LRC4C_HUMAN Loading...

Leucine-rich repeat-containing protein 4C

May promote neurite outgrowth of developing thalamic neurons.

AlphaFold DB , UniProt , Accession Q9HCJ2, Species HUMAN (Homo sapiens, Human), Gene LRRC4C, Length 640 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	40	Very low	39.7	Very low	236 Å²	236	156 Å²	156	100%	1.163	79%	0.788	S	S	*	*				0	171.2	0	-80.9	-178.9	167.2	0	0	109.3
2	L	37.6	Very low	39.7	Very low	156 Å²	156	154.7 Å²	154.7	82%	0.817	78%	0.782	S	S	*	*			trans	-12	156.6	162	-78.5	82.6	0	0	0	119.8
3	N	38	Very low	39.8	Very low	122 Å²	122	154.5 Å²	154.5	65%	0.652	78%	0.78	S	S	*	*			cis	-178.9	140.7	-22.4	-149.3	-12.2	0	0	0	109.1
4	K	40.5	Very low	40.1	Very low	165 Å²	165	154.7 Å²	154.7	72%	0.717	78%	0.781	S	S	*	*			trans	58.7	168.2	161.3	-72	166.5	-178.9	-176.1	0	116.3
5	M	42.4	Very low	40	Very low	151 Å²	151	149 Å²	149	74%	0.744	78%	0.777	S	S	*	*			cis	-148.9	135.1	3.5	-122.4	133.9	169.7	0	0	105
6	T	40	Very low	40.3	Very low	111 Å²	111	147.8 Å²	147.8	68%	0.681	78%	0.781	S	S	*	*				45.1	132.8	64.6	68.4	0	0	0	0	114.3
7	L	37.9	Very low	40.7	Very low	145 Å²	145	153.4 Å²	153.4	76%	0.759	79%	0.789	S	S	*	*			cis	-166.9	166.6	-2.2	-135.3	75.9	0	0	0	105.6
8	H	39.3	Very low	40.8	Very low	163 Å²	163	155.9 Å²	155.9	76%	0.755	79%	0.793	S	S	*	*			cis	-158.4	174.5	-6.2	-141.1	18.4	0	0	0	107.5
9	P	40.1	Very low	41.2	Very low	106 Å²	106	154.2 Å²	154.2	69%	0.688	79%	0.786	S	S	*	*			trans	-91.5	158.6	-172.9	36.8	-35.3	0	0	0	115.3
10	Q	40.9	Very low	41.7	Very low	193 Å²	193	159.1 Å²	159.1	90%	0.902	79%	0.794	S	S	*	*			trans	-133.1	116.6	157.1	-77.7	-169.7	-29.6	0	0	112
11	Q	39.4	Very low	42.3	Very low	168 Å²	168	155.6 Å²	155.6	79%	0.785	79%	0.79	S	S	*	*			trans	19.3	117	142.2	-67.8	-176.1	-23.4	0	0	118.6
12	I	40.7	Very low	43	Very low	140 Å²	140	151.4 Å²	151.4	72%	0.718	77%	0.772	S	S	*	*				76.1	124.5	95.1	-72.5	169.8	0	0	0	112
13	M	39.9	Very low	43.8	Very low	153 Å²	153	151.9 Å²	151.9	75%	0.754	77%	0.768	S	S	*	*			cis	-160.7	174.4	18.6	-141.5	-168.2	-54	0	0	113.9
14	I	44	Very low	45.1	Very low	157 Å²	157	150.1 Å²	150.1	81%	0.805	76%	0.758	S	S	*	*			trans	76.7	125.3	156.2	-62.5	152.7	0	0	0	118.6
15	G	39.6	Very low	46.7	Very low	69 Å²	69	146.7 Å²	146.7	71%	0.711	75%	0.753	S	S	*	*			trans	149	68.1	163.4	0	0	0	0	0	116.5
16	P	44.1	Very low	48.3	Very low	129 Å²	129	145.1 Å²	145.1	84%	0.838	75%	0.747	S	S	*	*			trans	-89	119.6	-170.7	33.5	-32.9	0	0	0	114.3
17	R	47.1	Very low	50.1	Low	243 Å²	243	144.2 Å²	144.2	92%	0.917	74%	0.738	S	S	*	*			trans	-150.9	31.1	173.2	-119.5	-176.5	-168.5	-165.6	3.7	117.2
18	F	43.6	Very low	52.1	Low	200 Å²	200	141.8 Å²	141.8	88%	0.877	73%	0.728	S	S	*	*			trans	-131.2	167.2	169.9	-92.6	-92.2	0	0	0	111.5
19	N	46.7	Very low	54.2	Low	122 Å²	122	138.1 Å²	138.1	65%	0.652	72%	0.717	S	S	*	*			trans	68.6	90.6	-175	-60.3	-14.3	0	0	0	115.9
20	R	52.2	Low	56.3	Low	252 Å²	252	137.4 Å²	137.4	95%	0.951	71%	0.707	S	S	*	*	S	Bend	trans	-140.4	11	167.8	-113.8	-174.9	-174.5	-162.9	0.4	116.3
21	A	54	Low	58.4	Low	86 Å²	86	133.1 Å²	133.1	71%	0.711	69%	0.69	S	S	*	*	S	Bend	trans	-126	-5	-178.3	0	0	0	0	0	115
22	L	54.1	Low	60.4	Low	149 Å²	149	127.3 Å²	127.3	78%	0.78	67%	0.67	S	S	*	*	S	Bend	trans	-115.9	8.3	179.6	-83	162	0	0	0	113.1
23	F	56	Low	62.3	Low	166 Å²	166	125.1 Å²	125.1	73%	0.728	66%	0.66	S	S	*	*			trans	-130.9	32.1	-179.4	-86.5	-82.7	0	0	0	111.3	P25	F23-P25 VanDerWaalsContact O-CD 3.3Å; F23-P25 WeakPolarHBondContact O-CD 3.18Å
24	D	64.9	Low	64.1	Low	84 Å²	84	124 Å²	124	45%	0.449	65%	0.653	S	S	.	*			trans	-76.5	112.5	166.9	-170.6	-25.1	0	0	0	108.7	L26 L27 V28	D24-L26 PolarHBondContact O-N 3.24Å; D24-L26 WeakPolarHBondContact OD1-CB 3.3Å; D24-L26 PolarHBondContact OD1-N 3.36Å; D24-L27 HydrophobicContact CB-CB 4.21Å; D24-L27 PolarHBondContact O-N 2.99Å; D24-V28 PolarHBondContact O-N 3.26Å
25	P	72.9	Confident	65.5	Low	94 Å²	94	122.4 Å²	122.4	61%	0.61	65%	0.645	S	S	*	*	H	α-helix	trans	-63.4	-25.2	-180	28.3	-35.6	0	0	0	112	F23 V28 V29	F23-P25 VanDerWaalsContact O-CD 3.3Å; F23-P25 WeakPolarHBondContact O-CD 3.18Å; P25-V28 PolarHBondContact O-N 2.85Å; P25-V29 WeakPolarHBondContact O-CB 3.36Å; P25-V29 VanDerWaalsContact O-CG2 3.26Å; P25-V29 WeakPolarHBondContact O-CG2 3.38Å; P25-V29 PolarHBondContact O-N 2.94Å
26	L	76.8	Confident	67.1	Low	117 Å²	117	124.9 Å²	124.9	61%	0.613	64%	0.641	S	S	*	*	H	α-helix	trans	-71.3	-34	-179	-156.1	143.8	0	0	0	111.2	D24 L30	D24-L26 PolarHBondContact O-N 3.24Å; D24-L26 WeakPolarHBondContact OD1-CB 3.3Å; D24-L26 PolarHBondContact OD1-N 3.36Å; L26-L30 HydrophobicContact CD2-CD1 4.04Å; L26-L30 WeakPolarHBondContact O-CB 3.22Å; L26-L30 PolarHBondContact O-N 2.88Å
27	L	76.9	Confident	68.2	Low	93 Å²	93	122.8 Å²	122.8	49%	0.487	63%	0.626	S	S	.	*	H	α-helix	trans	-68.9	-41.6	172.2	-172.3	69.4	0	0	0	111.9	D24 L30 L31	D24-L27 HydrophobicContact CB-CB 4.21Å; D24-L27 PolarHBondContact O-N 2.99Å; L27-L30 PolarHBondContact O-N 3.37Å; L27-L31 PolarHBondContact O-N 3.35Å
28	V	80.5	Confident	68.9	Low	93 Å²	93	115 Å²	115	56%	0.564	61%	0.606	S	S	*	*	H	α-helix	trans	-65	-42.2	176.1	179.4	0	0	0	0	110.9	D24 P25 L31 A32	D24-V28 PolarHBondContact O-N 3.26Å; P25-V28 PolarHBondContact O-N 2.85Å; V28-L31 PolarHBondContact O-N 3.44Å; V28-A32 WeakPolarHBondContact O-CB 3.4Å; V28-A32 PolarHBondContact O-N 3.38Å
29	V	83.6	Confident	69.7	Low	87 Å²	87	108.5 Å²	108.5	53%	0.527	59%	0.589	S	S	.	*	H	α-helix	trans	-64	-40.1	174.6	166	0	0	0	0	111.5	P25 A32 L33	P25-V29 WeakPolarHBondContact O-CB 3.36Å; P25-V29 VanDerWaalsContact O-CG2 3.26Å; P25-V29 WeakPolarHBondContact O-CG2 3.38Å; P25-V29 PolarHBondContact O-N 2.94Å; V29-A32 PolarHBondContact O-N 2.84Å; V29-L33 HydrophobicContact CG1-CD1 3.92Å; V29-L33 WeakPolarHBondContact O-CB 3.26Å; V29-L33 PolarHBondContact O-N 3.37Å
30	L	84.2	Confident	70.1	Confident	90 Å²	90	104.9 Å²	104.9	47%	0.471	58%	0.58	S	S	.	*	H	α-helix	trans	-62.6	-43.4	174.2	-98.8	162.9	0	0	0	112.7	L26 L27 L33 Q34	L26-L30 HydrophobicContact CD2-CD1 4.04Å; L26-L30 WeakPolarHBondContact O-CB 3.22Å; L26-L30 PolarHBondContact O-N 2.88Å; L27-L30 PolarHBondContact O-N 3.37Å; L30-L33 PolarHBondContact O-N 2.9Å; L30-Q34 WeakPolarHBondContact O-CB 3.29Å; L30-Q34 VanDerWaalsContact O-CG 3.22Å; L30-Q34 WeakPolarHBondContact O-CG 3.45Å; L30-Q34 PolarHBondContact O-N 2.93Å
31	L	84.2	Confident	70	Confident	104 Å²	104	99.5 Å²	99.5	55%	0.545	57%	0.569	S	S	.	*	H	α-helix	trans	-66.6	-38.8	175.6	-76.1	165.9	0	0	0	112.1	L27 V28 Q34 L35	L27-L31 PolarHBondContact O-N 3.35Å; V28-L31 PolarHBondContact O-N 3.44Å; L31-Q34 PolarHBondContact O-N 3.37Å; L31-L35 WeakPolarHBondContact O-CB 3.44Å; L31-L35 WeakPolarHBondContact O-CG 3.49Å; L31-L35 PolarHBondContact O-N 2.86Å
32	A	81.6	Confident	69.7	Low	45 Å²	45	100.1 Å²	100.1	37%	0.372	56%	0.564	S	S	.	*	H	α-helix	trans	-65.7	-39.4	173.8	0	0	0	0	0	112.1	V28 V29 L35 L36	V28-A32 WeakPolarHBondContact O-CB 3.4Å; V28-A32 PolarHBondContact O-N 3.38Å; V29-A32 PolarHBondContact O-N 2.84Å; A32-L35 PolarHBondContact O-N 2.82Å; A32-L36 WeakPolarHBondContact O-CB 3.43Å; A32-L36 VanDerWaalsContact O-CG 3.32Å; A32-L36 WeakPolarHBondContact O-CG 3.38Å; A32-L36 PolarHBondContact O-N 3.28Å
33	L	82.2	Confident	69.5	Low	95 Å²	95	103.7 Å²	103.7	50%	0.497	57%	0.567	S	S	.	*	H	α-helix	trans	-66.2	-42.8	173.5	-90.2	159.5	0	0	0	112.1	V29 L30 L36 V37	V29-L33 HydrophobicContact CG1-CD1 3.92Å; V29-L33 WeakPolarHBondContact O-CB 3.26Å; V29-L33 PolarHBondContact O-N 3.37Å; L30-L33 PolarHBondContact O-N 2.9Å; L33-L36 PolarHBondContact O-N 2.87Å; L33-V37 WeakPolarHBondContact O-CB 3.35Å; L33-V37 VanDerWaalsContact O-CG2 3.29Å; L33-V37 WeakPolarHBondContact O-CG2 3.32Å; L33-V37 PolarHBondContact O-N 3.43Å
34	Q	77.6	Confident	69.3	Low	129 Å²	129	99 Å²	99	60%	0.603	56%	0.559	S	S	*	*	H	α-helix	trans	-58	-47.6	172.4	-74.2	-94.2	-28.4	0	0	110.8	L30 L31 L36 V37 V38	L30-Q34 WeakPolarHBondContact O-CB 3.29Å; L30-Q34 VanDerWaalsContact O-CG 3.22Å; L30-Q34 WeakPolarHBondContact O-CG 3.45Å; L30-Q34 PolarHBondContact O-N 2.93Å; L31-Q34 PolarHBondContact O-N 3.37Å; Q34-L36 PolarHBondContact O-N 3.33Å; Q34-V37 PolarHBondContact O-N 2.81Å; Q34-V38 WeakPolarHBondContact O-CB 3.4Å; Q34-V38 VanDerWaalsContact O-CG2 3.32Å; Q34-V38 WeakPolarHBondContact O-CG2 3.32Å; Q34-V38 PolarHBondContact O-N 2.81Å
35	L	73.2	Confident	69	Low	123 Å²	123	100.3 Å²	100.3	64%	0.644	56%	0.563	S	S	*	*	H	α-helix	trans	-63.5	-38.5	175.9	-80.9	164.1	0	0	0	113	L31 A32 A39	L31-L35 WeakPolarHBondContact O-CB 3.44Å; L31-L35 WeakPolarHBondContact O-CG 3.49Å; L31-L35 PolarHBondContact O-N 2.86Å; A32-L35 PolarHBondContact O-N 2.82Å; L35-A39 WeakPolarHBondContact O-CB 3.32Å; L35-A39 PolarHBondContact O-N 3.48Å
36	L	73.7	Confident	69.1	Low	121 Å²	121	99.1 Å²	99.1	63%	0.634	55%	0.554	S	S	*	*	H	α-helix	trans	-70.4	-35	175.6	-79.2	165.3	0	0	0	112.8	A32 L33 Q34 G40	A32-L36 WeakPolarHBondContact O-CB 3.43Å; A32-L36 VanDerWaalsContact O-CG 3.32Å; A32-L36 WeakPolarHBondContact O-CG 3.38Å; A32-L36 PolarHBondContact O-N 3.28Å; L33-L36 PolarHBondContact O-N 2.87Å; Q34-L36 PolarHBondContact O-N 3.33Å; L36-G40 WeakPolarHBondContact O-CA 3.3Å; L36-G40 PolarHBondContact O-N 2.84Å
37	V	67.2	Low	69.7	Low	85 Å²	85	95.9 Å²	95.9	52%	0.515	54%	0.54	S	S	.	.	H	α-helix	trans	-69	-44.6	173.3	167.5	0	0	0	0	110.3	L33 Q34 G40 L41	L33-V37 WeakPolarHBondContact O-CB 3.35Å; L33-V37 VanDerWaalsContact O-CG2 3.29Å; L33-V37 WeakPolarHBondContact O-CG2 3.32Å; L33-V37 PolarHBondContact O-N 3.43Å; Q34-V37 PolarHBondContact O-N 2.81Å; V37-G40 PolarHBondContact O-N 3.3Å; V37-L41 HydrophobicContact CG1-CD1 3.89Å; V37-L41 WeakPolarHBondContact O-CB 3.18Å; V37-L41 WeakPolarHBondContact O-CG 3.38Å; V37-L41 PolarHBondContact O-N 2.88Å
38	V	61.7	Low	70.3	Confident	81 Å²	81	92 Å²	92	49%	0.491	52%	0.521	S	S	.	.	H	α-helix	trans	-63.9	-43.9	175	171.8	0	0	0	0	111	Q34 G40 L41 V42	Q34-V38 WeakPolarHBondContact O-CB 3.4Å; Q34-V38 VanDerWaalsContact O-CG2 3.32Å; Q34-V38 WeakPolarHBondContact O-CG2 3.32Å; Q34-V38 PolarHBondContact O-N 2.81Å; V38-G40 VanDerWaalsContact C-N 3.34Å; V38-G40 PolarHBondContact O-N 2.8Å; V38-L41 PolarHBondContact O-N 2.94Å; V38-V42 HydrophobicContact CG1-CG2 4.49Å; V38-V42 WeakPolarHBondContact O-CB 3.49Å; V38-V42 VanDerWaalsContact O-CG2 3.3Å; V38-V42 WeakPolarHBondContact O-CG2 3.39Å; V38-V42 PolarHBondContact O-N 3.49Å
39	A	59.4	Low	70.7	Confident	63 Å²	63	93.5 Å²	93.5	52%	0.521	54%	0.535	S	S	.	.	H	α-helix	trans	-69	-29.6	175.4	0	0	0	0	0	113.2	L35 V42	L35-A39 WeakPolarHBondContact O-CB 3.32Å; L35-A39 PolarHBondContact O-N 3.48Å; A39-V42 CarbonylContact O-C 3.44Å; A39-V42 VanDerWaalsContact O-O 3.06Å
40	G	55.7	Low	71.1	Confident	45 Å²	45	92.2 Å²	92.2	46%	0.464	53%	0.527	S	S	.	.	H	α-helix	trans	-74	-33.7	174.2	0	0	0	0	0	113.3	L36 V37 V38	L36-G40 WeakPolarHBondContact O-CA 3.3Å; L36-G40 PolarHBondContact O-N 2.84Å; V37-G40 PolarHBondContact O-N 3.3Å; V38-G40 VanDerWaalsContact C-N 3.34Å; V38-G40 PolarHBondContact O-N 2.8Å
41	L	50.3	Low	71.6	Confident	139 Å²	139	88.6 Å²	88.6	73%	0.728	51%	0.51	S	S	*	.	H	α-helix	trans	-74.6	-40.4	171.1	-73.9	165.4	0	0	0	111.2	V37 V38 R43	V37-L41 HydrophobicContact CG1-CD1 3.89Å; V37-L41 WeakPolarHBondContact O-CB 3.18Å; V37-L41 WeakPolarHBondContact O-CG 3.38Å; V37-L41 PolarHBondContact O-N 2.88Å; V38-L41 PolarHBondContact O-N 2.94Å; L41-R43 PolarHBondContact O-N 3.4Å
42	V	46.4	Very low	72.1	Confident	99 Å²	99	87.3 Å²	87.3	60%	0.6	51%	0.509	S	S	*	.			trans	-79.4	58.5	166.9	-171.2	0	0	0	0	109.6	V38 A39 A44	V38-V42 HydrophobicContact CG1-CG2 4.49Å; V38-V42 WeakPolarHBondContact O-CB 3.49Å; V38-V42 VanDerWaalsContact O-CG2 3.3Å; V38-V42 WeakPolarHBondContact O-CG2 3.39Å; V38-V42 PolarHBondContact O-N 3.49Å; A39-V42 CarbonylContact O-C 3.44Å; A39-V42 VanDerWaalsContact O-O 3.06Å; V42-A44 PolarHBondContact O-N 3.38Å
43	R	49.8	Very low	72.7	Confident	224 Å²	224	86.6 Å²	86.6	85%	0.845	50%	0.501	S	S	*	.			trans	-63	85.9	151.8	-90.4	179.3	168.8	157.7	-1.2	107.4	L41 Q45	L41-R43 PolarHBondContact O-N 3.4Å; R43-Q45 PolarHBondContact O-N 3.35Å
44	A	52.1	Low	73.1	Confident	69 Å²	69	84.2 Å²	84.2	57%	0.57	49%	0.492	S	S	*	.			trans	-48	131.7	-177.6	0	0	0	0	0	109.7	V42 T46	V42-A44 PolarHBondContact O-N 3.38Å; A44-T46 VanDerWaalsContact O-CG2 3.24Å; A44-T46 WeakPolarHBondContact O-CG2 3.24Å; A44-T46 PolarHBondContact O-N 2.79Å
45	Q	59.4	Low	73.2	Confident	111 Å²	111	85.2 Å²	85.2	52%	0.519	50%	0.502	S	S	.	.			trans	-55	111.4	-171.4	-67.7	171.1	-14.4	0	0	109.7	R43 F57	R43-Q45 PolarHBondContact O-N 3.35Å; Q45-F57 HydrophobicContact CB-CD1 4.38Å; Q45-F57 HydrophobicContact CB-CD2 3.55Å; Q45-F57 HydrophobicContact CB-CE1 4.17Å; Q45-F57 HydrophobicContact CB-CE2 3.33Å; Q45-F57 HydrophobicContact CB-CG 4.11Å; Q45-F57 HydrophobicContact CB-CZ 3.67Å; Q45-F57 HydrophobicContact CG-CD2 4.3Å; Q45-F57 HydrophobicContact CG-CE2 4.27Å; Q45-F57 WeakPolarHBondContact O-CE1 3.5Å; Q45-F57 WeakPolarHBondContact O-CZ 3.45Å; Q45-F57 VanDerWaalsContact OE1-CD2 3.29Å
46	T	75.7	Confident	73.8	Confident	68 Å²	68	86.9 Å²	86.9	42%	0.417	51%	0.506	S	S	.	.	P	Polyproline II helix	trans	-85.1	128.3	-165.9	50.2	0	0	0	0	111.6	A44 G73 S75	A44-T46 VanDerWaalsContact O-CG2 3.24Å; A44-T46 WeakPolarHBondContact O-CG2 3.24Å; A44-T46 PolarHBondContact O-N 2.79Å; T46-G73 CarbonylContact C-O 3.6Å; T46-G73 WeakPolarHBondContact CB-O 3.48Å; T46-G73 PolarHBondContact OG1-O 3.33Å; T46-S75 WeakPolarHBondContact O-CB 3.38Å; T46-S75 PolarHBondContact O-N 2.96Å
47	C	88	Confident	74.4	Confident	49 Å²	49	83.2 Å²	83.2	33%	0.331	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-102.9	129	157.5	-169.2	0	0	0	0	108	S49 C53 F57	C47-S49 PolarHBondContact O-N 3.36Å; C47-C53 WeakPolarHBondContact CA-SG 3.42Å; C47-C53 HydrophobicContact CB-CB 3.77Å; C47-C53 WeakPolarHBondContact CB-SG 3.45Å; C47-C53 WeakPolarHBondContact SG-CB 3.5Å; C47-C53 PolarHBondContact SG-N 2.85Å; C47-C53 CovalentContact SG-SG 2.03Å; C47-C53 PolarHBondContact SG-SG 3.38Å; C47-F57 HydrophobicContact CB-CD1 4.35Å; C47-F57 HydrophobicContact CB-CE1 4.01Å
48	P	89.5	Confident	75.6	Confident	12 Å²	12	80.7 Å²	80.7	8%	0.078	47%	0.472	C	S	.	.	P	Polyproline II helix	trans	-60.3	130.7	171.1	-19.4	30.7	0	0	0	109.7	V50 C51 P71 D72 I74	P48-V50 PolarHBondContact O-N 3.27Å; P48-C51 HydrophobicContact CB-CB 4.35Å; P48-C51 PolarHBondContact O-N 3.1Å; P48-P71 HydrophobicContact CB-CB 4.3Å; P48-D72 WeakPolarHBondContact CG-O 3.15Å; P48-I74 HydrophobicContact CG-CG1 3.86Å
49	S	89.9	Confident	77.3	Confident	124 Å²	124	82.3 Å²	82.3	87%	0.867	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-21.2	-172.9	55.6	0	0	0	0	114.9	C47	C47-S49 PolarHBondContact O-N 3.36Å
50	V	92.4	Very high	79	Confident	60 Å²	60	79.3 Å²	79.3	36%	0.364	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-24	176.8	-175.3	0	0	0	0	111.9	P48 K65 L67	P48-V50 PolarHBondContact O-N 3.27Å; V50-K65 HydrophobicContact CG1-CB 3.69Å; V50-K65 HydrophobicContact CG1-CD 3.96Å; V50-K65 HydrophobicContact CG1-CG 3.9Å; V50-K65 VanDerWaalsContact O-CD 3.25Å; V50-K65 WeakPolarHBondContact O-CD 3.39Å; V50-K65 WeakPolarHBondContact O-CE 3.13Å; V50-K65 PolarHBondContact O-NZ 2.67Å; V50-L67 HydrophobicContact CG1-CD2 4.08Å; V50-L67 HydrophobicContact CG1-CG 4.49Å
51	C	94	Very high	81	Confident	15 Å²	15	80.2 Å²	80.2	10%	0.101	44%	0.441	C	S	.	.	S	Bend	trans	-100.5	168.9	-173.4	-55.7	0	0	0	0	112.5	P48 V60 I61 C62	P48-C51 HydrophobicContact CB-CB 4.35Å; P48-C51 PolarHBondContact O-N 3.1Å; C51-V60 HydrophobicContact CB-CG1 4.15Å; C51-I61 WeakPolarHBondContact CA-O 3.06Å; C51-C62 HydrophobicContact CB-CB 4.08Å; C51-C62 WeakPolarHBondContact CB-SG 3.46Å; C51-C62 WeakPolarHBondContact SG-CB 3.37Å; C51-C62 CovalentContact SG-SG 2.04Å; C51-C62 PolarHBondContact SG-SG 2.99Å
52	S	94.3	Very high	83.2	Confident	77 Å²	77	73.6 Å²	73.6	54%	0.538	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	129.7	169.6	-179	0	0	0	0	109.3	I61	S52-I61 PolarHBondContact N-O 3.03Å; S52-I61 PolarHBondContact O-N 2.79Å
53	C	93.7	Very high	85.6	Confident	30 Å²	30	70.8 Å²	70.8	20%	0.203	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	143.2	-177.8	-55.8	0	0	0	0	110.7	C47 F57 K59 V60	C47-C53 WeakPolarHBondContact CA-SG 3.42Å; C47-C53 HydrophobicContact CB-CB 3.77Å; C47-C53 WeakPolarHBondContact CB-SG 3.45Å; C47-C53 WeakPolarHBondContact SG-CB 3.5Å; C47-C53 PolarHBondContact SG-N 2.85Å; C47-C53 CovalentContact SG-SG 2.03Å; C47-C53 PolarHBondContact SG-SG 3.38Å; C53-F57 HydrophobicContact CB-CD1 4.08Å; C53-K59 CarbonylContact C-O 3.19Å; C53-K59 WeakPolarHBondContact CA-O 3.35Å; C53-V60 HydrophobicContact CB-CG2 4.42Å
54	S	92.4	Very high	87.8	Confident	44 Å²	44	68.4 Å²	68.4	31%	0.308	38%	0.38	S	S	.	.			trans	-69.2	162	172.1	73.1	0	0	0	0	111.4	F57 S58 K59	S54-F57 WeakPolarHBondContact O-CA 3.23Å; S54-F57 PolarHBondContact O-N 3.07Å; S54-S58 PolarHBondContact OG-N 2.91Å; S54-K59 PolarHBondContact N-O 2.93Å; S54-K59 PolarHBondContact OG-N 2.77Å; S54-K59 VanDerWaalsContact OG-N 3.1Å
55	N	79.3	Confident	89.9	Confident	150 Å²	150	69.5 Å²	69.5	80%	0.802	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-48.3	145.1	157.6	-64.9	-2.1	0	0	0	109.6	F57	N55-F57 PolarHBondContact O-N 3.38Å; N55-F57 VanDerWaalsContact O-N 3.11Å
56	Q	84.8	Confident	91.7	Very high	158 Å²	158	69.5 Å²	69.5	74%	0.738	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	61.4	4	-171.1	-53.1	176.7	-11.8	0	0	115.9	S58	Q56-S58 PolarHBondContact O-N 3.11Å
57	F	86.8	Confident	92.7	Very high	45 Å²	45	67.4 Å²	67.4	20%	0.197	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	59.2	16.5	177.3	-54.2	-98.8	0	0	0	115	Q45 C47 C53 S54 N55 K59 T78	Q45-F57 HydrophobicContact CB-CD1 4.38Å; Q45-F57 HydrophobicContact CB-CD2 3.55Å; Q45-F57 HydrophobicContact CB-CE1 4.17Å; Q45-F57 HydrophobicContact CB-CE2 3.33Å; Q45-F57 HydrophobicContact CB-CG 4.11Å; Q45-F57 HydrophobicContact CB-CZ 3.67Å; Q45-F57 HydrophobicContact CG-CD2 4.3Å; Q45-F57 HydrophobicContact CG-CE2 4.27Å; Q45-F57 WeakPolarHBondContact O-CE1 3.5Å; Q45-F57 WeakPolarHBondContact O-CZ 3.45Å; Q45-F57 VanDerWaalsContact OE1-CD2 3.29Å; C47-F57 HydrophobicContact CB-CD1 4.35Å; C47-F57 HydrophobicContact CB-CE1 4.01Å; C53-F57 HydrophobicContact CB-CD1 4.08Å; S54-F57 WeakPolarHBondContact O-CA 3.23Å; S54-F57 PolarHBondContact O-N 3.07Å; N55-F57 PolarHBondContact O-N 3.38Å; N55-F57 VanDerWaalsContact O-N 3.11Å; F57-K59 VanDerWaalsContact C-N 3.35Å; F57-K59 PolarHBondContact O-N 2.9Å; F57-T78 WeakPolarHBondContact O-CA 2.99Å; F57-T78 PolarHBondContact O-OG1 3.02Å
58	S	93.3	Very high	93.1	Very high	32 Å²	32	74.1 Å²	74.1	22%	0.224	38%	0.38	C	S	.	.			trans	-67.9	-31.1	-178.4	179.3	0	0	0	0	113	S54 Q56 R79 L80	S54-S58 PolarHBondContact OG-N 2.91Å; Q56-S58 PolarHBondContact O-N 3.11Å; S58-R79 PolarHBondContact O-N 3.46Å; S58-L80 PolarHBondContact O-N 2.87Å
59	K	96	Very high	93.3	Very high	115 Å²	115	78.7 Å²	78.7	50%	0.5	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	129.3	175	-53	-173.3	180	179.9	0	110.2	C53 S54 F57 L80	C53-K59 CarbonylContact C-O 3.19Å; C53-K59 WeakPolarHBondContact CA-O 3.35Å; S54-K59 PolarHBondContact N-O 2.93Å; S54-K59 PolarHBondContact OG-N 2.77Å; S54-K59 VanDerWaalsContact OG-N 3.1Å; F57-K59 VanDerWaalsContact C-N 3.35Å; F57-K59 PolarHBondContact O-N 2.9Å; K59-L80 WeakPolarHBondContact CA-O 3.27Å; K59-L80 HydrophobicContact CG-CB 4.21Å
60	V	96.3	Very high	93.6	Very high	0 Å²	0	73.8 Å²	73.8	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	117.8	178.3	178.5	0	0	0	0	109	C51 C53 I74 T78 L80 L81 N82	C51-V60 HydrophobicContact CB-CG1 4.15Å; C53-V60 HydrophobicContact CB-CG2 4.42Å; V60-I74 HydrophobicContact CG2-CG2 4.41Å; V60-T78 HydrophobicContact CB-CG2 4.02Å; V60-T78 HydrophobicContact CG2-CG2 3.7Å; V60-T78 WeakPolarHBondContact CG2-OG1 3.38Å; V60-L80 PolarHBondContact N-O 2.76Å; V60-L81 HydrophobicContact CB-CD1 3.97Å; V60-L81 HydrophobicContact CG1-CD1 3.84Å; V60-N82 PolarHBondContact O-N 2.88Å
61	I	96.9	Very high	93.6	Very high	63 Å²	63	71.8 Å²	71.8	32%	0.323	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	108.8	-169.8	-50.6	-58	0	0	0	109.7	C51 S52 V63 L80 N82	C51-I61 WeakPolarHBondContact CA-O 3.06Å; S52-I61 PolarHBondContact N-O 3.03Å; S52-I61 PolarHBondContact O-N 2.79Å; I61-V63 HydrophobicContact CG2-CB 4.34Å; I61-V63 HydrophobicContact CG2-CG2 3.83Å; I61-L80 HydrophobicContact CD1-CD2 3.94Å; I61-N82 HydrophobicContact CD1-CB 3.95Å
62	C	96.7	Very high	93.5	Very high	0 Å²	0	78.4 Å²	78.4	0%	0	39%	0.388	C	S	.	.			trans	-116.5	28.9	-176.1	-55.6	0	0	0	0	111.8	C51 K65 L67 N82 L83 N86	C51-C62 HydrophobicContact CB-CB 4.08Å; C51-C62 WeakPolarHBondContact CB-SG 3.46Å; C51-C62 WeakPolarHBondContact SG-CB 3.37Å; C51-C62 CovalentContact SG-SG 2.04Å; C51-C62 PolarHBondContact SG-SG 2.99Å; C62-K65 VanDerWaalsContact O-CG 3.24Å; C62-K65 WeakPolarHBondContact O-CG 3.31Å; C62-L67 HydrophobicContact CB-CD1 3.87Å; C62-N82 WeakPolarHBondContact CA-O 3.37Å; C62-N82 WeakPolarHBondContact CB-O 3.43Å; C62-N82 PolarHBondContact N-O 3.09Å; C62-L83 HydrophobicContact CB-CD2 3.58Å; C62-L83 HydrophobicContact CB-CG 4.38Å; C62-N86 PolarHBondContact O-ND2 2.95Å
63	V	96.8	Very high	93.2	Very high	40 Å²	40	76.5 Å²	76.5	24%	0.242	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	137.9	-173.2	177.6	0	0	0	0	112.4	I61 K65 N82 H84	I61-V63 HydrophobicContact CG2-CB 4.34Å; I61-V63 HydrophobicContact CG2-CG2 3.83Å; V63-K65 WeakPolarHBondContact O-CG 3.4Å; V63-K65 PolarHBondContact O-N 2.91Å; V63-N82 HydrophobicContact CG2-CB 4.45Å; V63-N82 WeakPolarHBondContact CG2-OD1 3.33Å; V63-H84 WeakPolarHBondContact CA-O 3.17Å; V63-H84 HydrophobicContact CG2-CB 4.22Å
64	R	96.3	Very high	93.2	Very high	175 Å²	175	76.2 Å²	76.2	66%	0.66	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	47	178.2	-67.4	173	-175.6	147.4	12.9	113.6	H84 E85	R64-H84 PolarHBondContact N-O 3.37Å; R64-E85 VanDerWaalsContact CA-O 3.27Å; R64-E85 WeakPolarHBondContact CA-O 3.44Å; R64-E85 HydrophobicContact CG-CB 3.94Å; R64-E85 IonicContact CZ-OE2 3.35Å; R64-E85 PolarHBondContact N-O 3.1Å; R64-E85 IonicContact NE-OE2 3.25Å; R64-E85 PolarHBondContact NE-OE2 2.97Å; R64-E85 IonicContact NH2-OE1 3.61Å; R64-E85 IonicContact NH2-OE2 3.51Å; R64-E85 PolarHBondContact NH2-OE2 3.18Å
65	K	96	Very high	93.2	Very high	92 Å²	92	74.4 Å²	74.4	40%	0.4	36%	0.364	S	S	.	.	S	Bend	trans	-108.1	3.7	-176.9	-63.8	-59.9	179.8	146.8	0	114.3	V50 C62 V63 L67 N86	V50-K65 HydrophobicContact CG1-CB 3.69Å; V50-K65 HydrophobicContact CG1-CD 3.96Å; V50-K65 HydrophobicContact CG1-CG 3.9Å; V50-K65 VanDerWaalsContact O-CD 3.25Å; V50-K65 WeakPolarHBondContact O-CD 3.39Å; V50-K65 WeakPolarHBondContact O-CE 3.13Å; V50-K65 PolarHBondContact O-NZ 2.67Å; C62-K65 VanDerWaalsContact O-CG 3.24Å; C62-K65 WeakPolarHBondContact O-CG 3.31Å; V63-K65 WeakPolarHBondContact O-CG 3.4Å; V63-K65 PolarHBondContact O-N 2.91Å; K65-L67 HydrophobicContact CB-CD1 3.89Å; K65-L67 HydrophobicContact CB-CG 3.78Å; K65-L67 PolarHBondContact O-N 2.69Å; K65-L67 VanDerWaalsContact O-N 3.14Å; K65-N86 WeakPolarHBondContact CA-OD1 3.31Å; K65-N86 PolarHBondContact N-OD1 3.42Å
66	N	96.2	Very high	93.8	Very high	111 Å²	111	70.8 Å²	70.8	59%	0.594	35%	0.348	S	S	*	.			trans	53.2	27.8	-175.5	-61.8	-42.1	0	0	0	113.4	R68 N86	N66-R68 PolarHBondContact O-N 3.25Å; N66-N86 PolarHBondContact N-OD1 3.37Å
67	L	96.5	Very high	94.2	Very high	24 Å²	24	66.3 Å²	66.3	13%	0.126	33%	0.329	C	S	.	.			trans	-64.6	124.8	180	-70.6	165.3	0	0	0	109.8	V50 C62 K65 P71 L83 N86 Q87 I88	V50-L67 HydrophobicContact CG1-CD2 4.08Å; V50-L67 HydrophobicContact CG1-CG 4.49Å; C62-L67 HydrophobicContact CB-CD1 3.87Å; K65-L67 HydrophobicContact CB-CD1 3.89Å; K65-L67 HydrophobicContact CB-CG 3.78Å; K65-L67 PolarHBondContact O-N 2.69Å; K65-L67 VanDerWaalsContact O-N 3.14Å; L67-P71 HydrophobicContact CD1-CG 4.12Å; L67-P71 HydrophobicContact CD2-CB 4.4Å; L67-L83 HydrophobicContact CD1-CD2 3.82Å; L67-N86 HydrophobicContact CB-CB 4.23Å; L67-N86 PolarHBondContact N-OD1 2.99Å; L67-Q87 CarbonylContact O-C 3.59Å; L67-Q87 VanDerWaalsContact O-CA 3.25Å; L67-Q87 WeakPolarHBondContact O-CA 3.4Å; L67-Q87 PolarHBondContact O-N 3.31Å; L67-I88 HydrophobicContact CB-CG1 4.45Å; L67-I88 WeakPolarHBondContact O-CG1 3.21Å; L67-I88 PolarHBondContact O-N 2.9Å; L67-I88 VanDerWaalsContact O-N 3.1Å
68	R	96.3	Very high	94.6	Very high	190 Å²	190	64.2 Å²	64.2	72%	0.717	32%	0.319	S	S	*	.	S	Bend	trans	-88.7	-17.9	176.5	-64.2	-179.4	-179.9	172.1	0.8	113.2	N66 Q87 I88	N66-R68 PolarHBondContact O-N 3.25Å; R68-Q87 HydrophobicContact CG-CB 4.24Å; R68-I88 WeakPolarHBondContact O-CA 3.39Å
69	E	95.4	Very high	94.8	Very high	107 Å²	107	69 Å²	69	50%	0.5	33%	0.333	S	S	.	.	S	Bend	trans	-138.6	168.9	177.5	-56.3	-157.6	162	0	0	109.8	K92	E69-K92 WeakPolarHBondContact OE1-CE 3.38Å; E69-K92 IonicContact OE1-NZ 3.52Å; E69-K92 PolarHBondContact OE1-NZ 3.06Å; E69-K92 IonicContact OE2-NZ 2.69Å; E69-K92 PolarHBondContact OE2-NZ 3.09Å
70	V	95.4	Very high	94.8	Very high	22 Å²	22	65 Å²	65	13%	0.133	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-66.3	131.3	171.7	178.7	0	0	0	0	108.8	I74 L83 I88 I91 F96	V70-I74 HydrophobicContact CG1-CD1 4.28Å; V70-L83 HydrophobicContact CG1-CD1 4.33Å; V70-I88 HydrophobicContact CG2-CD1 4.44Å; V70-I91 HydrophobicContact CG2-CD1 4.14Å; V70-F96 HydrophobicContact CG1-CD1 4.34Å; V70-F96 HydrophobicContact CG1-CE1 3.64Å; V70-F96 HydrophobicContact CG1-CZ 4.25Å; V70-F96 HydrophobicContact CG2-CE1 4.11Å; V70-F96 HydrophobicContact CG2-CZ 3.86Å
71	P	93.4	Very high	94.9	Very high	17 Å²	17	65 Å²	65	11%	0.11	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-75.8	134	-177.3	29.4	-33.1	0	0	0	111.9	P48 L67 I74 L83	P48-P71 HydrophobicContact CB-CB 4.3Å; L67-P71 HydrophobicContact CD1-CG 4.12Å; L67-P71 HydrophobicContact CD2-CB 4.4Å; P71-I74 HydrophobicContact CG-CD1 4.34Å; P71-I74 WeakPolarHBondContact O-CD1 3.43Å; P71-I74 WeakPolarHBondContact O-CG1 3.43Å; P71-L83 VanDerWaalsContact CD-CD2 3.5Å; P71-L83 HydrophobicContact CG-CD2 3.95Å
72	D	90.2	Very high	95	Very high	154 Å²	154	63.1 Å²	63.1	82%	0.824	31%	0.307	S	S	*	.	S	Bend	trans	-68.3	164	172	-70.2	-60.9	0	0	0	112.8	P48	P48-D72 WeakPolarHBondContact CG-O 3.15Å
73	G	88.9	Confident	95	Very high	38 Å²	38	63.1 Å²	63.1	39%	0.392	31%	0.307	S	S	.	.			trans	79.3	19.6	174.7	0	0	0	0	0	115.1	T46 S75	T46-G73 CarbonylContact C-O 3.6Å; T46-G73 WeakPolarHBondContact CB-O 3.48Å; T46-G73 PolarHBondContact OG1-O 3.33Å; G73-S75 PolarHBondContact O-N 2.8Å
74	I	92.6	Very high	95	Very high	24 Å²	24	62.6 Å²	62.6	12%	0.123	30%	0.302	C	S	.	.			trans	-70.3	127	173.2	-59.3	161.9	0	0	0	109.7	P48 V60 V70 P71 T78 L81 L99	P48-I74 HydrophobicContact CG-CG1 3.86Å; V60-I74 HydrophobicContact CG2-CG2 4.41Å; V70-I74 HydrophobicContact CG1-CD1 4.28Å; P71-I74 HydrophobicContact CG-CD1 4.34Å; P71-I74 WeakPolarHBondContact O-CD1 3.43Å; P71-I74 WeakPolarHBondContact O-CG1 3.43Å; I74-T78 HydrophobicContact CG2-CG2 4.31Å; I74-T78 WeakPolarHBondContact CG2-OG1 3.29Å; I74-L81 HydrophobicContact CD1-CD1 3.93Å; I74-L81 HydrophobicContact CD1-CD2 3.72Å; I74-L81 HydrophobicContact CG1-CD1 4.45Å; I74-L81 HydrophobicContact CG2-CD1 4.42Å; I74-L99 HydrophobicContact CB-CD1 4.48Å; I74-L99 HydrophobicContact CB-CD2 4.16Å; I74-L99 HydrophobicContact CG2-CD1 3.93Å; I74-L99 HydrophobicContact CG2-CD2 3.71Å
75	S	92.3	Very high	95.1	Very high	5 Å²	5	56.5 Å²	56.5	4%	0.035	28%	0.281	C	S	.	.			trans	-58	138.7	179.4	178.7	0	0	0	0	113.3	T46 G73 N77 T78 L99	T46-S75 WeakPolarHBondContact O-CB 3.38Å; T46-S75 PolarHBondContact O-N 2.96Å; G73-S75 PolarHBondContact O-N 2.8Å; S75-N77 PolarHBondContact O-N 3.07Å; S75-N77 VanDerWaalsContact O-N 3.1Å; S75-N77 PolarHBondContact OG-N 2.68Å; S75-T78 VanDerWaalsContact O-CB 3.31Å; S75-T78 WeakPolarHBondContact O-CB 3.47Å; S75-T78 PolarHBondContact O-N 3.49Å; S75-T78 PolarHBondContact O-OG1 3.1Å; S75-L99 WeakPolarHBondContact O-CD2 3.07Å
76	T	92.4	Very high	95.2	Very high	75 Å²	75	52.4 Å²	52.4	46%	0.46	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-13	175.9	50.2	0	0	0	0	114.2	H98 H101	T76-H98 HydrophobicContact CG2-CB 4.19Å; T76-H101 PolarHBondContact O-ND1 2.85Å
77	N	92.8	Very high	95.3	Very high	64 Å²	64	50.5 Å²	50.5	34%	0.342	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-2.8	176.2	-65.6	-6.3	0	0	0	113.3	S75 R79	S75-N77 PolarHBondContact O-N 3.07Å; S75-N77 VanDerWaalsContact O-N 3.1Å; S75-N77 PolarHBondContact OG-N 2.68Å; N77-R79 PolarHBondContact O-N 3.42Å
78	T	95.8	Very high	95.3	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.245	C	C	.	.			trans	-64.6	120.1	-177.7	-53.2	0	0	0	0	111.2	F57 V60 I74 S75 L80 L81 H101 L102	F57-T78 WeakPolarHBondContact O-CA 2.99Å; F57-T78 PolarHBondContact O-OG1 3.02Å; V60-T78 HydrophobicContact CB-CG2 4.02Å; V60-T78 HydrophobicContact CG2-CG2 3.7Å; V60-T78 WeakPolarHBondContact CG2-OG1 3.38Å; I74-T78 HydrophobicContact CG2-CG2 4.31Å; I74-T78 WeakPolarHBondContact CG2-OG1 3.29Å; S75-T78 VanDerWaalsContact O-CB 3.31Å; S75-T78 WeakPolarHBondContact O-CB 3.47Å; S75-T78 PolarHBondContact O-N 3.49Å; S75-T78 PolarHBondContact O-OG1 3.1Å; T78-L80 VanDerWaalsContact CG2-O 3.31Å; T78-L80 WeakPolarHBondContact CG2-O 3.03Å; T78-L81 HydrophobicContact CG2-CB 4.17Å; T78-H101 CarbonylContact O-C 3.55Å; T78-L102 HydrophobicContact CG2-CD1 3.94Å; T78-L102 WeakPolarHBondContact O-CA 3.5Å; T78-L102 PolarHBondContact O-N 3.47Å
79	R	96.7	Very high	95.4	Very high	134 Å²	134	44.6 Å²	44.6	51%	0.506	23%	0.231	S	C	.	.	S	Bend	trans	-97.1	-30.4	172	-66.7	179.8	178.3	-129.5	11.3	112.7	S58 N77 H101 E103 I104	S58-R79 PolarHBondContact O-N 3.46Å; N77-R79 PolarHBondContact O-N 3.42Å; R79-H101 WeakPolarHBondContact CA-O 3.07Å; R79-E103 VanDerWaalsContact CD-OE1 3.27Å; R79-E103 WeakPolarHBondContact CD-OE1 3.25Å; R79-E103 IonicContact CZ-OE1 2.69Å; R79-E103 IonicContact NE-OE1 3.6Å; R79-E103 IonicContact NH1-OE1 2.74Å; R79-E103 PolarHBondContact NH1-OE1 3.21Å; R79-E103 PolarHBondContact O-N 3.01Å; R79-I104 PolarHBondContact O-N 3.49Å
80	L	97.7	Very high	95.5	Very high	31 Å²	31	42.1 Å²	42.1	16%	0.162	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	117.5	176.4	-173.8	162.6	0	0	0	109.8	S58 K59 V60 I61 T78 N82 I104	S58-L80 PolarHBondContact O-N 2.87Å; K59-L80 WeakPolarHBondContact CA-O 3.27Å; K59-L80 HydrophobicContact CG-CB 4.21Å; V60-L80 PolarHBondContact N-O 2.76Å; I61-L80 HydrophobicContact CD1-CD2 3.94Å; T78-L80 VanDerWaalsContact CG2-O 3.31Å; T78-L80 WeakPolarHBondContact CG2-O 3.03Å; L80-N82 HydrophobicContact CD2-CB 3.95Å; L80-I104 WeakPolarHBondContact CA-O 3.32Å; L80-I104 HydrophobicContact CB-CB 4.47Å; L80-I104 HydrophobicContact CD1-CD1 4.3Å; L80-I104 HydrophobicContact CG-CB 4.16Å; L80-I104 HydrophobicContact CG-CG2 4.25Å
81	L	97.7	Very high	95.6	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	118.6	172.8	177.6	61.8	0	0	0	109.2	V60 I74 T78 L83 F96 L99 L102 I104 L105 Q106	V60-L81 HydrophobicContact CB-CD1 3.97Å; V60-L81 HydrophobicContact CG1-CD1 3.84Å; I74-L81 HydrophobicContact CD1-CD1 3.93Å; I74-L81 HydrophobicContact CD1-CD2 3.72Å; I74-L81 HydrophobicContact CG1-CD1 4.45Å; I74-L81 HydrophobicContact CG2-CD1 4.42Å; T78-L81 HydrophobicContact CG2-CB 4.17Å; L81-L83 HydrophobicContact CD1-CD1 4.46Å; L81-L83 HydrophobicContact CD1-CG 4.38Å; L81-L83 HydrophobicContact CD2-CD1 3.93Å; L81-L83 HydrophobicContact CG-CD1 4.06Å; L81-L83 HydrophobicContact CG-CG 4.29Å; L81-F96 HydrophobicContact CD2-CD1 4.03Å; L81-F96 HydrophobicContact CD2-CE1 3.82Å; L81-L99 HydrophobicContact CD2-CD1 4.04Å; L81-L102 HydrophobicContact CB-CD1 3.67Å; L81-I104 PolarHBondContact N-O 3.32Å; L81-L105 HydrophobicContact CB-CD1 4.18Å; L81-L105 HydrophobicContact CD2-CD1 3.89Å; L81-L105 HydrophobicContact CG-CD1 4.15Å; L81-Q106 PolarHBondContact O-N 3.21Å
82	N	98	Very high	95.7	Very high	22 Å²	22	44.3 Å²	44.3	12%	0.118	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	113.2	179.3	-174	-30.6	0	0	0	111.2	V60 I61 C62 V63 L80 H84 Q106	V60-N82 PolarHBondContact O-N 2.88Å; I61-N82 HydrophobicContact CD1-CB 3.95Å; C62-N82 WeakPolarHBondContact CA-O 3.37Å; C62-N82 WeakPolarHBondContact CB-O 3.43Å; C62-N82 PolarHBondContact N-O 3.09Å; V63-N82 HydrophobicContact CG2-CB 4.45Å; V63-N82 WeakPolarHBondContact CG2-OD1 3.33Å; L80-N82 HydrophobicContact CD2-CB 3.95Å; N82-H84 WeakPolarHBondContact OD1-CB 3.26Å; N82-H84 PolarHBondContact OD1-N 3.49Å; N82-Q106 HydrophobicContact CB-CB 4.31Å; N82-Q106 PolarHBondContact ND2-OE1 2.94Å
83	L	97.8	Very high	96	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.206	C	C	.	.			trans	-114.1	22.4	178.1	-72.3	159.2	0	0	0	111.6	C62 L67 V70 P71 L81 N86 I88 F96 Q106 L107 N110	C62-L83 HydrophobicContact CB-CD2 3.58Å; C62-L83 HydrophobicContact CB-CG 4.38Å; L67-L83 HydrophobicContact CD1-CD2 3.82Å; V70-L83 HydrophobicContact CG1-CD1 4.33Å; P71-L83 VanDerWaalsContact CD-CD2 3.5Å; P71-L83 HydrophobicContact CG-CD2 3.95Å; L81-L83 HydrophobicContact CD1-CD1 4.46Å; L81-L83 HydrophobicContact CD1-CG 4.38Å; L81-L83 HydrophobicContact CD2-CD1 3.93Å; L81-L83 HydrophobicContact CG-CD1 4.06Å; L81-L83 HydrophobicContact CG-CG 4.29Å; L83-N86 PolarHBondContact O-ND2 2.03Å; L83-I88 HydrophobicContact CB-CD1 4.25Å; L83-I88 HydrophobicContact CD1-CD1 4.34Å; L83-I88 HydrophobicContact CD2-CD1 4.21Å; L83-F96 HydrophobicContact CD1-CE1 4.48Å; L83-Q106 WeakPolarHBondContact CA-O 3.44Å; L83-Q106 PolarHBondContact N-O 3.34Å; L83-L107 HydrophobicContact CB-CD2 4.07Å; L83-L107 HydrophobicContact CD1-CD2 3.72Å; L83-N110 PolarHBondContact O-ND2 2.65Å
84	H	97.1	Very high	96.3	Very high	29 Å²	29	41.3 Å²	41.3	13%	0.134	20%	0.203	C	C	.	.			trans	-61.7	144.5	-176.1	-171.5	83.3	0	0	0	113.2	V63 R64 N82 N86 S108	V63-H84 WeakPolarHBondContact CA-O 3.17Å; V63-H84 HydrophobicContact CG2-CB 4.22Å; R64-H84 PolarHBondContact N-O 3.37Å; N82-H84 WeakPolarHBondContact OD1-CB 3.26Å; N82-H84 PolarHBondContact OD1-N 3.49Å; H84-N86 PolarHBondContact O-ND2 2.86Å; H84-S108 WeakPolarHBondContact CA-O 3.48Å; H84-S108 PolarHBondContact ND1-O 3.39Å; H84-S108 PolarHBondContact ND1-OG 3.37Å
85	E	97.6	Very high	96.4	Very high	48 Å²	48	42.2 Å²	42.2	22%	0.224	21%	0.212	C	C	.	.	S	Bend	trans	55.7	65	-179.3	-71.9	174.6	-161.8	0	0	112.6	R64 S108 R109	R64-E85 VanDerWaalsContact CA-O 3.27Å; R64-E85 WeakPolarHBondContact CA-O 3.44Å; R64-E85 HydrophobicContact CG-CB 3.94Å; R64-E85 IonicContact CZ-OE2 3.35Å; R64-E85 PolarHBondContact N-O 3.1Å; R64-E85 IonicContact NE-OE2 3.25Å; R64-E85 PolarHBondContact NE-OE2 2.97Å; R64-E85 IonicContact NH2-OE1 3.61Å; R64-E85 IonicContact NH2-OE2 3.51Å; R64-E85 PolarHBondContact NH2-OE2 3.18Å; E85-S108 PolarHBondContact N-O 3.21Å; E85-R109 WeakPolarHBondContact CA-O 3.24Å; E85-R109 HydrophobicContact CB-CB 4.46Å; E85-R109 HydrophobicContact CG-CB 3.62Å; E85-R109 HydrophobicContact CG-CG 4.2Å; E85-R109 PolarHBondContact N-O 3Å; E85-R109 WeakPolarHBondContact OE1-CD 3.36Å; E85-R109 IonicContact OE1-CZ 3.99Å; E85-R109 IonicContact OE1-NE 3.14Å; E85-R109 IonicContact OE1-NH1 2.7Å; E85-R109 PolarHBondContact OE1-NH1 2.72Å
86	N	98.1	Very high	96.5	Very high	5 Å²	5	42.1 Å²	42.1	3%	0.027	21%	0.211	C	C	.	.	S	Bend	trans	-135.2	-175.9	176.5	-80.7	-67.4	0	0	0	111.9	C62 K65 N66 L67 L83 H84 I88 R109 N110 H111	C62-N86 PolarHBondContact O-ND2 2.95Å; K65-N86 WeakPolarHBondContact CA-OD1 3.31Å; K65-N86 PolarHBondContact N-OD1 3.42Å; N66-N86 PolarHBondContact N-OD1 3.37Å; L67-N86 HydrophobicContact CB-CB 4.23Å; L67-N86 PolarHBondContact N-OD1 2.99Å; L83-N86 PolarHBondContact O-ND2 2.03Å; H84-N86 PolarHBondContact O-ND2 2.86Å; N86-I88 HydrophobicContact CB-CG1 4.32Å; N86-R109 PolarHBondContact N-O 2.88Å; N86-N110 WeakPolarHBondContact CA-OD1 3.5Å; N86-N110 WeakPolarHBondContact CB-OD1 3.15Å; N86-N110 PolarHBondContact O-OD1 2.87Å; N86-H111 PolarHBondContact O-ND1 3.26Å
87	Q	98	Very high	96.6	Very high	71 Å²	71	43.6 Å²	43.6	33%	0.332	21%	0.211	S	C	.	.			trans	-107.4	19.7	-174.3	-61.7	-175.9	-0.4	0	0	112.6	L67 R68 Q89	L67-Q87 CarbonylContact O-C 3.59Å; L67-Q87 VanDerWaalsContact O-CA 3.25Å; L67-Q87 WeakPolarHBondContact O-CA 3.4Å; L67-Q87 PolarHBondContact O-N 3.31Å; R68-Q87 HydrophobicContact CG-CB 4.24Å; Q87-Q89 PolarHBondContact O-N 3.29Å
88	I	98	Very high	96.6	Very high	0 Å²	0	47 Å²	47	0%	0	22%	0.224	C	C	.	.			trans	-67.9	125.5	-175	-54.5	175.4	0	0	0	109.5	L67 R68 V70 L83 N86 I91 L107 N110 H111 I112	L67-I88 HydrophobicContact CB-CG1 4.45Å; L67-I88 WeakPolarHBondContact O-CG1 3.21Å; L67-I88 PolarHBondContact O-N 2.9Å; L67-I88 VanDerWaalsContact O-N 3.1Å; R68-I88 WeakPolarHBondContact O-CA 3.39Å; V70-I88 HydrophobicContact CG2-CD1 4.44Å; L83-I88 HydrophobicContact CB-CD1 4.25Å; L83-I88 HydrophobicContact CD1-CD1 4.34Å; L83-I88 HydrophobicContact CD2-CD1 4.21Å; N86-I88 HydrophobicContact CB-CG1 4.32Å; I88-I91 HydrophobicContact CG2-CD1 3.7Å; I88-L107 HydrophobicContact CD1-CD2 4.5Å; I88-N110 HydrophobicContact CB-CB 4.41Å; I88-N110 WeakPolarHBondContact CB-OD1 3.42Å; I88-N110 WeakPolarHBondContact CG1-OD1 3.23Å; I88-N110 PolarHBondContact N-OD1 3.28Å; I88-N110 VanDerWaalsContact N-OD1 3.12Å; I88-H111 CarbonylContact O-C 3.54Å; I88-H111 VanDerWaalsContact O-CA 3.31Å; I88-H111 WeakPolarHBondContact O-CA 3.24Å; I88-H111 PolarHBondContact O-N 3.1Å; I88-I112 HydrophobicContact CG2-CG1 4.42Å; I88-I112 WeakPolarHBondContact O-CG1 3.4Å; I88-I112 PolarHBondContact O-N 3.5Å
89	Q	97.4	Very high	96.5	Very high	91 Å²	91	47.3 Å²	47.3	43%	0.425	23%	0.226	S	C	.	.			trans	-105.1	-29.6	-176.6	-64.2	-173.5	12.3	0	0	114.7	Q87 H111 I112 R113	Q87-Q89 PolarHBondContact O-N 3.29Å; Q89-H111 WeakPolarHBondContact CA-O 3.21Å; Q89-H111 HydrophobicContact CG-CB 4.03Å; Q89-I112 WeakPolarHBondContact O-CA 3.37Å; Q89-R113 VanDerWaalsContact O-CG 3.24Å; Q89-R113 WeakPolarHBondContact O-CG 3.36Å; Q89-R113 PolarHBondContact O-N 2.8Å
90	I	97.5	Very high	96.3	Very high	54 Å²	54	49.2 Å²	49.2	28%	0.277	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	132.4	-174	-52.3	-177.1	0	0	0	107.5	K92 T114 E116	I90-K92 HydrophobicContact CG2-CG 4.49Å; I90-T114 WeakPolarHBondContact CA-O 3.43Å; I90-E116 HydrophobicContact CG2-CG 4.39Å
91	I	97.6	Very high	96.2	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	114.1	166.8	-49.6	-59.3	0	0	0	107.7	V70 I88 F96 L107 I112 T114 I115 E116 A119	V70-I91 HydrophobicContact CG2-CD1 4.14Å; I88-I91 HydrophobicContact CG2-CD1 3.7Å; I91-F96 HydrophobicContact CG2-CE2 3.65Å; I91-F96 HydrophobicContact CG2-CZ 4.24Å; I91-L107 HydrophobicContact CD1-CD1 4.14Å; I91-L107 HydrophobicContact CD1-CD2 3.99Å; I91-L107 HydrophobicContact CG1-CD1 4.37Å; I91-I112 HydrophobicContact CD1-CD1 3.83Å; I91-I112 HydrophobicContact CD1-CG1 4.22Å; I91-I112 HydrophobicContact CG1-CD1 4.02Å; I91-I112 HydrophobicContact CG1-CG1 4.4Å; I91-I112 HydrophobicContact CG1-CG2 4.14Å; I91-T114 PolarHBondContact N-O 3.17Å; I91-I115 HydrophobicContact CB-CG1 4.29Å; I91-I115 HydrophobicContact CB-CG2 4.22Å; I91-I115 HydrophobicContact CG1-CG1 4.1Å; I91-E116 PolarHBondContact O-N 2.83Å; I91-A119 HydrophobicContact CB-CB 4.35Å; I91-A119 HydrophobicContact CG2-CB 3.77Å
92	K	96.2	Very high	96.2	Very high	85 Å²	85	52.1 Å²	52.1	37%	0.37	25%	0.246	S	C	.	.			trans	-79.7	156.2	-171.9	-60.6	175.3	-179.3	173.6	0	111.5	E69 I90 N94 S95 E116 A119	E69-K92 WeakPolarHBondContact OE1-CE 3.38Å; E69-K92 IonicContact OE1-NZ 3.52Å; E69-K92 PolarHBondContact OE1-NZ 3.06Å; E69-K92 IonicContact OE2-NZ 2.69Å; E69-K92 PolarHBondContact OE2-NZ 3.09Å; I90-K92 HydrophobicContact CG2-CG 4.49Å; K92-N94 PolarHBondContact O-N 3.09Å; K92-S95 PolarHBondContact N-OG 2.98Å; K92-S95 PolarHBondContact O-N 3.28Å; K92-S95 PolarHBondContact O-OG 3.04Å; K92-S95 VanDerWaalsContact O-OG 3.12Å; K92-E116 WeakPolarHBondContact CA-OE2 3.48Å; K92-A119 WeakPolarHBondContact O-CA 3.11Å
93	V	95.6	Very high	96.2	Very high	67 Å²	67	54.2 Å²	54.2	41%	0.406	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.8	135.4	173.3	-170.6	0	0	0	0	110.1	S95 E116 I117	V93-S95 VanDerWaalsContact C-N 3.26Å; V93-S95 PolarHBondContact O-N 2.82Å; V93-E116 HydrophobicContact CG2-CB 3.7Å; V93-E116 WeakPolarHBondContact CG2-OE2 3.47Å; V93-E116 PolarHBondContact N-OE2 2.9Å; V93-I117 WeakPolarHBondContact CG2-O 3.05Å
