicContact CD1-CZ 3.69Å; D286-F288 PolarHBondContact O-N 2.96Å; D286-F288 VanDerWaalsContact O-N 3.08Å; F288-L291 HydrophobicContact CD1-CD1 4.03Å; F288-L291 WeakPolarHBondContact O-CB 3.37Å; F288-L291 PolarHBondContact O-N 2.89Å; F288-L294 HydrophobicContact CB-CD2 4.16Å; F288-L294 HydrophobicContact CD1-CD2 4.12Å; F288-L294 HydrophobicContact CG-CD2 4.05Å; F288-V297 HydrophobicContact CE2-CG1 4.38Å; F288-V297 HydrophobicContact CZ-CG1 4.2Å; F288-L299 HydrophobicContact CE2-CD1 4.5Å; F288-W312 HydrophobicContact CB-CZ3 4.39Å; F288-W312 AromaticContact CD2-CH2 3.9Å; F288-W312 HydrophobicContact CD2-CH2 3.9Å; F288-W312 AromaticContact CD2-CZ3 3.92Å; F288-W312 HydrophobicContact CD2-CZ3 3.92Å; F288-W312 HydrophobicContact CE2-CH2 4.16Å; F288-W312 HydrophobicContact CG-CH2 4.26Å; F288-W312 HydrophobicContact CG-CZ3 4.29Å; F288-L313 HydrophobicContact CD2-CD1 4.16Å; F288-L313 HydrophobicContact CE2-CD1 3.66Å; F288-W316 HydrophobicContact CB-CD2 4.46Å; F288-W316 HydrophobicContact CB-CZ2 4.32Å; F288-W316 AromaticContact CD2-CD2 3.91Å; F288-W316 HydrophobicContact CD2-CD2 3.91Å; F288-W316 HydrophobicContact CD2-CE3 4.03Å; F288-W316 HydrophobicContact CD2-CG 4.46Å; F288-W316 HydrophobicContact CD2-CZ2 4.35Å; F288-W316 HydrophobicContact CD2-CZ3 4.33Å
289	T	89.1	Confident	92.7	Very high	72 Å²	72	45.6 Å²	45.6	44%	0.442	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-38.5	-176.2	-58.4	0	0	0	0	113.4	D286 L291 H292	D286-T289 WeakPolarHBondContact CA-OG1 3.18Å; D286-T289 WeakPolarHBondContact CB-OG1 3.37Å; D286-T289 WeakPolarHBondContact O-CB 3.19Å; D286-T289 PolarHBondContact O-N 2.96Å; D286-T289 PolarHBondContact O-OG1 2.87Å; D286-T289 PolarHBondContact OD1-OG1 2.95Å; T289-L291 PolarHBondContact O-N 2.95Å; T289-H292 PolarHBondContact O-CE1 3.28Å; T289-H292 VanDerWaalsContact O-CE1 3.25Å; T289-H292 PolarHBondContact O-ND1 2.8Å
290	P	89.5	Confident	92.5	Very high	37 Å²	37	43.4 Å²	43.4	24%	0.24	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-15.9	174.1	-20.6	34.6	0	0	0	114.4	D286 H292	D286-P290 WeakPolarHBondContact O-CD 3.13Å; P290-H292 PolarHBondContact O-N 2.8Å; P290-H292 VanDerWaalsContact O-N 3.14Å
291	L	92.6	Very high	92.4	Very high	6 Å²	6	49.7 Å²	49.7	3%	0.031	24%	0.244	C	C	.	.			trans	-90.9	68.1	-172.3	-53.8	177.3	0	0	0	110.7	F264 L267 L270 F288 T289 H293 L294	F264-L291 HydrophobicContact CB-CD1 4.11Å; F264-L291 HydrophobicContact CB-CD2 4.4Å; F264-L291 WeakPolarHBondContact O-CD2 3.45Å; L267-L291 HydrophobicContact CB-CD2 3.97Å; L267-L291 WeakPolarHBondContact O-CD2 3.49Å; L270-L291 HydrophobicContact CB-CD2 4.48Å; L270-L291 HydrophobicContact CD2-CD1 4.26Å; F288-L291 HydrophobicContact CD1-CD1 4.03Å; F288-L291 WeakPolarHBondContact O-CB 3.37Å; F288-L291 PolarHBondContact O-N 2.89Å; T289-L291 PolarHBondContact O-N 2.95Å; L291-H293 PolarHBondContact O-N 3.31Å; L291-H293 VanDerWaalsContact O-N 3.1Å; L291-L294 HydrophobicContact CB-CB 3.89Å; L291-L294 HydrophobicContact CB-CD2 4.18Å; L291-L294 HydrophobicContact CD1-CD2 3.88Å; L291-L294 VanDerWaalsContact O-CB 3.24Å; L291-L294 WeakPolarHBondContact O-CB 3.31Å; L291-L294 PolarHBondContact O-N 3.19Å
292	H	90.5	Very high	92.5	Very high	161 Å²	161	47.1 Å²	47.1	75%	0.745	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-20.7	-171.5	-57.2	-51.4	0	0	0	115.4	T289 P290	T289-H292 PolarHBondContact O-CE1 3.28Å; T289-H292 VanDerWaalsContact O-CE1 3.25Å; T289-H292 PolarHBondContact O-ND1 2.8Å; P290-H292 PolarHBondContact O-N 2.8Å; P290-H292 VanDerWaalsContact O-N 3.14Å
293	H	92.9	Very high	92.6	Very high	113 Å²	113	48 Å²	48	52%	0.523	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.8	4.9	179.4	-59.2	99.8	0	0	0	113.3	Q268 L270 V271 L291 E295	Q268-H293 PolarHBondContact O-ND1 3.08Å; L270-H293 CarbonylContact O-C 3.6Å; V271-H293 WeakPolarHBondContact CA-O 3.22Å; L291-H293 PolarHBondContact O-N 3.31Å; L291-H293 VanDerWaalsContact O-N 3.1Å; H293-E295 PolarHBondContact O-N 2.89Å
294	L	91.9	Very high	92.6	Very high	6 Å²	6	48 Å²	48	3%	0.031	23%	0.234	C	C	.	.			trans	-74.9	111.3	-173.6	-171.1	66	0	0	0	110.9	L270 L273 F288 L291 V297 W316	L270-L294 HydrophobicContact CD2-CD1 4.15Å; L270-L294 HydrophobicContact CG-CD1 4.2Å; L270-L294 VanDerWaalsContact O-CA 3.24Å; L270-L294 WeakPolarHBondContact O-CA 3.42Å; L270-L294 PolarHBondContact O-N 3.16Å; L270-L294 VanDerWaalsContact O-N 3.16Å; L273-L294 HydrophobicContact CB-CD1 4.04Å; F288-L294 HydrophobicContact CB-CD2 4.16Å; F288-L294 HydrophobicContact CD1-CD2 4.12Å; F288-L294 HydrophobicContact CG-CD2 4.05Å; L291-L294 HydrophobicContact CB-CB 3.89Å; L291-L294 HydrophobicContact CB-CD2 4.18Å; L291-L294 HydrophobicContact CD1-CD2 3.88Å; L291-L294 VanDerWaalsContact O-CB 3.24Å; L291-L294 WeakPolarHBondContact O-CB 3.31Å; L291-L294 PolarHBondContact O-N 3.19Å; L294-V297 HydrophobicContact CD1-CG2 4.04Å; L294-V297 HydrophobicContact CD2-CG2 3.52Å; L294-V297 HydrophobicContact CG-CG2 3.69Å; L294-W316 HydrophobicContact CB-CZ2 4.4Å; L294-W316 HydrophobicContact CD2-CH2 4.04Å; L294-W316 HydrophobicContact CD2-CZ2 3.81Å; L294-W316 HydrophobicContact CG-CH2 4.27Å; L294-W316 HydrophobicContact CG-CZ2 4.16Å
295	E	87.5	Confident	92.7	Very high	129 Å²	129	50.1 Å²	50.1	60%	0.603	25%	0.246	S	C	*	.			trans	-106.1	-32.1	-177.7	-66.8	177.9	-179.4	0	0	112.4	V271 H293	V271-E295 HydrophobicContact CG1-CB 4.25Å; V271-E295 HydrophobicContact CG1-CG 4.34Å; V271-E295 PolarHBondContact O-N 3.37Å; H293-E295 PolarHBondContact O-N 2.89Å
296	R	88.7	Confident	92.8	Very high	110 Å²	110	49.1 Å²	49.1	42%	0.415	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	116.3	-169.5	-68.3	-176.3	-73.4	128.3	11.6	111.1	V271 E272 L273	V271-R296 PolarHBondContact O-N 3.36Å; E272-R296 CarbonylContact C-O 3.56Å; E272-R296 VanDerWaalsContact CA-O 3.29Å; E272-R296 WeakPolarHBondContact CA-O 3.45Å; E272-R296 HydrophobicContact CB-CB 4.33Å; E272-R296 HydrophobicContact CG-CB 4.1Å; E272-R296 IonicContact OE1-CZ 3.77Å; E272-R296 IonicContact OE1-NH1 2.75Å; E272-R296 PolarHBondContact OE1-NH1 3.41Å; E272-R296 VanDerWaalsContact OE1-NH1 3.17Å; E272-R296 IonicContact OE2-CZ 2.76Å; E272-R296 IonicContact OE2-NH1 3.93Å; E272-R296 PolarHBondContact OE2-NH1 3.03Å; E272-R296 IonicContact OE2-NH2 3.04Å; E272-R296 PolarHBondContact OE2-NH2 3.07Å; L273-R296 PolarHBondContact N-O 3.11Å
297	V	91.6	Very high	92.9	Very high	17 Å²	17	48.2 Å²	48.2	10%	0.103	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	126.5	176.8	-168.1	0	0	0	0	110.5	L273 F288 L294 L299 W316	L273-V297 HydrophobicContact CB-CG1 4.43Å; L273-V297 CarbonylContact O-C 3.16Å; L273-V297 VanDerWaalsContact O-CA 3.3Å; L273-V297 WeakPolarHBondContact O-CA 3.47Å; F288-V297 HydrophobicContact CE2-CG1 4.38Å; F288-V297 HydrophobicContact CZ-CG1 4.2Å; L294-V297 HydrophobicContact CD1-CG2 4.04Å; L294-V297 HydrophobicContact CD2-CG2 3.52Å; L294-V297 HydrophobicContact CG-CG2 3.69Å; V297-L299 HydrophobicContact CG1-CD1 4.1Å; V297-L299 HydrophobicContact CG1-CD2 3.78Å; V297-L299 HydrophobicContact CG1-CG 3.64Å; V297-W316 HydrophobicContact CB-CH2 4.37Å; V297-W316 HydrophobicContact CB-CZ3 4.3Å; V297-W316 HydrophobicContact CG2-CH2 3.43Å; V297-W316 VanDerWaalsContact CG2-CH2 3.43Å; V297-W316 HydrophobicContact CG2-CZ2 4.39Å; V297-W316 HydrophobicContact CG2-CZ3 3.8Å
298	H	92.8	Very high	92.8	Very high	41 Å²	41	49.5 Å²	49.5	19%	0.19	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	107.2	176	-51.9	-92.1	0	0	0	109.6	E272 L273 N274 L275 A276	E272-H298 IonicContact OE1-CD2 2.78Å; E272-H298 IonicContact OE1-CE1 2.72Å; E272-H298 IonicContact OE1-NE2 3.17Å; E272-H298 PolarHBondContact OE1-NE2 2.85Å; L273-H298 PolarHBondContact O-N 2.98Å; N274-H298 HydrophobicContact CB-CB 4.21Å; N274-H298 WeakPolarHBondContact OD1-CB 3.34Å; L275-H298 CarbonylContact C-O 3.58Å; L275-H298 WeakPolarHBondContact CA-O 3.35Å; L275-H298 PolarHBondContact N-O 2.82Å; A276-H298 HydrophobicContact CB-CB 4.18Å; A276-H298 PolarHBondContact N-O 3.42Å; A276-H298 VanDerWaalsContact N-O 3.1Å
299	L	93.7	Very high	92.9	Very high	3 Å²	3	51 Å²	51	2%	0.016	25%	0.253	C	S	.	.			trans	-117	3.5	-176.7	-66.4	178.7	0	0	0	113.2	L275 L283 F288 V297 N302 W304 L313 A329	L275-L299 HydrophobicContact CB-CD2 4.06Å; L275-L299 HydrophobicContact CD1-CD2 4.11Å; L283-L299 HydrophobicContact CD1-CD2 4.42Å; F288-L299 HydrophobicContact CE2-CD1 4.5Å; V297-L299 HydrophobicContact CG1-CD1 4.1Å; V297-L299 HydrophobicContact CG1-CD2 3.78Å; V297-L299 HydrophobicContact CG1-CG 3.64Å; L299-N302 PolarHBondContact O-ND2 3.31Å; L299-N302 VanDerWaalsContact O-ND2 3.15Å; L299-W304 HydrophobicContact CB-CZ2 3.84Å; L299-W304 HydrophobicContact CD1-CZ2 4.45Å; L299-W304 HydrophobicContact CD2-CH2 4.23Å; L299-W304 HydrophobicContact CD2-CZ2 3.92Å; L299-W304 HydrophobicContact CG-CZ2 4.27Å; L299-W304 PolarHBondContact O-NE1 2.87Å; L299-L313 HydrophobicContact CD1-CD1 3.94Å; L299-L313 HydrophobicContact CD1-CD2 4.1Å; L299-A329 HydrophobicContact CB-CB 3.73Å
300	H	92.8	Very high	93.1	Very high	36 Å²	36	47.6 Å²	47.6	17%	0.167	23%	0.232	C	C	.	.			trans	-65	159.1	-177.3	63	81.1	0	0	0	112.6	A276 H277 N302 C327	A276-H300 VanDerWaalsContact CA-O 3.27Å; A276-H300 WeakPolarHBondContact CA-O 3.27Å; A276-H300 WeakPolarHBondContact CB-CE1 3.49Å; A276-H300 WeakPolarHBondContact CB-NE2 3.28Å; H277-H300 AromaticContact CD2-CE1 3.49Å; H277-H300 PolarHBondContact CD2-CE1 2.97Å; H277-H300 VanDerWaalsContact CD2-CE1 3.49Å; H277-H300 AromaticContact CD2-ND1 3.58Å; H277-H300 PolarHBondContact N-O 3.34Å; H277-H300 AromaticContact NE2-CE1 3.23Å; H277-H300 PolarHBondContact NE2-CE1 3.17Å; H277-H300 AromaticContact NE2-ND1 3.32Å; H277-H300 PolarHBondContact NE2-ND1 3.08Å; H300-N302 VanDerWaalsContact C-N 3.33Å; H300-N302 PolarHBondContact O-N 2.88Å; H300-N302 PolarHBondContact O-ND2 2.81Å; H300-C327 PolarHBondContact CD2-SG 2.81Å
301	H	95.4	Very high	93.3	Very high	132 Å²	132	45.8 Å²	45.8	61%	0.611	22%	0.221	S	C	*	.	S	Bend	trans	57.8	43.7	178.7	-63.4	76.8	0	0	0	113.3	H277	H277-H301 VanDerWaalsContact CA-O 3.23Å; H277-H301 WeakPolarHBondContact CA-O 3.41Å; H277-H301 HydrophobicContact CB-CB 4.31Å; H277-H301 AromaticContact CE1-CD2 3.38Å; H277-H301 PolarHBondContact CE1-CD2 3.39Å; H277-H301 AromaticContact CE1-CE1 3.83Å; H277-H301 AromaticContact CE1-CG 3.28Å; H277-H301 AromaticContact CE1-ND1 3.61Å; H277-H301 AromaticContact CE1-NE2 3.74Å; H277-H301 PolarHBondContact N-O 2.89Å; H277-H301 WeakPolarHBondContact ND1-CB 3.46Å; H277-H301 AromaticContact ND1-CD2 3.77Å; H277-H301 AromaticContact ND1-CG 3.62Å; H277-H301 AromaticContact NE2-CE1 3.99Å; H277-H301 AromaticContact NE2-CG 3.61Å; H277-H301 AromaticContact NE2-ND1 3.56Å
302	N	96.9	Very high	93.3	Very high	11 Å²	11	46 Å²	46	6%	0.059	22%	0.221	C	C	.	.	S	Bend	trans	-122	144.5	167.6	-78.8	-77.4	0	0	0	108.6	L275 N278 L280 L299 H300 W304	L275-N302 PolarHBondContact O-ND2 3.12Å; N278-N302 WeakPolarHBondContact CA-OD1 3.22Å; N278-N302 WeakPolarHBondContact CB-OD1 3.43Å; N278-N302 PolarHBondContact N-OD1 2.75Å; N278-N302 PolarHBondContact O-OD1 2.79Å; L280-N302 HydrophobicContact CB-CB 4.18Å; L280-N302 WeakPolarHBondContact CB-OD1 3.26Å; L280-N302 PolarHBondContact N-OD1 2.86Å; L280-N302 VanDerWaalsContact N-OD1 3.11Å; L299-N302 PolarHBondContact O-ND2 3.31Å; L299-N302 VanDerWaalsContact O-ND2 3.15Å; H300-N302 VanDerWaalsContact C-N 3.33Å; H300-N302 PolarHBondContact O-N 2.88Å; H300-N302 PolarHBondContact O-ND2 2.81Å; N302-W304 HydrophobicContact CB-CD2 4.16Å; N302-W304 HydrophobicContact CB-CG 4.42Å; N302-W304 HydrophobicContact CB-CZ2 3.74Å; N302-W304 VanDerWaalsContact O-CD1 3.29Å; N302-W304 PolarHBondContact O-N 3.03Å
303	P	96.8	Very high	93.5	Very high	38 Å²	38	38.3 Å²	38.3	25%	0.247	19%	0.185	C	C	.	.			trans	-77.6	61.6	-179.6	33.9	-38.1	0	0	0	112.7	L280 T281 N305	L280-P303 CarbonylContact O-C 3.18Å; L280-P303 WeakPolarHBondContact O-CD 3.36Å; T281-P303 HydrophobicContact CG2-CG 4.25Å; P303-N305 PolarHBondContact O-N 3.26Å
304	W	96.6	Very high	93.4	Very high	1 Å²	1	33 Å²	33	0%	0.004	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.2	128.8	-176.1	-62.5	110.5	0	0	0	113	L280 T281 L283 L299 N302 I310 S332 S333 I342	L280-W304 HydrophobicContact CB-CH2 3.72Å; L280-W304 HydrophobicContact CB-CZ2 4.29Å; L280-W304 HydrophobicContact CB-CZ3 3.92Å; L280-W304 HydrophobicContact CD1-CH2 4.01Å; L280-W304 HydrophobicContact CD1-CZ2 4.5Å; L280-W304 HydrophobicContact CG-CH2 4.49Å; T281-W304 CarbonylContact O-C 3.28Å; T281-W304 WeakPolarHBondContact O-CA 3.45Å; L283-W304 HydrophobicContact CD1-CH2 3.99Å; L283-W304 HydrophobicContact CD1-CZ3 4.35Å; L283-W304 HydrophobicContact CD2-CH2 4.21Å; L283-W304 HydrophobicContact CD2-CZ3 4.43Å; L283-W304 HydrophobicContact CG-CH2 3.81Å; L283-W304 HydrophobicContact CG-CZ3 3.81Å; L299-W304 HydrophobicContact CB-CZ2 3.84Å; L299-W304 HydrophobicContact CD1-CZ2 4.45Å; L299-W304 HydrophobicContact CD2-CH2 4.23Å; L299-W304 HydrophobicContact CD2-CZ2 3.92Å; L299-W304 HydrophobicContact CG-CZ2 4.27Å; L299-W304 PolarHBondContact O-NE1 2.87Å; N302-W304 HydrophobicContact CB-CD2 4.16Å; N302-W304 HydrophobicContact CB-CG 4.42Å; N302-W304 HydrophobicContact CB-CZ2 3.74Å; N302-W304 VanDerWaalsContact O-CD1 3.29Å; N302-W304 PolarHBondContact O-N 3.03Å; W304-I310 HydrophobicContact CE3-CD1 4.1Å; W304-S332 PolarHBondContact O-N 2.86Å; W304-S333 PolarHBondContact O-N 3.34Å; W304-S333 VanDerWaalsContact O-N 3.13Å; W304-I342 HydrophobicContact CB-CD1 3.78Å; W304-I342 HydrophobicContact CD2-CD1 4.03Å; W304-I342 HydrophobicContact CG-CD1 3.56Å
305	N	96.1	Very high	93.4	Very high	49 Å²	49	37.3 Å²	37.3	26%	0.262	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	101.7	172.6	-174.2	33.6	0	0	0	109.4	T281 L282 P303 N307 S333	T281-N305 PolarHBondContact O-N 3.01Å; L282-N305 HydrophobicContact CD2-CB 4.49Å; L282-N305 WeakPolarHBondContact CD2-O 3.35Å; L282-N305 HydrophobicContact CG-CB 4.34Å; P303-N305 PolarHBondContact O-N 3.26Å; N305-N307 PolarHBondContact O-N 3.12Å; N305-N307 VanDerWaalsContact O-N 3.12Å; N305-S333 CarbonylContact C-O 3.23Å; N305-S333 WeakPolarHBondContact CA-O 3.38Å; N305-S333 WeakPolarHBondContact OD1-CB 3.45Å; N305-S333 PolarHBondContact OD1-OG 2.82Å
306	C	95.3	Very high	93.6	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.007	15%	0.153	C	C	.	.			trans	-82.8	92.6	-175.8	-66.8	0	0	0	0	110.9	I310 C331 S333 P334 L345 F350	C306-I310 HydrophobicContact CB-CG2 4.22Å; C306-C331 HydrophobicContact CB-CB 3.83Å; C306-C331 WeakPolarHBondContact CB-SG 3.42Å; C306-C331 WeakPolarHBondContact SG-CA 3.09Å; C306-C331 WeakPolarHBondContact SG-CB 3.36Å; C306-C331 CovalentContact SG-SG 2.02Å; C306-C331 PolarHBondContact SG-SG 3.39Å; C306-S333 PolarHBondContact N-O 3.07Å; C306-P334 WeakPolarHBondContact O-CD 3.04Å; C306-L345 HydrophobicContact CB-CD1 3.92Å; C306-F350 VanDerWaalsContact O-CE1 3.23Å; C306-F350 WeakPolarHBondContact O-CE1 3.25Å
307	N	93.3	Very high	93.6	Very high	44 Å²	44	27.6 Å²	27.6	24%	0.235	14%	0.135	C	C	.	.	S	Bend	trans	-123.7	-164.5	172.6	70.3	-5	0	0	0	109.9	L282 N305 D309 I310	L282-N307 WeakPolarHBondContact CD2-OD1 3.3Å; N305-N307 PolarHBondContact O-N 3.12Å; N305-N307 VanDerWaalsContact O-N 3.12Å; N307-D309 PolarHBondContact ND2-OD2 3.23Å; N307-D309 PolarHBondContact O-N 2.85Å; N307-D309 WeakPolarHBondContact OD1-CB 3.22Å; N307-D309 PolarHBondContact OD1-N 2.98Å; N307-D309 PolarHBondContact OD1-OD2 2.82Å; N307-I310 VanDerWaalsContact O-CG2 3.26Å; N307-I310 WeakPolarHBondContact O-CG2 3.22Å; N307-I310 PolarHBondContact O-N 2.99Å
308	C	92.6	Very high	93.4	Very high	30 Å²	30	34.3 Å²	34.3	20%	0.203	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-57	-29.8	176.4	-70.6	0	0	0	0	115.1	I310 L311 C352 S431	C308-I310 PolarHBondContact O-N 2.77Å; C308-L311 WeakPolarHBondContact O-CB 3.3Å; C308-L311 PolarHBondContact O-N 2.96Å; C308-C352 VanDerWaalsContact CA-SG 3.53Å; C308-C352 HydrophobicContact CB-CB 3.77Å; C308-C352 WeakPolarHBondContact CB-SG 2.98Å; C308-C352 WeakPolarHBondContact SG-CA 3.37Å; C308-C352 WeakPolarHBondContact SG-CB 3.48Å; C308-C352 CovalentContact SG-SG 2.04Å; C308-C352 PolarHBondContact SG-SG 3.45Å; C308-S431 PolarHBondContact O-OG 2.85Å
309	D	93.4	Very high	93.1	Very high	33 Å²	33	39.7 Å²	39.7	18%	0.176	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-74.5	-14.8	-177.4	-53.5	-56.4	0	0	0	112.2	L282 N307 W312 L381	L282-D309 HydrophobicContact CD2-CB 4.09Å; N307-D309 PolarHBondContact ND2-OD2 3.23Å; N307-D309 PolarHBondContact O-N 2.85Å; N307-D309 WeakPolarHBondContact OD1-CB 3.22Å; N307-D309 PolarHBondContact OD1-N 2.98Å; N307-D309 PolarHBondContact OD1-OD2 2.82Å; D309-W312 PolarHBondContact O-NE1 2.93Å; D309-W312 VanDerWaalsContact O-NE1 3.12Å; D309-L381 HydrophobicContact CB-CD1 4.17Å