94	N	94.7	Very high	96.2	Very high	62 Å²	62	56.7 Å²	56.7	33%	0.332	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.1	11.3	178.2	-61	-51.5	0	0	0	116.8	K92 F96 K97 G118 N121	K92-N94 PolarHBondContact O-N 3.09Å; N94-F96 PolarHBondContact O-N 3.04Å; N94-K97 HydrophobicContact CB-CB 3.95Å; N94-K97 HydrophobicContact CB-CD 3.95Å; N94-K97 VanDerWaalsContact O-CB 3.26Å; N94-K97 WeakPolarHBondContact O-CB 3.47Å; N94-K97 PolarHBondContact O-N 2.81Å; N94-G118 PolarHBondContact N-O 3.02Å; N94-N121 WeakPolarHBondContact OD1-CB 3.49Å; N94-N121 PolarHBondContact OD1-ND2 2.73Å
95	S	95	Very high	96.3	Very high	44 Å²	44	55.3 Å²	55.3	31%	0.308	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.8	-24.4	-179.2	-78.2	0	0	0	0	115.3	K92 V93	K92-S95 PolarHBondContact N-OG 2.98Å; K92-S95 PolarHBondContact O-N 3.28Å; K92-S95 PolarHBondContact O-OG 3.04Å; K92-S95 VanDerWaalsContact O-OG 3.12Å; V93-S95 VanDerWaalsContact C-N 3.26Å; V93-S95 PolarHBondContact O-N 2.82Å
96	F	95	Very high	96.3	Very high	2 Å²	2	54.8 Å²	54.8	1%	0.009	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.2	14.6	-179.9	-47.4	-73.4	0	0	0	114.4	V70 L81 L83 I91 N94 H98 L99 L105 L107 F120 L123	V70-F96 HydrophobicContact CG1-CD1 4.34Å; V70-F96 HydrophobicContact CG1-CE1 3.64Å; V70-F96 HydrophobicContact CG1-CZ 4.25Å; V70-F96 HydrophobicContact CG2-CE1 4.11Å; V70-F96 HydrophobicContact CG2-CZ 3.86Å; L81-F96 HydrophobicContact CD2-CD1 4.03Å; L81-F96 HydrophobicContact CD2-CE1 3.82Å; L83-F96 HydrophobicContact CD1-CE1 4.48Å; I91-F96 HydrophobicContact CG2-CE2 3.65Å; I91-F96 HydrophobicContact CG2-CZ 4.24Å; N94-F96 PolarHBondContact O-N 3.04Å; F96-H98 PolarHBondContact O-N 3.03Å; F96-L99 HydrophobicContact CB-CD1 4.24Å; F96-L99 HydrophobicContact CD1-CD1 4.04Å; F96-L99 WeakPolarHBondContact O-CB 3.44Å; F96-L99 PolarHBondContact O-N 2.9Å; F96-L105 HydrophobicContact CD2-CD2 4.04Å; F96-L105 HydrophobicContact CE1-CD1 4.1Å; F96-L105 HydrophobicContact CE1-CD2 4.36Å; F96-L105 HydrophobicContact CE2-CD2 3.81Å; F96-L105 HydrophobicContact CG-CD2 4.41Å; F96-L105 HydrophobicContact CZ-CD1 4.2Å; F96-L105 HydrophobicContact CZ-CD2 3.99Å; F96-L107 HydrophobicContact CE2-CD1 4.32Å; F96-L107 HydrophobicContact CZ-CD1 4.1Å; F96-L107 HydrophobicContact CZ-CD2 4.36Å; F96-F120 AromaticContact CD2-CD1 3.98Å; F96-F120 HydrophobicContact CD2-CD1 3.98Å; F96-F120 HydrophobicContact CD2-CE1 4.38Å; F96-F120 HydrophobicContact CE2-CD1 4.04Å; F96-F120 AromaticContact CE2-CE1 3.96Å; F96-F120 HydrophobicContact CE2-CE1 3.96Å; F96-L123 HydrophobicContact CB-CD1 3.89Å; F96-L123 HydrophobicContact CB-CD2 3.67Å; F96-L123 HydrophobicContact CB-CG 3.94Å; F96-L123 HydrophobicContact CD2-CD1 4.18Å; F96-L123 HydrophobicContact CG-CD1 4.26Å
97	K	93.7	Very high	96.3	Very high	106 Å²	106	54.5 Å²	54.5	46%	0.461	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.1	-27.7	-169.1	179.9	175.1	-179.4	176.2	0	116.4	N94 N121	N94-K97 HydrophobicContact CB-CB 3.95Å; N94-K97 HydrophobicContact CB-CD 3.95Å; N94-K97 VanDerWaalsContact O-CB 3.26Å; N94-K97 WeakPolarHBondContact O-CB 3.47Å; N94-K97 PolarHBondContact O-N 2.81Å; K97-N121 WeakPolarHBondContact CA-O 3.45Å
98	H	92.4	Very high	96.3	Very high	135 Å²	135	51.1 Å²	51.1	63%	0.625	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-12.4	-177.8	-59.2	-72.3	0	0	0	113.8	T76 F96 R100	T76-H98 HydrophobicContact CG2-CB 4.19Å; F96-H98 PolarHBondContact O-N 3.03Å; H98-R100 PolarHBondContact O-N 2.78Å
99	L	94.5	Very high	96.3	Very high	7 Å²	7	56.5 Å²	56.5	4%	0.037	26%	0.262	C	S	.	.			trans	-85.3	54.5	-173	-51.4	-175.4	0	0	0	111.9	I74 S75 L81 F96 H101 L102 L123	I74-L99 HydrophobicContact CB-CD1 4.48Å; I74-L99 HydrophobicContact CB-CD2 4.16Å; I74-L99 HydrophobicContact CG2-CD1 3.93Å; I74-L99 HydrophobicContact CG2-CD2 3.71Å; S75-L99 WeakPolarHBondContact O-CD2 3.07Å; L81-L99 HydrophobicContact CD2-CD1 4.04Å; F96-L99 HydrophobicContact CB-CD1 4.24Å; F96-L99 HydrophobicContact CD1-CD1 4.04Å; F96-L99 WeakPolarHBondContact O-CB 3.44Å; F96-L99 PolarHBondContact O-N 2.9Å; L99-H101 PolarHBondContact O-N 2.04Å; L99-H101 VanDerWaalsContact O-N 3.09Å; L99-L102 HydrophobicContact CB-CB 4.02Å; L99-L102 HydrophobicContact CB-CD2 4.42Å; L99-L102 HydrophobicContact CD1-CD2 4.26Å; L99-L102 VanDerWaalsContact O-CB 3.23Å; L99-L102 WeakPolarHBondContact O-CB 3.21Å; L99-L102 PolarHBondContact O-N 2.78Å; L99-L123 HydrophobicContact CB-CD2 4Å; L99-L123 WeakPolarHBondContact O-CD2 3.39Å
100	R	93.5	Very high	96.4	Very high	175 Å²	175	52.3 Å²	52.3	66%	0.66	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-23.1	-176.4	-67.2	-178.2	178	178.2	-1.9	113.9	H98 N125	H98-R100 PolarHBondContact O-N 2.78Å; R100-N125 PolarHBondContact O-ND2 3.14Å
101	H	95.4	Very high	96.4	Very high	92 Å²	92	53.9 Å²	53.9	43%	0.426	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	0.2	178.3	-57.4	113.3	0	0	0	114	T76 T78 R79 L99 E103	T76-H101 PolarHBondContact O-ND1 2.85Å; T78-H101 CarbonylContact O-C 3.55Å; R79-H101 WeakPolarHBondContact CA-O 3.07Å; L99-H101 PolarHBondContact O-N 2.04Å; L99-H101 VanDerWaalsContact O-N 3.09Å; H101-E103 PolarHBondContact O-N 2.76Å
102	L	97.1	Very high	96.4	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	25%	0.248	C	C	.	.			trans	-68.7	119.3	-175.9	-164.5	71.4	0	0	0	110.7	T78 L81 L99 L105 L123 N125 L126	T78-L102 HydrophobicContact CG2-CD1 3.94Å; T78-L102 WeakPolarHBondContact O-CA 3.5Å; T78-L102 PolarHBondContact O-N 3.47Å; L81-L102 HydrophobicContact CB-CD1 3.67Å; L99-L102 HydrophobicContact CB-CB 4.02Å; L99-L102 HydrophobicContact CB-CD2 4.42Å; L99-L102 HydrophobicContact CD1-CD2 4.26Å; L99-L102 VanDerWaalsContact O-CB 3.23Å; L99-L102 WeakPolarHBondContact O-CB 3.21Å; L99-L102 PolarHBondContact O-N 2.78Å; L102-L105 HydrophobicContact CD2-CB 3.97Å; L102-L105 HydrophobicContact CD2-CD1 4.29Å; L102-L105 HydrophobicContact CD2-CD2 4.28Å; L102-L105 HydrophobicContact CD2-CG 4.41Å; L102-L123 HydrophobicContact CB-CD2 3.98Å; L102-L123 HydrophobicContact CD2-CD1 4.31Å; L102-L123 HydrophobicContact CD2-CD2 3.77Å; L102-N125 CarbonylContact O-C 3.36Å; L102-L126 HydrophobicContact CD2-CD1 4.35Å; L102-L126 HydrophobicContact CG-CD1 4.38Å; L102-L126 WeakPolarHBondContact O-CA 3.46Å; L102-L126 PolarHBondContact O-N 3.47Å
103	E	98	Very high	96.5	Very high	65 Å²	65	56.3 Å²	56.3	30%	0.304	26%	0.255	S	S	.	.			trans	-99.7	-35.6	177.6	-66	171.7	-140.8	0	0	111.1	R79 H101 N127 T128	R79-E103 VanDerWaalsContact CD-OE1 3.27Å; R79-E103 WeakPolarHBondContact CD-OE1 3.25Å; R79-E103 IonicContact CZ-OE1 2.69Å; R79-E103 IonicContact NE-OE1 3.6Å; R79-E103 IonicContact NH1-OE1 2.74Å; R79-E103 PolarHBondContact NH1-OE1 3.21Å; R79-E103 PolarHBondContact O-N 3.01Å; H101-E103 PolarHBondContact O-N 2.76Å; E103-N127 WeakPolarHBondContact O-CA 3.48Å; E103-N127 WeakPolarHBondContact O-CB 3.35Å; E103-N127 PolarHBondContact O-N 3.25Å; E103-T128 PolarHBondContact O-N 3.34Å
104	I	98.4	Very high	96.5	Very high	52 Å²	52	56.3 Å²	56.3	27%	0.267	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	124.1	-175.7	-58.4	172.5	0	0	0	109.9	R79 L80 L81 Q106 T128	R79-I104 PolarHBondContact O-N 3.49Å; L80-I104 WeakPolarHBondContact CA-O 3.32Å; L80-I104 HydrophobicContact CB-CB 4.47Å; L80-I104 HydrophobicContact CD1-CD1 4.3Å; L80-I104 HydrophobicContact CG-CB 4.16Å; L80-I104 HydrophobicContact CG-CG2 4.25Å; L81-I104 PolarHBondContact N-O 3.32Å; I104-Q106 HydrophobicContact CG2-CG 3.86Å; I104-T128 WeakPolarHBondContact CA-O 3.05Å
105	L	98.2	Very high	96.7	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	111.3	176	178.5	51.5	0	0	0	110.3	L81 F96 L102 L107 F120 L123 L126 T128 L129 E130	L81-L105 HydrophobicContact CB-CD1 4.18Å; L81-L105 HydrophobicContact CD2-CD1 3.89Å; L81-L105 HydrophobicContact CG-CD1 4.15Å; F96-L105 HydrophobicContact CD2-CD2 4.04Å; F96-L105 HydrophobicContact CE1-CD1 4.1Å; F96-L105 HydrophobicContact CE1-CD2 4.36Å; F96-L105 HydrophobicContact CE2-CD2 3.81Å; F96-L105 HydrophobicContact CG-CD2 4.41Å; F96-L105 HydrophobicContact CZ-CD1 4.2Å; F96-L105 HydrophobicContact CZ-CD2 3.99Å; L102-L105 HydrophobicContact CD2-CB 3.97Å; L102-L105 HydrophobicContact CD2-CD1 4.29Å; L102-L105 HydrophobicContact CD2-CD2 4.28Å; L102-L105 HydrophobicContact CD2-CG 4.41Å; L105-L107 HydrophobicContact CD1-CD1 4.23Å; L105-L107 HydrophobicContact CD1-CG 3.98Å; L105-L107 HydrophobicContact CD2-CD1 3.95Å; L105-L107 HydrophobicContact CG-CD1 3.95Å; L105-L107 HydrophobicContact CG-CG 4.06Å; L105-F120 HydrophobicContact CD2-CD1 4.05Å; L105-F120 HydrophobicContact CD2-CE1 3.86Å; L105-L123 HydrophobicContact CD2-CD1 4.04Å; L105-L126 HydrophobicContact CB-CD1 3.69Å; L105-T128 PolarHBondContact N-O 2.9Å; L105-L129 HydrophobicContact CB-CD1 4.07Å; L105-L129 HydrophobicContact CD2-CD1 3.96Å; L105-L129 HydrophobicContact CG-CD1 3.95Å; L105-E130 PolarHBondContact O-N 3.38Å
106	Q	98.5	Very high	96.7	Very high	37 Å²	37	55.7 Å²	55.7	17%	0.173	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	99.9	-179.4	-44.8	-176	-94.1	0	0	110.2	L81 N82 L83 I104 E130	L81-Q106 PolarHBondContact O-N 3.21Å; N82-Q106 HydrophobicContact CB-CB 4.31Å; N82-Q106 PolarHBondContact ND2-OE1 2.94Å; L83-Q106 WeakPolarHBondContact CA-O 3.44Å; L83-Q106 PolarHBondContact N-O 3.34Å; I104-Q106 HydrophobicContact CG2-CG 3.86Å; Q106-E130 HydrophobicContact CG-CG 4.46Å; Q106-E130 PolarHBondContact NE2-OE1 3.07Å; Q106-E130 PolarHBondContact NE2-OE2 2.92Å
107	L	98.2	Very high	96.7	Very high	0 Å²	0	62 Å²	62	0%	0	28%	0.279	C	S	.	.			trans	-109	12.9	176.4	-73.2	166.7	0	0	0	112	L83 I88 I91 F96 L105 N110 I112 F120 E130 L131 N134	L83-L107 HydrophobicContact CB-CD2 4.07Å; L83-L107 HydrophobicContact CD1-CD2 3.72Å; I88-L107 HydrophobicContact CD1-CD2 4.5Å; I91-L107 HydrophobicContact CD1-CD1 4.14Å; I91-L107 HydrophobicContact CD1-CD2 3.99Å; I91-L107 HydrophobicContact CG1-CD1 4.37Å; F96-L107 HydrophobicContact CE2-CD1 4.32Å; F96-L107 HydrophobicContact CZ-CD1 4.1Å; F96-L107 HydrophobicContact CZ-CD2 4.36Å; L105-L107 HydrophobicContact CD1-CD1 4.23Å; L105-L107 HydrophobicContact CD1-CG 3.98Å; L105-L107 HydrophobicContact CD2-CD1 3.95Å; L105-L107 HydrophobicContact CG-CD1 3.95Å; L105-L107 HydrophobicContact CG-CG 4.06Å; L107-N110 PolarHBondContact O-ND2 3.03Å; L107-I112 HydrophobicContact CB-CD1 3.92Å; L107-I112 HydrophobicContact CD2-CD1 4.42Å; L107-F120 HydrophobicContact CD1-CE1 4.08Å; L107-F120 HydrophobicContact CD1-CZ 4.48Å; L107-E130 CarbonylContact C-O 3.44Å; L107-E130 WeakPolarHBondContact CA-O 3.32Å; L107-E130 WeakPolarHBondContact CB-O 3.42Å; L107-E130 PolarHBondContact N-O 2.83Å; L107-L131 HydrophobicContact CB-CD2 3.88Å; L107-L131 HydrophobicContact CD1-CD2 4.08Å; L107-N134 PolarHBondContact O-ND2 3.12Å
108	S	97.9	Very high	96.7	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	26%	0.261	C	S	.	.			trans	-64.1	154.4	-179.5	42.1	0	0	0	0	112.9	H84 E85 N110 E130 F132	H84-S108 WeakPolarHBondContact CA-O 3.48Å; H84-S108 PolarHBondContact ND1-O 3.39Å; H84-S108 PolarHBondContact ND1-OG 3.37Å; E85-S108 PolarHBondContact N-O 3.21Å; S108-N110 PolarHBondContact O-N 3.23Å; S108-N110 PolarHBondContact O-ND2 2.81Å; S108-N110 VanDerWaalsContact O-ND2 3.15Å; S108-E130 PolarHBondContact N-O 3.2Å; S108-E130 PolarHBondContact OG-OE2 2.94Å; S108-F132 CarbonylContact C-O 3.59Å; S108-F132 WeakPolarHBondContact CA-O 3.37Å; S108-F132 VanDerWaalsContact CB-CE1 3.46Å; S108-F132 VanDerWaalsContact CB-CE2 3.49Å; S108-F132 VanDerWaalsContact CB-CZ 3.4Å
109	R	98.2	Very high	96.9	Very high	113 Å²	113	51 Å²	51	43%	0.426	23%	0.231	S	C	.	.	S	Bend	trans	50.7	53	-175	-67.7	-175.4	-171.2	156.9	3.8	113.5	E85 N86 F132 D133	E85-R109 WeakPolarHBondContact CA-O 3.24Å; E85-R109 HydrophobicContact CB-CB 4.46Å; E85-R109 HydrophobicContact CG-CB 3.62Å; E85-R109 HydrophobicContact CG-CG 4.2Å; E85-R109 PolarHBondContact N-O 3Å; E85-R109 WeakPolarHBondContact OE1-CD 3.36Å; E85-R109 IonicContact OE1-CZ 3.99Å; E85-R109 IonicContact OE1-NE 3.14Å; E85-R109 IonicContact OE1-NH1 2.7Å; E85-R109 PolarHBondContact OE1-NH1 2.72Å; N86-R109 PolarHBondContact N-O 2.88Å; R109-F132 PolarHBondContact N-O 3.37Å; R109-D133 WeakPolarHBondContact CA-O 3.44Å; R109-D133 HydrophobicContact CB-CB 4.27Å; R109-D133 HydrophobicContact CG-CB 3.43Å; R109-D133 VanDerWaalsContact CG-CB 3.43Å; R109-D133 WeakPolarHBondContact CG-OD2 3.39Å; R109-D133 IonicContact CZ-OD2 2.73Å; R109-D133 IonicContact NE-OD2 3.37Å; R109-D133 PolarHBondContact NE-OD2 3.02Å; R109-D133 IonicContact NH2-OD2 2.65Å
110	N	98.3	Very high	97	Very high	2 Å²	2	50.7 Å²	50.7	1%	0.011	23%	0.23	C	C	.	.	S	Bend	trans	-118.2	-170.9	170.7	-86.7	-88.6	0	0	0	110.2	L83 N86 I88 L107 S108 I112 N134	L83-N110 PolarHBondContact O-ND2 2.65Å; N86-N110 WeakPolarHBondContact CA-OD1 3.5Å; N86-N110 WeakPolarHBondContact CB-OD1 3.15Å; N86-N110 PolarHBondContact O-OD1 2.87Å; I88-N110 HydrophobicContact CB-CB 4.41Å; I88-N110 WeakPolarHBondContact CB-OD1 3.42Å; I88-N110 WeakPolarHBondContact CG1-OD1 3.23Å; I88-N110 PolarHBondContact N-OD1 3.28Å; I88-N110 VanDerWaalsContact N-OD1 3.12Å; L107-N110 PolarHBondContact O-ND2 3.03Å; S108-N110 PolarHBondContact O-N 3.23Å; S108-N110 PolarHBondContact O-ND2 2.81Å; S108-N110 VanDerWaalsContact O-ND2 3.15Å; N110-I112 HydrophobicContact CB-CD1 4.01Å; N110-I112 HydrophobicContact CB-CG1 3.84Å; N110-N134 VanDerWaalsContact CA-OD1 3.25Å; N110-N134 WeakPolarHBondContact CA-OD1 3.42Å; N110-N134 WeakPolarHBondContact CB-OD1 3.36Å; N110-N134 PolarHBondContact N-OD1 3.2Å; N110-N134 PolarHBondContact O-OD1 3.3Å
111	H	97.9	Very high	97	Very high	87 Å²	87	44.9 Å²	44.9	40%	0.403	21%	0.212	S	C	.	.			trans	-106.7	24.2	178.5	-68.9	68.8	0	0	0	111	N86 I88 Q89 R113	N86-H111 PolarHBondContact O-ND1 3.26Å; I88-H111 CarbonylContact O-C 3.54Å; I88-H111 VanDerWaalsContact O-CA 3.31Å; I88-H111 WeakPolarHBondContact O-CA 3.24Å; I88-H111 PolarHBondContact O-N 3.1Å; Q89-H111 WeakPolarHBondContact CA-O 3.21Å; Q89-H111 HydrophobicContact CG-CB 4.03Å; H111-R113 PolarHBondContact O-N 2.78Å; H111-R113 VanDerWaalsContact O-N 3.08Å
112	I	98.3	Very high	96.9	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.21	C	C	.	.			trans	-66.7	112.6	-168.7	-57.7	165.6	0	0	0	109.1	I88 Q89 I91 L107 N110 T114 I115 L131 N134 R135 L136	I88-I112 HydrophobicContact CG2-CG1 4.42Å; I88-I112 WeakPolarHBondContact O-CG1 3.4Å; I88-I112 PolarHBondContact O-N 3.5Å; Q89-I112 WeakPolarHBondContact O-CA 3.37Å; I91-I112 HydrophobicContact CD1-CD1 3.83Å; I91-I112 HydrophobicContact CD1-CG1 4.22Å; I91-I112 HydrophobicContact CG1-CD1 4.02Å; I91-I112 HydrophobicContact CG1-CG1 4.4Å; I91-I112 HydrophobicContact CG1-CG2 4.14Å; L107-I112 HydrophobicContact CB-CD1 3.92Å; L107-I112 HydrophobicContact CD2-CD1 4.42Å; N110-I112 HydrophobicContact CB-CD1 4.01Å; N110-I112 HydrophobicContact CB-CG1 3.84Å; I112-T114 WeakPolarHBondContact CG2-O 3.45Å; I112-I115 HydrophobicContact CG2-CD1 4.14Å; I112-I115 HydrophobicContact CG2-CG1 3.67Å; I112-L131 HydrophobicContact CD1-CD2 4.11Å; I112-N134 HydrophobicContact CB-CB 4.35Å; I112-N134 VanDerWaalsContact CB-OD1 3.26Å; I112-N134 WeakPolarHBondContact CB-OD1 3.39Å; I112-N134 VanDerWaalsContact CG1-OD1 3.29Å; I112-N134 WeakPolarHBondContact CG1-OD1 3.32Å; I112-N134 PolarHBondContact N-OD1 2.88Å; I112-R135 CarbonylContact O-C 3.1Å; I112-R135 VanDerWaalsContact O-CA 3.27Å; I112-R135 WeakPolarHBondContact O-CA 3.41Å; I112-R135 WeakPolarHBondContact O-CB 3.43Å; I112-R135 PolarHBondContact O-N 2.99Å; I112-L136 HydrophobicContact CG2-CD2 4.02Å; I112-L136 PolarHBondContact O-N 3.09Å; I112-L136 VanDerWaalsContact O-N 3.16Å
113	R	97.3	Very high	96.8	Very high	136 Å²	136	42.5 Å²	42.5	51%	0.513	21%	0.211	S	C	.	.			trans	-100.5	-28.8	176.1	52.1	169.6	176.4	178.7	-2.9	112.4	Q89 H111 R135	Q89-R113 VanDerWaalsContact O-CG 3.24Å; Q89-R113 WeakPolarHBondContact O-CG 3.36Å; Q89-R113 PolarHBondContact O-N 2.8Å; H111-R113 PolarHBondContact O-N 2.78Å; H111-R113 VanDerWaalsContact O-N 3.08Å; R113-R135 HydrophobicContact CB-CB 4.44Å
114	T	96.5	Very high	96.6	Very high	67 Å²	67	42 Å²	42	41%	0.411	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	144.4	-178	51.1	0	0	0	0	111.2	I90 I91 I112	I90-T114 WeakPolarHBondContact CA-O 3.43Å; I91-T114 PolarHBondContact N-O 3.17Å; I112-T114 WeakPolarHBondContact CG2-O 3.45Å
115	I	97.4	Very high	96.5	Very high	18 Å²	18	42 Å²	42	9%	0.092	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	120.6	173.3	-59.9	-175.5	0	0	0	106	I91 I112 A119 F120 L131 L136 P140 A143	I91-I115 HydrophobicContact CB-CG1 4.29Å; I91-I115 HydrophobicContact CB-CG2 4.22Å; I91-I115 HydrophobicContact CG1-CG1 4.1Å; I112-I115 HydrophobicContact CG2-CD1 4.14Å; I112-I115 HydrophobicContact CG2-CG1 3.67Å; I115-A119 HydrophobicContact CG2-CB 3.58Å; I115-F120 HydrophobicContact CD1-CE2 4.34Å; I115-F120 HydrophobicContact CD1-CZ 4.11Å; I115-F120 HydrophobicContact CG2-CD2 4.48Å; I115-F120 HydrophobicContact CG2-CE2 3.79Å; I115-F120 HydrophobicContact CG2-CZ 4.07Å; I115-L131 HydrophobicContact CD1-CD1 3.78Å; I115-L131 HydrophobicContact CD1-CD2 3.75Å; I115-L131 HydrophobicContact CD1-CG 4.44Å; I115-L136 HydrophobicContact CD1-CD1 4.45Å; I115-L136 HydrophobicContact CD1-CD2 4.27Å; I115-L136 HydrophobicContact CG1-CD2 4.16Å; I115-P140 HydrophobicContact CB-CB 4.19Å; I115-P140 HydrophobicContact CB-CG 4.34Å; I115-P140 HydrophobicContact CD1-CG 4.2Å; I115-A143 HydrophobicContact CB-CB 4.38Å; I115-A143 HydrophobicContact CG2-CB 3.54Å
116	E	95.9	Very high	96.4	Very high	76 Å²	76	42.1 Å²	42.1	36%	0.355	22%	0.219	S	C	.	.			trans	-76.4	154.5	-173.4	-64.4	174.7	177.9	0	0	111.9	I90 I91 K92 V93 G118 A119	I90-E116 HydrophobicContact CG2-CG 4.39Å; I91-E116 PolarHBondContact O-N 2.83Å; K92-E116 WeakPolarHBondContact CA-OE2 3.48Å; V93-E116 HydrophobicContact CG2-CB 3.7Å; V93-E116 WeakPolarHBondContact CG2-OE2 3.47Å; V93-E116 PolarHBondContact N-OE2 2.9Å; E116-G118 PolarHBondContact O-N 2.95Å; E116-A119 WeakPolarHBondContact O-CB 3.38Å; E116-A119 PolarHBondContact O-N 2.95Å
117	I	94.7	Very high	96.4	Very high	134 Å²	134	42.6 Å²	42.6	69%	0.687	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.5	122.1	177.6	-64	172.1	0	0	0	108.6	V93	V93-I117 WeakPolarHBondContact CG2-O 3.05Å
118	G	93.9	Very high	96.4	Very high	9 Å²	9	43.2 Å²	43.2	9%	0.093	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.1	16.2	-173.8	0	0	0	0	0	115.5	N94 E116 F120 N121	N94-G118 PolarHBondContact N-O 3.02Å; E116-G118 PolarHBondContact O-N 2.95Å; G118-F120 PolarHBondContact O-N 2.73Å; G118-N121 VanDerWaalsContact CA-OD1 3.32Å; G118-N121 WeakPolarHBondContact CA-OD1 3.48Å; G118-N121 VanDerWaalsContact O-CB 3.29Å; G118-N121 WeakPolarHBondContact O-CB 3.39Å; G118-N121 PolarHBondContact O-N 2.87Å; G118-N121 PolarHBondContact O-ND2 2.77Å
119	A	96.6	Very high	96.5	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-41.8	168.5	0	0	0	0	0	113	I91 K92 I115 E116	I91-A119 HydrophobicContact CB-CB 4.35Å; I91-A119 HydrophobicContact CG2-CB 3.77Å; K92-A119 WeakPolarHBondContact O-CA 3.11Å; I115-A119 HydrophobicContact CG2-CB 3.58Å; E116-A119 WeakPolarHBondContact O-CB 3.38Å; E116-A119 PolarHBondContact O-N 2.95Å
120	F	96.4	Very high	96.5	Very high	2 Å²	2	39 Å²	39	1%	0.009	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	15.5	-178.9	-56.9	-57.2	0	0	0	114.1	F96 L105 L107 I115 G118 L123 L129 L131 A143 F144 L147	F96-F120 AromaticContact CD2-CD1 3.98Å; F96-F120 HydrophobicContact CD2-CD1 3.98Å; F96-F120 HydrophobicContact CD2-CE1 4.38Å; F96-F120 HydrophobicContact CE2-CD1 4.04Å; F96-F120 AromaticContact CE2-CE1 3.96Å; F96-F120 HydrophobicContact CE2-CE1 3.96Å; L105-F120 HydrophobicContact CD2-CD1 4.05Å; L105-F120 HydrophobicContact CD2-CE1 3.86Å; L107-F120 HydrophobicContact CD1-CE1 4.08Å; L107-F120 HydrophobicContact CD1-CZ 4.48Å; I115-F120 HydrophobicContact CD1-CE2 4.34Å; I115-F120 HydrophobicContact CD1-CZ 4.11Å; I115-F120 HydrophobicContact CG2-CD2 4.48Å; I115-F120 HydrophobicContact CG2-CE2 3.79Å; I115-F120 HydrophobicContact CG2-CZ 4.07Å; G118-F120 PolarHBondContact O-N 2.73Å; F120-L123 HydrophobicContact CB-CD1 4.07Å; F120-L123 HydrophobicContact CD1-CD1 4Å; F120-L123 WeakPolarHBondContact O-CB 3.42Å; F120-L123 WeakPolarHBondContact O-CG 3.24Å; F120-L123 PolarHBondContact O-N 2.9Å; F120-L129 HydrophobicContact CD2-CD2 4.36Å; F120-L129 HydrophobicContact CE1-CD1 4.08Å; F120-L129 HydrophobicContact CE1-CD2 4.32Å; F120-L129 HydrophobicContact CE2-CD2 3.88Å; F120-L129 HydrophobicContact CZ-CD1 4.14Å; F120-L129 HydrophobicContact CZ-CD2 3.86Å; F120-L131 HydrophobicContact CZ-CD1 4.37Å; F120-A143 HydrophobicContact CD2-CB 4.07Å; F120-A143 WeakPolarHBondContact CD2-O 3.33Å; F120-A143 HydrophobicContact CE2-CB 4.15Å; F120-F144 HydrophobicContact CD2-CD1 4.4Å; F120-F144 HydrophobicContact CE2-CD1 4.34Å; F120-F144 HydrophobicContact CE2-CE1 4.21Å; F120-L147 HydrophobicContact CB-CD1 4.16Å; F120-L147 HydrophobicContact CB-CD2 4.06Å; F120-L147 HydrophobicContact CD2-CD1 4.34Å; F120-L147 HydrophobicContact CG-CD1 4.48Å
121	N	94.5	Very high	96.5	Very high	52 Å²	52	39 Å²	39	28%	0.278	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	142.7	176.3	-79.7	-13.8	0	0	0	112	N94 K97 G118 L123	N94-N121 WeakPolarHBondContact OD1-CB 3.49Å; N94-N121 PolarHBondContact OD1-ND2 2.73Å; K97-N121 WeakPolarHBondContact CA-O 3.45Å; G118-N121 VanDerWaalsContact CA-OD1 3.32Å; G118-N121 WeakPolarHBondContact CA-OD1 3.48Å; G118-N121 VanDerWaalsContact O-CB 3.29Å; G118-N121 WeakPolarHBondContact O-CB 3.39Å; G118-N121 PolarHBondContact O-N 2.87Å; G118-N121 PolarHBondContact O-ND2 2.77Å; N121-L123 VanDerWaalsContact C-N 3.27Å; N121-L123 PolarHBondContact O-N 2.9Å
122	G	92.7	Very high	96.5	Very high	38 Å²	38	36.5 Å²	36.5	39%	0.392	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.7	-8.1	176	0	0	0	0	0	115.6	A124	G122-A124 PolarHBondContact O-N 2.84Å
123	L	96	Very high	96.5	Very high	4 Å²	4	37.7 Å²	37.7	2%	0.021	21%	0.206	C	C	.	.			trans	-78.4	52.7	-178.9	-65.4	-172.1	0	0	0	113.7	F96 L99 L102 L105 F120 N121 N125 L126 L147	F96-L123 HydrophobicContact CB-CD1 3.89Å; F96-L123 HydrophobicContact CB-CD2 3.67Å; F96-L123 HydrophobicContact CB-CG 3.94Å; F96-L123 HydrophobicContact CD2-CD1 4.18Å; F96-L123 HydrophobicContact CG-CD1 4.26Å; L99-L123 HydrophobicContact CB-CD2 4Å; L99-L123 WeakPolarHBondContact O-CD2 3.39Å; L102-L123 HydrophobicContact CB-CD2 3.98Å; L102-L123 HydrophobicContact CD2-CD1 4.31Å; L102-L123 HydrophobicContact CD2-CD2 3.77Å; L105-L123 HydrophobicContact CD2-CD1 4.04Å; F120-L123 HydrophobicContact CB-CD1 4.07Å; F120-L123 HydrophobicContact CD1-CD1 4Å; F120-L123 WeakPolarHBondContact O-CB 3.42Å; F120-L123 WeakPolarHBondContact O-CG 3.24Å; F120-L123 PolarHBondContact O-N 2.9Å; N121-L123 VanDerWaalsContact C-N 3.27Å; N121-L123 PolarHBondContact O-N 2.9Å; L123-N125 PolarHBondContact O-N 2.82Å; L123-L126 HydrophobicContact CB-CB 4.04Å; L123-L126 HydrophobicContact CB-CD2 4.47Å; L123-L126 HydrophobicContact CD1-CD2 3.99Å; L123-L126 WeakPolarHBondContact O-CB 3.2Å; L123-L126 PolarHBondContact O-N 2.96Å; L123-L126 VanDerWaalsContact O-N 3.09Å; L123-L147 HydrophobicContact CB-CD2 4.14Å
124	A	92.7	Very high	96.5	Very high	54 Å²	54	31.2 Å²	31.2	45%	0.446	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-7.5	-172	0	0	0	0	0	116	G122 K149	G122-A124 PolarHBondContact O-N 2.84Å; A124-K149 WeakPolarHBondContact O-CD 3.27Å; A124-K149 WeakPolarHBondContact O-CE 3.49Å
125	N	96	Very high	96.6	Very high	54 Å²	54	34 Å²	34	29%	0.289	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.7	4.8	175.1	-73.1	-58.4	0	0	0	114.3	R100 L102 L123 N127 K149	R100-N125 PolarHBondContact O-ND2 3.14Å; L102-N125 CarbonylContact O-C 3.36Å; L123-N125 PolarHBondContact O-N 2.82Å; N125-N127 PolarHBondContact O-N 3.38Å; N125-K149 PolarHBondContact OD1-NZ 2.84Å
126	L	97.6	Very high	96.6	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.005	18%	0.182	C	C	.	.			trans	-65	125.6	-175.9	-170.6	72.2	0	0	0	110.9	L102 L105 L123 L129 L147 K149 L150	L102-L126 HydrophobicContact CD2-CD1 4.35Å; L102-L126 HydrophobicContact CG-CD1 4.38Å; L102-L126 WeakPolarHBondContact O-CA 3.46Å; L102-L126 PolarHBondContact O-N 3.47Å; L105-L126 HydrophobicContact CB-CD1 3.69Å; L123-L126 HydrophobicContact CB-CB 4.04Å; L123-L126 HydrophobicContact CB-CD2 4.47Å; L123-L126 HydrophobicContact CD1-CD2 3.99Å; L123-L126 WeakPolarHBondContact O-CB 3.2Å; L123-L126 PolarHBondContact O-N 2.96Å; L123-L126 VanDerWaalsContact O-N 3.09Å; L126-L129 HydrophobicContact CD2-CB 4.23Å; L126-L147 HydrophobicContact CD2-CD1 4.46Å; L126-L147 HydrophobicContact CD2-CD2 4.3Å; L126-K149 CarbonylContact O-C 3.37Å; L126-L150 HydrophobicContact CD2-CD1 4.08Å; L126-L150 HydrophobicContact CG-CD1 4.04Å; L126-L150 VanDerWaalsContact O-CA 3.24Å; L126-L150 WeakPolarHBondContact O-CA 3.18Å; L126-L150 PolarHBondContact O-N 3.15Å; L126-L150 VanDerWaalsContact O-N 3.09Å
127	N	97.9	Very high	96.7	Very high	47 Å²	47	32.4 Å²	32.4	25%	0.251	18%	0.181	S	C	.	.			trans	-114.7	-41.6	-172.9	-176.2	30.8	0	0	0	110.4	E103 N125 K151 E152	E103-N127 WeakPolarHBondContact O-CA 3.48Å; E103-N127 WeakPolarHBondContact O-CB 3.35Å; E103-N127 PolarHBondContact O-N 3.25Å; N125-N127 PolarHBondContact O-N 3.38Å; N127-K151 PolarHBondContact O-N 2.88Å; N127-K151 WeakPolarHBondContact OD1-CB 3.45Å; N127-K151 WeakPolarHBondContact OD1-CD 3.19Å; N127-K151 WeakPolarHBondContact OD1-CG 3.48Å; N127-E152 PolarHBondContact O-N 3.36Å
128	T	98.6	Very high	96.8	Very high	13 Å²	13	30 Å²	30	8%	0.08	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	126.8	178.7	-55.2	0	0	0	0	111.2	E103 I104 L105 E152	E103-T128 PolarHBondContact O-N 3.34Å; I104-T128 WeakPolarHBondContact CA-O 3.05Å; L105-T128 PolarHBondContact N-O 2.9Å; T128-E152 WeakPolarHBondContact CA-O 3.43Å; T128-E152 HydrophobicContact CG2-CB 3.97Å; T128-E152 PolarHBondContact OG1-OE2 3.15Å
129	L	98.2	Very high	96.9	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	115.9	176.2	176.9	56.3	0	0	0	110.4	L105 F120 L126 L131 F144 L150 E152 L153 W154	L105-L129 HydrophobicContact CB-CD1 4.07Å; L105-L129 HydrophobicContact CD2-CD1 3.96Å; L105-L129 HydrophobicContact CG-CD1 3.95Å; F120-L129 HydrophobicContact CD2-CD2 4.36Å; F120-L129 HydrophobicContact CE1-CD1 4.08Å; F120-L129 HydrophobicContact CE1-CD2 4.32Å; F120-L129 HydrophobicContact CE2-CD2 3.88Å; F120-L129 HydrophobicContact CZ-CD1 4.14Å; F120-L129 HydrophobicContact CZ-CD2 3.86Å; L126-L129 HydrophobicContact CD2-CB 4.23Å; L129-L131 HydrophobicContact CD1-CG 4.25Å; L129-L131 HydrophobicContact CD2-CD1 4.07Å; L129-L131 HydrophobicContact CG-CD1 4.16Å; L129-L131 HydrophobicContact CG-CG 4.21Å; L129-F144 HydrophobicContact CD2-CD1 4.47Å; L129-F144 HydrophobicContact CD2-CE1 4.13Å; L129-L150 HydrophobicContact CB-CD1 3.8Å; L129-E152 PolarHBondContact N-O 2.84Å; L129-L153 HydrophobicContact CB-CD1 4.21Å; L129-L153 HydrophobicContact CD2-CD1 4Å; L129-L153 HydrophobicContact CG-CD1 4.08Å; L129-W154 PolarHBondContact O-N 3.39Å
130	E	98.6	Very high	96.8	Very high	26 Å²	26	30.8 Å²	30.8	12%	0.121	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	120.9	174.3	-56.5	173	-162.2	0	0	111.6	L105 Q106 L107 S108 F132 W154	L105-E130 PolarHBondContact O-N 3.38Å; Q106-E130 HydrophobicContact CG-CG 4.46Å; Q106-E130 PolarHBondContact NE2-OE1 3.07Å; Q106-E130 PolarHBondContact NE2-OE2 2.92Å; L107-E130 CarbonylContact C-O 3.44Å; L107-E130 WeakPolarHBondContact CA-O 3.32Å; L107-E130 WeakPolarHBondContact CB-O 3.42Å; L107-E130 PolarHBondContact N-O 2.83Å; S108-E130 PolarHBondContact N-O 3.2Å; S108-E130 PolarHBondContact OG-OE2 2.94Å; E130-F132 HydrophobicContact CB-CD1 3.92Å; E130-F132 HydrophobicContact CB-CE1 3.88Å; E130-F132 HydrophobicContact CG-CD1 4.28Å; E130-F132 HydrophobicContact CG-CE1 3.9Å; E130-F132 WeakPolarHBondContact OE2-CE1 3.5Å; E130-W154 HydrophobicContact CG-CG 4.43Å
131	L	98.3	Very high	96.5	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.198	C	C	.	.			trans	-125.7	13	175.2	-73.4	169.5	0	0	0	112.1	L107 I112 I115 F120 L129 N134 L136 F144 W154 L155 N158	L107-L131 HydrophobicContact CB-CD2 3.88Å; L107-L131 HydrophobicContact CD1-CD2 4.08Å; I112-L131 HydrophobicContact CD1-CD2 4.11Å; I115-L131 HydrophobicContact CD1-CD1 3.78Å; I115-L131 HydrophobicContact CD1-CD2 3.75Å; I115-L131 HydrophobicContact CD1-CG 4.44Å; F120-L131 HydrophobicContact CZ-CD1 4.37Å; L129-L131 HydrophobicContact CD1-CG 4.25Å; L129-L131 HydrophobicContact CD2-CD1 4.07Å; L129-L131 HydrophobicContact CG-CD1 4.16Å; L129-L131 HydrophobicContact CG-CG 4.21Å; L131-N134 WeakPolarHBondContact O-CB 3.37Å; L131-N134 PolarHBondContact O-ND2 3.24Å; L131-L136 HydrophobicContact CB-CD1 4.46Å; L131-F144 HydrophobicContact CD1-CE1 4.4Å; L131-W154 CarbonylContact C-O 3.25Å; L131-W154 WeakPolarHBondContact CA-O 3.32Å; L131-W154 PolarHBondContact N-O 3.44Å; L131-L155 HydrophobicContact CB-CD2 3.83Å; L131-L155 HydrophobicContact CD1-CD2 4.06Å; L131-N158 PolarHBondContact O-ND2 3.36Å
132	F	98.2	Very high	96.2	Very high	36 Å²	36	33.3 Å²	33.3	16%	0.158	19%	0.194	C	C	.	.			trans	-68.1	161.9	-177.7	66	-101.4	0	0	0	114.4	S108 R109 E130 N134 W154 R156	S108-F132 CarbonylContact C-O 3.59Å; S108-F132 WeakPolarHBondContact CA-O 3.37Å; S108-F132 VanDerWaalsContact CB-CE1 3.46Å; S108-F132 VanDerWaalsContact CB-CE2 3.49Å; S108-F132 VanDerWaalsContact CB-CZ 3.4Å; R109-F132 PolarHBondContact N-O 3.37Å; E130-F132 HydrophobicContact CB-CD1 3.92Å; E130-F132 HydrophobicContact CB-CE1 3.88Å; E130-F132 HydrophobicContact CG-CD1 4.28Å; E130-F132 HydrophobicContact CG-CE1 3.9Å; E130-F132 WeakPolarHBondContact OE2-CE1 3.5Å; F132-N134 VanDerWaalsContact C-N 3.31Å; F132-N134 PolarHBondContact O-N 2.99Å; F132-N134 PolarHBondContact O-ND2 2.92Å; F132-W154 HydrophobicContact CD1-CB 3.97Å; F132-W154 PolarHBondContact N-O 3.44Å; F132-R156 WeakPolarHBondContact CA-O 3.47Å; F132-R156 HydrophobicContact CB-CG 3.63Å; F132-R156 WeakPolarHBondContact CB-O 3.44Å; F132-R156 HydrophobicContact CG-CG 4.38Å
133	D	98.4	Very high	96.2	Very high	25 Å²	25	31.7 Å²	31.7	13%	0.134	18%	0.177	C	C	.	.	S	Bend	trans	55.1	39	-177.1	-65.5	-30.2	0	0	0	113.4	R109 R156 N157	R109-D133 WeakPolarHBondContact CA-O 3.44Å; R109-D133 HydrophobicContact CB-CB 4.27Å; R109-D133 HydrophobicContact CG-CB 3.43Å; R109-D133 VanDerWaalsContact CG-CB 3.43Å; R109-D133 WeakPolarHBondContact CG-OD2 3.39Å; R109-D133 IonicContact CZ-OD2 2.73Å; R109-D133 IonicContact NE-OD2 3.37Å; R109-D133 PolarHBondContact NE-OD2 3.02Å; R109-D133 IonicContact NH2-OD2 2.65Å; D133-R156 PolarHBondContact N-O 2.88Å; D133-N157 WeakPolarHBondContact OD1-CB 3.27Å; D133-N157 PolarHBondContact OD1-ND2 3.34Å
134	N	98.5	Very high	95.9	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.176	C	C	.	.	S	Bend	trans	-110.8	-157.1	-178.3	-90.8	-73.2	0	0	0	112.6	L107 N110 I112 L131 F132 N158	L107-N134 PolarHBondContact O-ND2 3.12Å; N110-N134 VanDerWaalsContact CA-OD1 3.25Å; N110-N134 WeakPolarHBondContact CA-OD1 3.42Å; N110-N134 WeakPolarHBondContact CB-OD1 3.36Å; N110-N134 PolarHBondContact N-OD1 3.2Å; N110-N134 PolarHBondContact O-OD1 3.3Å; I112-N134 HydrophobicContact CB-CB 4.35Å; I112-N134 VanDerWaalsContact CB-OD1 3.26Å; I112-N134 WeakPolarHBondContact CB-OD1 3.39Å; I112-N134 VanDerWaalsContact CG1-OD1 3.29Å; I112-N134 WeakPolarHBondContact CG1-OD1 3.32Å; I112-N134 PolarHBondContact N-OD1 2.88Å; L131-N134 WeakPolarHBondContact O-CB 3.37Å; L131-N134 PolarHBondContact O-ND2 3.24Å; F132-N134 VanDerWaalsContact C-N 3.31Å; F132-N134 PolarHBondContact O-N 2.99Å; F132-N134 PolarHBondContact O-ND2 2.92Å; N134-N158 VanDerWaalsContact CA-OD1 3.29Å; N134-N158 WeakPolarHBondContact CA-OD1 3.39Å; N134-N158 WeakPolarHBondContact CB-OD1 3.1Å
135	R	98.2	Very high	95.6	Very high	125 Å²	125	31 Å²	31	47%	0.472	17%	0.167	S	C	.	.			trans	-127.7	23.8	-175.6	-59.1	-64.8	176.9	-97.7	-0.7	112.9	I112 R113 T137 N158	I112-R135 CarbonylContact O-C 3.1Å; I112-R135 VanDerWaalsContact O-CA 3.27Å; I112-R135 WeakPolarHBondContact O-CA 3.41Å; I112-R135 WeakPolarHBondContact O-CB 3.43Å; I112-R135 PolarHBondContact O-N 2.99Å; R113-R135 HydrophobicContact CB-CB 4.44Å; R135-T137 PolarHBondContact O-N 2.93Å; R135-N158 PolarHBondContact N-OD1 3Å
136	L	98	Very high	94.9	Very high	4 Å²	4	37.7 Å²	37.7	2%	0.021	19%	0.19	C	C	.	.			trans	-69.9	121.4	178	-60.5	172.5	0	0	0	110.6	I112 I115 L131 L155 N158 P159 I160	I112-L136 HydrophobicContact CG2-CD2 4.02Å; I112-L136 PolarHBondContact O-N 3.09Å; I112-L136 VanDerWaalsContact O-N 3.16Å; I115-L136 HydrophobicContact CD1-CD1 4.45Å; I115-L136 HydrophobicContact CD1-CD2 4.27Å; I115-L136 HydrophobicContact CG1-CD2 4.16Å; L131-L136 HydrophobicContact CB-CD1 4.46Å; L136-L155 HydrophobicContact CD1-CD2 3.81Å; L136-N158 HydrophobicContact CB-CB 4.3Å; L136-N158 WeakPolarHBondContact CB-OD1 3.38Å; L136-N158 PolarHBondContact N-OD1 2.83Å; L136-P159 CarbonylContact O-C 3.08Å; L136-P159 VanDerWaalsContact O-C 3.29Å; L136-P159 VanDerWaalsContact O-CD 3.24Å; L136-P159 WeakPolarHBondContact O-CD 3.36Å; L136-P159 WeakPolarHBondContact O-CG 3.25Å; L136-I160 WeakPolarHBondContact O-CG1 3.31Å; L136-I160 PolarHBondContact O-N 3.26Å
137	T	97.3	Very high	94.7	Very high	56 Å²	56	37.8 Å²	37.8	34%	0.344	19%	0.191	S	C	.	.	S	Bend	trans	-89.9	-17.1	174.7	52.5	0	0	0	0	113.3	R135 P159 I160 E161	R135-T137 PolarHBondContact O-N 2.93Å; T137-P159 WeakPolarHBondContact CA-O 3.47Å; T137-P159 HydrophobicContact CG2-CG 4.38Å; T137-I160 WeakPolarHBondContact O-CA 3.29Å; T137-E161 PolarHBondContact O-N 3.2Å
138	T	96.9	Very high	94.2	Very high	84 Å²	84	39.8 Å²	39.8	52%	0.515	21%	0.208	S	C	.	.	S	Bend	trans	-138.3	161.2	177.9	57.4	0	0	0	0	110.7	P140	T138-P140 WeakPolarHBondContact O-CD 3.22Å
139	I	96.3	Very high	94.1	Very high	8 Å²	8	44.2 Å²	44.2	4%	0.041	23%	0.226	C	C	.	.			trans	-80.4	121.7	174.3	-66.3	161.3	0	0	0	108.8	N141 F144 I160 I163 A167 F168	I139-N141 PolarHBondContact O-N 2.94Å; I139-F144 HydrophobicContact CG2-CE2 3.88Å; I139-I160 HydrophobicContact CG1-CD1 4.05Å; I139-I160 HydrophobicContact CG1-CG2 4.32Å; I139-I163 HydrophobicContact CD1-CB 4.13Å; I139-I163 HydrophobicContact CD1-CG1 3.89Å; I139-I163 HydrophobicContact CD1-CG2 3.74Å; I139-A167 HydrophobicContact CD1-CB 4.31Å; I139-A167 HydrophobicContact CG2-CB 4.43Å; I139-F168 HydrophobicContact CD1-CE1 4.35Å; I139-F168 HydrophobicContact CD1-CE2 4.23Å; I139-F168 HydrophobicContact CD1-CZ 3.62Å; I139-F168 HydrophobicContact CG1-CZ 4.4Å; I139-F168 HydrophobicContact CG2-CE1 3.87Å; I139-F168 HydrophobicContact CG2-CZ 4.22Å
140	P	93.8	Very high	94	Very high	18 Å²	18	44.2 Å²	44.2	12%	0.117	23%	0.226	C	C	.	.			trans	-80.8	67.1	-176.1	33.4	-35.1	0	0	0	111.4	I115 T138 G142 A143 F144	I115-P140 HydrophobicContact CB-CB 4.19Å; I115-P140 HydrophobicContact CB-CG 4.34Å; I115-P140 HydrophobicContact CD1-CG 4.2Å; T138-P140 WeakPolarHBondContact O-CD 3.22Å; P140-G142 PolarHBondContact O-N 2.99Å; P140-G142 VanDerWaalsContact O-N 3.16Å; P140-A143 HydrophobicContact CB-CB 4.05Å; P140-A143 WeakPolarHBondContact O-CB 3.18Å; P140-A143 PolarHBondContact O-N 3Å; P140-F144 HydrophobicContact CG-CE1 4.36Å; P140-F144 HydrophobicContact CG-CE2 4.16Å; P140-F144 HydrophobicContact CG-CZ 3.75Å; P140-F144 WeakPolarHBondContact O-CD2 3.17Å
141	N	89.5	Confident	94	Very high	87 Å²	87	47.2 Å²	47.2	47%	0.465	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-49.9	-39.5	-178.8	62.4	-8	0	0	0	113.7	I139 A143 F144	I139-N141 PolarHBondContact O-N 2.94Å; N141-A143 VanDerWaalsContact C-N 3.28Å; N141-A143 PolarHBondContact O-N 2.97Å; N141-F144 PolarHBondContact O-N 2.79Å
142	G	89.8	Confident	94	Very high	20 Å²	20	49 Å²	49	21%	0.206	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-72.5	-10	176.7	0	0	0	0	0	115.4	P140	P140-G142 PolarHBondContact O-N 2.99Å; P140-G142 VanDerWaalsContact O-N 3.16Å
143	A	91.8	Very high	94	Very high	4 Å²	4	47.3 Å²	47.3	3%	0.033	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-86.6	-25.5	174.4	0	0	0	0	0	112.8	I115 F120 P140 N141 V145	I115-A143 HydrophobicContact CB-CB 4.38Å; I115-A143 HydrophobicContact CG2-CB 3.54Å; F120-A143 HydrophobicContact CD2-CB 4.07Å; F120-A143 WeakPolarHBondContact CD2-O 3.33Å; F120-A143 HydrophobicContact CE2-CB 4.15Å; P140-A143 HydrophobicContact CB-CB 4.05Å; P140-A143 WeakPolarHBondContact O-CB 3.18Å; P140-A143 PolarHBondContact O-N 3Å; N141-A143 VanDerWaalsContact C-N 3.28Å; N141-A143 PolarHBondContact O-N 2.97Å; A143-V145 VanDerWaalsContact C-N 3.3Å; A143-V145 PolarHBondContact O-N 2.91Å
144	F	88.5	Confident	94	Very high	1 Å²	1	48.5 Å²	48.5	0%	0.004	24%	0.242	C	C	.	.	S	Bend	trans	-85.3	6.2	-173.4	-53.4	-48.7	0	0	0	114.8	F120 L129 L131 I139 P140 N141 L147 L153 I171	F120-F144 HydrophobicContact CD2-CD1 4.4Å; F120-F144 HydrophobicContact CE2-CD1 4.34Å; F120-F144 HydrophobicContact CE2-CE1 4.21Å; L129-F144 HydrophobicContact CD2-CD1 4.47Å; L129-F144 HydrophobicContact CD2-CE1 4.13Å; L131-F144 HydrophobicContact CD1-CE1 4.4Å; I139-F144 HydrophobicContact CG2-CE2 3.88Å; P140-F144 HydrophobicContact CG-CE1 4.36Å; P140-F144 HydrophobicContact CG-CE2 4.16Å; P140-F144 HydrophobicContact CG-CZ 3.75Å; P140-F144 WeakPolarHBondContact O-CD2 3.17Å; N141-F144 PolarHBondContact O-N 2.79Å; F144-L147 HydrophobicContact CB-CD1 4.37Å; F144-L147 HydrophobicContact CD1-CD1 4.27Å; F144-L147 PolarHBondContact O-N 3.33Å; F144-L153 HydrophobicContact CE1-CD1 4.25Å; F144-L153 HydrophobicContact CE1-CD2 4.42Å; F144-L153 HydrophobicContact CE2-CD2 4.32Å; F144-L153 HydrophobicContact CZ-CD1 4.39Å; F144-L153 HydrophobicContact CZ-CD2 4.09Å; F144-I171 HydrophobicContact CB-CD1 4.49Å; F144-I171 HydrophobicContact CB-CG2 3.93Å; F144-I171 HydrophobicContact CG-CD1 4.5Å; F144-I171 WeakPolarHBondContact O-CG2 3.42Å
145	V	87.2	Confident	94	Very high	43 Å²	43	48.5 Å²	48.5	26%	0.261	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	139.5	-177	-164.2	0	0	0	0	110.6	A143 L147	A143-V145 VanDerWaalsContact C-N 3.3Å; A143-V145 PolarHBondContact O-N 2.91Å; V145-L147 VanDerWaalsContact C-N 3.28Å; V145-L147 PolarHBondContact O-N 2.94Å
146	Y	81.8	Confident	94	Very high	193 Å²	193	45.2 Å²	45.2	76%	0.757	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	67	9.8	-179.5	-46.3	-65.3	0	0	0	116.9	S148	Y146-S148 PolarHBondContact O-N 3.18Å
147	L	92.5	Very high	94	Very high	4 Å²	4	47.4 Å²	47.4	2%	0.021	24%	0.242	C	C	.	.			trans	-78.4	55.7	175.1	-62.3	-178.2	0	0	0	112.8	F120 L123 L126 F144 V145 K149 L150 I171 S173	F120-L147 HydrophobicContact CB-CD1 4.16Å; F120-L147 HydrophobicContact CB-CD2 4.06Å; F120-L147 HydrophobicContact CD2-CD1 4.34Å; F120-L147 HydrophobicContact CG-CD1 4.48Å; L123-L147 HydrophobicContact CB-CD2 4.14Å; L126-L147 HydrophobicContact CD2-CD1 4.46Å; L126-L147 HydrophobicContact CD2-CD2 4.3Å; F144-L147 HydrophobicContact CB-CD1 4.37Å; F144-L147 HydrophobicContact CD1-CD1 4.27Å; F144-L147 PolarHBondContact O-N 3.33Å; V145-L147 VanDerWaalsContact C-N 3.28Å; V145-L147 PolarHBondContact O-N 2.94Å; L147-K149 PolarHBondContact O-N 3.12Å; L147-L150 HydrophobicContact CB-CB 4.09Å; L147-L150 HydrophobicContact CB-CD2 4.5Å; L147-L150 HydrophobicContact CD1-CD2 4.2Å; L147-L150 WeakPolarHBondContact O-CB 3.48Å; L147-L150 PolarHBondContact O-N 3.34Å; L147-L150 VanDerWaalsContact O-N 3.09Å; L147-I171 HydrophobicContact CB-CG2 3.94Å; L147-S173 PolarHBondContact O-OG 3.07Å
148	S	89	Confident	94.1	Very high	89 Å²	89	44.9 Å²	44.9	62%	0.622	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-14.2	-169.2	60.1	0	0	0	0	115.9	Y146 S173	Y146-S148 PolarHBondContact O-N 3.18Å; S148-S173 WeakPolarHBondContact O-CB 3.34Å; S148-S173 PolarHBondContact O-OG 3.34Å