310	I	93.8	Very high	92.4	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.005	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-84.6	-13	176.6	-147.1	68.6	0	0	0	113.1	L282 W304 C306 N307 C308 W312 L313 S314 I342 L345	L282-I310 HydrophobicContact CD2-CD1 4.2Å; W304-I310 HydrophobicContact CE3-CD1 4.1Å; C306-I310 HydrophobicContact CB-CG2 4.22Å; N307-I310 VanDerWaalsContact O-CG2 3.26Å; N307-I310 WeakPolarHBondContact O-CG2 3.22Å; N307-I310 PolarHBondContact O-N 2.99Å; C308-I310 PolarHBondContact O-N 2.77Å; I310-W312 PolarHBondContact O-N 3.31Å; I310-L313 HydrophobicContact CD1-CD2 3.82Å; I310-L313 HydrophobicContact CG1-CD2 4.39Å; I310-L313 WeakPolarHBondContact O-CB 3.43Å; I310-L313 PolarHBondContact O-N 3.02Å; I310-L313 VanDerWaalsContact O-N 3.12Å; I310-S314 PolarHBondContact O-N 3.11Å; I310-I342 HydrophobicContact CD1-CD1 4.22Å; I310-I342 HydrophobicContact CG1-CD1 4.08Å; I310-I342 HydrophobicContact CG1-CG2 3.82Å; I310-L345 HydrophobicContact CG2-CD1 3.83Å
311	L	93.6	Very high	91.4	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-62.8	-43.3	-169.9	-79.5	175.3	0	0	0	113.1	C308 L313 S314 W315 Q347 F350	C308-L311 WeakPolarHBondContact O-CB 3.3Å; C308-L311 PolarHBondContact O-N 2.96Å; L311-L313 PolarHBondContact O-N 3.03Å; L311-S314 WeakPolarHBondContact O-CB 3.5Å; L311-S314 PolarHBondContact O-N 2.65Å; L311-S314 VanDerWaalsContact O-N 3.09Å; L311-W315 HydrophobicContact CB-CH2 4.28Å; L311-W315 HydrophobicContact CB-CZ2 4.1Å; L311-W315 PolarHBondContact O-N 3.45Å; L311-Q347 HydrophobicContact CD1-CB 4.44Å; L311-Q347 HydrophobicContact CD1-CG 4.3Å; L311-F350 HydrophobicContact CD1-CD2 4.12Å; L311-F350 HydrophobicContact CD2-CD2 3.72Å; L311-F350 HydrophobicContact CD2-CE2 3.87Å; L311-F350 HydrophobicContact CG-CD2 3.99Å; L311-F350 HydrophobicContact CG-CE2 4.34Å
312	W	93.8	Very high	90.1	Very high	10 Å²	10	40.9 Å²	40.9	4%	0.038	20%	0.204	C	C	.	.	H	α-helix	trans	-57.1	-40.2	175.5	76.8	-92.9	0	0	0	111.4	L283 P284 H285 L287 F288 D309 I310 W315 W316	L283-W312 HydrophobicContact CB-CH2 4.43Å; L283-W312 HydrophobicContact CB-CZ2 3.69Å; P284-W312 WeakPolarHBondContact O-CZ2 3.29Å; H285-W312 AromaticContact CD2-CD1 3.8Å; H285-W312 AromaticContact CD2-CG 3.88Å; L287-W312 HydrophobicContact CB-CH2 3.95Å; L287-W312 HydrophobicContact CB-CZ2 4.29Å; F288-W312 HydrophobicContact CB-CZ3 4.39Å; F288-W312 AromaticContact CD2-CH2 3.9Å; F288-W312 HydrophobicContact CD2-CH2 3.9Å; F288-W312 AromaticContact CD2-CZ3 3.92Å; F288-W312 HydrophobicContact CD2-CZ3 3.92Å; F288-W312 HydrophobicContact CE2-CH2 4.16Å; F288-W312 HydrophobicContact CG-CH2 4.26Å; F288-W312 HydrophobicContact CG-CZ3 4.29Å; D309-W312 PolarHBondContact O-NE1 2.93Å; D309-W312 VanDerWaalsContact O-NE1 3.12Å; I310-W312 PolarHBondContact O-N 3.31Å; W312-W315 PolarHBondContact O-N 3.01Å; W312-W316 WeakPolarHBondContact O-CB 3.46Å; W312-W316 PolarHBondContact O-N 2.84Å
313	L	93.6	Very high	88.3	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-69.9	-37.2	178.2	178.9	64.5	0	0	0	111.4	L283 F288 L299 I310 L311 W316 L317 I342	L283-L313 HydrophobicContact CD1-CD1 4.49Å; L283-L313 HydrophobicContact CD1-CD2 4.18Å; F288-L313 HydrophobicContact CD2-CD1 4.16Å; F288-L313 HydrophobicContact CE2-CD1 3.66Å; L299-L313 HydrophobicContact CD1-CD1 3.94Å; L299-L313 HydrophobicContact CD1-CD2 4.1Å; I310-L313 HydrophobicContact CD1-CD2 3.82Å; I310-L313 HydrophobicContact CG1-CD2 4.39Å; I310-L313 WeakPolarHBondContact O-CB 3.43Å; I310-L313 PolarHBondContact O-N 3.02Å; I310-L313 VanDerWaalsContact O-N 3.12Å; L311-L313 PolarHBondContact O-N 3.03Å; L313-W316 PolarHBondContact O-N 2.9Å; L313-L317 HydrophobicContact CD1-CD1 4.3Å; L313-L317 HydrophobicContact CD1-CG 4.17Å; L313-L317 HydrophobicContact CG-CD1 4.04Å; L313-L317 HydrophobicContact CG-CG 4.36Å; L313-L317 WeakPolarHBondContact O-CB 3.25Å; L313-L317 VanDerWaalsContact O-CG 3.22Å; L313-L317 WeakPolarHBondContact O-CG 3.23Å; L313-L317 PolarHBondContact O-N 2.93Å; L313-I342 HydrophobicContact CD2-CG2 4.49Å; L313-I342 HydrophobicContact CG-CG2 4.45Å
314	S	92.4	Very high	86.4	Confident	1 Å²	1	51 Å²	51	1%	0.007	27%	0.272	C	S	.	.	H	α-helix	trans	-57.7	-50.5	172.3	177.7	0	0	0	0	111.2	I310 L311 W316 L317 K318 I342 L345	I310-S314 PolarHBondContact O-N 3.11Å; L311-S314 WeakPolarHBondContact O-CB 3.5Å; L311-S314 PolarHBondContact O-N 2.65Å; L311-S314 VanDerWaalsContact O-N 3.09Å; S314-W316 PolarHBondContact O-N 2.93Å; S314-L317 PolarHBondContact O-N 2.82Å; S314-K318 WeakPolarHBondContact O-CB 3.15Å; S314-K318 PolarHBondContact O-N 3.01Å; S314-I342 WeakPolarHBondContact CB-O 3.45Å; S314-I342 PolarHBondContact OG-O 3.22Å; S314-L345 PolarHBondContact OG-O 2.95Å
315	W	91.4	Very high	84.9	Confident	97 Å²	97	53.7 Å²	53.7	37%	0.367	29%	0.289	S	S	.	.	H	α-helix	trans	-61.7	-45.3	178.9	-58.2	-30.4	0	0	0	111.7	L311 W312 L317 K318 E319 Q347 S431	L311-W315 HydrophobicContact CB-CH2 4.28Å; L311-W315 HydrophobicContact CB-CZ2 4.1Å; L311-W315 PolarHBondContact O-N 3.45Å; W312-W315 PolarHBondContact O-N 3.01Å; W315-L317 PolarHBondContact O-N 3.02Å; W315-K318 PolarHBondContact O-N 2.83Å; W315-E319 PolarHBondContact O-N 3.12Å; W315-E319 VanDerWaalsContact O-N 3.09Å; W315-Q347 HydrophobicContact CZ2-CB 4.49Å; W315-S431 WeakPolarHBondContact CH2-O 3.26Å
316	W	91.3	Very high	82.7	Confident	26 Å²	26	57.4 Å²	57.4	10%	0.098	32%	0.319	C	S	.	.	H	α-helix	trans	-58.9	-46.3	176.5	-171.5	91.2	0	0	0	112	F288 L294 V297 W312 L313 S314 K318 E319 M320 V321	F288-W316 HydrophobicContact CB-CD2 4.46Å; F288-W316 HydrophobicContact CB-CZ2 4.32Å; F288-W316 AromaticContact CD2-CD2 3.91Å; F288-W316 HydrophobicContact CD2-CD2 3.91Å; F288-W316 HydrophobicContact CD2-CE3 4.03Å; F288-W316 HydrophobicContact CD2-CG 4.46Å; F288-W316 HydrophobicContact CD2-CZ2 4.35Å; F288-W316 HydrophobicContact CD2-CZ3 4.33Å; L294-W316 HydrophobicContact CB-CZ2 4.4Å; L294-W316 HydrophobicContact CD2-CH2 4.04Å; L294-W316 HydrophobicContact CD2-CZ2 3.81Å; L294-W316 HydrophobicContact CG-CH2 4.27Å; L294-W316 HydrophobicContact CG-CZ2 4.16Å; V297-W316 HydrophobicContact CB-CH2 4.37Å; V297-W316 HydrophobicContact CB-CZ3 4.3Å; V297-W316 HydrophobicContact CG2-CH2 3.43Å; V297-W316 VanDerWaalsContact CG2-CH2 3.43Å; V297-W316 HydrophobicContact CG2-CZ2 4.39Å; V297-W316 HydrophobicContact CG2-CZ3 3.8Å; W312-W316 WeakPolarHBondContact O-CB 3.46Å; W312-W316 PolarHBondContact O-N 2.84Å; L313-W316 PolarHBondContact O-N 2.9Å; S314-W316 PolarHBondContact O-N 2.93Å; W316-K318 VanDerWaalsContact C-N 3.34Å; W316-K318 PolarHBondContact O-N 2.8Å; W316-E319 PolarHBondContact O-N 2.93Å; W316-M320 HydrophobicContact CD2-CB 4.4Å; W316-M320 HydrophobicContact CD2-CG 4.08Å; W316-M320 HydrophobicContact CE3-CB 4.39Å; W316-M320 HydrophobicContact CG-CG 4.5Å; W316-M320 HydrophobicContact CH2-CB 3.95Å; W316-M320 HydrophobicContact CH2-CG 4.24Å; W316-M320 HydrophobicContact CZ2-CB 4.01Å; W316-M320 HydrophobicContact CZ2-CG 3.77Å; W316-M320 HydrophobicContact CZ3-CB 4.18Å; W316-M320 WeakPolarHBondContact O-CB 3.31Å; W316-M320 WeakPolarHBondContact O-CG 3.42Å; W316-M320 PolarHBondContact O-N 2.86Å; W316-V321 HydrophobicContact CZ3-CG2 4.43Å
317	L	89.8	Confident	81	Confident	8 Å²	8	60 Å²	60	4%	0.042	34%	0.336	C	S	.	.	H	α-helix	trans	-63.8	-39.3	177.7	-74	171	0	0	0	112	L313 S314 W315 E319 V321 I342	L313-L317 HydrophobicContact CD1-CD1 4.3Å; L313-L317 HydrophobicContact CD1-CG 4.17Å; L313-L317 HydrophobicContact CG-CD1 4.04Å; L313-L317 HydrophobicContact CG-CG 4.36Å; L313-L317 WeakPolarHBondContact O-CB 3.25Å; L313-L317 VanDerWaalsContact O-CG 3.22Å; L313-L317 WeakPolarHBondContact O-CG 3.23Å; L313-L317 PolarHBondContact O-N 2.93Å; S314-L317 PolarHBondContact O-N 2.82Å; W315-L317 PolarHBondContact O-N 3.02Å; L317-E319 VanDerWaalsContact C-N 3.29Å; L317-E319 PolarHBondContact O-N 3.05Å; L317-V321 HydrophobicContact CD2-CG2 3.73Å; L317-V321 VanDerWaalsContact O-CB 3.26Å; L317-V321 WeakPolarHBondContact O-CB 3.26Å; L317-V321 PolarHBondContact O-N 3.31Å; L317-I342 HydrophobicContact CD1-CB 4.13Å; L317-I342 HydrophobicContact CD1-CG2 3.97Å
318	K	87.2	Confident	80.1	Confident	159 Å²	159	59.1 Å²	59.1	69%	0.691	33%	0.333	S	S	*	.	H	α-helix	trans	-65.1	-33.4	179.1	-175.5	178.3	178.3	-178.3	0	112.6	S314 W315 W316	S314-K318 WeakPolarHBondContact O-CB 3.15Å; S314-K318 PolarHBondContact O-N 3.01Å; W315-K318 PolarHBondContact O-N 2.83Å; W316-K318 VanDerWaalsContact C-N 3.34Å; W316-K318 PolarHBondContact O-N 2.8Å
319	E	85.9	Confident	80	Confident	154 Å²	154	57.9 Å²	57.9	72%	0.72	33%	0.325	S	S	*	.	H	α-helix	trans	-82	-45.2	179.7	-173.1	173	-177.9	0	0	112.4	W315 W316 L317	W315-E319 PolarHBondContact O-N 3.12Å; W315-E319 VanDerWaalsContact O-N 3.09Å; W316-E319 PolarHBondContact O-N 2.93Å; L317-E319 VanDerWaalsContact C-N 3.29Å; L317-E319 PolarHBondContact O-N 3.05Å
320	M	78.3	Confident	80	Confident	89 Å²	89	63.1 Å²	63.1	44%	0.438	34%	0.342	S	S	.	.	H	α-helix	trans	-91.9	-27.7	-169	-63.4	-64.7	176.3	0	0	114.2	W316	W316-M320 HydrophobicContact CD2-CB 4.4Å; W316-M320 HydrophobicContact CD2-CG 4.08Å; W316-M320 HydrophobicContact CE3-CB 4.39Å; W316-M320 HydrophobicContact CG-CG 4.5Å; W316-M320 HydrophobicContact CH2-CB 3.95Å; W316-M320 HydrophobicContact CH2-CG 4.24Å; W316-M320 HydrophobicContact CZ2-CB 4.01Å; W316-M320 HydrophobicContact CZ2-CG 3.77Å; W316-M320 HydrophobicContact CZ3-CB 4.18Å; W316-M320 WeakPolarHBondContact O-CB 3.31Å; W316-M320 WeakPolarHBondContact O-CG 3.42Å; W316-M320 PolarHBondContact O-N 2.86Å
321	V	72.8	Confident	80.1	Confident	29 Å²	29	63.3 Å²	63.3	18%	0.176	34%	0.343	C	S	.	.	S	Bend	trans	-100.5	119	-172	-178.5	0	0	0	0	110.7	W316 L317 A323 T325	W316-V321 HydrophobicContact CZ3-CG2 4.43Å; L317-V321 HydrophobicContact CD2-CG2 3.73Å; L317-V321 VanDerWaalsContact O-CB 3.26Å; L317-V321 WeakPolarHBondContact O-CB 3.26Å; L317-V321 PolarHBondContact O-N 3.31Å; V321-A323 PolarHBondContact O-N 2.82Å; V321-T325 WeakPolarHBondContact CG1-OG1 3.42Å
322	P	67.8	Low	80.2	Confident	78 Å²	78	65.9 Å²	65.9	51%	0.506	36%	0.361	S	S	.	.			trans	-60	137.6	177.3	-23.4	33.3	0	0	0	111.9	N324 T325	P322-N324 WeakPolarHBondContact CB-OD1 3.11Å; P322-N324 PolarHBondContact O-N 3.3Å; P322-T325 PolarHBondContact O-N 3.33Å; P322-T325 VanDerWaalsContact O-N 3.07Å; P322-T325 PolarHBondContact O-OG1 3.5Å
323	A	58.9	Low	80.3	Confident	118 Å²	118	67.8 Å²	67.8	98%	0.975	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-10.7	-176.5	0	0	0	0	0	115.4	V321	V321-A323 PolarHBondContact O-N 2.82Å
324	N	57.9	Low	80.4	Confident	142 Å²	142	69.8 Å²	69.8	76%	0.759	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	0.3	-179.4	65.6	1.7	0	0	0	114.4	P322	P322-N324 WeakPolarHBondContact CB-OD1 3.11Å; P322-N324 PolarHBondContact O-N 3.3Å
325	T	63.7	Low	80.4	Confident	58 Å²	58	75.9 Å²	75.9	36%	0.356	43%	0.427	S	S	.	.			trans	-88.4	118.2	179.7	48.5	0	0	0	0	111.2	V321 P322 C327 C328	V321-T325 WeakPolarHBondContact CG1-OG1 3.42Å; P322-T325 PolarHBondContact O-N 3.33Å; P322-T325 VanDerWaalsContact O-N 3.07Å; P322-T325 PolarHBondContact O-OG1 3.5Å; T325-C327 PolarHBondContact O-N 2.78Å; T325-C327 VanDerWaalsContact O-N 3.15Å; T325-C328 PolarHBondContact O-SG 3.19Å
326	S	51	Low	80.4	Confident	127 Å²	127	78.2 Å²	78.2	89%	0.888	44%	0.442	S	S	*	.			trans	-81.5	21	-178.1	64.1	0	0	0	0	114.2
327	C	59.1	Low	80.5	Confident	56 Å²	56	78.5 Å²	78.5	38%	0.378	44%	0.443	S	S	.	.			trans	-108.7	60.3	-169.8	-135	0	0	0	0	111.2	H300 T325	H300-C327 PolarHBondContact CD2-SG 2.81Å; T325-C327 PolarHBondContact O-N 2.78Å; T325-C327 VanDerWaalsContact O-N 3.15Å
328	C	74.3	Confident	80.7	Confident	26 Å²	26	85 Å²	85	18%	0.176	47%	0.471	C	S	.	.			trans	-108.9	126	-157.8	-73.4	0	0	0	0	112.8	T325 R330 Y341	T325-C328 PolarHBondContact O-SG 3.19Å; C328-R330 PolarHBondContact O-N 3.22Å; C328-Y341 HydrophobicContact CB-CD2 3.35Å; C328-Y341 HydrophobicContact CB-CE2 3.27Å; C328-Y341 HydrophobicContact CB-CG 4.19Å; C328-Y341 WeakPolarHBondContact SG-CE2 3.24Å; C328-Y341 VanDerWaalsContact SG-CZ 3.57Å
329	A	90	Very high	80.9	Confident	3 Å²	3	79.1 Å²	79.1	3%	0.025	46%	0.455	C	S	.	.			trans	-59.4	127.3	168.4	0	0	0	0	0	110.7	L299 Y341 I342	L299-A329 HydrophobicContact CB-CB 3.73Å; A329-Y341 VanDerWaalsContact O-CD2 3.25Å; A329-Y341 WeakPolarHBondContact O-CD2 3.37Å; A329-I342 HydrophobicContact CB-CD1 3.66Å; A329-I342 HydrophobicContact CB-CG1 4.26Å; A329-I342 WeakPolarHBondContact O-CG1 3.48Å; A329-I342 PolarHBondContact O-N 3.32Å; A329-I342 VanDerWaalsContact O-N 3.07Å
330	R	93.1	Very high	81.2	Confident	144 Å²	144	76.8 Å²	76.8	54%	0.543	44%	0.44	S	S	.	.	B	Isolated β-bridge	trans	-119.9	144.4	-179.1	-68.9	176.8	-178.8	-85.8	-3.5	110.6	C328 G339 R340	C328-R330 PolarHBondContact O-N 3.22Å; R330-G339 WeakPolarHBondContact CD-O 3.43Å; R330-G339 PolarHBondContact NH1-O 3.12Å; R330-R340 CarbonylContact C-O 3.56Å; R330-R340 WeakPolarHBondContact CA-O 3.46Å
331	C	95.8	Very high	81.8	Confident	4 Å²	4	74.2 Å²	74.2	3%	0.027	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	137.7	175.8	-58.2	0	0	0	0	111.1	C306 Y337 K338 G339 R340	C306-C331 HydrophobicContact CB-CB 3.83Å; C306-C331 WeakPolarHBondContact CB-SG 3.42Å; C306-C331 WeakPolarHBondContact SG-CA 3.09Å; C306-C331 WeakPolarHBondContact SG-CB 3.36Å; C306-C331 CovalentContact SG-SG 2.02Å; C306-C331 PolarHBondContact SG-SG 3.39Å; C331-Y337 WeakPolarHBondContact CB-O 3.46Å; C331-K338 CarbonylContact O-C 3.23Å; C331-K338 WeakPolarHBondContact O-CA 3.46Å; C331-G339 PolarHBondContact O-N 3.39Å; C331-R340 PolarHBondContact N-O 2.82Å
332	S	96.9	Very high	82.7	Confident	54 Å²	54	72.9 Å²	72.9	38%	0.378	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	-37.5	169.8	-172.8	0	0	0	0	111.3	W304 K338	W304-S332 PolarHBondContact O-N 2.86Å; S332-K338 WeakPolarHBondContact O-CG 3.42Å
333	S	95.2	Very high	83.7	Confident	51 Å²	51	69.5 Å²	69.5	36%	0.357	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	155	178.6	171.8	0	0	0	0	109.6	W304 N305 C306	W304-S333 PolarHBondContact O-N 3.34Å; W304-S333 VanDerWaalsContact O-N 3.13Å; N305-S333 CarbonylContact C-O 3.23Å; N305-S333 WeakPolarHBondContact CA-O 3.38Å; N305-S333 WeakPolarHBondContact OD1-CB 3.45Å; N305-S333 PolarHBondContact OD1-OG 2.82Å; C306-S333 PolarHBondContact N-O 3.07Å
334	P	95.3	Very high	85.1	Confident	41 Å²	41	70.6 Å²	70.6	27%	0.266	38%	0.381	S	S	.	.	S	Bend	cis	-67.9	167.7	-14.2	30.1	-34.9	0	0	0	111.7	C306 Q336 Y337 K338	C306-P334 WeakPolarHBondContact O-CD 3.04Å; P334-Q336 PolarHBondContact O-N 3Å; P334-Q336 VanDerWaalsContact O-N 3.08Å; P334-Y337 HydrophobicContact CG-CD2 3.7Å; P334-Y337 HydrophobicContact CG-CE2 4.24Å; P334-Y337 PolarHBondContact O-N 3.06Å; P334-K338 PolarHBondContact O-N 3.21Å
335	T	92.3	Very high	86.7	Confident	129 Å²	129	64.1 Å²	64.1	79%	0.791	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-30.2	-176.8	50.2	0	0	0	0	113.7	Y337 K338	T335-Y337 VanDerWaalsContact C-N 3.27Å; T335-Y337 PolarHBondContact O-N 3.35Å; T335-K338 PolarHBondContact O-N 3.49Å
336	Q	92.6	Very high	87.8	Confident	146 Å²	146	64.7 Å²	64.7	68%	0.682	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-31.3	177.7	-61.1	173.3	-0.1	0	0	113.3	P334	P334-Q336 PolarHBondContact O-N 3Å; P334-Q336 VanDerWaalsContact O-N 3.08Å
337	Y	92.6	Very high	89.6	Confident	33 Å²	33	63 Å²	63	13%	0.129	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110	-0.6	-177.1	-56.2	-42.7	0	0	0	113.2	C331 P334 T335 G339 R340 Y349 F350	C331-Y337 WeakPolarHBondContact CB-O 3.46Å; P334-Y337 HydrophobicContact CG-CD2 3.7Å; P334-Y337 HydrophobicContact CG-CE2 4.24Å; P334-Y337 PolarHBondContact O-N 3.06Å; T335-Y337 VanDerWaalsContact C-N 3.27Å; T335-Y337 PolarHBondContact O-N 3.35Å; Y337-G339 PolarHBondContact O-N 3.2Å; Y337-R340 VanDerWaalsContact O-CB 3.24Å; Y337-R340 WeakPolarHBondContact O-CB 3.35Å; Y337-R340 WeakPolarHBondContact O-CG 3.4Å; Y337-R340 PolarHBondContact O-N 3.19Å; Y337-Y349 AromaticContact CE1-CD1 3.71Å; Y337-Y349 HydrophobicContact CE1-CD1 3.71Å; Y337-Y349 HydrophobicContact CE1-CE1 4.42Å; Y337-Y349 PolarHBondContact OH-O 2.93Å; Y337-F350 AromaticContact CD2-CE1 3.89Å; Y337-F350 HydrophobicContact CD2-CE1 3.89Å; Y337-F350 HydrophobicContact CD2-CZ 4.16Å; Y337-F350 HydrophobicContact CE2-CD1 4.2Å; Y337-F350 AromaticContact CE2-CE1 3.45Å; Y337-F350 HydrophobicContact CE2-CE1 3.45Å; Y337-F350 VanDerWaalsContact CE2-CE1 3.45Å; Y337-F350 AromaticContact CE2-CZ 3.97Å; Y337-F350 HydrophobicContact CE2-CZ 3.97Å
338	K	93.9	Very high	91	Very high	144 Å²	144	67 Å²	67	63%	0.626	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	129.6	-178.6	-174.4	174.7	-178.8	178.6	0	112	C331 S332 P334 T335 R340	C331-K338 CarbonylContact O-C 3.23Å; C331-K338 WeakPolarHBondContact O-CA 3.46Å; S332-K338 WeakPolarHBondContact O-CG 3.42Å; P334-K338 PolarHBondContact O-N 3.21Å; T335-K338 PolarHBondContact O-N 3.49Å; K338-R340 VanDerWaalsContact C-N 3.28Å; K338-R340 PolarHBondContact O-N 3.06Å
339	G	91.6	Very high	91.5	Very high	35 Å²	35	70.2 Å²	70.2	36%	0.361	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.4	-12.2	-179.6	0	0	0	0	0	115.2	R330 C331 Y337	R330-G339 WeakPolarHBondContact CD-O 3.43Å; R330-G339 PolarHBondContact NH1-O 3.12Å; C331-G339 PolarHBondContact O-N 3.39Å; Y337-G339 PolarHBondContact O-N 3.2Å
340	R	91.4	Very high	91.6	Very high	106 Å²	106	71.2 Å²	71.2	40%	0.4	36%	0.356	S	S	.	.			trans	-67	146.6	175.2	-66.3	-172.6	179.8	-136.6	0.6	111.1	R330 C331 Y337 K338 Y349	R330-R340 CarbonylContact C-O 3.56Å; R330-R340 WeakPolarHBondContact CA-O 3.46Å; C331-R340 PolarHBondContact N-O 2.82Å; Y337-R340 VanDerWaalsContact O-CB 3.24Å; Y337-R340 WeakPolarHBondContact O-CB 3.35Å; Y337-R340 WeakPolarHBondContact O-CG 3.4Å; Y337-R340 PolarHBondContact O-N 3.19Å; K338-R340 VanDerWaalsContact C-N 3.28Å; K338-R340 PolarHBondContact O-N 3.06Å; R340-Y349 VanDerWaalsContact NH1-CE1 3.25Å; R340-Y349 PolarHBondContact NH1-OH 3.26Å
341	Y	91.4	Very high	91.4	Very high	35 Å²	35	72.4 Å²	72.4	14%	0.137	37%	0.368	C	S	.	.	B	Isolated β-bridge	trans	-73.5	134.1	174.2	176	-138.4	0	0	0	110.1	C328 A329 G343 E344	C328-Y341 HydrophobicContact CB-CD2 3.35Å; C328-Y341 HydrophobicContact CB-CE2 3.27Å; C328-Y341 HydrophobicContact CB-CG 4.19Å; C328-Y341 WeakPolarHBondContact SG-CE2 3.24Å; C328-Y341 VanDerWaalsContact SG-CZ 3.57Å; A329-Y341 VanDerWaalsContact O-CD2 3.25Å; A329-Y341 WeakPolarHBondContact O-CD2 3.37Å; Y341-G343 PolarHBondContact O-N 2.93Å; Y341-E344 HydrophobicContact CD1-CG 3.9Å; Y341-E344 PolarHBondContact O-N 2.96Å
342	I	92.4	Very high	91.3	Very high	0 Å²	0	73.4 Å²	73.4	0%	0	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-62.6	-40.6	-177.7	-66.6	179.3	0	0	0	111.7	W304 I310 L313 S314 L317 A329 E344 L345	W304-I342 HydrophobicContact CB-CD1 3.78Å; W304-I342 HydrophobicContact CD2-CD1 4.03Å; W304-I342 HydrophobicContact CG-CD1 3.56Å; I310-I342 HydrophobicContact CD1-CD1 4.22Å; I310-I342 HydrophobicContact CG1-CD1 4.08Å; I310-I342 HydrophobicContact CG1-CG2 3.82Å; L313-I342 HydrophobicContact CD2-CG2 4.49Å; L313-I342 HydrophobicContact CG-CG2 4.45Å; S314-I342 WeakPolarHBondContact CB-O 3.45Å; S314-I342 PolarHBondContact OG-O 3.22Å; L317-I342 HydrophobicContact CD1-CB 4.13Å; L317-I342 HydrophobicContact CD1-CG2 3.97Å; A329-I342 HydrophobicContact CB-CD1 3.66Å; A329-I342 HydrophobicContact CB-CG1 4.26Å; A329-I342 WeakPolarHBondContact O-CG1 3.48Å; A329-I342 PolarHBondContact O-N 3.32Å; A329-I342 VanDerWaalsContact O-N 3.07Å; I342-E344 PolarHBondContact O-N 3.44Å; I342-E344 VanDerWaalsContact O-N 3.11Å; I342-L345 HydrophobicContact CG2-CD1 4.46Å; I342-L345 VanDerWaalsContact O-CB 3.3Å; I342-L345 WeakPolarHBondContact O-CB 3.33Å; I342-L345 WeakPolarHBondContact O-CG 3.49Å; I342-L345 PolarHBondContact O-N 3.09Å
343	G	88.9	Confident	91	Very high	7 Å²	7	79.6 Å²	79.6	7%	0.072	39%	0.391	C	S	.	.	G	3₁₀ helix	trans	-68.7	-7.4	-177.2	0	0	0	0	0	115.5	Y341	Y341-G343 PolarHBondContact O-N 2.93Å
344	E	88.2	Confident	90.9	Very high	141 Å²	141	79.6 Å²	79.6	66%	0.659	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-94.8	-4.8	173.7	-75.7	166.6	-162.1	0	0	112.7	Y341 I342	Y341-E344 HydrophobicContact CD1-CG 3.9Å; Y341-E344 PolarHBondContact O-N 2.96Å; I342-E344 PolarHBondContact O-N 3.44Å; I342-E344 VanDerWaalsContact O-N 3.11Å
345	L	90.4	Very high	90.9	Very high	7 Å²	7	78 Å²	78	4%	0.037	38%	0.384	C	S	.	.			trans	-77.6	135.7	-179.1	-61.5	175.5	0	0	0	110.7	C306 I310 S314 I342 F350	C306-L345 HydrophobicContact CB-CD1 3.92Å; I310-L345 HydrophobicContact CG2-CD1 3.83Å; S314-L345 PolarHBondContact OG-O 2.95Å; I342-L345 HydrophobicContact CG2-CD1 4.46Å; I342-L345 VanDerWaalsContact O-CB 3.3Å; I342-L345 WeakPolarHBondContact O-CB 3.33Å; I342-L345 WeakPolarHBondContact O-CG 3.49Å; I342-L345 PolarHBondContact O-N 3.09Å; L345-F350 HydrophobicContact CB-CE2 4.32Å; L345-F350 HydrophobicContact CD1-CE2 4.49Å; L345-F350 HydrophobicContact CD1-CZ 4.3Å
346	D	88.4	Confident	90.9	Very high	69 Å²	69	77 Å²	77	37%	0.369	38%	0.377	S	S	.	.			trans	-121.4	162.3	179.6	-170.2	14.6	0	0	0	110.6	N348 Y349	D346-N348 PolarHBondContact O-N 3.17Å; D346-N348 VanDerWaalsContact O-N 3.17Å; D346-N348 PolarHBondContact OD2-ND2 3.08Å; D346-Y349 HydrophobicContact CB-CD2 4.01Å; D346-Y349 HydrophobicContact CB-CE2 4.19Å; D346-Y349 WeakPolarHBondContact O-CB 3.43Å; D346-Y349 WeakPolarHBondContact O-CD2 3.24Å; D346-Y349 PolarHBondContact O-N 2.88Å; D346-Y349 VanDerWaalsContact O-N 3.08Å
347	Q	88.3	Confident	91	Very high	91 Å²	91	71.2 Å²	71.2	43%	0.425	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-58	-30.3	178.4	-168	175.2	13.6	0	0	111.9	L311 W315 Y349 F350	L311-Q347 HydrophobicContact CD1-CB 4.44Å; L311-Q347 HydrophobicContact CD1-CG 4.3Å; W315-Q347 HydrophobicContact CZ2-CB 4.49Å; Q347-Y349 PolarHBondContact O-N 3.49Å; Q347-F350 CarbonylContact O-C 3.56Å; Q347-F350 PolarHBondContact O-N 3.47Å
348	N	88.1	Confident	91	Very high	141 Å²	141	75.1 Å²	75.1	75%	0.754	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-58.7	-20.1	177.3	-67.2	-47.2	0	0	0	114.5	D346 F350	D346-N348 PolarHBondContact O-N 3.17Å; D346-N348 VanDerWaalsContact O-N 3.17Å; D346-N348 PolarHBondContact OD2-ND2 3.08Å; N348-F350 VanDerWaalsContact C-N 3.31Å
349	Y	85.8	Confident	91	Very high	94 Å²	94	71.1 Å²	71.1	37%	0.369	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-80.1	-11.9	176.6	-71.6	-92.4	0	0	0	113.4	Y337 R340 D346 Q347	Y337-Y349 AromaticContact CE1-CD1 3.71Å; Y337-Y349 HydrophobicContact CE1-CD1 3.71Å; Y337-Y349 HydrophobicContact CE1-CE1 4.42Å; Y337-Y349 PolarHBondContact OH-O 2.93Å; R340-Y349 VanDerWaalsContact NH1-CE1 3.25Å; R340-Y349 PolarHBondContact NH1-OH 3.26Å; D346-Y349 HydrophobicContact CB-CD2 4.01Å; D346-Y349 HydrophobicContact CB-CE2 4.19Å; D346-Y349 WeakPolarHBondContact O-CB 3.43Å; D346-Y349 WeakPolarHBondContact O-CD2 3.24Å; D346-Y349 PolarHBondContact O-N 2.88Å; D346-Y349 VanDerWaalsContact O-N 3.08Å; Q347-Y349 PolarHBondContact O-N 3.49Å
350	F	90.4	Very high	91.1	Very high	23 Å²	23	73.1 Å²	73.1	10%	0.101	37%	0.368	C	S	.	.			trans	-138.4	138.2	-170.3	-51.5	-77.3	0	0	0	112.3	C306 L311 Y337 L345 Q347 N348 C352	C306-F350 VanDerWaalsContact O-CE1 3.23Å; C306-F350 WeakPolarHBondContact O-CE1 3.25Å; L311-F350 HydrophobicContact CD1-CD2 4.12Å; L311-F350 HydrophobicContact CD2-CD2 3.72Å; L311-F350 HydrophobicContact CD2-CE2 3.87Å; L311-F350 HydrophobicContact CG-CD2 3.99Å; L311-F350 HydrophobicContact CG-CE2 4.34Å; Y337-F350 AromaticContact CD2-CE1 3.89Å; Y337-F350 HydrophobicContact CD2-CE1 3.89Å; Y337-F350 HydrophobicContact CD2-CZ 4.16Å; Y337-F350 HydrophobicContact CE2-CD1 4.2Å; Y337-F350 AromaticContact CE2-CE1 3.45Å; Y337-F350 HydrophobicContact CE2-CE1 3.45Å; Y337-F350 VanDerWaalsContact CE2-CE1 3.45Å; Y337-F350 AromaticContact CE2-CZ 3.97Å; Y337-F350 HydrophobicContact CE2-CZ 3.97Å; L345-F350 HydrophobicContact CB-CE2 4.32Å; L345-F350 HydrophobicContact CD1-CE2 4.49Å; L345-F350 HydrophobicContact CD1-CZ 4.3Å; Q347-F350 CarbonylContact O-C 3.56Å; Q347-F350 PolarHBondContact O-N 3.47Å; N348-F350 VanDerWaalsContact C-N 3.31Å; F350-C352 WeakPolarHBondContact CB-SG 3.21Å; F350-C352 PolarHBondContact O-N 2.93Å
351	H	90.3	Very high	91.4	Very high	170 Å²	170	68.7 Å²	68.7	79%	0.787	35%	0.352	S	S	*	.			trans	-93	98.2	168.6	-63.2	-53.2	0	0	0	109.2
352	C	92.4	Very high	91.6	Very high	25 Å²	25	70.5 Å²	70.5	17%	0.169	38%	0.375	C	S	.	.			trans	-107.5	148.1	-174.2	-52.1	0	0	0	0	112	C308 F350 A432	C308-C352 VanDerWaalsContact CA-SG 3.53Å; C308-C352 HydrophobicContact CB-CB 3.77Å; C308-C352 WeakPolarHBondContact CB-SG 2.98Å; C308-C352 WeakPolarHBondContact SG-CA 3.37Å; C308-C352 WeakPolarHBondContact SG-CB 3.48Å; C308-C352 CovalentContact SG-SG 2.04Å; C308-C352 PolarHBondContact SG-SG 3.45Å; F350-C352 WeakPolarHBondContact CB-SG 3.21Å; F350-C352 PolarHBondContact O-N 2.93Å; C352-A432 HydrophobicContact CB-CB 3.78Å
353	Y	92.1	Very high	91.8	Very high	184 Å²	184	76 Å²	76	72%	0.722	40%	0.404	S	S	*	.			trans	-125.8	154.1	-179.4	-58.2	-82.6	0	0	0	110.5	N430 A432	Y353-N430 PolarHBondContact O-ND2 3.4Å; Y353-A432 WeakPolarHBondContact O-CB 3.4Å
354	A	92.3	Very high	92.1	Very high	50 Å²	50	78.4 Å²	78.4	41%	0.413	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-54.2	150.8	173.6	0	0	0	0	0	111.3
355	P	94.4	Very high	92.4	Very high	8 Å²	8	77.6 Å²	77.6	5%	0.052	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-68.2	147.3	-173.7	28.7	-32.7	0	0	0	111	T382 V428 N430 G433 T435	P355-T382 HydrophobicContact CB-CG2 3.97Å; P355-V428 HydrophobicContact CB-CG1 3.84Å; P355-V428 HydrophobicContact CG-CB 4.33Å; P355-V428 HydrophobicContact CG-CG1 4.04Å; P355-V428 VanDerWaalsContact CG-O 3.27Å; P355-V428 WeakPolarHBondContact CG-O 3.48Å; P355-N430 HydrophobicContact CB-CB 4.27Å; P355-N430 WeakPolarHBondContact CD-OD1 3.48Å; P355-N430 HydrophobicContact CG-CB 4.44Å; P355-G433 WeakPolarHBondContact CD-O 3.47Å; P355-T435 VanDerWaalsContact O-CB 3.22Å; P355-T435 WeakPolarHBondContact O-CB 3.37Å; P355-T435 PolarHBondContact O-OG1 2.74Å
356	V	93	Very high	92.6	Very high	108 Å²	108	78 Å²	78	66%	0.655	42%	0.418	S	S	*	.	P	Polyproline II helix	trans	-103.2	128.5	178.2	-178.2	0	0	0	0	109.6	V358	V356-V358 PolarHBondContact O-N 2.99Å
357	I	94.1	Very high	92.8	Very high	25 Å²	25	77.9 Å²	77.9	13%	0.128	42%	0.42	C	S	.	.			trans	-83	111.7	170.4	-56.6	175.9	0	0	0	107.1	P360 V428 T435 A437	I357-P360 HydrophobicContact CG2-CB 4.09Å; I357-V428 HydrophobicContact CD1-CG2 4.1Å; I357-V428 HydrophobicContact CG1-CB 4.37Å; I357-V428 HydrophobicContact CG1-CG2 3.82Å; I357-T435 HydrophobicContact CD1-CG2 3.97Å; I357-T435 HydrophobicContact CG1-CG2 4.09Å; I357-A437 HydrophobicContact CD1-CB 3.63Å
358	V	93.1	Very high	93	Very high	114 Å²	114	77.9 Å²	77.9	69%	0.691	42%	0.42	S	S	*	.	S	Bend	trans	-73.6	-43.9	-175.7	-179.4	0	0	0	0	110.8	V356 R377	V356-V358 PolarHBondContact O-N 2.99Å; V358-R377 HydrophobicContact CB-CB 4.47Å; V358-R377 WeakPolarHBondContact CB-O 3.29Å; V358-R377 PolarHBondContact N-O 3.29Å
359	E	94.1	Very high	93.1	Very high	61 Å²	61	73.4 Å²	73.4	29%	0.285	41%	0.407	S	S	.	.	B	Isolated β-bridge	trans	-127.6	98.5	176.7	-166.6	176.1	-170.6	0	0	107.8	K375 C376 R377	E359-K375 HydrophobicContact CG-CB 4.34Å; E359-K375 HydrophobicContact CG-CD 4.2Å; E359-K375 WeakPolarHBondContact OE1-CD 3.33Å; E359-K375 WeakPolarHBondContact OE1-CE 3.3Å; E359-K375 IonicContact OE1-NZ 3.29Å; E359-K375 PolarHBondContact OE1-NZ 3.31Å; E359-K375 IonicContact OE2-NZ 3.42Å; E359-C376 WeakPolarHBondContact O-CA 3.4Å; E359-R377 HydrophobicContact CB-CB 3.89Å; E359-R377 HydrophobicContact CB-CG 4.09Å; E359-R377 PolarHBondContact N-O 3.12Å; E359-R377 PolarHBondContact O-N 2.95Å; E359-R377 VanDerWaalsContact O-N 3.07Å; E359-R377 WeakPolarHBondContact OE2-CD 3.43Å; E359-R377 IonicContact OE2-NE 3.98Å; E359-R377 PolarHBondContact OE2-NE 3.44Å
360	P	94.9	Very high	93.3	Very high	76 Å²	76	70.7 Å²	70.7	49%	0.494	40%	0.402	S	S	.	.			trans	-73.3	154.6	178.9	30.5	-34.2	0	0	0	111.1	I357 K375 A437	I357-P360 HydrophobicContact CG2-CB 4.09Å; P360-K375 CarbonylContact C-O 3.41Å; P360-A437 HydrophobicContact CB-CB 4.17Å
361	P	96.6	Very high	93.4	Very high	13 Å²	13	73 Å²	73	8%	0.084	43%	0.425	C	S	.	.			trans	-68	145.3	177.5	29.5	-35.4	0	0	0	110.6	L374 K375 W386 A437 A439	P361-L374 HydrophobicContact CB-CB 4.38Å; P361-K375 WeakPolarHBondContact CA-O 3.33Å; P361-K375 WeakPolarHBondContact CB-O 3.35Å; P361-K375 WeakPolarHBondContact CD-O 3.33Å; P361-W386 HydrophobicContact CB-CH2 3.81Å; P361-W386 HydrophobicContact CG-CH2 3.97Å; P361-A437 HydrophobicContact CG-CB 4.23Å; P361-A439 HydrophobicContact CB-CB 3.65Å; P361-A439 HydrophobicContact CG-CB 4.03Å
362	A	96.4	Very high	93.6	Very high	74 Å²	74	65.1 Å²	65.1	61%	0.612	39%	0.389	S	S	*	.			trans	-114.7	151.4	176	0	0	0	0	0	110.1	L364	A362-L364 PolarHBondContact O-N 2.9Å
363	D	96.6	Very high	93.7	Very high	114 Å²	114	69 Å²	69	61%	0.61	41%	0.405	S	S	*	.			trans	-59.1	136	176.3	-64.4	-24.5	0	0	0	110.5	A439 T440	D363-A439 WeakPolarHBondContact OD1-CA 3.43Å; D363-T440 WeakPolarHBondContact CA-O 3.21Å; D363-T440 PolarHBondContact OD1-N 3.49Å
364	L	95	Very high	93.9	Very high	58 Å²	58	60.2 Å²	60.2	30%	0.304	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	128.5	-171.6	-171	70	0	0	0	110.9	A362 V366 A372 L374 T440 L441 N442	A362-L364 PolarHBondContact O-N 2.9Å; L364-V366 HydrophobicContact CB-CG2 4.42Å; L364-V366 HydrophobicContact CD1-CG2 4.47Å; L364-V366 HydrophobicContact CD2-CG2 3.51Å; L364-V366 HydrophobicContact CG-CG2 3.48Å; L364-V366 VanDerWaalsContact CG-CG2 3.48Å; L364-A372 HydrophobicContact CD2-CB 3.88Å; L364-L374 HydrophobicContact CB-CD2 4.13Å; L364-T440 PolarHBondContact N-O 2.9Å; L364-L441 HydrophobicContact CB-CD1 4.14Å; L364-L441 HydrophobicContact CD2-CD1 4.1Å; L364-L441 HydrophobicContact CG-CD1 4.38Å; L364-L441 WeakPolarHBondContact O-CA 3.02Å; L364-N442 PolarHBondContact O-N 3.14Å
365	N	94.5	Very high	94	Very high	124 Å²	124	61.9 Å²	61.9	66%	0.663	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.4	123.7	174.5	-62	-20.7	0	0	0	109.1	N442	N365-N442 CarbonylContact C-O 3.54Å; N365-N442 WeakPolarHBondContact CA-O 3.28Å; N365-N442 WeakPolarHBondContact OD1-CB 3.49Å; N365-N442 PolarHBondContact OD1-ND2 3.42Å; N365-N442 VanDerWaalsContact OD1-ND2 3.13Å
366	V	94	Very high	94	Very high	15 Å²	15	61.5 Å²	61.5	9%	0.091	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	146.1	-169.9	-161.2	0	0	0	0	110.2	L364 S370 A372 L441 N442 V443 S444	L364-V366 HydrophobicContact CB-CG2 4.42Å; L364-V366 HydrophobicContact CD1-CG2 4.47Å; L364-V366 HydrophobicContact CD2-CG2 3.51Å; L364-V366 HydrophobicContact CG-CG2 3.48Å; L364-V366 VanDerWaalsContact CG-CG2 3.48Å; V366-S370 WeakPolarHBondContact CG1-OG 3.4Å; V366-A372 HydrophobicContact CG1-CB 4.26Å; V366-A372 HydrophobicContact CG2-CB 3.96Å; V366-L441 HydrophobicContact CG2-CD1 3.72Å; V366-N442 PolarHBondContact N-O 3.02Å; V366-V443 CarbonylContact O-C 3.24Å; V366-V443 VanDerWaalsContact O-CA 3.25Å; V366-V443 WeakPolarHBondContact O-CA 3.35Å; V366-S444 PolarHBondContact O-N 3.21Å; V366-S444 PolarHBondContact O-OG 3.06Å
367	T	93.2	Very high	94	Very high	68 Å²	68	61.2 Å²	61.2	42%	0.417	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	145.1	172.5	51.9	0	0	0	0	111.2	G369 S370 S444	T367-G369 PolarHBondContact O-N 3.05Å; T367-S370 PolarHBondContact O-N 3.36Å; T367-S370 PolarHBondContact O-OG 3.16Å; T367-S444 VanDerWaalsContact CA-O 3.28Å; T367-S444 WeakPolarHBondContact CA-O 3.38Å
368	E	92.7	Very high	93.8	Very high	90 Å²	90	60.7 Å²	60.7	42%	0.421	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	140.3	172.6	-177.2	170.3	-141.1	0	0	111.2	S370 V443 S444	E368-S370 VanDerWaalsContact C-N 3.35Å; E368-V443 HydrophobicContact CB-CG1 4.16Å; E368-S444 PolarHBondContact N-O 2.95Å
369	G	88.7	Confident	93.6	Very high	47 Å²	47	58.2 Å²	58.2	49%	0.485	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.9	-19	-179.5	0	0	0	0	0	115.1	T367 N415 V416	T367-G369 PolarHBondContact O-N 3.05Å; G369-N415 WeakPolarHBondContact CA-OD1 3.33Å; G369-V416 PolarHBondContact N-O 3.13Å
370	S	90.8	Very high	93.1	Very high	38 Å²	38	58.9 Å²	58.9	27%	0.266	35%	0.352	S	S	.	.	S	Bend	trans	-91.7	161.7	-176.2	64.8	0	0	0	0	113	V366 T367 E368 V416	V366-S370 WeakPolarHBondContact CG1-OG 3.4Å; T367-S370 PolarHBondContact O-N 3.36Å; T367-S370 PolarHBondContact O-OG 3.16Å; E368-S370 VanDerWaalsContact C-N 3.35Å; S370-V416 WeakPolarHBondContact O-CB 3.38Å; S370-V416 VanDerWaalsContact O-CG2 3.31Å; S370-V416 WeakPolarHBondContact O-CG2 3.39Å; S370-V416 PolarHBondContact O-N 2.79Å
371	A	93	Very high	92.7	Very high	70 Å²	70	56.9 Å²	56.9	58%	0.579	34%	0.337	S	S	*	.			trans	-82.4	144.5	176.1	0	0	0	0	0	110.6	F413	A371-F413 VanDerWaalsContact CA-O 3.28Å; A371-F413 WeakPolarHBondContact CA-O 3.27Å; A371-F413 WeakPolarHBondContact CB-O 3.17Å
372	A	93.6	Very high	92.5	Very high	5 Å²	5	56.6 Å²	56.6	4%	0.041	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	148.7	-178.8	0	0	0	0	0	111.5	L364 V366 F413 V416 L441	L364-A372 HydrophobicContact CD2-CB 3.88Å; V366-A372 HydrophobicContact CG1-CB 4.26Å; V366-A372 HydrophobicContact CG2-CB 3.96Å; A372-F413 HydrophobicContact CB-CB 4.24Å; A372-F413 HydrophobicContact CB-CD2 4.33Å; A372-F413 PolarHBondContact N-O 3.35Å; A372-F413 VanDerWaalsContact N-O 3.13Å; A372-F413 WeakPolarHBondContact O-CD2 3.44Å; A372-F413 PolarHBondContact O-N 3.02Å; A372-V416 HydrophobicContact CB-CG2 3.55Å; A372-L441 HydrophobicContact CB-CD1 4.35Å
373	E	94.8	Very high	92.2	Very high	106 Å²	106	54.1 Å²	54.1	50%	0.495	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	124.1	-179.7	-66.8	-178	170.8	0	0	110.5	T410 L411	E373-T410 HydrophobicContact CB-CG2 4.01Å; E373-T410 HydrophobicContact CG-CG2 4.49Å; E373-L411 WeakPolarHBondContact CA-O 3.15Å