149	K	95	Very high	94.1	Very high	106 Å²	106	42.1 Å²	42.1	46%	0.461	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.8	0.4	176.1	-63.1	-163.9	-167.5	174.8	0	114.7	A124 N125 L126 L147 K151	A124-K149 WeakPolarHBondContact O-CD 3.27Å; A124-K149 WeakPolarHBondContact O-CE 3.49Å; N125-K149 PolarHBondContact OD1-NZ 2.84Å; L126-K149 CarbonylContact O-C 3.37Å; L147-K149 PolarHBondContact O-N 3.12Å; K149-K151 PolarHBondContact O-N 3.1Å
150	L	97.3	Very high	94.2	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.208	C	C	.	.			trans	-68.3	120.4	-176.5	-172.1	73.6	0	0	0	110.3	L126 L129 L147 I171 S173 L174	L126-L150 HydrophobicContact CD2-CD1 4.08Å; L126-L150 HydrophobicContact CG-CD1 4.04Å; L126-L150 VanDerWaalsContact O-CA 3.24Å; L126-L150 WeakPolarHBondContact O-CA 3.18Å; L126-L150 PolarHBondContact O-N 3.15Å; L126-L150 VanDerWaalsContact O-N 3.09Å; L129-L150 HydrophobicContact CB-CD1 3.8Å; L147-L150 HydrophobicContact CB-CB 4.09Å; L147-L150 HydrophobicContact CB-CD2 4.5Å; L147-L150 HydrophobicContact CD1-CD2 4.2Å; L147-L150 WeakPolarHBondContact O-CB 3.48Å; L147-L150 PolarHBondContact O-N 3.34Å; L147-L150 VanDerWaalsContact O-N 3.09Å; L150-I171 HydrophobicContact CD2-CD1 4.03Å; L150-I171 HydrophobicContact CD2-CG2 4.32Å; L150-S173 CarbonylContact O-C 3.51Å; L150-S173 VanDerWaalsContact O-C 3.25Å; L150-S173 PolarHBondContact O-OG 2.77Å; L150-L174 HydrophobicContact CD2-CD1 4.21Å; L150-L174 HydrophobicContact CG-CD1 4.11Å; L150-L174 WeakPolarHBondContact O-CA 3.48Å; L150-L174 PolarHBondContact O-N 3.16Å
151	K	98	Very high	94.4	Very high	88 Å²	88	44.9 Å²	44.9	38%	0.383	22%	0.221	S	C	.	.			trans	-109.2	-23.7	178.2	-61.7	178.5	-157.4	155	0	112.5	N127 K149 R175 R176	N127-K151 PolarHBondContact O-N 2.88Å; N127-K151 WeakPolarHBondContact OD1-CB 3.45Å; N127-K151 WeakPolarHBondContact OD1-CD 3.19Å; N127-K151 WeakPolarHBondContact OD1-CG 3.48Å; K149-K151 PolarHBondContact O-N 3.1Å; K151-R175 HydrophobicContact CB-CB 4.3Å; K151-R175 HydrophobicContact CB-CG 4.32Å; K151-R175 HydrophobicContact CG-CG 4.4Å; K151-R175 CarbonylContact O-C 3.57Å; K151-R175 WeakPolarHBondContact O-CA 3.27Å; K151-R175 PolarHBondContact O-N 2.84Å; K151-R176 PolarHBondContact O-N 2.73Å
152	E	98.6	Very high	94.7	Very high	39 Å²	39	42.8 Å²	42.8	18%	0.182	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	124	-174	-52.4	-171.9	146.4	0	0	111.7	N127 T128 L129 R176	N127-E152 PolarHBondContact O-N 3.36Å; T128-E152 WeakPolarHBondContact CA-O 3.43Å; T128-E152 HydrophobicContact CG2-CB 3.97Å; T128-E152 PolarHBondContact OG1-OE2 3.15Å; L129-E152 PolarHBondContact N-O 2.84Å; E152-R176 WeakPolarHBondContact CA-O 3.36Å; E152-R176 HydrophobicContact CB-CB 4.34Å; E152-R176 HydrophobicContact CG-CB 4.07Å; E152-R176 HydrophobicContact CG-CG 4.13Å; E152-R176 WeakPolarHBondContact OE1-CD 3.49Å; E152-R176 IonicContact OE1-CZ 2.72Å; E152-R176 IonicContact OE1-NE 2.7Å; E152-R176 IonicContact OE1-NH1 2.65Å; E152-R176 PolarHBondContact OE1-NH1 3.38Å
153	L	98.3	Very high	95.1	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	117	-179.9	177.4	58.9	0	0	0	110	L129 F144 L155 F168 I171 L174 R176 L177 D178	L129-L153 HydrophobicContact CB-CD1 4.21Å; L129-L153 HydrophobicContact CD2-CD1 4Å; L129-L153 HydrophobicContact CG-CD1 4.08Å; F144-L153 HydrophobicContact CE1-CD1 4.25Å; F144-L153 HydrophobicContact CE1-CD2 4.42Å; F144-L153 HydrophobicContact CE2-CD2 4.32Å; F144-L153 HydrophobicContact CZ-CD1 4.39Å; F144-L153 HydrophobicContact CZ-CD2 4.09Å; L153-L155 HydrophobicContact CD1-CD1 4.38Å; L153-L155 HydrophobicContact CD1-CG 4.22Å; L153-L155 HydrophobicContact CD2-CD1 3.93Å; L153-L155 HydrophobicContact CG-CD1 4.02Å; L153-L155 HydrophobicContact CG-CG 4.19Å; L153-F168 HydrophobicContact CD2-CD1 4.2Å; L153-F168 HydrophobicContact CD2-CE1 4.15Å; L153-I171 HydrophobicContact CD2-CD1 3.82Å; L153-L174 HydrophobicContact CB-CD1 3.75Å; L153-L174 HydrophobicContact CB-CD2 4.23Å; L153-R176 PolarHBondContact N-O 2.99Å; L153-L177 HydrophobicContact CB-CD1 4.26Å; L153-L177 HydrophobicContact CD2-CD1 4.13Å; L153-L177 HydrophobicContact CG-CD1 4.21Å; L153-D178 PolarHBondContact O-N 2.89Å
154	W	98.5	Very high	95.4	Very high	49 Å²	49	44 Å²	44	19%	0.186	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	102.8	-175.6	-50.5	87.1	0	0	0	110.3	L129 E130 L131 F132 D178 Y201	L129-W154 PolarHBondContact O-N 3.39Å; E130-W154 HydrophobicContact CG-CG 4.43Å; L131-W154 CarbonylContact C-O 3.25Å; L131-W154 WeakPolarHBondContact CA-O 3.32Å; L131-W154 PolarHBondContact N-O 3.44Å; F132-W154 HydrophobicContact CD1-CB 3.97Å; F132-W154 PolarHBondContact N-O 3.44Å; W154-D178 HydrophobicContact CD2-CB 4.16Å; W154-D178 HydrophobicContact CE3-CB 3.32Å; W154-D178 VanDerWaalsContact CE3-OD2 3.31Å; W154-D178 HydrophobicContact CZ3-CB 3.77Å; W154-Y201 HydrophobicContact CZ3-CE1 4.47Å
155	L	98.2	Very high	95.8	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.237	C	C	.	.			trans	-110.5	-1.2	-177.6	-78.3	165	0	0	0	113.5	L131 L136 L153 N158 F168 D178 L179	L131-L155 HydrophobicContact CB-CD2 3.83Å; L131-L155 HydrophobicContact CD1-CD2 4.06Å; L136-L155 HydrophobicContact CD1-CD2 3.81Å; L153-L155 HydrophobicContact CD1-CD1 4.38Å; L153-L155 HydrophobicContact CD1-CG 4.22Å; L153-L155 HydrophobicContact CD2-CD1 3.93Å; L153-L155 HydrophobicContact CG-CD1 4.02Å; L153-L155 HydrophobicContact CG-CG 4.19Å; L155-N158 PolarHBondContact O-ND2 2.89Å; L155-F168 HydrophobicContact CD1-CE1 4.15Å; L155-D178 CarbonylContact C-O 3.09Å; L155-D178 WeakPolarHBondContact CA-O 3.46Å; L155-D178 PolarHBondContact N-O 3.27Å; L155-L179 HydrophobicContact CB-CD2 3.88Å; L155-L179 HydrophobicContact CD1-CD2 3.95Å
156	R	98	Very high	96.2	Very high	57 Å²	57	51.3 Å²	51.3	22%	0.215	25%	0.25	C	S	.	.			trans	-50.4	150.6	-176.5	49.9	163.4	-81.9	106.9	3.5	116	F132 D133 N158 D178 G180 E181	F132-R156 WeakPolarHBondContact CA-O 3.47Å; F132-R156 HydrophobicContact CB-CG 3.63Å; F132-R156 WeakPolarHBondContact CB-O 3.44Å; F132-R156 HydrophobicContact CG-CG 4.38Å; D133-R156 PolarHBondContact N-O 2.88Å; R156-N158 VanDerWaalsContact C-N 3.3Å; R156-N158 PolarHBondContact O-N 3.32Å; R156-D178 WeakPolarHBondContact CB-OD1 3.44Å; R156-D178 WeakPolarHBondContact CD-OD2 3.07Å; R156-D178 WeakPolarHBondContact CG-OD2 3.38Å; R156-D178 PolarHBondContact N-O 2.98Å; R156-D178 VanDerWaalsContact N-O 3.11Å; R156-G180 CarbonylContact C-O 3.16Å; R156-G180 WeakPolarHBondContact CA-O 3.42Å; R156-G180 WeakPolarHBondContact CB-O 3.31Å; R156-E181 IonicContact CZ-OE1 3.47Å; R156-E181 IonicContact NH1-OE1 2.77Å; R156-E181 PolarHBondContact NH1-OE1 3.08Å; R156-E181 IonicContact NH2-OE1 3.31Å; R156-E181 PolarHBondContact NH2-OE1 2.94Å
157	N	98.1	Very high	96.9	Very high	49 Å²	49	42.3 Å²	42.3	26%	0.262	22%	0.215	S	C	.	.	S	Bend	trans	52.5	44.3	-178.1	-164.4	44.7	0	0	0	113	D133 G180 E181 K183	D133-N157 WeakPolarHBondContact OD1-CB 3.27Å; D133-N157 PolarHBondContact OD1-ND2 3.34Å; N157-G180 PolarHBondContact N-O 3.35Å; N157-E181 HydrophobicContact CB-CB 3.95Å; N157-K183 PolarHBondContact OD1-NZ 3.26Å; N157-K183 VanDerWaalsContact OD1-NZ 3.11Å
158	N	98.5	Very high	97.1	Very high	4 Å²	4	42.1 Å²	42.1	2%	0.021	21%	0.214	C	C	.	.			trans	-103.9	153.9	163.3	-86.7	-84.6	0	0	0	110.3	L131 N134 R135 L136 L155 R156 I160 L182	L131-N158 PolarHBondContact O-ND2 3.36Å; N134-N158 VanDerWaalsContact CA-OD1 3.29Å; N134-N158 WeakPolarHBondContact CA-OD1 3.39Å; N134-N158 WeakPolarHBondContact CB-OD1 3.1Å; R135-N158 PolarHBondContact N-OD1 3Å; L136-N158 HydrophobicContact CB-CB 4.3Å; L136-N158 WeakPolarHBondContact CB-OD1 3.38Å; L136-N158 PolarHBondContact N-OD1 2.83Å; L155-N158 PolarHBondContact O-ND2 2.89Å; R156-N158 VanDerWaalsContact C-N 3.3Å; R156-N158 PolarHBondContact O-N 3.32Å; N158-I160 HydrophobicContact CB-CD1 4.08Å; N158-I160 HydrophobicContact CB-CG1 3.87Å; N158-I160 PolarHBondContact O-N 3.01Å; N158-L182 HydrophobicContact CB-CD2 4.13Å; N158-L182 WeakPolarHBondContact O-CD2 3.31Å
159	P	97.9	Very high	97.4	Very high	25 Å²	25	40.9 Å²	40.9	16%	0.162	20%	0.201	C	C	.	.			trans	-76.6	40.4	176.8	34.4	-37.2	0	0	0	113	L136 T137 E161 R184	L136-P159 CarbonylContact O-C 3.08Å; L136-P159 VanDerWaalsContact O-C 3.29Å; L136-P159 VanDerWaalsContact O-CD 3.24Å; L136-P159 WeakPolarHBondContact O-CD 3.36Å; L136-P159 WeakPolarHBondContact O-CG 3.25Å; T137-P159 WeakPolarHBondContact CA-O 3.47Å; T137-P159 HydrophobicContact CG2-CG 4.38Å; P159-E161 PolarHBondContact O-N 3.28Å; P159-R184 HydrophobicContact CB-CG 4.45Å
160	I	98.1	Very high	97.3	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.21	C	C	.	.			trans	-67.8	129.2	-177.2	-62.8	171.4	0	0	0	109.9	L136 T137 I139 N158 S162 L182 R184 L185	L136-I160 WeakPolarHBondContact O-CG1 3.31Å; L136-I160 PolarHBondContact O-N 3.26Å; T137-I160 WeakPolarHBondContact O-CA 3.29Å; I139-I160 HydrophobicContact CG1-CD1 4.05Å; I139-I160 HydrophobicContact CG1-CG2 4.32Å; N158-I160 HydrophobicContact CB-CD1 4.08Å; N158-I160 HydrophobicContact CB-CG1 3.87Å; N158-I160 PolarHBondContact O-N 3.01Å; I160-S162 WeakPolarHBondContact CG2-O 3.32Å; I160-L182 HydrophobicContact CB-CD1 4.24Å; I160-L182 HydrophobicContact CB-CD2 4.1Å; I160-L182 HydrophobicContact CD1-CD1 4.27Å; I160-L182 HydrophobicContact CD1-CD2 3.95Å; I160-L182 HydrophobicContact CG1-CD2 4.17Å; I160-R184 CarbonylContact O-C 3.49Å; I160-L185 WeakPolarHBondContact O-CA 3.3Å; I160-L185 PolarHBondContact O-N 3.01Å
161	E	97.2	Very high	97.1	Very high	85 Å²	85	44.1 Å²	44.1	40%	0.397	21%	0.21	S	C	.	.			trans	-95.6	-28.1	-172.5	-67.2	170.8	-176.7	0	0	112.6	T137 P159 R184 S186	T137-E161 PolarHBondContact O-N 3.2Å; P159-E161 PolarHBondContact O-N 3.28Å; E161-R184 HydrophobicContact CG-CB 4.29Å; E161-R184 IonicContact OE1-NH1 3.48Å; E161-S186 PolarHBondContact O-N 2.7Å; E161-S186 PolarHBondContact O-OG 2.75Å
162	S	97.4	Very high	97	Very high	42 Å²	42	42.7 Å²	42.7	29%	0.294	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	157.4	176	60.2	0	0	0	0	114	I160 Y187	I160-S162 WeakPolarHBondContact CG2-O 3.32Å; S162-Y187 CarbonylContact C-O 3.57Å; S162-Y187 VanDerWaalsContact CA-O 3.25Å; S162-Y187 WeakPolarHBondContact CA-O 3.4Å
163	I	97.7	Very high	96.8	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	104.6	169.4	-51.7	-179.6	0	0	0	109	I139 A167 F168 L179 L185 Y187 I188 S189 A192 F193	I139-I163 HydrophobicContact CD1-CB 4.13Å; I139-I163 HydrophobicContact CD1-CG1 3.89Å; I139-I163 HydrophobicContact CD1-CG2 3.74Å; I163-A167 HydrophobicContact CG2-CB 4.09Å; I163-F168 HydrophobicContact CG2-CE2 4.19Å; I163-L179 HydrophobicContact CD1-CD1 4.02Å; I163-L185 HydrophobicContact CD1-CD2 4.21Å; I163-L185 HydrophobicContact CG1-CD1 3.95Å; I163-Y187 PolarHBondContact N-O 2.67Å; I163-I188 HydrophobicContact CB-CG1 4.49Å; I163-I188 HydrophobicContact CB-CG2 4.31Å; I163-I188 HydrophobicContact CD1-CD1 4.28Å; I163-I188 HydrophobicContact CD1-CG1 4.11Å; I163-I188 HydrophobicContact CG1-CG1 4.37Å; I163-S189 PolarHBondContact O-N 2.91Å; I163-A192 HydrophobicContact CB-CB 4.32Å; I163-A192 HydrophobicContact CG2-CB 3.59Å; I163-F193 HydrophobicContact CD1-CZ 4.48Å
164	P	97.3	Very high	96.8	Very high	51 Å²	51	42.2 Å²	42.2	33%	0.331	21%	0.211	S	C	.	.			trans	-76	165.3	-178.3	32.2	-35.9	0	0	0	112.5	A167	P164-A167 HydrophobicContact CG-CB 4.2Å; P164-A167 WeakPolarHBondContact O-CB 3.5Å; P164-A167 PolarHBondContact O-N 2.97Å
165	S	97.1	Very high	96.8	Very high	60 Å²	60	45.5 Å²	45.5	42%	0.42	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	143.4	175	-31.1	0	0	0	0	111.5	A167 S189	S165-A167 PolarHBondContact O-N 3.49Å; S165-A167 VanDerWaalsContact O-N 3.16Å; S165-S189 PolarHBondContact OG-OG 3.34Å
166	Y	96.3	Very high	96.8	Very high	137 Å²	137	50.2 Å²	50.2	54%	0.537	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	22.1	-179.6	-53.6	-83	0	0	0	115.1	F168 N169 G191 E194	Y166-F168 PolarHBondContact O-N 3.21Å; Y166-N169 HydrophobicContact CD1-CB 4.24Å; Y166-N169 WeakPolarHBondContact CD1-ND2 3.26Å; Y166-N169 WeakPolarHBondContact O-CB 3.5Å; Y166-N169 PolarHBondContact O-N 3.41Å; Y166-N169 VanDerWaalsContact O-N 3.1Å; Y166-G191 PolarHBondContact N-O 3.23Å; Y166-E194 HydrophobicContact CD1-CB 3.69Å; Y166-E194 HydrophobicContact CD1-CG 3.67Å; Y166-E194 HydrophobicContact CE1-CB 3.88Å; Y166-E194 HydrophobicContact CE1-CG 3.37Å; Y166-E194 HydrophobicContact CG-CB 4.48Å
167	A	96.4	Very high	96.8	Very high	3 Å²	3	47.5 Å²	47.5	3%	0.025	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.9	-33.7	-173.3	0	0	0	0	0	114.3	I139 I163 P164 S165	I139-A167 HydrophobicContact CD1-CB 4.31Å; I139-A167 HydrophobicContact CG2-CB 4.43Å; I163-A167 HydrophobicContact CG2-CB 4.09Å; P164-A167 HydrophobicContact CG-CB 4.2Å; P164-A167 WeakPolarHBondContact O-CB 3.5Å; P164-A167 PolarHBondContact O-N 2.97Å; S165-A167 PolarHBondContact O-N 3.49Å; S165-A167 VanDerWaalsContact O-N 3.16Å
168	F	95.9	Very high	96.8	Very high	1 Å²	1	45.5 Å²	45.5	0%	0.004	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.7	5.5	-176.4	-50.1	-77.3	0	0	0	114.3	I139 L153 L155 I163 Y166 R170 I171 L177 L179 F193 L196	I139-F168 HydrophobicContact CD1-CE1 4.35Å; I139-F168 HydrophobicContact CD1-CE2 4.23Å; I139-F168 HydrophobicContact CD1-CZ 3.62Å; I139-F168 HydrophobicContact CG1-CZ 4.4Å; I139-F168 HydrophobicContact CG2-CE1 3.87Å; I139-F168 HydrophobicContact CG2-CZ 4.22Å; L153-F168 HydrophobicContact CD2-CD1 4.2Å; L153-F168 HydrophobicContact CD2-CE1 4.15Å; L155-F168 HydrophobicContact CD1-CE1 4.15Å; I163-F168 HydrophobicContact CG2-CE2 4.19Å; Y166-F168 PolarHBondContact O-N 3.21Å; F168-R170 PolarHBondContact O-N 3.17Å; F168-I171 HydrophobicContact CB-CG1 4.23Å; F168-I171 HydrophobicContact CD1-CD1 4.39Å; F168-I171 WeakPolarHBondContact O-CG1 3.49Å; F168-I171 PolarHBondContact O-N 3.49Å; F168-L177 HydrophobicContact CD1-CD1 4.48Å; F168-L177 HydrophobicContact CD1-CD2 4.44Å; F168-L177 HydrophobicContact CD2-CD2 3.99Å; F168-L177 HydrophobicContact CE1-CD1 3.99Å; F168-L177 HydrophobicContact CE1-CD2 4.3Å; F168-L177 HydrophobicContact CE2-CD2 3.85Å; F168-L177 HydrophobicContact CG-CD2 4.28Å; F168-L177 HydrophobicContact CZ-CD1 4.17Å; F168-L177 HydrophobicContact CZ-CD2 4Å; F168-L179 HydrophobicContact CE2-CD1 4.12Å; F168-L179 HydrophobicContact CZ-CD1 3.93Å; F168-L179 HydrophobicContact CZ-CD2 4.05Å; F168-F193 HydrophobicContact CE2-CD1 4.45Å; F168-F193 HydrophobicContact CE2-CE1 4.41Å; F168-L196 HydrophobicContact CB-CD1 3.84Å; F168-L196 HydrophobicContact CB-CD2 3.74Å; F168-L196 HydrophobicContact CB-CG 3.91Å; F168-L196 HydrophobicContact CD2-CD1 3.96Å; F168-L196 HydrophobicContact CG-CD1 4.14Å
169	N	94.7	Very high	96.8	Very high	62 Å²	62	45.3 Å²	45.3	33%	0.332	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-14.1	-175.9	-169.4	14.2	0	0	0	113.8	Y166 I171 E194	Y166-N169 HydrophobicContact CD1-CB 4.24Å; Y166-N169 WeakPolarHBondContact CD1-ND2 3.26Å; Y166-N169 WeakPolarHBondContact O-CB 3.5Å; Y166-N169 PolarHBondContact O-N 3.41Å; Y166-N169 VanDerWaalsContact O-N 3.1Å; N169-I171 VanDerWaalsContact C-N 3.34Å; N169-E194 WeakPolarHBondContact CB-O 3.27Å
170	R	93	Very high	96.8	Very high	173 Å²	173	44.1 Å²	44.1	65%	0.653	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-6.7	173.9	-58	-53.8	-172.4	-172.2	1.4	114.4	F168 P172	F168-R170 PolarHBondContact O-N 3.17Å; R170-P172 VanDerWaalsContact C-CD 3.46Å
171	I	95	Very high	96.8	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.005	22%	0.218	C	C	.	.			trans	-130.1	58.5	179.8	51.5	174.1	0	0	0	112.9	F144 L147 L150 L153 F168 N169 S173 L174	F144-I171 HydrophobicContact CB-CD1 4.49Å; F144-I171 HydrophobicContact CB-CG2 3.93Å; F144-I171 HydrophobicContact CG-CD1 4.5Å; F144-I171 WeakPolarHBondContact O-CG2 3.42Å; L147-I171 HydrophobicContact CB-CG2 3.94Å; L150-I171 HydrophobicContact CD2-CD1 4.03Å; L150-I171 HydrophobicContact CD2-CG2 4.32Å; L153-I171 HydrophobicContact CD2-CD1 3.82Å; F168-I171 HydrophobicContact CB-CG1 4.23Å; F168-I171 HydrophobicContact CD1-CD1 4.39Å; F168-I171 WeakPolarHBondContact O-CG1 3.49Å; F168-I171 PolarHBondContact O-N 3.49Å; N169-I171 VanDerWaalsContact C-N 3.34Å; I171-S173 PolarHBondContact O-N 2.85Å; I171-L174 HydrophobicContact CD1-CD1 4.39Å; I171-L174 HydrophobicContact CD1-CD2 4.12Å; I171-L174 VanDerWaalsContact O-CB 3.32Å; I171-L174 WeakPolarHBondContact O-CB 3.32Å; I171-L174 PolarHBondContact O-N 3.33Å; I171-L174 VanDerWaalsContact O-N 3.1Å
172	P	94.1	Very high	96.9	Very high	59 Å²	59	41.6 Å²	41.6	38%	0.383	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-1.8	-179.1	31	-38.1	0	0	0	114.5	R170 L174 G195 N198	R170-P172 VanDerWaalsContact C-CD 3.46Å; P172-L174 VanDerWaalsContact C-N 3.34Å; P172-G195 WeakPolarHBondContact CB-O 3.24Å; P172-N198 PolarHBondContact O-ND2 3.06Å
173	S	95.6	Very high	96.8	Very high	28 Å²	28	44.8 Å²	44.8	20%	0.196	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-12.7	172.7	41.7	0	0	0	0	113.7	L147 S148 L150 I171	L147-S173 PolarHBondContact O-OG 3.07Å; S148-S173 WeakPolarHBondContact O-CB 3.34Å; S148-S173 PolarHBondContact O-OG 3.34Å; L150-S173 CarbonylContact O-C 3.51Å; L150-S173 VanDerWaalsContact O-C 3.25Å; L150-S173 PolarHBondContact O-OG 2.77Å; I171-S173 PolarHBondContact O-N 2.85Å
174	L	97.4	Very high	96.8	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	24%	0.235	C	C	.	.			trans	-63.4	137.3	-173.9	-161.4	72.7	0	0	0	112.1	L150 L153 I171 P172 L177 L196 N198 L199	L150-L174 HydrophobicContact CD2-CD1 4.21Å; L150-L174 HydrophobicContact CG-CD1 4.11Å; L150-L174 WeakPolarHBondContact O-CA 3.48Å; L150-L174 PolarHBondContact O-N 3.16Å; L153-L174 HydrophobicContact CB-CD1 3.75Å; L153-L174 HydrophobicContact CB-CD2 4.23Å; I171-L174 HydrophobicContact CD1-CD1 4.39Å; I171-L174 HydrophobicContact CD1-CD2 4.12Å; I171-L174 VanDerWaalsContact O-CB 3.32Å; I171-L174 WeakPolarHBondContact O-CB 3.32Å; I171-L174 PolarHBondContact O-N 3.33Å; I171-L174 VanDerWaalsContact O-N 3.1Å; P172-L174 VanDerWaalsContact C-N 3.34Å; L174-L177 HydrophobicContact CD2-CB 3.89Å; L174-L177 HydrophobicContact CD2-CD1 4.17Å; L174-L177 HydrophobicContact CD2-CD2 4.33Å; L174-L177 HydrophobicContact CD2-CG 4.36Å; L174-L196 HydrophobicContact CB-CD2 4.05Å; L174-L196 HydrophobicContact CD2-CD2 4.11Å; L174-N198 CarbonylContact O-C 3.4Å; L174-L199 HydrophobicContact CB-CD1 4.37Å; L174-L199 HydrophobicContact CD2-CD1 3.99Å; L174-L199 HydrophobicContact CG-CD1 4.01Å; L174-L199 WeakPolarHBondContact O-CA 3.3Å; L174-L199 PolarHBondContact O-N 2.94Å
175	R	98.3	Very high	96.8	Very high	118 Å²	118	50.4 Å²	50.4	45%	0.445	22%	0.224	S	C	.	.			trans	-119.5	-27.3	179.9	-62.9	-167.2	177	-158.9	-3.3	113.4	K151 R200 Y201	K151-R175 HydrophobicContact CB-CB 4.3Å; K151-R175 HydrophobicContact CB-CG 4.32Å; K151-R175 HydrophobicContact CG-CG 4.4Å; K151-R175 CarbonylContact O-C 3.57Å; K151-R175 WeakPolarHBondContact O-CA 3.27Å; K151-R175 PolarHBondContact O-N 2.84Å; R175-R200 WeakPolarHBondContact O-CA 3.45Å; R175-R200 PolarHBondContact O-N 3.04Å; R175-Y201 PolarHBondContact O-N 3.1Å
176	R	98.8	Very high	96.7	Very high	99 Å²	99	52.4 Å²	52.4	37%	0.374	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	128.3	175.5	-52.6	-156.8	162.4	93.9	1.8	110.7	K151 E152 L153 Y201	K151-R176 PolarHBondContact O-N 2.73Å; E152-R176 WeakPolarHBondContact CA-O 3.36Å; E152-R176 HydrophobicContact CB-CB 4.34Å; E152-R176 HydrophobicContact CG-CB 4.07Å; E152-R176 HydrophobicContact CG-CG 4.13Å; E152-R176 WeakPolarHBondContact OE1-CD 3.49Å; E152-R176 IonicContact OE1-CZ 2.72Å; E152-R176 IonicContact OE1-NE 2.7Å; E152-R176 IonicContact OE1-NH1 2.65Å; E152-R176 PolarHBondContact OE1-NH1 3.38Å; L153-R176 PolarHBondContact N-O 2.99Å; R176-Y201 WeakPolarHBondContact CA-O 3.42Å; R176-Y201 HydrophobicContact CB-CD1 4.16Å; R176-Y201 HydrophobicContact CB-CG 4.47Å; R176-Y201 HydrophobicContact CG-CG 4.48Å
177	L	98.6	Very high	96.7	Very high	0 Å²	0	52 Å²	52	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	117.1	177.2	178.6	54.3	0	0	0	109	L153 F168 L174 L179 F193 L196 L199 Y201 L202 N203	L153-L177 HydrophobicContact CB-CD1 4.26Å; L153-L177 HydrophobicContact CD2-CD1 4.13Å; L153-L177 HydrophobicContact CG-CD1 4.21Å; F168-L177 HydrophobicContact CD1-CD1 4.48Å; F168-L177 HydrophobicContact CD1-CD2 4.44Å; F168-L177 HydrophobicContact CD2-CD2 3.99Å; F168-L177 HydrophobicContact CE1-CD1 3.99Å; F168-L177 HydrophobicContact CE1-CD2 4.3Å; F168-L177 HydrophobicContact CE2-CD2 3.85Å; F168-L177 HydrophobicContact CG-CD2 4.28Å; F168-L177 HydrophobicContact CZ-CD1 4.17Å; F168-L177 HydrophobicContact CZ-CD2 4Å; L174-L177 HydrophobicContact CD2-CB 3.89Å; L174-L177 HydrophobicContact CD2-CD1 4.17Å; L174-L177 HydrophobicContact CD2-CD2 4.33Å; L174-L177 HydrophobicContact CD2-CG 4.36Å; L177-L179 HydrophobicContact CD1-CD1 4.2Å; L177-L179 HydrophobicContact CD1-CD2 4.25Å; L177-L179 HydrophobicContact CD1-CG 3.93Å; L177-L179 HydrophobicContact CD2-CD1 3.83Å; L177-L179 HydrophobicContact CD2-CG 4.44Å; L177-L179 HydrophobicContact CG-CD1 3.85Å; L177-L179 HydrophobicContact CG-CG 3.94Å; L177-F193 HydrophobicContact CD2-CD1 4.45Å; L177-F193 HydrophobicContact CD2-CE1 4.43Å; L177-L196 HydrophobicContact CD2-CD1 3.81Å; L177-L199 HydrophobicContact CB-CD1 3.75Å; L177-L199 HydrophobicContact CB-CD2 4.21Å; L177-Y201 PolarHBondContact N-O 2.86Å; L177-L202 HydrophobicContact CB-CD1 4.18Å; L177-L202 HydrophobicContact CD2-CD1 4.13Å; L177-L202 HydrophobicContact CG-CD1 4.08Å; L177-L202 WeakPolarHBondContact O-CA 3.33Å; L177-N203 PolarHBondContact O-N 3Å
178	D	98.7	Very high	96.8	Very high	8 Å²	8	53.1 Å²	53.1	4%	0.043	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	107.1	176.3	-171.8	-6.3	0	0	0	111	L153 W154 L155 R156 G180 N203	L153-D178 PolarHBondContact O-N 2.89Å; W154-D178 HydrophobicContact CD2-CB 4.16Å; W154-D178 HydrophobicContact CE3-CB 3.32Å; W154-D178 VanDerWaalsContact CE3-OD2 3.31Å; W154-D178 HydrophobicContact CZ3-CB 3.77Å; L155-D178 CarbonylContact C-O 3.09Å; L155-D178 WeakPolarHBondContact CA-O 3.46Å; L155-D178 PolarHBondContact N-O 3.27Å; R156-D178 WeakPolarHBondContact CB-OD1 3.44Å; R156-D178 WeakPolarHBondContact CD-OD2 3.07Å; R156-D178 WeakPolarHBondContact CG-OD2 3.38Å; R156-D178 PolarHBondContact N-O 2.98Å; R156-D178 VanDerWaalsContact N-O 3.11Å; D178-G180 PolarHBondContact OD1-N 2.97Å; D178-N203 HydrophobicContact CB-CB 4.37Å; D178-N203 WeakPolarHBondContact OD1-CB 3.32Å; D178-N203 PolarHBondContact OD1-ND2 3.08Å
179	L	98.4	Very high	96.8	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	25%	0.245	C	C	.	.			trans	-115.6	26.6	177.8	-66.9	167	0	0	0	110.6	L155 I163 F168 L177 L182 F193 L202 N203 L204 C207	L155-L179 HydrophobicContact CB-CD2 3.88Å; L155-L179 HydrophobicContact CD1-CD2 3.95Å; I163-L179 HydrophobicContact CD1-CD1 4.02Å; F168-L179 HydrophobicContact CE2-CD1 4.12Å; F168-L179 HydrophobicContact CZ-CD1 3.93Å; F168-L179 HydrophobicContact CZ-CD2 4.05Å; L177-L179 HydrophobicContact CD1-CD1 4.2Å; L177-L179 HydrophobicContact CD1-CD2 4.25Å; L177-L179 HydrophobicContact CD1-CG 3.93Å; L177-L179 HydrophobicContact CD2-CD1 3.83Å; L177-L179 HydrophobicContact CD2-CG 4.44Å; L177-L179 HydrophobicContact CG-CD1 3.85Å; L177-L179 HydrophobicContact CG-CG 3.94Å; L179-L182 HydrophobicContact CB-CD1 4Å; L179-L182 HydrophobicContact CD2-CD1 4.2Å; L179-L182 WeakPolarHBondContact O-CD1 3.26Å; L179-L182 VanDerWaalsContact O-CG 3.25Å; L179-L182 WeakPolarHBondContact O-CG 3.12Å; L179-F193 HydrophobicContact CD1-CE1 3.93Å; L179-L202 HydrophobicContact CD1-CD1 4.45Å; L179-N203 CarbonylContact C-O 3.15Å; L179-N203 VanDerWaalsContact C-O 3.3Å; L179-N203 WeakPolarHBondContact CA-O 3.29Å; L179-N203 WeakPolarHBondContact CB-O 3.29Å; L179-N203 PolarHBondContact N-O 2.93Å; L179-L204 HydrophobicContact CB-CD2 3.88Å; L179-L204 HydrophobicContact CD1-CD2 4.22Å; L179-C207 PolarHBondContact O-SG 3.16Å
180	G	97.7	Very high	96.9	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	162.3	179.2	0	0	0	0	0	114.5	R156 N157 D178 L182 N203 A205	R156-G180 CarbonylContact C-O 3.16Å; R156-G180 WeakPolarHBondContact CA-O 3.42Å; R156-G180 WeakPolarHBondContact CB-O 3.31Å; N157-G180 PolarHBondContact N-O 3.35Å; D178-G180 PolarHBondContact OD1-N 2.97Å; G180-L182 PolarHBondContact O-N 3.1Å; G180-N203 PolarHBondContact N-O 3.21Å; G180-A205 CarbonylContact C-O 3.59Å; G180-A205 WeakPolarHBondContact CA-O 3.25Å
181	E	97.9	Very high	97.1	Very high	32 Å²	32	49.2 Å²	49.2	15%	0.15	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.8	26.9	176.5	-70.7	-177.5	-112.8	0	0	115.7	R156 N157 K183 A205 M206	R156-E181 IonicContact CZ-OE1 3.47Å; R156-E181 IonicContact NH1-OE1 2.77Å; R156-E181 PolarHBondContact NH1-OE1 3.08Å; R156-E181 IonicContact NH2-OE1 3.31Å; R156-E181 PolarHBondContact NH2-OE1 2.94Å; N157-E181 HydrophobicContact CB-CB 3.95Å; E181-K183 PolarHBondContact O-N 3.11Å; E181-K183 IonicContact OE2-NZ 3.72Å; E181-K183 PolarHBondContact OE2-NZ 2.8Å; E181-A205 PolarHBondContact N-O 2.9Å; E181-M206 WeakPolarHBondContact CA-O 3.48Å; E181-M206 HydrophobicContact CG-CB 3.71Å; E181-M206 HydrophobicContact CG-CE 3.66Å; E181-M206 HydrophobicContact CG-CG 4.41Å; E181-M206 HydrophobicContact CG-SD 3.87Å
182	L	98	Very high	97.2	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	23%	0.234	C	C	.	.			trans	-76.7	69.9	172.9	-57.6	180	0	0	0	110.3	N158 I160 L179 G180 R184 L185	N158-L182 HydrophobicContact CB-CD2 4.13Å; N158-L182 WeakPolarHBondContact O-CD2 3.31Å; I160-L182 HydrophobicContact CB-CD1 4.24Å; I160-L182 HydrophobicContact CB-CD2 4.1Å; I160-L182 HydrophobicContact CD1-CD1 4.27Å; I160-L182 HydrophobicContact CD1-CD2 3.95Å; I160-L182 HydrophobicContact CG1-CD2 4.17Å; L179-L182 HydrophobicContact CB-CD1 4Å; L179-L182 HydrophobicContact CD2-CD1 4.2Å; L179-L182 WeakPolarHBondContact O-CD1 3.26Å; L179-L182 VanDerWaalsContact O-CG 3.25Å; L179-L182 WeakPolarHBondContact O-CG 3.12Å; G180-L182 PolarHBondContact O-N 3.1Å; L182-R184 PolarHBondContact O-N 3.02Å; L182-L185 HydrophobicContact CB-CB 3.95Å; L182-L185 HydrophobicContact CB-CD2 4.41Å; L182-L185 HydrophobicContact CD1-CD2 4.37Å; L182-L185 WeakPolarHBondContact O-CB 3.47Å; L182-L185 PolarHBondContact O-N 2.89Å
183	K	96.8	Very high	97.4	Very high	108 Å²	108	46.4 Å²	46.4	47%	0.47	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-5.3	-172.6	-67.1	151.9	-169.6	153.4	0	115.2	N157 E181	N157-K183 PolarHBondContact OD1-NZ 3.26Å; N157-K183 VanDerWaalsContact OD1-NZ 3.11Å; E181-K183 PolarHBondContact O-N 3.11Å; E181-K183 IonicContact OE2-NZ 3.72Å; E181-K183 PolarHBondContact OE2-NZ 2.8Å
184	R	96.5	Very high	97.4	Very high	150 Å²	150	48.4 Å²	48.4	57%	0.566	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108.8	0.2	173.3	-68.1	-164.8	-177.9	-174.2	-2.4	113.9	P159 I160 E161 L182 S186	P159-R184 HydrophobicContact CB-CG 4.45Å; I160-R184 CarbonylContact O-C 3.49Å; E161-R184 HydrophobicContact CG-CB 4.29Å; E161-R184 IonicContact OE1-NH1 3.48Å; L182-R184 PolarHBondContact O-N 3.02Å; R184-S186 PolarHBondContact O-N 3.06Å
185	L	97.2	Very high	97.3	Very high	20 Å²	20	49.1 Å²	49.1	11%	0.105	23%	0.23	C	C	.	.			trans	-63.7	125.5	-176.1	-175.7	57.5	0	0	0	109.8	I160 I163 L182 Y187 I188 C207 L209	I160-L185 WeakPolarHBondContact O-CA 3.3Å; I160-L185 PolarHBondContact O-N 3.01Å; I163-L185 HydrophobicContact CD1-CD2 4.21Å; I163-L185 HydrophobicContact CG1-CD1 3.95Å; L182-L185 HydrophobicContact CB-CB 3.95Å; L182-L185 HydrophobicContact CB-CD2 4.41Å; L182-L185 HydrophobicContact CD1-CD2 4.37Å; L182-L185 WeakPolarHBondContact O-CB 3.47Å; L182-L185 PolarHBondContact O-N 2.89Å; L185-Y187 WeakPolarHBondContact CD1-O 3.44Å; L185-I188 HydrophobicContact CD1-CG1 4.38Å; L185-I188 HydrophobicContact CD2-CD1 3.94Å; L185-I188 HydrophobicContact CD2-CG1 3.98Å; L185-I188 HydrophobicContact CG-CG1 4.37Å; L185-C207 HydrophobicContact CD2-CB 4.23Å; L185-L209 HydrophobicContact CD2-CD2 4.21Å
186	S	95.6	Very high	97.2	Very high	101 Å²	101	43.6 Å²	43.6	71%	0.706	21%	0.209	S	C	*	.			trans	-120.5	-21.9	-174.2	66.8	0	0	0	0	113.3	E161 R184	E161-S186 PolarHBondContact O-N 2.7Å; E161-S186 PolarHBondContact O-OG 2.75Å; R184-S186 PolarHBondContact O-N 3.06Å
187	Y	96.5	Very high	97	Very high	130 Å²	130	41 Å²	41	51%	0.51	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	134.4	-176.5	177.6	-108.3	0	0	0	111.7	S162 I163 L185 S189	S162-Y187 CarbonylContact C-O 3.57Å; S162-Y187 VanDerWaalsContact CA-O 3.25Å; S162-Y187 WeakPolarHBondContact CA-O 3.4Å; I163-Y187 PolarHBondContact N-O 2.67Å; L185-Y187 WeakPolarHBondContact CD1-O 3.44Å; Y187-S189 WeakPolarHBondContact OH-CA 3.46Å
188	I	97.6	Very high	96.9	Very high	26 Å²	26	43.6 Å²	43.6	13%	0.133	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	131.1	166.1	-56.7	179.8	0	0	0	106.4	I163 L185 A192 F193 L209 P213	I163-I188 HydrophobicContact CB-CG1 4.49Å; I163-I188 HydrophobicContact CB-CG2 4.31Å; I163-I188 HydrophobicContact CD1-CD1 4.28Å; I163-I188 HydrophobicContact CD1-CG1 4.11Å; I163-I188 HydrophobicContact CG1-CG1 4.37Å; L185-I188 HydrophobicContact CD1-CG1 4.38Å; L185-I188 HydrophobicContact CD2-CD1 3.94Å; L185-I188 HydrophobicContact CD2-CG1 3.98Å; L185-I188 HydrophobicContact CG-CG1 4.37Å; I188-A192 HydrophobicContact CG2-CB 3.62Å; I188-F193 HydrophobicContact CG2-CE2 4.15Å; I188-L209 HydrophobicContact CD1-CD2 3.81Å; I188-P213 HydrophobicContact CB-CB 4.27Å; I188-P213 HydrophobicContact CD1-CB 4.06Å; I188-P213 HydrophobicContact CD1-CG 3.97Å; I188-P213 HydrophobicContact CG2-CB 3.86Å
189	S	97.6	Very high	96.9	Very high	11 Å²	11	43.2 Å²	43.2	8%	0.077	22%	0.218	C	C	.	.			trans	-78.3	146.1	175.5	-170.5	0	0	0	0	112	I163 S165 Y187 G191 A192	I163-S189 PolarHBondContact O-N 2.91Å; S165-S189 PolarHBondContact OG-OG 3.34Å; Y187-S189 WeakPolarHBondContact OH-CA 3.46Å; S189-G191 PolarHBondContact O-N 2.82Å; S189-G191 VanDerWaalsContact O-N 3.1Å; S189-A192 WeakPolarHBondContact O-CB 2.98Å; S189-A192 PolarHBondContact O-N 2.96Å
190	E	95.9	Very high	96.9	Very high	125 Å²	125	49.2 Å²	49.2	58%	0.584	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-32.2	172.4	-69.6	-58.1	103.7	0	0	113.6	N214	E190-N214 PolarHBondContact O-ND2 2.89Å; E190-N214 WeakPolarHBondContact OE2-CB 3.34Å
191	G	96.8	Very high	97	Very high	17 Å²	17	49.7 Å²	49.7	18%	0.175	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	16.9	175.1	0	0	0	0	0	114.5	Y166 S189 F193 E194	Y166-G191 PolarHBondContact N-O 3.23Å; S189-G191 PolarHBondContact O-N 2.82Å; S189-G191 VanDerWaalsContact O-N 3.1Å; G191-F193 PolarHBondContact O-N 3.18Å; G191-E194 VanDerWaalsContact O-CB 3.29Å; G191-E194 WeakPolarHBondContact O-CB 3.44Å; G191-E194 PolarHBondContact O-N 3.38Å
192	A	97.9	Very high	97	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-42.4	-172.2	0	0	0	0	0	113.9	I163 I188 S189	I163-A192 HydrophobicContact CB-CB 4.32Å; I163-A192 HydrophobicContact CG2-CB 3.59Å; I188-A192 HydrophobicContact CG2-CB 3.62Å; S189-A192 WeakPolarHBondContact O-CB 2.98Å; S189-A192 PolarHBondContact O-N 2.96Å
193	F	97.4	Very high	97	Very high	1 Å²	1	48.3 Å²	48.3	0%	0.004	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.2	11.2	-175.4	-56.8	-67.7	0	0	0	113.2	I163 F168 L177 L179 I188 G191 L196 L202 L204 P213 L215 L218	I163-F193 HydrophobicContact CD1-CZ 4.48Å; F168-F193 HydrophobicContact CE2-CD1 4.45Å; F168-F193 HydrophobicContact CE2-CE1 4.41Å; L177-F193 HydrophobicContact CD2-CD1 4.45Å; L177-F193 HydrophobicContact CD2-CE1 4.43Å; L179-F193 HydrophobicContact CD1-CE1 3.93Å; I188-F193 HydrophobicContact CG2-CE2 4.15Å; G191-F193 PolarHBondContact O-N 3.18Å; F193-L196 HydrophobicContact CB-CD1 4.32Å; F193-L196 HydrophobicContact CD1-CD1 4.17Å; F193-L196 VanDerWaalsContact O-CB 3.31Å; F193-L196 WeakPolarHBondContact O-CB 3.39Å; F193-L196 PolarHBondContact O-N 3.15Å; F193-L202 HydrophobicContact CE1-CD1 4.2Å; F193-L202 HydrophobicContact CE1-CD2 4.35Å; F193-L202 HydrophobicContact CZ-CD2 4.41Å; F193-L204 HydrophobicContact CE2-CD1 4.49Å; F193-L204 HydrophobicContact CZ-CD1 4.05Å; F193-L204 HydrophobicContact CZ-CD2 4.31Å; F193-P213 HydrophobicContact CE2-CB 4.44Å; F193-P213 HydrophobicContact CE2-CG 4.17Å; F193-L215 HydrophobicContact CD2-CD2 4.04Å; F193-L215 HydrophobicContact CE2-CD2 3.99Å; F193-L218 HydrophobicContact CB-CD1 4.35Å; F193-L218 HydrophobicContact CB-CD2 4.01Å; F193-L218 HydrophobicContact CB-CG 4.23Å; F193-L218 HydrophobicContact CG-CD1 4.4Å
194	E	96.9	Very high	97.1	Very high	71 Å²	71	43.2 Å²	43.2	33%	0.332	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	136.2	-174.8	-164.2	49.8	-106.6	0	0	112.3	Y166 N169 G191 P217	Y166-E194 HydrophobicContact CD1-CB 3.69Å; Y166-E194 HydrophobicContact CD1-CG 3.67Å; Y166-E194 HydrophobicContact CE1-CB 3.88Å; Y166-E194 HydrophobicContact CE1-CG 3.37Å; Y166-E194 HydrophobicContact CG-CB 4.48Å; N169-E194 WeakPolarHBondContact CB-O 3.27Å; G191-E194 VanDerWaalsContact O-CB 3.29Å; G191-E194 WeakPolarHBondContact O-CB 3.44Å; G191-E194 PolarHBondContact O-N 3.38Å; E194-P217 VanDerWaalsContact OE2-CG 3.27Å; E194-P217 WeakPolarHBondContact OE2-CG 3.21Å
195	G	94.9	Very high	97.2	Very high	15 Å²	15	36.1 Å²	36.1	16%	0.155	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.8	-5	-172.9	0	0	0	0	0	116.5	P172 S197	P172-G195 WeakPolarHBondContact CB-O 3.24Å; G195-S197 PolarHBondContact O-N 2.98Å
196	L	96.6	Very high	97.2	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.005	20%	0.202	C	C	.	.			trans	-82.4	38.9	179.5	-70.2	179.9	0	0	0	114.6	F168 L174 L177 F193 N198 L199 L218	F168-L196 HydrophobicContact CB-CD1 3.84Å; F168-L196 HydrophobicContact CB-CD2 3.74Å; F168-L196 HydrophobicContact CB-CG 3.91Å; F168-L196 HydrophobicContact CD2-CD1 3.96Å; F168-L196 HydrophobicContact CG-CD1 4.14Å; L174-L196 HydrophobicContact CB-CD2 4.05Å; L174-L196 HydrophobicContact CD2-CD2 4.11Å; L177-L196 HydrophobicContact CD2-CD1 3.81Å; F193-L196 HydrophobicContact CB-CD1 4.32Å; F193-L196 HydrophobicContact CD1-CD1 4.17Å; F193-L196 VanDerWaalsContact O-CB 3.31Å; F193-L196 WeakPolarHBondContact O-CB 3.39Å; F193-L196 PolarHBondContact O-N 3.15Å; L196-N198 PolarHBondContact O-N 3.34Å; L196-L199 HydrophobicContact CB-CB 4.23Å; L196-L199 HydrophobicContact CD1-CD2 4.32Å; L196-L199 WeakPolarHBondContact O-CB 3.19Å; L196-L199 PolarHBondContact O-N 3.27Å; L196-L218 HydrophobicContact CB-CD2 3.61Å; L196-L218 HydrophobicContact CD1-CD2 4.41Å
197	S	94.7	Very high	97.3	Very high	46 Å²	46	34.4 Å²	34.4	32%	0.322	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	2	-173.1	64.1	0	0	0	0	116.3	G195 K220	G195-S197 PolarHBondContact O-N 2.98Å; S197-K220 VanDerWaalsContact O-CD 3.24Å; S197-K220 WeakPolarHBondContact O-CD 3.38Å; S197-K220 VanDerWaalsContact O-CE 3.23Å; S197-K220 WeakPolarHBondContact O-CE 3.38Å; S197-K220 WeakPolarHBondContact O-CG 3.47Å
198	N	96.4	Very high	97.3	Very high	54 Å²	54	31.7 Å²	31.7	29%	0.289	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.5	3.1	173.2	-64.4	-62.9	0	0	0	113.9	P172 L174 L196 K220	P172-N198 PolarHBondContact O-ND2 3.06Å; L174-N198 CarbonylContact O-C 3.4Å; L196-N198 PolarHBondContact O-N 3.34Å; N198-K220 PolarHBondContact OD1-NZ 3.14Å
199	L	98.1	Very high	97.2	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.162	C	C	.	.			trans	-66.6	137.4	178.2	-159.7	76.6	0	0	0	110.6	L174 L177 L196 L202 L218 K220 L221	L174-L199 HydrophobicContact CB-CD1 4.37Å; L174-L199 HydrophobicContact CD2-CD1 3.99Å; L174-L199 HydrophobicContact CG-CD1 4.01Å; L174-L199 WeakPolarHBondContact O-CA 3.3Å; L174-L199 PolarHBondContact O-N 2.94Å; L177-L199 HydrophobicContact CB-CD1 3.75Å; L177-L199 HydrophobicContact CB-CD2 4.21Å; L196-L199 HydrophobicContact CB-CB 4.23Å; L196-L199 HydrophobicContact CD1-CD2 4.32Å; L196-L199 WeakPolarHBondContact O-CB 3.19Å; L196-L199 PolarHBondContact O-N 3.27Å; L199-L202 HydrophobicContact CD2-CB 4.02Å; L199-L202 HydrophobicContact CD2-CD1 4.37Å; L199-L218 HydrophobicContact CB-CD2 4.08Å; L199-L218 HydrophobicContact CD2-CD1 4.26Å; L199-L218 HydrophobicContact CD2-CD2 3.83Å; L199-K220 CarbonylContact O-C 3.53Å; L199-L221 HydrophobicContact CD2-CD1 4.05Å; L199-L221 HydrophobicContact CG-CD1 4.28Å; L199-L221 PolarHBondContact O-N 2.69Å
200	R	98.4	Very high	97.1	Very high	125 Å²	125	40.9 Å²	40.9	47%	0.472	20%	0.196	S	C	.	.			trans	-118.2	-39.8	176.8	-69.3	-165.4	178.3	-156.9	-1.6	112.4	R175 L221 D222 E223	R175-R200 WeakPolarHBondContact O-CA 3.45Å; R175-R200 PolarHBondContact O-N 3.04Å; R200-L221 WeakPolarHBondContact O-CD1 3.47Å; R200-D222 HydrophobicContact CB-CB 3.83Å; R200-D222 HydrophobicContact CG-CB 4.3Å; R200-D222 IonicContact NH1-OD2 3.69Å; R200-D222 WeakPolarHBondContact O-CA 3.4Å; R200-D222 WeakPolarHBondContact O-CB 3.24Å; R200-D222 PolarHBondContact O-N 3.45Å; R200-E223 PolarHBondContact O-N 2.8Å
201	Y	98.7	Very high	97	Very high	10 Å²	10	42.2 Å²	42.2	4%	0.039	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	125.6	178.2	179.6	-91.7	0	0	0	110.7	W154 R175 R176 L177 N203 E223 W249	W154-Y201 HydrophobicContact CZ3-CE1 4.47Å; R175-Y201 PolarHBondContact O-N 3.1Å; R176-Y201 WeakPolarHBondContact CA-O 3.42Å; R176-Y201 HydrophobicContact CB-CD1 4.16Å; R176-Y201 HydrophobicContact CB-CG 4.47Å; R176-Y201 HydrophobicContact CG-CG 4.48Å; L177-Y201 PolarHBondContact N-O 2.86Å; Y201-N203 HydrophobicContact CE1-CB 3.73Å; Y201-E223 WeakPolarHBondContact CA-O 3.34Å; Y201-E223 HydrophobicContact CD2-CB 3.76Å; Y201-E223 WeakPolarHBondContact CD2-OE2 3.26Å; Y201-E223 HydrophobicContact CE2-CB 4.45Å; Y201-W249 HydrophobicContact CE2-CZ3 4.08Å
202	L	98.7	Very high	96.9	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	127.5	169	179.5	60.5	0	0	0	110.1	L177 L179 F193 L199 L204 L215 L218 L221 E223 L224 D225	L177-L202 HydrophobicContact CB-CD1 4.18Å; L177-L202 HydrophobicContact CD2-CD1 4.13Å; L177-L202 HydrophobicContact CG-CD1 4.08Å; L177-L202 WeakPolarHBondContact O-CA 3.33Å; L179-L202 HydrophobicContact CD1-CD1 4.45Å; F193-L202 HydrophobicContact CE1-CD1 4.2Å; F193-L202 HydrophobicContact CE1-CD2 4.35Å; F193-L202 HydrophobicContact CZ-CD2 4.41Å; L199-L202 HydrophobicContact CD2-CB 4.02Å; L199-L202 HydrophobicContact CD2-CD1 4.37Å; L202-L204 HydrophobicContact CD1-CG 4.25Å; L202-L204 HydrophobicContact CD2-CD1 3.88Å; L202-L204 HydrophobicContact CD2-CG 4.35Å; L202-L204 HydrophobicContact CG-CD1 4.23Å; L202-L204 HydrophobicContact CG-CG 4.15Å; L202-L215 HydrophobicContact CD2-CD2 3.81Å; L202-L218 HydrophobicContact CD2-CD1 3.64Å; L202-L221 HydrophobicContact CB-CD1 3.85Å; L202-L221 HydrophobicContact CB-CD2 4.46Å; L202-E223 PolarHBondContact N-O 2.88Å; L202-L224 HydrophobicContact CB-CD1 4.13Å; L202-L224 HydrophobicContact CD2-CD1 4.17Å; L202-L224 HydrophobicContact CG-CD1 4.2Å; L202-L224 WeakPolarHBondContact O-CA 3.22Å; L202-D225 PolarHBondContact O-N 3.26Å
203	N	98.7	Very high	96.9	Very high	4 Å²	4	43.1 Å²	43.1	2%	0.021	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	122	169.9	-178.5	18.2	0	0	0	110.5	L177 D178 L179 G180 Y201 A205 D225	L177-N203 PolarHBondContact O-N 3Å; D178-N203 HydrophobicContact CB-CB 4.37Å; D178-N203 WeakPolarHBondContact OD1-CB 3.32Å; D178-N203 PolarHBondContact OD1-ND2 3.08Å; L179-N203 CarbonylContact C-O 3.15Å; L179-N203 VanDerWaalsContact C-O 3.3Å; L179-N203 WeakPolarHBondContact CA-O 3.29Å; L179-N203 WeakPolarHBondContact CB-O 3.29Å; L179-N203 PolarHBondContact N-O 2.93Å; G180-N203 PolarHBondContact N-O 3.21Å; Y201-N203 HydrophobicContact CE1-CB 3.73Å; N203-A205 WeakPolarHBondContact OD1-CB 3.48Å; N203-A205 PolarHBondContact OD1-N 3.34Å; N203-D225 HydrophobicContact CB-CB 4.29Å; N203-D225 WeakPolarHBondContact OD1-CB 3.44Å; N203-D225 PolarHBondContact OD1-O 3.28Å
204	L	98.3	Very high	96.8	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.215	C	C	.	.			trans	-126.8	20.4	173.5	-72.4	170.4	0	0	0	110.9	L179 F193 L202 C207 L209 P213 D225 L226 N229	L179-L204 HydrophobicContact CB-CD2 3.88Å; L179-L204 HydrophobicContact CD1-CD2 4.22Å; F193-L204 HydrophobicContact CE2-CD1 4.49Å; F193-L204 HydrophobicContact CZ-CD1 4.05Å; F193-L204 HydrophobicContact CZ-CD2 4.31Å; L202-L204 HydrophobicContact CD1-CG 4.25Å; L202-L204 HydrophobicContact CD2-CD1 3.88Å; L202-L204 HydrophobicContact CD2-CG 4.35Å; L202-L204 HydrophobicContact CG-CD1 4.23Å; L202-L204 HydrophobicContact CG-CG 4.15Å; L204-C207 PolarHBondContact O-SG 3.04Å; L204-L209 HydrophobicContact CB-CD1 4.13Å; L204-P213 HydrophobicContact CD1-CG 4.02Å; L204-D225 CarbonylContact C-O 3.42Å; L204-D225 PolarHBondContact N-O 3.34Å; L204-L226 HydrophobicContact CB-CD2 4.02Å; L204-L226 HydrophobicContact CD1-CD2 4.44Å; L204-N229 PolarHBondContact O-ND2 2.75Å