374	L	95.6	Very high	92.1	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.005	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	106.8	169.5	-62.9	176.6	0	0	0	108.7	P361 L364 W386 T410 L411 F413 Y424 A439	P361-L374 HydrophobicContact CB-CB 4.38Å; L364-L374 HydrophobicContact CB-CD2 4.13Å; L374-W386 HydrophobicContact CB-CH2 3.61Å; L374-W386 HydrophobicContact CB-CZ2 4.12Å; L374-W386 HydrophobicContact CB-CZ3 4.32Å; L374-W386 HydrophobicContact CD1-CH2 4.35Å; L374-W386 HydrophobicContact CD1-CZ3 4.25Å; L374-W386 VanDerWaalsContact O-CZ2 3.31Å; L374-W386 WeakPolarHBondContact O-CZ2 3.48Å; L374-T410 WeakPolarHBondContact O-CA 3.01Å; L374-T410 WeakPolarHBondContact O-CG2 3.39Å; L374-L411 HydrophobicContact CB-CB 4.32Å; L374-L411 HydrophobicContact CD1-CD2 4.47Å; L374-L411 PolarHBondContact N-O 3.09Å; L374-L411 PolarHBondContact O-N 2.04Å; L374-F413 HydrophobicContact CD1-CE2 4.39Å; L374-Y424 HydrophobicContact CD1-CD2 3.95Å; L374-Y424 HydrophobicContact CD1-CG 3.91Å; L374-A439 HydrophobicContact CD2-CB 4.43Å
375	K	95.3	Very high	91.9	Very high	84 Å²	84	46.8 Å²	46.8	37%	0.365	28%	0.276	S	S	.	.			trans	-71.7	136	-175.6	-61.4	-174.5	-179.6	174.6	0	111.4	E359 P360 P361 T410	E359-K375 HydrophobicContact CG-CB 4.34Å; E359-K375 HydrophobicContact CG-CD 4.2Å; E359-K375 WeakPolarHBondContact OE1-CD 3.33Å; E359-K375 WeakPolarHBondContact OE1-CE 3.3Å; E359-K375 IonicContact OE1-NZ 3.29Å; E359-K375 PolarHBondContact OE1-NZ 3.31Å; E359-K375 IonicContact OE2-NZ 3.42Å; P360-K375 CarbonylContact C-O 3.41Å; P361-K375 WeakPolarHBondContact CA-O 3.33Å; P361-K375 WeakPolarHBondContact CB-O 3.35Å; P361-K375 WeakPolarHBondContact CD-O 3.33Å; K375-T410 HydrophobicContact CG-CG2 4.4Å
376	C	94.6	Very high	91.9	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	24%	0.244	C	C	.	.			trans	-146.3	72.6	170.2	-173.4	0	0	0	0	109.8	E359 A378 W386 G409 C426	E359-C376 WeakPolarHBondContact O-CA 3.4Å; C376-A378 PolarHBondContact O-N 3.34Å; C376-W386 HydrophobicContact CB-CH2 4.34Å; C376-W386 HydrophobicContact CB-CZ2 3.52Å; C376-G409 WeakPolarHBondContact O-CA 3.36Å; C376-C426 HydrophobicContact CB-CB 3.68Å; C376-C426 WeakPolarHBondContact CB-SG 3.43Å; C376-C426 WeakPolarHBondContact SG-CB 3.42Å; C376-C426 CovalentContact SG-SG 2.02Å; C376-C426 PolarHBondContact SG-SG 3.34Å
377	R	92.6	Very high	91.9	Very high	102 Å²	102	42.7 Å²	42.7	39%	0.385	25%	0.253	S	S	.	.	B	Isolated β-bridge	trans	-77.7	122.4	-176.1	-65.9	-173.1	-172.7	-83.6	-20	110.9	V358 E359 D408	V358-R377 HydrophobicContact CB-CB 4.47Å; V358-R377 WeakPolarHBondContact CB-O 3.29Å; V358-R377 PolarHBondContact N-O 3.29Å; E359-R377 HydrophobicContact CB-CB 3.89Å; E359-R377 HydrophobicContact CB-CG 4.09Å; E359-R377 PolarHBondContact N-O 3.12Å; E359-R377 PolarHBondContact O-N 2.95Å; E359-R377 VanDerWaalsContact O-N 3.07Å; E359-R377 WeakPolarHBondContact OE2-CD 3.43Å; E359-R377 IonicContact OE2-NE 3.98Å; E359-R377 PolarHBondContact OE2-NE 3.44Å; R377-D408 WeakPolarHBondContact CA-O 3.03Å; R377-D408 HydrophobicContact CG-CB 4.49Å; R377-D408 IonicContact CZ-OD2 2.74Å; R377-D408 IonicContact NH1-OD2 2.67Å; R377-D408 PolarHBondContact NH1-OD2 3.34Å; R377-D408 IonicContact NH2-OD2 3.96Å; R377-D408 PolarHBondContact NH2-OD2 3.06Å
378	A	90.2	Very high	91.8	Very high	15 Å²	15	40.1 Å²	40.1	12%	0.124	24%	0.237	C	C	.	.			trans	-135.5	167.4	172.7	0	0	0	0	0	111	R261 C376 S380 V384 V428	R261-A378 PolarHBondContact NH2-O 3.17Å; C376-A378 PolarHBondContact O-N 3.34Å; A378-S380 PolarHBondContact O-N 3.18Å; A378-V384 HydrophobicContact CB-CG2 4.21Å; A378-V428 HydrophobicContact CB-CG1 3.64Å; A378-V428 HydrophobicContact CB-CG2 4.07Å
379	S	87.5	Confident	91.8	Very high	62 Å²	62	38.4 Å²	38.4	43%	0.434	23%	0.233	S	C	.	.			trans	-51.6	135.9	175.3	170.4	0	0	0	0	111.4	R261 L381 T382	R261-S379 PolarHBondContact NH1-O 3.04Å; R261-S379 VanDerWaalsContact NH1-O 3.14Å; R261-S379 VanDerWaalsContact NH2-C 3.35Å; R261-S379 PolarHBondContact NH2-O 3.29Å; S379-L381 PolarHBondContact O-N 2.94Å; S379-T382 PolarHBondContact O-N 3.21Å; S379-T382 PolarHBondContact O-OG1 3.17Å
380	S	83.8	Confident	91.8	Very high	75 Å²	75	43.4 Å²	43.4	52%	0.524	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-18.8	-176.9	52.6	0	0	0	0	114.6	R261 A378	R261-S380 WeakPolarHBondContact CG-O 3.25Å; R261-S380 PolarHBondContact NE-O 3.36Å; R261-S380 VanDerWaalsContact NH2-CA 3.34Å; A378-S380 PolarHBondContact O-N 3.18Å
381	L	87.3	Confident	91.6	Very high	34 Å²	34	44 Å²	44	18%	0.178	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-15.2	179.5	-62	172.9	0	0	0	113.8	L282 H285 D309 S379	L282-L381 HydrophobicContact CB-CD1 4.04Å; L282-L381 HydrophobicContact CB-CD2 3.79Å; L282-L381 HydrophobicContact CD1-CD1 3.39Å; L282-L381 HydrophobicContact CG-CD1 4.24Å; H285-L381 WeakPolarHBondContact CB-O 3.48Å; H285-L381 PolarHBondContact N-O 2.9Å; D309-L381 HydrophobicContact CB-CD1 4.17Å; S379-L381 PolarHBondContact O-N 2.94Å
382	T	92	Very high	91.4	Very high	6 Å²	6	43 Å²	43	4%	0.037	25%	0.25	C	S	.	.	S	Bend	trans	-73.9	160.5	175.6	57.3	0	0	0	0	110.2	R261 P355 S379 V428 S429 N430	R261-T382 VanDerWaalsContact CD-O 3.26Å; R261-T382 WeakPolarHBondContact CD-O 3.25Å; R261-T382 VanDerWaalsContact NH1-C 3.32Å; R261-T382 PolarHBondContact NH1-O 3.47Å; R261-T382 PolarHBondContact NH1-OG1 3.12Å; P355-T382 HydrophobicContact CB-CG2 3.97Å; S379-T382 PolarHBondContact O-N 3.21Å; S379-T382 PolarHBondContact O-OG1 3.17Å; T382-V428 HydrophobicContact CG2-CG1 4.21Å; T382-V428 WeakPolarHBondContact OG1-CG1 3.5Å; T382-S429 WeakPolarHBondContact CA-O 3.31Å; T382-S429 WeakPolarHBondContact CB-O 3.32Å; T382-N430 HydrophobicContact CG2-CB 4.16Å
383	S	91.4	Very high	91.1	Very high	22 Å²	22	48 Å²	48	15%	0.154	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	136.1	165.6	35.3	0	0	0	0	109.1	H285 V428 S429	H285-S383 PolarHBondContact ND1-OG 3.22Å; S383-V428 CarbonylContact O-C 3.54Å; S383-V428 VanDerWaalsContact O-CA 3.32Å; S383-V428 WeakPolarHBondContact O-CA 3.33Å; S383-S429 PolarHBondContact N-O 3.14Å; S383-S429 PolarHBondContact O-N 2.67Å; S383-S429 PolarHBondContact OG-O 3.25Å; S383-S429 PolarHBondContact OG-OG 3.39Å
384	V	92.6	Very high	90.7	Very high	5 Å²	5	43 Å²	43	3%	0.03	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	129.3	175.6	171	0	0	0	0	108.1	A378 V428	A378-V384 HydrophobicContact CB-CG2 4.21Å; V384-V428 HydrophobicContact CG2-CG1 4.32Å; V384-V428 HydrophobicContact CG2-CG2 4.04Å
385	S	92.1	Very high	90.2	Very high	14 Å²	14	44.7 Å²	44.7	10%	0.098	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	143.9	176	60.4	0	0	0	0	110	M394 M427	S385-M394 CarbonylContact C-O 3.54Å; S385-M394 WeakPolarHBondContact CA-O 3.33Å; S385-M427 PolarHBondContact N-O 3.46Å; S385-M427 PolarHBondContact O-N 3.43Å; S385-M427 WeakPolarHBondContact OG-CE 3.37Å; S385-M427 PolarHBondContact OG-O 3.21Å
386	W	93.9	Very high	89.3	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	128.7	179.5	-82.2	91.7	0	0	0	110.4	P361 L374 C376 I393 M394 V405 G409 L411 C426	P361-W386 HydrophobicContact CB-CH2 3.81Å; P361-W386 HydrophobicContact CG-CH2 3.97Å; L374-W386 HydrophobicContact CB-CH2 3.61Å; L374-W386 HydrophobicContact CB-CZ2 4.12Å; L374-W386 HydrophobicContact CB-CZ3 4.32Å; L374-W386 HydrophobicContact CD1-CH2 4.35Å; L374-W386 HydrophobicContact CD1-CZ3 4.25Å; L374-W386 VanDerWaalsContact O-CZ2 3.31Å; L374-W386 WeakPolarHBondContact O-CZ2 3.48Å; C376-W386 HydrophobicContact CB-CH2 4.34Å; C376-W386 HydrophobicContact CB-CZ2 3.52Å; W386-I393 CarbonylContact O-C 3.42Å; W386-I393 WeakPolarHBondContact O-CA 3.4Å; W386-M394 HydrophobicContact CB-CB 4.24Å; W386-M394 PolarHBondContact N-O 3.15Å; W386-M394 PolarHBondContact O-N 3.25Å; W386-V405 HydrophobicContact CG-CG2 4.45Å; W386-G409 PolarHBondContact NE1-O 2.69Å; W386-L411 HydrophobicContact CB-CD1 4.27Å; W386-L411 HydrophobicContact CB-CD2 4.49Å; W386-L411 HydrophobicContact CD2-CB 3.88Å; W386-L411 HydrophobicContact CD2-CD2 3.98Å; W386-L411 HydrophobicContact CD2-CG 4.37Å; W386-L411 HydrophobicContact CE3-CB 4.47Å; W386-L411 HydrophobicContact CE3-CD2 4Å; W386-L411 HydrophobicContact CG-CB 4.18Å; W386-L411 HydrophobicContact CG-CD1 4.06Å; W386-L411 HydrophobicContact CG-CD2 4.23Å; W386-L411 HydrophobicContact CG-CG 4.41Å; W386-L411 HydrophobicContact CH2-CB 4.4Å; W386-L411 HydrophobicContact CZ2-CB 3.83Å; W386-L411 HydrophobicContact CZ3-CD2 4.49Å; W386-C426 HydrophobicContact CD2-CB 4.05Å; W386-C426 HydrophobicContact CE3-CB 4.06Å; W386-C426 HydrophobicContact CH2-CB 3.83Å; W386-C426 HydrophobicContact CZ2-CB 3.78Å; W386-C426 HydrophobicContact CZ3-CB 3.95Å
387	I	94.2	Very high	87.9	Confident	53 Å²	53	43.5 Å²	43.5	27%	0.272	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	114.7	173.8	-53.5	168.3	0	0	0	107	T425	I387-T425 PolarHBondContact N-O 3Å; I387-T425 PolarHBondContact O-N 3.43Å
388	T	92	Very high	86.8	Confident	13 Å²	13	40.2 Å²	40.2	8%	0.08	26%	0.257	C	S	.	.			trans	-72.2	162	176.8	59.4	0	0	0	0	111.5	N390 G391 S392 M394 Y424	T388-N390 PolarHBondContact O-N 3.11Å; T388-G391 PolarHBondContact O-N 3.02Å; T388-S392 PolarHBondContact N-O 2.66Å; T388-S392 WeakPolarHBondContact OG1-CA 3.47Å; T388-S392 WeakPolarHBondContact OG1-CB 3.42Å; T388-S392 PolarHBondContact OG1-N 3.1Å; T388-S392 PolarHBondContact OG1-O 3.42Å; T388-S392 PolarHBondContact OG1-OG 3.11Å; T388-M394 HydrophobicContact CG2-CG 3.98Å; T388-M394 HydrophobicContact CG2-SD 3.68Å; T388-Y424 HydrophobicContact CG2-CE1 4.17Å
389	P	91.3	Very high	85.5	Confident	54 Å²	54	47.8 Å²	47.8	35%	0.351	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-28.2	175.3	-24.9	32.3	0	0	0	113.8	G391 Y424	P389-G391 PolarHBondContact O-N 3.16Å; P389-Y424 HydrophobicContact CG-CD2 4.19Å; P389-Y424 HydrophobicContact CG-CE1 4.38Å; P389-Y424 HydrophobicContact CG-CE2 3.81Å
390	N	88.8	Confident	84.7	Confident	152 Å²	152	49.9 Å²	49.9	81%	0.813	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	1.1	177.6	-62.7	-19.7	0	0	0	113.5	T388 S392	T388-N390 PolarHBondContact O-N 3.11Å; N390-S392 VanDerWaalsContact C-N 3.3Å; N390-S392 PolarHBondContact O-N 2.9Å
391	G	87.5	Confident	84.1	Confident	52 Å²	52	52.6 Å²	52.6	54%	0.536	30%	0.299	S	S	.	.	S	Bend	trans	79.7	1.5	-176.3	0	0	0	0	0	115.1	T388 P389	T388-G391 PolarHBondContact O-N 3.02Å; P389-G391 PolarHBondContact O-N 3.16Å
392	S	88.4	Confident	84.1	Confident	47 Å²	47	54.5 Å²	54.5	33%	0.329	30%	0.303	S	S	.	.			trans	-75.1	141.5	175	77.8	0	0	0	0	111.6	T388 N390	T388-S392 PolarHBondContact N-O 2.66Å; T388-S392 WeakPolarHBondContact OG1-CA 3.47Å; T388-S392 WeakPolarHBondContact OG1-CB 3.42Å; T388-S392 PolarHBondContact OG1-N 3.1Å; T388-S392 PolarHBondContact OG1-O 3.42Å; T388-S392 PolarHBondContact OG1-OG 3.11Å; N390-S392 VanDerWaalsContact C-N 3.3Å; N390-S392 PolarHBondContact O-N 2.9Å
393	I	88.1	Confident	83.9	Confident	110 Å²	110	54.9 Å²	54.9	56%	0.564	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.4	134.4	179.3	-57.4	172.8	0	0	0	109.5	W386	W386-I393 CarbonylContact O-C 3.42Å; W386-I393 WeakPolarHBondContact O-CA 3.4Å
394	M	86.6	Confident	83.8	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.005	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	128.2	176.6	-63.7	-171.3	57	0	0	110.1	S385 W386 T388 K400 I403 V405 L411	S385-M394 CarbonylContact C-O 3.54Å; S385-M394 WeakPolarHBondContact CA-O 3.33Å; W386-M394 HydrophobicContact CB-CB 4.24Å; W386-M394 PolarHBondContact N-O 3.15Å; W386-M394 PolarHBondContact O-N 3.25Å; T388-M394 HydrophobicContact CG2-CG 3.98Å; T388-M394 HydrophobicContact CG2-SD 3.68Å; M394-K400 HydrophobicContact CE-CD 4.15Å; M394-K400 HydrophobicContact SD-CD 4.47Å; M394-I403 HydrophobicContact CE-CB 3.8Å; M394-I403 HydrophobicContact CE-CG2 3.49Å; M394-I403 VanDerWaalsContact CE-CG2 3.49Å; M394-I403 WeakPolarHBondContact CE-O 3.01Å; M394-I403 HydrophobicContact SD-CB 4.48Å; M394-I403 HydrophobicContact SD-CG2 3.95Å; M394-V405 HydrophobicContact CB-CG2 4.33Å; M394-L411 HydrophobicContact CE-CD1 4.34Å
395	T	85	Confident	83.6	Confident	38 Å²	38	55.8 Å²	55.8	23%	0.233	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	171.5	175.5	63.2	0	0	0	0	109.9	G397 A398	T395-G397 PolarHBondContact O-N 3.19Å; T395-A398 WeakPolarHBondContact O-CB 3.39Å; T395-A398 PolarHBondContact O-N 2.98Å
396	H	75.6	Confident	83.4	Confident	40 Å²	40	57.9 Å²	57.9	19%	0.185	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-28.9	174.9	-169.8	-73.1	0	0	0	113.3	P237 N262 V405 L406 N407	P237-H396 VanDerWaalsContact CB-CE1 3.44Å; P237-H396 WeakPolarHBondContact CB-CE1 3.25Å; P237-H396 WeakPolarHBondContact CB-ND1 3.32Å; P237-H396 WeakPolarHBondContact CG-CE1 3.24Å; P237-H396 WeakPolarHBondContact CG-ND1 3.46Å; N262-H396 HydrophobicContact CB-CB 4.09Å; N262-H396 WeakPolarHBondContact OD1-CB 3.37Å; H396-V405 PolarHBondContact CD2-O 2.69Å; H396-V405 PolarHBondContact NE2-O 3.1Å; H396-L406 PolarHBondContact CD2-O 3.14Å; H396-L406 VanDerWaalsContact CD2-O 3.32Å; H396-N407 VanDerWaalsContact CD2-CA 3.47Å; H396-N407 WeakPolarHBondContact CD2-CA 3.18Å; H396-N407 PolarHBondContact CD2-N 3.03Å; H396-N407 VanDerWaalsContact CD2-N 3.28Å; H396-N407 VanDerWaalsContact NE2-CA 3.35Å; H396-N407 WeakPolarHBondContact NE2-CA 3.22Å; H396-N407 PolarHBondContact NE2-N 3.29Å
397	G	66.1	Low	82.9	Confident	19 Å²	19	60.7 Å²	60.7	20%	0.196	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-17.4	175.8	0	0	0	0	0	114.2	T395 Y399	T395-G397 PolarHBondContact O-N 3.19Å; G397-Y399 PolarHBondContact O-N 3.31Å
398	A	69.4	Low	82.5	Confident	32 Å²	32	60.2 Å²	60.2	26%	0.264	33%	0.334	S	S	.	.			trans	-75.8	93.1	-175.4	0	0	0	0	0	111.3	T395 K400	T395-A398 WeakPolarHBondContact O-CB 3.39Å; T395-A398 PolarHBondContact O-N 2.98Å; A398-K400 PolarHBondContact O-N 3.01Å
399	Y	62.1	Low	82.3	Confident	174 Å²	174	59.6 Å²	59.6	68%	0.682	33%	0.331	S	S	*	.			trans	-77.3	89.2	179.9	-159.2	-88	0	0	0	111.6	K241 G397	K241-Y399 VanDerWaalsContact NZ-CD1 3.28Å; G397-Y399 PolarHBondContact O-N 3.31Å
400	K	70.8	Confident	82.4	Confident	107 Å²	107	57.1 Å²	57.1	47%	0.465	32%	0.315	S	S	.	.			trans	-96.1	135.7	160.5	-68.4	-176.5	-179	175.9	0	108.7	M394 A398 R402 I403	M394-K400 HydrophobicContact CE-CD 4.15Å; M394-K400 HydrophobicContact SD-CD 4.47Å; A398-K400 PolarHBondContact O-N 3.01Å; K400-R402 PolarHBondContact O-N 3.04Å; K400-I403 WeakPolarHBondContact CB-O 3.34Å
401	V	71.6	Confident	82.6	Confident	132 Å²	132	49.9 Å²	49.9	80%	0.8	28%	0.276	S	S	*	.	S	Bend	trans	-58	-27.5	-173.1	-176.9	0	0	0	0	113
402	R	87.2	Confident	82.9	Confident	73 Å²	73	49 Å²	49	28%	0.275	26%	0.259	S	S	.	.	S	Bend	trans	-109.7	-29.6	-172.4	-167.2	172.8	63.8	71	-2.8	115.2	K400 T414 N415 D420	K400-R402 PolarHBondContact O-N 3.04Å; R402-T414 PolarHBondContact O-N 3.22Å; R402-T414 PolarHBondContact O-OG1 3.08Å; R402-N415 WeakPolarHBondContact CD-O 3.28Å; R402-N415 HydrophobicContact CG-CB 4.49Å; R402-N415 WeakPolarHBondContact CG-O 3.16Å; R402-N415 PolarHBondContact NH1-O 3.39Å; R402-D420 IonicContact CZ-OD1 3.24Å; R402-D420 IonicContact CZ-OD2 2.73Å; R402-D420 VanDerWaalsContact CZ-OD2 3.24Å; R402-D420 VanDerWaalsContact NH1-CG 3.28Å; R402-D420 IonicContact NH1-OD1 2.63Å; R402-D420 PolarHBondContact NH1-OD1 3.38Å; R402-D420 IonicContact NH1-OD2 3.74Å; R402-D420 PolarHBondContact NH1-OD2 3.1Å; R402-D420 VanDerWaalsContact NH2-CG 3.35Å; R402-D420 IonicContact NH2-OD1 3.23Å; R402-D420 PolarHBondContact NH2-OD1 3.42Å; R402-D420 IonicContact NH2-OD2 3.85Å; R402-D420 PolarHBondContact NH2-OD2 3.38Å
403	I	87.7	Confident	83.1	Confident	14 Å²	14	46.7 Å²	46.7	7%	0.072	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	124.3	-175.4	-51.1	174.9	0	0	0	107.5	M394 K400 L411 N412 F413	M394-I403 HydrophobicContact CE-CB 3.8Å; M394-I403 HydrophobicContact CE-CG2 3.49Å; M394-I403 VanDerWaalsContact CE-CG2 3.49Å; M394-I403 WeakPolarHBondContact CE-O 3.01Å; M394-I403 HydrophobicContact SD-CB 4.48Å; M394-I403 HydrophobicContact SD-CG2 3.95Å; K400-I403 WeakPolarHBondContact CB-O 3.34Å; I403-L411 HydrophobicContact CG2-CD1 3.65Å; I403-L411 HydrophobicContact CG2-CD2 4.45Å; I403-L411 HydrophobicContact CG2-CG 4.03Å; I403-N412 WeakPolarHBondContact CA-O 2.95Å; I403-F413 HydrophobicContact CB-CD1 4.45Å; I403-F413 HydrophobicContact CD1-CD1 3.93Å; I403-F413 HydrophobicContact CD1-CE1 3.58Å; I403-F413 HydrophobicContact CG1-CD1 3.63Å; I403-F413 HydrophobicContact CG1-CE1 3.77Å; I403-F413 HydrophobicContact CG2-CD1 4.19Å; I403-F413 HydrophobicContact CG2-CE1 3.94Å; I403-F413 HydrophobicContact CG2-CZ 4.15Å
404	S	88.4	Confident	83.2	Confident	38 Å²	38	45.4 Å²	45.4	27%	0.266	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	150.5	-176.2	59.8	0	0	0	0	110.9	N412	S404-N412 PolarHBondContact N-O 3.09Å; S404-N412 PolarHBondContact O-N 3.49Å
405	V	88.9	Confident	83.4	Confident	9 Å²	9	48.9 Å²	48.9	6%	0.055	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	124.7	172.8	-179.3	0	0	0	0	107.6	W386 M394 H396 T410 L411	W386-V405 HydrophobicContact CG-CG2 4.45Å; M394-V405 HydrophobicContact CB-CG2 4.33Å; H396-V405 PolarHBondContact CD2-O 2.69Å; H396-V405 PolarHBondContact NE2-O 3.1Å; V405-T410 CarbonylContact C-O 3.58Å; V405-T410 WeakPolarHBondContact CA-O 3.34Å; V405-L411 HydrophobicContact CG2-CD1 3.69Å
406	L	87.3	Confident	83.8	Confident	58 Å²	58	47.1 Å²	47.1	30%	0.304	25%	0.248	S	C	.	.			trans	-81.1	161.6	178.7	-57	-177.8	0	0	0	111.4	H396 D408 G409 T410 N412	H396-L406 PolarHBondContact CD2-O 3.14Å; H396-L406 VanDerWaalsContact CD2-O 3.32Å; L406-D408 PolarHBondContact O-N 2.91Å; L406-D408 VanDerWaalsContact O-N 3.14Å; L406-G409 WeakPolarHBondContact O-CA 3.21Å; L406-G409 PolarHBondContact O-N 3.12Å; L406-T410 HydrophobicContact CD1-CG2 4.32Å; L406-T410 PolarHBondContact N-O 3.23Å; L406-N412 HydrophobicContact CD1-CB 4.13Å; L406-N412 HydrophobicContact CD2-CB 4.15Å; L406-N412 HydrophobicContact CG-CB 3.97Å
407	N	83.3	Confident	84.5	Confident	58 Å²	58	46.9 Å²	46.9	31%	0.31	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-29.7	-175.1	-177.7	16.9	0	0	0	113.2	E260 H396 G409	E260-N407 PolarHBondContact OE1-ND2 3.48Å; E260-N407 VanDerWaalsContact OE1-ND2 3.14Å; H396-N407 VanDerWaalsContact CD2-CA 3.47Å; H396-N407 WeakPolarHBondContact CD2-CA 3.18Å; H396-N407 PolarHBondContact CD2-N 3.03Å; H396-N407 VanDerWaalsContact CD2-N 3.28Å; H396-N407 VanDerWaalsContact NE2-CA 3.35Å; H396-N407 WeakPolarHBondContact NE2-CA 3.22Å; H396-N407 PolarHBondContact NE2-N 3.29Å; N407-G409 PolarHBondContact O-N 3.01Å
408	D	86.7	Confident	85.7	Confident	43 Å²	43	50.2 Å²	50.2	23%	0.23	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-5.5	174.9	67.7	5	0	0	0	114	R377 L406 T410	R377-D408 WeakPolarHBondContact CA-O 3.03Å; R377-D408 HydrophobicContact CG-CB 4.49Å; R377-D408 IonicContact CZ-OD2 2.74Å; R377-D408 IonicContact NH1-OD2 2.67Å; R377-D408 PolarHBondContact NH1-OD2 3.34Å; R377-D408 IonicContact NH2-OD2 3.96Å; R377-D408 PolarHBondContact NH2-OD2 3.06Å; L406-D408 PolarHBondContact O-N 2.91Å; L406-D408 VanDerWaalsContact O-N 3.14Å; D408-T410 WeakPolarHBondContact OD1-CB 3.44Å; D408-T410 PolarHBondContact OD1-N 3.34Å; D408-T410 PolarHBondContact OD1-OG1 3.43Å; D408-T410 PolarHBondContact OD2-OG1 3Å
409	G	88.5	Confident	86.6	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.01	29%	0.289	C	S	.	.	S	Bend	trans	98	-4.4	-178.8	0	0	0	0	0	114.4	C376 W386 L406 N407	C376-G409 WeakPolarHBondContact O-CA 3.36Å; W386-G409 PolarHBondContact NE1-O 2.69Å; L406-G409 WeakPolarHBondContact O-CA 3.21Å; L406-G409 PolarHBondContact O-N 3.12Å; N407-G409 PolarHBondContact O-N 3.01Å
410	T	92.1	Very high	88	Confident	2 Å²	2	49.6 Å²	49.6	1%	0.012	26%	0.259	C	S	.	.			trans	-68.5	133.6	-178.8	-57.2	0	0	0	0	111.7	E373 L374 K375 V405 L406 D408	E373-T410 HydrophobicContact CB-CG2 4.01Å; E373-T410 HydrophobicContact CG-CG2 4.49Å; L374-T410 WeakPolarHBondContact O-CA 3.01Å; L374-T410 WeakPolarHBondContact O-CG2 3.39Å; K375-T410 HydrophobicContact CG-CG2 4.4Å; V405-T410 CarbonylContact C-O 3.58Å; V405-T410 WeakPolarHBondContact CA-O 3.34Å; L406-T410 HydrophobicContact CD1-CG2 4.32Å; L406-T410 PolarHBondContact N-O 3.23Å; D408-T410 WeakPolarHBondContact OD1-CB 3.44Å; D408-T410 PolarHBondContact OD1-N 3.34Å; D408-T410 PolarHBondContact OD1-OG1 3.43Å; D408-T410 PolarHBondContact OD2-OG1 3Å
411	L	93	Very high	89.1	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	115.9	171.9	-170.4	69.2	0	0	0	109.3	E373 L374 W386 M394 I403 V405 F413 Y424	E373-L411 WeakPolarHBondContact CA-O 3.15Å; L374-L411 HydrophobicContact CB-CB 4.32Å; L374-L411 HydrophobicContact CD1-CD2 4.47Å; L374-L411 PolarHBondContact N-O 3.09Å; L374-L411 PolarHBondContact O-N 2.04Å; W386-L411 HydrophobicContact CB-CD1 4.27Å; W386-L411 HydrophobicContact CB-CD2 4.49Å; W386-L411 HydrophobicContact CD2-CB 3.88Å; W386-L411 HydrophobicContact CD2-CD2 3.98Å; W386-L411 HydrophobicContact CD2-CG 4.37Å; W386-L411 HydrophobicContact CE3-CB 4.47Å; W386-L411 HydrophobicContact CE3-CD2 4Å; W386-L411 HydrophobicContact CG-CB 4.18Å; W386-L411 HydrophobicContact CG-CD1 4.06Å; W386-L411 HydrophobicContact CG-CD2 4.23Å; W386-L411 HydrophobicContact CG-CG 4.41Å; W386-L411 HydrophobicContact CH2-CB 4.4Å; W386-L411 HydrophobicContact CZ2-CB 3.83Å; W386-L411 HydrophobicContact CZ3-CD2 4.49Å; M394-L411 HydrophobicContact CE-CD1 4.34Å; I403-L411 HydrophobicContact CG2-CD1 3.65Å; I403-L411 HydrophobicContact CG2-CD2 4.45Å; I403-L411 HydrophobicContact CG2-CG 4.03Å; V405-L411 HydrophobicContact CG2-CD1 3.69Å; L411-F413 HydrophobicContact CB-CE2 4.45Å; L411-F413 HydrophobicContact CD2-CE2 3.63Å; L411-F413 HydrophobicContact CD2-CZ 3.63Å; L411-F413 HydrophobicContact CG-CE2 3.73Å; L411-F413 HydrophobicContact CG-CZ 4.1Å; L411-Y424 HydrophobicContact CD2-CD1 3.56Å; L411-Y424 HydrophobicContact CD2-CE1 3.98Å; L411-Y424 HydrophobicContact CD2-CG 4.26Å
412	N	93	Very high	90.2	Very high	32 Å²	32	41.8 Å²	41.8	17%	0.171	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	130.3	-176.7	-179.6	20.5	0	0	0	111.2	I403 S404 L406	I403-N412 WeakPolarHBondContact CA-O 2.95Å; S404-N412 PolarHBondContact N-O 3.09Å; S404-N412 PolarHBondContact O-N 3.49Å; L406-N412 HydrophobicContact CD1-CB 4.13Å; L406-N412 HydrophobicContact CD2-CB 4.15Å; L406-N412 HydrophobicContact CG-CB 3.97Å
413	F	92.9	Very high	90.6	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	118.6	174.9	-61.8	-105.1	0	0	0	109.1	A371 A372 L374 I403 L411 V416 D420 Y424 L441	A371-F413 VanDerWaalsContact CA-O 3.28Å; A371-F413 WeakPolarHBondContact CA-O 3.27Å; A371-F413 WeakPolarHBondContact CB-O 3.17Å; A372-F413 HydrophobicContact CB-CB 4.24Å; A372-F413 HydrophobicContact CB-CD2 4.33Å; A372-F413 PolarHBondContact N-O 3.35Å; A372-F413 VanDerWaalsContact N-O 3.13Å; A372-F413 WeakPolarHBondContact O-CD2 3.44Å; A372-F413 PolarHBondContact O-N 3.02Å; L374-F413 HydrophobicContact CD1-CE2 4.39Å; I403-F413 HydrophobicContact CB-CD1 4.45Å; I403-F413 HydrophobicContact CD1-CD1 3.93Å; I403-F413 HydrophobicContact CD1-CE1 3.58Å; I403-F413 HydrophobicContact CG1-CD1 3.63Å; I403-F413 HydrophobicContact CG1-CE1 3.77Å; I403-F413 HydrophobicContact CG2-CD1 4.19Å; I403-F413 HydrophobicContact CG2-CE1 3.94Å; I403-F413 HydrophobicContact CG2-CZ 4.15Å; L411-F413 HydrophobicContact CB-CE2 4.45Å; L411-F413 HydrophobicContact CD2-CE2 3.63Å; L411-F413 HydrophobicContact CD2-CZ 3.63Å; L411-F413 HydrophobicContact CG-CE2 3.73Å; L411-F413 HydrophobicContact CG-CZ 4.1Å; F413-V416 HydrophobicContact CB-CG2 3.65Å; F413-V416 HydrophobicContact CD1-CG2 4.35Å; F413-V416 HydrophobicContact CG-CG2 4.13Å; F413-D420 HydrophobicContact CE1-CB 4.39Å; F413-Y424 HydrophobicContact CE1-CE1 4.38Å; F413-Y424 HydrophobicContact CZ-CD1 4.42Å; F413-Y424 AromaticContact CZ-CE1 3.81Å; F413-Y424 HydrophobicContact CZ-CE1 3.81Å; F413-Y424 HydrophobicContact CZ-CE2 4.32Å; F413-Y424 AromaticContact CZ-CZ 3.75Å; F413-L441 HydrophobicContact CE1-CD2 4.16Å; F413-L441 HydrophobicContact CE2-CD2 4.32Å; F413-L441 HydrophobicContact CZ-CD2 4.02Å
414	T	91.3	Very high	91	Very high	83 Å²	83	41.2 Å²	41.2	51%	0.509	23%	0.229	S	C	.	.	S	Bend	trans	-73.8	-36.2	176.4	53.1	0	0	0	0	112.2	R402	R402-T414 PolarHBondContact O-N 3.22Å; R402-T414 PolarHBondContact O-OG1 3.08Å
415	N	90.8	Very high	91.4	Very high	74 Å²	74	40.8 Å²	40.8	40%	0.396	22%	0.224	S	C	.	.	S	Bend	trans	-146.5	120.9	175.4	-173	-15	0	0	0	109	G369 R402	G369-N415 WeakPolarHBondContact CA-OD1 3.33Å; R402-N415 WeakPolarHBondContact CD-O 3.28Å; R402-N415 HydrophobicContact CG-CB 4.49Å; R402-N415 WeakPolarHBondContact CG-O 3.16Å; R402-N415 PolarHBondContact NH1-O 3.39Å
416	V	92.3	Very high	91.8	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.222	C	C	.	.			trans	-90.4	134.6	-179.2	179.5	0	0	0	0	110.7	G369 S370 A372 F413 D420 L441 V443	G369-V416 PolarHBondContact N-O 3.13Å; S370-V416 WeakPolarHBondContact O-CB 3.38Å; S370-V416 VanDerWaalsContact O-CG2 3.31Å; S370-V416 WeakPolarHBondContact O-CG2 3.39Å; S370-V416 PolarHBondContact O-N 2.79Å; A372-V416 HydrophobicContact CB-CG2 3.55Å; F413-V416 HydrophobicContact CB-CG2 3.65Å; F413-V416 HydrophobicContact CD1-CG2 4.35Å; F413-V416 HydrophobicContact CG-CG2 4.13Å; V416-D420 HydrophobicContact CG1-CB 4.33Å; V416-L441 HydrophobicContact CG1-CD2 4.31Å; V416-V443 HydrophobicContact CG1-CB 4.21Å; V416-V443 HydrophobicContact CG1-CG1 3.82Å; V416-V443 HydrophobicContact CG1-CG2 3.29Å
417	T	91.9	Very high	92.1	Very high	36 Å²	36	39.7 Å²	39.7	22%	0.221	22%	0.218	C	C	.	.			trans	-113.5	157.4	177.9	65.6	0	0	0	0	110.5	Q419 D420	T417-Q419 PolarHBondContact O-N 3.34Å; T417-D420 PolarHBondContact N-OD2 2.9Å; T417-D420 WeakPolarHBondContact O-CB 3.34Å; T417-D420 PolarHBondContact O-N 3.08Å; T417-D420 PolarHBondContact OG1-OD2 2.98Å
418	M	90.1	Very high	92.7	Very high	88 Å²	88	37 Å²	37	43%	0.433	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-55.6	-28.4	177.5	-68.1	-63.1	-68	0	0	113.5	D420 T421 V443	M418-D420 VanDerWaalsContact C-N 3.26Å; M418-D420 PolarHBondContact O-N 3.07Å; M418-T421 PolarHBondContact O-N 2.98Å; M418-T421 PolarHBondContact O-OG1 3.34Å; M418-T421 VanDerWaalsContact O-OG1 3.1Å; M418-V443 WeakPolarHBondContact CE-O 3.14Å; M418-V443 HydrophobicContact SD-CB 4.05Å; M418-V443 HydrophobicContact SD-CG1 3.77Å; M418-V443 VanDerWaalsContact SD-O 3.41Å
419	Q	89.6	Confident	93	Very high	183 Å²	183	35.5 Å²	35.5	86%	0.855	20%	0.196	S	C	*	.	G	3₁₀ helix	trans	-71.2	-15.5	178.3	-64.7	-178.8	-2.4	0	0	114.1	T417 T421	T417-Q419 PolarHBondContact O-N 3.34Å; Q419-T421 PolarHBondContact O-N 3.14Å
420	D	90.8	Very high	93.3	Very high	10 Å²	10	36.5 Å²	36.5	5%	0.053	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-80.9	-7.2	179.3	-61.6	-54	0	0	0	113.1	R402 F413 V416 T417 M418 G422 Y424 L441	R402-D420 IonicContact CZ-OD1 3.24Å; R402-D420 IonicContact CZ-OD2 2.73Å; R402-D420 VanDerWaalsContact CZ-OD2 3.24Å; R402-D420 VanDerWaalsContact NH1-CG 3.28Å; R402-D420 IonicContact NH1-OD1 2.63Å; R402-D420 PolarHBondContact NH1-OD1 3.38Å; R402-D420 IonicContact NH1-OD2 3.74Å; R402-D420 PolarHBondContact NH1-OD2 3.1Å; R402-D420 VanDerWaalsContact NH2-CG 3.35Å; R402-D420 IonicContact NH2-OD1 3.23Å; R402-D420 PolarHBondContact NH2-OD1 3.42Å; R402-D420 IonicContact NH2-OD2 3.85Å; R402-D420 PolarHBondContact NH2-OD2 3.38Å; F413-D420 HydrophobicContact CE1-CB 4.39Å; V416-D420 HydrophobicContact CG1-CB 4.33Å; T417-D420 PolarHBondContact N-OD2 2.9Å; T417-D420 WeakPolarHBondContact O-CB 3.34Å; T417-D420 PolarHBondContact O-N 3.08Å; T417-D420 PolarHBondContact OG1-OD2 2.98Å; M418-D420 VanDerWaalsContact C-N 3.26Å; M418-D420 PolarHBondContact O-N 3.07Å; D420-G422 PolarHBondContact O-N 3.17Å; D420-Y424 VanDerWaalsContact O-CE2 3.24Å; D420-Y424 WeakPolarHBondContact O-CE2 3.5Å; D420-Y424 PolarHBondContact O-OH 3.35Å; D420-L441 HydrophobicContact CB-CD2 4.21Å
421	T	93.6	Very high	93.2	Very high	60 Å²	60	37.1 Å²	37.1	37%	0.368	21%	0.206	S	C	.	.			trans	-58.9	129.1	179	-62.1	0	0	0	0	110.4	M418 Q419 L441 V443	M418-T421 PolarHBondContact O-N 2.98Å; M418-T421 PolarHBondContact O-OG1 3.34Å; M418-T421 VanDerWaalsContact O-OG1 3.1Å; Q419-T421 PolarHBondContact O-N 3.14Å; T421-L441 VanDerWaalsContact CA-O 3.29Å; T421-L441 WeakPolarHBondContact CA-O 3.4Å; T421-V443 WeakPolarHBondContact OG1-CB 3.45Å; T421-V443 WeakPolarHBondContact OG1-CG2 3.46Å; T421-V443 PolarHBondContact OG1-N 3.35Å
422	G	94.6	Very high	93.2	Very high	16 Å²	16	38.8 Å²	38.8	17%	0.165	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	154	-176.1	175.3	0	0	0	0	0	113.6	D420 Y424 T440 L441	D420-G422 PolarHBondContact O-N 3.17Å; G422-Y424 WeakPolarHBondContact O-CD2 3.19Å; G422-T440 WeakPolarHBondContact O-CA 3.01Å; G422-L441 PolarHBondContact N-O 3.11Å; G422-L441 PolarHBondContact O-N 3.2Å
423	T	96.4	Very high	93.1	Very high	68 Å²	68	38.4 Å²	38.4	42%	0.417	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	121.1	-179.8	-52.4	0	0	0	0	111	A439	T423-A439 WeakPolarHBondContact CA-O 3.48Å
424	Y	96.1	Very high	93.2	Very high	6 Å²	6	43.3 Å²	43.3	2%	0.024	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	132.4	174	-68.6	-98.2	0	0	0	109.2	L374 T388 P389 L411 F413 D420 G422 S438 A439 L441	L374-Y424 HydrophobicContact CD1-CD2 3.95Å; L374-Y424 HydrophobicContact CD1-CG 3.91Å; T388-Y424 HydrophobicContact CG2-CE1 4.17Å; P389-Y424 HydrophobicContact CG-CD2 4.19Å; P389-Y424 HydrophobicContact CG-CE1 4.38Å; P389-Y424 HydrophobicContact CG-CE2 3.81Å; L411-Y424 HydrophobicContact CD2-CD1 3.56Å; L411-Y424 HydrophobicContact CD2-CE1 3.98Å; L411-Y424 HydrophobicContact CD2-CG 4.26Å; F413-Y424 HydrophobicContact CE1-CE1 4.38Å; F413-Y424 HydrophobicContact CZ-CD1 4.42Å; F413-Y424 AromaticContact CZ-CE1 3.81Å; F413-Y424 HydrophobicContact CZ-CE1 3.81Å; F413-Y424 HydrophobicContact CZ-CE2 4.32Å; F413-Y424 AromaticContact CZ-CZ 3.75Å; D420-Y424 VanDerWaalsContact O-CE2 3.24Å; D420-Y424 WeakPolarHBondContact O-CE2 3.5Å; D420-Y424 PolarHBondContact O-OH 3.35Å; G422-Y424 WeakPolarHBondContact O-CD2 3.19Å; Y424-S438 CarbonylContact O-C 3.59Å; Y424-S438 VanDerWaalsContact O-CA 3.28Å; Y424-S438 WeakPolarHBondContact O-CA 3.2Å; Y424-A439 PolarHBondContact N-O 3.24Å; Y424-A439 PolarHBondContact O-N 2.97Å; Y424-L441 HydrophobicContact CD2-CB 4.1Å; Y424-L441 HydrophobicContact CE2-CB 3.9Å; Y424-L441 HydrophobicContact CE2-CD2 4.13Å
425	T	96.5	Very high	93.4	Very high	29 Å²	29	41.4 Å²	41.4	18%	0.178	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	117.2	178.9	-58.4	0	0	0	0	110	I387 T436 A437 S438	I387-T425 PolarHBondContact N-O 3Å; I387-T425 PolarHBondContact O-N 3.43Å; T425-T436 HydrophobicContact CG2-CG2 4.42Å; T425-A437 CarbonylContact C-O 3.34Å; T425-S438 WeakPolarHBondContact CB-OG 3.22Å; T425-S438 WeakPolarHBondContact CG2-OG 3.38Å; T425-S438 PolarHBondContact OG1-OG 2.65Å
426	C	96.3	Very high	93.7	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	123.8	169	-175.6	0	0	0	0	109.3	C376 W386 T436 A437	C376-C426 HydrophobicContact CB-CB 3.68Å; C376-C426 WeakPolarHBondContact CB-SG 3.43Å; C376-C426 WeakPolarHBondContact SG-CB 3.42Å; C376-C426 CovalentContact SG-SG 2.02Å; C376-C426 PolarHBondContact SG-SG 3.34Å; W386-C426 HydrophobicContact CD2-CB 4.05Å; W386-C426 HydrophobicContact CE3-CB 4.06Å; W386-C426 HydrophobicContact CH2-CB 3.83Å; W386-C426 HydrophobicContact CZ2-CB 3.78Å; W386-C426 HydrophobicContact CZ3-CB 3.95Å; C426-T436 CarbonylContact O-C 3.59Å; C426-T436 WeakPolarHBondContact O-CA 3.27Å; C426-A437 PolarHBondContact N-O 2.88Å; C426-A437 PolarHBondContact O-N 2.64Å
427	M	94.8	Very high	93.9	Very high	45 Å²	45	42.9 Å²	42.9	22%	0.222	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	117.7	173.8	-179.5	174.1	67.7	0	0	109.4	S385 T436	S385-M427 PolarHBondContact N-O 3.46Å; S385-M427 PolarHBondContact O-N 3.43Å; S385-M427 WeakPolarHBondContact OG-CE 3.37Å; S385-M427 PolarHBondContact OG-O 3.21Å; M427-T436 HydrophobicContact CB-CG2 3.96Å; M427-T436 HydrophobicContact CG-CG2 3.88Å
428	V	95	Very high	94.1	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	130	176.5	-173.3	0	0	0	0	108.8	P355 I357 A378 T382 S383 V384 N434 T435	P355-V428 HydrophobicContact CB-CG1 3.84Å; P355-V428 HydrophobicContact CG-CB 4.33Å; P355-V428 HydrophobicContact CG-CG1 4.04Å; P355-V428 VanDerWaalsContact CG-O 3.27Å; P355-V428 WeakPolarHBondContact CG-O 3.48Å; I357-V428 HydrophobicContact CD1-CG2 4.1Å; I357-V428 HydrophobicContact CG1-CB 4.37Å; I357-V428 HydrophobicContact CG1-CG2 3.82Å; A378-V428 HydrophobicContact CB-CG1 3.64Å; A378-V428 HydrophobicContact CB-CG2 4.07Å; T382-V428 HydrophobicContact CG2-CG1 4.21Å; T382-V428 WeakPolarHBondContact OG1-CG1 3.5Å; S383-V428 CarbonylContact O-C 3.54Å; S383-V428 VanDerWaalsContact O-CA 3.32Å; S383-V428 WeakPolarHBondContact O-CA 3.33Å; V384-V428 HydrophobicContact CG2-CG1 4.32Å; V384-V428 HydrophobicContact CG2-CG2 4.04Å; V428-N434 CarbonylContact O-C 3.5Å; V428-N434 WeakPolarHBondContact O-CA 3.12Å; V428-T435 PolarHBondContact N-O 2.87Å; V428-T435 PolarHBondContact O-N 2.96Å
429	S	93.6	Very high	94.4	Very high	13 Å²	13	40.2 Å²	40.2	9%	0.091	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	148.5	179.6	48.5	0	0	0	0	112.7	T382 S383 G433 N434	T382-S429 WeakPolarHBondContact CA-O 3.31Å; T382-S429 WeakPolarHBondContact CB-O 3.32Å; S383-S429 PolarHBondContact N-O 3.14Å; S383-S429 PolarHBondContact O-N 2.67Å; S383-S429 PolarHBondContact OG-O 3.25Å; S383-S429 PolarHBondContact OG-OG 3.39Å; S429-G433 WeakPolarHBondContact CA-O 3.39Å; S429-N434 VanDerWaalsContact CB-OD1 3.22Å; S429-N434 WeakPolarHBondContact CB-OD1 3.22Å
430	N	93.8	Very high	94.8	Very high	22 Å²	22	33.5 Å²	33.5	12%	0.118	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	-179.3	170.2	76.3	-1.8	0	0	0	109.8	Y353 P355 T382 A432 G433	Y353-N430 PolarHBondContact O-ND2 3.4Å; P355-N430 HydrophobicContact CB-CB 4.27Å; P355-N430 WeakPolarHBondContact CD-OD1 3.48Å; P355-N430 HydrophobicContact CG-CB 4.44Å; T382-N430 HydrophobicContact CG2-CB 4.16Å; N430-A432 PolarHBondContact O-N 2.97Å; N430-A432 WeakPolarHBondContact OD1-CA 3.35Å; N430-A432 WeakPolarHBondContact OD1-CB 3.35Å; N430-A432 PolarHBondContact OD1-N 2.92Å; N430-G433 PolarHBondContact N-O 2.63Å; N430-G433 PolarHBondContact O-N 3.24Å; N430-G433 PolarHBondContact OD1-N 2.99Å; N430-G433 PolarHBondContact OD1-O 3.27Å