205	A	98.3	Very high	96.8	Very high	2 Å²	2	42 Å²	42	2%	0.017	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63	148	179.3	0	0	0	0	0	112.3	G180 E181 N203 C207 D225 S227	G180-A205 CarbonylContact C-O 3.59Å; G180-A205 WeakPolarHBondContact CA-O 3.25Å; E181-A205 PolarHBondContact N-O 2.9Å; N203-A205 WeakPolarHBondContact OD1-CB 3.48Å; N203-A205 PolarHBondContact OD1-N 3.34Å; A205-C207 VanDerWaalsContact C-N 3.26Å; A205-C207 PolarHBondContact O-N 2.93Å; A205-C207 PolarHBondContact O-SG 2.97Å; A205-D225 PolarHBondContact N-O 3Å; A205-S227 CarbonylContact C-O 3.59Å; A205-S227 WeakPolarHBondContact CA-O 3.37Å; A205-S227 WeakPolarHBondContact CB-O 3.37Å
206	M	97.8	Very high	96.8	Very high	83 Å²	83	43.9 Å²	43.9	41%	0.409	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	36.3	175.7	-62.7	174.4	-83.5	0	0	114.2	E181 S227 G228	E181-M206 WeakPolarHBondContact CA-O 3.48Å; E181-M206 HydrophobicContact CG-CB 3.71Å; E181-M206 HydrophobicContact CG-CE 3.66Å; E181-M206 HydrophobicContact CG-CG 4.41Å; E181-M206 HydrophobicContact CG-SD 3.87Å; M206-S227 PolarHBondContact N-O 2.83Å; M206-G228 WeakPolarHBondContact CA-O 3.49Å
207	C	97.7	Very high	96.7	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.007	21%	0.214	C	C	.	.	S	Bend	trans	-104.5	13	178.3	-65.1	0	0	0	0	112.9	L179 L185 L204 A205 L209 N229	L179-C207 PolarHBondContact O-SG 3.16Å; L185-C207 HydrophobicContact CD2-CB 4.23Å; L204-C207 PolarHBondContact O-SG 3.04Å; A205-C207 VanDerWaalsContact C-N 3.26Å; A205-C207 PolarHBondContact O-N 2.93Å; A205-C207 PolarHBondContact O-SG 2.97Å; C207-L209 HydrophobicContact CB-CD1 4.42Å; C207-L209 HydrophobicContact CB-CD2 4.14Å; C207-L209 HydrophobicContact CB-CG 3.92Å; C207-L209 PolarHBondContact O-N 2.76Å; C207-L209 VanDerWaalsContact O-N 3.15Å; C207-N229 WeakPolarHBondContact CA-OD1 3.26Å; C207-N229 PolarHBondContact N-OD1 2.9Å
208	N	95	Very high	96.8	Very high	73 Å²	73	42.6 Å²	42.6	39%	0.39	20%	0.199	S	C	.	.			trans	56.8	23.4	179.8	-51.7	-28.3	0	0	0	114.4	R210 N229	N208-R210 PolarHBondContact O-N 3.05Å; N208-N229 PolarHBondContact N-OD1 3.44Å
209	L	96.2	Very high	96.7	Very high	19 Å²	19	44.2 Å²	44.2	10%	0.099	21%	0.207	C	C	.	.			trans	-64.4	133.1	-175.5	-56.3	179.4	0	0	0	111.2	L185 I188 L204 C207 L226 N229 H230 L231	L185-L209 HydrophobicContact CD2-CD2 4.21Å; I188-L209 HydrophobicContact CD1-CD2 3.81Å; L204-L209 HydrophobicContact CB-CD1 4.13Å; C207-L209 HydrophobicContact CB-CD1 4.42Å; C207-L209 HydrophobicContact CB-CD2 4.14Å; C207-L209 HydrophobicContact CB-CG 3.92Å; C207-L209 PolarHBondContact O-N 2.76Å; C207-L209 VanDerWaalsContact O-N 3.15Å; L209-L226 HydrophobicContact CD1-CD2 4.3Å; L209-N229 HydrophobicContact CB-CB 4.15Å; L209-N229 PolarHBondContact N-OD1 2.96Å; L209-H230 CarbonylContact O-C 3.35Å; L209-H230 VanDerWaalsContact O-C 3.29Å; L209-H230 VanDerWaalsContact O-CA 3.31Å; L209-H230 WeakPolarHBondContact O-CA 3.36Å; L209-H230 PolarHBondContact O-N 2.65Å; L209-L231 HydrophobicContact CB-CD2 4.35Å
210	R	95.1	Very high	96.7	Very high	211 Å²	211	48.6 Å²	48.6	80%	0.796	23%	0.226	S	C	*	.	S	Bend	trans	-91.1	-22	176	-64.4	179.6	-178.7	171.7	0.1	113.2	N208 H230	N208-R210 PolarHBondContact O-N 3.05Å; R210-H230 HydrophobicContact CG-CB 4.48Å
211	E	94.5	Very high	96.6	Very high	154 Å²	154	42.7 Å²	42.7	72%	0.72	20%	0.204	S	C	*	.	S	Bend	trans	-142.1	163.2	-179.7	66	-157.5	157.6	0	0	109.3
212	I	95.7	Very high	96.6	Very high	21 Å²	21	43.9 Å²	43.9	11%	0.108	21%	0.211	C	C	.	.			trans	-87.9	124.3	178.4	-65.2	162.9	0	0	0	107.3	L215 L226 L231 I234 S238 F239	I212-L215 HydrophobicContact CG2-CD1 4.16Å; I212-L215 HydrophobicContact CG2-CG 4.46Å; I212-L226 HydrophobicContact CD1-CD1 4.16Å; I212-L226 HydrophobicContact CG1-CD1 4.06Å; I212-L226 HydrophobicContact CG2-CD1 4.34Å; I212-L231 HydrophobicContact CD1-CD1 4.18Å; I212-L231 HydrophobicContact CG1-CD1 3.87Å; I212-L231 HydrophobicContact CG1-CD2 4.01Å; I212-I234 HydrophobicContact CD1-CD1 4.06Å; I212-S238 WeakPolarHBondContact CG2-O 3.21Å; I212-F239 HydrophobicContact CD1-CE1 3.8Å; I212-F239 HydrophobicContact CD1-CE2 4.11Å; I212-F239 HydrophobicContact CD1-CZ 3.45Å; I212-F239 VanDerWaalsContact CD1-CZ 3.45Å
213	P	96.2	Very high	96.6	Very high	15 Å²	15	45.1 Å²	45.1	10%	0.097	22%	0.216	C	C	.	.			trans	-68.9	167.6	-178.8	30.6	-36.9	0	0	0	111.3	I188 F193 L204 L215	I188-P213 HydrophobicContact CB-CB 4.27Å; I188-P213 HydrophobicContact CD1-CB 4.06Å; I188-P213 HydrophobicContact CD1-CG 3.97Å; I188-P213 HydrophobicContact CG2-CB 3.86Å; F193-P213 HydrophobicContact CE2-CB 4.44Å; F193-P213 HydrophobicContact CE2-CG 4.17Å; L204-P213 HydrophobicContact CD1-CG 4.02Å; P213-L215 HydrophobicContact CG-CD2 4.18Å; P213-L215 WeakPolarHBondContact O-CG 3.32Å; P213-L215 PolarHBondContact O-N 2.96Å
214	N	95.8	Very high	96.6	Very high	43 Å²	43	44.9 Å²	44.9	23%	0.23	22%	0.215	C	C	.	.			trans	-58.8	112.8	173.9	179.6	24.1	0	0	0	112.4	E190 T216	E190-N214 PolarHBondContact O-ND2 2.89Å; E190-N214 WeakPolarHBondContact OE2-CB 3.34Å; N214-T216 PolarHBondContact ND2-OG1 2.82Å; N214-T216 WeakPolarHBondContact OD1-CB 3.02Å; N214-T216 WeakPolarHBondContact OD1-CG2 3.34Å; N214-T216 PolarHBondContact OD1-N 3.42Å; N214-T216 PolarHBondContact OD1-OG1 3.2Å
215	L	96.6	Very high	96.6	Very high	5 Å²	5	45 Å²	45	3%	0.026	22%	0.216	C	C	.	.			trans	-106.3	1.8	176	-57.8	-175.9	0	0	0	113.3	F193 L202 I212 P213 P217 L218 L224 L242	F193-L215 HydrophobicContact CD2-CD2 4.04Å; F193-L215 HydrophobicContact CE2-CD2 3.99Å; L202-L215 HydrophobicContact CD2-CD2 3.81Å; I212-L215 HydrophobicContact CG2-CD1 4.16Å; I212-L215 HydrophobicContact CG2-CG 4.46Å; P213-L215 HydrophobicContact CG-CD2 4.18Å; P213-L215 WeakPolarHBondContact O-CG 3.32Å; P213-L215 PolarHBondContact O-N 2.96Å; L215-P217 VanDerWaalsContact C-N 3.32Å; L215-P217 VanDerWaalsContact O-N 3.15Å; L215-L218 HydrophobicContact CB-CD1 4.31Å; L215-L218 HydrophobicContact CD2-CD1 3.92Å; L215-L218 VanDerWaalsContact O-CB 3.32Å; L215-L218 WeakPolarHBondContact O-CB 3.48Å; L215-L218 PolarHBondContact O-N 2.94Å; L215-L224 HydrophobicContact CD1-CD1 4.16Å; L215-L224 HydrophobicContact CD1-CD2 3.52Å; L215-L242 HydrophobicContact CB-CD1 4.11Å; L215-L242 HydrophobicContact CB-CD2 4.15Å; L215-L242 HydrophobicContact CB-CG 4.46Å; L215-L242 HydrophobicContact CD1-CD1 3.99Å
216	T	94.5	Very high	96.6	Very high	55 Å²	55	44.9 Å²	44.9	34%	0.337	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-29.8	-175.9	58.1	0	0	0	0	116	N214 L218 Q240	N214-T216 PolarHBondContact ND2-OG1 2.82Å; N214-T216 WeakPolarHBondContact OD1-CB 3.02Å; N214-T216 WeakPolarHBondContact OD1-CG2 3.34Å; N214-T216 PolarHBondContact OD1-N 3.42Å; N214-T216 PolarHBondContact OD1-OG1 3.2Å; T216-L218 PolarHBondContact O-N 2.75Å; T216-Q240 HydrophobicContact CG2-CB 4.15Å; T216-Q240 HydrophobicContact CG2-CG 4.39Å; T216-Q240 WeakPolarHBondContact CG2-O 3.11Å
217	P	95.8	Very high	96.6	Very high	18 Å²	18	41.5 Å²	41.5	12%	0.117	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-14.6	176.1	-20.2	34.6	0	0	0	114.1	E194 L215 I219	E194-P217 VanDerWaalsContact OE2-CG 3.27Å; E194-P217 WeakPolarHBondContact OE2-CG 3.21Å; L215-P217 VanDerWaalsContact C-N 3.32Å; L215-P217 VanDerWaalsContact O-N 3.15Å; P217-I219 PolarHBondContact O-N 2.85Å
218	L	96.8	Very high	96.6	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.005	21%	0.21	C	C	.	.			trans	-86.2	49.9	-172.5	-57.1	179.2	0	0	0	112.3	F193 L196 L199 L202 L215 T216 K220 L221 L242	F193-L218 HydrophobicContact CB-CD1 4.35Å; F193-L218 HydrophobicContact CB-CD2 4.01Å; F193-L218 HydrophobicContact CB-CG 4.23Å; F193-L218 HydrophobicContact CG-CD1 4.4Å; L196-L218 HydrophobicContact CB-CD2 3.61Å; L196-L218 HydrophobicContact CD1-CD2 4.41Å; L199-L218 HydrophobicContact CB-CD2 4.08Å; L199-L218 HydrophobicContact CD2-CD1 4.26Å; L199-L218 HydrophobicContact CD2-CD2 3.83Å; L202-L218 HydrophobicContact CD2-CD1 3.64Å; L215-L218 HydrophobicContact CB-CD1 4.31Å; L215-L218 HydrophobicContact CD2-CD1 3.92Å; L215-L218 VanDerWaalsContact O-CB 3.32Å; L215-L218 WeakPolarHBondContact O-CB 3.48Å; L215-L218 PolarHBondContact O-N 2.94Å; T216-L218 PolarHBondContact O-N 2.75Å; L218-K220 PolarHBondContact O-N 2.76Å; L218-L221 HydrophobicContact CB-CB 4.13Å; L218-L221 HydrophobicContact CB-CD1 4.49Å; L218-L221 HydrophobicContact CB-CD2 4.41Å; L218-L221 HydrophobicContact CD1-CD1 4.37Å; L218-L221 HydrophobicContact CD1-CD2 4.19Å; L218-L221 VanDerWaalsContact O-CB 3.3Å; L218-L221 WeakPolarHBondContact O-CB 3.34Å; L218-L221 PolarHBondContact O-N 3.03Å; L218-L242 HydrophobicContact CB-CD2 4.31Å
219	I	94.6	Very high	96.8	Very high	89 Å²	89	39.1 Å²	39.1	46%	0.456	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-10.4	-172.2	58	162.9	0	0	0	116.1	P217 H244	P217-I219 PolarHBondContact O-N 2.85Å; I219-H244 PolarHBondContact O-CD2 3.46Å; I219-H244 VanDerWaalsContact O-CD2 3.3Å
220	K	96.6	Very high	96.8	Very high	92 Å²	92	41.8 Å²	41.8	40%	0.4	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.7	15.5	176.4	-62.2	-177.2	-158.3	164.3	0	113.4	S197 N198 L199 L218	S197-K220 VanDerWaalsContact O-CD 3.24Å; S197-K220 WeakPolarHBondContact O-CD 3.38Å; S197-K220 VanDerWaalsContact O-CE 3.23Å; S197-K220 WeakPolarHBondContact O-CE 3.38Å; S197-K220 WeakPolarHBondContact O-CG 3.47Å; N198-K220 PolarHBondContact OD1-NZ 3.14Å; L199-K220 CarbonylContact O-C 3.53Å; L218-K220 PolarHBondContact O-N 2.76Å
221	L	98	Very high	96.9	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.005	17%	0.166	C	C	.	.			trans	-62.6	140	178.8	-154.8	69.1	0	0	0	110.4	L199 R200 L202 L218 L224 L242 H244 L245	L199-L221 HydrophobicContact CD2-CD1 4.05Å; L199-L221 HydrophobicContact CG-CD1 4.28Å; L199-L221 PolarHBondContact O-N 2.69Å; R200-L221 WeakPolarHBondContact O-CD1 3.47Å; L202-L221 HydrophobicContact CB-CD1 3.85Å; L202-L221 HydrophobicContact CB-CD2 4.46Å; L218-L221 HydrophobicContact CB-CB 4.13Å; L218-L221 HydrophobicContact CB-CD1 4.49Å; L218-L221 HydrophobicContact CB-CD2 4.41Å; L218-L221 HydrophobicContact CD1-CD1 4.37Å; L218-L221 HydrophobicContact CD1-CD2 4.19Å; L218-L221 VanDerWaalsContact O-CB 3.3Å; L218-L221 WeakPolarHBondContact O-CB 3.34Å; L218-L221 PolarHBondContact O-N 3.03Å; L221-L224 HydrophobicContact CD2-CB 4.13Å; L221-L224 HydrophobicContact CD2-CD1 4.32Å; L221-L224 HydrophobicContact CD2-CD2 4.3Å; L221-L224 HydrophobicContact CD2-CG 4.49Å; L221-L242 HydrophobicContact CB-CD2 4.2Å; L221-L242 HydrophobicContact CD2-CD1 4.49Å; L221-L242 HydrophobicContact CD2-CD2 4.15Å; L221-H244 CarbonylContact O-C 3.49Å; L221-L245 HydrophobicContact CB-CD1 4.24Å; L221-L245 HydrophobicContact CD2-CD1 4.02Å; L221-L245 HydrophobicContact CG-CD1 3.92Å; L221-L245 VanDerWaalsContact O-CA 3.3Å; L221-L245 WeakPolarHBondContact O-CA 3.48Å; L221-L245 PolarHBondContact O-N 2.92Å
222	D	97.8	Very high	96.9	Very high	35 Å²	35	27.5 Å²	27.5	19%	0.187	15%	0.153	C	C	.	.			trans	-129.5	-43.6	-164.3	-173.7	-8.3	0	0	0	108.4	R200 Q246 K247	R200-D222 HydrophobicContact CB-CB 3.83Å; R200-D222 HydrophobicContact CG-CB 4.3Å; R200-D222 IonicContact NH1-OD2 3.69Å; R200-D222 WeakPolarHBondContact O-CA 3.4Å; R200-D222 WeakPolarHBondContact O-CB 3.24Å; R200-D222 PolarHBondContact O-N 3.45Å; D222-Q246 WeakPolarHBondContact O-CA 3.43Å; D222-Q246 PolarHBondContact O-N 2.8Å; D222-K247 PolarHBondContact O-N 3.02Å
223	E	98.6	Very high	96.8	Very high	25 Å²	25	27.4 Å²	27.4	12%	0.117	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	127.8	179.2	-61	-172.9	154.9	0	0	111.1	R200 Y201 L202 K247 W249	R200-E223 PolarHBondContact O-N 2.8Å; Y201-E223 WeakPolarHBondContact CA-O 3.34Å; Y201-E223 HydrophobicContact CD2-CB 3.76Å; Y201-E223 WeakPolarHBondContact CD2-OE2 3.26Å; Y201-E223 HydrophobicContact CE2-CB 4.45Å; L202-E223 PolarHBondContact N-O 2.88Å; E223-K247 HydrophobicContact CG-CB 4.2Å; E223-K247 HydrophobicContact CG-CD 4.01Å; E223-K247 HydrophobicContact CG-CG 4.2Å; E223-K247 WeakPolarHBondContact OE1-CD 3.25Å; E223-K247 WeakPolarHBondContact OE1-CE 3.44Å; E223-K247 IonicContact OE1-NZ 3.88Å; E223-K247 PolarHBondContact OE1-NZ 3.2Å; E223-W249 HydrophobicContact CB-CH2 3.89Å; E223-W249 HydrophobicContact CB-CZ3 3.91Å; E223-W249 HydrophobicContact CG-CH2 4.07Å
224	L	98.6	Very high	96.8	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	117.5	-179.9	177.2	57.2	0	0	0	111.4	L202 L215 L221 L226 F239 L242 L245 K247 L248 W249	L202-L224 HydrophobicContact CB-CD1 4.13Å; L202-L224 HydrophobicContact CD2-CD1 4.17Å; L202-L224 HydrophobicContact CG-CD1 4.2Å; L202-L224 WeakPolarHBondContact O-CA 3.22Å; L215-L224 HydrophobicContact CD1-CD1 4.16Å; L215-L224 HydrophobicContact CD1-CD2 3.52Å; L221-L224 HydrophobicContact CD2-CB 4.13Å; L221-L224 HydrophobicContact CD2-CD1 4.32Å; L221-L224 HydrophobicContact CD2-CD2 4.3Å; L221-L224 HydrophobicContact CD2-CG 4.49Å; L224-L226 HydrophobicContact CD1-CD1 4.38Å; L224-L226 HydrophobicContact CD1-CG 4.07Å; L224-L226 HydrophobicContact CD2-CD1 3.85Å; L224-L226 HydrophobicContact CD2-CG 4.42Å; L224-L226 HydrophobicContact CG-CD1 4.01Å; L224-L226 HydrophobicContact CG-CG 4.06Å; L224-F239 HydrophobicContact CD2-CD1 4.43Å; L224-F239 HydrophobicContact CD2-CE1 4.2Å; L224-L242 HydrophobicContact CD2-CD1 4.24Å; L224-L245 HydrophobicContact CB-CD1 3.8Å; L224-L245 HydrophobicContact CB-CD2 4.31Å; L224-L245 HydrophobicContact CD2-CD2 4.42Å; L224-K247 PolarHBondContact N-O 2.81Å; L224-L248 HydrophobicContact CB-CD1 4.3Å; L224-L248 HydrophobicContact CD2-CD1 3.97Å; L224-L248 HydrophobicContact CG-CD1 4.12Å; L224-W249 PolarHBondContact O-N 2.89Å
225	D	98.7	Very high	96.7	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	110	174.5	-162.5	-7.8	0	0	0	110.5	L202 N203 L204 A205 S227 W249 R551	L202-D225 PolarHBondContact O-N 3.26Å; N203-D225 HydrophobicContact CB-CB 4.29Å; N203-D225 WeakPolarHBondContact OD1-CB 3.44Å; N203-D225 PolarHBondContact OD1-O 3.28Å; L204-D225 CarbonylContact C-O 3.42Å; L204-D225 PolarHBondContact N-O 3.34Å; A205-D225 PolarHBondContact N-O 3Å; D225-S227 WeakPolarHBondContact OD1-CB 3.47Å; D225-S227 PolarHBondContact OD1-N 3.36Å; D225-S227 PolarHBondContact OD1-OG 2.78Å; D225-W249 HydrophobicContact CB-CE3 3.78Å; D225-W249 HydrophobicContact CB-CZ3 4.4Å; D225-R551 IonicContact OD2-CZ 3.74Å; D225-R551 IonicContact OD2-NH1 2.75Å; D225-R551 PolarHBondContact OD2-NH1 2.93Å; D225-R551 IonicContact OD2-NH2 2.73Å; D225-R551 PolarHBondContact OD2-NH2 3.36Å
226	L	98.3	Very high	96.4	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.163	C	C	.	.			trans	-115.4	13.6	177.5	-78.7	167.4	0	0	0	111.8	L204 L209 I212 L224 N229 L231 F239 L248 W249 M250 S253	L204-L226 HydrophobicContact CB-CD2 4.02Å; L204-L226 HydrophobicContact CD1-CD2 4.44Å; L209-L226 HydrophobicContact CD1-CD2 4.3Å; I212-L226 HydrophobicContact CD1-CD1 4.16Å; I212-L226 HydrophobicContact CG1-CD1 4.06Å; I212-L226 HydrophobicContact CG2-CD1 4.34Å; L224-L226 HydrophobicContact CD1-CD1 4.38Å; L224-L226 HydrophobicContact CD1-CG 4.07Å; L224-L226 HydrophobicContact CD2-CD1 3.85Å; L224-L226 HydrophobicContact CD2-CG 4.42Å; L224-L226 HydrophobicContact CG-CD1 4.01Å; L224-L226 HydrophobicContact CG-CG 4.06Å; L226-N229 PolarHBondContact O-ND2 3.16Å; L226-L231 HydrophobicContact CB-CD1 4.32Å; L226-F239 HydrophobicContact CD1-CE1 4.01Å; L226-L248 HydrophobicContact CD1-CD1 4.39Å; L226-W249 WeakPolarHBondContact CA-O 3.35Å; L226-W249 PolarHBondContact N-O 3.14Å; L226-M250 HydrophobicContact CB-CG 4.05Å; L226-S253 PolarHBondContact O-OG 2.88Å
227	S	98.4	Very high	96	Very high	13 Å²	13	30.1 Å²	30.1	9%	0.091	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	147.9	-174.2	-53.7	0	0	0	0	113.6	A205 M206 D225 N229 W249 I251 S253	A205-S227 CarbonylContact C-O 3.59Å; A205-S227 WeakPolarHBondContact CA-O 3.37Å; A205-S227 WeakPolarHBondContact CB-O 3.37Å; M206-S227 PolarHBondContact N-O 2.83Å; D225-S227 WeakPolarHBondContact OD1-CB 3.47Å; D225-S227 PolarHBondContact OD1-N 3.36Å; D225-S227 PolarHBondContact OD1-OG 2.78Å; S227-N229 PolarHBondContact O-N 2.81Å; S227-W249 PolarHBondContact N-O 2.78Å; S227-I251 CarbonylContact C-O 3.56Å; S227-I251 VanDerWaalsContact CA-O 3.23Å; S227-I251 WeakPolarHBondContact CA-O 3.43Å; S227-I251 VanDerWaalsContact CB-O 3.29Å; S227-I251 WeakPolarHBondContact CB-O 3.43Å; S227-I251 PolarHBondContact OG-N 3.01Å; S227-S253 WeakPolarHBondContact CA-OG 3.2Å
228	G	97.8	Very high	95.8	Very high	22 Å²	22	30.7 Å²	30.7	23%	0.227	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.3	27.4	173.1	0	0	0	0	0	114.6	M206 I251 Q252 S253	M206-G228 WeakPolarHBondContact CA-O 3.49Å; G228-I251 PolarHBondContact N-O 3.11Å; G228-Q252 WeakPolarHBondContact CA-O 3.4Å; G228-S253 PolarHBondContact N-OG 3.39Å
229	N	98	Very high	95.6	Very high	2 Å²	2	30.7 Å²	30.7	1%	0.011	17%	0.173	C	C	.	.	S	Bend	trans	-100.6	-170.4	173.9	-76.3	-56.6	0	0	0	111.4	L204 C207 N208 L209 L226 S227 L231 S253	L204-N229 PolarHBondContact O-ND2 2.75Å; C207-N229 WeakPolarHBondContact CA-OD1 3.26Å; C207-N229 PolarHBondContact N-OD1 2.9Å; N208-N229 PolarHBondContact N-OD1 3.44Å; L209-N229 HydrophobicContact CB-CB 4.15Å; L209-N229 PolarHBondContact N-OD1 2.96Å; L226-N229 PolarHBondContact O-ND2 3.16Å; S227-N229 PolarHBondContact O-N 2.81Å; N229-L231 HydrophobicContact CB-CD1 4.45Å; N229-L231 HydrophobicContact CB-CG 3.99Å; N229-S253 CarbonylContact O-C 3.58Å; N229-S253 VanDerWaalsContact O-CA 3.26Å; N229-S253 WeakPolarHBondContact O-CA 3.32Å; N229-S253 VanDerWaalsContact O-O 3.11Å
230	H	96.8	Very high	95.4	Very high	74 Å²	74	30.5 Å²	30.5	34%	0.343	17%	0.17	S	C	.	.			trans	-115.1	43.3	-179.8	-63.2	-64.5	0	0	0	111.6	L209 R210 S232 S253 Q254	L209-H230 CarbonylContact O-C 3.35Å; L209-H230 VanDerWaalsContact O-C 3.29Å; L209-H230 VanDerWaalsContact O-CA 3.31Å; L209-H230 WeakPolarHBondContact O-CA 3.36Å; L209-H230 PolarHBondContact O-N 2.65Å; R210-H230 HydrophobicContact CG-CB 4.48Å; H230-S232 PolarHBondContact O-N 2.84Å; H230-S253 CarbonylContact C-O 3.48Å; H230-Q254 VanDerWaalsContact ND1-CD 3.35Å; H230-Q254 PolarHBondContact ND1-OE1 2.89Å
231	L	96.1	Very high	95	Very high	2 Å²	2	27.3 Å²	27.3	1%	0.01	16%	0.164	C	C	.	.			trans	-79.1	81.2	-176.2	-56.9	-180	0	0	0	110.1	L209 I212 L226 N229 A233 I234 S253 I255	L209-L231 HydrophobicContact CB-CD2 4.35Å; I212-L231 HydrophobicContact CD1-CD1 4.18Å; I212-L231 HydrophobicContact CG1-CD1 3.87Å; I212-L231 HydrophobicContact CG1-CD2 4.01Å; L226-L231 HydrophobicContact CB-CD1 4.32Å; N229-L231 HydrophobicContact CB-CD1 4.45Å; N229-L231 HydrophobicContact CB-CG 3.99Å; L231-A233 VanDerWaalsContact C-N 3.3Å; L231-A233 PolarHBondContact O-N 3.03Å; L231-I234 HydrophobicContact CB-CD1 4.13Å; L231-I234 HydrophobicContact CD1-CD1 4.41Å; L231-S253 PolarHBondContact N-O 3.1Å; L231-I255 HydrophobicContact CB-CG1 4.41Å; L231-I255 VanDerWaalsContact O-CA 3.23Å; L231-I255 WeakPolarHBondContact O-CA 3.46Å; L231-I255 VanDerWaalsContact O-CG1 3.24Å; L231-I255 WeakPolarHBondContact O-CG1 3.18Å; L231-I255 PolarHBondContact O-N 3.39Å
232	S	94.2	Very high	94.9	Very high	64 Å²	64	27.4 Å²	27.4	45%	0.448	16%	0.164	S	C	.	.			trans	-62.7	-32.9	-172.7	58.5	0	0	0	0	114.5	H230 Q256 V257	H230-S232 PolarHBondContact O-N 2.84Å; S232-Q256 PolarHBondContact O-N 3.44Å; S232-V257 PolarHBondContact O-N 3.28Å
233	A	95	Very high	94.6	Very high	19 Å²	19	30.9 Å²	30.9	16%	0.157	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	140.8	179.4	0	0	0	0	0	111.2	L231 V257	L231-A233 VanDerWaalsContact C-N 3.3Å; L231-A233 PolarHBondContact O-N 3.03Å; A233-V257 WeakPolarHBondContact CA-O 3.5Å; A233-V257 HydrophobicContact CB-CG1 3.57Å
234	I	96.3	Very high	94.4	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	132.3	175.3	-53.6	-59.2	0	0	0	109.7	I212 L231 F239 M250 I255 V257 I258 E259 A262 F263	I212-I234 HydrophobicContact CD1-CD1 4.06Å; L231-I234 HydrophobicContact CB-CD1 4.13Å; L231-I234 HydrophobicContact CD1-CD1 4.41Å; I234-F239 HydrophobicContact CG2-CD2 4.47Å; I234-F239 HydrophobicContact CG2-CE2 3.61Å; I234-F239 HydrophobicContact CG2-CZ 4.41Å; I234-M250 HydrophobicContact CD1-SD 3.77Å; I234-M250 HydrophobicContact CG1-SD 4.36Å; I234-I255 HydrophobicContact CD1-CD1 3.99Å; I234-I255 HydrophobicContact CD1-CG1 4.12Å; I234-I255 HydrophobicContact CG1-CD1 3.89Å; I234-I255 HydrophobicContact CG1-CG1 4.13Å; I234-I255 HydrophobicContact CG1-CG2 3.89Å; I234-V257 PolarHBondContact N-O 3.04Å; I234-V257 VanDerWaalsContact N-O 3.15Å; I234-I258 HydrophobicContact CB-CG1 4.09Å; I234-I258 HydrophobicContact CB-CG2 4.36Å; I234-I258 HydrophobicContact CG1-CG1 4.12Å; I234-E259 WeakPolarHBondContact O-CB 3.28Å; I234-E259 PolarHBondContact O-N 3.42Å; I234-A262 HydrophobicContact CG2-CB 4.25Å; I234-F263 HydrophobicContact CG2-CE1 4.01Å; I234-F263 HydrophobicContact CG2-CZ 4.36Å
235	R	93.5	Very high	94.4	Very high	124 Å²	124	35.1 Å²	35.1	47%	0.468	20%	0.2	S	C	.	.			trans	-122.4	155.5	-174.6	-49.4	-157.3	162.3	86.8	13.5	111.5	G237 S238 E259	R235-G237 VanDerWaalsContact C-N 3.29Å; R235-G237 PolarHBondContact O-N 3.08Å; R235-S238 VanDerWaalsContact O-CB 3.3Å; R235-S238 WeakPolarHBondContact O-CB 3.49Å; R235-S238 PolarHBondContact O-N 3.25Å; R235-S238 PolarHBondContact O-OG 3.03Å; R235-E259 VanDerWaalsContact CD-OE2 3.28Å; R235-E259 WeakPolarHBondContact CD-OE2 3.34Å; R235-E259 VanDerWaalsContact CG-OE2 3.27Å; R235-E259 WeakPolarHBondContact CG-OE2 3.32Å; R235-E259 IonicContact CZ-OE1 2.75Å; R235-E259 IonicContact NE-OE1 2.66Å; R235-E259 PolarHBondContact NE-OE1 2.74Å; R235-E259 IonicContact NE-OE2 3.65Å; R235-E259 PolarHBondContact NE-OE2 2.98Å; R235-E259 IonicContact NH2-OE1 2.79Å; R235-E259 PolarHBondContact NH2-OE1 2.92Å
236	P	89.3	Confident	94.4	Very high	6 Å²	6	39 Å²	39	4%	0.039	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-54.2	-44.8	176.5	-23.4	31.8	0	0	0	113	S238 F239 R260 N265 Y399	P236-S238 PolarHBondContact O-N 2.99Å; P236-F239 PolarHBondContact O-N 3.35Å; P236-R260 VanDerWaalsContact CG-O 3.28Å; P236-R260 WeakPolarHBondContact CG-O 3.09Å; P236-N265 PolarHBondContact O-ND2 3.42Å; P236-Y399 PolarHBondContact O-OH 2.88Å
237	G	86.7	Confident	94.3	Very high	45 Å²	45	40 Å²	40	46%	0.464	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-50.6	-31.3	176.9	0	0	0	0	0	114.9	R235 F239 Q240 Y399	R235-G237 VanDerWaalsContact C-N 3.29Å; R235-G237 PolarHBondContact O-N 3.08Å; G237-F239 PolarHBondContact O-N 3.39Å; G237-F239 VanDerWaalsContact O-N 3.15Å; G237-Q240 PolarHBondContact O-N 3.2Å; G237-Y399 WeakPolarHBondContact CA-OH 3.39Å; G237-Y399 PolarHBondContact N-OH 3.5Å
238	S	91.2	Very high	94.3	Very high	29 Å²	29	39.4 Å²	39.4	20%	0.203	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-65.9	-18.5	-171.7	-59.1	0	0	0	0	115.3	I212 R235 P236	I212-S238 WeakPolarHBondContact CG2-O 3.21Å; R235-S238 VanDerWaalsContact O-CB 3.3Å; R235-S238 WeakPolarHBondContact O-CB 3.49Å; R235-S238 PolarHBondContact O-N 3.25Å; R235-S238 PolarHBondContact O-OG 3.03Å; P236-S238 PolarHBondContact O-N 2.99Å
239	F	93.4	Very high	94.4	Very high	1 Å²	1	39.5 Å²	39.5	0%	0.004	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-126.5	24	-179.1	-56.1	-67.8	0	0	0	113.5	I212 L224 L226 I234 P236 G237 G241 L242 L248 M250 F263 L266	I212-F239 HydrophobicContact CD1-CE1 3.8Å; I212-F239 HydrophobicContact CD1-CE2 4.11Å; I212-F239 HydrophobicContact CD1-CZ 3.45Å; I212-F239 VanDerWaalsContact CD1-CZ 3.45Å; L224-F239 HydrophobicContact CD2-CD1 4.43Å; L224-F239 HydrophobicContact CD2-CE1 4.2Å; L226-F239 HydrophobicContact CD1-CE1 4.01Å; I234-F239 HydrophobicContact CG2-CD2 4.47Å; I234-F239 HydrophobicContact CG2-CE2 3.61Å; I234-F239 HydrophobicContact CG2-CZ 4.41Å; P236-F239 PolarHBondContact O-N 3.35Å; G237-F239 PolarHBondContact O-N 3.39Å; G237-F239 VanDerWaalsContact O-N 3.15Å; F239-G241 PolarHBondContact O-N 3.47Å; F239-L242 HydrophobicContact CB-CD1 4.3Å; F239-L242 HydrophobicContact CD1-CD1 4.08Å; F239-L242 PolarHBondContact O-N 2.83Å; F239-L248 HydrophobicContact CE1-CD1 3.85Å; F239-L248 HydrophobicContact CE1-CD2 4.04Å; F239-L248 HydrophobicContact CE2-CD2 4.14Å; F239-L248 HydrophobicContact CZ-CD1 4.12Å; F239-L248 HydrophobicContact CZ-CD2 3.8Å; F239-M250 HydrophobicContact CZ-CE 4.2Å; F239-M250 HydrophobicContact CZ-SD 3.88Å; F239-F263 HydrophobicContact CD2-CD1 4.14Å; F239-F263 HydrophobicContact CD2-CE1 4.3Å; F239-F263 HydrophobicContact CE2-CD1 4.06Å; F239-F263 AromaticContact CE2-CE1 3.74Å; F239-F263 HydrophobicContact CE2-CE1 3.74Å; F239-L266 HydrophobicContact CB-CD1 4.36Å; F239-L266 HydrophobicContact CB-CD2 3.95Å; F239-L266 HydrophobicContact CB-CG 4.31Å; F239-L266 HydrophobicContact CD2-CD1 4.39Å; F239-L266 HydrophobicContact CG-CD1 4.32Å
240	Q	90.2	Very high	94.3	Very high	85 Å²	85	39.4 Å²	39.4	40%	0.397	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	135.7	179.1	-170.5	177.5	-11.2	0	0	111.6	T216 G237 L242 Y399	T216-Q240 HydrophobicContact CG2-CB 4.15Å; T216-Q240 HydrophobicContact CG2-CG 4.39Å; T216-Q240 WeakPolarHBondContact CG2-O 3.11Å; G237-Q240 PolarHBondContact O-N 3.2Å; Q240-L242 VanDerWaalsContact C-N 3.27Å; Q240-L242 PolarHBondContact O-N 2.92Å; Q240-Y399 HydrophobicContact CB-CE1 4.04Å; Q240-Y399 VanDerWaalsContact CD-CD1 3.48Å; Q240-Y399 HydrophobicContact CG-CD1 4.15Å; Q240-Y399 HydrophobicContact CG-CE1 3.67Å; Q240-Y399 HydrophobicContact CG-CE2 4.16Å
241	G	88.5	Confident	94.3	Very high	26 Å²	26	37.2 Å²	37.2	27%	0.268	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.8	-10.2	176.4	0	0	0	0	0	116.1	F239 M243	F239-G241 PolarHBondContact O-N 3.47Å; G241-M243 PolarHBondContact O-N 2.95Å
242	L	94.8	Very high	94.4	Very high	3 Å²	3	43.3 Å²	43.3	2%	0.016	23%	0.23	C	C	.	.			trans	-79.3	42.8	-178.2	-60.7	-176.5	0	0	0	113.8	L215 L218 L221 L224 F239 Q240 H244 L245 L266	L215-L242 HydrophobicContact CB-CD1 4.11Å; L215-L242 HydrophobicContact CB-CD2 4.15Å; L215-L242 HydrophobicContact CB-CG 4.46Å; L215-L242 HydrophobicContact CD1-CD1 3.99Å; L218-L242 HydrophobicContact CB-CD2 4.31Å; L221-L242 HydrophobicContact CB-CD2 4.2Å; L221-L242 HydrophobicContact CD2-CD1 4.49Å; L221-L242 HydrophobicContact CD2-CD2 4.15Å; L224-L242 HydrophobicContact CD2-CD1 4.24Å; F239-L242 HydrophobicContact CB-CD1 4.3Å; F239-L242 HydrophobicContact CD1-CD1 4.08Å; F239-L242 PolarHBondContact O-N 2.83Å; Q240-L242 VanDerWaalsContact C-N 3.27Å; Q240-L242 PolarHBondContact O-N 2.92Å; L242-H244 PolarHBondContact O-N 3.22Å; L242-H244 VanDerWaalsContact O-N 3.1Å; L242-L245 HydrophobicContact CB-CB 4.24Å; L242-L245 HydrophobicContact CD1-CD2 4.43Å; L242-L245 VanDerWaalsContact O-CB 3.32Å; L242-L245 WeakPolarHBondContact O-CB 3.04Å; L242-L245 PolarHBondContact O-N 2.81Å; L242-L245 VanDerWaalsContact O-N 3.08Å; L242-L266 HydrophobicContact CB-CD2 3.83Å
243	M	92.1	Very high	94.6	Very high	108 Å²	108	40.2 Å²	40.2	53%	0.532	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-23.3	-171.9	-64	176.8	-71.2	0	0	114.2	G241 S268	G241-M243 PolarHBondContact O-N 2.95Å; M243-S268 VanDerWaalsContact O-CB 3.26Å; M243-S268 WeakPolarHBondContact O-CB 3.48Å; M243-S268 PolarHBondContact O-N 2.96Å; M243-S268 PolarHBondContact O-OG 3.12Å
244	H	95.3	Very high	94.6	Very high	114 Å²	114	44.5 Å²	44.5	53%	0.528	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-1.6	179.6	-73.1	-63.2	0	0	0	114.8	I219 L221 L242 Q246	I219-H244 PolarHBondContact O-CD2 3.46Å; I219-H244 VanDerWaalsContact O-CD2 3.3Å; L221-H244 CarbonylContact O-C 3.49Å; L242-H244 PolarHBondContact O-N 3.22Å; L242-H244 VanDerWaalsContact O-N 3.1Å; H244-Q246 PolarHBondContact O-N 2.82Å
245	L	97.7	Very high	94.7	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.226	C	C	.	.			trans	-67.8	123.8	-175.6	-170.3	75.4	0	0	0	111.1	L221 L224 L242 L248 L266 S268 L269	L221-L245 HydrophobicContact CB-CD1 4.24Å; L221-L245 HydrophobicContact CD2-CD1 4.02Å; L221-L245 HydrophobicContact CG-CD1 3.92Å; L221-L245 VanDerWaalsContact O-CA 3.3Å; L221-L245 WeakPolarHBondContact O-CA 3.48Å; L221-L245 PolarHBondContact O-N 2.92Å; L224-L245 HydrophobicContact CB-CD1 3.8Å; L224-L245 HydrophobicContact CB-CD2 4.31Å; L224-L245 HydrophobicContact CD2-CD2 4.42Å; L242-L245 HydrophobicContact CB-CB 4.24Å; L242-L245 HydrophobicContact CD1-CD2 4.43Å; L242-L245 VanDerWaalsContact O-CB 3.32Å; L242-L245 WeakPolarHBondContact O-CB 3.04Å; L242-L245 PolarHBondContact O-N 2.81Å; L242-L245 VanDerWaalsContact O-N 3.08Å; L245-L248 HydrophobicContact CD2-CB 4.16Å; L245-L248 HydrophobicContact CD2-CD1 4.43Å; L245-L266 HydrophobicContact CB-CD2 4.15Å; L245-L266 HydrophobicContact CD2-CD2 3.92Å; L245-S268 CarbonylContact O-C 3.51Å; L245-S268 VanDerWaalsContact O-C 3.27Å; L245-L269 HydrophobicContact CD2-CD1 4.32Å; L245-L269 HydrophobicContact CG-CD1 4.34Å; L245-L269 VanDerWaalsContact O-CA 3.31Å; L245-L269 WeakPolarHBondContact O-CA 3.2Å; L245-L269 PolarHBondContact O-N 3.39Å
246	Q	97.8	Very high	94.8	Very high	82 Å²	82	44.3 Å²	44.3	38%	0.383	23%	0.23	S	C	.	.			trans	-98.3	-31.6	178.7	-59.8	-164.7	-8.5	0	0	113.1	D222 H244 V270 E271	D222-Q246 WeakPolarHBondContact O-CA 3.43Å; D222-Q246 PolarHBondContact O-N 2.8Å; H244-Q246 PolarHBondContact O-N 2.82Å; Q246-V270 HydrophobicContact CB-CG2 4.28Å; Q246-V270 PolarHBondContact O-N 3.38Å; Q246-E271 PolarHBondContact O-N 2.86Å
247	K	98.2	Very high	95.1	Very high	21 Å²	21	47.3 Å²	47.3	9%	0.091	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	126.6	-173.8	-46.1	-174.2	-165.1	152.3	0	112.3	D222 E223 L224 W249 E271	D222-K247 PolarHBondContact O-N 3.02Å; E223-K247 HydrophobicContact CG-CB 4.2Å; E223-K247 HydrophobicContact CG-CD 4.01Å; E223-K247 HydrophobicContact CG-CG 4.2Å; E223-K247 WeakPolarHBondContact OE1-CD 3.25Å; E223-K247 WeakPolarHBondContact OE1-CE 3.44Å; E223-K247 IonicContact OE1-NZ 3.88Å; E223-K247 PolarHBondContact OE1-NZ 3.2Å; L224-K247 PolarHBondContact N-O 2.81Å; K247-W249 HydrophobicContact CB-CH2 4.05Å; K247-W249 HydrophobicContact CB-CZ2 3.73Å; K247-W249 HydrophobicContact CD-CH2 4.2Å; K247-W249 HydrophobicContact CD-CZ2 3.78Å; K247-W249 HydrophobicContact CG-CZ2 4.37Å; K247-E271 WeakPolarHBondContact CA-O 3.5Å; K247-E271 HydrophobicContact CB-CB 4.35Å; K247-E271 HydrophobicContact CG-CB 4.1Å
248	L	98.1	Very high	95.6	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	108.6	-178.3	177.7	56.4	0	0	0	110.8	L224 L226 F239 L245 M250 F263 L266 L269 E271 I272 N273	L224-L248 HydrophobicContact CB-CD1 4.3Å; L224-L248 HydrophobicContact CD2-CD1 3.97Å; L224-L248 HydrophobicContact CG-CD1 4.12Å; L226-L248 HydrophobicContact CD1-CD1 4.39Å; F239-L248 HydrophobicContact CE1-CD1 3.85Å; F239-L248 HydrophobicContact CE1-CD2 4.04Å; F239-L248 HydrophobicContact CE2-CD2 4.14Å; F239-L248 HydrophobicContact CZ-CD1 4.12Å; F239-L248 HydrophobicContact CZ-CD2 3.8Å; L245-L248 HydrophobicContact CD2-CB 4.16Å; L245-L248 HydrophobicContact CD2-CD1 4.43Å; L248-M250 HydrophobicContact CD1-CE 4.48Å; L248-M250 HydrophobicContact CD1-CG 4.21Å; L248-M250 HydrophobicContact CD2-CE 3.86Å; L248-M250 HydrophobicContact CG-CE 4.01Å; L248-M250 HydrophobicContact CG-CG 4.47Å; L248-F263 HydrophobicContact CD2-CD1 4.39Å; L248-F263 HydrophobicContact CD2-CE1 4.12Å; L248-L266 HydrophobicContact CD2-CD1 3.75Å; L248-L269 HydrophobicContact CB-CD1 3.92Å; L248-E271 PolarHBondContact N-O 3.01Å; L248-I272 HydrophobicContact CB-CG1 4.4Å; L248-I272 HydrophobicContact CD2-CD1 4.36Å; L248-I272 HydrophobicContact CD2-CG1 4.49Å; L248-I272 HydrophobicContact CG-CG1 4.49Å; L248-I272 WeakPolarHBondContact O-CA 3.18Å; L248-N273 PolarHBondContact O-N 3.11Å
249	W	98.3	Very high	95.7	Very high	25 Å²	25	45.5 Å²	45.5	10%	0.095	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	120.6	178.3	-51.2	-67.6	0	0	0	111	Y201 E223 L224 D225 L226 S227 K247 E271 N273 H554	Y201-W249 HydrophobicContact CE2-CZ3 4.08Å; E223-W249 HydrophobicContact CB-CH2 3.89Å; E223-W249 HydrophobicContact CB-CZ3 3.91Å; E223-W249 HydrophobicContact CG-CH2 4.07Å; L224-W249 PolarHBondContact O-N 2.89Å; D225-W249 HydrophobicContact CB-CE3 3.78Å; D225-W249 HydrophobicContact CB-CZ3 4.4Å; L226-W249 WeakPolarHBondContact CA-O 3.35Å; L226-W249 PolarHBondContact N-O 3.14Å; S227-W249 PolarHBondContact N-O 2.78Å; K247-W249 HydrophobicContact CB-CH2 4.05Å; K247-W249 HydrophobicContact CB-CZ2 3.73Å; K247-W249 HydrophobicContact CD-CH2 4.2Å; K247-W249 HydrophobicContact CD-CZ2 3.78Å; K247-W249 HydrophobicContact CG-CZ2 4.37Å; W249-E271 PolarHBondContact NE1-OE1 3.35Å; W249-N273 HydrophobicContact CB-CB 4.49Å; W249-N273 HydrophobicContact CG-CB 4.49Å; W249-H554 AromaticContact CZ2-CE1 3.97Å
250	M	97.4	Very high	95.7	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.227	C	C	.	.			trans	-129.2	42.7	175.8	-64.8	-175.4	-77.4	0	0	110.3	L226 I234 F239 L248 Q252 S253 I255 F263 N273 L274 N277	L226-M250 HydrophobicContact CB-CG 4.05Å; I234-M250 HydrophobicContact CD1-SD 3.77Å; I234-M250 HydrophobicContact CG1-SD 4.36Å; F239-M250 HydrophobicContact CZ-CE 4.2Å; F239-M250 HydrophobicContact CZ-SD 3.88Å; L248-M250 HydrophobicContact CD1-CE 4.48Å; L248-M250 HydrophobicContact CD1-CG 4.21Å; L248-M250 HydrophobicContact CD2-CE 3.86Å; L248-M250 HydrophobicContact CG-CE 4.01Å; L248-M250 HydrophobicContact CG-CG 4.47Å; M250-Q252 PolarHBondContact O-N 3.34Å; M250-S253 PolarHBondContact O-OG 3.15Å; M250-I255 HydrophobicContact CB-CD1 3.91Å; M250-I255 HydrophobicContact CE-CD1 4.4Å; M250-I255 HydrophobicContact SD-CD1 4.06Å; M250-F263 HydrophobicContact CE-CE1 3.89Å; M250-F263 HydrophobicContact CE-CZ 3.95Å; M250-N273 CarbonylContact C-O 3.33Å; M250-N273 PolarHBondContact N-O 3.34Å; M250-L274 HydrophobicContact CE-CD2 3.66Å; M250-N277 PolarHBondContact O-ND2 3.37Å
251	I	97	Very high	95.9	Very high	28 Å²	28	43.4 Å²	43.4	14%	0.144	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	130.2	-175.3	-51	172.8	0	0	0	108.9	S227 G228 S253 N273 A275 H276	S227-I251 CarbonylContact C-O 3.56Å; S227-I251 VanDerWaalsContact CA-O 3.23Å; S227-I251 WeakPolarHBondContact CA-O 3.43Å; S227-I251 VanDerWaalsContact CB-O 3.29Å; S227-I251 WeakPolarHBondContact CB-O 3.43Å; S227-I251 PolarHBondContact OG-N 3.01Å; G228-I251 PolarHBondContact N-O 3.11Å; I251-S253 PolarHBondContact O-N 2.93Å; I251-N273 HydrophobicContact CG1-CB 4.17Å; I251-N273 WeakPolarHBondContact CG1-OD1 3.25Å; I251-A275 CarbonylContact C-O 3.55Å; I251-A275 WeakPolarHBondContact CA-O 3.17Å; I251-A275 HydrophobicContact CG2-CB 4.4Å; I251-H276 HydrophobicContact CG2-CB 4.43Å
252	Q	97.3	Very high	96.2	Very high	129 Å²	129	42.2 Å²	42.2	60%	0.603	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.2	33.2	175.5	-155.8	-175.9	-8.8	0	0	114.1	G228 M250 Q254 A275 H276	G228-Q252 WeakPolarHBondContact CA-O 3.4Å; M250-Q252 PolarHBondContact O-N 3.34Å; Q252-Q254 VanDerWaalsContact C-N 3.3Å; Q252-Q254 PolarHBondContact O-N 2.92Å; Q252-A275 PolarHBondContact N-O 2.89Å; Q252-H276 WeakPolarHBondContact CA-O 3.34Å; Q252-H276 HydrophobicContact CB-CB 3.98Å; Q252-H276 HydrophobicContact CG-CB 4.27Å
253	S	97.7	Very high	96.2	Very high	0 Å²	0	42 Å²	42	0%	0	20%	0.202	C	C	.	.			trans	-88.7	13.1	-179.2	-60.9	0	0	0	0	114.4	L226 S227 G228 N229 H230 L231 M250 I251 I255 N277	L226-S253 PolarHBondContact O-OG 2.88Å; S227-S253 WeakPolarHBondContact CA-OG 3.2Å; G228-S253 PolarHBondContact N-OG 3.39Å; N229-S253 CarbonylContact O-C 3.58Å; N229-S253 VanDerWaalsContact O-CA 3.26Å; N229-S253 WeakPolarHBondContact O-CA 3.32Å; N229-S253 VanDerWaalsContact O-O 3.11Å; H230-S253 CarbonylContact C-O 3.48Å; L231-S253 PolarHBondContact N-O 3.1Å; M250-S253 PolarHBondContact O-OG 3.15Å; I251-S253 PolarHBondContact O-N 2.93Å; S253-I255 PolarHBondContact O-N 2.91Å; S253-N277 VanDerWaalsContact C-OD1 3.32Å; S253-N277 WeakPolarHBondContact CA-OD1 3.14Å; S253-N277 PolarHBondContact N-OD1 2.82Å
254	Q	96.7	Very high	96.3	Very high	108 Å²	108	38.3 Å²	38.3	51%	0.505	18%	0.184	S	C	.	.			trans	59.1	24.3	-179.6	-56.2	-172.2	-17.8	0	0	115.5	H230 Q252 Q256 N277	H230-Q254 VanDerWaalsContact ND1-CD 3.35Å; H230-Q254 PolarHBondContact ND1-OE1 2.89Å; Q252-Q254 VanDerWaalsContact C-N 3.3Å; Q252-Q254 PolarHBondContact O-N 2.92Å; Q254-Q256 PolarHBondContact O-N 2.69Å; Q254-N277 PolarHBondContact N-OD1 3.42Å
255	I	97.5	Very high	96	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.165	C	C	.	.			trans	-63.1	126.5	179	-52.3	164.7	0	0	0	109.7	L231 I234 M250 S253 V257 I258 L274 N277 N278 L279	L231-I255 HydrophobicContact CB-CG1 4.41Å; L231-I255 VanDerWaalsContact O-CA 3.23Å; L231-I255 WeakPolarHBondContact O-CA 3.46Å; L231-I255 VanDerWaalsContact O-CG1 3.24Å; L231-I255 WeakPolarHBondContact O-CG1 3.18Å; L231-I255 PolarHBondContact O-N 3.39Å; I234-I255 HydrophobicContact CD1-CD1 3.99Å; I234-I255 HydrophobicContact CD1-CG1 4.12Å; I234-I255 HydrophobicContact CG1-CD1 3.89Å; I234-I255 HydrophobicContact CG1-CG1 4.13Å; I234-I255 HydrophobicContact CG1-CG2 3.89Å; M250-I255 HydrophobicContact CB-CD1 3.91Å; M250-I255 HydrophobicContact CE-CD1 4.4Å; M250-I255 HydrophobicContact SD-CD1 4.06Å; S253-I255 PolarHBondContact O-N 2.91Å; I255-V257 WeakPolarHBondContact CG2-O 3.36Å; I255-I258 HydrophobicContact CG2-CG1 3.98Å; I255-L274 HydrophobicContact CD1-CD2 3.78Å; I255-N277 HydrophobicContact CB-CB 4.13Å; I255-N277 PolarHBondContact N-OD1 3.41Å; I255-N278 CarbonylContact O-C 3.18Å; I255-N278 WeakPolarHBondContact O-CA 3.35Å; I255-N278 PolarHBondContact O-N 2.63Å; I255-L279 HydrophobicContact CB-CD2 4.38Å; I255-L279 HydrophobicContact CG2-CD2 3.74Å; I255-L279 PolarHBondContact O-N 3.21Å
256	Q	96.3	Very high	95.8	Very high	121 Å²	121	34.1 Å²	34.1	57%	0.565	17%	0.165	S	C	*	.			trans	-104.9	-32.5	175.8	-54.9	-174.2	11.2	0	0	111.7	S232 Q254 N278	S232-Q256 PolarHBondContact O-N 3.44Å; Q254-Q256 PolarHBondContact O-N 2.69Å; Q256-N278 HydrophobicContact CG-CB 4.31Å
257	V	95	Very high	95.6	Very high	69 Å²	69	36 Å²	36	42%	0.418	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	145.7	-178.6	65.1	0	0	0	0	111.1	S232 A233 I234 I255	S232-V257 PolarHBondContact O-N 3.28Å; A233-V257 WeakPolarHBondContact CA-O 3.5Å; A233-V257 HydrophobicContact CB-CG1 3.57Å; I234-V257 PolarHBondContact N-O 3.04Å; I234-V257 VanDerWaalsContact N-O 3.15Å; I255-V257 WeakPolarHBondContact CG2-O 3.36Å
258	I	96.3	Very high	95.5	Very high	3 Å²	3	36.5 Å²	36.5	2%	0.015	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	125.7	166.4	-64.6	169.3	0	0	0	105.5	I234 I255 A262 F263 L274 L279 L282 P283 L286	I234-I258 HydrophobicContact CB-CG1 4.09Å; I234-I258 HydrophobicContact CB-CG2 4.36Å; I234-I258 HydrophobicContact CG1-CG1 4.12Å; I255-I258 HydrophobicContact CG2-CG1 3.98Å; I258-A262 HydrophobicContact CG2-CB 3.55Å; I258-F263 HydrophobicContact CD1-CE2 4.14Å; I258-F263 HydrophobicContact CD1-CZ 4.08Å; I258-F263 HydrophobicContact CG2-CE2 4.04Å; I258-F263 HydrophobicContact CG2-CZ 4.21Å; I258-L274 HydrophobicContact CD1-CD1 3.75Å; I258-L274 HydrophobicContact CD1-CD2 3.93Å; I258-L279 HydrophobicContact CD1-CD1 4.08Å; I258-L279 HydrophobicContact CD1-CD2 3.99Å; I258-L279 HydrophobicContact CG1-CD2 4.01Å; I258-L282 HydrophobicContact CD1-CD2 3.78Å; I258-P283 WeakPolarHBondContact O-CD 3.44Å; I258-P283 WeakPolarHBondContact O-CG 3.23Å; I258-L286 HydrophobicContact CG2-CD1 4.09Å; I258-L286 HydrophobicContact CG2-CD2 3.98Å