431	S	91.6	Very high	95	Very high	14 Å²	14	33 Å²	33	10%	0.098	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-14.6	-179.8	-35.8	0	0	0	0	114.6	H285 C308 W315	H285-S431 PolarHBondContact CD2-N 3.03Å; H285-S431 PolarHBondContact NE2-N 3.18Å; C308-S431 PolarHBondContact O-OG 2.85Å; W315-S431 WeakPolarHBondContact CH2-O 3.26Å
432	A	91.6	Very high	95	Very high	36 Å²	36	33.7 Å²	33.7	30%	0.298	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.2	-17.7	-177.8	0	0	0	0	0	113.8	C352 Y353 N430	C352-A432 HydrophobicContact CB-CB 3.78Å; Y353-A432 WeakPolarHBondContact O-CB 3.4Å; N430-A432 PolarHBondContact O-N 2.97Å; N430-A432 WeakPolarHBondContact OD1-CA 3.35Å; N430-A432 WeakPolarHBondContact OD1-CB 3.35Å; N430-A432 PolarHBondContact OD1-N 2.92Å
433	G	91.9	Very high	95	Very high	24 Å²	24	33.5 Å²	33.5	25%	0.247	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	156.4	-166.8	178.8	0	0	0	0	0	113.8	P355 S429 N430	P355-G433 WeakPolarHBondContact CD-O 3.47Å; S429-G433 WeakPolarHBondContact CA-O 3.39Å; N430-G433 PolarHBondContact N-O 2.63Å; N430-G433 PolarHBondContact O-N 3.24Å; N430-G433 PolarHBondContact OD1-N 2.99Å; N430-G433 PolarHBondContact OD1-O 3.27Å
434	N	94.8	Very high	94.7	Very high	103 Å²	103	33.1 Å²	33.1	55%	0.551	21%	0.209	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-123.8	143.6	-173.4	-55.9	-1.3	0	0	0	110.1	V428 S429	V428-N434 CarbonylContact O-C 3.5Å; V428-N434 WeakPolarHBondContact O-CA 3.12Å; S429-N434 VanDerWaalsContact CB-OD1 3.22Å; S429-N434 WeakPolarHBondContact CB-OD1 3.22Å
435	T	95.8	Very high	94	Very high	43 Å²	43	35 Å²	35	26%	0.264	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	134.3	174.5	-58	0	0	0	0	108.7	P355 I357 V428	P355-T435 VanDerWaalsContact O-CB 3.22Å; P355-T435 WeakPolarHBondContact O-CB 3.37Å; P355-T435 PolarHBondContact O-OG1 2.74Å; I357-T435 HydrophobicContact CD1-CG2 3.97Å; I357-T435 HydrophobicContact CG1-CG2 4.09Å; V428-T435 PolarHBondContact N-O 2.87Å; V428-T435 PolarHBondContact O-N 2.96Å
436	T	96.2	Very high	92.8	Very high	85 Å²	85	37.8 Å²	37.8	52%	0.521	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	144.8	-176.7	54.9	0	0	0	0	111.7	T425 C426 M427	T425-T436 HydrophobicContact CG2-CG2 4.42Å; C426-T436 CarbonylContact O-C 3.59Å; C426-T436 WeakPolarHBondContact O-CA 3.27Å; M427-T436 HydrophobicContact CB-CG2 3.96Å; M427-T436 HydrophobicContact CG-CG2 3.88Å
437	A	96.6	Very high	91.1	Very high	20 Å²	20	45.6 Å²	45.6	17%	0.165	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	139.4	169.4	0	0	0	0	0	110	I357 P360 P361 T425 C426	I357-A437 HydrophobicContact CD1-CB 3.63Å; P360-A437 HydrophobicContact CB-CB 4.17Å; P361-A437 HydrophobicContact CG-CB 4.23Å; T425-A437 CarbonylContact C-O 3.34Å; C426-A437 PolarHBondContact N-O 2.88Å; C426-A437 PolarHBondContact O-N 2.64Å
438	S	96.8	Very high	89.1	Confident	67 Å²	67	50.8 Å²	50.8	47%	0.469	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	146.6	-174.8	-53.4	0	0	0	0	111.1	Y424 T425	Y424-S438 CarbonylContact O-C 3.59Å; Y424-S438 VanDerWaalsContact O-CA 3.28Å; Y424-S438 WeakPolarHBondContact O-CA 3.2Å; T425-S438 WeakPolarHBondContact CB-OG 3.22Å; T425-S438 WeakPolarHBondContact CG2-OG 3.38Å; T425-S438 PolarHBondContact OG1-OG 2.65Å
439	A	97	Very high	87	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.008	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	153.2	172.6	0	0	0	0	0	110.5	P361 D363 L374 T423 Y424	P361-A439 HydrophobicContact CB-CB 3.65Å; P361-A439 HydrophobicContact CG-CB 4.03Å; D363-A439 WeakPolarHBondContact OD1-CA 3.43Å; L374-A439 HydrophobicContact CD2-CB 4.43Å; T423-A439 WeakPolarHBondContact CA-O 3.48Å; Y424-A439 PolarHBondContact N-O 3.24Å; Y424-A439 PolarHBondContact O-N 2.97Å
440	T	96.4	Very high	84.8	Confident	42 Å²	42	59.7 Å²	59.7	26%	0.258	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	126.6	-179.8	-50.8	0	0	0	0	110.2	D363 L364 G422	D363-T440 WeakPolarHBondContact CA-O 3.21Å; D363-T440 PolarHBondContact OD1-N 3.49Å; L364-T440 PolarHBondContact N-O 2.9Å; G422-T440 WeakPolarHBondContact O-CA 3.01Å
441	L	95.6	Very high	82.9	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	119.1	171.5	-177.5	68.7	0	0	0	108.5	L364 V366 A372 F413 V416 D420 T421 G422 Y424 V443	L364-L441 HydrophobicContact CB-CD1 4.14Å; L364-L441 HydrophobicContact CD2-CD1 4.1Å; L364-L441 HydrophobicContact CG-CD1 4.38Å; L364-L441 WeakPolarHBondContact O-CA 3.02Å; V366-L441 HydrophobicContact CG2-CD1 3.72Å; A372-L441 HydrophobicContact CB-CD1 4.35Å; F413-L441 HydrophobicContact CE1-CD2 4.16Å; F413-L441 HydrophobicContact CE2-CD2 4.32Å; F413-L441 HydrophobicContact CZ-CD2 4.02Å; V416-L441 HydrophobicContact CG1-CD2 4.31Å; D420-L441 HydrophobicContact CB-CD2 4.21Å; T421-L441 VanDerWaalsContact CA-O 3.29Å; T421-L441 WeakPolarHBondContact CA-O 3.4Å; G422-L441 PolarHBondContact N-O 3.11Å; G422-L441 PolarHBondContact O-N 3.2Å; Y424-L441 HydrophobicContact CD2-CB 4.1Å; Y424-L441 HydrophobicContact CE2-CB 3.9Å; Y424-L441 HydrophobicContact CE2-CD2 4.13Å; L441-V443 HydrophobicContact CG-CG2 4.37Å
442	N	94.4	Very high	80.4	Confident	73 Å²	73	72.4 Å²	72.4	39%	0.39	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	126.8	174.4	-69.8	-31	0	0	0	110.3	L364 N365 V366	L364-N442 PolarHBondContact O-N 3.14Å; N365-N442 CarbonylContact C-O 3.54Å; N365-N442 WeakPolarHBondContact CA-O 3.28Å; N365-N442 WeakPolarHBondContact OD1-CB 3.49Å; N365-N442 PolarHBondContact OD1-ND2 3.42Å; N365-N442 VanDerWaalsContact OD1-ND2 3.13Å; V366-N442 PolarHBondContact N-O 3.02Å
443	V	93.8	Very high	78.2	Confident	13 Å²	13	79.8 Å²	79.8	8%	0.079	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	123.3	180	-167.7	0	0	0	0	109.9	V366 E368 V416 M418 T421 L441	V366-V443 CarbonylContact O-C 3.24Å; V366-V443 VanDerWaalsContact O-CA 3.25Å; V366-V443 WeakPolarHBondContact O-CA 3.35Å; E368-V443 HydrophobicContact CB-CG1 4.16Å; V416-V443 HydrophobicContact CG1-CB 4.21Å; V416-V443 HydrophobicContact CG1-CG1 3.82Å; V416-V443 HydrophobicContact CG1-CG2 3.29Å; M418-V443 WeakPolarHBondContact CE-O 3.14Å; M418-V443 HydrophobicContact SD-CB 4.05Å; M418-V443 HydrophobicContact SD-CG1 3.77Å; M418-V443 VanDerWaalsContact SD-O 3.41Å; T421-V443 WeakPolarHBondContact OG1-CB 3.45Å; T421-V443 WeakPolarHBondContact OG1-CG2 3.46Å; T421-V443 PolarHBondContact OG1-N 3.35Å; L441-V443 HydrophobicContact CG-CG2 4.37Å
444	S	90.3	Very high	75.9	Confident	60 Å²	60	88.3 Å²	88.3	42%	0.42	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	140.9	177.4	58.6	0	0	0	0	111.7	V366 T367 E368	V366-S444 PolarHBondContact O-N 3.21Å; V366-S444 PolarHBondContact O-OG 3.06Å; T367-S444 VanDerWaalsContact CA-O 3.28Å; T367-S444 WeakPolarHBondContact CA-O 3.38Å; E368-S444 PolarHBondContact N-O 2.95Å
445	S	81.9	Confident	73.3	Confident	46 Å²	46	89.1 Å²	89.1	32%	0.322	50%	0.495	S	S	.	.			trans	-69.1	141.2	169.7	169.4	0	0	0	0	110.6	E447	S445-E447 PolarHBondContact O-N 2.81Å; S445-E447 VanDerWaalsContact O-N 3.08Å; S445-E447 PolarHBondContact OG-N 3.14Å
446	P	70.1	Confident	70.9	Confident	86 Å²	86	93.2 Å²	93.2	56%	0.558	52%	0.52	S	S	*	.	G	3₁₀ helix	trans	-62.7	-7.9	174	24.7	-32.7	0	0	0	114.4
447	E	61.3	Low	68.2	Low	165 Å²	165	95.3 Å²	95.3	77%	0.771	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-89.3	0.2	-176	-66	-170.9	164.7	0	0	115.4	S445 S449	S445-E447 PolarHBondContact O-N 2.81Å; S445-E447 VanDerWaalsContact O-N 3.08Å; S445-E447 PolarHBondContact OG-N 3.14Å; E447-S449 PolarHBondContact O-N 3.32Å
448	N	53.3	Low	65.4	Low	153 Å²	153	100.8 Å²	100.8	82%	0.818	56%	0.564	S	S	*	*	G	3₁₀ helix	trans	-92.4	16.5	-177.8	-102.9	14.1	0	0	0	116	S450	N448-S450 VanDerWaalsContact C-N 3.34Å
449	S	50	Low	62.5	Low	107 Å²	107	103.6 Å²	103.6	75%	0.748	58%	0.578	S	S	*	*			trans	-96.3	63.7	156.7	57.6	0	0	0	0	109.7	E447 F451	E447-S449 PolarHBondContact O-N 3.32Å; S449-F451 PolarHBondContact O-N 3.45Å
450	S	47.5	Very low	59.5	Low	93 Å²	93	112.9 Å²	112.9	65%	0.65	62%	0.621	S	S	*	*			trans	-70.1	114	172	61.1	0	0	0	0	109.8	N448 S452	N448-S450 VanDerWaalsContact C-N 3.34Å; S450-S452 PolarHBondContact O-N 2.99Å
451	F	54.8	Low	56.5	Low	210 Å²	210	116.6 Å²	116.6	92%	0.921	64%	0.644	S	S	*	*			trans	2.1	111	152.2	-64.2	-88.6	0	0	0	115.6	S449	S449-F451 PolarHBondContact O-N 3.45Å
452	S	39.1	Very low	53.5	Low	93 Å²	93	124.7 Å²	124.7	65%	0.65	69%	0.685	S	S	*	*			trans	-99.9	114.1	167.3	84.4	0	0	0	0	110.9	S450	S450-S452 PolarHBondContact O-N 2.99Å
453	Y	44.6	Very low	50.5	Low	191 Å²	191	129.6 Å²	129.6	75%	0.749	71%	0.706	S	S	*	*			trans	63.3	114.3	156.9	69.4	-90.9	0	0	0	120.9
454	F	43.5	Very low	47.5	Very low	204 Å²	204	135.1 Å²	135.1	90%	0.895	74%	0.74	S	S	*	*			trans	-57.6	132.7	147.4	-78.7	-102.1	0	0	0	110.3
455	T	39.6	Very low	45.1	Very low	119 Å²	119	137.3 Å²	137.3	73%	0.73	75%	0.753	S	S	*	*			trans	-110.9	110.3	152.2	-0.5	0	0	0	0	106.9	V457	T455-V457 PolarHBondContact O-N 3.06Å
456	T	46.7	Very low	42.6	Very low	130 Å²	130	143.5 Å²	143.5	80%	0.798	78%	0.776	S	S	*	*			trans	-68.1	113.5	170.7	43.9	0	0	0	0	109
457	V	37.8	Very low	40.7	Very low	129 Å²	129	144.6 Å²	144.6	78%	0.782	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-95.1	118.5	165.4	-179.9	0	0	0	0	107.4	T455 V459	T455-V457 PolarHBondContact O-N 3.06Å; V457-V459 PolarHBondContact O-N 3.28Å
458	T	39.8	Very low	39.1	Very low	134 Å²	134	144.8 Å²	144.8	82%	0.822	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-61	127	172	40.5	0	0	0	0	110.3
459	V	34.2	Very low	38	Very low	126 Å²	126	141.1 Å²	141.1	76%	0.764	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-87	116.5	174.4	178.4	0	0	0	0	108.5	V457 T461	V457-V459 PolarHBondContact O-N 3.28Å; V459-T461 HydrophobicContact CG1-CG2 3.9Å
460	E	35.2	Very low	37	Very low	196 Å²	196	145.8 Å²	145.8	92%	0.916	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-95.7	118.6	154.3	-82.6	-174.2	164.1	0	0	108.2
461	T	32.2	Very low	35.9	Very low	121 Å²	121	147.7 Å²	147.7	74%	0.742	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-86.8	123.1	175.1	45.2	0	0	0	0	110.4	V459	V459-T461 HydrophobicContact CG1-CG2 3.9Å
462	I	33	Very low	34.6	Very low	169 Å²	169	144 Å²	144	87%	0.867	79%	0.787	S	S	*	*			trans	-135.7	133.5	152.7	-60.1	-179.7	0	0	0	107.9
463	E	31	Very low	34	Very low	176 Å²	176	145.7 Å²	145.7	82%	0.822	79%	0.793	S	S	*	*			trans	-72.3	144.2	-170.1	-63.3	173.8	148.1	0	0	114.4
464	T	32.3	Very low	33.5	Very low	129 Å²	129	143.6 Å²	143.6	79%	0.791	80%	0.8	S	S	*	*			trans	10.8	164.1	145.4	67.5	0	0	0	0	121.8
465	P	39.7	Very low	32.7	Very low	107 Å²	107	143 Å²	143	70%	0.695	80%	0.8	S	S	*	*			cis	-146.9	172	22.3	40.5	-19.1	0	0	0	119.4
466	H	28.1	Very low	32.2	Very low	175 Å²	175	145.2 Å²	145.2	81%	0.81	80%	0.802	S	S	*	*			trans	60.1	146.1	152.6	-92.5	-62.9	0	0	0	118.9
467	N	30.1	Very low	31.4	Very low	110 Å²	110	147.4 Å²	147.4	59%	0.588	80%	0.801	S	S	*	*			cis	-162.9	162.6	17.1	-152.3	11.6	0	0	0	110.4
468	E	29.1	Very low	31	Very low	168 Å²	168	147.3 Å²	147.3	79%	0.785	80%	0.8	S	S	*	*			trans	71.5	90.9	151.5	-76.4	171	-149.2	0	0	122.2
469	G	30.2	Very low	30.6	Very low	76 Å²	76	143.9 Å²	143.9	78%	0.784	79%	0.791	S	S	*	*				30.3	114.3	122.8	0	0	0	0	0	122.1
470	F	28.4	Very low	31.3	Very low	206 Å²	206	143.9 Å²	143.9	90%	0.904	79%	0.794	S	S	*	*				-172.3	116	120.5	-143.7	-103.1	0	0	0	108.8
471	T	25.4	Very low	31.1	Very low	132 Å²	132	140.8 Å²	140.8	81%	0.81	79%	0.788	S	S	*	*			trans	-113.1	116.9	170.2	32	0	0	0	0	110.9
472	T	27.5	Very low	31.7	Very low	134 Å²	134	140.1 Å²	140.1	82%	0.822	79%	0.786	S	S	*	*			trans	-52.9	141.2	150	23.8	0	0	0	0	110.9
473	T	26.6	Very low	31.5	Very low	128 Å²	128	137.4 Å²	137.4	79%	0.785	78%	0.782	S	S	*	*			trans	-117.6	127.6	169	39.4	0	0	0	0	109.3
474	V	33.5	Very low	31.2	Very low	146 Å²	146	133.9 Å²	133.9	89%	0.885	78%	0.783	S	S	*	*			trans	-148.1	110.3	130.9	-177.6	0	0	0	0	106.9
475	Q	26.5	Very low	31.1	Very low	192 Å²	192	132.6 Å²	132.6	90%	0.897	78%	0.779	S	S	*	*			trans	-144.9	157.1	148.7	-94.2	-152.7	-0.2	0	0	112
476	Q	30.1	Very low	30.4	Very low	166 Å²	166	134 Å²	134	78%	0.776	78%	0.779	S	S	*	*			trans	-76.5	156.7	-166.3	-153.5	177.8	-8.2	0	0	112.8
477	K	28.8	Very low	30.3	Very low	176 Å²	176	136 Å²	136	77%	0.765	78%	0.78	S	S	*	*			trans	90.3	138.6	133.5	-130.5	-169.9	175	175.9	0	121.1
478	V	30.1	Very low	29.9	Very low	127 Å²	127	138.3 Å²	138.3	77%	0.77	79%	0.787	S	S	*	*			trans	83.6	130.8	153.5	-161.2	0	0	0	0	117.9
479	G	31.5	Very low	29.7	Very low	62 Å²	62	135.2 Å²	135.2	64%	0.639	79%	0.785	S	S	*	*			trans	-69.3	-159.3	174.3	0	0	0	0	0	113.9
480	P	47.5	Very low	30.3	Very low	126 Å²	126	136.8 Å²	136.8	82%	0.818	78%	0.781	S	S	*	*			cis	-146.9	-173.7	45.1	33	-7.4	0	0	0	116
481	T	31.6	Very low	30.1	Very low	130 Å²	130	132.1 Å²	132.1	80%	0.798	77%	0.774	S	S	*	*			trans	-37.1	172.2	169.1	37.7	0	0	0	0	118.1
482	P	45.4	Very low	30.8	Very low	107 Å²	107	131.5 Å²	131.5	70%	0.695	77%	0.772	S	S	*	*			cis	-140.3	170.7	5.9	31.8	-8.5	0	0	0	117.7
483	S	28.1	Very low	30.8	Very low	112 Å²	112	131.1 Å²	131.1	78%	0.783	77%	0.769	S	S	*	*			trans	65.5	140.8	144.8	53.9	0	0	0	0	123.6
484	A	24.7	Very low	31	Very low	103 Å²	103	129.6 Å²	129.6	85%	0.851	76%	0.764	S	S	*	*			trans	95.1	121.4	156	0	0	0	0	0	119
485	S	30.6	Very low	30.7	Very low	101 Å²	101	128.2 Å²	128.2	71%	0.706	76%	0.756	S	S	*	*			trans	-61.2	155.6	176.1	49.9	0	0	0	0	115.5
486	I	25.7	Very low	30.8	Very low	136 Å²	136	124.9 Å²	124.9	70%	0.697	75%	0.749	S	S	*	*				158.7	132	120.5	-83.9	159.6	0	0	0	113.9
487	W	25.3	Very low	30.7	Very low	219 Å²	219	122.7 Å²	122.7	83%	0.83	75%	0.747	S	S	*	*			trans	57.6	136.4	151.3	-86.3	-54	0	0	0	127.6
488	E	21.3	Very low	30.5	Very low	157 Å²	157	119.9 Å²	119.9	73%	0.734	75%	0.745	S	S	*	*			trans	85.9	109.1	137.3	-79.5	174.7	170.7	0	0	123.1
489	S	24.9	Very low	30.4	Very low	104 Å²	104	119.8 Å²	119.8	73%	0.727	75%	0.745	S	S	*	*				49.9	167.4	115.2	-35.9	0	0	0	0	122
490	P	42	Very low	30.3	Very low	108 Å²	108	123 Å²	123	70%	0.701	75%	0.752	S	S	*	*			cis	-135.8	154.4	-19.2	31.4	-11.3	0	0	0	116.4
491	S	25.6	Very low	29.3	Very low	109 Å²	109	127.7 Å²	127.7	76%	0.762	75%	0.753	S	S	*	*			trans	63.1	155.7	137	76.2	0	0	0	0	121.3
492	P	39.7	Very low	29.1	Very low	119 Å²	119	127.4 Å²	127.4	77%	0.773	75%	0.752	S	S	*	*				-139.7	163	66.1	25.8	-1.2	0	0	0	119.1
493	T	27.6	Very low	28.5	Very low	125 Å²	125	128.7 Å²	128.7	77%	0.767	76%	0.76	S	S	*	*			trans	-13.8	129.3	159.8	14.5	0	0	0	0	122.1
494	S	29.9	Very low	28.5	Very low	96 Å²	96	131 Å²	131	67%	0.671	76%	0.762	S	S	*	*				94.4	137.2	92.5	68.6	0	0	0	0	114.5
495	T	28	Very low	28.7	Very low	118 Å²	118	131.9 Å²	131.9	72%	0.724	76%	0.763	S	S	*	*				-173.3	144.5	57.7	-6	0	0	0	0	113.3
496	T	28.5	Very low	28.6	Very low	121 Å²	121	132.9 Å²	132.9	74%	0.742	77%	0.765	S	S	*	*			trans	57.9	142.6	144.3	46.4	0	0	0	0	122.3
497	T	27.6	Very low	28.8	Very low	120 Å²	120	137.5 Å²	137.5	74%	0.736	77%	0.774	S	S	*	*			cis	-168	139.2	21.5	3.2	0	0	0	0	112.1
498	T	26	Very low	29	Very low	118 Å²	118	132 Å²	132	72%	0.724	78%	0.775	S	S	*	*			trans	52.3	136.6	137.4	2.3	0	0	0	0	127.9
499	T	27	Very low	29.5	Very low	124 Å²	124	130.3 Å²	130.3	76%	0.761	78%	0.775	S	S	*	*			trans	97.7	98.2	142.8	56.8	0	0	0	0	123.5
500	V	28.6	Very low	29.8	Very low	131 Å²	131	134.9 Å²	134.9	79%	0.794	79%	0.785	S	S	*	*				47.1	129.2	113.3	-177.4	0	0	0	0	122.2
501	R	26.6	Very low	29.3	Very low	223 Å²	223	139.4 Å²	139.4	84%	0.842	79%	0.794	S	S	*	*			trans	106.8	117.6	143.6	-99.1	170	-174.2	-176.3	1.3	121.6
502	T	27.6	Very low	29.5	Very low	125 Å²	125	140.2 Å²	140.2	77%	0.767	80%	0.797	S	S	*	*			trans	55.9	131.7	142.2	49.6	0	0	0	0	121.7
503	P	33.2	Very low	29	Very low	133 Å²	133	144.7 Å²	144.7	86%	0.864	80%	0.8	S	S	*	*			trans	-95.2	130.2	167.4	34.3	-26.7	0	0	0	112.5
504	L	27.7	Very low	29.1	Very low	160 Å²	160	145 Å²	145	84%	0.838	80%	0.802	S	S	*	*			trans	-109.8	122.5	163.9	-162.8	79.1	0	0	0	107.5
505	S	28.5	Very low	29.1	Very low	123 Å²	123	147 Å²	147	86%	0.86	80%	0.803	S	S	*	*			trans	-98	117.8	174.9	-179.7	0	0	0	0	109
506	T	28.9	Very low	29.2	Very low	122 Å²	122	147.1 Å²	147.1	75%	0.748	81%	0.806	S	S	*	*			trans	-113.3	129.8	170.4	43.8	0	0	0	0	111.1
507	R	31.4	Very low	29.3	Very low	233 Å²	233	148.1 Å²	148.1	88%	0.879	81%	0.811	S	S	*	*			trans	-71	139.1	170.4	179.4	179.7	-179	174.7	0.1	109.9
508	A	29.5	Very low	29.5	Very low	104 Å²	104	148.8 Å²	148.8	86%	0.86	82%	0.815	S	S	*	*			trans	-121.8	131.6	169.2	0	0	0	0	0	110.7
509	T	31.5	Very low	30.1	Very low	120 Å²	120	152.8 Å²	152.8	74%	0.736	83%	0.826	S	S	*	*			trans	-106.1	138.4	-180	32	0	0	0	0	110.3
510	E	31	Very low	30.3	Very low	201 Å²	201	150.3 Å²	150.3	94%	0.939	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-84.3	157.2	172.4	-73.9	-176.1	152.1	0	0	113.1
511	K	30.1	Very low	30.5	Very low	202 Å²	202	148.9 Å²	148.9	88%	0.878	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-87.4	156.4	-168.3	-71.1	176.5	176.5	176.7	0	114
512	P	31.8	Very low	31.4	Very low	127 Å²	127	147 Å²	147	83%	0.825	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-92.6	151.6	178.9	35.8	-32.2	0	0	0	114.2
513	Y	28.3	Very low	32.3	Very low	213 Å²	213	145.4 Å²	145.4	84%	0.835	82%	0.821	S	S	*	*			trans	-104.3	144.6	172	-164.6	-94.1	0	0	0	110.1	I515	Y513-I515 HydrophobicContact CD1-CG1 4.15Å; Y513-I515 HydrophobicContact CE1-CG1 4.02Å
514	T	28.9	Very low	32.9	Very low	132 Å²	132	141.1 Å²	141.1	81%	0.81	80%	0.801	S	S	*	*			trans	-119.1	140.2	-179.1	7.2	0	0	0	0	110.6
515	I	30.2	Very low	34	Very low	137 Å²	137	140.5 Å²	140.5	70%	0.703	80%	0.798	S	S	*	*			trans	-125.1	139.6	171.1	-58.8	175	0	0	0	107.4	Y513	Y513-I515 HydrophobicContact CD1-CG1 4.15Å; Y513-I515 HydrophobicContact CE1-CG1 4.02Å
516	P	31.1	Very low	35.3	Very low	120 Å²	120	138.9 Å²	138.9	78%	0.779	78%	0.779	S	S	*	*			trans	-81.7	143.8	-175.5	32.3	-32.7	0	0	0	112.4
517	V	30.8	Very low	36.6	Very low	142 Å²	142	140 Å²	140	86%	0.861	78%	0.776	S	S	*	*			trans	-96.7	125	173.8	176.6	0	0	0	0	108.8
518	T	31	Very low	37.8	Very low	134 Å²	134	133.1 Å²	133.1	82%	0.822	76%	0.759	S	S	*	*			trans	-105.2	144.7	162.8	8.4	0	0	0	0	109.2
519	E	39.3	Very low	39.1	Very low	202 Å²	202	133 Å²	133	94%	0.944	74%	0.742	S	S	*	*			trans	-58.1	136.1	-172.9	-65.3	-179.6	146.4	0	0	113.7
520	G	31.3	Very low	40.5	Very low	72 Å²	72	133.6 Å²	133.6	74%	0.742	74%	0.735	S	S	*	*			trans	-172.8	83.7	178.1	0	0	0	0	0	114
521	S	31.5	Very low	42	Very low	102 Å²	102	127.5 Å²	127.5	71%	0.713	71%	0.711	S	S	*	*			trans	65.1	104.6	135.7	-157.5	0	0	0	0	120.7	S523	S521-S523 PolarHBondContact O-N 3.46Å; S521-S523 PolarHBondContact O-OG 2.85Å
522	L	46.2	Very low	43.6	Very low	182 Å²	182	120.9 Å²	120.9	95%	0.953	69%	0.688	S	S	*	*	S	Bend	trans	5.2	10.2	141.7	-99.3	99.7	0	0	0	124.9
523	S	46.6	Very low	45.4	Very low	92 Å²	92	122.1 Å²	122.1	64%	0.643	68%	0.681	S	S	*	*			trans	-90.3	-14.1	-178.8	55.8	0	0	0	0	115.3	S521	S521-S523 PolarHBondContact O-N 3.46Å; S521-S523 PolarHBondContact O-OG 2.85Å
524	G	45.7	Very low	47.7	Very low	43 Å²	43	117.3 Å²	117.3	44%	0.443	67%	0.668	S	S	.	*	H	α-helix	trans	-78.4	-26.9	-172.9	0	0	0	0	0	116.1	V528	G524-V528 VanDerWaalsContact O-CG2 3.24Å; G524-V528 WeakPolarHBondContact O-CG2 3.45Å; G524-V528 PolarHBondContact O-N 2.72Å
525	L	51.6	Low	50	Low	148 Å²	148	116.2 Å²	116.2	78%	0.775	66%	0.656	S	S	*	*	H	α-helix	trans	-72.4	-31.2	-175.9	-103.5	92.2	0	0	0	113.3	V528 M529	L525-V528 PolarHBondContact O-N 2.88Å; L525-M529 WeakPolarHBondContact O-CG 3.49Å; L525-M529 PolarHBondContact O-N 2.99Å
526	D	53.9	Low	52.3	Low	89 Å²	89	114.5 Å²	114.5	48%	0.476	65%	0.647	S	S	.	*	H	α-helix	trans	-75.8	-33.5	-179.2	-159.6	50.3	0	0	0	111.9	M529 K530	D526-M529 PolarHBondContact O-N 2.82Å; D526-K530 WeakPolarHBondContact O-CB 3.22Å; D526-K530 PolarHBondContact O-N 3.3Å
527	E	56.5	Low	54.5	Low	145 Å²	145	110.7 Å²	110.7	68%	0.678	63%	0.63	S	S	*	*	H	α-helix	trans	-69.1	-37.4	170.9	-74.1	-148.6	149.2	0	0	112.5	K530 T531	E527-K530 PolarHBondContact O-N 2.63Å; E527-T531 WeakPolarHBondContact O-CB 3.33Å; E527-T531 WeakPolarHBondContact O-CG2 3Å; E527-T531 PolarHBondContact O-N 2.91Å; E527-T531 PolarHBondContact O-OG1 2.8Å
528	V	56.3	Low	56.9	Low	88 Å²	88	107.2 Å²	107.2	53%	0.533	61%	0.611	S	S	.	*	H	α-helix	trans	-67.1	-37.5	174.7	174.7	0	0	0	0	111.1	G524 L525 T531 T532	G524-V528 VanDerWaalsContact O-CG2 3.24Å; G524-V528 WeakPolarHBondContact O-CG2 3.45Å; G524-V528 PolarHBondContact O-N 2.72Å; L525-V528 PolarHBondContact O-N 2.88Å; V528-T531 WeakPolarHBondContact CA-OG1 3.45Å; V528-T531 PolarHBondContact O-OG1 2.8Å; V528-T531 VanDerWaalsContact O-OG1 3.11Å; V528-T532 VanDerWaalsContact O-CB 3.26Å; V528-T532 WeakPolarHBondContact O-CB 3.4Å; V528-T532 PolarHBondContact O-N 3.47Å; V528-T532 PolarHBondContact O-OG1 2.83Å
529	M	56.6	Low	59.3	Low	102 Å²	102	107.8 Å²	107.8	50%	0.502	60%	0.603	S	S	.	*	H	α-helix	trans	-69.3	-38.2	173.5	-75	-157.7	-44.7	0	0	113.1	L525 D526 K533	L525-M529 WeakPolarHBondContact O-CG 3.49Å; L525-M529 PolarHBondContact O-N 2.99Å; D526-M529 PolarHBondContact O-N 2.82Å; M529-K533 WeakPolarHBondContact O-CB 3.2Å; M529-K533 WeakPolarHBondContact O-CG 3.35Å; M529-K533 PolarHBondContact O-N 2.94Å
530	K	62	Low	61.5	Low	133 Å²	133	102 Å²	102	58%	0.578	58%	0.581	S	S	*	*	H	α-helix	trans	-65.7	-46.1	175.5	-94.5	175.7	176.9	163	0	112.1	D526 E527 K533 I534	D526-K530 WeakPolarHBondContact O-CB 3.22Å; D526-K530 PolarHBondContact O-N 3.3Å; E527-K530 PolarHBondContact O-N 2.63Å; K530-K533 PolarHBondContact O-N 2.86Å; K530-I534 WeakPolarHBondContact O-CG1 3.05Å; K530-I534 PolarHBondContact O-N 3Å
531	T	62.5	Low	63.9	Low	72 Å²	72	101.1 Å²	101.1	44%	0.442	57%	0.566	S	S	.	*	H	α-helix	trans	-65.3	-38.2	176.9	46.2	0	0	0	0	111.8	E527 V528 I534 I535	E527-T531 WeakPolarHBondContact O-CB 3.33Å; E527-T531 WeakPolarHBondContact O-CG2 3Å; E527-T531 PolarHBondContact O-N 2.91Å; E527-T531 PolarHBondContact O-OG1 2.8Å; V528-T531 WeakPolarHBondContact CA-OG1 3.45Å; V528-T531 PolarHBondContact O-OG1 2.8Å; V528-T531 VanDerWaalsContact O-OG1 3.11Å; T531-I534 PolarHBondContact O-N 3.06Å; T531-I535 WeakPolarHBondContact O-CD1 3.41Å; T531-I535 VanDerWaalsContact O-CG1 3.23Å; T531-I535 WeakPolarHBondContact O-CG1 3.31Å; T531-I535 PolarHBondContact O-N 3.04Å
532	T	62.7	Low	66.6	Low	64 Å²	64	101.8 Å²	101.8	39%	0.393	56%	0.561	S	S	.	*	H	α-helix	trans	-65.9	-39	175.2	-54.1	0	0	0	0	112.2	V528 I535 I536	V528-T532 VanDerWaalsContact O-CB 3.26Å; V528-T532 WeakPolarHBondContact O-CB 3.4Å; V528-T532 PolarHBondContact O-N 3.47Å; V528-T532 PolarHBondContact O-OG1 2.83Å; T532-I535 PolarHBondContact O-N 2.02Å; T532-I536 HydrophobicContact CG2-CD1 3.85Å; T532-I536 HydrophobicContact CG2-CG1 4.42Å; T532-I536 WeakPolarHBondContact O-CB 3.48Å; T532-I536 VanDerWaalsContact O-CG1 3.23Å; T532-I536 WeakPolarHBondContact O-CG1 3.28Å; T532-I536 PolarHBondContact O-N 3.07Å
533	K	70.2	Confident	68.3	Low	153 Å²	153	96.5 Å²	96.5	67%	0.665	54%	0.536	S	S	*	.	H	α-helix	trans	-64.4	-37.9	173.6	-79	178.7	179.5	176.2	0	112.6	M529 K530 G537	M529-K533 WeakPolarHBondContact O-CB 3.2Å; M529-K533 WeakPolarHBondContact O-CG 3.35Å; M529-K533 PolarHBondContact O-N 2.94Å; K530-K533 PolarHBondContact O-N 2.86Å; K533-G537 PolarHBondContact O-N 2.81Å
534	I	77.4	Confident	70.2	Confident	112 Å²	112	97.3 Å²	97.3	57%	0.574	53%	0.532	S	S	*	.	H	α-helix	trans	-67.2	-43.3	175.4	-66.8	166	0	0	0	110.5	K530 T531 G537 C538	K530-I534 WeakPolarHBondContact O-CG1 3.05Å; K530-I534 PolarHBondContact O-N 3Å; T531-I534 PolarHBondContact O-N 3.06Å; I534-G537 PolarHBondContact O-N 2.78Å; I534-C538 WeakPolarHBondContact O-CB 3.42Å; I534-C538 PolarHBondContact O-N 2.74Å
535	I	75.8	Confident	72.2	Confident	109 Å²	109	101.1 Å²	101.1	56%	0.559	54%	0.54	S	S	*	.	H	α-helix	trans	-64.6	-44.3	178.8	-67.1	163.8	0	0	0	111	T531 T532 G537 C538 F539	T531-I535 WeakPolarHBondContact O-CD1 3.41Å; T531-I535 VanDerWaalsContact O-CG1 3.23Å; T531-I535 WeakPolarHBondContact O-CG1 3.31Å; T531-I535 PolarHBondContact O-N 3.04Å; T532-I535 PolarHBondContact O-N 2.02Å; I535-G537 VanDerWaalsContact C-N 3.34Å; I535-C538 PolarHBondContact O-N 3.27Å; I535-F539 WeakPolarHBondContact O-CB 3.38Å; I535-F539 PolarHBondContact O-N 2.88Å
536	I	78.5	Confident	73.7	Confident	100 Å²	100	96.3 Å²	96.3	51%	0.513	52%	0.522	S	S	.	.	H	α-helix	trans	-63.1	-42.6	175.2	-66.2	165.9	0	0	0	110.2	T532 C538 F539 V540	T532-I536 HydrophobicContact CG2-CD1 3.85Å; T532-I536 HydrophobicContact CG2-CG1 4.42Å; T532-I536 WeakPolarHBondContact O-CB 3.48Å; T532-I536 VanDerWaalsContact O-CG1 3.23Å; T532-I536 WeakPolarHBondContact O-CG1 3.28Å; T532-I536 PolarHBondContact O-N 3.07Å; I536-C538 PolarHBondContact O-N 3.48Å; I536-F539 PolarHBondContact O-N 2.77Å; I536-V540 HydrophobicContact CG2-CG2 4.34Å; I536-V540 VanDerWaalsContact O-CG2 3.3Å; I536-V540 WeakPolarHBondContact O-CG2 3.47Å; I536-V540 PolarHBondContact O-N 2.78Å
537	G	79.3	Confident	75.2	Confident	41 Å²	41	94.4 Å²	94.4	42%	0.423	52%	0.518	S	S	.	.	H	α-helix	trans	-58.8	-45.1	175	0	0	0	0	0	112.9	K533 I534 I535 V540 A541	K533-G537 PolarHBondContact O-N 2.81Å; I534-G537 PolarHBondContact O-N 2.78Å; I535-G537 VanDerWaalsContact C-N 3.34Å; G537-V540 PolarHBondContact O-N 2.92Å; G537-A541 WeakPolarHBondContact O-CB 3.44Å; G537-A541 PolarHBondContact O-N 2.77Å
538	C	80.3	Confident	76.7	Confident	69 Å²	69	90.6 Å²	90.6	47%	0.466	51%	0.505	S	S	.	.	H	α-helix	trans	-64.2	-40.7	174.7	-77.3	0	0	0	0	112	I534 I535 I536 A541 I542	I534-C538 WeakPolarHBondContact O-CB 3.42Å; I534-C538 PolarHBondContact O-N 2.74Å; I535-C538 PolarHBondContact O-N 3.27Å; I536-C538 PolarHBondContact O-N 3.48Å; C538-A541 PolarHBondContact O-N 2.9Å; C538-I542 WeakPolarHBondContact O-CB 3.45Å; C538-I542 WeakPolarHBondContact O-CD1 3.49Å; C538-I542 WeakPolarHBondContact O-CG1 3.33Å; C538-I542 PolarHBondContact O-N 2.87Å
539	F	80.4	Confident	78	Confident	146 Å²	146	92.3 Å²	92.3	64%	0.64	51%	0.509	S	S	*	.	H	α-helix	trans	-66.1	-40.6	178.7	-145.4	-89.4	0	0	0	111.6	I535 I536 T543	I535-F539 WeakPolarHBondContact O-CB 3.38Å; I535-F539 PolarHBondContact O-N 2.88Å; I536-F539 PolarHBondContact O-N 2.77Å; F539-T543 HydrophobicContact CD1-CG2 4.08Å; F539-T543 HydrophobicContact CE1-CG2 4.18Å; F539-T543 WeakPolarHBondContact O-CB 3.44Å; F539-T543 VanDerWaalsContact O-CG2 3.24Å; F539-T543 WeakPolarHBondContact O-CG2 3.28Å; F539-T543 PolarHBondContact O-N 2.92Å; F539-T543 PolarHBondContact O-OG1 2.9Å
540	V	86.4	Confident	79.4	Confident	81 Å²	81	93.3 Å²	93.3	49%	0.491	52%	0.515	S	S	.	.	H	α-helix	trans	-66.2	-42.3	174.1	175	0	0	0	0	110.8	I536 G537 T543 L544	I536-V540 HydrophobicContact CG2-CG2 4.34Å; I536-V540 VanDerWaalsContact O-CG2 3.3Å; I536-V540 WeakPolarHBondContact O-CG2 3.47Å; I536-V540 PolarHBondContact O-N 2.78Å; G537-V540 PolarHBondContact O-N 2.92Å; V540-T543 WeakPolarHBondContact CA-OG1 3.5Å; V540-T543 PolarHBondContact O-N 2.8Å; V540-T543 PolarHBondContact O-OG1 2.84Å; V540-L544 VanDerWaalsContact O-CB 3.24Å; V540-L544 WeakPolarHBondContact O-CB 3.11Å; V540-L544 PolarHBondContact O-N 2.99Å
541	A	82.1	Confident	80.5	Confident	52 Å²	52	92.1 Å²	92.1	43%	0.43	51%	0.514	S	S	.	.	H	α-helix	trans	-64.5	-43.5	177.1	0	0	0	0	0	112.4	G537 C538 L544 M545	G537-A541 WeakPolarHBondContact O-CB 3.44Å; G537-A541 PolarHBondContact O-N 2.77Å; C538-A541 PolarHBondContact O-N 2.9Å; A541-L544 PolarHBondContact O-N 3.2Å; A541-M545 WeakPolarHBondContact O-CB 3.21Å; A541-M545 VanDerWaalsContact O-CG 3.23Å; A541-M545 WeakPolarHBondContact O-CG 3.08Å; A541-M545 PolarHBondContact O-N 3.43Å
542	I	86.8	Confident	81.5	Confident	117 Å²	117	92.7 Å²	92.7	60%	0.6	51%	0.514	S	S	*	.	H	α-helix	trans	-64.8	-43.7	177.8	-69.5	164.9	0	0	0	110.7	C538 M545 A546	C538-I542 WeakPolarHBondContact O-CB 3.45Å; C538-I542 WeakPolarHBondContact O-CD1 3.49Å; C538-I542 WeakPolarHBondContact O-CG1 3.33Å; C538-I542 PolarHBondContact O-N 2.87Å; I542-M545 PolarHBondContact O-N 3Å; I542-A546 VanDerWaalsContact O-CB 3.29Å; I542-A546 WeakPolarHBondContact O-CB 3.49Å; I542-A546 PolarHBondContact O-N 3.41Å
543	T	82.9	Confident	82.4	Confident	70 Å²	70	96 Å²	96	43%	0.429	52%	0.523	S	S	.	.	H	α-helix	trans	-66.8	-37.3	178.5	50.2	0	0	0	0	112.2	F539 V540 A546 A547	F539-T543 HydrophobicContact CD1-CG2 4.08Å; F539-T543 HydrophobicContact CE1-CG2 4.18Å; F539-T543 WeakPolarHBondContact O-CB 3.44Å; F539-T543 VanDerWaalsContact O-CG2 3.24Å; F539-T543 WeakPolarHBondContact O-CG2 3.28Å; F539-T543 PolarHBondContact O-N 2.92Å; F539-T543 PolarHBondContact O-OG1 2.9Å; V540-T543 WeakPolarHBondContact CA-OG1 3.5Å; V540-T543 PolarHBondContact O-N 2.8Å; V540-T543 PolarHBondContact O-OG1 2.84Å; T543-A546 PolarHBondContact O-N 2.85Å; T543-A547 WeakPolarHBondContact O-CB 3.24Å; T543-A547 PolarHBondContact O-N 2.9Å
544	L	87.1	Confident	83.1	Confident	109 Å²	109	96.6 Å²	96.6	57%	0.571	52%	0.522	S	S	*	.	H	α-helix	trans	-70.8	-40.6	177.3	-154.4	147.7	0	0	0	111.5	V540 A541 A547 V548	V540-L544 VanDerWaalsContact O-CB 3.24Å; V540-L544 WeakPolarHBondContact O-CB 3.11Å; V540-L544 PolarHBondContact O-N 2.99Å; A541-L544 PolarHBondContact O-N 3.2Å; L544-A547 PolarHBondContact O-N 3.13Å; L544-V548 HydrophobicContact CD2-CG2 4.31Å; L544-V548 WeakPolarHBondContact O-CG2 3.4Å; L544-V548 PolarHBondContact O-N 2.68Å
545	M	86.6	Confident	82.9	Confident	123 Å²	123	98.5 Å²	98.5	61%	0.606	53%	0.526	S	S	*	.	H	α-helix	trans	-64.7	-40.3	172.7	-71.5	-66.2	-82.4	0	0	112	A541 I542 V548 M549	A541-M545 WeakPolarHBondContact O-CB 3.21Å; A541-M545 VanDerWaalsContact O-CG 3.23Å; A541-M545 WeakPolarHBondContact O-CG 3.08Å; A541-M545 PolarHBondContact O-N 3.43Å; I542-M545 PolarHBondContact O-N 3Å; M545-V548 PolarHBondContact O-N 3.07Å; M545-M549 WeakPolarHBondContact O-CB 3.31Å; M545-M549 VanDerWaalsContact O-CG 3.26Å; M545-M549 WeakPolarHBondContact O-CG 3.5Å; M545-M549 PolarHBondContact O-N 2.79Å
546	A	82.9	Confident	82.6	Confident	48 Å²	48	99.1 Å²	99.1	40%	0.397	53%	0.528	S	S	.	.	H	α-helix	trans	-63.7	-40	174.7	0	0	0	0	0	112	I542 T543 M549 L550	I542-A546 VanDerWaalsContact O-CB 3.29Å; I542-A546 WeakPolarHBondContact O-CB 3.49Å; I542-A546 PolarHBondContact O-N 3.41Å; T543-A546 PolarHBondContact O-N 2.85Å; A546-M549 PolarHBondContact O-N 2.67Å; A546-L550 WeakPolarHBondContact O-CB 3.47Å; A546-L550 WeakPolarHBondContact O-CG 3.29Å; A546-L550 PolarHBondContact O-N 3.29Å
547	A	85.8	Confident	82.5	Confident	48 Å²	48	103 Å²	103	40%	0.397	54%	0.537	S	S	.	.	H	α-helix	trans	-64.5	-43.4	175.2	0	0	0	0	0	111.9	T543 L544 L550 I551	T543-A547 WeakPolarHBondContact O-CB 3.24Å; T543-A547 PolarHBondContact O-N 2.9Å; L544-A547 PolarHBondContact O-N 3.13Å; A547-L550 PolarHBondContact O-N 2.78Å; A547-I551 VanDerWaalsContact O-CG1 3.28Å; A547-I551 WeakPolarHBondContact O-CG1 3.5Å; A547-I551 PolarHBondContact O-N 2.98Å
548	V	87.9	Confident	82.2	Confident	65 Å²	65	106.5 Å²	106.5	39%	0.394	54%	0.54	S	S	.	.	H	α-helix	trans	-62.1	-43.8	174.9	171.7	0	0	0	0	110.8	L544 M545 L550 I551 I552	L544-V548 HydrophobicContact CD2-CG2 4.31Å; L544-V548 WeakPolarHBondContact O-CG2 3.4Å; L544-V548 PolarHBondContact O-N 2.68Å; M545-V548 PolarHBondContact O-N 3.07Å; V548-L550 PolarHBondContact O-N 2.92Å; V548-I551 PolarHBondContact O-N 2.82Å; V548-I552 HydrophobicContact CG1-CD1 3.86Å; V548-I552 HydrophobicContact CG1-CG1 4.47Å; V548-I552 VanDerWaalsContact O-CG1 3.31Å; V548-I552 WeakPolarHBondContact O-CG1 3.38Å; V548-I552 PolarHBondContact O-N 3.23Å
549	M	84.4	Confident	81.6	Confident	125 Å²	125	108.8 Å²	108.8	62%	0.616	54%	0.544	S	S	*	.	H	α-helix	trans	-62.4	-40.2	176.2	-73.5	-63	-135.6	0	0	112.4	M545 A546 I552 F553	M545-M549 WeakPolarHBondContact O-CB 3.31Å; M545-M549 VanDerWaalsContact O-CG 3.26Å; M545-M549 WeakPolarHBondContact O-CG 3.5Å; M545-M549 PolarHBondContact O-N 2.79Å; A546-M549 PolarHBondContact O-N 2.67Å; M549-I552 PolarHBondContact O-N 3.48Å; M549-I552 HydrophobicContact SD-CD1 4.46Å; M549-F553 WeakPolarHBondContact O-CB 3.49Å; M549-F553 PolarHBondContact O-N 2.63Å
550	L	85.9	Confident	80.8	Confident	122 Å²	122	107.5 Å²	107.5	64%	0.639	54%	0.539	S	S	*	.	H	α-helix	trans	-65.8	-36.6	175	-75.7	169.7	0	0	0	112.5	A546 A547 V548 F553 Y554	A546-L550 WeakPolarHBondContact O-CB 3.47Å; A546-L550 WeakPolarHBondContact O-CG 3.29Å; A546-L550 PolarHBondContact O-N 3.29Å; A547-L550 PolarHBondContact O-N 2.78Å; V548-L550 PolarHBondContact O-N 2.92Å; L550-F553 PolarHBondContact O-N 3.05Å; L550-Y554 VanDerWaalsContact O-CB 3.28Å; L550-Y554 WeakPolarHBondContact O-CB 2.88Å; L550-Y554 PolarHBondContact O-N 2.75Å
551	I	85.4	Confident	79.5	Confident	108 Å²	108	109.5 Å²	109.5	55%	0.554	54%	0.543	S	S	*	.	H	α-helix	trans	-67.3	-42.1	174.9	-67.7	164.6	0	0	0	110.6	A547 V548 Y554 K555	A547-I551 VanDerWaalsContact O-CG1 3.28Å; A547-I551 WeakPolarHBondContact O-CG1 3.5Å; A547-I551 PolarHBondContact O-N 2.98Å; V548-I551 PolarHBondContact O-N 2.82Å; I551-Y554 PolarHBondContact O-N 2.93Å; I551-K555 PolarHBondContact O-N 3.45Å
552	I	83.2	Confident	78.2	Confident	84 Å²	84	112.5 Å²	112.5	43%	0.431	55%	0.549	S	S	.	.	H	α-helix	trans	-62	-46.1	174.6	-67.7	167	0	0	0	109.9	V548 M549 Y554 K555 M556	V548-I552 HydrophobicContact CG1-CD1 3.86Å; V548-I552 HydrophobicContact CG1-CG1 4.47Å; V548-I552 VanDerWaalsContact O-CG1 3.31Å; V548-I552 WeakPolarHBondContact O-CG1 3.38Å; V548-I552 PolarHBondContact O-N 3.23Å; M549-I552 PolarHBondContact O-N 3.48Å; M549-I552 HydrophobicContact SD-CD1 4.46Å; I552-Y554 VanDerWaalsContact C-N 3.34Å; I552-Y554 PolarHBondContact O-N 3.37Å; I552-K555 PolarHBondContact O-N 3.46Å; I552-M556 HydrophobicContact CG2-CG 4.47Å; I552-M556 HydrophobicContact CG2-SD 4.31Å; I552-M556 WeakPolarHBondContact O-CG 3.41Å; I552-M556 PolarHBondContact O-N 2.89Å