259	E	94.3	Very high	95.4	Very high	33 Å²	33	36.5 Å²	36.5	15%	0.154	18%	0.18	C	C	.	.			trans	-75.1	163.9	-177.7	-66.7	174.4	-169.6	0	0	110.9	I234 R235 A262 H396	I234-E259 WeakPolarHBondContact O-CB 3.28Å; I234-E259 PolarHBondContact O-N 3.42Å; R235-E259 VanDerWaalsContact CD-OE2 3.28Å; R235-E259 WeakPolarHBondContact CD-OE2 3.34Å; R235-E259 VanDerWaalsContact CG-OE2 3.27Å; R235-E259 WeakPolarHBondContact CG-OE2 3.32Å; R235-E259 IonicContact CZ-OE1 2.75Å; R235-E259 IonicContact NE-OE1 2.66Å; R235-E259 PolarHBondContact NE-OE1 2.74Å; R235-E259 IonicContact NE-OE2 3.65Å; R235-E259 PolarHBondContact NE-OE2 2.98Å; R235-E259 IonicContact NH2-OE1 2.79Å; R235-E259 PolarHBondContact NH2-OE1 2.92Å; E259-A262 VanDerWaalsContact O-CB 3.23Å; E259-A262 WeakPolarHBondContact O-CB 3.5Å; E259-A262 PolarHBondContact O-N 2.84Å; E259-H396 IonicContact OE2-NE2 3.61Å
260	R	93.2	Very high	95.2	Very high	13 Å²	13	36.4 Å²	36.4	5%	0.049	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	140.4	178.5	-67.8	162.3	169.6	153.3	-12.4	110.3	P236 A262 S380 T382 V384 H396 S407 D408	P236-R260 VanDerWaalsContact CG-O 3.28Å; P236-R260 WeakPolarHBondContact CG-O 3.09Å; R260-A262 PolarHBondContact O-N 3.32Å; R260-A262 VanDerWaalsContact O-N 3.16Å; R260-S380 PolarHBondContact NE-O 3.45Å; R260-S380 VanDerWaalsContact NE-O 3.1Å; R260-T382 PolarHBondContact NE-O 2.91Å; R260-T382 PolarHBondContact NH2-O 3.32Å; R260-T382 PolarHBondContact NH2-OG1 2.91Å; R260-V384 VanDerWaalsContact CZ-CG2 3.44Å; R260-V384 VanDerWaalsContact NH2-CG2 3.29Å; R260-H396 HydrophobicContact CB-CB 4.15Å; R260-H396 PolarHBondContact O-CD2 2.87Å; R260-H396 VanDerWaalsContact O-CD2 3.26Å; R260-S407 PolarHBondContact NH1-O 2.86Å; R260-D408 PolarHBondContact NH1-O 3.37Å
261	N	94.1	Very high	95.1	Very high	29 Å²	29	36.9 Å²	36.9	16%	0.155	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.9	22.1	176.7	-53.4	100.6	0	0	0	115.4	F263 D264 T395 H396	N261-F263 PolarHBondContact O-N 3.48Å; N261-F263 VanDerWaalsContact O-N 3.11Å; N261-D264 VanDerWaalsContact C-OD1 3.29Å; N261-D264 WeakPolarHBondContact CA-OD1 3.5Å; N261-D264 WeakPolarHBondContact CB-OD2 3.49Å; N261-D264 PolarHBondContact ND2-OD2 2.98Å; N261-D264 PolarHBondContact O-N 3.16Å; N261-T395 WeakPolarHBondContact OD1-CB 3.48Å; N261-H396 HydrophobicContact CB-CB 4.38Å; N261-H396 PolarHBondContact OD1-N 2.8Å
262	A	95.1	Very high	95	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-14.5	-170.5	0	0	0	0	0	115.5	I234 I258 E259 R260	I234-A262 HydrophobicContact CG2-CB 4.25Å; I258-A262 HydrophobicContact CG2-CB 3.55Å; E259-A262 VanDerWaalsContact O-CB 3.23Å; E259-A262 WeakPolarHBondContact O-CB 3.5Å; E259-A262 PolarHBondContact O-N 2.84Å; R260-A262 PolarHBondContact O-N 3.32Å; R260-A262 VanDerWaalsContact O-N 3.16Å
263	F	95.4	Very high	94.9	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.1	-4.1	-177	-59.8	-50	0	0	0	114.4	I234 F239 L248 M250 I258 N261 N265 L266 I272 L286 F287 L290	I234-F263 HydrophobicContact CG2-CE1 4.01Å; I234-F263 HydrophobicContact CG2-CZ 4.36Å; F239-F263 HydrophobicContact CD2-CD1 4.14Å; F239-F263 HydrophobicContact CD2-CE1 4.3Å; F239-F263 HydrophobicContact CE2-CD1 4.06Å; F239-F263 AromaticContact CE2-CE1 3.74Å; F239-F263 HydrophobicContact CE2-CE1 3.74Å; L248-F263 HydrophobicContact CD2-CD1 4.39Å; L248-F263 HydrophobicContact CD2-CE1 4.12Å; M250-F263 HydrophobicContact CE-CE1 3.89Å; M250-F263 HydrophobicContact CE-CZ 3.95Å; I258-F263 HydrophobicContact CD1-CE2 4.14Å; I258-F263 HydrophobicContact CD1-CZ 4.08Å; I258-F263 HydrophobicContact CG2-CE2 4.04Å; I258-F263 HydrophobicContact CG2-CZ 4.21Å; N261-F263 PolarHBondContact O-N 3.48Å; N261-F263 VanDerWaalsContact O-N 3.11Å; F263-N265 PolarHBondContact O-N 2.95Å; F263-L266 HydrophobicContact CB-CD1 4.3Å; F263-L266 HydrophobicContact CD1-CD1 3.95Å; F263-L266 VanDerWaalsContact O-CB 3.28Å; F263-L266 WeakPolarHBondContact O-CB 3.34Å; F263-L266 WeakPolarHBondContact O-CG 3.29Å; F263-L266 PolarHBondContact O-N 3Å; F263-I272 HydrophobicContact CD1-CD1 4.35Å; F263-I272 HydrophobicContact CD2-CD1 4.05Å; F263-I272 HydrophobicContact CE1-CD1 3.96Å; F263-I272 HydrophobicContact CE2-CD1 3.63Å; F263-I272 HydrophobicContact CG-CD1 4.4Å; F263-I272 HydrophobicContact CZ-CD1 3.6Å; F263-L286 HydrophobicContact CD2-CD1 3.78Å; F263-L286 HydrophobicContact CD2-CD2 4.1Å; F263-L286 HydrophobicContact CD2-CG 3.87Å; F263-L286 HydrophobicContact CE2-CD1 4.3Å; F263-L286 HydrophobicContact CE2-CD2 3.96Å; F263-L286 HydrophobicContact CE2-CG 4.25Å; F263-F287 HydrophobicContact CD2-CE1 4.27Å; F263-F287 HydrophobicContact CE2-CE1 4.33Å; F263-L290 HydrophobicContact CB-CD1 3.98Å
264	D	93	Very high	94.9	Very high	30 Å²	30	30.1 Å²	30.1	16%	0.16	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-24	-170.1	-61.9	24.5	0	0	0	114.7	N261 L266	N261-D264 VanDerWaalsContact C-OD1 3.29Å; N261-D264 WeakPolarHBondContact CA-OD1 3.5Å; N261-D264 WeakPolarHBondContact CB-OD2 3.49Å; N261-D264 PolarHBondContact ND2-OD2 2.98Å; N261-D264 PolarHBondContact O-N 3.16Å; D264-L266 VanDerWaalsContact C-N 3.29Å; D264-L266 PolarHBondContact O-N 2.74Å
265	N	89.3	Confident	94.8	Very high	25 Å²	25	25 Å²	25	13%	0.134	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-26.3	174	-65.8	-41.8	0	0	0	114.2	P236 F263 Q267 Y399	P236-N265 PolarHBondContact O-ND2 3.42Å; F263-N265 PolarHBondContact O-N 2.95Å; N265-Q267 PolarHBondContact O-N 3.47Å; N265-Y399 WeakPolarHBondContact ND2-CE2 3.23Å; N265-Y399 PolarHBondContact ND2-OH 3.47Å; N265-Y399 VanDerWaalsContact OD1-CE2 3.29Å; N265-Y399 WeakPolarHBondContact OD1-CE2 3.24Å
266	L	94.6	Very high	94.7	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.148	C	C	.	.			trans	-86.5	51.6	-167.5	-57.6	178.9	0	0	0	110.8	F239 L242 L245 L248 F263 D264 S268 L269 L290	F239-L266 HydrophobicContact CB-CD1 4.36Å; F239-L266 HydrophobicContact CB-CD2 3.95Å; F239-L266 HydrophobicContact CB-CG 4.31Å; F239-L266 HydrophobicContact CD2-CD1 4.39Å; F239-L266 HydrophobicContact CG-CD1 4.32Å; L242-L266 HydrophobicContact CB-CD2 3.83Å; L245-L266 HydrophobicContact CB-CD2 4.15Å; L245-L266 HydrophobicContact CD2-CD2 3.92Å; L248-L266 HydrophobicContact CD2-CD1 3.75Å; F263-L266 HydrophobicContact CB-CD1 4.3Å; F263-L266 HydrophobicContact CD1-CD1 3.95Å; F263-L266 VanDerWaalsContact O-CB 3.28Å; F263-L266 WeakPolarHBondContact O-CB 3.34Å; F263-L266 WeakPolarHBondContact O-CG 3.29Å; F263-L266 PolarHBondContact O-N 3Å; D264-L266 VanDerWaalsContact C-N 3.29Å; D264-L266 PolarHBondContact O-N 2.74Å; L266-S268 PolarHBondContact O-N 2.91Å; L266-L269 HydrophobicContact CB-CB 4Å; L266-L269 HydrophobicContact CB-CD2 4.29Å; L266-L269 HydrophobicContact CD1-CD1 4.45Å; L266-L269 HydrophobicContact CD1-CD2 4.08Å; L266-L269 WeakPolarHBondContact O-CB 3.44Å; L266-L269 PolarHBondContact O-N 2.95Å; L266-L290 HydrophobicContact CB-CD2 4.35Å; L266-L290 WeakPolarHBondContact O-CD2 3.2Å
267	Q	92	Very high	94.8	Very high	123 Å²	123	23.7 Å²	23.7	58%	0.575	12%	0.123	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-21.3	-171	-63.9	178.9	-0.5	0	0	113.8	N265 H292	N265-Q267 PolarHBondContact O-N 3.47Å; Q267-H292 PolarHBondContact O-ND1 2.81Å
268	S	96	Very high	94.9	Very high	31 Å²	31	24.4 Å²	24.4	22%	0.217	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92	6	174.9	-54.7	0	0	0	0	114.8	M243 L245 L266 V270	M243-S268 VanDerWaalsContact O-CB 3.26Å; M243-S268 WeakPolarHBondContact O-CB 3.48Å; M243-S268 PolarHBondContact O-N 2.96Å; M243-S268 PolarHBondContact O-OG 3.12Å; L245-S268 CarbonylContact O-C 3.51Å; L245-S268 VanDerWaalsContact O-C 3.27Å; L266-S268 PolarHBondContact O-N 2.91Å; S268-V270 PolarHBondContact O-N 3.08Å
269	L	96.6	Very high	94.9	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.124	C	C	.	.			trans	-71.4	126.1	-170.3	-160.4	72.8	0	0	0	112.3	L245 L248 L266 I272 L290 H292 L293	L245-L269 HydrophobicContact CD2-CD1 4.32Å; L245-L269 HydrophobicContact CG-CD1 4.34Å; L245-L269 VanDerWaalsContact O-CA 3.31Å; L245-L269 WeakPolarHBondContact O-CA 3.2Å; L245-L269 PolarHBondContact O-N 3.39Å; L248-L269 HydrophobicContact CB-CD1 3.92Å; L266-L269 HydrophobicContact CB-CB 4Å; L266-L269 HydrophobicContact CB-CD2 4.29Å; L266-L269 HydrophobicContact CD1-CD1 4.45Å; L266-L269 HydrophobicContact CD1-CD2 4.08Å; L266-L269 WeakPolarHBondContact O-CB 3.44Å; L266-L269 PolarHBondContact O-N 2.95Å; L269-I272 HydrophobicContact CD2-CB 4.02Å; L269-I272 HydrophobicContact CD2-CD1 4.22Å; L269-I272 HydrophobicContact CD2-CG1 4.41Å; L269-L290 HydrophobicContact CD2-CD1 4.29Å; L269-H292 CarbonylContact O-C 3.21Å; L269-L293 HydrophobicContact CD2-CD1 4.2Å; L269-L293 HydrophobicContact CG-CD1 4.17Å; L269-L293 VanDerWaalsContact O-CA 3.26Å; L269-L293 WeakPolarHBondContact O-CA 3.28Å; L269-L293 PolarHBondContact O-N 2.79Å
270	V	94.8	Very high	95	Very high	23 Å²	23	25.8 Å²	25.8	14%	0.139	14%	0.136	C	C	.	.			trans	-110.3	-32.6	-178.7	-175.9	0	0	0	0	111.8	Q246 S268 H292 E294 R295	Q246-V270 HydrophobicContact CB-CG2 4.28Å; Q246-V270 PolarHBondContact O-N 3.38Å; S268-V270 PolarHBondContact O-N 3.08Å; V270-H292 WeakPolarHBondContact CA-O 3.42Å; V270-H292 HydrophobicContact CG2-CB 4.41Å; V270-E294 HydrophobicContact CG1-CB 4.03Å; V270-E294 HydrophobicContact CG1-CG 3.94Å; V270-E294 PolarHBondContact O-N 2.93Å; V270-R295 PolarHBondContact O-N 3.27Å
271	E	94.5	Very high	95.1	Very high	9 Å²	9	26.1 Å²	26.1	4%	0.042	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	122.3	-176.4	-174.3	176	120.2	0	0	111.5	Q246 K247 L248 W249 R295 H554	Q246-E271 PolarHBondContact O-N 2.86Å; K247-E271 WeakPolarHBondContact CA-O 3.5Å; K247-E271 HydrophobicContact CB-CB 4.35Å; K247-E271 HydrophobicContact CG-CB 4.1Å; L248-E271 PolarHBondContact N-O 3.01Å; W249-E271 PolarHBondContact NE1-OE1 3.35Å; E271-R295 WeakPolarHBondContact CA-O 3.37Å; E271-R295 HydrophobicContact CB-CB 4.2Å; E271-R295 HydrophobicContact CG-CB 3.98Å; E271-R295 WeakPolarHBondContact OE2-CD 3.45Å; E271-R295 IonicContact OE2-CZ 2.75Å; E271-R295 IonicContact OE2-NH1 2.67Å; E271-R295 PolarHBondContact OE2-NH1 2.95Å; E271-H554 IonicContact OE1-CE1 3.32Å; E271-H554 IonicContact OE2-NE2 3.36Å
272	I	95.4	Very high	95.1	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	135	172	-165	174.6	0	0	0	110.9	L248 F263 L269 L274 L293 R295 I296 H297	L248-I272 HydrophobicContact CB-CG1 4.4Å; L248-I272 HydrophobicContact CD2-CD1 4.36Å; L248-I272 HydrophobicContact CD2-CG1 4.49Å; L248-I272 HydrophobicContact CG-CG1 4.49Å; L248-I272 WeakPolarHBondContact O-CA 3.18Å; F263-I272 HydrophobicContact CD1-CD1 4.35Å; F263-I272 HydrophobicContact CD2-CD1 4.05Å; F263-I272 HydrophobicContact CE1-CD1 3.96Å; F263-I272 HydrophobicContact CE2-CD1 3.63Å; F263-I272 HydrophobicContact CG-CD1 4.4Å; F263-I272 HydrophobicContact CZ-CD1 3.6Å; L269-I272 HydrophobicContact CD2-CB 4.02Å; L269-I272 HydrophobicContact CD2-CD1 4.22Å; L269-I272 HydrophobicContact CD2-CG1 4.41Å; I272-L274 HydrophobicContact CD1-CD1 4.27Å; I272-L274 HydrophobicContact CD1-CG 4.42Å; I272-L274 HydrophobicContact CG1-CG 4.39Å; I272-L293 HydrophobicContact CB-CD1 4.4Å; I272-L293 HydrophobicContact CG2-CD1 4.07Å; I272-L293 HydrophobicContact CG2-CD2 4.36Å; I272-R295 PolarHBondContact N-O 3.49Å; I272-I296 HydrophobicContact CG2-CB 4.17Å; I272-I296 HydrophobicContact CG2-CG1 4.04Å; I272-I296 HydrophobicContact CG2-CG2 3.71Å; I272-I296 WeakPolarHBondContact O-CA 3.38Å; I272-H297 PolarHBondContact O-N 3.37Å
273	N	95.7	Very high	95.2	Very high	16 Å²	16	25 Å²	25	9%	0.086	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	107.5	-179.9	-162.3	-30.2	0	0	0	111.9	L248 W249 M250 I251 A275 H297	L248-N273 PolarHBondContact O-N 3.11Å; W249-N273 HydrophobicContact CB-CB 4.49Å; W249-N273 HydrophobicContact CG-CB 4.49Å; M250-N273 CarbonylContact C-O 3.33Å; M250-N273 PolarHBondContact N-O 3.34Å; I251-N273 HydrophobicContact CG1-CB 4.17Å; I251-N273 WeakPolarHBondContact CG1-OD1 3.25Å; N273-A275 WeakPolarHBondContact OD1-CB 3.39Å; N273-A275 PolarHBondContact OD1-N 2.75Å; N273-A275 VanDerWaalsContact OD1-N 3.12Å; N273-H297 HydrophobicContact CB-CB 4.13Å; N273-H297 VanDerWaalsContact CG-CB 3.44Å; N273-H297 PolarHBondContact ND2-CD2 3.15Å; N273-H297 WeakPolarHBondContact OD1-CB 3.37Å
274	L	96.4	Very high	95.1	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.139	C	C	.	.			trans	-109.8	15.6	179.8	-70	168	0	0	0	111.7	M250 I255 I258 I272 N277 L279 H297 L298 N301	M250-L274 HydrophobicContact CE-CD2 3.66Å; I255-L274 HydrophobicContact CD1-CD2 3.78Å; I258-L274 HydrophobicContact CD1-CD1 3.75Å; I258-L274 HydrophobicContact CD1-CD2 3.93Å; I272-L274 HydrophobicContact CD1-CD1 4.27Å; I272-L274 HydrophobicContact CD1-CG 4.42Å; I272-L274 HydrophobicContact CG1-CG 4.39Å; L274-N277 VanDerWaalsContact C-ND2 3.32Å; L274-N277 PolarHBondContact O-ND2 2.92Å; L274-L279 HydrophobicContact CB-CD1 3.99Å; L274-L279 HydrophobicContact CD1-CD1 4.23Å; L274-L279 HydrophobicContact CD2-CD1 4.38Å; L274-L279 HydrophobicContact CG-CD1 4.45Å; L274-H297 CarbonylContact C-O 3.12Å; L274-H297 PolarHBondContact N-O 3.2Å; L274-L298 HydrophobicContact CB-CD2 4.1Å; L274-L298 HydrophobicContact CD1-CD2 4.04Å; L274-N301 PolarHBondContact O-ND2 3.28Å
275	A	95.4	Very high	95.1	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	152.9	-176	0	0	0	0	0	113.8	I251 Q252 N273 N277 H297 H299	I251-A275 CarbonylContact C-O 3.55Å; I251-A275 WeakPolarHBondContact CA-O 3.17Å; I251-A275 HydrophobicContact CG2-CB 4.4Å; Q252-A275 PolarHBondContact N-O 2.89Å; N273-A275 WeakPolarHBondContact OD1-CB 3.39Å; N273-A275 PolarHBondContact OD1-N 2.75Å; N273-A275 VanDerWaalsContact OD1-N 3.12Å; A275-N277 PolarHBondContact O-N 3.21Å; A275-N277 PolarHBondContact O-ND2 2.91Å; A275-H297 PolarHBondContact N-O 2.84Å; A275-H299 VanDerWaalsContact CA-O 3.29Å; A275-H299 WeakPolarHBondContact CA-O 3.37Å; A275-H299 WeakPolarHBondContact CB-CE1 3.38Å; A275-H299 WeakPolarHBondContact CB-ND1 3.27Å; A275-H299 WeakPolarHBondContact CB-O 3.39Å
276	H	96.5	Very high	95.4	Very high	84 Å²	84	26.7 Å²	26.7	39%	0.389	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.8	24.3	176.7	-53	99.3	0	0	0	114.8	I251 Q252 H299 H300	I251-H276 HydrophobicContact CG2-CB 4.43Å; Q252-H276 WeakPolarHBondContact CA-O 3.34Å; Q252-H276 HydrophobicContact CB-CB 3.98Å; Q252-H276 HydrophobicContact CG-CB 4.27Å; H276-H299 AromaticContact CE1-CE1 3.74Å; H276-H299 PolarHBondContact N-O 3.46Å; H276-H300 WeakPolarHBondContact CA-O 3.19Å; H276-H300 WeakPolarHBondContact CD2-CB 3.44Å; H276-H300 AromaticContact CD2-CG 3.61Å; H276-H300 PolarHBondContact N-O 2.96Å; H276-H300 AromaticContact NE2-CD2 4Å; H276-H300 AromaticContact NE2-CG 3.48Å; H276-H300 AromaticContact NE2-ND1 3.54Å
277	N	97.7	Very high	95.3	Very high	10 Å²	10	26.8 Å²	26.8	5%	0.053	14%	0.141	C	C	.	.	S	Bend	trans	-95.4	-173.8	172.6	-73.4	-71.4	0	0	0	111.1	M250 S253 Q254 I255 L274 A275 L279 N301	M250-N277 PolarHBondContact O-ND2 3.37Å; S253-N277 VanDerWaalsContact C-OD1 3.32Å; S253-N277 WeakPolarHBondContact CA-OD1 3.14Å; S253-N277 PolarHBondContact N-OD1 2.82Å; Q254-N277 PolarHBondContact N-OD1 3.42Å; I255-N277 HydrophobicContact CB-CB 4.13Å; I255-N277 PolarHBondContact N-OD1 3.41Å; L274-N277 VanDerWaalsContact C-ND2 3.32Å; L274-N277 PolarHBondContact O-ND2 2.92Å; A275-N277 PolarHBondContact O-N 3.21Å; A275-N277 PolarHBondContact O-ND2 2.91Å; N277-L279 HydrophobicContact CB-CD1 4.45Å; N277-L279 HydrophobicContact CB-CG 4.25Å; N277-N301 VanDerWaalsContact CA-OD1 3.29Å; N277-N301 WeakPolarHBondContact CA-OD1 3.49Å; N277-N301 WeakPolarHBondContact CB-OD1 3.34Å; N277-N301 PolarHBondContact N-OD1 2.87Å; N277-N301 PolarHBondContact O-OD1 3.39Å; N277-N301 VanDerWaalsContact O-OD1 3.05Å
278	N	97.5	Very high	95.3	Very high	84 Å²	84	24 Å²	24	45%	0.449	13%	0.133	S	C	.	.			trans	-108.5	30.9	-179.9	-164	70.7	0	0	0	111.7	I255 Q256 T280	I255-N278 CarbonylContact O-C 3.18Å; I255-N278 WeakPolarHBondContact O-CA 3.35Å; I255-N278 PolarHBondContact O-N 2.63Å; Q256-N278 HydrophobicContact CG-CB 4.31Å; N278-T280 PolarHBondContact O-N 3.05Å
279	L	96.4	Very high	95.1	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.136	C	C	.	.			trans	-71	125.5	-180	-63.1	167.9	0	0	0	110.7	I255 I258 L274 N277 L282 N301 P302 W303	I255-L279 HydrophobicContact CB-CD2 4.38Å; I255-L279 HydrophobicContact CG2-CD2 3.74Å; I255-L279 PolarHBondContact O-N 3.21Å; I258-L279 HydrophobicContact CD1-CD1 4.08Å; I258-L279 HydrophobicContact CD1-CD2 3.99Å; I258-L279 HydrophobicContact CG1-CD2 4.01Å; L274-L279 HydrophobicContact CB-CD1 3.99Å; L274-L279 HydrophobicContact CD1-CD1 4.23Å; L274-L279 HydrophobicContact CD2-CD1 4.38Å; L274-L279 HydrophobicContact CG-CD1 4.45Å; N277-L279 HydrophobicContact CB-CD1 4.45Å; N277-L279 HydrophobicContact CB-CG 4.25Å; L279-L282 HydrophobicContact CD1-CD2 4.32Å; L279-N301 HydrophobicContact CB-CB 4.26Å; L279-N301 WeakPolarHBondContact CB-OD1 3.27Å; L279-N301 PolarHBondContact N-OD1 2.75Å; L279-N301 VanDerWaalsContact N-OD1 3.17Å; L279-P302 CarbonylContact O-C 3.2Å; L279-P302 WeakPolarHBondContact O-CD 3.49Å; L279-W303 HydrophobicContact CB-CH2 3.62Å; L279-W303 HydrophobicContact CB-CZ2 4.27Å; L279-W303 HydrophobicContact CB-CZ3 3.84Å; L279-W303 HydrophobicContact CD1-CH2 3.95Å; L279-W303 HydrophobicContact CD1-CZ2 4.49Å; L279-W303 HydrophobicContact CG-CH2 4.42Å
280	T	95.7	Very high	94.9	Very high	65 Å²	65	24.7 Å²	24.7	40%	0.399	14%	0.136	S	C	.	.			trans	-96.1	-36.7	172.6	54.3	0	0	0	0	111.9	N278 P302 W303 N304	N278-T280 PolarHBondContact O-N 3.05Å; T280-P302 HydrophobicContact CG2-CG 4.19Å; T280-W303 CarbonylContact O-C 3.58Å; T280-W303 WeakPolarHBondContact O-CA 3.03Å; T280-N304 PolarHBondContact O-N 3.4Å
281	L	94.7	Very high	94.7	Very high	20 Å²	20	30.4 Å²	30.4	11%	0.105	16%	0.161	C	C	.	.			trans	-148.1	165.1	-176.1	-76.9	169	0	0	0	110.2	N304 N306 D308 I309 L381	L281-N304 HydrophobicContact CD1-CB 4.5Å; L281-N304 WeakPolarHBondContact CD2-O 3.49Å; L281-N304 HydrophobicContact CG-CB 4.29Å; L281-N306 WeakPolarHBondContact CD2-OD1 3.32Å; L281-D308 HydrophobicContact CD1-CB 4.43Å; L281-D308 HydrophobicContact CD2-CB 4.05Å; L281-I309 HydrophobicContact CD2-CD1 3.96Å; L281-L381 HydrophobicContact CB-CD1 3.55Å; L281-L381 HydrophobicContact CB-CD2 3.87Å; L281-L381 HydrophobicContact CB-CG 4.39Å; L281-L381 HydrophobicContact CD1-CD1 3.3Å; L281-L381 HydrophobicContact CG-CD1 3.92Å
282	L	95.4	Very high	94.6	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.005	18%	0.184	C	C	.	.			trans	-126.1	143	173.5	-66.6	179.9	0	0	0	110	I258 L279 L286 F287 L298 W303 W311 L312	I258-L282 HydrophobicContact CD1-CD2 3.78Å; L279-L282 HydrophobicContact CD1-CD2 4.32Å; L282-L286 HydrophobicContact CB-CD2 4.17Å; L282-L286 HydrophobicContact CD1-CD2 4.29Å; L282-L286 HydrophobicContact CD2-CD2 3.95Å; L282-L286 HydrophobicContact CG-CD2 4.36Å; L282-F287 HydrophobicContact CD1-CE2 3.78Å; L282-F287 HydrophobicContact CD1-CZ 3.68Å; L282-L298 HydrophobicContact CD1-CD1 4.45Å; L282-W303 HydrophobicContact CD1-CH2 4.1Å; L282-W303 HydrophobicContact CD1-CZ3 4.43Å; L282-W303 HydrophobicContact CD2-CH2 4.13Å; L282-W303 HydrophobicContact CD2-CZ3 4.34Å; L282-W303 HydrophobicContact CG-CH2 3.86Å; L282-W303 HydrophobicContact CG-CZ3 3.84Å; L282-W311 HydrophobicContact CB-CZ2 3.87Å; L282-L312 HydrophobicContact CD1-CD1 4.48Å; L282-L312 HydrophobicContact CD1-CD2 4.14Å
283	P	95.4	Very high	94.4	Very high	5 Å²	5	35.5 Å²	35.5	3%	0.032	18%	0.184	C	C	.	.			trans	-52.8	148.3	171.3	-26.9	33.3	0	0	0	113.3	I258 L286 W311 L381	I258-P283 WeakPolarHBondContact O-CD 3.44Å; I258-P283 WeakPolarHBondContact O-CG 3.23Å; P283-L286 WeakPolarHBondContact O-CB 3.23Å; P283-L286 PolarHBondContact O-N 2.75Å; P283-W311 WeakPolarHBondContact O-CZ2 3.41Å; P283-W311 PolarHBondContact O-NE1 3.31Å; P283-L381 CarbonylContact C-O 3.27Å; P283-L381 WeakPolarHBondContact CA-O 3.48Å
284	H	94.5	Very high	94	Very high	27 Å²	27	39.2 Å²	39.2	13%	0.125	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	142.3	175.4	-161.7	-94.6	0	0	0	111.8	L286 W311 L381 S383 N430 S431	H284-L286 PolarHBondContact O-N 3.45Å; H284-L286 VanDerWaalsContact O-N 3.08Å; H284-W311 AromaticContact CD2-CD1 3.61Å; H284-W311 AromaticContact CD2-CG 3.79Å; H284-L381 PolarHBondContact N-O 3.43Å; H284-S383 PolarHBondContact ND1-OG 3.17Å; H284-N430 VanDerWaalsContact CD2-C 3.49Å; H284-S431 PolarHBondContact CD2-N 3.46Å; H284-S431 VanDerWaalsContact CD2-N 3.31Å; H284-S431 VanDerWaalsContact NE2-CA 3.33Å; H284-S431 WeakPolarHBondContact NE2-CA 3.49Å; H284-S431 PolarHBondContact NE2-N 2.86Å; H284-S431 VanDerWaalsContact NE2-N 3.1Å
285	D	92.6	Very high	93.7	Very high	60 Å²	60	42.7 Å²	42.7	32%	0.321	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.6	15.6	179.9	-72.5	-52.5	0	0	0	116.6	F287 T288 P289	D285-F287 PolarHBondContact O-N 2.89Å; D285-T288 WeakPolarHBondContact CA-OG1 3.29Å; D285-T288 WeakPolarHBondContact O-CB 3.5Å; D285-T288 PolarHBondContact O-N 2.93Å; D285-T288 PolarHBondContact O-OG1 2.94Å; D285-T288 WeakPolarHBondContact OD1-CB 3.29Å; D285-T288 PolarHBondContact OD1-OG1 3.11Å; D285-P289 VanDerWaalsContact O-CD 3.23Å; D285-P289 WeakPolarHBondContact O-CD 3.48Å
286	L	94.8	Very high	93.5	Very high	3 Å²	3	42.8 Å²	42.8	2%	0.016	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-25.8	-175.6	-178.8	68.2	0	0	0	114.5	I258 F263 L282 P283 H284 W311	I258-L286 HydrophobicContact CG2-CD1 4.09Å; I258-L286 HydrophobicContact CG2-CD2 3.98Å; F263-L286 HydrophobicContact CD2-CD1 3.78Å; F263-L286 HydrophobicContact CD2-CD2 4.1Å; F263-L286 HydrophobicContact CD2-CG 3.87Å; F263-L286 HydrophobicContact CE2-CD1 4.3Å; F263-L286 HydrophobicContact CE2-CD2 3.96Å; F263-L286 HydrophobicContact CE2-CG 4.25Å; L282-L286 HydrophobicContact CB-CD2 4.17Å; L282-L286 HydrophobicContact CD1-CD2 4.29Å; L282-L286 HydrophobicContact CD2-CD2 3.95Å; L282-L286 HydrophobicContact CG-CD2 4.36Å; P283-L286 WeakPolarHBondContact O-CB 3.23Å; P283-L286 PolarHBondContact O-N 2.75Å; H284-L286 PolarHBondContact O-N 3.45Å; H284-L286 VanDerWaalsContact O-N 3.08Å; L286-W311 HydrophobicContact CB-CH2 3.92Å; L286-W311 HydrophobicContact CB-CZ2 4.12Å
287	F	93.4	Very high	93.3	Very high	1 Å²	1	41 Å²	41	0%	0.004	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.7	-4.2	178.1	-54.1	-39.7	0	0	0	113.9	F263 L282 D285 L290 L293 I296 W311 L312 W315	F263-F287 HydrophobicContact CD2-CE1 4.27Å; F263-F287 HydrophobicContact CE2-CE1 4.33Å; L282-F287 HydrophobicContact CD1-CE2 3.78Å; L282-F287 HydrophobicContact CD1-CZ 3.68Å; D285-F287 PolarHBondContact O-N 2.89Å; F287-L290 HydrophobicContact CD1-CD1 4.12Å; F287-L290 WeakPolarHBondContact O-CB 3.19Å; F287-L290 PolarHBondContact O-N 2.92Å; F287-L290 VanDerWaalsContact O-N 3.11Å; F287-L293 HydrophobicContact CB-CD2 4.09Å; F287-L293 HydrophobicContact CD1-CD2 4.01Å; F287-L293 HydrophobicContact CG-CD2 4.1Å; F287-I296 HydrophobicContact CB-CD1 4.46Å; F287-I296 HydrophobicContact CD1-CD1 4.3Å; F287-I296 HydrophobicContact CD2-CD1 3.4Å; F287-I296 VanDerWaalsContact CD2-CD1 3.4Å; F287-I296 HydrophobicContact CE1-CD1 4.42Å; F287-I296 HydrophobicContact CE2-CD1 3.55Å; F287-I296 HydrophobicContact CE2-CG2 4.15Å; F287-I296 HydrophobicContact CG-CD1 3.82Å; F287-I296 HydrophobicContact CZ-CD1 4.07Å; F287-I296 HydrophobicContact CZ-CG2 4.1Å; F287-W311 HydrophobicContact CB-CH2 4.46Å; F287-W311 HydrophobicContact CB-CZ3 4.24Å; F287-W311 AromaticContact CD2-CH2 3.57Å; F287-W311 HydrophobicContact CD2-CH2 3.57Å; F287-W311 AromaticContact CD2-CZ3 3.85Å; F287-W311 HydrophobicContact CD2-CZ3 3.85Å; F287-W311 AromaticContact CE2-CH2 3.98Å; F287-W311 HydrophobicContact CE2-CH2 3.98Å; F287-W311 HydrophobicContact CG-CH2 4.08Å; F287-W311 HydrophobicContact CG-CZ3 4.31Å; F287-L312 HydrophobicContact CD2-CD1 4.02Å; F287-L312 HydrophobicContact CE2-CD1 3.73Å; F287-W315 HydrophobicContact CB-CD2 4.46Å; F287-W315 HydrophobicContact CB-CZ2 4.37Å
288	T	91.3	Very high	93.1	Very high	66 Å²	66	40.8 Å²	40.8	41%	0.405	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-35.7	-175.9	-54.3	0	0	0	0	113.4	D285 L290 H291	D285-T288 WeakPolarHBondContact CA-OG1 3.29Å; D285-T288 WeakPolarHBondContact O-CB 3.5Å; D285-T288 PolarHBondContact O-N 2.93Å; D285-T288 PolarHBondContact O-OG1 2.94Å; D285-T288 WeakPolarHBondContact OD1-CB 3.29Å; D285-T288 PolarHBondContact OD1-OG1 3.11Å; T288-L290 VanDerWaalsContact C-N 3.25Å; T288-L290 PolarHBondContact O-N 3.5Å; T288-H291 PolarHBondContact O-CE1 2.99Å; T288-H291 PolarHBondContact O-ND1 3.25Å
289	P	91.7	Very high	92.9	Very high	43 Å²	43	38.8 Å²	38.8	28%	0.279	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-12.6	170.9	-21	33.9	0	0	0	115.1	D285 H291	D285-P289 VanDerWaalsContact O-CD 3.23Å; D285-P289 WeakPolarHBondContact O-CD 3.48Å; P289-H291 PolarHBondContact O-N 2.87Å; P289-H291 VanDerWaalsContact O-N 3.15Å
290	L	93.1	Very high	92.8	Very high	2 Å²	2	45 Å²	45	1%	0.01	22%	0.222	C	C	.	.			trans	-93.7	66	-169.3	-55.8	-179.8	0	0	0	110.9	F263 L266 L269 F287 T288 H292 L293	F263-L290 HydrophobicContact CB-CD1 3.98Å; L266-L290 HydrophobicContact CB-CD2 4.35Å; L266-L290 WeakPolarHBondContact O-CD2 3.2Å; L269-L290 HydrophobicContact CD2-CD1 4.29Å; F287-L290 HydrophobicContact CD1-CD1 4.12Å; F287-L290 WeakPolarHBondContact O-CB 3.19Å; F287-L290 PolarHBondContact O-N 2.92Å; F287-L290 VanDerWaalsContact O-N 3.11Å; T288-L290 VanDerWaalsContact C-N 3.25Å; T288-L290 PolarHBondContact O-N 3.5Å; L290-H292 PolarHBondContact O-N 2.8Å; L290-L293 HydrophobicContact CB-CB 3.96Å; L290-L293 HydrophobicContact CB-CD2 4.05Å; L290-L293 HydrophobicContact CD1-CD2 3.87Å; L290-L293 WeakPolarHBondContact O-CB 3.34Å; L290-L293 PolarHBondContact O-N 2.95Å
291	H	91.2	Very high	92.9	Very high	143 Å²	143	42.5 Å²	42.5	66%	0.662	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-14.8	-169.7	-53.5	-39.6	0	0	0	115.8	T288 P289	T288-H291 PolarHBondContact O-CE1 2.99Å; T288-H291 PolarHBondContact O-ND1 3.25Å; P289-H291 PolarHBondContact O-N 2.87Å; P289-H291 VanDerWaalsContact O-N 3.15Å
292	H	92.4	Very high	93	Very high	114 Å²	114	43 Å²	43	53%	0.528	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100	2.5	178.5	-60	106.1	0	0	0	114.1	Q267 L269 V270 L290 E294	Q267-H292 PolarHBondContact O-ND1 2.81Å; L269-H292 CarbonylContact O-C 3.21Å; V270-H292 WeakPolarHBondContact CA-O 3.42Å; V270-H292 HydrophobicContact CG2-CB 4.41Å; L290-H292 PolarHBondContact O-N 2.8Å; H292-E294 PolarHBondContact O-N 2.7Å; H292-E294 VanDerWaalsContact O-N 3.14Å
293	L	91.5	Very high	93	Very high	1 Å²	1	43 Å²	43	1%	0.005	21%	0.211	C	C	.	.			trans	-79.3	98.5	-167.1	-170	63.9	0	0	0	112.9	L269 I272 F287 L290 I296 W315	L269-L293 HydrophobicContact CD2-CD1 4.2Å; L269-L293 HydrophobicContact CG-CD1 4.17Å; L269-L293 VanDerWaalsContact O-CA 3.26Å; L269-L293 WeakPolarHBondContact O-CA 3.28Å; L269-L293 PolarHBondContact O-N 2.79Å; I272-L293 HydrophobicContact CB-CD1 4.4Å; I272-L293 HydrophobicContact CG2-CD1 4.07Å; I272-L293 HydrophobicContact CG2-CD2 4.36Å; F287-L293 HydrophobicContact CB-CD2 4.09Å; F287-L293 HydrophobicContact CD1-CD2 4.01Å; F287-L293 HydrophobicContact CG-CD2 4.1Å; L290-L293 HydrophobicContact CB-CB 3.96Å; L290-L293 HydrophobicContact CB-CD2 4.05Å; L290-L293 HydrophobicContact CD1-CD2 3.87Å; L290-L293 WeakPolarHBondContact O-CB 3.34Å; L290-L293 PolarHBondContact O-N 2.95Å; L293-I296 HydrophobicContact CD2-CD1 3.53Å; L293-I296 HydrophobicContact CD2-CG1 3.87Å; L293-I296 HydrophobicContact CG-CD1 4.14Å; L293-I296 HydrophobicContact CG-CG1 3.99Å; L293-W315 HydrophobicContact CB-CZ2 4.32Å; L293-W315 HydrophobicContact CD2-CH2 4.45Å; L293-W315 HydrophobicContact CD2-CZ2 4.2Å; L293-W315 HydrophobicContact CG-CH2 4.37Å; L293-W315 HydrophobicContact CG-CZ2 4.36Å; L293-W315 WeakPolarHBondContact O-CH2 3.36Å
294	E	87.2	Confident	93.1	Very high	95 Å²	95	45.1 Å²	45.1	44%	0.444	22%	0.222	S	C	.	.			trans	-84.6	-29.2	178.7	-69.5	179.3	179.7	0	0	114	V270 H292	V270-E294 HydrophobicContact CG1-CB 4.03Å; V270-E294 HydrophobicContact CG1-CG 3.94Å; V270-E294 PolarHBondContact O-N 2.93Å; H292-E294 PolarHBondContact O-N 2.7Å; H292-E294 VanDerWaalsContact O-N 3.14Å
295	R	88.7	Confident	93.1	Very high	72 Å²	72	43.9 Å²	43.9	27%	0.272	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	118.8	-163.1	-53.7	179.8	-152.2	141.5	13.7	112.1	V270 E271 I272 T324	V270-R295 PolarHBondContact O-N 3.27Å; E271-R295 WeakPolarHBondContact CA-O 3.37Å; E271-R295 HydrophobicContact CB-CB 4.2Å; E271-R295 HydrophobicContact CG-CB 3.98Å; E271-R295 WeakPolarHBondContact OE2-CD 3.45Å; E271-R295 IonicContact OE2-CZ 2.75Å; E271-R295 IonicContact OE2-NH1 2.67Å; E271-R295 PolarHBondContact OE2-NH1 2.95Å; I272-R295 PolarHBondContact N-O 3.49Å; R295-T324 HydrophobicContact CG-CG2 3.91Å
296	I	91	Very high	93.1	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.01	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	115.2	177	-45.8	-168.6	0	0	0	109.8	I272 F287 L293 L298 W315	I272-I296 HydrophobicContact CG2-CB 4.17Å; I272-I296 HydrophobicContact CG2-CG1 4.04Å; I272-I296 HydrophobicContact CG2-CG2 3.71Å; I272-I296 WeakPolarHBondContact O-CA 3.38Å; F287-I296 HydrophobicContact CB-CD1 4.46Å; F287-I296 HydrophobicContact CD1-CD1 4.3Å; F287-I296 HydrophobicContact CD2-CD1 3.4Å; F287-I296 VanDerWaalsContact CD2-CD1 3.4Å; F287-I296 HydrophobicContact CE1-CD1 4.42Å; F287-I296 HydrophobicContact CE2-CD1 3.55Å; F287-I296 HydrophobicContact CE2-CG2 4.15Å; F287-I296 HydrophobicContact CG-CD1 3.82Å; F287-I296 HydrophobicContact CZ-CD1 4.07Å; F287-I296 HydrophobicContact CZ-CG2 4.1Å; L293-I296 HydrophobicContact CD2-CD1 3.53Å; L293-I296 HydrophobicContact CD2-CG1 3.87Å; L293-I296 HydrophobicContact CG-CD1 4.14Å; L293-I296 HydrophobicContact CG-CG1 3.99Å; I296-L298 HydrophobicContact CG2-CD1 4.06Å; I296-L298 HydrophobicContact CG2-CD2 3.52Å; I296-L298 HydrophobicContact CG2-CG 3.54Å; I296-W315 HydrophobicContact CD1-CD2 4.39Å; I296-W315 HydrophobicContact CD1-CE3 3.83Å; I296-W315 HydrophobicContact CD1-CH2 3.38Å; I296-W315 HydrophobicContact CD1-CZ2 3.91Å; I296-W315 HydrophobicContact CD1-CZ3 3.31Å; I296-W315 HydrophobicContact CG1-CH2 3.8Å; I296-W315 HydrophobicContact CG1-CZ3 3.8Å
297	H	92.7	Very high	93.1	Very high	48 Å²	48	44.4 Å²	44.4	22%	0.222	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	103.2	174.6	-58.4	-82.3	0	0	0	110.5	I272 N273 L274 A275	I272-H297 PolarHBondContact O-N 3.37Å; N273-H297 HydrophobicContact CB-CB 4.13Å; N273-H297 VanDerWaalsContact CG-CB 3.44Å; N273-H297 PolarHBondContact ND2-CD2 3.15Å; N273-H297 WeakPolarHBondContact OD1-CB 3.37Å; L274-H297 CarbonylContact C-O 3.12Å; L274-H297 PolarHBondContact N-O 3.2Å; A275-H297 PolarHBondContact N-O 2.84Å
298	L	94	Very high	93.1	Very high	4 Å²	4	45.4 Å²	45.4	2%	0.021	23%	0.227	C	C	.	.			trans	-109.6	-1.5	-178.3	-62.4	-173.1	0	0	0	114.2	L274 L282 I296 N301 W303 L312 A328	L274-L298 HydrophobicContact CB-CD2 4.1Å; L274-L298 HydrophobicContact CD1-CD2 4.04Å; L282-L298 HydrophobicContact CD1-CD1 4.45Å; I296-L298 HydrophobicContact CG2-CD1 4.06Å; I296-L298 HydrophobicContact CG2-CD2 3.52Å; I296-L298 HydrophobicContact CG2-CG 3.54Å; L298-N301 PolarHBondContact O-ND2 3.42Å; L298-N301 VanDerWaalsContact O-ND2 3.11Å; L298-W303 HydrophobicContact CB-CZ2 3.78Å; L298-W303 HydrophobicContact CD1-CZ2 4.26Å; L298-W303 HydrophobicContact CD2-CH2 4.44Å; L298-W303 HydrophobicContact CD2-CZ2 4.07Å; L298-W303 HydrophobicContact CG-CZ2 4.25Å; L298-W303 PolarHBondContact O-NE1 2.97Å; L298-L312 HydrophobicContact CD1-CD1 3.96Å; L298-L312 HydrophobicContact CD1-CD2 3.85Å; L298-L312 HydrophobicContact CD1-CG 4.38Å; L298-A328 HydrophobicContact CB-CB 3.94Å
299	H	93	Very high	93.1	Very high	42 Å²	42	42.3 Å²	42.3	19%	0.194	21%	0.207	C	C	.	.			trans	-62.9	157.4	-176.3	64.6	52.1	0	0	0	113.1	A275 H276 C327	A275-H299 VanDerWaalsContact CA-O 3.29Å; A275-H299 WeakPolarHBondContact CA-O 3.37Å; A275-H299 WeakPolarHBondContact CB-CE1 3.38Å; A275-H299 WeakPolarHBondContact CB-ND1 3.27Å; A275-H299 WeakPolarHBondContact CB-O 3.39Å; H276-H299 AromaticContact CE1-CE1 3.74Å; H276-H299 PolarHBondContact N-O 3.46Å; H299-C327 HydrophobicContact CB-CB 4.01Å; H299-C327 WeakPolarHBondContact CB-O 3.24Å
300	H	95.4	Very high	93.2	Very high	132 Å²	132	40.3 Å²	40.3	61%	0.611	19%	0.194	S	C	*	.	S	Bend	trans	57.9	47.3	-178.1	-62	89.5	0	0	0	113.3	H276	H276-H300 WeakPolarHBondContact CA-O 3.19Å; H276-H300 WeakPolarHBondContact CD2-CB 3.44Å; H276-H300 AromaticContact CD2-CG 3.61Å; H276-H300 PolarHBondContact N-O 2.96Å; H276-H300 AromaticContact NE2-CD2 4Å; H276-H300 AromaticContact NE2-CG 3.48Å; H276-H300 AromaticContact NE2-ND1 3.54Å
301	N	96.7	Very high	93.2	Very high	12 Å²	12	40.8 Å²	40.8	6%	0.064	20%	0.196	C	C	.	.	S	Bend	trans	-126.5	148.3	167.3	-80.2	-82.5	0	0	0	108.7	L274 N277 L279 L298 W303	L274-N301 PolarHBondContact O-ND2 3.28Å; N277-N301 VanDerWaalsContact CA-OD1 3.29Å; N277-N301 WeakPolarHBondContact CA-OD1 3.49Å; N277-N301 WeakPolarHBondContact CB-OD1 3.34Å; N277-N301 PolarHBondContact N-OD1 2.87Å; N277-N301 PolarHBondContact O-OD1 3.39Å; N277-N301 VanDerWaalsContact O-OD1 3.05Å; L279-N301 HydrophobicContact CB-CB 4.26Å; L279-N301 WeakPolarHBondContact CB-OD1 3.27Å; L279-N301 PolarHBondContact N-OD1 2.75Å; L279-N301 VanDerWaalsContact N-OD1 3.17Å; L298-N301 PolarHBondContact O-ND2 3.42Å; L298-N301 VanDerWaalsContact O-ND2 3.11Å; N301-W303 HydrophobicContact CB-CD2 4.16Å; N301-W303 HydrophobicContact CB-CG 4.43Å; N301-W303 HydrophobicContact CB-CZ2 3.71Å; N301-W303 PolarHBondContact O-N 3.23Å
302	P	96.9	Very high	93.3	Very high	31 Å²	31	34 Å²	34	20%	0.201	16%	0.164	C	C	.	.			trans	-77.7	53.3	-177.3	33.9	-38.7	0	0	0	113.7	L279 T280 N304 N331	L279-P302 CarbonylContact O-C 3.2Å; L279-P302 WeakPolarHBondContact O-CD 3.49Å; T280-P302 HydrophobicContact CG2-CG 4.19Å; P302-N304 PolarHBondContact O-N 3.23Å; P302-N331 HydrophobicContact CB-CB 4.43Å
303	W	96.5	Very high	93.2	Very high	1 Å²	1	28.6 Å²	28.6	0%	0.004	14%	0.139	C	C	.	.			trans	-53	130.3	-173.5	-63.8	115.1	0	0	0	114.1	L279 T280 L282 L298 N301 I309 N331 T332 I341	L279-W303 HydrophobicContact CB-CH2 3.62Å; L279-W303 HydrophobicContact CB-CZ2 4.27Å; L279-W303 HydrophobicContact CB-CZ3 3.84Å; L279-W303 HydrophobicContact CD1-CH2 3.95Å; L279-W303 HydrophobicContact CD1-CZ2 4.49Å; L279-W303 HydrophobicContact CG-CH2 4.42Å; T280-W303 CarbonylContact O-C 3.58Å; T280-W303 WeakPolarHBondContact O-CA 3.03Å; L282-W303 HydrophobicContact CD1-CH2 4.1Å; L282-W303 HydrophobicContact CD1-CZ3 4.43Å; L282-W303 HydrophobicContact CD2-CH2 4.13Å; L282-W303 HydrophobicContact CD2-CZ3 4.34Å; L282-W303 HydrophobicContact CG-CH2 3.86Å; L282-W303 HydrophobicContact CG-CZ3 3.84Å; L298-W303 HydrophobicContact CB-CZ2 3.78Å; L298-W303 HydrophobicContact CD1-CZ2 4.26Å; L298-W303 HydrophobicContact CD2-CH2 4.44Å; L298-W303 HydrophobicContact CD2-CZ2 4.07Å; L298-W303 HydrophobicContact CG-CZ2 4.25Å; L298-W303 PolarHBondContact O-NE1 2.97Å; N301-W303 HydrophobicContact CB-CD2 4.16Å; N301-W303 HydrophobicContact CB-CG 4.43Å; N301-W303 HydrophobicContact CB-CZ2 3.71Å; N301-W303 PolarHBondContact O-N 3.23Å; W303-I309 HydrophobicContact CE3-CD1 4.17Å; W303-N331 PolarHBondContact O-N 3.37Å; W303-T332 PolarHBondContact O-N 2.71Å; W303-T332 VanDerWaalsContact O-N 3.14Å; W303-I341 HydrophobicContact CB-CD1 3.9Å; W303-I341 HydrophobicContact CD2-CD1 4.07Å; W303-I341 HydrophobicContact CG-CD1 3.58Å
304	N	96.1	Very high	93.1	Very high	48 Å²	48	33.3 Å²	33.3	26%	0.257	16%	0.157	S	C	.	.	B	Isolated β-bridge	trans	-101.2	99.5	174.8	-176.2	43.9	0	0	0	109.7	T280 L281 P302 N306 T332	T280-N304 PolarHBondContact O-N 3.4Å; L281-N304 HydrophobicContact CD1-CB 4.5Å; L281-N304 WeakPolarHBondContact CD2-O 3.49Å; L281-N304 HydrophobicContact CG-CB 4.29Å; P302-N304 PolarHBondContact O-N 3.23Å; N304-N306 PolarHBondContact O-N 2.88Å; N304-N306 VanDerWaalsContact O-N 3.09Å; N304-T332 CarbonylContact C-O 3.54Å; N304-T332 WeakPolarHBondContact CA-OG1 3.42Å; N304-T332 WeakPolarHBondContact CB-OG1 3.08Å; N304-T332 WeakPolarHBondContact OD1-CB 3.39Å; N304-T332 PolarHBondContact OD1-OG1 3.12Å
305	C	95.3	Very high	93.2	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.007	14%	0.142	C	C	.	.			trans	-80	95.4	-176.2	-66.1	0	0	0	0	110.8	I309 C330 T332 P333 L336 L344 F349	C305-I309 HydrophobicContact CB-CG2 4.21Å; C305-C330 HydrophobicContact CB-CB 3.88Å; C305-C330 WeakPolarHBondContact CB-SG 3.33Å; C305-C330 VanDerWaalsContact SG-CA 3.54Å; C305-C330 WeakPolarHBondContact SG-CB 3.43Å; C305-C330 CovalentContact SG-SG 2.03Å; C305-C330 PolarHBondContact SG-SG 3.1Å; C305-T332 PolarHBondContact N-O 3.24Å; C305-P333 WeakPolarHBondContact O-CD 3.48Å; C305-L336 HydrophobicContact CB-CD1 3.97Å; C305-L344 HydrophobicContact CB-CD1 3.89Å; C305-F349 VanDerWaalsContact O-CE1 3.26Å; C305-F349 WeakPolarHBondContact O-CE1 3.5Å
306	N	93.4	Very high	93.2	Very high	45 Å²	45	27.3 Å²	27.3	24%	0.241	13%	0.131	C	C	.	.	S	Bend	trans	-127.9	-166.4	173.7	74.1	-14	0	0	0	109.9	L281 N304 D308 I309	L281-N306 WeakPolarHBondContact CD2-OD1 3.32Å; N304-N306 PolarHBondContact O-N 2.88Å; N304-N306 VanDerWaalsContact O-N 3.09Å; N306-D308 PolarHBondContact ND2-OD2 3.42Å; N306-D308 PolarHBondContact O-N 3.33Å; N306-D308 VanDerWaalsContact O-N 3.16Å; N306-D308 WeakPolarHBondContact OD1-CB 3.35Å; N306-D308 PolarHBondContact OD1-N 3.48Å; N306-D308 PolarHBondContact OD1-OD2 3.06Å; N306-I309 WeakPolarHBondContact O-CG2 3.17Å; N306-I309 PolarHBondContact O-N 3.01Å; N306-I309 VanDerWaalsContact O-N 3.11Å
307	C	93.2	Very high	92.9	Very high	29 Å²	29	33.9 Å²	33.9	20%	0.196	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	-54.1	-31.5	175.5	-64.4	0	0	0	0	115	I309 L310 C351 S431	C307-I309 VanDerWaalsContact C-N 3.26Å; C307-I309 PolarHBondContact O-N 2.95Å; C307-L310 WeakPolarHBondContact O-CB 3.26Å; C307-L310 PolarHBondContact O-N 3.36Å; C307-C351 VanDerWaalsContact CA-SG 3.55Å; C307-C351 HydrophobicContact CB-CB 3.76Å; C307-C351 WeakPolarHBondContact CB-SG 3.41Å; C307-C351 WeakPolarHBondContact SG-CA 3.39Å; C307-C351 WeakPolarHBondContact SG-CB 3.44Å; C307-C351 CovalentContact SG-SG 2.03Å; C307-C351 PolarHBondContact SG-SG 3.43Å; C307-S431 PolarHBondContact O-OG 2.97Å
308	D	93.2	Very high	92.4	Very high	23 Å²	23	38.7 Å²	38.7	12%	0.123	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-73.4	-16.7	-178.1	-52.3	-58.8	0	0	0	112.4	L281 N306 W311 L381	L281-D308 HydrophobicContact CD1-CB 4.43Å; L281-D308 HydrophobicContact CD2-CB 4.05Å; N306-D308 PolarHBondContact ND2-OD2 3.42Å; N306-D308 PolarHBondContact O-N 3.33Å; N306-D308 VanDerWaalsContact O-N 3.16Å; N306-D308 WeakPolarHBondContact OD1-CB 3.35Å; N306-D308 PolarHBondContact OD1-N 3.48Å; N306-D308 PolarHBondContact OD1-OD2 3.06Å; D308-W311 PolarHBondContact O-NE1 3.46Å; D308-L381 HydrophobicContact CB-CB 4.5Å; D308-L381 HydrophobicContact CB-CD1 3.98Å
309	I	93	Very high	91.5	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.005	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-84.1	-11.7	175.7	-143.8	72.9	0	0	0	113.3	L281 W303 C305 N306 C307 W311 L312 S313 I341 L344	L281-I309 HydrophobicContact CD2-CD1 3.96Å; W303-I309 HydrophobicContact CE3-CD1 4.17Å; C305-I309 HydrophobicContact CB-CG2 4.21Å; N306-I309 WeakPolarHBondContact O-CG2 3.17Å; N306-I309 PolarHBondContact O-N 3.01Å; N306-I309 VanDerWaalsContact O-N 3.11Å; C307-I309 VanDerWaalsContact C-N 3.26Å; C307-I309 PolarHBondContact O-N 2.95Å; I309-W311 PolarHBondContact O-N 3.29Å; I309-L312 HydrophobicContact CD1-CD2 3.84Å; I309-L312 HydrophobicContact CG1-CD2 4.27Å; I309-L312 WeakPolarHBondContact O-CB 3.48Å; I309-L312 PolarHBondContact O-N 3.27Å; I309-L312 VanDerWaalsContact O-N 3.11Å; I309-S313 PolarHBondContact O-N 2.99Å; I309-I341 HydrophobicContact CG1-CD1 4.36Å; I309-I341 HydrophobicContact CG1-CG2 3.95Å; I309-L344 HydrophobicContact CG2-CD1 3.67Å