553	F	81.1	Confident	76.6	Confident	135 Å²	135	113.6 Å²	113.6	59%	0.592	55%	0.551	S	S	*	*	H	α-helix	trans	-62.8	-40.3	178	-156.1	-92.7	0	0	0	111.9	M549 L550 M556 R557	M549-F553 WeakPolarHBondContact O-CB 3.49Å; M549-F553 PolarHBondContact O-N 2.63Å; L550-F553 PolarHBondContact O-N 3.05Å; F553-M556 PolarHBondContact O-N 3.06Å; F553-R557 VanDerWaalsContact O-CB 3.29Å; F553-R557 WeakPolarHBondContact O-CB 3.28Å; F553-R557 PolarHBondContact O-N 3.27Å
554	Y	86.1	Confident	74.9	Confident	164 Å²	164	115.7 Å²	115.7	64%	0.643	56%	0.56	S	S	*	*	H	α-helix	trans	-64.4	-42.4	174.2	-177.7	-97.4	0	0	0	112	L550 I551 I552 R557 K558	L550-Y554 VanDerWaalsContact O-CB 3.28Å; L550-Y554 WeakPolarHBondContact O-CB 2.88Å; L550-Y554 PolarHBondContact O-N 2.75Å; I551-Y554 PolarHBondContact O-N 2.93Å; I552-Y554 VanDerWaalsContact C-N 3.34Å; I552-Y554 PolarHBondContact O-N 3.37Å; Y554-R557 PolarHBondContact O-N 3.04Å; Y554-K558 WeakPolarHBondContact O-CB 3.34Å; Y554-K558 PolarHBondContact O-N 2.87Å
555	K	71.2	Confident	72.9	Confident	152 Å²	152	117.1 Å²	117.1	66%	0.661	56%	0.563	S	S	*	*	H	α-helix	trans	-63.9	-45.1	174.6	-97.5	-169	170.7	-174.7	0	112.1	I551 I552 K558 Q559	I551-K555 PolarHBondContact O-N 3.45Å; I552-K555 PolarHBondContact O-N 3.46Å; K555-K558 PolarHBondContact O-N 3.38Å; K555-Q559 WeakPolarHBondContact O-CB 3.37Å; K555-Q559 PolarHBondContact O-N 2.96Å
556	M	71.4	Confident	70.6	Confident	122 Å²	122	119.2 Å²	119.2	60%	0.601	57%	0.571	S	S	*	*	H	α-helix	trans	-62.2	-43.2	176.5	-76.4	-172.9	65.8	0	0	111.7	I552 F553 K558 Q559 H560	I552-M556 HydrophobicContact CG2-CG 4.47Å; I552-M556 HydrophobicContact CG2-SD 4.31Å; I552-M556 WeakPolarHBondContact O-CG 3.41Å; I552-M556 PolarHBondContact O-N 2.89Å; F553-M556 PolarHBondContact O-N 3.06Å; M556-K558 PolarHBondContact O-N 2.88Å; M556-Q559 PolarHBondContact O-N 3.02Å; M556-H560 PolarHBondContact O-N 2.72Å
557	R	75.3	Confident	68.2	Low	183 Å²	183	120.6 Å²	120.6	69%	0.691	58%	0.582	S	S	*	*	H	α-helix	trans	-66.4	-36.9	177.2	-166.5	173.2	-175.4	156.4	3.4	112.3	F553 Y554 H560 H561	F553-R557 VanDerWaalsContact O-CB 3.29Å; F553-R557 WeakPolarHBondContact O-CB 3.28Å; F553-R557 PolarHBondContact O-N 3.27Å; Y554-R557 PolarHBondContact O-N 3.04Å; R557-H560 PolarHBondContact O-N 2.95Å; R557-H561 PolarHBondContact O-N 2.78Å
558	K	73.3	Confident	65.8	Low	114 Å²	114	124.3 Å²	124.3	50%	0.496	60%	0.602	S	S	.	*	H	α-helix	trans	-66.1	-38.9	173.5	-172.3	176.5	-179.8	179.8	0	111.8	Y554 K555 M556 H561 Q562	Y554-K558 WeakPolarHBondContact O-CB 3.34Å; Y554-K558 PolarHBondContact O-N 2.87Å; K555-K558 PolarHBondContact O-N 3.38Å; M556-K558 PolarHBondContact O-N 2.88Å; K558-H561 PolarHBondContact O-N 3.5Å; K558-Q562 WeakPolarHBondContact O-CG 3.25Å; K558-Q562 PolarHBondContact O-N 3.48Å
559	Q	68.3	Low	63	Low	116 Å²	116	127.2 Å²	127.2	54%	0.542	62%	0.621	S	S	.	*	H	α-helix	trans	-66.7	-39.9	175.8	-166.1	172.9	-0.3	0	0	111.7	K555 M556 H561 Q562 Q563	K555-Q559 WeakPolarHBondContact O-CB 3.37Å; K555-Q559 PolarHBondContact O-N 2.96Å; M556-Q559 PolarHBondContact O-N 3.02Å; Q559-H561 VanDerWaalsContact C-N 3.31Å; Q559-H561 PolarHBondContact O-N 2.88Å; Q559-Q562 PolarHBondContact O-N 3.06Å; Q559-Q563 PolarHBondContact O-N 3.13Å
560	H	61.8	Low	60.6	Low	119 Å²	119	132.4 Å²	132.4	55%	0.551	63%	0.634	S	S	*	*	H	α-helix	trans	-64.4	-33.5	172.1	-168.9	-76.6	0	0	0	112.4	M556 R557	M556-H560 PolarHBondContact O-N 2.72Å; R557-H560 PolarHBondContact O-N 2.95Å
561	H	60.3	Low	57.9	Low	123 Å²	123	132.7 Å²	132.7	57%	0.569	64%	0.64	S	S	*	*	H	α-helix	trans	-74.9	-31.2	175.7	-139	50.2	0	0	0	112.9	R557 K558 Q559 H565	R557-H561 PolarHBondContact O-N 2.78Å; K558-H561 PolarHBondContact O-N 3.5Å; Q559-H561 VanDerWaalsContact C-N 3.31Å; Q559-H561 PolarHBondContact O-N 2.88Å; H561-H565 PolarHBondContact O-CD2 3.08Å
562	Q	54.1	Low	55.2	Low	116 Å²	116	134.7 Å²	134.7	54%	0.542	65%	0.651	S	S	.	*	H	α-helix	trans	-73.9	-32.3	175.1	-75.6	178.7	-29	0	0	112.8	K558 Q559 N564 H565	K558-Q562 WeakPolarHBondContact O-CG 3.25Å; K558-Q562 PolarHBondContact O-N 3.48Å; Q559-Q562 PolarHBondContact O-N 3.06Å; Q562-N564 VanDerWaalsContact C-N 3.28Å; Q562-N564 PolarHBondContact O-N 3.1Å; Q562-H565 PolarHBondContact O-N 2.66Å
563	Q	53.7	Low	52.6	Low	139 Å²	139	139.2 Å²	139.2	65%	0.65	67%	0.67	S	S	*	*	H	α-helix	trans	-67.5	-26.1	173.7	-76.7	-176.6	-15.6	0	0	113.2	Q559 H565	Q559-Q563 PolarHBondContact O-N 3.13Å; Q563-H565 VanDerWaalsContact C-N 3.27Å; Q563-H565 PolarHBondContact O-N 3.34Å
564	N	47.1	Very low	50.1	Low	114 Å²	114	139.6 Å²	139.6	61%	0.61	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	-6.5	173.9	-78	-4.5	0	0	0	114.4	Q562	Q562-N564 VanDerWaalsContact C-N 3.28Å; Q562-N564 PolarHBondContact O-N 3.1Å
565	H	44.9	Very low	47.3	Very low	140 Å²	140	138.9 Å²	138.9	65%	0.648	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.1	4.2	-179.5	-79.7	-58.9	0	0	0	114.8	H561 Q562 Q563	H561-H565 PolarHBondContact O-CD2 3.08Å; Q562-H565 PolarHBondContact O-N 2.66Å; Q563-H565 VanDerWaalsContact C-N 3.27Å; Q563-H565 PolarHBondContact O-N 3.34Å
566	H	39.3	Very low	45.2	Very low	166 Å²	166	138.1 Å²	138.1	77%	0.769	69%	0.686	S	S	*	*			trans	-119.5	59.2	173.5	-68.1	-45.3	0	0	0	111.6
567	A	31.1	Very low	43.2	Very low	77 Å²	77	138.5 Å²	138.5	64%	0.636	70%	0.695	S	S	*	*	S	Bend	trans	-88.1	127.2	148.2	0	0	0	0	0	107.2	T569	A567-T569 PolarHBondContact O-N 3.47Å; A567-T569 VanDerWaalsContact O-N 3.07Å
568	P	35.4	Very low	41	Very low	126 Å²	126	136.9 Å²	136.9	82%	0.818	70%	0.699	S	S	*	*			trans	-68.6	111.9	-179.9	27	-30.5	0	0	0	109.1	R570	P568-R570 PolarHBondContact O-N 3.25Å; P568-R570 VanDerWaalsContact O-N 3.07Å
569	T	30.7	Very low	39.1	Very low	127 Å²	127	140.4 Å²	140.4	78%	0.779	72%	0.718	S	S	*	*			trans	-66.7	101.5	168	-36.1	0	0	0	0	107.4	A567 T571	A567-T569 PolarHBondContact O-N 3.47Å; A567-T569 VanDerWaalsContact O-N 3.07Å; T569-T571 PolarHBondContact O-N 3.26Å; T569-T571 VanDerWaalsContact O-N 3.09Å
570	R	32.8	Very low	37.1	Very low	234 Å²	234	143 Å²	143	88%	0.883	74%	0.735	S	S	*	*			trans	-64	107.7	161.8	-87.2	-177.9	169.3	158	-2.9	106.9	P568 I572	P568-R570 PolarHBondContact O-N 3.25Å; P568-R570 VanDerWaalsContact O-N 3.07Å; R570-I572 PolarHBondContact O-N 3.43Å
571	T	28.7	Very low	35.4	Very low	127 Å²	127	142.9 Å²	142.9	78%	0.779	75%	0.746	S	S	*	*			trans	-63.9	106.4	170.3	43	0	0	0	0	108.8	T569	T569-T571 PolarHBondContact O-N 3.26Å; T569-T571 VanDerWaalsContact O-N 3.09Å
572	I	30.3	Very low	33.8	Very low	151 Å²	151	142.7 Å²	142.7	77%	0.774	75%	0.754	S	S	*	*			trans	-90	103.3	161.9	-62.5	171.2	0	0	0	105.1	R570	R570-I572 PolarHBondContact O-N 3.43Å
573	E	26.9	Very low	32.6	Very low	178 Å²	178	143.7 Å²	143.7	83%	0.832	77%	0.768	S	S	*	*			trans	-70.6	124.5	165.6	-83.9	-175.7	156	0	0	108.9
574	I	29.6	Very low	31.3	Very low	143 Å²	143	140.9 Å²	140.9	73%	0.733	78%	0.776	S	S	*	*			trans	-80.9	114.2	173.2	-63.3	165.6	0	0	0	106.6
575	I	27.5	Very low	30.2	Very low	150 Å²	150	139.1 Å²	139.1	77%	0.769	79%	0.785	S	S	*	*			trans	-85.9	110	161	-62.2	173.7	0	0	0	106.2	V577	I575-V577 HydrophobicContact CG2-CG2 4.11Å
576	N	27.2	Very low	30	Very low	136 Å²	136	139.2 Å²	139.2	73%	0.727	80%	0.798	S	S	*	*			trans	-62.4	131.5	162.2	-85.9	-0.4	0	0	0	108.4
577	V	29	Very low	29.4	Very low	130 Å²	130	134.9 Å²	134.9	79%	0.788	80%	0.798	S	S	*	*			trans	-122.6	114.1	162	-176.2	0	0	0	0	106.6	I575	I575-V577 HydrophobicContact CG2-CG2 4.11Å
578	D	29.5	Very low	29.3	Very low	148 Å²	148	140.5 Å²	140.5	79%	0.791	81%	0.814	S	S	*	*			trans	-65	142.4	174.2	-67.7	-53.7	0	0	0	111
579	E	33.3	Very low	29	Very low	189 Å²	189	143.7 Å²	143.7	88%	0.883	82%	0.818	S	S	*	*			trans	-72.4	129.6	163.2	-87.2	-167.3	138.8	0	0	109.8
580	D	26.9	Very low	29	Very low	170 Å²	170	141.4 Å²	141.4	91%	0.909	82%	0.819	S	S	*	*			trans	-156.7	155.8	148.5	-100.7	-29.9	0	0	0	111.6
581	C	25.4	Very low	28.8	Very low	116 Å²	116	138.8 Å²	138.8	78%	0.784	82%	0.817	S	S	*	*			trans	-82.1	151.5	-151.1	-106.4	0	0	0	0	118.4
582	V	27.1	Very low	28.8	Very low	119 Å²	119	140 Å²	140	72%	0.721	82%	0.817	S	S	*	*			trans	90.8	126.6	130.4	172.9	0	0	0	0	122.3
583	T	27.9	Very low	28.8	Very low	138 Å²	138	138.3 Å²	138.3	85%	0.847	81%	0.814	S	S	*	*			trans	83.1	123.8	151	52.3	0	0	0	0	124.1
584	G	26.6	Very low	28.9	Very low	79 Å²	79	138 Å²	138	81%	0.814	82%	0.817	S	S	*	*			trans	111.3	108.1	136.6	0	0	0	0	0	117.5
585	G	24.8	Very low	28.9	Very low	78 Å²	78	136.9 Å²	136.9	80%	0.804	82%	0.82	S	S	*	*			trans	-83	-160	164.3	0	0	0	0	0	112.6
586	P	40.4	Very low	29	Very low	142 Å²	142	135.1 Å²	135.1	92%	0.922	82%	0.82	S	S	*	*			cis	-126.8	170.2	-26.7	38.3	-23	0	0	0	113
587	G	26.7	Very low	29	Very low	74 Å²	74	136.1 Å²	136.1	76%	0.763	83%	0.825	S	S	*	*			trans	141	125.3	150.7	0	0	0	0	0	119.9
588	M	28	Very low	28.9	Very low	196 Å²	196	138.5 Å²	138.5	97%	0.966	83%	0.827	S	S	*	*			trans	86.7	137.7	143.7	-87	-174.1	160.9	0	0	123.6
589	E	29.8	Very low	28.9	Very low	193 Å²	193	140.9 Å²	140.9	90%	0.902	83%	0.833	S	S	*	*			trans	-67.7	158.8	-176.7	-59.7	172.5	139.9	0	0	114.5
590	G	29.9	Very low	28.7	Very low	78 Å²	78	140.4 Å²	140.4	80%	0.804	83%	0.831	S	S	*	*			trans	-175.8	94.1	169	0	0	0	0	0	113.7
591	H	29.3	Very low	28.8	Very low	180 Å²	180	140 Å²	140	83%	0.833	82%	0.823	S	S	*	*			trans	-56.5	144.7	164.4	-134.6	-80.6	0	0	0	111.2
592	L	28.7	Very low	28.9	Very low	152 Å²	152	141.7 Å²	141.7	80%	0.796	82%	0.824	S	S	*	*			trans	168.1	113.8	134.6	-88.4	151.9	0	0	0	114.3
593	T	30.1	Very low	28.9	Very low	116 Å²	116	143.3 Å²	143.3	71%	0.712	83%	0.829	S	S	*	*			trans	9.7	132.9	140.5	55.3	0	0	0	0	122.2
594	L	28.4	Very low	28.9	Very low	171 Å²	171	144.3 Å²	144.3	90%	0.895	82%	0.823	S	S	*	*			trans	-82.1	152.5	161.5	-89.1	140.4	0	0	0	112.9
595	P	31.6	Very low	29	Very low	120 Å²	120	149.5 Å²	149.5	78%	0.779	82%	0.82	S	S	*	*			trans	-117.4	157	152.4	35.5	-22.9	0	0	0	113.9
596	S	29.1	Very low	29.1	Very low	112 Å²	112	152 Å²	152	78%	0.783	81%	0.814	S	S	*	*			trans	-88.4	155.2	-178	51	0	0	0	0	114.4
597	L	27	Very low	28.5	Very low	158 Å²	158	150.1 Å²	150.1	83%	0.827	80%	0.8	S	S	*	*			trans	-150.8	105.5	157.9	-91.5	137.2	0	0	0	107.4
598	E	26.8	Very low	28.6	Very low	180 Å²	180	158.2 Å²	158.2	84%	0.841	81%	0.81	S	S	*	*				65.8	119.5	93.5	-82.8	-174.1	164.6	0	0	115.4
599	H	29	Very low	28.5	Very low	197 Å²	197	157.9 Å²	157.9	91%	0.912	80%	0.803	S	S	*	*			trans	-109	125.8	175.3	-96.2	45.8	0	0	0	108.9
600	E	28.6	Very low	28.4	Very low	179 Å²	179	155.7 Å²	155.7	84%	0.836	80%	0.803	S	S	*	*			trans	-100.6	130.2	168	-80.1	-162.1	139.9	0	0	112.4
601	H	29.4	Very low	28.3	Very low	161 Å²	161	155.5 Å²	155.5	75%	0.745	79%	0.793	S	S	*	*			trans	35.7	123.9	136	-64.3	-85.5	0	0	0	121.4
602	L	28.2	Very low	28.2	Very low	152 Å²	152	158 Å²	158	80%	0.796	80%	0.797	S	S	*	*				-176.9	131.3	89.4	-117.3	107	0	0	0	112.4
603	N	27.8	Very low	28.1	Very low	154 Å²	154	157.8 Å²	157.8	82%	0.824	80%	0.797	S	S	*	*			trans	-110.1	149	167.4	-102	-22.1	0	0	0	109.4
604	H	27.6	Very low	28.1	Very low	158 Å²	158	161.3 Å²	161.3	73%	0.731	81%	0.805	S	S	*	*			trans	-137.4	109.4	155	-101	43.8	0	0	0	107.3
605	Y	28.9	Very low	28	Very low	189 Å²	189	157.5 Å²	157.5	74%	0.741	80%	0.798	S	S	*	*				66	131	105	-86.4	-65.9	0	0	0	114.1
606	N	26.2	Very low	27.8	Very low	130 Å²	130	157.6 Å²	157.6	70%	0.695	80%	0.802	S	S	*	*			cis	-152.5	134.3	22	-95.5	-61.4	0	0	0	108.6
607	T	27.2	Very low	27.7	Very low	102 Å²	102	156.8 Å²	156.8	63%	0.626	80%	0.802	S	S	*	*				65.2	109.4	83	-26.9	0	0	0	0	115.9
608	Y	28.7	Very low	27.7	Very low	244 Å²	244	157 Å²	157	96%	0.957	80%	0.801	S	S	*	*				-157.8	121.2	125.2	-93.4	-73.1	0	0	0	109.1
609	K	26.4	Very low	27.8	Very low	190 Å²	190	155 Å²	155	83%	0.826	80%	0.795	S	S	*	*			trans	-126.3	135.2	179.3	-166.1	-178.1	-171.4	-179.6	0	106.8
610	T	26.6	Very low	27.6	Very low	147 Å²	147	149.9 Å²	149.9	90%	0.902	78%	0.782	S	S	*	*			trans	-120.1	122.9	159.1	40.8	0	0	0	0	108.2
611	A	28	Very low	27.5	Very low	73 Å²	73	148.4 Å²	148.4	60%	0.603	78%	0.778	S	S	*	*			trans	-92.7	149	179.9	0	0	0	0	0	110.6
612	Y	27.2	Very low	27.5	Very low	233 Å²	233	149.3 Å²	149.3	91%	0.914	78%	0.783	S	S	*	*			trans	-136.9	119.8	146	-100.7	-82.2	0	0	0	108.3
613	N	27.7	Very low	27.5	Very low	148 Å²	148	146.9 Å²	146.9	79%	0.791	78%	0.778	S	S	*	*			trans	-82.9	141.9	168.4	-83.2	-21.8	0	0	0	108.9
614	H	29.1	Very low	27.5	Very low	189 Å²	189	145.3 Å²	145.3	88%	0.875	78%	0.779	S	S	*	*			trans	-144.8	119.6	140	-112.4	-73.2	0	0	0	108.8
615	A	26.6	Very low	27.6	Very low	92 Å²	92	142.2 Å²	142.2	76%	0.76	78%	0.781	S	S	*	*			trans	-101.3	138.3	169	0	0	0	0	0	108.5
616	S	27.8	Very low	27.7	Very low	122 Å²	122	142.5 Å²	142.5	85%	0.853	79%	0.789	S	S	*	*			trans	-160.3	119.5	151.1	32	0	0	0	0	108.7
617	A	27.5	Very low	27.9	Very low	95 Å²	95	145 Å²	145	79%	0.785	80%	0.797	S	S	*	*			trans	-98.4	144.4	174.6	0	0	0	0	0	109.9
618	M	27.5	Very low	28.1	Very low	163 Å²	163	145.9 Å²	145.9	80%	0.803	80%	0.804	S	S	*	*				164.9	132.7	114.6	-95	-169.9	162.3	0	0	113.3
619	N	27.2	Very low	28	Very low	136 Å²	136	142.2 Å²	142.2	73%	0.727	80%	0.8	S	S	*	*			trans	71.5	134.1	140.8	-63.8	-3.7	0	0	0	118.9
620	S	25.2	Very low	27.9	Very low	91 Å²	91	141 Å²	141	64%	0.636	80%	0.802	S	S	*	*			cis	-164.9	143.5	15.1	-88.6	0	0	0	0	112
621	I	27.7	Very low	27.9	Very low	147 Å²	147	141.7 Å²	141.7	75%	0.754	80%	0.798	S	S	*	*			trans	52.6	109.3	131.8	-49.6	167	0	0	0	119.7
622	H	28.1	Very low	27.8	Very low	181 Å²	181	149.1 Å²	149.1	84%	0.838	81%	0.81	S	S	*	*				-159.9	139.5	116.2	-121.8	-79.8	0	0	0	112.2
623	S	28.8	Very low	27.7	Very low	100 Å²	100	142.8 Å²	142.8	70%	0.699	81%	0.806	S	S	*	*			trans	-78.3	147.1	-173.5	56.2	0	0	0	0	115
624	S	28.4	Very low	27.7	Very low	121 Å²	121	142.1 Å²	142.1	85%	0.846	81%	0.808	S	S	*	*				-168.3	124.4	122.7	52.9	0	0	0	0	110.9
625	A	29.3	Very low	27.7	Very low	93 Å²	93	138 Å²	138	77%	0.769	80%	0.8	S	S	*	*			trans	-92.8	140.5	171	0	0	0	0	0	109
626	H	30.1	Very low	27.8	Very low	196 Å²	196	142.4 Å²	142.4	91%	0.907	80%	0.802	S	S	*	*			trans	-142.7	126.2	153.8	-97.4	-68.6	0	0	0	109.6
627	E	30.2	Very low	27.9	Very low	183 Å²	183	142.8 Å²	142.8	86%	0.855	79%	0.794	S	S	*	*			trans	-60.8	157.8	178.4	-86.8	168.2	126.4	0	0	114.5
628	P	31.1	Very low	27.9	Very low	119 Å²	119	145.3 Å²	145.3	77%	0.773	80%	0.795	S	S	*	*			trans	-82.4	130.9	168.5	32.6	-29.8	0	0	0	112.1	L630	P628-L630 PolarHBondContact O-N 3.33Å
629	L	26.9	Very low	28	Very low	168 Å²	168	144 Å²	144	88%	0.88	80%	0.795	S	S	*	*			trans	-69	109.7	173.7	-91.6	151.3	0	0	0	111.6
630	L	24.9	Very low	28.1	Very low	165 Å²	165	146.6 Å²	146.6	86%	0.864	80%	0.803	S	S	*	*			trans	-82.5	111	162.6	-93.9	143.5	0	0	0	109.4	P628 R632	P628-L630 PolarHBondContact O-N 3.33Å; L630-R632 PolarHBondContact O-N 3.49Å
631	I	26.3	Very low	28.3	Very low	161 Å²	161	150.8 Å²	150.8	83%	0.826	81%	0.813	S	S	*	*			trans	-84.3	113.5	168.9	-63.3	176	0	0	0	108.7
632	R	25.9	Very low	28.3	Very low	229 Å²	229	150.6 Å²	150.6	86%	0.864	82%	0.819	S	S	*	*			trans	-84.9	117.1	176.1	-157.8	175.6	-170.9	173.9	2.1	108.5	L630	L630-R632 PolarHBondContact O-N 3.49Å
633	A	24.5	Very low	28.3	Very low	100 Å²	100	150.7 Å²	150.7	83%	0.826	82%	0.82	S	S	*	*			trans	-75.5	125.9	172	0	0	0	0	0	110.3
634	T	27.7	Very low	28.6	Very low	134 Å²	134	157.6 Å²	157.6	82%	0.822	85%	0.846	S	S	*	*			trans	-109.2	130.8	167	46.7	0	0	0	0	110
635	S	29.1	Very low	28.6	Very low	102 Å²	102	159.4 Å²	159.4	71%	0.713	85%	0.846	S	S	*	*			trans	-80.7	157.8	-179.1	58.9	0	0	0	0	114
636	K	29.8	Very low	28.6	Very low	185 Å²	185	162.9 Å²	162.9	80%	0.804	85%	0.85	S	S	*	*			trans	72.4	130.6	152.5	-80.2	-179.7	177.9	-178.5	0	115.6
637	D	29	Very low	28.5	Very low	129 Å²	129	161.1 Å²	161.1	69%	0.69	85%	0.847	S	S	*	*			cis	-165.3	165.7	49.2	-99.9	-34	0	0	0	113.7
638	N	28.8	Very low	28.4	Very low	149 Å²	149	159.8 Å²	159.8	80%	0.797	85%	0.846	S	S	*	*			trans	94.2	104.9	148.5	-63.6	-22	0	0	0	122.1
639	V	28.8	Very low	28.3	Very low	134 Å²	134	162.3 Å²	162.3	81%	0.812	85%	0.851	S	S	*	*			trans	-49.7	134.3	148.7	175.7	0	0	0	0	111.7
640	Q	30.4	Very low	28.4	Very low	192 Å²	192	161.9 Å²	161.9	90%	0.897	85%	0.849	S	S	*	*			trans	-150.4	121.2	144	-117.9	179.7	-0.4	0	0	110.6
641	E	28.3	Very low	28.6	Very low	178 Å²	178	161.7 Å²	161.7	83%	0.832	85%	0.848	S	S	*	*			trans	-62	138.1	162.2	-69	170	131.8	0	0	110.2
642	T	28.7	Very low	28.8	Very low	143 Å²	143	161.8 Å²	161.8	88%	0.877	85%	0.85	S	S	*	*			trans	-147.3	128.8	142.4	30.5	0	0	0	0	110.2
643	Q	28.3	Very low	29	Very low	184 Å²	184	156.2 Å²	156.2	86%	0.86	85%	0.849	S	S	*	*			trans	-60.1	139.7	166.6	-66	166.4	-24.7	0	0	110.5
644	I	35.1	Very low	29.4	Very low	244 Å²	244	161.3 Å²	161.3	100%	1.251	85%	0.851	S	S	*	*				-165.2	0	116.3	-84.9	152	0	0	0	107.3

Retrieved 644 of 644 residues in 267.8 ms (Link to these results)

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