310	L	92.7	Very high	90.2	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-62.6	-42.1	-170.3	-81	172.2	0	0	0	113.3	C307 L312 S313 W314 Q346 F349	C307-L310 WeakPolarHBondContact O-CB 3.26Å; C307-L310 PolarHBondContact O-N 3.36Å; L310-L312 PolarHBondContact O-N 3.21Å; L310-S313 WeakPolarHBondContact O-CB 3.2Å; L310-S313 PolarHBondContact O-N 3.35Å; L310-W314 HydrophobicContact CB-CH2 4.16Å; L310-W314 HydrophobicContact CB-CZ2 4.03Å; L310-W314 HydrophobicContact CD1-CZ2 4.48Å; L310-W314 HydrophobicContact CD2-CZ2 4.32Å; L310-W314 VanDerWaalsContact O-CD2 3.31Å; L310-W314 VanDerWaalsContact O-CG 3.29Å; L310-W314 PolarHBondContact O-N 2.87Å; L310-Q346 HydrophobicContact CD1-CG 4.3Å; L310-F349 HydrophobicContact CD1-CD2 4.19Å; L310-F349 HydrophobicContact CD2-CD2 3.86Å; L310-F349 HydrophobicContact CD2-CE2 3.98Å; L310-F349 HydrophobicContact CG-CD2 4.11Å; L310-F349 HydrophobicContact CG-CE2 4.39Å
311	W	92.8	Very high	88.8	Confident	13 Å²	13	38.6 Å²	38.6	5%	0.049	20%	0.198	C	C	.	.	H	α-helix	trans	-58.6	-37.9	176.6	78.3	-93.6	0	0	0	111.5	L282 P283 H284 L286 F287 D308 I309 W314 W315	L282-W311 HydrophobicContact CB-CZ2 3.87Å; P283-W311 WeakPolarHBondContact O-CZ2 3.41Å; P283-W311 PolarHBondContact O-NE1 3.31Å; H284-W311 AromaticContact CD2-CD1 3.61Å; H284-W311 AromaticContact CD2-CG 3.79Å; L286-W311 HydrophobicContact CB-CH2 3.92Å; L286-W311 HydrophobicContact CB-CZ2 4.12Å; F287-W311 HydrophobicContact CB-CH2 4.46Å; F287-W311 HydrophobicContact CB-CZ3 4.24Å; F287-W311 AromaticContact CD2-CH2 3.57Å; F287-W311 HydrophobicContact CD2-CH2 3.57Å; F287-W311 AromaticContact CD2-CZ3 3.85Å; F287-W311 HydrophobicContact CD2-CZ3 3.85Å; F287-W311 AromaticContact CE2-CH2 3.98Å; F287-W311 HydrophobicContact CE2-CH2 3.98Å; F287-W311 HydrophobicContact CG-CH2 4.08Å; F287-W311 HydrophobicContact CG-CZ3 4.31Å; D308-W311 PolarHBondContact O-NE1 3.46Å; I309-W311 PolarHBondContact O-N 3.29Å; W311-W314 PolarHBondContact O-N 2.86Å; W311-W315 HydrophobicContact CE3-CB 4.41Å; W311-W315 HydrophobicContact CZ3-CB 4.43Å; W311-W315 WeakPolarHBondContact O-CB 3.33Å; W311-W315 PolarHBondContact O-N 3.48Å
312	L	92.7	Very high	87	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-73.3	-36.2	179.3	-179	66	0	0	0	112	L282 F287 L298 I309 L310 I316 I341	L282-L312 HydrophobicContact CD1-CD1 4.48Å; L282-L312 HydrophobicContact CD1-CD2 4.14Å; F287-L312 HydrophobicContact CD2-CD1 4.02Å; F287-L312 HydrophobicContact CE2-CD1 3.73Å; L298-L312 HydrophobicContact CD1-CD1 3.96Å; L298-L312 HydrophobicContact CD1-CD2 3.85Å; L298-L312 HydrophobicContact CD1-CG 4.38Å; I309-L312 HydrophobicContact CD1-CD2 3.84Å; I309-L312 HydrophobicContact CG1-CD2 4.27Å; I309-L312 WeakPolarHBondContact O-CB 3.48Å; I309-L312 PolarHBondContact O-N 3.27Å; I309-L312 VanDerWaalsContact O-N 3.11Å; L310-L312 PolarHBondContact O-N 3.21Å; L312-I316 HydrophobicContact CD1-CD1 4.13Å; L312-I316 HydrophobicContact CD1-CG1 4.32Å; L312-I316 HydrophobicContact CG-CD1 3.96Å; L312-I316 WeakPolarHBondContact O-CB 3.31Å; L312-I316 VanDerWaalsContact O-CG1 3.24Å; L312-I316 WeakPolarHBondContact O-CG1 3.4Å; L312-I316 PolarHBondContact O-N 2.95Å; L312-I341 HydrophobicContact CD2-CG2 4.45Å; L312-I341 HydrophobicContact CG-CG2 4.46Å
313	S	91.3	Very high	85.2	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-58.7	-49.3	170.5	177.9	0	0	0	0	110.6	I309 L310 I316 K317 I341 L344	I309-S313 PolarHBondContact O-N 2.99Å; L310-S313 WeakPolarHBondContact O-CB 3.2Å; L310-S313 PolarHBondContact O-N 3.35Å; S313-I316 PolarHBondContact O-N 3.32Å; S313-K317 VanDerWaalsContact O-CB 3.27Å; S313-K317 WeakPolarHBondContact O-CB 3.49Å; S313-K317 PolarHBondContact O-N 3.3Å; S313-I341 WeakPolarHBondContact CB-O 3.35Å; S313-I341 PolarHBondContact OG-O 3.37Å; S313-L344 PolarHBondContact OG-O 3.01Å
314	W	89.4	Confident	83.3	Confident	100 Å²	100	49.2 Å²	49.2	38%	0.379	26%	0.262	S	S	.	.	H	α-helix	trans	-63.1	-45.1	178.9	-56.6	-28	0	0	0	112	L310 W311 I316 K317 D318 S431	L310-W314 HydrophobicContact CB-CH2 4.16Å; L310-W314 HydrophobicContact CB-CZ2 4.03Å; L310-W314 HydrophobicContact CD1-CZ2 4.48Å; L310-W314 HydrophobicContact CD2-CZ2 4.32Å; L310-W314 VanDerWaalsContact O-CD2 3.31Å; L310-W314 VanDerWaalsContact O-CG 3.29Å; L310-W314 PolarHBondContact O-N 2.87Å; W311-W314 PolarHBondContact O-N 2.86Å; W314-I316 PolarHBondContact O-N 3.32Å; W314-K317 PolarHBondContact O-N 2.94Å; W314-D318 PolarHBondContact O-N 3.25Å; W314-S431 VanDerWaalsContact CH2-O 3.27Å; W314-S431 WeakPolarHBondContact CH2-O 3.23Å; W314-S431 WeakPolarHBondContact CZ3-O 3.49Å
315	W	89.6	Confident	81.5	Confident	33 Å²	33	47.1 Å²	47.1	13%	0.125	25%	0.252	C	S	.	.	H	α-helix	trans	-57.6	-46.8	175.7	-167.6	102	0	0	0	111.8	F287 L293 I296 W311 K317 D318 M319 A320	F287-W315 HydrophobicContact CB-CD2 4.46Å; F287-W315 HydrophobicContact CB-CZ2 4.37Å; L293-W315 HydrophobicContact CB-CZ2 4.32Å; L293-W315 HydrophobicContact CD2-CH2 4.45Å; L293-W315 HydrophobicContact CD2-CZ2 4.2Å; L293-W315 HydrophobicContact CG-CH2 4.37Å; L293-W315 HydrophobicContact CG-CZ2 4.36Å; L293-W315 WeakPolarHBondContact O-CH2 3.36Å; I296-W315 HydrophobicContact CD1-CD2 4.39Å; I296-W315 HydrophobicContact CD1-CE3 3.83Å; I296-W315 HydrophobicContact CD1-CH2 3.38Å; I296-W315 HydrophobicContact CD1-CZ2 3.91Å; I296-W315 HydrophobicContact CD1-CZ3 3.31Å; I296-W315 HydrophobicContact CG1-CH2 3.8Å; I296-W315 HydrophobicContact CG1-CZ3 3.8Å; W311-W315 HydrophobicContact CE3-CB 4.41Å; W311-W315 HydrophobicContact CZ3-CB 4.43Å; W311-W315 WeakPolarHBondContact O-CB 3.33Å; W311-W315 PolarHBondContact O-N 3.48Å; W315-K317 PolarHBondContact O-N 2.84Å; W315-D318 PolarHBondContact O-N 3.28Å; W315-M319 HydrophobicContact CD2-CB 4.06Å; W315-M319 HydrophobicContact CE3-CB 4.22Å; W315-M319 HydrophobicContact CH2-CB 3.97Å; W315-M319 HydrophobicContact CH2-CG 3.8Å; W315-M319 HydrophobicContact CZ2-CB 3.87Å; W315-M319 HydrophobicContact CZ2-CG 3.52Å; W315-M319 HydrophobicContact CZ3-CB 4.16Å; W315-M319 HydrophobicContact CZ3-CG 4.49Å; W315-M319 WeakPolarHBondContact O-CB 3.28Å; W315-M319 PolarHBondContact O-N 2.73Å; W315-A320 HydrophobicContact CZ3-CB 4.22Å
316	I	88	Confident	79.9	Confident	9 Å²	9	49.9 Å²	49.9	5%	0.046	27%	0.27	C	S	.	.	H	α-helix	trans	-63.1	-31.9	176.8	-72.3	169.3	0	0	0	111.7	L312 S313 W314 A320 A325 Y340 I341	L312-I316 HydrophobicContact CD1-CD1 4.13Å; L312-I316 HydrophobicContact CD1-CG1 4.32Å; L312-I316 HydrophobicContact CG-CD1 3.96Å; L312-I316 WeakPolarHBondContact O-CB 3.31Å; L312-I316 VanDerWaalsContact O-CG1 3.24Å; L312-I316 WeakPolarHBondContact O-CG1 3.4Å; L312-I316 PolarHBondContact O-N 2.95Å; S313-I316 PolarHBondContact O-N 3.32Å; W314-I316 PolarHBondContact O-N 3.32Å; I316-A320 WeakPolarHBondContact O-CB 3.3Å; I316-A325 HydrophobicContact CG1-CB 4.23Å; I316-A325 HydrophobicContact CG2-CB 3.94Å; I316-Y340 HydrophobicContact CG2-CE1 4.22Å; I316-Y340 WeakPolarHBondContact CG2-OH 3.44Å; I316-I341 HydrophobicContact CD1-CB 4.48Å; I316-I341 HydrophobicContact CD1-CG2 4.19Å
317	K	84.4	Confident	79.3	Confident	140 Å²	140	51 Å²	51	61%	0.609	28%	0.28	S	S	*	.	H	α-helix	trans	-82.6	-25.9	-174.9	-164.6	171.4	-170.3	168.6	0	113.8	S313 W314 W315	S313-K317 VanDerWaalsContact O-CB 3.27Å; S313-K317 WeakPolarHBondContact O-CB 3.49Å; S313-K317 PolarHBondContact O-N 3.3Å; W314-K317 PolarHBondContact O-N 2.94Å; W315-K317 PolarHBondContact O-N 2.84Å
318	D	82.7	Confident	79.2	Confident	148 Å²	148	49.6 Å²	49.6	79%	0.791	27%	0.272	S	S	*	.	H	α-helix	trans	-98.2	-47.7	180	-166	52.9	0	0	0	112	W314 W315	W314-D318 PolarHBondContact O-N 3.25Å; W315-D318 PolarHBondContact O-N 3.28Å
319	M	75.9	Confident	79.2	Confident	85 Å²	85	55 Å²	55	42%	0.419	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-25.3	-166.4	-162.2	65.4	172.4	0	0	114.5	W315 P321	W315-M319 HydrophobicContact CD2-CB 4.06Å; W315-M319 HydrophobicContact CE3-CB 4.22Å; W315-M319 HydrophobicContact CH2-CB 3.97Å; W315-M319 HydrophobicContact CH2-CG 3.8Å; W315-M319 HydrophobicContact CZ2-CB 3.87Å; W315-M319 HydrophobicContact CZ2-CG 3.52Å; W315-M319 HydrophobicContact CZ3-CB 4.16Å; W315-M319 HydrophobicContact CZ3-CG 4.49Å; W315-M319 WeakPolarHBondContact O-CB 3.28Å; W315-M319 PolarHBondContact O-N 2.73Å; M319-P321 WeakPolarHBondContact O-CD 3.23Å
320	A	66.1	Low	79.4	Confident	21 Å²	21	55.2 Å²	55.2	17%	0.174	29%	0.291	C	S	.	.	S	Bend	trans	-89.1	122	-174.4	0	0	0	0	0	112.6	W315 I316 A325	W315-A320 HydrophobicContact CZ3-CB 4.22Å; I316-A320 WeakPolarHBondContact O-CB 3.3Å; A320-A325 HydrophobicContact CB-CB 3.69Å
321	P	64.3	Low	79.6	Confident	71 Å²	71	58 Å²	58	46%	0.461	31%	0.306	S	S	.	.			trans	-54.3	143.4	165.7	-24.4	32.6	0	0	0	111	M319 N323 T324	M319-P321 WeakPolarHBondContact O-CD 3.23Å; P321-N323 PolarHBondContact O-N 3.26Å; P321-T324 HydrophobicContact CB-CG2 4.04Å; P321-T324 WeakPolarHBondContact CD-OG1 3.47Å; P321-T324 HydrophobicContact CG-CG2 4.19Å; P321-T324 PolarHBondContact O-N 3.26Å; P321-T324 PolarHBondContact O-OG1 3.1Å
322	S	58.9	Low	79.7	Confident	110 Å²	110	59.8 Å²	59.8	77%	0.769	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.5	-16.6	-173.2	61.3	0	0	0	0	116.3
323	N	59.4	Low	79.9	Confident	134 Å²	134	61.6 Å²	61.6	72%	0.717	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109	-1.6	-173.3	-56.9	-3.2	0	0	0	113.7	P321	P321-N323 PolarHBondContact O-N 3.26Å
324	T	56.5	Low	80.1	Confident	22 Å²	22	67 Å²	67	14%	0.135	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.2	-50.8	-169.1	58.6	0	0	0	0	114.1	R295 P321 C326	R295-T324 HydrophobicContact CG-CG2 3.91Å; P321-T324 HydrophobicContact CB-CG2 4.04Å; P321-T324 WeakPolarHBondContact CD-OG1 3.47Å; P321-T324 HydrophobicContact CG-CG2 4.19Å; P321-T324 PolarHBondContact O-N 3.26Å; P321-T324 PolarHBondContact O-OG1 3.1Å; T324-C326 PolarHBondContact O-N 2.89Å
325	A	58.3	Low	80.3	Confident	5 Å²	5	67.9 Å²	67.9	4%	0.041	38%	0.378	C	S	.	.	S	Bend	trans	-82.5	8.4	-179.7	0	0	0	0	0	114.6	I316 A320 Y340	I316-A325 HydrophobicContact CG1-CB 4.23Å; I316-A325 HydrophobicContact CG2-CB 3.94Å; A320-A325 HydrophobicContact CB-CB 3.69Å; A325-Y340 PolarHBondContact O-OH 3.37Å
326	C	62.9	Low	80.5	Confident	58 Å²	58	66.5 Å²	66.5	39%	0.392	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	151.3	-167.3	61.9	0	0	0	0	113.7	T324 A328	T324-C326 PolarHBondContact O-N 2.89Å; C326-A328 VanDerWaalsContact C-N 3.34Å; C326-A328 PolarHBondContact O-N 2.75Å
327	C	79.3	Confident	80.8	Confident	68 Å²	68	72.4 Å²	72.4	46%	0.459	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.6	11.4	177.6	-58.4	0	0	0	0	117.5	H299 R329	H299-C327 HydrophobicContact CB-CB 4.01Å; H299-C327 WeakPolarHBondContact CB-O 3.24Å; C327-R329 PolarHBondContact O-N 2.94Å
328	A	91.4	Very high	81.3	Confident	1 Å²	1	67.3 Å²	67.3	1%	0.008	39%	0.386	C	S	.	.			trans	-70	108.1	163.2	0	0	0	0	0	110.8	L298 C326 Y340 I341	L298-A328 HydrophobicContact CB-CB 3.94Å; C326-A328 VanDerWaalsContact C-N 3.34Å; C326-A328 PolarHBondContact O-N 2.75Å; A328-Y340 HydrophobicContact CB-CE2 4.35Å; A328-Y340 WeakPolarHBondContact O-CA 3.31Å; A328-Y340 WeakPolarHBondContact O-CD2 3.37Å; A328-I341 HydrophobicContact CB-CD1 4.24Å; A328-I341 PolarHBondContact O-N 3.16Å
329	R	94.1	Very high	81.7	Confident	137 Å²	137	65 Å²	65	52%	0.517	37%	0.366	S	S	.	.	B	Isolated β-bridge	trans	-124.8	146.4	-173.3	-66	176.7	-175.5	-91.9	3	112.9	C327 G338 R339	C327-R329 PolarHBondContact O-N 2.94Å; R329-G338 WeakPolarHBondContact CD-O 3.04Å; R329-G338 PolarHBondContact NH1-O 3.27Å; R329-R339 CarbonylContact C-O 3.59Å; R329-R339 WeakPolarHBondContact CA-O 3.4Å; R329-R339 WeakPolarHBondContact CB-O 3.37Å
330	C	96.3	Very high	82.5	Confident	4 Å²	4	63.2 Å²	63.2	3%	0.027	36%	0.355	C	S	.	.			trans	-63.6	137.7	173.9	-56.7	0	0	0	0	112	C305 L336 K337 G338 R339	C305-C330 HydrophobicContact CB-CB 3.88Å; C305-C330 WeakPolarHBondContact CB-SG 3.33Å; C305-C330 VanDerWaalsContact SG-CA 3.54Å; C305-C330 WeakPolarHBondContact SG-CB 3.43Å; C305-C330 CovalentContact SG-SG 2.03Å; C305-C330 PolarHBondContact SG-SG 3.1Å; C330-L336 HydrophobicContact CB-CB 4.32Å; C330-L336 WeakPolarHBondContact CB-O 3.26Å; C330-K337 WeakPolarHBondContact O-CA 3.43Å; C330-G338 PolarHBondContact O-N 2.8Å; C330-R339 PolarHBondContact N-O 2.82Å
331	N	97.1	Very high	83.7	Confident	59 Å²	59	62.2 Å²	62.2	32%	0.316	35%	0.346	S	S	.	.			trans	-102.7	-38.1	168.6	178	49	0	0	0	111.9	P302 W303 K337	P302-N331 HydrophobicContact CB-CB 4.43Å; W303-N331 PolarHBondContact O-N 3.37Å; N331-K337 WeakPolarHBondContact O-CD 3.29Å; N331-K337 WeakPolarHBondContact O-CG 3.2Å; N331-K337 WeakPolarHBondContact OD1-CE 3.43Å; N331-K337 PolarHBondContact OD1-NZ 3.15Å
332	T	96	Very high	84.8	Confident	50 Å²	50	59.3 Å²	59.3	31%	0.307	33%	0.329	S	S	.	.	B	Isolated β-bridge	trans	-130.6	160.8	172.4	52.4	0	0	0	0	110.2	W303 N304 C305	W303-T332 PolarHBondContact O-N 2.71Å; W303-T332 VanDerWaalsContact O-N 3.14Å; N304-T332 CarbonylContact C-O 3.54Å; N304-T332 WeakPolarHBondContact CA-OG1 3.42Å; N304-T332 WeakPolarHBondContact CB-OG1 3.08Å; N304-T332 WeakPolarHBondContact OD1-CB 3.39Å; N304-T332 PolarHBondContact OD1-OG1 3.12Å; C305-T332 PolarHBondContact N-O 3.24Å
333	P	96.1	Very high	86.2	Confident	39 Å²	39	60.1 Å²	60.1	25%	0.253	32%	0.321	S	S	.	.	S	Bend	cis	-67.9	164.2	-12.5	32.1	-37.4	0	0	0	112.3	C305 N335 L336 K337	C305-P333 WeakPolarHBondContact O-CD 3.48Å; P333-N335 VanDerWaalsContact C-N 3.26Å; P333-N335 WeakPolarHBondContact CB-OD1 3.37Å; P333-N335 VanDerWaalsContact CG-OD1 3.29Å; P333-N335 WeakPolarHBondContact CG-OD1 3.15Å; P333-N335 PolarHBondContact O-N 3.48Å; P333-N335 VanDerWaalsContact O-N 3.13Å; P333-L336 HydrophobicContact CG-CB 4.48Å; P333-L336 HydrophobicContact CG-CD1 4.2Å; P333-L336 HydrophobicContact CG-CG 4.28Å; P333-L336 PolarHBondContact O-N 3.28Å; P333-K337 PolarHBondContact O-N 3.22Å
334	P	94.9	Very high	87.7	Confident	113 Å²	113	53.9 Å²	53.9	73%	0.734	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-32.3	-171.3	-28	36.3	0	0	0	115.2	L336 K337	P334-L336 VanDerWaalsContact C-N 3.26Å; P334-L336 PolarHBondContact O-N 3.34Å; P334-K337 WeakPolarHBondContact O-CB 3.4Å; P334-K337 PolarHBondContact O-N 2.98Å
335	N	94.5	Very high	89.1	Confident	119 Å²	119	55.3 Å²	55.3	64%	0.636	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-15.4	177.5	60.6	-59.6	0	0	0	114.4	P333	P333-N335 VanDerWaalsContact C-N 3.26Å; P333-N335 WeakPolarHBondContact CB-OD1 3.37Å; P333-N335 VanDerWaalsContact CG-OD1 3.29Å; P333-N335 WeakPolarHBondContact CG-OD1 3.15Å; P333-N335 PolarHBondContact O-N 3.48Å; P333-N335 VanDerWaalsContact O-N 3.13Å
336	L	94.1	Very high	90.4	Very high	4 Å²	4	59.6 Å²	59.6	2%	0.021	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.2	-6.6	174	-60.6	-178.8	0	0	0	112.9	C305 C330 P333 P334 G338 R339 L344 Y348 F349	C305-L336 HydrophobicContact CB-CD1 3.97Å; C330-L336 HydrophobicContact CB-CB 4.32Å; C330-L336 WeakPolarHBondContact CB-O 3.26Å; P333-L336 HydrophobicContact CG-CB 4.48Å; P333-L336 HydrophobicContact CG-CD1 4.2Å; P333-L336 HydrophobicContact CG-CG 4.28Å; P333-L336 PolarHBondContact O-N 3.28Å; P334-L336 VanDerWaalsContact C-N 3.26Å; P334-L336 PolarHBondContact O-N 3.34Å; L336-G338 PolarHBondContact O-N 3.06Å; L336-R339 VanDerWaalsContact O-CB 3.28Å; L336-R339 WeakPolarHBondContact O-CB 3.27Å; L336-R339 WeakPolarHBondContact O-CG 3.46Å; L336-R339 PolarHBondContact O-N 3.5Å; L336-R339 VanDerWaalsContact O-N 3.07Å; L336-L344 HydrophobicContact CD1-CD2 4.39Å; L336-Y348 HydrophobicContact CD2-CD1 3.97Å; L336-Y348 HydrophobicContact CD2-CE1 4.43Å; L336-F349 HydrophobicContact CD1-CE1 3.56Å; L336-F349 HydrophobicContact CD1-CZ 3.58Å
337	K	94.9	Very high	91.6	Very high	133 Å²	133	63.8 Å²	63.8	58%	0.578	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	129.5	-174.9	-174.1	168.8	-170.9	164.6	0	111.9	C330 N331 P333 P334	C330-K337 WeakPolarHBondContact O-CA 3.43Å; N331-K337 WeakPolarHBondContact O-CD 3.29Å; N331-K337 WeakPolarHBondContact O-CG 3.2Å; N331-K337 WeakPolarHBondContact OD1-CE 3.43Å; N331-K337 PolarHBondContact OD1-NZ 3.15Å; P333-K337 PolarHBondContact O-N 3.22Å; P334-K337 WeakPolarHBondContact O-CB 3.4Å; P334-K337 PolarHBondContact O-N 2.98Å
338	G	92.8	Very high	92	Very high	33 Å²	33	65.7 Å²	65.7	34%	0.34	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.6	-15.5	-179	0	0	0	0	0	115.6	R329 C330 L336	R329-G338 WeakPolarHBondContact CD-O 3.04Å; R329-G338 PolarHBondContact NH1-O 3.27Å; C330-G338 PolarHBondContact O-N 2.8Å; L336-G338 PolarHBondContact O-N 3.06Å
339	R	92.6	Very high	91.9	Very high	100 Å²	100	67.1 Å²	67.1	38%	0.377	34%	0.336	S	S	.	.			trans	-65.1	148.8	173.7	-65.8	178	176.4	-117.7	4.5	111.4	R329 C330 L336 Y348	R329-R339 CarbonylContact C-O 3.59Å; R329-R339 WeakPolarHBondContact CA-O 3.4Å; R329-R339 WeakPolarHBondContact CB-O 3.37Å; C330-R339 PolarHBondContact N-O 2.82Å; L336-R339 VanDerWaalsContact O-CB 3.28Å; L336-R339 WeakPolarHBondContact O-CB 3.27Å; L336-R339 WeakPolarHBondContact O-CG 3.46Å; L336-R339 PolarHBondContact O-N 3.5Å; L336-R339 VanDerWaalsContact O-N 3.07Å; R339-Y348 VanDerWaalsContact NH1-CZ 3.33Å; R339-Y348 PolarHBondContact NH1-OH 3.26Å
340	Y	91.7	Very high	91.8	Very high	47 Å²	47	66.5 Å²	66.5	18%	0.184	35%	0.348	C	S	.	.	B	Isolated β-bridge	trans	-77.3	142.5	175	180	-114.9	0	0	0	110.7	I316 A325 A328 E343	I316-Y340 HydrophobicContact CG2-CE1 4.22Å; I316-Y340 WeakPolarHBondContact CG2-OH 3.44Å; A325-Y340 PolarHBondContact O-OH 3.37Å; A328-Y340 HydrophobicContact CB-CE2 4.35Å; A328-Y340 WeakPolarHBondContact O-CA 3.31Å; A328-Y340 WeakPolarHBondContact O-CD2 3.37Å; Y340-E343 HydrophobicContact CD1-CG 4.13Å; Y340-E343 PolarHBondContact O-N 2.78Å
341	I	92.5	Very high	91.6	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-67.6	-41.1	-173.2	-67.5	177.2	0	0	0	112	W303 I309 L312 S313 I316 A328 E343 L344	W303-I341 HydrophobicContact CB-CD1 3.9Å; W303-I341 HydrophobicContact CD2-CD1 4.07Å; W303-I341 HydrophobicContact CG-CD1 3.58Å; I309-I341 HydrophobicContact CG1-CD1 4.36Å; I309-I341 HydrophobicContact CG1-CG2 3.95Å; L312-I341 HydrophobicContact CD2-CG2 4.45Å; L312-I341 HydrophobicContact CG-CG2 4.46Å; S313-I341 WeakPolarHBondContact CB-O 3.35Å; S313-I341 PolarHBondContact OG-O 3.37Å; I316-I341 HydrophobicContact CD1-CB 4.48Å; I316-I341 HydrophobicContact CD1-CG2 4.19Å; A328-I341 HydrophobicContact CB-CD1 4.24Å; A328-I341 PolarHBondContact O-N 3.16Å; I341-E343 PolarHBondContact O-N 2.9Å; I341-E343 VanDerWaalsContact O-N 3.14Å; I341-L344 HydrophobicContact CG2-CD1 4.47Å; I341-L344 WeakPolarHBondContact O-CB 3.32Å; I341-L344 WeakPolarHBondContact O-CG 3.33Å; I341-L344 PolarHBondContact O-N 2.84Å; I341-L344 VanDerWaalsContact O-N 3.07Å
342	G	87.6	Confident	91.4	Very high	9 Å²	9	73.2 Å²	73.2	9%	0.093	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-70.5	-3.5	178.7	0	0	0	0	0	115.6
343	E	87.1	Confident	91.2	Very high	128 Å²	128	73.2 Å²	73.2	60%	0.598	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-90	-10	171	-77.6	161.3	-154.9	0	0	112.6	Y340 I341	Y340-E343 HydrophobicContact CD1-CG 4.13Å; Y340-E343 PolarHBondContact O-N 2.78Å; I341-E343 PolarHBondContact O-N 2.9Å; I341-E343 VanDerWaalsContact O-N 3.14Å
344	L	90.2	Very high	91.2	Very high	2 Å²	2	71.6 Å²	71.6	1%	0.01	37%	0.367	C	S	.	.			trans	-75.9	130.4	-178.5	-59.8	173.9	0	0	0	111.1	C305 I309 S313 L336 I341 F349	C305-L344 HydrophobicContact CB-CD1 3.89Å; I309-L344 HydrophobicContact CG2-CD1 3.67Å; S313-L344 PolarHBondContact OG-O 3.01Å; L336-L344 HydrophobicContact CD1-CD2 4.39Å; I341-L344 HydrophobicContact CG2-CD1 4.47Å; I341-L344 WeakPolarHBondContact O-CB 3.32Å; I341-L344 WeakPolarHBondContact O-CG 3.33Å; I341-L344 PolarHBondContact O-N 2.84Å; I341-L344 VanDerWaalsContact O-N 3.07Å; L344-F349 HydrophobicContact CB-CE2 4.44Å; L344-F349 HydrophobicContact CD1-CZ 4.39Å; L344-F349 HydrophobicContact CD2-CZ 4.48Å
345	D	86.6	Confident	91.2	Very high	52 Å²	52	70.2 Å²	70.2	28%	0.278	36%	0.356	S	S	.	.			trans	-108.8	176.8	168	71.9	19.4	0	0	0	111.5	N347 Y348 F349	D345-N347 VanDerWaalsContact C-N 3.25Å; D345-N347 PolarHBondContact O-N 3.47Å; D345-N347 WeakPolarHBondContact OD1-CA 3.17Å; D345-N347 VanDerWaalsContact OD1-CB 3.23Å; D345-N347 WeakPolarHBondContact OD1-CB 3.49Å; D345-N347 PolarHBondContact OD1-N 3Å; D345-N347 PolarHBondContact OD1-ND2 3Å; D345-N347 PolarHBondContact OD2-ND2 2.93Å; D345-Y348 WeakPolarHBondContact OD1-CD2 3.34Å; D345-Y348 WeakPolarHBondContact OD1-CE2 3.45Å; D345-Y348 PolarHBondContact OD1-N 3.47Å; D345-F349 WeakPolarHBondContact O-CD2 3.37Å
346	Q	86.6	Confident	91.3	Very high	95 Å²	95	65.9 Å²	65.9	44%	0.444	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-69.7	-20.7	177.9	-168.8	174.6	4.1	0	0	112.9	L310 Y348 F349	L310-Q346 HydrophobicContact CD1-CG 4.3Å; Q346-Y348 PolarHBondContact O-N 3.08Å; Q346-F349 PolarHBondContact O-N 3.44Å; Q346-F349 VanDerWaalsContact O-N 3.08Å
347	N	87.9	Confident	91.3	Very high	146 Å²	146	70.5 Å²	70.5	78%	0.781	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-69.5	-20.1	-175.6	-53	-59.7	0	0	0	112.5	D345 F349	D345-N347 VanDerWaalsContact C-N 3.25Å; D345-N347 PolarHBondContact O-N 3.47Å; D345-N347 WeakPolarHBondContact OD1-CA 3.17Å; D345-N347 VanDerWaalsContact OD1-CB 3.23Å; D345-N347 WeakPolarHBondContact OD1-CB 3.49Å; D345-N347 PolarHBondContact OD1-N 3Å; D345-N347 PolarHBondContact OD1-ND2 3Å; D345-N347 PolarHBondContact OD2-ND2 2.93Å; N347-F349 PolarHBondContact O-N 3.45Å
348	Y	86.5	Confident	91.4	Very high	108 Å²	108	67 Å²	67	42%	0.424	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-71.7	-11.1	172.2	-68.6	-78.9	0	0	0	114.2	L336 R339 D345 Q346	L336-Y348 HydrophobicContact CD2-CD1 3.97Å; L336-Y348 HydrophobicContact CD2-CE1 4.43Å; R339-Y348 VanDerWaalsContact NH1-CZ 3.33Å; R339-Y348 PolarHBondContact NH1-OH 3.26Å; D345-Y348 WeakPolarHBondContact OD1-CD2 3.34Å; D345-Y348 WeakPolarHBondContact OD1-CE2 3.45Å; D345-Y348 PolarHBondContact OD1-N 3.47Å; Q346-Y348 PolarHBondContact O-N 3.08Å
349	F	89.8	Confident	91.6	Very high	31 Å²	31	68.9 Å²	68.9	14%	0.136	35%	0.353	C	S	.	.			trans	-140.8	138.4	-167.3	-48.9	-75.9	0	0	0	114.1	C305 L310 L336 L344 D345 Q346 N347 C351	C305-F349 VanDerWaalsContact O-CE1 3.26Å; C305-F349 WeakPolarHBondContact O-CE1 3.5Å; L310-F349 HydrophobicContact CD1-CD2 4.19Å; L310-F349 HydrophobicContact CD2-CD2 3.86Å; L310-F349 HydrophobicContact CD2-CE2 3.98Å; L310-F349 HydrophobicContact CG-CD2 4.11Å; L310-F349 HydrophobicContact CG-CE2 4.39Å; L336-F349 HydrophobicContact CD1-CE1 3.56Å; L336-F349 HydrophobicContact CD1-CZ 3.58Å; L344-F349 HydrophobicContact CB-CE2 4.44Å; L344-F349 HydrophobicContact CD1-CZ 4.39Å; L344-F349 HydrophobicContact CD2-CZ 4.48Å; D345-F349 WeakPolarHBondContact O-CD2 3.37Å; Q346-F349 PolarHBondContact O-N 3.44Å; Q346-F349 VanDerWaalsContact O-N 3.08Å; N347-F349 PolarHBondContact O-N 3.45Å; F349-C351 WeakPolarHBondContact CB-SG 3.37Å
350	T	91.7	Very high	91.8	Very high	124 Å²	124	64.9 Å²	64.9	76%	0.761	34%	0.339	S	S	*	.			trans	-96.1	98.3	169.7	40.5	0	0	0	0	110.2
351	C	92	Very high	92.1	Very high	21 Å²	21	66.1 Å²	66.1	14%	0.142	36%	0.359	C	S	.	.			trans	-114.5	150.5	-170.7	-52.6	0	0	0	0	112.5	C307 F349 V432	C307-C351 VanDerWaalsContact CA-SG 3.55Å; C307-C351 HydrophobicContact CB-CB 3.76Å; C307-C351 WeakPolarHBondContact CB-SG 3.41Å; C307-C351 WeakPolarHBondContact SG-CA 3.39Å; C307-C351 WeakPolarHBondContact SG-CB 3.44Å; C307-C351 CovalentContact SG-SG 2.03Å; C307-C351 PolarHBondContact SG-SG 3.43Å; F349-C351 WeakPolarHBondContact CB-SG 3.37Å; C351-V432 HydrophobicContact CB-CG2 3.37Å
352	Y	93	Very high	92.3	Very high	184 Å²	184	71.4 Å²	71.4	72%	0.722	39%	0.388	S	S	*	.			trans	-128.8	161.4	-176.4	-58	-85.5	0	0	0	111.4	N430	Y352-N430 PolarHBondContact O-ND2 3.32Å
353	A	93.1	Very high	92.7	Very high	50 Å²	50	73.7 Å²	73.7	41%	0.413	40%	0.397	S	S	.	.			trans	-58.5	154.8	170.9	0	0	0	0	0	111.6
354	P	95	Very high	93.1	Very high	4 Å²	4	73.5 Å²	73.5	3%	0.026	40%	0.401	C	S	.	.			trans	-71.5	145.7	-174.2	29.7	-33.6	0	0	0	111.6	T382 V428 N430 G433 T435	P354-T382 HydrophobicContact CB-CG2 3.76Å; P354-V428 HydrophobicContact CB-CG1 3.83Å; P354-V428 HydrophobicContact CG-CB 4.44Å; P354-V428 HydrophobicContact CG-CG1 4.11Å; P354-V428 WeakPolarHBondContact CG-O 3.28Å; P354-N430 HydrophobicContact CB-CB 4.4Å; P354-G433 WeakPolarHBondContact CD-O 3.35Å; P354-T435 VanDerWaalsContact O-CB 3.26Å; P354-T435 WeakPolarHBondContact O-CB 3.44Å; P354-T435 PolarHBondContact O-OG1 2.97Å
355	V	95.1	Very high	93.3	Very high	85 Å²	85	74.1 Å²	74.1	52%	0.515	40%	0.404	S	S	.	.			trans	-105.9	130.4	179.5	179.8	0	0	0	0	109.6	A377 S378	V355-A377 CarbonylContact O-C 3.46Å; V355-A377 WeakPolarHBondContact O-CA 3.34Å; V355-S378 PolarHBondContact O-N 3.1Å
356	I	95.9	Very high	93.6	Very high	28 Å²	28	74.1 Å²	74.1	14%	0.144	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	117.3	170.6	-55.3	177.8	0	0	0	107.2	P359 R376 V428 T435 A437	I356-P359 HydrophobicContact CG2-CB 3.91Å; I356-R376 CarbonylContact C-O 3.54Å; I356-V428 HydrophobicContact CD1-CG2 3.93Å; I356-V428 HydrophobicContact CG1-CB 4.33Å; I356-V428 HydrophobicContact CG1-CG2 3.83Å; I356-T435 HydrophobicContact CD1-CG2 4.02Å; I356-T435 HydrophobicContact CG1-CG2 4.09Å; I356-A437 HydrophobicContact CD1-CB 3.72Å
357	V	95.6	Very high	94	Very high	101 Å²	101	72.9 Å²	72.9	61%	0.612	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90	-41.5	-174.7	178.9	0	0	0	0	111.4	R376	V357-R376 PolarHBondContact N-O 3.17Å
358	E	95.9	Very high	94.1	Very high	60 Å²	60	68.2 Å²	68.2	28%	0.28	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	90.6	173.1	-165.2	172.5	-171.7	0	0	107.1	K374 C375 R376	E358-K374 VanDerWaalsContact CD-CD 3.41Å; E358-K374 HydrophobicContact CG-CB 4.43Å; E358-K374 HydrophobicContact CG-CD 4.13Å; E358-K374 WeakPolarHBondContact OE1-CD 3.36Å; E358-K374 WeakPolarHBondContact OE1-CE 3.45Å; E358-K374 IonicContact OE1-NZ 2.92Å; E358-K374 PolarHBondContact OE1-NZ 3.05Å; E358-C375 WeakPolarHBondContact O-CA 3.37Å; E358-R376 HydrophobicContact CB-CB 3.96Å; E358-R376 HydrophobicContact CB-CG 4.22Å; E358-R376 PolarHBondContact N-O 3.31Å; E358-R376 PolarHBondContact O-N 3.3Å; E358-R376 WeakPolarHBondContact OE2-CD 3.41Å; E358-R376 IonicContact OE2-CZ 3.84Å; E358-R376 IonicContact OE2-NE 3.89Å; E358-R376 IonicContact OE2-NH1 3.16Å; E358-R376 PolarHBondContact OE2-NH1 3.29Å
359	P	96.4	Very high	94.4	Very high	72 Å²	72	68.1 Å²	68.1	47%	0.468	39%	0.392	S	S	.	.			trans	-73.1	159.3	176.1	31.6	-35	0	0	0	110.9	I356 K374 A437	I356-P359 HydrophobicContact CG2-CB 3.91Å; P359-K374 CarbonylContact C-O 3.3Å; P359-A437 HydrophobicContact CB-CB 4.02Å
360	P	97.5	Very high	94.7	Very high	15 Å²	15	69.9 Å²	69.9	10%	0.097	41%	0.412	C	S	.	.			trans	-69.2	148.4	176.8	29.6	-35.3	0	0	0	111.1	L373 K374 W386 A437 A439	P360-L373 HydrophobicContact CB-CB 4.33Å; P360-K374 WeakPolarHBondContact CA-O 3.1Å; P360-K374 VanDerWaalsContact CB-O 3.25Å; P360-K374 WeakPolarHBondContact CB-O 3.36Å; P360-K374 VanDerWaalsContact CD-O 3.31Å; P360-K374 WeakPolarHBondContact CD-O 3.29Å; P360-W386 HydrophobicContact CB-CH2 3.86Å; P360-W386 HydrophobicContact CG-CH2 3.89Å; P360-W386 HydrophobicContact CG-CZ3 4.48Å; P360-A437 HydrophobicContact CG-CB 4.45Å; P360-A439 HydrophobicContact CB-CB 3.68Å; P360-A439 HydrophobicContact CG-CB 3.97Å
361	A	97.2	Very high	94.8	Very high	73 Å²	73	64.3 Å²	64.3	60%	0.603	38%	0.378	S	S	*	.			trans	-112.7	154.7	172.9	0	0	0	0	0	109.8
362	D	97.3	Very high	95	Very high	112 Å²	112	68.1 Å²	68.1	60%	0.599	39%	0.394	S	S	*	.			trans	-61.7	137.7	175.8	-58.2	-62.2	0	0	0	111.3	T440	D362-T440 WeakPolarHBondContact CA-O 3.42Å; D362-T440 WeakPolarHBondContact OD1-CB 3.41Å; D362-T440 PolarHBondContact OD1-N 3.38Å; D362-T440 PolarHBondContact OD1-OG1 2.8Å
363	L	95.9	Very high	95.2	Very high	56 Å²	56	59.5 Å²	59.5	29%	0.293	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	120.7	-171.4	-177	60.5	0	0	0	111.8	A371 L373 T440 L441 N442	L363-A371 HydrophobicContact CD2-CB 3.86Å; L363-L373 HydrophobicContact CB-CD2 4.08Å; L363-L373 HydrophobicContact CD2-CD2 4.32Å; L363-T440 PolarHBondContact N-O 3.11Å; L363-L441 HydrophobicContact CB-CD1 4.09Å; L363-L441 HydrophobicContact CD2-CD1 4.06Å; L363-L441 HydrophobicContact CG-CD1 4.16Å; L363-N442 PolarHBondContact O-N 2.03Å
364	N	95.4	Very high	95.4	Very high	124 Å²	124	60.8 Å²	60.8	66%	0.663	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.4	128	166.5	-62.8	-52.1	0	0	0	109.2	N442	N364-N442 WeakPolarHBondContact CA-O 3.2Å; N364-N442 WeakPolarHBondContact OD1-CB 3.33Å; N364-N442 PolarHBondContact OD1-ND2 2.94Å
365	V	94.4	Very high	95.5	Very high	15 Å²	15	60.6 Å²	60.6	9%	0.091	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	149.5	-179.2	63.9	0	0	0	0	110.5	M369 A371 V416 L441 N442 V443 T444	V365-M369 HydrophobicContact CG2-CB 3.73Å; V365-A371 HydrophobicContact CG2-CB 4.47Å; V365-V416 HydrophobicContact CG1-CB 4.38Å; V365-V416 HydrophobicContact CG1-CG1 3.94Å; V365-V416 HydrophobicContact CG1-CG2 4.39Å; V365-L441 HydrophobicContact CG1-CD1 3.83Å; V365-N442 PolarHBondContact N-O 2.82Å; V365-V443 HydrophobicContact CG1-CG2 4.13Å; V365-V443 CarbonylContact O-C 3.58Å; V365-V443 VanDerWaalsContact O-CA 3.3Å; V365-V443 WeakPolarHBondContact O-CA 3.43Å; V365-T444 PolarHBondContact O-N 2.81Å; V365-T444 PolarHBondContact O-OG1 2.84Å
366	T	94.3	Very high	95.5	Very high	52 Å²	52	61.4 Å²	61.4	32%	0.319	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	144.4	171.4	60.7	0	0	0	0	110.8	M369 T444	T366-M369 WeakPolarHBondContact O-CB 3.32Å; T366-M369 PolarHBondContact O-N 3.11Å; T366-M369 VanDerWaalsContact OG1-CE 3.27Å; T366-M369 WeakPolarHBondContact OG1-CE 3.44Å; T366-M369 WeakPolarHBondContact OG1-CG 3.44Å; T366-M369 PolarHBondContact OG1-SD 2.88Å; T366-T444 CarbonylContact C-O 3.29Å; T366-T444 WeakPolarHBondContact CA-O 3.39Å; T366-T444 WeakPolarHBondContact CG2-OG1 3.45Å
367	E	93.3	Very high	95.4	Very high	70 Å²	70	60.9 Å²	60.9	33%	0.327	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.3	138.5	170.5	179.4	160.5	-114.4	0	0	112.1	V416 T417 V418 V443 T444	E367-V416 WeakPolarHBondContact CA-O 3.34Å; E367-T417 WeakPolarHBondContact OE1-CA 3.49Å; E367-V418 HydrophobicContact CB-CG2 4.39Å; E367-V418 PolarHBondContact OE1-N 3.19Å; E367-V443 HydrophobicContact CB-CG1 4.18Å; E367-T444 PolarHBondContact N-O 3.43Å
368	G	90.8	Very high	95.1	Very high	48 Å²	48	59.5 Å²	59.5	50%	0.495	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.5	-17.9	-175.4	0	0	0	0	0	115.4	N415 V416	G368-N415 VanDerWaalsContact CA-OD1 3.29Å; G368-N415 WeakPolarHBondContact CA-OD1 3.5Å; G368-V416 PolarHBondContact N-O 2.82Å
369	M	93.4	Very high	94.8	Very high	105 Å²	105	58.4 Å²	58.4	52%	0.517	34%	0.342	S	S	.	.	S	Bend	trans	-82	163.5	174.8	-67.9	-172.5	-180	0	0	112.5	V365 T366 V416	V365-M369 HydrophobicContact CG2-CB 3.73Å; T366-M369 WeakPolarHBondContact O-CB 3.32Å; T366-M369 PolarHBondContact O-N 3.11Å; T366-M369 VanDerWaalsContact OG1-CE 3.27Å; T366-M369 WeakPolarHBondContact OG1-CE 3.44Å; T366-M369 WeakPolarHBondContact OG1-CG 3.44Å; T366-M369 PolarHBondContact OG1-SD 2.88Å; M369-V416 WeakPolarHBondContact O-CG2 3.16Å; M369-V416 PolarHBondContact O-N 2.97Å
370	A	94.6	Very high	94.4	Very high	68 Å²	68	59.1 Å²	59.1	56%	0.562	35%	0.349	S	S	*	.			trans	-84.3	154.4	166.3	0	0	0	0	0	111	F413	A370-F413 WeakPolarHBondContact CA-O 3.34Å; A370-F413 WeakPolarHBondContact CB-O 3.2Å
371	A	95.3	Very high	94	Very high	7 Å²	7	59.6 Å²	59.6	6%	0.058	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	152.3	179	0	0	0	0	0	112.3	L363 V365 F413 V416 L441	L363-A371 HydrophobicContact CD2-CB 3.86Å; V365-A371 HydrophobicContact CG2-CB 4.47Å; A371-F413 HydrophobicContact CB-CB 4.28Å; A371-F413 HydrophobicContact CB-CD2 4.31Å; A371-F413 PolarHBondContact N-O 2.79Å; A371-F413 VanDerWaalsContact N-O 3.11Å; A371-F413 PolarHBondContact O-N 2.84Å; A371-V416 HydrophobicContact CB-CG2 3.59Å; A371-L441 HydrophobicContact CB-CD1 4.43Å
372	E	96.1	Very high	93.9	Very high	102 Å²	102	56.1 Å²	56.1	48%	0.477	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	123.6	177.8	-66.1	-170.9	151.6	0	0	110.9	T410 L411 N412	E372-T410 HydrophobicContact CB-CG2 3.96Å; E372-T410 HydrophobicContact CG-CG2 4.38Å; E372-L411 WeakPolarHBondContact CA-O 3.41Å; E372-N412 HydrophobicContact CG-CB 4.49Å
373	L	97.3	Very high	93.7	Very high	2 Å²	2	51.7 Å²	51.7	1%	0.01	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	103.6	167.5	-60.4	179.4	0	0	0	108.5	P360 L363 W386 T410 L411 F413 Y424	P360-L373 HydrophobicContact CB-CB 4.33Å; L363-L373 HydrophobicContact CB-CD2 4.08Å; L363-L373 HydrophobicContact CD2-CD2 4.32Å; L373-W386 HydrophobicContact CB-CH2 3.69Å; L373-W386 HydrophobicContact CB-CZ2 4.21Å; L373-W386 HydrophobicContact CB-CZ3 4.36Å; L373-W386 HydrophobicContact CD1-CH2 4.5Å; L373-W386 HydrophobicContact CD1-CZ3 4.38Å; L373-W386 VanDerWaalsContact O-CZ2 3.23Å; L373-W386 WeakPolarHBondContact O-CZ2 3.29Å; L373-T410 WeakPolarHBondContact O-CA 3.39Å; L373-L411 HydrophobicContact CB-CB 4.38Å; L373-L411 PolarHBondContact N-O 3.23Å; L373-L411 PolarHBondContact O-N 3.36Å; L373-F413 HydrophobicContact CD1-CE2 4.45Å; L373-F413 HydrophobicContact CG-CE2 4.5Å; L373-Y424 HydrophobicContact CD1-CD2 4.09Å; L373-Y424 HydrophobicContact CD1-CG 3.97Å
374	K	96.9	Very high	93.7	Very high	78 Å²	78	49.2 Å²	49.2	34%	0.339	29%	0.286	S	S	.	.			trans	-70.9	142.4	-177	-58	-175.1	-166.3	177.5	0	111.7	E358 P359 P360 T410	E358-K374 VanDerWaalsContact CD-CD 3.41Å; E358-K374 HydrophobicContact CG-CB 4.43Å; E358-K374 HydrophobicContact CG-CD 4.13Å; E358-K374 WeakPolarHBondContact OE1-CD 3.36Å; E358-K374 WeakPolarHBondContact OE1-CE 3.45Å; E358-K374 IonicContact OE1-NZ 2.92Å; E358-K374 PolarHBondContact OE1-NZ 3.05Å; P359-K374 CarbonylContact C-O 3.3Å; P360-K374 WeakPolarHBondContact CA-O 3.1Å; P360-K374 VanDerWaalsContact CB-O 3.25Å; P360-K374 WeakPolarHBondContact CB-O 3.36Å; P360-K374 VanDerWaalsContact CD-O 3.31Å; P360-K374 WeakPolarHBondContact CD-O 3.29Å; K374-T410 HydrophobicContact CG-CG2 4.28Å
375	C	96.7	Very high	93.7	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	26%	0.262	C	S	.	.			trans	-148.8	91.2	167	-175.1	0	0	0	0	109.9	E358 W386 G409 C426	E358-C375 WeakPolarHBondContact O-CA 3.37Å; C375-W386 HydrophobicContact CB-CH2 4.32Å; C375-W386 HydrophobicContact CB-CZ2 3.51Å; C375-G409 CarbonylContact O-C 3.47Å; C375-G409 WeakPolarHBondContact O-CA 3.41Å; C375-C426 HydrophobicContact CB-CB 3.65Å; C375-C426 WeakPolarHBondContact CB-SG 3.33Å; C375-C426 WeakPolarHBondContact SG-CB 3.36Å; C375-C426 CovalentContact SG-SG 2.03Å; C375-C426 PolarHBondContact SG-SG 3.03Å
376	R	95.1	Very high	93.8	Very high	101 Å²	101	43.6 Å²	43.6	38%	0.381	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	122.1	-178.1	-62.3	-172.2	171.7	145.4	-8.3	111.2	I356 V357 E358 D408	I356-R376 CarbonylContact C-O 3.54Å; V357-R376 PolarHBondContact N-O 3.17Å; E358-R376 HydrophobicContact CB-CB 3.96Å; E358-R376 HydrophobicContact CB-CG 4.22Å; E358-R376 PolarHBondContact N-O 3.31Å; E358-R376 PolarHBondContact O-N 3.3Å; E358-R376 WeakPolarHBondContact OE2-CD 3.41Å; E358-R376 IonicContact OE2-CZ 3.84Å; E358-R376 IonicContact OE2-NE 3.89Å; E358-R376 IonicContact OE2-NH1 3.16Å; E358-R376 PolarHBondContact OE2-NH1 3.29Å; R376-D408 IonicContact CZ-OD2 2.88Å; R376-D408 IonicContact NE-OD2 3.6Å; R376-D408 PolarHBondContact NE-OD2 2.89Å; R376-D408 IonicContact NH2-OD2 2.67Å; R376-D408 PolarHBondContact NH2-OD2 3.32Å
377	A	93.9	Very high	93.9	Very high	17 Å²	17	43.7 Å²	43.7	14%	0.14	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	159.1	174.1	0	0	0	0	0	112.3	V355 T379 T382 V428	V355-A377 CarbonylContact O-C 3.46Å; V355-A377 WeakPolarHBondContact O-CA 3.34Å; A377-T379 PolarHBondContact O-N 3.23Å; A377-T382 HydrophobicContact CB-CG2 4.12Å; A377-T382 WeakPolarHBondContact CB-OG1 3.5Å; A377-V428 HydrophobicContact CB-CG1 3.67Å
378	S	90.2	Very high	93.9	Very high	73 Å²	73	40.9 Å²	40.9	51%	0.51	24%	0.243	S	C	.	.	S	Bend	trans	-65.1	-20.1	179.1	57.5	0	0	0	0	115.1	V355	V355-S378 PolarHBondContact O-N 3.1Å
379	T	88.9	Confident	94.1	Very high	37 Å²	37	41.1 Å²	41.1	23%	0.227	24%	0.236	C	C	.	.	S	Bend	trans	-138.1	139	168.7	176.8	0	0	0	0	110.1	A377 L381 T382	A377-T379 PolarHBondContact O-N 3.23Å; T379-L381 HydrophobicContact CG2-CB 4.5Å; T379-L381 PolarHBondContact O-N 3.27Å; T379-L381 PolarHBondContact OG1-N 2.91Å; T379-T382 HydrophobicContact CG2-CG2 3.83Å; T379-T382 PolarHBondContact O-N 3.4Å; T379-T382 PolarHBondContact O-OG1 3.04Å
380	S	88	Confident	94	Very high	87 Å²	87	42.8 Å²	42.8	61%	0.608	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-14	176.9	50.7	0	0	0	0	113.5	R260	R260-S380 PolarHBondContact NE-O 3.45Å; R260-S380 VanDerWaalsContact NE-O 3.1Å
381	L	90	Very high	93.9	Very high	25 Å²	25	42 Å²	42	13%	0.131	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-14.4	179.2	-61.1	165.8	0	0	0	113.4	L281 P283 H284 D308 T379	L281-L381 HydrophobicContact CB-CD1 3.55Å; L281-L381 HydrophobicContact CB-CD2 3.87Å; L281-L381 HydrophobicContact CB-CG 4.39Å; L281-L381 HydrophobicContact CD1-CD1 3.3Å; L281-L381 HydrophobicContact CG-CD1 3.92Å; P283-L381 CarbonylContact C-O 3.27Å; P283-L381 WeakPolarHBondContact CA-O 3.48Å; H284-L381 PolarHBondContact N-O 3.43Å; D308-L381 HydrophobicContact CB-CB 4.5Å; D308-L381 HydrophobicContact CB-CD1 3.98Å; T379-L381 HydrophobicContact CG2-CB 4.5Å; T379-L381 PolarHBondContact O-N 3.27Å; T379-L381 PolarHBondContact OG1-N 2.91Å
382	T	93.3	Very high	93.8	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	26%	0.261	C	S	.	.	S	Bend	trans	-58.3	141.6	168.5	48.6	0	0	0	0	110.8	R260 P354 A377 T379 V428 S429 N430	R260-T382 PolarHBondContact NE-O 2.91Å; R260-T382 PolarHBondContact NH2-O 3.32Å; R260-T382 PolarHBondContact NH2-OG1 2.91Å; P354-T382 HydrophobicContact CB-CG2 3.76Å; A377-T382 HydrophobicContact CB-CG2 4.12Å; A377-T382 WeakPolarHBondContact CB-OG1 3.5Å; T379-T382 HydrophobicContact CG2-CG2 3.83Å; T379-T382 PolarHBondContact O-N 3.4Å; T379-T382 PolarHBondContact O-OG1 3.04Å; T382-V428 HydrophobicContact CG2-CG1 3.76Å; T382-S429 WeakPolarHBondContact CA-O 3.18Å; T382-S429 WeakPolarHBondContact CB-O 3.33Å; T382-N430 HydrophobicContact CG2-CB 4.37Å
383	S	93.8	Very high	93.7	Very high	19 Å²	19	44.1 Å²	44.1	13%	0.133	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	136.2	163.4	34.4	0	0	0	0	109.1	H284 V428 S429	H284-S383 PolarHBondContact ND1-OG 3.17Å; S383-V428 WeakPolarHBondContact O-CA 3.28Å; S383-S429 PolarHBondContact N-O 2.93Å; S383-S429 VanDerWaalsContact N-O 3.07Å; S383-S429 PolarHBondContact O-N 3.07Å; S383-S429 PolarHBondContact OG-O 2.86Å; S383-S429 PolarHBondContact OG-OG 3.37Å
384	V	95.5	Very high	93.4	Very high	4 Å²	4	44 Å²	44	2%	0.024	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	128.3	178.7	179.3	0	0	0	0	108.5	R260 V428	R260-V384 VanDerWaalsContact CZ-CG2 3.44Å; R260-V384 VanDerWaalsContact NH2-CG2 3.29Å; V384-V428 HydrophobicContact CG2-CG1 4.31Å; V384-V428 HydrophobicContact CG2-CG2 4.18Å
385	S	95.5	Very high	93.3	Very high	21 Å²	21	42 Å²	42	15%	0.147	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	150.7	178.3	62	0	0	0	0	110.6	M394 M427	S385-M394 CarbonylContact C-O 3.55Å; S385-M394 WeakPolarHBondContact CA-O 3.49Å; S385-M427 PolarHBondContact N-O 2.82Å; S385-M427 PolarHBondContact O-N 3.49Å; S385-M427 PolarHBondContact OG-O 3.29Å
386	W	96.5	Very high	93	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	125	-179.3	-82.5	93	0	0	0	110.5	P360 L373 C375 V393 M394 V405 G409 L411 T425 C426	P360-W386 HydrophobicContact CB-CH2 3.86Å; P360-W386 HydrophobicContact CG-CH2 3.89Å; P360-W386 HydrophobicContact CG-CZ3 4.48Å; L373-W386 HydrophobicContact CB-CH2 3.69Å; L373-W386 HydrophobicContact CB-CZ2 4.21Å; L373-W386 HydrophobicContact CB-CZ3 4.36Å; L373-W386 HydrophobicContact CD1-CH2 4.5Å; L373-W386 HydrophobicContact CD1-CZ3 4.38Å; L373-W386 VanDerWaalsContact O-CZ2 3.23Å; L373-W386 WeakPolarHBondContact O-CZ2 3.29Å; C375-W386 HydrophobicContact CB-CH2 4.32Å; C375-W386 HydrophobicContact CB-CZ2 3.51Å; W386-V393 CarbonylContact O-C 3.53Å; W386-V393 WeakPolarHBondContact O-CA 3.5Å; W386-M394 HydrophobicContact CB-CB 4.41Å; W386-M394 PolarHBondContact N-O 2.99Å; W386-M394 PolarHBondContact O-N 3.17Å; W386-V405 HydrophobicContact CB-CG2 4.42Å; W386-V405 HydrophobicContact CG-CG2 4.36Å; W386-G409 PolarHBondContact NE1-O 3.01Å; W386-L411 HydrophobicContact CB-CD1 4.29Å; W386-L411 HydrophobicContact CD2-CB 3.9Å; W386-L411 HydrophobicContact CD2-CD2 4.07Å; W386-L411 HydrophobicContact CD2-CG 4.44Å; W386-L411 HydrophobicContact CE3-CB 4.49Å; W386-L411 HydrophobicContact CE3-CD2 4.08Å; W386-L411 HydrophobicContact CG-CB 4.16Å; W386-L411 HydrophobicContact CG-CD1 4.16Å; W386-L411 HydrophobicContact CG-CD2 4.3Å; W386-L411 HydrophobicContact CG-CG 4.46Å; W386-L411 HydrophobicContact CH2-CB 4.49Å; W386-L411 HydrophobicContact CZ2-CB 3.93Å; W386-T425 WeakPolarHBondContact CA-O 3.48Å; W386-C426 HydrophobicContact CD2-CB 4.05Å; W386-C426 HydrophobicContact CE3-CB 4.06Å; W386-C426 HydrophobicContact CH2-CB 3.87Å; W386-C426 HydrophobicContact CZ2-CB 3.81Å; W386-C426 HydrophobicContact CZ3-CB 3.96Å
387	I	96.7	Very high	92.6	Very high	53 Å²	53	39.3 Å²	39.3	27%	0.272	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	116.2	172.1	-52.3	174.8	0	0	0	107.3	V393 Y424 T425 M427	I387-V393 HydrophobicContact CG1-CG2 4.5Å; I387-Y424 WeakPolarHBondContact O-CA 3.43Å; I387-T425 PolarHBondContact N-O 2.91Å; I387-T425 PolarHBondContact O-N 3.3Å; I387-M427 HydrophobicContact CD1-CE 4.06Å
388	T	94.2	Very high	92.2	Very high	11 Å²	11	40.1 Å²	40.1	7%	0.067	26%	0.258	C	S	.	.			trans	-75.4	161.7	176	58.8	0	0	0	0	111.8	N390 G391 T392 M394 Y424	T388-N390 PolarHBondContact O-N 2.67Å; T388-N390 VanDerWaalsContact O-N 3.1Å; T388-G391 PolarHBondContact O-N 3.07Å; T388-T392 WeakPolarHBondContact CB-O 3.49Å; T388-T392 PolarHBondContact N-O 3.11Å; T388-T392 WeakPolarHBondContact OG1-CA 3.4Å; T388-T392 PolarHBondContact OG1-N 3Å; T388-T392 VanDerWaalsContact OG1-N 3.08Å; T388-T392 PolarHBondContact OG1-O 2.88Å; T388-T392 PolarHBondContact OG1-OG1 3.25Å; T388-M394 HydrophobicContact CG2-CG 4.29Å; T388-M394 HydrophobicContact CG2-SD 3.71Å; T388-Y424 HydrophobicContact CG2-CD1 4.34Å; T388-Y424 HydrophobicContact CG2-CE1 3.95Å
389	P	94	Very high	91.3	Very high	53 Å²	53	41.2 Å²	41.2	34%	0.344	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-32.6	176.1	-26.5	32.9	0	0	0	113.6	G391 M423 Y424	P389-G391 PolarHBondContact O-N 3.14Å; P389-M423 WeakPolarHBondContact CG-O 3.48Å; P389-Y424 VanDerWaalsContact CD-CZ 3.45Å; P389-Y424 HydrophobicContact CG-CD2 3.97Å; P389-Y424 HydrophobicContact CG-CE2 3.63Å
390	N	92.2	Very high	90.7	Very high	141 Å²	141	43.7 Å²	43.7	75%	0.754	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	13	178.6	-60.1	-7.5	0	0	0	113.3	T388 T392	T388-N390 PolarHBondContact O-N 2.67Å; T388-N390 VanDerWaalsContact O-N 3.1Å; N390-T392 HydrophobicContact CB-CG2 4.49Å; N390-T392 PolarHBondContact O-N 2.99Å; N390-T392 VanDerWaalsContact O-N 3.12Å
391	G	92.5	Very high	90.2	Very high	52 Å²	52	46.7 Å²	46.7	54%	0.536	27%	0.274	S	S	.	.	S	Bend	trans	73	-6.2	-178.4	0	0	0	0	0	115.6	T388 P389	T388-G391 PolarHBondContact O-N 3.07Å; P389-G391 PolarHBondContact O-N 3.14Å
392	T	92.8	Very high	90.3	Very high	63 Å²	63	49.3 Å²	49.3	39%	0.387	28%	0.282	S	S	.	.			trans	-69.9	134.4	178.6	81.6	0	0	0	0	110.6	T388 N390 K400	T388-T392 WeakPolarHBondContact CB-O 3.49Å; T388-T392 PolarHBondContact N-O 3.11Å; T388-T392 WeakPolarHBondContact OG1-CA 3.4Å; T388-T392 PolarHBondContact OG1-N 3Å; T388-T392 VanDerWaalsContact OG1-N 3.08Å; T388-T392 PolarHBondContact OG1-O 2.88Å; T388-T392 PolarHBondContact OG1-OG1 3.25Å; N390-T392 HydrophobicContact CB-CG2 4.49Å; N390-T392 PolarHBondContact O-N 2.99Å; N390-T392 VanDerWaalsContact O-N 3.12Å; T392-K400 PolarHBondContact OG1-NZ 2.75Å
393	V	93	Very high	90.3	Very high	89 Å²	89	50 Å²	50	54%	0.539	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	142.8	176.4	-174.9	0	0	0	0	109.8	W386 I387	W386-V393 CarbonylContact O-C 3.53Å; W386-V393 WeakPolarHBondContact O-CA 3.5Å; I387-V393 HydrophobicContact CG1-CG2 4.5Å
394	M	92.6	Very high	90.2	Very high	1 Å²	1	51 Å²	51	1%	0.005	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	139.1	177	-68.8	179.9	50.6	0	0	110.6	S385 W386 T388 K400 I403 V405 L411	S385-M394 CarbonylContact C-O 3.55Å; S385-M394 WeakPolarHBondContact CA-O 3.49Å; W386-M394 HydrophobicContact CB-CB 4.41Å; W386-M394 PolarHBondContact N-O 2.99Å; W386-M394 PolarHBondContact O-N 3.17Å; T388-M394 HydrophobicContact CG2-CG 4.29Å; T388-M394 HydrophobicContact CG2-SD 3.71Å; M394-K400 HydrophobicContact CE-CD 3.95Å; M394-K400 HydrophobicContact CG-CD 4.47Å; M394-K400 HydrophobicContact SD-CD 3.83Å; M394-K400 PolarHBondContact SD-NZ 2.97Å; M394-I403 HydrophobicContact CE-CB 3.98Å; M394-I403 HydrophobicContact CE-CG2 3.78Å; M394-I403 VanDerWaalsContact CE-O 3.23Å; M394-I403 WeakPolarHBondContact CE-O 3.37Å; M394-I403 HydrophobicContact SD-CG2 4.46Å; M394-V405 HydrophobicContact CB-CG2 4.14Å; M394-L411 HydrophobicContact CE-CD1 3.99Å
395	T	93.7	Very high	90.2	Very high	35 Å²	35	51.2 Å²	51.2	22%	0.215	30%	0.296	C	S	.	.			trans	-128.2	175.6	179.6	68.3	0	0	0	0	109.8	N261 G397 A398	N261-T395 WeakPolarHBondContact OD1-CB 3.48Å; T395-G397 PolarHBondContact O-N 3.4Å; T395-G397 PolarHBondContact OG1-N 3.32Å; T395-A398 WeakPolarHBondContact O-CB 3.27Å; T395-A398 PolarHBondContact O-N 3.37Å; T395-A398 VanDerWaalsContact O-N 3.1Å
396	H	91.1	Very high	90.1	Very high	37 Å²	37	53 Å²	53	17%	0.171	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-22.4	178.6	-171.9	35.9	0	0	0	113	E259 R260 N261 V405 S407	E259-H396 IonicContact OE2-NE2 3.61Å; R260-H396 HydrophobicContact CB-CB 4.15Å; R260-H396 PolarHBondContact O-CD2 2.87Å; R260-H396 VanDerWaalsContact O-CD2 3.26Å; N261-H396 HydrophobicContact CB-CB 4.38Å; N261-H396 PolarHBondContact OD1-N 2.8Å; H396-V405 PolarHBondContact ND1-O 3.02Å; H396-S407 PolarHBondContact CE1-N 2.83Å; H396-S407 WeakPolarHBondContact NE2-CB 3.28Å
397	G	86	Confident	89.8	Confident	8 Å²	8	56 Å²	56	8%	0.082	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-0.6	175	0	0	0	0	0	115.2	T395 Y399	T395-G397 PolarHBondContact O-N 3.4Å; T395-G397 PolarHBondContact OG1-N 3.32Å; G397-Y399 VanDerWaalsContact O-CD2 3.28Å; G397-Y399 WeakPolarHBondContact O-CD2 3.36Å; G397-Y399 WeakPolarHBondContact O-CE2 3.31Å; G397-Y399 PolarHBondContact O-N 2.87Å
398	A	84.9	Confident	89.6	Confident	33 Å²	33	55.7 Å²	55.7	27%	0.273	32%	0.324	S	S	.	.			trans	-83.6	106	-175.7	0	0	0	0	0	112.4	T395 K400	T395-A398 WeakPolarHBondContact O-CB 3.27Å; T395-A398 PolarHBondContact O-N 3.37Å; T395-A398 VanDerWaalsContact O-N 3.1Å; A398-K400 PolarHBondContact O-N 2.96Å
399	Y	71.2	Confident	89.6	Confident	97 Å²	97	55.2 Å²	55.2	38%	0.38	32%	0.321	S	S	.	.			trans	-73.1	94.5	176.9	-57.9	-90.7	0	0	0	112.1	P236 G237 Q240 N265 G397	P236-Y399 PolarHBondContact O-OH 2.88Å; G237-Y399 WeakPolarHBondContact CA-OH 3.39Å; G237-Y399 PolarHBondContact N-OH 3.5Å; Q240-Y399 HydrophobicContact CB-CE1 4.04Å; Q240-Y399 VanDerWaalsContact CD-CD1 3.48Å; Q240-Y399 HydrophobicContact CG-CD1 4.15Å; Q240-Y399 HydrophobicContact CG-CE1 3.67Å; Q240-Y399 HydrophobicContact CG-CE2 4.16Å; N265-Y399 WeakPolarHBondContact ND2-CE2 3.23Å; N265-Y399 PolarHBondContact ND2-OH 3.47Å; N265-Y399 VanDerWaalsContact OD1-CE2 3.29Å; N265-Y399 WeakPolarHBondContact OD1-CE2 3.24Å; G397-Y399 VanDerWaalsContact O-CD2 3.28Å; G397-Y399 WeakPolarHBondContact O-CD2 3.36Å; G397-Y399 WeakPolarHBondContact O-CE2 3.31Å; G397-Y399 PolarHBondContact O-N 2.87Å
400	K	77.3	Confident	89.6	Confident	89 Å²	89	52.9 Å²	52.9	39%	0.387	31%	0.305	S	S	.	.			trans	-123.6	126.7	162.3	-68.4	-179.6	-172.1	176.4	0	108.1	T392 M394 A398 R402 I403	T392-K400 PolarHBondContact OG1-NZ 2.75Å; M394-K400 HydrophobicContact CE-CD 3.95Å; M394-K400 HydrophobicContact CG-CD 4.47Å; M394-K400 HydrophobicContact SD-CD 3.83Å; M394-K400 PolarHBondContact SD-NZ 2.97Å; A398-K400 PolarHBondContact O-N 2.96Å; K400-R402 VanDerWaalsContact C-N 3.26Å; K400-R402 PolarHBondContact O-N 2.88Å; K400-I403 VanDerWaalsContact CB-O 3.31Å; K400-I403 WeakPolarHBondContact CB-O 3.44Å
401	V	78	Confident	89.8	Confident	150 Å²	150	46.1 Å²	46.1	91%	0.909	27%	0.269	S	S	*	.	S	Bend	trans	-66.3	-26.5	-171.4	-176.8	0	0	0	0	113.1
402	R	91.7	Very high	90	Very high	79 Å²	79	45.5 Å²	45.5	30%	0.298	25%	0.254	S	S	.	.	S	Bend	trans	-103.3	-25.9	-171.6	-163	175.3	63.3	70.1	-5	114.7	K400 F413 T414 N415 D420	K400-R402 VanDerWaalsContact C-N 3.26Å; K400-R402 PolarHBondContact O-N 2.88Å; R402-F413 WeakPolarHBondContact O-CA 3.37Å; R402-T414 WeakPolarHBondContact CA-OG1 3.36Å; R402-T414 PolarHBondContact O-N 2.84Å; R402-T414 PolarHBondContact O-OG1 2.76Å; R402-N415 VanDerWaalsContact CD-O 3.26Å; R402-N415 WeakPolarHBondContact CD-O 3.33Å; R402-N415 HydrophobicContact CG-CB 4.5Å; R402-N415 WeakPolarHBondContact CG-O 3.45Å; R402-N415 PolarHBondContact NH1-O 2.81Å; R402-D420 IonicContact CZ-OD1 2.85Å; R402-D420 IonicContact CZ-OD2 3.67Å; R402-D420 IonicContact NH1-OD1 3.94Å; R402-D420 PolarHBondContact NH1-OD1 3.24Å; R402-D420 IonicContact NH1-OD2 3.21Å; R402-D420 PolarHBondContact NH1-OD2 3.36Å; R402-D420 IonicContact NH2-OD1 2.76Å; R402-D420 PolarHBondContact NH2-OD1 3.22Å; R402-D420 IonicContact NH2-OD2 3.74Å; R402-D420 PolarHBondContact NH2-OD2 3.3Å
403	I	92.5	Very high	90.1	Very high	16 Å²	16	42.5 Å²	42.5	8%	0.082	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	122.3	-176.7	-44.6	174.8	0	0	0	107.5	M394 K400 L411 N412 F413	M394-I403 HydrophobicContact CE-CB 3.98Å; M394-I403 HydrophobicContact CE-CG2 3.78Å; M394-I403 VanDerWaalsContact CE-O 3.23Å; M394-I403 WeakPolarHBondContact CE-O 3.37Å; M394-I403 HydrophobicContact SD-CG2 4.46Å; K400-I403 VanDerWaalsContact CB-O 3.31Å; K400-I403 WeakPolarHBondContact CB-O 3.44Å; I403-L411 HydrophobicContact CG2-CD1 3.78Å; I403-L411 HydrophobicContact CG2-CD2 4.39Å; I403-L411 HydrophobicContact CG2-CG 4.01Å; I403-N412 CarbonylContact C-O 3.57Å; I403-N412 WeakPolarHBondContact CA-O 3.34Å; I403-F413 HydrophobicContact CB-CD1 4.37Å; I403-F413 HydrophobicContact CD1-CD1 3.94Å; I403-F413 HydrophobicContact CD1-CE1 3.72Å; I403-F413 HydrophobicContact CG1-CD1 3.7Å; I403-F413 HydrophobicContact CG1-CE1 3.96Å; I403-F413 HydrophobicContact CG1-CG 4.47Å; I403-F413 HydrophobicContact CG2-CD1 3.92Å; I403-F413 HydrophobicContact CG2-CD2 4.36Å; I403-F413 HydrophobicContact CG2-CE1 3.81Å; I403-F413 HydrophobicContact CG2-CE2 4.25Å; I403-F413 HydrophobicContact CG2-CG 4.19Å; I403-F413 HydrophobicContact CG2-CZ 3.98Å
404	A	93.4	Very high	90.1	Very high	39 Å²	39	42.6 Å²	42.6	32%	0.322	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	146.8	-176.8	0	0	0	0	0	111.7	N412	A404-N412 PolarHBondContact N-O 2.87Å; A404-N412 PolarHBondContact O-N 2.94Å
405	V	94.3	Very high	90.1	Very high	8 Å²	8	46 Å²	46	5%	0.048	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	124.4	169.3	-175.1	0	0	0	0	108	W386 M394 H396 L411	W386-V405 HydrophobicContact CB-CG2 4.42Å; W386-V405 HydrophobicContact CG-CG2 4.36Å; M394-V405 HydrophobicContact CB-CG2 4.14Å; H396-V405 PolarHBondContact ND1-O 3.02Å; V405-L411 HydrophobicContact CG2-CD1 3.79Å
406	L	92.8	Very high	90.1	Very high	60 Å²	60	44.4 Å²	44.4	31%	0.314	25%	0.245	S	C	.	.			trans	-79.5	161.8	176.4	-57.3	-175.4	0	0	0	111.2	D408 G409 T410 N412	L406-D408 PolarHBondContact O-N 2.65Å; L406-G409 PolarHBondContact O-N 2.94Å; L406-T410 HydrophobicContact CD1-CG2 4.34Å; L406-T410 PolarHBondContact N-O 2.85Å; L406-N412 HydrophobicContact CD1-CB 4.01Å; L406-N412 HydrophobicContact CD2-CB 4.1Å; L406-N412 HydrophobicContact CG-CB 3.93Å
407	S	90.6	Very high	90.2	Very high	62 Å²	62	44.3 Å²	44.3	43%	0.434	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-26.4	-175	55.4	0	0	0	0	113.9	R260 H396 G409	R260-S407 PolarHBondContact NH1-O 2.86Å; H396-S407 PolarHBondContact CE1-N 2.83Å; H396-S407 WeakPolarHBondContact NE2-CB 3.28Å; S407-G409 VanDerWaalsContact C-N 3.34Å
408	D	92.2	Very high	90.5	Very high	47 Å²	47	46.8 Å²	46.8	25%	0.251	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-20.9	174.6	79.6	-15	0	0	0	113.8	R260 R376 L406 T410	R260-D408 PolarHBondContact NH1-O 3.37Å; R376-D408 IonicContact CZ-OD2 2.88Å; R376-D408 IonicContact NE-OD2 3.6Å; R376-D408 PolarHBondContact NE-OD2 2.89Å; R376-D408 IonicContact NH2-OD2 2.67Å; R376-D408 PolarHBondContact NH2-OD2 3.32Å; L406-D408 PolarHBondContact O-N 2.65Å; D408-T410 WeakPolarHBondContact OD1-CB 3.13Å; D408-T410 PolarHBondContact OD1-N 2.96Å; D408-T410 PolarHBondContact OD1-OG1 2.91Å; D408-T410 PolarHBondContact OD2-OG1 3.32Å
409	G	94	Very high	90.8	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.287	C	S	.	.	S	Bend	trans	116.5	-6.8	-179	0	0	0	0	0	114.5	C375 W386 L406 S407	C375-G409 CarbonylContact O-C 3.47Å; C375-G409 WeakPolarHBondContact O-CA 3.41Å; W386-G409 PolarHBondContact NE1-O 3.01Å; L406-G409 PolarHBondContact O-N 2.94Å; S407-G409 VanDerWaalsContact C-N 3.34Å
410	T	95.5	Very high	91.9	Very high	4 Å²	4	49.5 Å²	49.5	3%	0.025	27%	0.271	C	S	.	.			trans	-66.7	135.3	178	-58.1	0	0	0	0	112.2	E372 L373 K374 L406 D408	E372-T410 HydrophobicContact CB-CG2 3.96Å; E372-T410 HydrophobicContact CG-CG2 4.38Å; L373-T410 WeakPolarHBondContact O-CA 3.39Å; K374-T410 HydrophobicContact CG-CG2 4.28Å; L406-T410 HydrophobicContact CD1-CG2 4.34Å; L406-T410 PolarHBondContact N-O 2.85Å; D408-T410 WeakPolarHBondContact OD1-CB 3.13Å; D408-T410 PolarHBondContact OD1-N 2.96Å; D408-T410 PolarHBondContact OD1-OG1 2.91Å; D408-T410 PolarHBondContact OD2-OG1 3.32Å
411	L	96.2	Very high	92.8	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	115	170.4	-172.4	71.6	0	0	0	109.4	E372 L373 W386 M394 I403 V405 F413 Y424	E372-L411 WeakPolarHBondContact CA-O 3.41Å; L373-L411 HydrophobicContact CB-CB 4.38Å; L373-L411 PolarHBondContact N-O 3.23Å; L373-L411 PolarHBondContact O-N 3.36Å; W386-L411 HydrophobicContact CB-CD1 4.29Å; W386-L411 HydrophobicContact CD2-CB 3.9Å; W386-L411 HydrophobicContact CD2-CD2 4.07Å; W386-L411 HydrophobicContact CD2-CG 4.44Å; W386-L411 HydrophobicContact CE3-CB 4.49Å; W386-L411 HydrophobicContact CE3-CD2 4.08Å; W386-L411 HydrophobicContact CG-CB 4.16Å; W386-L411 HydrophobicContact CG-CD1 4.16Å; W386-L411 HydrophobicContact CG-CD2 4.3Å; W386-L411 HydrophobicContact CG-CG 4.46Å; W386-L411 HydrophobicContact CH2-CB 4.49Å; W386-L411 HydrophobicContact CZ2-CB 3.93Å; M394-L411 HydrophobicContact CE-CD1 3.99Å; I403-L411 HydrophobicContact CG2-CD1 3.78Å; I403-L411 HydrophobicContact CG2-CD2 4.39Å; I403-L411 HydrophobicContact CG2-CG 4.01Å; V405-L411 HydrophobicContact CG2-CD1 3.79Å; L411-F413 HydrophobicContact CD2-CE2 3.7Å; L411-F413 HydrophobicContact CD2-CZ 3.78Å; L411-F413 HydrophobicContact CG-CE2 3.81Å; L411-F413 HydrophobicContact CG-CZ 4.27Å; L411-Y424 HydrophobicContact CD2-CD1 3.47Å; L411-Y424 VanDerWaalsContact CD2-CD1 3.47Å; L411-Y424 HydrophobicContact CD2-CE1 3.8Å; L411-Y424 HydrophobicContact CD2-CG 4.33Å
412	N	95.5	Very high	93.6	Very high	39 Å²	39	42 Å²	42	21%	0.209	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	135.3	-177	-178.5	-12.5	0	0	0	110.6	E372 I403 A404 L406	E372-N412 HydrophobicContact CG-CB 4.49Å; I403-N412 CarbonylContact C-O 3.57Å; I403-N412 WeakPolarHBondContact CA-O 3.34Å; A404-N412 PolarHBondContact N-O 2.87Å; A404-N412 PolarHBondContact O-N 2.94Å; L406-N412 HydrophobicContact CD1-CB 4.01Å; L406-N412 HydrophobicContact CD2-CB 4.1Å; L406-N412 HydrophobicContact CG-CB 3.93Å
413	F	95.2	Very high	93.9	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	118.3	176.3	-61.3	-113.3	0	0	0	108.9	A370 A371 L373 R402 I403 L411 V416 D420 Y424 L441	A370-F413 WeakPolarHBondContact CA-O 3.34Å; A370-F413 WeakPolarHBondContact CB-O 3.2Å; A371-F413 HydrophobicContact CB-CB 4.28Å; A371-F413 HydrophobicContact CB-CD2 4.31Å; A371-F413 PolarHBondContact N-O 2.79Å; A371-F413 VanDerWaalsContact N-O 3.11Å; A371-F413 PolarHBondContact O-N 2.84Å; L373-F413 HydrophobicContact CD1-CE2 4.45Å; L373-F413 HydrophobicContact CG-CE2 4.5Å; R402-F413 WeakPolarHBondContact O-CA 3.37Å; I403-F413 HydrophobicContact CB-CD1 4.37Å; I403-F413 HydrophobicContact CD1-CD1 3.94Å; I403-F413 HydrophobicContact CD1-CE1 3.72Å; I403-F413 HydrophobicContact CG1-CD1 3.7Å; I403-F413 HydrophobicContact CG1-CE1 3.96Å; I403-F413 HydrophobicContact CG1-CG 4.47Å; I403-F413 HydrophobicContact CG2-CD1 3.92Å; I403-F413 HydrophobicContact CG2-CD2 4.36Å; I403-F413 HydrophobicContact CG2-CE1 3.81Å; I403-F413 HydrophobicContact CG2-CE2 4.25Å; I403-F413 HydrophobicContact CG2-CG 4.19Å; I403-F413 HydrophobicContact CG2-CZ 3.98Å; L411-F413 HydrophobicContact CD2-CE2 3.7Å; L411-F413 HydrophobicContact CD2-CZ 3.78Å; L411-F413 HydrophobicContact CG-CE2 3.81Å; L411-F413 HydrophobicContact CG-CZ 4.27Å; F413-V416 HydrophobicContact CB-CG2 3.55Å; F413-V416 HydrophobicContact CD1-CG2 4.15Å; F413-V416 HydrophobicContact CG-CG2 4.01Å; F413-D420 HydrophobicContact CE1-CB 4.16Å; F413-Y424 HydrophobicContact CE1-CE1 4.35Å; F413-Y424 HydrophobicContact CZ-CD1 4.45Å; F413-Y424 AromaticContact CZ-CE1 3.76Å; F413-Y424 HydrophobicContact CZ-CE1 3.76Å; F413-Y424 HydrophobicContact CZ-CE2 4.28Å; F413-Y424 AromaticContact CZ-CZ 3.67Å; F413-L441 HydrophobicContact CD1-CD2 4.36Å; F413-L441 HydrophobicContact CE1-CD2 3.77Å; F413-L441 HydrophobicContact CE2-CD2 4.14Å; F413-L441 HydrophobicContact CZ-CD2 3.65Å
414	T	93.2	Very high	94.1	Very high	91 Å²	91	43.4 Å²	43.4	56%	0.558	25%	0.248	S	C	*	.	S	Bend	trans	-76.2	-26.7	179	55.2	0	0	0	0	113	R402	R402-T414 WeakPolarHBondContact CA-OG1 3.36Å; R402-T414 PolarHBondContact O-N 2.84Å; R402-T414 PolarHBondContact O-OG1 2.76Å
415	N	93	Very high	94.3	Very high	73 Å²	73	42.8 Å²	42.8	39%	0.39	24%	0.24	S	C	.	.	S	Bend	trans	-155	119.1	172.2	-177.2	-18.6	0	0	0	108.1	G368 R402	G368-N415 VanDerWaalsContact CA-OD1 3.29Å; G368-N415 WeakPolarHBondContact CA-OD1 3.5Å; R402-N415 VanDerWaalsContact CD-O 3.26Å; R402-N415 WeakPolarHBondContact CD-O 3.33Å; R402-N415 HydrophobicContact CG-CB 4.5Å; R402-N415 WeakPolarHBondContact CG-O 3.45Å; R402-N415 PolarHBondContact NH1-O 2.81Å
416	V	93.9	Very high	94.5	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.238	C	C	.	.			trans	-90.5	135.4	-179.4	-175.3	0	0	0	0	110.6	V365 E367 G368 M369 A371 F413 D420 L441 V443	V365-V416 HydrophobicContact CG1-CB 4.38Å; V365-V416 HydrophobicContact CG1-CG1 3.94Å; V365-V416 HydrophobicContact CG1-CG2 4.39Å; E367-V416 WeakPolarHBondContact CA-O 3.34Å; G368-V416 PolarHBondContact N-O 2.82Å; M369-V416 WeakPolarHBondContact O-CG2 3.16Å; M369-V416 PolarHBondContact O-N 2.97Å; A371-V416 HydrophobicContact CB-CG2 3.59Å; F413-V416 HydrophobicContact CB-CG2 3.55Å; F413-V416 HydrophobicContact CD1-CG2 4.15Å; F413-V416 HydrophobicContact CG-CG2 4.01Å; V416-D420 HydrophobicContact CG1-CB 4.11Å; V416-L441 HydrophobicContact CG1-CD2 4.28Å; V416-V443 HydrophobicContact CG1-CB 4.23Å; V416-V443 HydrophobicContact CG1-CG1 3.78Å; V416-V443 HydrophobicContact CG1-CG2 3.37Å
417	T	93.4	Very high	94.7	Very high	35 Å²	35	42.1 Å²	42.1	22%	0.215	24%	0.236	C	C	.	.			trans	-113.3	158.8	175.4	70.6	0	0	0	0	110.7	E367 Q419 D420	E367-T417 WeakPolarHBondContact OE1-CA 3.49Å; T417-Q419 PolarHBondContact O-N 2.78Å; T417-D420 PolarHBondContact N-OD2 3.31Å; T417-D420 WeakPolarHBondContact O-CB 3.41Å; T417-D420 PolarHBondContact O-N 3.26Å; T417-D420 PolarHBondContact OG1-OD2 3.46Å
418	V	91.9	Very high	95	Very high	61 Å²	61	39.2 Å²	39.2	37%	0.37	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-55.2	-28.8	179.2	174.7	0	0	0	0	112.7	E367 D420 T421 V443 A445	E367-V418 HydrophobicContact CB-CG2 4.39Å; E367-V418 PolarHBondContact OE1-N 3.19Å; V418-D420 PolarHBondContact O-N 2.97Å; V418-T421 WeakPolarHBondContact O-CB 3Å; V418-T421 PolarHBondContact O-N 2.77Å; V418-T421 PolarHBondContact O-OG1 2.8Å; V418-V443 HydrophobicContact CG2-CG1 4.38Å; V418-A445 HydrophobicContact CG2-CB 3.91Å
419	Q	92	Very high	95.1	Very high	177 Å²	177	38.1 Å²	38.1	83%	0.827	21%	0.211	S	C	*	.	G	3₁₀ helix	trans	-68.9	-13.5	177.7	-62.1	-179.1	-2.2	0	0	114.7	T417 T421	T417-Q419 PolarHBondContact O-N 2.78Å; Q419-T421 VanDerWaalsContact C-N 3.25Å
420	D	93.8	Very high	95.1	Very high	10 Å²	10	39.1 Å²	39.1	5%	0.053	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-82.3	-1.4	173.7	-58.8	-55.1	0	0	0	112.9	R402 F413 V416 T417 V418 G422 Y424 L441 V443	R402-D420 IonicContact CZ-OD1 2.85Å; R402-D420 IonicContact CZ-OD2 3.67Å; R402-D420 IonicContact NH1-OD1 3.94Å; R402-D420 PolarHBondContact NH1-OD1 3.24Å; R402-D420 IonicContact NH1-OD2 3.21Å; R402-D420 PolarHBondContact NH1-OD2 3.36Å; R402-D420 IonicContact NH2-OD1 2.76Å; R402-D420 PolarHBondContact NH2-OD1 3.22Å; R402-D420 IonicContact NH2-OD2 3.74Å; R402-D420 PolarHBondContact NH2-OD2 3.3Å; F413-D420 HydrophobicContact CE1-CB 4.16Å; V416-D420 HydrophobicContact CG1-CB 4.11Å; T417-D420 PolarHBondContact N-OD2 3.31Å; T417-D420 WeakPolarHBondContact O-CB 3.41Å; T417-D420 PolarHBondContact O-N 3.26Å; T417-D420 PolarHBondContact OG1-OD2 3.46Å; V418-D420 PolarHBondContact O-N 2.97Å; D420-G422 PolarHBondContact O-N 2.9Å; D420-Y424 WeakPolarHBondContact O-CE2 3.23Å; D420-Y424 PolarHBondContact O-OH 3.15Å; D420-L441 HydrophobicContact CB-CD2 4.13Å; D420-V443 HydrophobicContact CB-CG2 4.45Å
421	T	95.2	Very high	94.8	Very high	62 Å²	62	39.6 Å²	39.6	38%	0.38	22%	0.22	S	C	.	.			trans	-63.6	124	178.7	-61.2	0	0	0	0	111.3	V418 Q419 L441 V443	V418-T421 WeakPolarHBondContact O-CB 3Å; V418-T421 PolarHBondContact O-N 2.77Å; V418-T421 PolarHBondContact O-OG1 2.8Å; Q419-T421 VanDerWaalsContact C-N 3.25Å; T421-L441 CarbonylContact C-O 3.56Å; T421-L441 WeakPolarHBondContact CA-O 3.04Å; T421-V443 WeakPolarHBondContact OG1-CB 3.34Å; T421-V443 PolarHBondContact OG1-N 2.87Å
422	G	95.9	Very high	94.5	Very high	20 Å²	20	42.3 Å²	42.3	21%	0.206	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	158.9	-173.3	175.4	0	0	0	0	0	114.8	D420 T440 L441	D420-G422 PolarHBondContact O-N 2.9Å; G422-T440 WeakPolarHBondContact O-CA 3.44Å; G422-L441 PolarHBondContact N-O 2.77Å; G422-L441 PolarHBondContact O-N 2.9Å
423	M	97.3	Very high	94.3	Very high	117 Å²	117	41.7 Å²	41.7	58%	0.576	24%	0.239	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-88.8	122.3	178.3	-178.4	172.5	58.1	0	0	111.3	P389 A439 T440	P389-M423 WeakPolarHBondContact CG-O 3.48Å; M423-A439 WeakPolarHBondContact CA-O 3.23Å; M423-T440 HydrophobicContact CB-CG2 4.25Å
424	Y	97.4	Very high	94.3	Very high	7 Å²	7	46.6 Å²	46.6	3%	0.027	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	133.9	173.6	-71.6	-103.3	0	0	0	109.6	L373 I387 T388 P389 L411 F413 D420 S438 A439 L441	L373-Y424 HydrophobicContact CD1-CD2 4.09Å; L373-Y424 HydrophobicContact CD1-CG 3.97Å; I387-Y424 WeakPolarHBondContact O-CA 3.43Å; T388-Y424 HydrophobicContact CG2-CD1 4.34Å; T388-Y424 HydrophobicContact CG2-CE1 3.95Å; P389-Y424 VanDerWaalsContact CD-CZ 3.45Å; P389-Y424 HydrophobicContact CG-CD2 3.97Å; P389-Y424 HydrophobicContact CG-CE2 3.63Å; L411-Y424 HydrophobicContact CD2-CD1 3.47Å; L411-Y424 VanDerWaalsContact CD2-CD1 3.47Å; L411-Y424 HydrophobicContact CD2-CE1 3.8Å; L411-Y424 HydrophobicContact CD2-CG 4.33Å; F413-Y424 HydrophobicContact CE1-CE1 4.35Å; F413-Y424 HydrophobicContact CZ-CD1 4.45Å; F413-Y424 AromaticContact CZ-CE1 3.76Å; F413-Y424 HydrophobicContact CZ-CE1 3.76Å; F413-Y424 HydrophobicContact CZ-CE2 4.28Å; F413-Y424 AromaticContact CZ-CZ 3.67Å; D420-Y424 WeakPolarHBondContact O-CE2 3.23Å; D420-Y424 PolarHBondContact O-OH 3.15Å; Y424-S438 VanDerWaalsContact O-CA 3.27Å; Y424-S438 WeakPolarHBondContact O-CA 3.3Å; Y424-A439 PolarHBondContact N-O 3.1Å; Y424-A439 PolarHBondContact O-N 3.35Å; Y424-L441 HydrophobicContact CD2-CB 4.07Å; Y424-L441 HydrophobicContact CE2-CB 3.93Å; Y424-L441 HydrophobicContact CE2-CD2 4.1Å
425	T	98	Very high	94.5	Very high	26 Å²	26	44.4 Å²	44.4	16%	0.16	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	117.9	177.7	-61.4	0	0	0	0	110.4	W386 I387 T436 S438	W386-T425 WeakPolarHBondContact CA-O 3.48Å; I387-T425 PolarHBondContact N-O 2.91Å; I387-T425 PolarHBondContact O-N 3.3Å; T425-T436 HydrophobicContact CG2-CG2 4.19Å; T425-S438 WeakPolarHBondContact CB-OG 3.4Å; T425-S438 WeakPolarHBondContact CG2-OG 3.1Å; T425-S438 PolarHBondContact OG1-OG 3.49Å
426	C	97.7	Very high	94.7	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	131	164.7	-177.2	0	0	0	0	109.5	C375 W386 T436 A437	C375-C426 HydrophobicContact CB-CB 3.65Å; C375-C426 WeakPolarHBondContact CB-SG 3.33Å; C375-C426 WeakPolarHBondContact SG-CB 3.36Å; C375-C426 CovalentContact SG-SG 2.03Å; C375-C426 PolarHBondContact SG-SG 3.03Å; W386-C426 HydrophobicContact CD2-CB 4.05Å; W386-C426 HydrophobicContact CE3-CB 4.06Å; W386-C426 HydrophobicContact CH2-CB 3.87Å; W386-C426 HydrophobicContact CZ2-CB 3.81Å; W386-C426 HydrophobicContact CZ3-CB 3.96Å; C426-T436 CarbonylContact O-C 3.59Å; C426-T436 VanDerWaalsContact O-CA 3.23Å; C426-T436 WeakPolarHBondContact O-CA 3.4Å; C426-A437 PolarHBondContact N-O 2.75Å; C426-A437 PolarHBondContact O-N 3.46Å
427	M	96.5	Very high	94.8	Very high	54 Å²	54	45.6 Å²	45.6	27%	0.266	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	121.2	171.2	-177.7	178.8	-66.9	0	0	109.4	S385 I387 T436	S385-M427 PolarHBondContact N-O 2.82Å; S385-M427 PolarHBondContact O-N 3.49Å; S385-M427 PolarHBondContact OG-O 3.29Å; I387-M427 HydrophobicContact CD1-CE 4.06Å; M427-T436 HydrophobicContact CB-CG2 3.94Å; M427-T436 HydrophobicContact CE-CG2 3.82Å; M427-T436 HydrophobicContact CG-CG2 3.89Å
428	V	96.5	Very high	95	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	132.4	178.3	-175.2	0	0	0	0	108.8	P354 I356 A377 T382 S383 V384 N434 T435	P354-V428 HydrophobicContact CB-CG1 3.83Å; P354-V428 HydrophobicContact CG-CB 4.44Å; P354-V428 HydrophobicContact CG-CG1 4.11Å; P354-V428 WeakPolarHBondContact CG-O 3.28Å; I356-V428 HydrophobicContact CD1-CG2 3.93Å; I356-V428 HydrophobicContact CG1-CB 4.33Å; I356-V428 HydrophobicContact CG1-CG2 3.83Å; A377-V428 HydrophobicContact CB-CG1 3.67Å; T382-V428 HydrophobicContact CG2-CG1 3.76Å; S383-V428 WeakPolarHBondContact O-CA 3.28Å; V384-V428 HydrophobicContact CG2-CG1 4.31Å; V384-V428 HydrophobicContact CG2-CG2 4.18Å; V428-N434 CarbonylContact O-C 3.08Å; V428-N434 VanDerWaalsContact O-CA 3.31Å; V428-N434 WeakPolarHBondContact O-CA 3.34Å; V428-T435 PolarHBondContact N-O 2.7Å; V428-T435 PolarHBondContact O-N 3.27Å
429	S	95	Very high	95.3	Very high	25 Å²	25	44.1 Å²	44.1	18%	0.175	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	152.4	-179	38.8	0	0	0	0	113.2	T382 S383 G433	T382-S429 WeakPolarHBondContact CA-O 3.18Å; T382-S429 WeakPolarHBondContact CB-O 3.33Å; S383-S429 PolarHBondContact N-O 2.93Å; S383-S429 VanDerWaalsContact N-O 3.07Å; S383-S429 PolarHBondContact O-N 3.07Å; S383-S429 PolarHBondContact OG-O 2.86Å; S383-S429 PolarHBondContact OG-OG 3.37Å; S429-G433 WeakPolarHBondContact CA-O 3.42Å
430	N	93.6	Very high	95.5	Very high	21 Å²	21	38.8 Å²	38.8	11%	0.112	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	-174.2	169.4	77	-1.1	0	0	0	110.5	H284 Y352 P354 T382 V432 G433	H284-N430 VanDerWaalsContact CD2-C 3.49Å; Y352-N430 PolarHBondContact O-ND2 3.32Å; P354-N430 HydrophobicContact CB-CB 4.4Å; T382-N430 HydrophobicContact CG2-CB 4.37Å; N430-V432 PolarHBondContact O-N 2.82Å; N430-V432 WeakPolarHBondContact OD1-CB 3.48Å; N430-V432 PolarHBondContact OD1-N 2.88Å; N430-G433 PolarHBondContact N-O 3.14Å; N430-G433 PolarHBondContact O-N 3.36Å; N430-G433 PolarHBondContact OD1-N 3.3Å; N430-G433 VanDerWaalsContact OD1-N 3.14Å; N430-G433 PolarHBondContact OD1-O 3.31Å
431	S	89	Confident	95.7	Very high	13 Å²	13	38.4 Å²	38.4	9%	0.091	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-3.1	-177.8	50.5	0	0	0	0	115.4	H284 C307 W314	H284-S431 PolarHBondContact CD2-N 3.46Å; H284-S431 VanDerWaalsContact CD2-N 3.31Å; H284-S431 VanDerWaalsContact NE2-CA 3.33Å; H284-S431 WeakPolarHBondContact NE2-CA 3.49Å; H284-S431 PolarHBondContact NE2-N 2.86Å; H284-S431 VanDerWaalsContact NE2-N 3.1Å; C307-S431 PolarHBondContact O-OG 2.97Å; W314-S431 VanDerWaalsContact CH2-O 3.27Å; W314-S431 WeakPolarHBondContact CH2-O 3.23Å; W314-S431 WeakPolarHBondContact CZ3-O 3.49Å
432	V	89.9	Confident	95.7	Very high	58 Å²	58	38.8 Å²	38.8	35%	0.352	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.9	-30.1	-177.9	-169.3	0	0	0	0	111.9	C351 N430	C351-V432 HydrophobicContact CB-CG2 3.37Å; N430-V432 PolarHBondContact O-N 2.82Å; N430-V432 WeakPolarHBondContact OD1-CB 3.48Å; N430-V432 PolarHBondContact OD1-N 2.88Å
433	G	92.2	Very high	95.6	Very high	25 Å²	25	38.3 Å²	38.3	26%	0.258	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	167.1	-163.8	-177.9	0	0	0	0	0	113.8	P354 S429 N430	P354-G433 WeakPolarHBondContact CD-O 3.35Å; S429-G433 WeakPolarHBondContact CA-O 3.42Å; N430-G433 PolarHBondContact N-O 3.14Å; N430-G433 PolarHBondContact O-N 3.36Å; N430-G433 PolarHBondContact OD1-N 3.3Å; N430-G433 VanDerWaalsContact OD1-N 3.14Å; N430-G433 PolarHBondContact OD1-O 3.31Å
434	N	95	Very high	95.4	Very high	104 Å²	104	36 Å²	36	56%	0.556	22%	0.221	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-128.4	151.1	-174.7	57.9	-16	0	0	0	112.6	V428	V428-N434 CarbonylContact O-C 3.08Å; V428-N434 VanDerWaalsContact O-CA 3.31Å; V428-N434 WeakPolarHBondContact O-CA 3.34Å
435	T	96.5	Very high	94.7	Very high	44 Å²	44	38.7 Å²	38.7	27%	0.27	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	138.4	177.5	-58.8	0	0	0	0	108.4	P354 I356 V428	P354-T435 VanDerWaalsContact O-CB 3.26Å; P354-T435 WeakPolarHBondContact O-CB 3.44Å; P354-T435 PolarHBondContact O-OG1 2.97Å; I356-T435 HydrophobicContact CD1-CG2 4.02Å; I356-T435 HydrophobicContact CG1-CG2 4.09Å; V428-T435 PolarHBondContact N-O 2.7Å; V428-T435 PolarHBondContact O-N 3.27Å
436	T	97	Very high	93.6	Very high	78 Å²	78	40 Å²	40	48%	0.479	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	148.4	-178.7	51	0	0	0	0	112	T425 C426 M427	T425-T436 HydrophobicContact CG2-CG2 4.19Å; C426-T436 CarbonylContact O-C 3.59Å; C426-T436 VanDerWaalsContact O-CA 3.23Å; C426-T436 WeakPolarHBondContact O-CA 3.4Å; M427-T436 HydrophobicContact CB-CG2 3.94Å; M427-T436 HydrophobicContact CE-CG2 3.82Å; M427-T436 HydrophobicContact CG-CG2 3.89Å
437	A	97.5	Very high	92.1	Very high	21 Å²	21	46.1 Å²	46.1	17%	0.174	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	141.6	166.9	0	0	0	0	0	109.5	I356 P359 P360 C426	I356-A437 HydrophobicContact CD1-CB 3.72Å; P359-A437 HydrophobicContact CB-CB 4.02Å; P360-A437 HydrophobicContact CG-CB 4.45Å; C426-A437 PolarHBondContact N-O 2.75Å; C426-A437 PolarHBondContact O-N 3.46Å
438	S	97.6	Very high	90.1	Very high	62 Å²	62	49.9 Å²	49.9	43%	0.434	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	147.9	-173.8	-51.9	0	0	0	0	110.9	Y424 T425	Y424-S438 VanDerWaalsContact O-CA 3.27Å; Y424-S438 WeakPolarHBondContact O-CA 3.3Å; T425-S438 WeakPolarHBondContact CB-OG 3.4Å; T425-S438 WeakPolarHBondContact CG2-OG 3.1Å; T425-S438 PolarHBondContact OG1-OG 3.49Å
439	A	97.6	Very high	87.7	Confident	2 Å²	2	54.1 Å²	54.1	2%	0.017	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	158.7	173	0	0	0	0	0	110.5	P360 M423 Y424	P360-A439 HydrophobicContact CB-CB 3.68Å; P360-A439 HydrophobicContact CG-CB 3.97Å; M423-A439 WeakPolarHBondContact CA-O 3.23Å; Y424-A439 PolarHBondContact N-O 3.1Å; Y424-A439 PolarHBondContact O-N 3.35Å
440	T	97.3	Very high	85.2	Confident	66 Å²	66	59 Å²	59	41%	0.405	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	130.1	175.8	58.9	0	0	0	0	111.3	D362 L363 G422 M423	D362-T440 WeakPolarHBondContact CA-O 3.42Å; D362-T440 WeakPolarHBondContact OD1-CB 3.41Å; D362-T440 PolarHBondContact OD1-N 3.38Å; D362-T440 PolarHBondContact OD1-OG1 2.8Å; L363-T440 PolarHBondContact N-O 3.11Å; G422-T440 WeakPolarHBondContact O-CA 3.44Å; M423-T440 HydrophobicContact CB-CG2 4.25Å
441	L	96.5	Very high	82.9	Confident	1 Å²	1	66 Å²	66	1%	0.005	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	126.9	167.4	-175.5	65.6	0	0	0	107.7	L363 V365 A371 F413 V416 D420 T421 G422 Y424 V443	L363-L441 HydrophobicContact CB-CD1 4.09Å; L363-L441 HydrophobicContact CD2-CD1 4.06Å; L363-L441 HydrophobicContact CG-CD1 4.16Å; V365-L441 HydrophobicContact CG1-CD1 3.83Å; A371-L441 HydrophobicContact CB-CD1 4.43Å; F413-L441 HydrophobicContact CD1-CD2 4.36Å; F413-L441 HydrophobicContact CE1-CD2 3.77Å; F413-L441 HydrophobicContact CE2-CD2 4.14Å; F413-L441 HydrophobicContact CZ-CD2 3.65Å; V416-L441 HydrophobicContact CG1-CD2 4.28Å; D420-L441 HydrophobicContact CB-CD2 4.13Å; T421-L441 CarbonylContact C-O 3.56Å; T421-L441 WeakPolarHBondContact CA-O 3.04Å; G422-L441 PolarHBondContact N-O 2.77Å; G422-L441 PolarHBondContact O-N 2.9Å; Y424-L441 HydrophobicContact CD2-CB 4.07Å; Y424-L441 HydrophobicContact CE2-CB 3.93Å; Y424-L441 HydrophobicContact CE2-CD2 4.1Å; L441-V443 HydrophobicContact CD2-CG2 4.46Å; L441-V443 HydrophobicContact CG-CG2 4.19Å
442	N	96	Very high	80.7	Confident	71 Å²	71	68.4 Å²	68.4	38%	0.38	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	118.8	-177.8	179.3	32.5	0	0	0	109.8	L363 N364 V365	L363-N442 PolarHBondContact O-N 2.03Å; N364-N442 WeakPolarHBondContact CA-O 3.2Å; N364-N442 WeakPolarHBondContact OD1-CB 3.33Å; N364-N442 PolarHBondContact OD1-ND2 2.94Å; V365-N442 PolarHBondContact N-O 2.82Å
443	V	94.1	Very high	78.6	Confident	9 Å²	9	75.1 Å²	75.1	6%	0.055	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	114.3	-168.3	-169.7	0	0	0	0	111	V365 E367 V416 V418 D420 T421 L441	V365-V443 HydrophobicContact CG1-CG2 4.13Å; V365-V443 CarbonylContact O-C 3.58Å; V365-V443 VanDerWaalsContact O-CA 3.3Å; V365-V443 WeakPolarHBondContact O-CA 3.43Å; E367-V443 HydrophobicContact CB-CG1 4.18Å; V416-V443 HydrophobicContact CG1-CB 4.23Å; V416-V443 HydrophobicContact CG1-CG1 3.78Å; V416-V443 HydrophobicContact CG1-CG2 3.37Å; V418-V443 HydrophobicContact CG2-CG1 4.38Å; D420-V443 HydrophobicContact CB-CG2 4.45Å; T421-V443 WeakPolarHBondContact OG1-CB 3.34Å; T421-V443 PolarHBondContact OG1-N 2.87Å; L441-V443 HydrophobicContact CD2-CG2 4.46Å; L441-V443 HydrophobicContact CG-CG2 4.19Å
444	T	91.8	Very high	76.4	Confident	70 Å²	70	84.1 Å²	84.1	43%	0.429	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	128.9	175.1	49.9	0	0	0	0	111	V365 T366 E367	V365-T444 PolarHBondContact O-N 2.81Å; V365-T444 PolarHBondContact O-OG1 2.84Å; T366-T444 CarbonylContact C-O 3.29Å; T366-T444 WeakPolarHBondContact CA-O 3.39Å; T366-T444 WeakPolarHBondContact CG2-OG1 3.45Å; E367-T444 PolarHBondContact N-O 3.43Å
445	A	84.4	Confident	74	Confident	63 Å²	63	83.7 Å²	83.7	52%	0.521	48%	0.483	S	S	.	.			trans	-61.2	138.5	177.4	0	0	0	0	0	111.2	V418 T447	V418-A445 HydrophobicContact CG2-CB 3.91Å; A445-T447 PolarHBondContact O-N 3.41Å
446	A	74.5	Confident	71.7	Confident	54 Å²	54	87.8 Å²	87.8	45%	0.446	51%	0.508	S	S	.	.			trans	-70.3	111.2	177.6	0	0	0	0	0	110.2	T448	A446-T448 VanDerWaalsContact C-N 3.34Å; A446-T448 PolarHBondContact O-N 3.39Å
447	T	66.4	Low	69.2	Low	127 Å²	127	90 Å²	90	78%	0.779	52%	0.521	S	S	*	.			trans	-73.2	85.3	-179.6	54.9	0	0	0	0	111.3	A445 T449	A445-T447 PolarHBondContact O-N 3.41Å; T447-T449 VanDerWaalsContact C-N 3.35Å; T447-T449 PolarHBondContact O-N 3.07Å
448	T	54.5	Low	66.8	Low	133 Å²	133	94.8 Å²	94.8	82%	0.816	55%	0.549	S	S	*	.			trans	-66.7	91.2	166.8	38.4	0	0	0	0	109.9	A446 P450	A446-T448 VanDerWaalsContact C-N 3.34Å; A446-T448 PolarHBondContact O-N 3.39Å; T448-P450 WeakPolarHBondContact O-CD 3.23Å
449	T	45.9	Very low	64.5	Low	90 Å²	90	97.4 Å²	97.4	55%	0.552	56%	0.562	S	S	*	*			trans	-68.9	122.1	170.5	44.2	0	0	0	0	109.5	T447 F451	T447-T449 VanDerWaalsContact C-N 3.35Å; T447-T449 PolarHBondContact O-N 3.07Å; T449-F451 HydrophobicContact CG2-CD2 4.28Å; T449-F451 HydrophobicContact CG2-CE2 3.94Å; T449-F451 PolarHBondContact O-N 3.32Å
450	P	42.8	Very low	61.9	Low	128 Å²	128	106.2 Å²	106.2	83%	0.831	60%	0.603	S	S	*	*			trans	-80.6	57.1	178.1	34.5	-35.9	0	0	0	110.9	T448 S452	T448-P450 WeakPolarHBondContact O-CD 3.23Å; P450-S452 PolarHBondContact O-N 3.26Å
451	F	44.9	Very low	59.5	Low	168 Å²	168	108.8 Å²	108.8	74%	0.737	62%	0.618	S	S	*	*			trans	-83.4	97.2	166.9	-66.9	-56.5	0	0	0	107.9	T449	T449-F451 HydrophobicContact CG2-CD2 4.28Å; T449-F451 HydrophobicContact CG2-CE2 3.94Å; T449-F451 PolarHBondContact O-N 3.32Å
452	S	41.9	Very low	56.9	Low	62 Å²	62	117.5 Å²	117.5	43%	0.434	66%	0.661	S	S	.	*				67.7	100.9	75.9	78.9	0	0	0	0	111.7	P450	P450-S452 PolarHBondContact O-N 3.26Å
453	Y	45.4	Very low	54.4	Low	199 Å²	199	122.5 Å²	122.5	78%	0.78	68%	0.682	S	S	*	*			trans	22	121.8	156.9	42.8	-96.5	0	0	0	118.3	S455	Y453-S455 PolarHBondContact O-N 2.94Å
454	F	46.1	Very low	52	Low	215 Å²	215	128.2 Å²	128.2	94%	0.943	72%	0.72	S	S	*	*			trans	-60.9	102.8	160.1	-76.2	-86.7	0	0	0	109.9	T456	F454-T456 PolarHBondContact O-N 3.44Å
455	S	45.1	Very low	49.4	Very low	94 Å²	94	129.3 Å²	129.3	66%	0.657	73%	0.73	S	S	*	*			trans	-72.7	119.8	167.7	38.1	0	0	0	0	109.6	Y453 V457	Y453-S455 PolarHBondContact O-N 2.94Å; S455-V457 PolarHBondContact O-N 3.48Å; S455-V457 VanDerWaalsContact O-N 3.14Å
456	T	48.8	Very low	47.3	Very low	131 Å²	131	134.3 Å²	134.3	80%	0.804	74%	0.743	S	S	*	*			trans	-68.1	107.9	174.3	48.2	0	0	0	0	110	F454 T458	F454-T456 PolarHBondContact O-N 3.44Å; T456-T458 PolarHBondContact O-N 2.87Å
457	V	44.5	Very low	45.7	Very low	123 Å²	123	138.4 Å²	138.4	75%	0.745	76%	0.757	S	S	*	*			trans	-79	110.4	171.1	179	0	0	0	0	108.8	S455 V459	S455-V457 PolarHBondContact O-N 3.48Å; S455-V457 VanDerWaalsContact O-N 3.14Å; V457-V459 PolarHBondContact O-N 3.4Å
458	T	47.6	Very low	44.4	Very low	123 Å²	123	141.1 Å²	141.1	76%	0.755	76%	0.761	S	S	*	*			trans	-70.3	121.3	167.6	45.7	0	0	0	0	109.6	T456	T456-T458 PolarHBondContact O-N 2.87Å
459	V	48.7	Very low	43.6	Very low	117 Å²	117	139 Å²	139	71%	0.709	76%	0.757	S	S	*	*			trans	-99.8	108.3	170.1	178	0	0	0	0	108	V457 T461	V457-V459 PolarHBondContact O-N 3.4Å; V459-T461 HydrophobicContact CG1-CG2 4.14Å
460	E	43.1	Very low	43	Very low	187 Å²	187	145.8 Å²	145.8	87%	0.874	77%	0.773	S	S	*	*			trans	-81.5	117.1	167.7	-66.2	-176.4	157.4	0	0	109.1
461	T	47.6	Very low	42.6	Very low	120 Å²	120	145 Å²	145	74%	0.736	77%	0.765	S	S	*	*			trans	-118.8	115	164.5	45.9	0	0	0	0	108.6	V459	V459-T461 HydrophobicContact CG1-CG2 4.14Å
462	M	40.8	Very low	42.1	Very low	184 Å²	184	143 Å²	143	91%	0.906	77%	0.768	S	S	*	*			trans	-64.3	133.2	179.9	-65.3	167.5	61.6	0	0	111.3
463	E	43.4	Very low	42	Very low	175 Å²	175	146.5 Å²	146.5	82%	0.818	78%	0.781	S	S	*	*			trans	-74	136.7	166.2	-61.7	-178.5	139.5	0	0	110.5	S465	E463-S465 PolarHBondContact O-N 3.21Å
464	P	43.1	Very low	41.8	Very low	129 Å²	129	142.3 Å²	142.3	84%	0.838	77%	0.772	S	S	*	*			trans	-83.2	94	151.2	32.3	-26.7	0	0	0	108.4
465	S	37.7	Very low	41.6	Very low	93 Å²	93	138.6 Å²	138.6	65%	0.65	76%	0.762	S	S	*	*			trans	-67.2	137.8	169.9	57.6	0	0	0	0	111.3	E463	E463-S465 PolarHBondContact O-N 3.21Å
466	Q	41.1	Very low	41.5	Very low	169 Å²	169	140.8 Å²	140.8	79%	0.79	77%	0.771	S	S	*	*			trans	-177.1	129.9	138.9	-101.7	161.8	5.7	0	0	111.1
467	D	40.6	Very low	41.2	Very low	140 Å²	140	137.6 Å²	137.6	75%	0.749	76%	0.764	S	S	*	*				42.5	136.8	123.9	-48.4	-16	0	0	0	119.1
468	E	39.3	Very low	41.4	Very low	183 Å²	183	137.9 Å²	137.9	86%	0.855	77%	0.769	S	S	*	*			cis	-163	-170.6	7.8	-134.1	-172.8	165	0	0	111.3
469	A	37	Very low	41.4	Very low	89 Å²	89	137.3 Å²	137.3	74%	0.736	77%	0.765	S	S	*	*			trans	58.6	89.7	152.3	0	0	0	0	0	121
470	R	33.2	Very low	41	Very low	233 Å²	233	137.6 Å²	137.6	88%	0.879	77%	0.769	S	S	*	*				27.1	142.8	123.7	-110.3	-177.6	176.4	160.9	-1.7	122.1
471	T	34.3	Very low	40.9	Very low	111 Å²	111	133.1 Å²	133.1	68%	0.681	76%	0.755	S	S	*	*			trans	75.5	121.3	146.4	40.6	0	0	0	0	121.6
472	T	35.7	Very low	40.6	Very low	127 Å²	127	133.6 Å²	133.6	78%	0.779	76%	0.757	S	S	*	*			trans	64.2	136.9	141.4	58.7	0	0	0	0	117.9
473	D	38.4	Very low	40.3	Very low	134 Å²	134	129.8 Å²	129.8	72%	0.717	74%	0.741	S	S	*	*			cis	-168.1	-175.6	15.6	-154	-6.5	0	0	0	111.7
474	N	42.2	Very low	39.8	Very low	112 Å²	112	132.1 Å²	132.1	60%	0.599	74%	0.742	S	S	*	*			trans	75.9	103.8	149.6	-72.7	-55.5	0	0	0	122.5
475	N	41.3	Very low	39.4	Very low	137 Å²	137	135.3 Å²	135.3	73%	0.733	75%	0.746	S	S	*	*				96.5	127.9	114.8	-76.2	-29.9	0	0	0	124.4
476	V	42.8	Very low	39.2	Very low	139 Å²	139	136.7 Å²	136.7	84%	0.842	75%	0.751	S	S	*	*			trans	65.4	131.6	150.6	-179.1	0	0	0	0	116.2
477	G	43.9	Very low	38.8	Very low	64 Å²	64	135.3 Å²	135.3	66%	0.66	75%	0.754	S	S	*	*			cis	117.6	162.8	15.5	0	0	0	0	0	110.7
478	P	48.4	Very low	38.3	Very low	130 Å²	130	135.9 Å²	135.9	84%	0.844	76%	0.757	S	S	*	*			cis	-125.6	-175.3	6.4	42.7	-28.1	0	0	0	114.9
479	T	45.8	Very low	38.1	Very low	111 Å²	111	133.5 Å²	133.5	68%	0.681	76%	0.755	S	S	*	*			trans	-102.1	-179	173.8	57.9	0	0	0	0	112	V481	T479-V481 HydrophobicContact CG2-CG2 4.34Å; T479-V481 WeakPolarHBondContact OG1-CG2 3.47Å
480	P	42.2	Very low	37.8	Very low	122 Å²	122	135.9 Å²	135.9	79%	0.792	76%	0.76	S	S	*	*				-136.7	148.5	82.4	39.2	-24.5	0	0	0	112.6
481	V	40.3	Very low	37.9	Very low	94 Å²	94	130.2 Å²	130.2	57%	0.57	75%	0.751	S	S	*	*			cis	67.1	106.5	41.9	-169.1	0	0	0	0	111	T479	T479-V481 HydrophobicContact CG2-CG2 4.34Å; T479-V481 WeakPolarHBondContact OG1-CG2 3.47Å
482	V	41.3	Very low	37.7	Very low	129 Å²	129	130.6 Å²	130.6	78%	0.782	76%	0.759	S	S	*	*				-170	143.6	92	153.1	0	0	0	0	107.2
483	D	33.6	Very low	37.7	Very low	105 Å²	105	131.8 Å²	131.8	56%	0.561	76%	0.76	S	S	*	*			cis	-159.5	-155.6	-20.2	-90.4	-26.6	0	0	0	106.9
484	W	34.5	Very low	37.5	Very low	224 Å²	224	131.6 Å²	131.6	85%	0.848	76%	0.763	S	S	*	*			trans	-108.9	158.4	-173.2	-56.8	-100.5	0	0	0	114.2
485	E	34.2	Very low	37.2	Very low	196 Å²	196	131.8 Å²	131.8	92%	0.916	77%	0.771	S	S	*	*				-173.9	163.4	113.4	-105.9	-175.7	180	0	0	114.6
486	T	32.4	Very low	36.8	Very low	122 Å²	122	134 Å²	134	75%	0.748	78%	0.777	S	S	*	*			trans	-90	141	-176.7	47.8	0	0	0	0	113.9
487	T	32.9	Very low	36.2	Very low	139 Å²	139	132 Å²	132	85%	0.853	77%	0.768	S	S	*	*				-178.4	168.6	119.8	23.6	0	0	0	0	113.4
488	N	31	Very low	35.8	Very low	153 Å²	153	135.5 Å²	135.5	82%	0.818	78%	0.777	S	S	*	*			trans	-61.9	145.2	177.8	-49.8	-47.9	0	0	0	113.1
489	V	35.1	Very low	34.9	Very low	133 Å²	133	140 Å²	140	81%	0.806	78%	0.778	S	S	*	*				-179.6	148.8	121.8	144.2	0	0	0	0	111.5	T491	V489-T491 PolarHBondContact O-N 2.9Å
490	T	30.5	Very low	34.5	Very low	138 Å²	138	140.1 Å²	140.1	85%	0.847	78%	0.783	S	S	*	*			trans	-68	117.3	179.3	-43.9	0	0	0	0	113.5
491	T	35	Very low	33.9	Very low	114 Å²	114	139.7 Å²	139.7	70%	0.699	78%	0.778	S	S	*	*			trans	-157.1	128.4	154.2	6.7	0	0	0	0	112.6	V489	V489-T491 PolarHBondContact O-N 2.9Å
492	S	30.5	Very low	33.6	Very low	120 Å²	120	142.5 Å²	142.5	84%	0.839	79%	0.785	S	S	*	*			trans	-90.2	119.6	164.6	54.7	0	0	0	0	109.9
493	L	34.6	Very low	33.2	Very low	152 Å²	152	143.7 Å²	143.7	80%	0.796	78%	0.78	S	S	*	*			trans	-135.7	131.1	179	-79.4	170.4	0	0	0	112.7
494	T	35.3	Very low	33	Very low	129 Å²	129	144.5 Å²	144.5	79%	0.791	79%	0.789	S	S	*	*			trans	-74.6	158.3	165.3	54.1	0	0	0	0	111.6
495	P	35.2	Very low	32.9	Very low	116 Å²	116	142.6 Å²	142.6	75%	0.753	79%	0.787	S	S	*	*				-146.3	146.3	124.7	32.6	-15.1	0	0	0	117.2
496	Q	32.9	Very low	32.9	Very low	185 Å²	185	138 Å²	138	86%	0.864	77%	0.772	S	S	*	*				12.9	157.1	117.7	-70	-179.7	12.4	0	0	119.9
497	S	31.2	Very low	33.2	Very low	95 Å²	95	139.9 Å²	139.9	66%	0.664	78%	0.776	S	S	*	*			cis	179.4	157.5	-5.2	166.9	0	0	0	0	110
498	T	35.6	Very low	33.2	Very low	139 Å²	139	138.5 Å²	138.5	85%	0.853	77%	0.77	S	S	*	*			trans	174.9	137	149.4	27.8	0	0	0	0	108.8
499	R	29.5	Very low	33.3	Very low	224 Å²	224	137.8 Å²	137.8	85%	0.845	77%	0.77	S	S	*	*			cis	94.7	92.4	8.4	-162.9	-168.5	177.2	-178.5	0.1	118
500	S	36.3	Very low	33.3	Very low	114 Å²	114	136.9 Å²	136.9	80%	0.797	77%	0.765	S	S	*	*			trans	-172	-179.2	142.3	57.6	0	0	0	0	112.2
501	T	30.3	Very low	33.3	Very low	112 Å²	112	136.2 Å²	136.2	69%	0.687	76%	0.756	S	S	*	*				-165.2	163.2	-124	38.3	0	0	0	0	113.5
502	E	34.5	Very low	33.2	Very low	153 Å²	153	137.4 Å²	137.4	72%	0.715	76%	0.757	S	S	*	*			trans	71.4	164.9	163	-67.8	-173.7	133.1	0	0	117.9
503	K	31.5	Very low	33.1	Very low	155 Å²	155	138.5 Å²	138.5	67%	0.674	75%	0.753	S	S	*	*			cis	-156.2	131.3	-1.2	-118.8	150.4	-177.2	148.8	0	107.6
504	T	30.5	Very low	32.9	Very low	122 Å²	122	137 Å²	137	75%	0.748	76%	0.755	S	S	*	*				91.4	149.1	75.9	-41.7	0	0	0	0	116.5
505	F	32.4	Very low	32.9	Very low	183 Å²	183	134.2 Å²	134.2	80%	0.803	75%	0.753	S	S	*	*			trans	118.3	110.7	149.4	-112.4	-101.3	0	0	0	122.6
506	T	34.5	Very low	32.9	Very low	100 Å²	100	136.4 Å²	136.4	61%	0.613	76%	0.756	S	S	*	*			trans	18.4	159.1	148.3	68.4	0	0	0	0	126.1
507	I	37.9	Very low	33.6	Very low	161 Å²	161	131.4 Å²	131.4	83%	0.826	74%	0.74	S	S	*	*			trans	161.9	148.4	135	-90.9	156.4	0	0	0	111.6
508	P	32.7	Very low	34.6	Very low	111 Å²	111	129.3 Å²	129.3	72%	0.721	73%	0.733	S	S	*	*			cis	-129.4	-167.7	-28.2	38.3	-18.7	0	0	0	113.9
509	V	32.9	Very low	35.6	Very low	137 Å²	137	129.1 Å²	129.1	83%	0.83	73%	0.726	S	S	*	*			trans	-130.4	143.1	165.1	172.1	0	0	0	0	109.3
510	T	36	Very low	37.3	Very low	114 Å²	114	123.9 Å²	123.9	70%	0.699	71%	0.714	S	S	*	*			trans	-144.7	109.6	168.1	51.4	0	0	0	0	108.6
511	D	30	Very low	38.6	Very low	124 Å²	124	122.6 Å²	122.6	66%	0.663	70%	0.696	S	S	*	*				81.5	100.2	96.8	-65	-34.6	0	0	0	112.9
512	I	32.1	Very low	40.4	Very low	139 Å²	139	121.5 Å²	121.5	71%	0.713	69%	0.689	S	S	*	*				71	97.5	71.5	-61.4	168.9	0	0	0	112.3
513	N	28.4	Very low	42.1	Very low	143 Å²	143	118.9 Å²	118.9	77%	0.765	68%	0.678	S	S	*	*				-175.9	156.4	113.6	-107.5	-55.7	0	0	0	115.3
514	S	31.4	Very low	44.2	Very low	120 Å²	120	116.9 Å²	116.9	84%	0.839	67%	0.669	S	S	*	*			trans	65.9	147	161.6	75.3	0	0	0	0	119.3
515	G	35.2	Very low	46.5	Very low	71 Å²	71	114.6 Å²	114.6	73%	0.732	66%	0.655	S	S	*	*			trans	97.6	75.3	169.9	0	0	0	0	0	115.3	P517	G515-P517 VanDerWaalsContact O-CD 3.3Å; G515-P517 WeakPolarHBondContact O-CD 3.18Å
516	I	36.2	Very low	48.7	Very low	162 Å²	162	109 Å²	109	83%	0.831	64%	0.636	S	S	*	*			trans	-82.1	118.1	174.8	-63.4	166	0	0	0	110.4
517	P	47.2	Very low	50.9	Low	81 Å²	81	110.7 Å²	110.7	53%	0.526	64%	0.635	S	S	.	*			trans	-96.8	89.1	160.3	29.7	-13.7	0	0	0	107.8	G515 I519 E521	G515-P517 VanDerWaalsContact O-CD 3.3Å; G515-P517 WeakPolarHBondContact O-CD 3.18Å; P517-I519 PolarHBondContact O-N 3.48Å; P517-E521 HydrophobicContact CB-CB 4.05Å; P517-E521 HydrophobicContact CB-CG 3.85Å; P517-E521 HydrophobicContact CG-CB 4.21Å; P517-E521 HydrophobicContact CG-CG 4.4Å
518	G	51.2	Low	53.1	Low	50 Å²	50	108.4 Å²	108.4	52%	0.515	62%	0.623	S	S	.	*			trans	-62.1	114.8	-160.5	0	0	0	0	0	114.9	D520	G518-D520 PolarHBondContact O-N 2.91Å
519	I	56.9	Low	55.6	Low	136 Å²	136	108.2 Å²	108.2	70%	0.697	62%	0.615	S	S	*	*	S	Bend	trans	65.5	-49.3	169.3	-57.4	175.7	0	0	0	115.4	P517 V522 M523	P517-I519 PolarHBondContact O-N 3.48Å; I519-V522 PolarHBondContact O-N 3.36Å; I519-M523 PolarHBondContact O-N 2.96Å
520	D	64.8	Low	58.2	Low	113 Å²	113	106.4 Å²	106.4	60%	0.604	60%	0.6	S	S	*	*	H	α-helix	trans	-68.7	-40.6	-170.6	-100	-21.4	0	0	0	114.2	G518 V522 M523 K524	G518-D520 PolarHBondContact O-N 2.91Å; D520-V522 VanDerWaalsContact C-N 3.32Å; D520-V522 PolarHBondContact O-N 3.39Å; D520-M523 PolarHBondContact O-N 2.87Å; D520-K524 WeakPolarHBondContact O-CG 3Å; D520-K524 PolarHBondContact O-N 3.17Å
521	E	64.3	Low	60.6	Low	87 Å²	87	102.9 Å²	102.9	41%	0.407	59%	0.585	S	S	.	*	H	α-helix	trans	-65.8	-36.3	175.2	-78.6	-57.9	123	0	0	112	P517 K524 T525	P517-E521 HydrophobicContact CB-CB 4.05Å; P517-E521 HydrophobicContact CB-CG 3.85Å; P517-E521 HydrophobicContact CG-CB 4.21Å; P517-E521 HydrophobicContact CG-CG 4.4Å; E521-K524 WeakPolarHBondContact OE1-CD 3.35Å; E521-K524 WeakPolarHBondContact OE1-CE 3.27Å; E521-K524 IonicContact OE1-NZ 2.71Å; E521-K524 PolarHBondContact OE1-NZ 2.91Å; E521-T525 WeakPolarHBondContact O-CB 3.39Å; E521-T525 PolarHBondContact O-N 3.2Å; E521-T525 PolarHBondContact O-OG1 3.11Å
522	V	68.2	Low	63.4	Low	90 Å²	90	100.3 Å²	100.3	55%	0.545	58%	0.576	S	S	.	*	H	α-helix	trans	-65	-44.9	171.8	-175.4	0	0	0	0	109.5	I519 D520 K524 T525 T526	I519-V522 PolarHBondContact O-N 3.36Å; D520-V522 VanDerWaalsContact C-N 3.32Å; D520-V522 PolarHBondContact O-N 3.39Å; V522-K524 PolarHBondContact O-N 2.87Å; V522-T525 PolarHBondContact O-N 2.97Å; V522-T526 WeakPolarHBondContact O-CB 3.23Å; V522-T526 PolarHBondContact O-N 2.9Å; V522-T526 PolarHBondContact O-OG1 2.84Å
523	M	70.4	Confident	66.2	Low	98 Å²	98	100.5 Å²	100.5	48%	0.483	57%	0.572	S	S	.	*	H	α-helix	trans	-65.7	-35.3	179.9	-152.3	-166.4	-123.3	0	0	112.7	I519 D520 K527	I519-M523 PolarHBondContact O-N 2.96Å; D520-M523 PolarHBondContact O-N 2.87Å; M523-K527 WeakPolarHBondContact O-CB 3.26Å; M523-K527 WeakPolarHBondContact O-CD 3.02Å; M523-K527 WeakPolarHBondContact O-CG 3.43Å; M523-K527 PolarHBondContact O-N 2.75Å; M523-K527 PolarHBondContact SD-NZ 2.87Å; M523-K527 VanDerWaalsContact SD-NZ 3.36Å
524	K	75.8	Confident	69.3	Low	112 Å²	112	97.4 Å²	97.4	49%	0.487	56%	0.558	S	S	.	*	H	α-helix	trans	-62.2	-52.3	169.2	-71.9	175.7	-168.9	168.3	0	111.1	D520 E521 V522 T526 K527 I528	D520-K524 WeakPolarHBondContact O-CG 3Å; D520-K524 PolarHBondContact O-N 3.17Å; E521-K524 WeakPolarHBondContact OE1-CD 3.35Å; E521-K524 WeakPolarHBondContact OE1-CE 3.27Å; E521-K524 IonicContact OE1-NZ 2.71Å; E521-K524 PolarHBondContact OE1-NZ 2.91Å; V522-K524 PolarHBondContact O-N 2.87Å; K524-T526 PolarHBondContact O-N 2.84Å; K524-K527 WeakPolarHBondContact O-CB 3.08Å; K524-K527 PolarHBondContact O-N 2.92Å; K524-K527 VanDerWaalsContact O-N 3.16Å; K524-I528 WeakPolarHBondContact O-CG1 3.34Å; K524-I528 PolarHBondContact O-N 2.85Å
525	T	77.5	Confident	71.9	Confident	74 Å²	74	94.1 Å²	94.1	45%	0.454	54%	0.538	S	S	.	.	H	α-helix	trans	-61.6	-43.7	-177	-55.2	0	0	0	0	111.5	E521 V522 I528 I529	E521-T525 WeakPolarHBondContact O-CB 3.39Å; E521-T525 PolarHBondContact O-N 3.2Å; E521-T525 PolarHBondContact O-OG1 3.11Å; V522-T525 PolarHBondContact O-N 2.97Å; T525-I528 PolarHBondContact O-N 2.96Å; T525-I529 HydrophobicContact CG2-CD1 4.02Å; T525-I529 WeakPolarHBondContact O-CG1 3Å; T525-I529 PolarHBondContact O-N 2.8Å
526	T	78.9	Confident	74.6	Confident	65 Å²	65	96.3 Å²	96.3	40%	0.399	53%	0.532	S	S	.	.	H	α-helix	trans	-64.8	-39.6	174.6	-57.7	0	0	0	0	112.2	V522 K524 I528 I529 I530	V522-T526 WeakPolarHBondContact O-CB 3.23Å; V522-T526 PolarHBondContact O-N 2.9Å; V522-T526 PolarHBondContact O-OG1 2.84Å; K524-T526 PolarHBondContact O-N 2.84Å; T526-I528 VanDerWaalsContact C-N 3.33Å; T526-I528 PolarHBondContact O-N 2.88Å; T526-I529 PolarHBondContact O-N 2.78Å; T526-I530 HydrophobicContact CG2-CD1 3.74Å; T526-I530 HydrophobicContact CG2-CG1 4.31Å; T526-I530 WeakPolarHBondContact O-CB 3.44Å; T526-I530 VanDerWaalsContact O-CG1 3.28Å; T526-I530 WeakPolarHBondContact O-CG1 2.98Å; T526-I530 PolarHBondContact O-N 3.3Å
527	K	81.6	Confident	77.2	Confident	137 Å²	137	91.7 Å²	91.7	60%	0.596	51%	0.512	S	S	*	.	H	α-helix	trans	-61.6	-39.2	173	-78.3	166.8	-177.6	166.6	0	112	M523 K524 G531	M523-K527 WeakPolarHBondContact O-CB 3.26Å; M523-K527 WeakPolarHBondContact O-CD 3.02Å; M523-K527 WeakPolarHBondContact O-CG 3.43Å; M523-K527 PolarHBondContact O-N 2.75Å; M523-K527 PolarHBondContact SD-NZ 2.87Å; M523-K527 VanDerWaalsContact SD-NZ 3.36Å; K524-K527 WeakPolarHBondContact O-CB 3.08Å; K524-K527 PolarHBondContact O-N 2.92Å; K524-K527 VanDerWaalsContact O-N 3.16Å; K527-G531 PolarHBondContact O-N 2.98Å
528	I	84.4	Confident	79.3	Confident	112 Å²	112	92.7 Å²	92.7	57%	0.574	51%	0.512	S	S	*	.	H	α-helix	trans	-65.4	-48.3	175.3	-67.1	163.8	0	0	0	110.7	K524 T525 T526 I530 G531 C532	K524-I528 WeakPolarHBondContact O-CG1 3.34Å; K524-I528 PolarHBondContact O-N 2.85Å; T525-I528 PolarHBondContact O-N 2.96Å; T526-I528 VanDerWaalsContact C-N 3.33Å; T526-I528 PolarHBondContact O-N 2.88Å; I528-I530 PolarHBondContact O-N 2.89Å; I528-G531 PolarHBondContact O-N 2.03Å; I528-C532 PolarHBondContact O-N 2.87Å; I528-C532 PolarHBondContact O-SG 2.8Å
529	I	85.2	Confident	81.2	Confident	108 Å²	108	94.3 Å²	94.3	55%	0.554	51%	0.507	S	S	*	.	H	α-helix	trans	-62	-44.9	179.7	-68	166.6	0	0	0	111.4	T525 T526 C532 F533	T525-I529 HydrophobicContact CG2-CD1 4.02Å; T525-I529 WeakPolarHBondContact O-CG1 3Å; T525-I529 PolarHBondContact O-N 2.8Å; T526-I529 PolarHBondContact O-N 2.78Å; I529-C532 PolarHBondContact O-N 2.9Å; I529-F533 PolarHBondContact O-N 2.64Å
530	I	86.4	Confident	82.7	Confident	99 Å²	99	90.3 Å²	90.3	51%	0.508	49%	0.494	S	S	.	.	H	α-helix	trans	-63.3	-43.2	175.4	-67.8	171.2	0	0	0	110.4	T526 I528 C532 F533 V534	T526-I530 HydrophobicContact CG2-CD1 3.74Å; T526-I530 HydrophobicContact CG2-CG1 4.31Å; T526-I530 WeakPolarHBondContact O-CB 3.44Å; T526-I530 VanDerWaalsContact O-CG1 3.28Å; T526-I530 WeakPolarHBondContact O-CG1 2.98Å; T526-I530 PolarHBondContact O-N 3.3Å; I528-I530 PolarHBondContact O-N 2.89Å; I530-C532 PolarHBondContact O-N 3.31Å; I530-F533 PolarHBondContact O-N 2.71Å; I530-V534 HydrophobicContact CG2-CG2 4.23Å; I530-V534 WeakPolarHBondContact O-CB 3.47Å; I530-V534 WeakPolarHBondContact O-CG2 3.4Å; I530-V534 PolarHBondContact O-N 3.26Å
531	G	86.8	Confident	84	Confident	39 Å²	39	87.3 Å²	87.3	40%	0.402	49%	0.486	S	S	.	.	H	α-helix	trans	-57.1	-47.7	175.4	0	0	0	0	0	112.6	K527 I528 V534 A535	K527-G531 PolarHBondContact O-N 2.98Å; I528-G531 PolarHBondContact O-N 2.03Å; G531-V534 PolarHBondContact O-N 3.18Å; G531-A535 VanDerWaalsContact O-CB 3.29Å; G531-A535 WeakPolarHBondContact O-CB 3.39Å; G531-A535 PolarHBondContact O-N 3.4Å
532	C	89.3	Confident	85.2	Confident	70 Å²	70	85.9 Å²	85.9	47%	0.473	48%	0.483	S	S	.	.	H	α-helix	trans	-63.1	-42.1	175.4	-71.1	0	0	0	0	112.5	I528 I529 I530 A535 I536	I528-C532 PolarHBondContact O-N 2.87Å; I528-C532 PolarHBondContact O-SG 2.8Å; I529-C532 PolarHBondContact O-N 2.9Å; I530-C532 PolarHBondContact O-N 3.31Å; C532-A535 PolarHBondContact O-N 2.93Å; C532-I536 WeakPolarHBondContact O-CB 3.38Å; C532-I536 WeakPolarHBondContact O-CD1 3.26Å; C532-I536 VanDerWaalsContact O-CG1 3.23Å; C532-I536 WeakPolarHBondContact O-CG1 3.5Å; C532-I536 PolarHBondContact O-N 2.87Å
533	F	90.5	Very high	86.2	Confident	143 Å²	143	85.7 Å²	85.7	63%	0.627	48%	0.477	S	S	*	.	H	α-helix	trans	-67.4	-41.2	179.1	-168.4	-93.9	0	0	0	112.4	I529 I530 T537	I529-F533 PolarHBondContact O-N 2.64Å; I530-F533 PolarHBondContact O-N 2.71Å; F533-T537 HydrophobicContact CD1-CG2 4.15Å; F533-T537 HydrophobicContact CE1-CG2 3.77Å; F533-T537 HydrophobicContact CZ-CG2 4.01Å; F533-T537 WeakPolarHBondContact O-CB 3.1Å; F533-T537 WeakPolarHBondContact O-CG2 3.29Å; F533-T537 PolarHBondContact O-N 3.44Å; F533-T537 PolarHBondContact O-OG1 2.03Å
534	V	92.3	Very high	87.1	Confident	78 Å²	78	86.9 Å²	86.9	47%	0.473	48%	0.484	S	S	.	.	H	α-helix	trans	-64.3	-42.2	173.2	172.2	0	0	0	0	110.8	I530 G531 T537 L538	I530-V534 HydrophobicContact CG2-CG2 4.23Å; I530-V534 WeakPolarHBondContact O-CB 3.47Å; I530-V534 WeakPolarHBondContact O-CG2 3.4Å; I530-V534 PolarHBondContact O-N 3.26Å; G531-V534 PolarHBondContact O-N 3.18Å; V534-T537 WeakPolarHBondContact CA-OG1 3.32Å; V534-T537 PolarHBondContact O-OG1 2.94Å; V534-L538 WeakPolarHBondContact O-CB 3.37Å; V534-L538 PolarHBondContact O-N 3.16Å
535	A	87	Confident	87.7	Confident	51 Å²	51	85.4 Å²	85.4	42%	0.421	49%	0.485	S	S	.	.	H	α-helix	trans	-60.8	-52.1	174.7	0	0	0	0	0	111.7	G531 C532 T537 L538 M539	G531-A535 VanDerWaalsContact O-CB 3.29Å; G531-A535 WeakPolarHBondContact O-CB 3.39Å; G531-A535 PolarHBondContact O-N 3.4Å; C532-A535 PolarHBondContact O-N 2.93Å; A535-T537 PolarHBondContact O-N 2.76Å; A535-L538 PolarHBondContact O-N 3.09Å; A535-M539 WeakPolarHBondContact O-CB 3.47Å; A535-M539 WeakPolarHBondContact O-CG 3.36Å; A535-M539 PolarHBondContact O-N 2.71Å
536	I	91.3	Very high	88.1	Confident	117 Å²	117	85.3 Å²	85.3	60%	0.6	48%	0.481	S	S	*	.	H	α-helix	trans	-60.5	-44	-178.7	-69.4	164.4	0	0	0	111.4	C532 M539 A540	C532-I536 WeakPolarHBondContact O-CB 3.38Å; C532-I536 WeakPolarHBondContact O-CD1 3.26Å; C532-I536 VanDerWaalsContact O-CG1 3.23Å; C532-I536 WeakPolarHBondContact O-CG1 3.5Å; C532-I536 PolarHBondContact O-N 2.87Å; I536-M539 PolarHBondContact O-N 3.41Å; I536-A540 WeakPolarHBondContact O-CB 3.39Å; I536-A540 PolarHBondContact O-N 3.14Å
537	T	91.8	Very high	88.3	Confident	65 Å²	65	87.3 Å²	87.3	40%	0.399	48%	0.484	S	S	.	.	H	α-helix	trans	-68.9	-37.2	178.8	50.4	0	0	0	0	112.8	F533 V534 A535 A541	F533-T537 HydrophobicContact CD1-CG2 4.15Å; F533-T537 HydrophobicContact CE1-CG2 3.77Å; F533-T537 HydrophobicContact CZ-CG2 4.01Å; F533-T537 WeakPolarHBondContact O-CB 3.1Å; F533-T537 WeakPolarHBondContact O-CG2 3.29Å; F533-T537 PolarHBondContact O-N 3.44Å; F533-T537 PolarHBondContact O-OG1 2.03Å; V534-T537 WeakPolarHBondContact CA-OG1 3.32Å; V534-T537 PolarHBondContact O-OG1 2.94Å; A535-T537 PolarHBondContact O-N 2.76Å; T537-A541 WeakPolarHBondContact O-CB 3.39Å; T537-A541 PolarHBondContact O-N 3.08Å
538	L	91	Very high	88.5	Confident	103 Å²	103	88 Å²	88	54%	0.539	48%	0.484	S	S	.	.	H	α-helix	trans	-68.6	-42	174.8	-167.5	154	0	0	0	111.4	V534 A535 A541 V542	V534-L538 WeakPolarHBondContact O-CB 3.37Å; V534-L538 PolarHBondContact O-N 3.16Å; A535-L538 PolarHBondContact O-N 3.09Å; L538-A541 PolarHBondContact O-N 3.25Å; L538-V542 HydrophobicContact CD2-CG2 3.96Å; L538-V542 WeakPolarHBondContact O-CB 3.38Å; L538-V542 WeakPolarHBondContact O-CG2 3.37Å; L538-V542 PolarHBondContact O-N 3.27Å
539	M	90.4	Very high	88.4	Confident	83 Å²	83	89.4 Å²	89.4	41%	0.409	49%	0.486	S	S	.	.	H	α-helix	trans	-61.1	-45.1	174.2	-68.4	-72.8	-121.1	0	0	111.5	A535 I536 A541 V542 M543 I640	A535-M539 WeakPolarHBondContact O-CB 3.47Å; A535-M539 WeakPolarHBondContact O-CG 3.36Å; A535-M539 PolarHBondContact O-N 2.71Å; I536-M539 PolarHBondContact O-N 3.41Å; M539-A541 PolarHBondContact O-N 2.8Å; M539-V542 PolarHBondContact O-N 3.41Å; M539-M543 WeakPolarHBondContact O-CB 3.43Å; M539-M543 WeakPolarHBondContact O-CG 3.47Å; M539-M543 PolarHBondContact O-N 2.97Å; M539-I640 HydrophobicContact CE-CB 4.39Å; M539-I640 HydrophobicContact CE-CD1 4.17Å; M539-I640 HydrophobicContact CE-CG1 4.12Å; M539-I640 HydrophobicContact CE-CG2 3.53Å; M539-I640 HydrophobicContact SD-CD1 3.98Å; M539-I640 HydrophobicContact SD-CG2 3.71Å
540	A	89.4	Confident	88.2	Confident	52 Å²	52	89.8 Å²	89.8	43%	0.43	49%	0.487	S	S	.	.	H	α-helix	trans	-62	-41	175.2	0	0	0	0	0	112.2	I536 M543 L544	I536-A540 WeakPolarHBondContact O-CB 3.39Å; I536-A540 PolarHBondContact O-N 3.14Å; A540-M543 PolarHBondContact O-N 2.79Å; A540-L544 WeakPolarHBondContact O-CG 3.27Å; A540-L544 PolarHBondContact O-N 3.2Å
541	A	90.9	Very high	87.9	Confident	51 Å²	51	89.5 Å²	89.5	42%	0.421	48%	0.48	S	S	.	.	H	α-helix	trans	-65.2	-41.7	175.2	0	0	0	0	0	112.3	T537 L538 M539 L544 V545	T537-A541 WeakPolarHBondContact O-CB 3.39Å; T537-A541 PolarHBondContact O-N 3.08Å; L538-A541 PolarHBondContact O-N 3.25Å; M539-A541 PolarHBondContact O-N 2.8Å; A541-L544 PolarHBondContact O-N 3.34Å; A541-V545 WeakPolarHBondContact O-CG2 3.42Å; A541-V545 PolarHBondContact O-N 3.37Å
542	V	90.2	Very high	87.6	Confident	57 Å²	57	92.8 Å²	92.8	35%	0.345	48%	0.483	S	S	.	.	H	α-helix	trans	-61.5	-46.3	174.1	166.7	0	0	0	0	110.7	L538 M539 L544 V545 I546	L538-V542 HydrophobicContact CD2-CG2 3.96Å; L538-V542 WeakPolarHBondContact O-CB 3.38Å; L538-V542 WeakPolarHBondContact O-CG2 3.37Å; L538-V542 PolarHBondContact O-N 3.27Å; M539-V542 PolarHBondContact O-N 3.41Å; V542-L544 PolarHBondContact O-N 2.94Å; V542-V545 CarbonylContact O-C 3.58Å; V542-V545 PolarHBondContact O-N 3.04Å; V542-V545 VanDerWaalsContact O-N 3.16Å; V542-I546 HydrophobicContact CG1-CD1 3.69Å; V542-I546 HydrophobicContact CG1-CG1 4.34Å; V542-I546 VanDerWaalsContact O-CG1 3.32Å; V542-I546 WeakPolarHBondContact O-CG1 3.06Å; V542-I546 PolarHBondContact O-N 3.46Å
543	M	88.2	Confident	86.8	Confident	86 Å²	86	94.9 Å²	94.9	42%	0.424	49%	0.486	S	S	.	.	H	α-helix	trans	-62.7	-40.6	177.5	-74.6	-64.4	174.5	0	0	112.7	M539 A540 V545 I546 F547 I640	M539-M543 WeakPolarHBondContact O-CB 3.43Å; M539-M543 WeakPolarHBondContact O-CG 3.47Å; M539-M543 PolarHBondContact O-N 2.97Å; A540-M543 PolarHBondContact O-N 2.79Å; M543-V545 VanDerWaalsContact C-N 3.35Å; M543-V545 PolarHBondContact O-N 3.37Å; M543-I546 PolarHBondContact O-N 3.13Å; M543-I546 HydrophobicContact SD-CD1 4.35Å; M543-F547 WeakPolarHBondContact O-CB 3.31Å; M543-F547 PolarHBondContact O-N 2.94Å; M543-I640 HydrophobicContact CE-CG2 3.67Å
544	L	90.2	Very high	85.7	Confident	122 Å²	122	90.6 Å²	90.6	64%	0.639	47%	0.467	S	S	*	.	H	α-helix	trans	-64.2	-37.8	173.2	-73	170.1	0	0	0	112.3	A540 A541 V542 Y548	A540-L544 WeakPolarHBondContact O-CG 3.27Å; A540-L544 PolarHBondContact O-N 3.2Å; A541-L544 PolarHBondContact O-N 3.34Å; V542-L544 PolarHBondContact O-N 2.94Å; L544-Y548 VanDerWaalsContact O-CB 3.26Å; L544-Y548 WeakPolarHBondContact O-CB 3.25Å; L544-Y548 PolarHBondContact O-N 3.21Å
545	V	88.8	Confident	84.6	Confident	81 Å²	81	91.4 Å²	91.4	49%	0.491	47%	0.466	S	S	.	.	H	α-helix	trans	-69.7	-37.3	175	169.5	0	0	0	0	111.8	A541 V542 M543 K549	A541-V545 WeakPolarHBondContact O-CG2 3.42Å; A541-V545 PolarHBondContact O-N 3.37Å; V542-V545 CarbonylContact O-C 3.58Å; V542-V545 PolarHBondContact O-N 3.04Å; V542-V545 VanDerWaalsContact O-N 3.16Å; M543-V545 VanDerWaalsContact C-N 3.35Å; M543-V545 PolarHBondContact O-N 3.37Å; V545-K549 HydrophobicContact CG1-CD 4.45Å; V545-K549 WeakPolarHBondContact O-CB 3.15Å; V545-K549 WeakPolarHBondContact O-CG 3.32Å; V545-K549 PolarHBondContact O-N 2.96Å
546	I	85.3	Confident	83.2	Confident	73 Å²	73	97.3 Å²	97.3	37%	0.374	48%	0.477	S	S	.	.	H	α-helix	trans	-64	-50.8	173.1	-70.9	167.8	0	0	0	109.8	V542 M543 Y548 K549 M550	V542-I546 HydrophobicContact CG1-CD1 3.69Å; V542-I546 HydrophobicContact CG1-CG1 4.34Å; V542-I546 VanDerWaalsContact O-CG1 3.32Å; V542-I546 WeakPolarHBondContact O-CG1 3.06Å; V542-I546 PolarHBondContact O-N 3.46Å; M543-I546 PolarHBondContact O-N 3.13Å; M543-I546 HydrophobicContact SD-CD1 4.35Å; I546-Y548 VanDerWaalsContact C-N 3.35Å; I546-Y548 PolarHBondContact O-N 3.26Å; I546-K549 CarbonylContact O-C 3.29Å; I546-K549 WeakPolarHBondContact O-CB 3.37Å; I546-K549 PolarHBondContact O-N 3.16Å; I546-K549 VanDerWaalsContact O-N 3.14Å; I546-M550 HydrophobicContact CG2-CG 4.36Å; I546-M550 HydrophobicContact CG2-SD 3.77Å; I546-M550 WeakPolarHBondContact O-CB 3.42Å; I546-M550 WeakPolarHBondContact O-CG 3.33Å; I546-M550 PolarHBondContact O-N 3.43Å
547	F	82.8	Confident	81.4	Confident	107 Å²	107	97.3 Å²	97.3	47%	0.469	48%	0.475	S	S	.	.	H	α-helix	trans	-60.2	-42.4	178.5	-170.8	-99.4	0	0	0	112.1	M543 M550 R551	M543-F547 WeakPolarHBondContact O-CB 3.31Å; M543-F547 PolarHBondContact O-N 2.94Å; F547-M550 PolarHBondContact O-N 3.04Å; F547-R551 PolarHBondContact O-N 2.86Å
548	Y	86.6	Confident	79.4	Confident	150 Å²	150	98 Å²	98	59%	0.588	48%	0.476	S	S	*	.	H	α-helix	trans	-65.3	-40.7	174.2	-178.4	-101.3	0	0	0	112.5	L544 I546 K552	L544-Y548 VanDerWaalsContact O-CB 3.26Å; L544-Y548 WeakPolarHBondContact O-CB 3.25Å; L544-Y548 PolarHBondContact O-N 3.21Å; I546-Y548 VanDerWaalsContact C-N 3.35Å; I546-Y548 PolarHBondContact O-N 3.26Å; Y548-K552 HydrophobicContact CE1-CD 4.17Å; Y548-K552 WeakPolarHBondContact O-CB 3.38Å; Y548-K552 PolarHBondContact O-N 3.28Å
549	K	82.2	Confident	77.4	Confident	142 Å²	142	100.3 Å²	100.3	62%	0.617	48%	0.483	S	S	*	.	H	α-helix	trans	-62.4	-44.4	172.5	-83.6	-178.2	175.3	-179	0	111.5	V545 I546 K552 Q553	V545-K549 HydrophobicContact CG1-CD 4.45Å; V545-K549 WeakPolarHBondContact O-CB 3.15Å; V545-K549 WeakPolarHBondContact O-CG 3.32Å; V545-K549 PolarHBondContact O-N 2.96Å; I546-K549 CarbonylContact O-C 3.29Å; I546-K549 WeakPolarHBondContact O-CB 3.37Å; I546-K549 PolarHBondContact O-N 3.16Å; I546-K549 VanDerWaalsContact O-N 3.14Å; K549-K552 CarbonylContact O-C 3.55Å; K549-K552 PolarHBondContact O-N 2.82Å; K549-Q553 VanDerWaalsContact O-CB 3.27Å; K549-Q553 WeakPolarHBondContact O-CB 3.43Å; K549-Q553 PolarHBondContact O-N 2.65Å
550	M	80.3	Confident	74.9	Confident	117 Å²	117	104 Å²	104	58%	0.576	50%	0.5	S	S	*	.	H	α-helix	trans	-61.2	-51.7	177.1	-74.2	171.3	62.5	0	0	111.5	I546 F547 K552 Q553 H554	I546-M550 HydrophobicContact CG2-CG 4.36Å; I546-M550 HydrophobicContact CG2-SD 3.77Å; I546-M550 WeakPolarHBondContact O-CB 3.42Å; I546-M550 WeakPolarHBondContact O-CG 3.33Å; I546-M550 PolarHBondContact O-N 3.43Å; F547-M550 PolarHBondContact O-N 3.04Å; M550-K552 VanDerWaalsContact C-N 3.25Å; M550-K552 PolarHBondContact O-N 2.81Å; M550-Q553 PolarHBondContact O-N 2.94Å; M550-Q553 VanDerWaalsContact O-N 3.07Å; M550-H554 PolarHBondContact O-N 2.96Å
551	R	81.1	Confident	72.3	Confident	93 Å²	93	105.6 Å²	105.6	35%	0.351	51%	0.512	S	S	.	.	H	α-helix	trans	-61.5	-34.5	178	-162.3	166	179.4	125	-2.8	111.7	D225 F547 H555	D225-R551 IonicContact OD2-CZ 3.74Å; D225-R551 IonicContact OD2-NH1 2.75Å; D225-R551 PolarHBondContact OD2-NH1 2.93Å; D225-R551 IonicContact OD2-NH2 2.73Å; D225-R551 PolarHBondContact OD2-NH2 3.36Å; F547-R551 PolarHBondContact O-N 2.86Å; R551-H555 PolarHBondContact O-CD2 2.85Å; R551-H555 PolarHBondContact O-N 2.76Å
552	K	79.1	Confident	69.5	Low	107 Å²	107	108.6 Å²	108.6	47%	0.465	53%	0.528	S	S	.	.	H	α-helix	trans	-74.7	-30.3	173.9	-170.3	169.4	-173.3	169	0	114	Y548 K549 M550 R556	Y548-K552 HydrophobicContact CE1-CD 4.17Å; Y548-K552 WeakPolarHBondContact O-CB 3.38Å; Y548-K552 PolarHBondContact O-N 3.28Å; K549-K552 CarbonylContact O-C 3.55Å; K549-K552 PolarHBondContact O-N 2.82Å; M550-K552 VanDerWaalsContact C-N 3.25Å; M550-K552 PolarHBondContact O-N 2.81Å; K552-R556 WeakPolarHBondContact O-CG 3.3Å; K552-R556 PolarHBondContact O-N 3.26Å
553	Q	72.9	Confident	66.6	Low	115 Å²	115	112.8 Å²	112.8	54%	0.537	55%	0.553	S	S	.	*	H	α-helix	trans	-73.4	-42.5	174.5	179.4	167.7	-25.9	0	0	110.6	K549 M550 H555 R556 Q557	K549-Q553 VanDerWaalsContact O-CB 3.27Å; K549-Q553 WeakPolarHBondContact O-CB 3.43Å; K549-Q553 PolarHBondContact O-N 2.65Å; M550-Q553 PolarHBondContact O-N 2.94Å; M550-Q553 VanDerWaalsContact O-N 3.07Å; Q553-H555 PolarHBondContact O-N 3.35Å; Q553-R556 WeakPolarHBondContact O-CA 3.46Å; Q553-R556 WeakPolarHBondContact O-CB 3.46Å; Q553-R556 PolarHBondContact O-N 2.78Å; Q553-Q557 PolarHBondContact O-N 3.2Å
554	H	68.8	Low	64	Low	52 Å²	52	119.3 Å²	119.3	24%	0.241	57%	0.573	C	S	.	*	H	α-helix	trans	-60	-46.7	174.8	-167.2	-143.8	0	0	0	111.5	W249 E271 M550 R556 Q557 N558	W249-H554 AromaticContact CZ2-CE1 3.97Å; E271-H554 IonicContact OE1-CE1 3.32Å; E271-H554 IonicContact OE2-NE2 3.36Å; M550-H554 PolarHBondContact O-N 2.96Å; H554-R556 PolarHBondContact O-N 2.75Å; H554-Q557 PolarHBondContact O-N 2.79Å; H554-N558 PolarHBondContact O-N 2.86Å; H554-N558 PolarHBondContact O-ND2 3.41Å
555	H	68.1	Low	61	Low	95 Å²	95	119.5 Å²	119.5	44%	0.44	58%	0.58	S	S	.	*	H	α-helix	trans	-60.1	-26.9	171.2	-89.5	-57.6	0	0	0	114.3	R551 Q553 H559	R551-H555 PolarHBondContact O-CD2 2.85Å; R551-H555 PolarHBondContact O-N 2.76Å; Q553-H555 PolarHBondContact O-N 3.35Å; H555-H559 PolarHBondContact O-CD2 2.66Å
556	R	57.8	Low	58.2	Low	176 Å²	176	121.5 Å²	121.5	66%	0.664	59%	0.592	S	S	*	*	H	α-helix	trans	-82.7	-36.8	177.9	-85.6	-178.8	157.5	-165.4	-9.3	113.3	K552 Q553 H554 N558 H559 H560	K552-R556 WeakPolarHBondContact O-CG 3.3Å; K552-R556 PolarHBondContact O-N 3.26Å; Q553-R556 WeakPolarHBondContact O-CA 3.46Å; Q553-R556 WeakPolarHBondContact O-CB 3.46Å; Q553-R556 PolarHBondContact O-N 2.78Å; H554-R556 PolarHBondContact O-N 2.75Å; R556-N558 VanDerWaalsContact C-N 3.34Å; R556-H559 PolarHBondContact O-N 3.48Å; R556-H559 VanDerWaalsContact O-N 3.15Å; R556-H560 PolarHBondContact O-ND1 3.18Å
557	Q	53.3	Low	55.3	Low	117 Å²	117	126.6 Å²	126.6	55%	0.547	61%	0.614	S	S	.	*	H	α-helix	trans	-64.3	-40	177	-74.8	173.8	-56	0	0	111.1	Q553 H554 H559 H560	Q553-Q557 PolarHBondContact O-N 3.2Å; H554-Q557 PolarHBondContact O-N 2.79Å; Q557-H559 PolarHBondContact O-N 3.31Å; Q557-H560 PolarHBondContact O-N 2.79Å
558	N	50	Low	52.9	Low	78 Å²	78	127.9 Å²	127.9	42%	0.417	62%	0.624	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.8	1	174.7	-63.2	-19.5	0	0	0	114.4	H554 R556	H554-N558 PolarHBondContact O-N 2.86Å; H554-N558 PolarHBondContact O-ND2 3.41Å; R556-N558 VanDerWaalsContact C-N 3.34Å
559	H	48.8	Very low	50.1	Low	152 Å²	152	127.6 Å²	127.6	70%	0.704	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.3	0.5	172	-83.1	-62	0	0	0	114.2	H555 R556 Q557	H555-H559 PolarHBondContact O-CD2 2.66Å; R556-H559 PolarHBondContact O-N 3.48Å; R556-H559 VanDerWaalsContact O-N 3.15Å; Q557-H559 PolarHBondContact O-N 3.31Å
560	H	38	Very low	47.5	Very low	162 Å²	162	127.8 Å²	127.8	75%	0.75	64%	0.639	S	S	*	*			trans	-135.6	59.9	-177.9	-69.6	74.6	0	0	0	111.9	R556 Q557	R556-H560 PolarHBondContact O-ND1 3.18Å; Q557-H560 PolarHBondContact O-N 2.79Å
561	A	35.1	Very low	45.3	Very low	84 Å²	84	127.8 Å²	127.8	69%	0.694	65%	0.646	S	S	*	*	S	Bend	trans	-98.3	144.9	158.8	0	0	0	0	0	109	T563	A561-T563 PolarHBondContact O-N 3.37Å
562	P	32.7	Very low	42.8	Very low	115 Å²	115	131 Å²	131	75%	0.747	67%	0.67	S	S	*	*			trans	-71	131	-166.3	26.8	-34.7	0	0	0	113.2	R564	P562-R564 PolarHBondContact O-N 3.46Å; P562-R564 VanDerWaalsContact O-N 3.1Å
563	T	29.4	Very low	40.7	Very low	144 Å²	144	133.4 Å²	133.4	88%	0.883	69%	0.688	S	S	*	*			trans	-63.6	105.9	167.7	38.8	0	0	0	0	110.7	A561	A561-T563 PolarHBondContact O-N 3.37Å
564	R	33.5	Very low	38.6	Very low	223 Å²	223	136.3 Å²	136.3	84%	0.842	70%	0.701	S	S	*	*			trans	-112.3	92.8	166.2	-88.4	-175.9	163	160.4	-4.5	110.6	P562	P562-R564 PolarHBondContact O-N 3.46Å; P562-R564 VanDerWaalsContact O-N 3.1Å
565	T	25.6	Very low	36.8	Very low	126 Å²	126	141.7 Å²	141.7	77%	0.773	73%	0.73	S	S	*	*			trans	31.3	111.1	144.5	53.7	0	0	0	0	118.1
566	V	31.5	Very low	34.9	Very low	124 Å²	124	143.6 Å²	143.6	75%	0.752	75%	0.749	S	S	*	*			trans	-125.6	100.1	144.5	-164.9	0	0	0	0	107.5	I568	V566-I568 HydrophobicContact CG1-CD1 4.13Å; V566-I568 HydrophobicContact CG1-CG1 3.59Å; V566-I568 PolarHBondContact O-N 3.14Å
567	E	24.5	Very low	33.4	Very low	180 Å²	180	138.4 Å²	138.4	84%	0.841	75%	0.75	S	S	*	*			trans	-77.6	102.1	162	-71	-176.5	139.4	0	0	107.3
568	I	32.8	Very low	32.3	Very low	133 Å²	133	140 Å²	140	68%	0.682	76%	0.763	S	S	*	*			trans	-95.6	97.1	162.3	-53	-172.5	0	0	0	106.6	V566 N570	V566-I568 HydrophobicContact CG1-CD1 4.13Å; V566-I568 HydrophobicContact CG1-CG1 3.59Å; V566-I568 PolarHBondContact O-N 3.14Å; I568-N570 PolarHBondContact O-N 2.67Å
569	I	27.4	Very low	31.3	Very low	145 Å²	145	142.7 Å²	142.7	74%	0.744	78%	0.782	S	S	*	*			trans	-66.8	121.4	165.5	-61.6	165.8	0	0	0	106.9
570	N	27.8	Very low	30.6	Very low	145 Å²	145	141.2 Å²	141.2	78%	0.775	79%	0.786	S	S	*	*			trans	-150.7	91.9	164.6	-110.6	-4.9	0	0	0	110.1	I568	I568-N570 PolarHBondContact O-N 2.67Å
571	V	33.3	Very low	30.3	Very low	118 Å²	118	142.1 Å²	142.1	72%	0.715	79%	0.793	S	S	*	*			trans	15.3	115.6	147.5	-173.1	0	0	0	0	117.1	D573	V571-D573 HydrophobicContact CG1-CB 4.44Å
572	D	29.5	Very low	29.9	Very low	161 Å²	161	145.6 Å²	145.6	86%	0.861	79%	0.794	S	S	*	*			trans	-72.8	132.4	149.6	-62.5	-72.6	0	0	0	109.3
573	D	35.2	Very low	30	Very low	157 Å²	157	145.3 Å²	145.3	84%	0.84	80%	0.795	S	S	*	*			trans	-160.4	158.7	151.1	-121.4	-29.6	0	0	0	111.4	V571	V571-D573 HydrophobicContact CG1-CB 4.44Å
574	E	28.2	Very low	30	Very low	175 Å²	175	146.3 Å²	146.3	82%	0.818	79%	0.79	S	S	*	*			trans	-84.9	155	-173.3	-57.5	-177.8	116	0	0	113.4
575	I	30.5	Very low	29.9	Very low	166 Å²	166	143.7 Å²	143.7	85%	0.851	79%	0.792	S	S	*	*				170.1	148.1	124	-86	157.7	0	0	0	112.3
576	T	28	Very low	30.2	Very low	134 Å²	134	143.1 Å²	143.1	82%	0.822	79%	0.79	S	S	*	*			trans	-67.8	156.6	-173.6	53.9	0	0	0	0	117.2
577	G	27.3	Very low	30.4	Very low	68 Å²	68	145.3 Å²	145.3	70%	0.701	79%	0.794	S	S	*	*				127.9	128	128.5	0	0	0	0	0	119.9
578	D	29	Very low	30.8	Very low	151 Å²	151	142.5 Å²	142.5	81%	0.807	79%	0.791	S	S	*	*			trans	53.7	108.3	138	-63.8	-5.6	0	0	0	124.5
579	T	28.5	Very low	30.7	Very low	133 Å²	133	140.3 Å²	140.3	82%	0.816	79%	0.793	S	S	*	*			trans	68.3	153.2	133.4	55.4	0	0	0	0	122.1
580	P	34.2	Very low	31.2	Very low	122 Å²	122	140.8 Å²	140.8	79%	0.792	80%	0.796	S	S	*	*			trans	-102.6	154.4	-173.4	39.1	-33.8	0	0	0	114.7
581	M	31.7	Very low	31.3	Very low	180 Å²	180	141.8 Å²	141.8	89%	0.887	80%	0.796	S	S	*	*			trans	-155	164.9	152.1	-120	-170.1	79.3	0	0	113.2
582	E	27.8	Very low	31.2	Very low	157 Å²	157	144.9 Å²	144.9	73%	0.734	80%	0.802	S	S	*	*			trans	-88.3	141	-170	-59	150.6	107.2	0	0	114.2
583	S	33.4	Very low	31.3	Very low	110 Å²	110	144.6 Å²	144.6	77%	0.769	80%	0.796	S	S	*	*			trans	-171.3	113.6	135.4	57.2	0	0	0	0	109.1
584	H	30.9	Very low	31.4	Very low	165 Å²	165	144.7 Å²	144.7	76%	0.764	79%	0.791	S	S	*	*				58.4	99.2	74.2	-80.9	-72.4	0	0	0	115.5
585	L	31.8	Very low	31.6	Very low	168 Å²	168	144 Å²	144	88%	0.88	79%	0.792	S	S	*	*				158.6	161	121.9	-81.4	163.3	0	0	0	111.1
586	P	32	Very low	31.4	Very low	113 Å²	113	143.2 Å²	143.2	73%	0.734	79%	0.789	S	S	*	*			trans	-119.1	179	-151.1	41.4	-29.6	0	0	0	116.7
587	M	35.1	Very low	31.6	Very low	170 Å²	170	144.2 Å²	144.2	84%	0.837	78%	0.784	S	S	*	*			trans	-53.6	142.1	176.8	-169.3	-169.7	-49.2	0	0	115.5
588	P	32.7	Very low	31.8	Very low	121 Å²	121	150.5 Å²	150.5	79%	0.786	79%	0.788	S	S	*	*			trans	-99.4	150.1	150.8	35.9	-29.4	0	0	0	111.5
589	A	30.7	Very low	31.9	Very low	88 Å²	88	149.2 Å²	149.2	73%	0.727	78%	0.781	S	S	*	*			trans	-120.4	151.8	176.5	0	0	0	0	0	111.4
590	I	37.7	Very low	31.9	Very low	155 Å²	155	147.8 Å²	147.8	80%	0.795	78%	0.776	S	S	*	*			trans	-145.9	105	170.6	-52.5	-178.8	0	0	0	103.7
591	E	30.1	Very low	31.8	Very low	165 Å²	165	153.3 Å²	153.3	77%	0.771	78%	0.783	S	S	*	*				58.4	107.7	86	-64.9	-172.2	145.7	0	0	112.1
592	H	31.5	Very low	31.7	Very low	184 Å²	184	153.7 Å²	153.7	85%	0.852	78%	0.78	S	S	*	*				93.1	153.6	69.4	-98.9	-68.8	0	0	0	113.7
593	E	31.2	Very low	31.8	Very low	155 Å²	155	151.6 Å²	151.6	72%	0.724	78%	0.783	S	S	*	*			trans	69.3	151.6	-174.5	-40.6	-154.3	148.4	0	0	115.6
594	H	37	Very low	32	Very low	159 Å²	159	151.1 Å²	151.1	74%	0.736	78%	0.777	S	S	*	*			cis	-123.1	140.3	1.5	-60.3	-81.3	0	0	0	109.7
595	L	31.6	Very low	32.2	Very low	160 Å²	160	152.6 Å²	152.6	84%	0.838	78%	0.782	S	S	*	*				83.4	136.8	69.3	-140.3	88.7	0	0	0	115
596	N	28.3	Very low	32	Very low	149 Å²	149	150.7 Å²	150.7	80%	0.797	77%	0.772	S	S	*	*			trans	-70	140.1	-171	-60.5	-50.3	0	0	0	115.2
597	H	31	Very low	32.1	Very low	155 Å²	155	152.8 Å²	152.8	72%	0.718	77%	0.772	S	S	*	*			trans	-174.3	150.9	151.1	-103	63.3	0	0	0	106.7
598	Y	32	Very low	31.8	Very low	200 Å²	200	149.5 Å²	149.5	78%	0.784	76%	0.761	S	S	*	*			cis	-123.1	143.4	5.6	-102.7	-105.8	0	0	0	109.1
599	N	30.7	Very low	31.6	Very low	125 Å²	125	149.3 Å²	149.3	67%	0.668	76%	0.758	S	S	*	*				67.7	106.6	67.7	-105.5	-22.6	0	0	0	117.1
600	S	28.5	Very low	31.5	Very low	102 Å²	102	151.3 Å²	151.3	71%	0.713	76%	0.762	S	S	*	*			trans	36.5	121.8	138.8	-170.8	0	0	0	0	121.5
601	Y	32.7	Very low	31.2	Very low	239 Å²	239	149.4 Å²	149.4	94%	0.937	76%	0.757	S	S	*	*			trans	-137.9	139	142.6	-104.3	-84.2	0	0	0	111.1
602	K	29	Very low	31.2	Very low	188 Å²	188	147.8 Å²	147.8	82%	0.817	75%	0.754	S	S	*	*			trans	-153.7	145.8	179.4	-156.2	175.8	-171.6	177.1	0	110.9
603	S	29.6	Very low	31.1	Very low	113 Å²	113	144.6 Å²	144.6	79%	0.79	75%	0.747	S	S	*	*			trans	65.7	172.9	166.4	79.9	0	0	0	0	116.8
604	P	38.8	Very low	31.2	Very low	100 Å²	100	143.5 Å²	143.5	65%	0.649	75%	0.745	S	S	*	*				-135.8	-177.2	-89.9	40.4	-22.6	0	0	0	114.1
605	F	33.7	Very low	30.8	Very low	196 Å²	196	142.7 Å²	142.7	86%	0.86	75%	0.746	S	S	*	*				178.2	163.9	124.8	-112.1	-84	0	0	0	113.3
606	N	28.5	Very low	30.8	Very low	127 Å²	127	139.8 Å²	139.8	68%	0.679	74%	0.739	S	S	*	*			trans	-76.4	147.1	171.8	-60.6	-26.5	0	0	0	111.7
607	H	34.2	Very low	31.1	Very low	157 Å²	157	139.4 Å²	139.4	73%	0.727	74%	0.736	S	S	*	*				176.7	127.9	101.8	-104.3	-77.3	0	0	0	116.2
608	T	28.5	Very low	31.2	Very low	101 Å²	101	140.3 Å²	140.3	62%	0.62	74%	0.74	S	S	*	*			trans	22.3	110.9	141.3	50.9	0	0	0	0	122.1
609	T	28.5	Very low	31.3	Very low	118 Å²	118	135.3 Å²	135.3	72%	0.724	73%	0.734	S	S	*	*				68.3	147.7	126.7	58.8	0	0	0	0	123
610	T	29.3	Very low	31.5	Very low	130 Å²	130	134.3 Å²	134.3	80%	0.798	74%	0.737	S	S	*	*			trans	68	145.1	157	53.4	0	0	0	0	117.6
611	V	30.1	Very low	31.8	Very low	115 Å²	115	135.2 Å²	135.2	70%	0.697	74%	0.738	S	S	*	*			cis	-156.5	167.4	-15.7	112.4	0	0	0	0	108.7
612	N	29.8	Very low	32.1	Very low	131 Å²	131	132.7 Å²	132.7	70%	0.701	73%	0.734	S	S	*	*			trans	-5.2	148.6	159.8	-43.1	-16.2	0	0	0	118
613	T	29.9	Very low	32.3	Very low	117 Å²	117	130.3 Å²	130.3	72%	0.718	73%	0.726	S	S	*	*			cis	-176.9	179.8	36.1	-18.7	0	0	0	0	111.5
614	I	33.8	Very low	32.6	Very low	131 Å²	131	130.4 Å²	130.4	67%	0.672	72%	0.724	S	S	*	*			trans	77.8	107.4	146.2	-74.2	159.2	0	0	0	117.8
615	N	28.8	Very low	32.2	Very low	142 Å²	142	132.7 Å²	132.7	76%	0.759	73%	0.73	S	S	*	*				50.1	144.9	118.3	-53.5	-6.7	0	0	0	120.1
616	S	30.6	Very low	31.9	Very low	99 Å²	99	130 Å²	130	69%	0.692	72%	0.724	S	S	*	*			cis	-175.5	-166.3	2.2	40.7	0	0	0	0	110.2
617	I	35.2	Very low	32	Very low	142 Å²	142	132 Å²	132	73%	0.728	73%	0.732	S	S	*	*			trans	115.9	103.6	151.5	-62.5	164.9	0	0	0	116.6
618	H	33.3	Very low	31.6	Very low	174 Å²	174	134.1 Å²	134.1	81%	0.806	73%	0.734	S	S	*	*			trans	63.9	150.3	147.4	-74.1	-127.6	0	0	0	119.7
619	S	34.7	Very low	31.7	Very low	94 Å²	94	138.1 Å²	138.1	66%	0.657	75%	0.748	S	S	*	*			cis	-160.8	152.6	-6.6	41.7	0	0	0	0	112.4
620	S	33.2	Very low	31.6	Very low	105 Å²	105	139 Å²	139	73%	0.734	75%	0.749	S	S	*	*			trans	10.4	145.5	153.2	58.8	0	0	0	0	120.9
621	V	36.4	Very low	31.8	Very low	121 Å²	121	137.8 Å²	137.8	73%	0.733	75%	0.745	S	S	*	*				-161.7	145	67.7	160.5	0	0	0	0	114
622	H	38.1	Very low	31.7	Very low	185 Å²	185	141.2 Å²	141.2	86%	0.856	75%	0.751	S	S	*	*			trans	60	121	163.7	-80.3	-59.5	0	0	0	124.3
623	E	33.3	Very low	31.8	Very low	139 Å²	139	141.8 Å²	141.8	65%	0.65	75%	0.754	S	S	*	*			trans	-91.5	170.9	157.1	-143.8	-159.2	133.2	0	0	109.9	L625	E623-L625 WeakPolarHBondContact OE1-CA 3.43Å; E623-L625 PolarHBondContact OE1-N 2.71Å
624	P	36.2	Very low	32	Very low	114 Å²	114	142.9 Å²	142.9	74%	0.74	76%	0.755	S	S	*	*				-148.2	138.6	75.7	36.6	-16.6	0	0	0	118.6
625	L	31.1	Very low	31.9	Very low	148 Å²	148	143.3 Å²	143.3	78%	0.775	76%	0.763	S	S	*	*			trans	67.4	116.7	136.3	-66.8	168.5	0	0	0	121.8	E623	E623-L625 WeakPolarHBondContact OE1-CA 3.43Å; E623-L625 PolarHBondContact OE1-N 2.71Å
626	L	26.9	Very low	32.1	Very low	140 Å²	140	145.3 Å²	145.3	73%	0.733	77%	0.768	S	S	*	*			trans	-70.3	154.3	160.3	-69.2	115.7	0	0	0	112.9
627	I	29.7	Very low	32.2	Very low	168 Å²	168	147.5 Å²	147.5	86%	0.862	77%	0.768	S	S	*	*			trans	-110.5	123.8	139	-65.1	179.3	0	0	0	107.8
628	R	26.6	Very low	32.2	Very low	203 Å²	203	147 Å²	147	77%	0.766	77%	0.771	S	S	*	*			trans	-125.6	102.7	-177.9	-169.5	-174.2	-165.5	-178.3	7.4	109
629	M	30.2	Very low	32	Very low	185 Å²	185	146.7 Å²	146.7	91%	0.911	77%	0.77	S	S	*	*			trans	-92.4	134.7	166.8	-77.5	-176.5	68.1	0	0	109.8
630	N	27.1	Very low	31.9	Very low	137 Å²	137	149.4 Å²	149.4	73%	0.733	78%	0.776	S	S	*	*			trans	-138.1	110.2	-160.6	-168.2	51.1	0	0	0	110.5
631	S	32.1	Very low	31.8	Very low	104 Å²	104	151.6 Å²	151.6	73%	0.727	78%	0.778	S	S	*	*			trans	-160.3	121.9	153.8	-150.9	0	0	0	0	106.2
632	K	28.2	Very low	31.6	Very low	187 Å²	187	153.2 Å²	153.2	81%	0.813	78%	0.78	S	S	*	*				44.5	94.5	72.3	-88.2	-169.6	171	-174.2	0	112.1
633	D	33.5	Very low	31.2	Very low	142 Å²	142	151.4 Å²	151.4	76%	0.759	78%	0.776	S	S	*	*				-153.1	126.1	128.3	-102.5	-38.2	0	0	0	111.7
634	N	33	Very low	31.1	Very low	140 Å²	140	152.2 Å²	152.2	75%	0.749	78%	0.783	S	S	*	*			trans	30.2	112.6	150.8	-46.9	-43.1	0	0	0	121
635	V	32.5	Very low	30.7	Very low	140 Å²	140	154.6 Å²	154.6	85%	0.848	79%	0.786	S	S	*	*			trans	-15.5	126.9	131.8	178.7	0	0	0	0	114.5
636	Q	33	Very low	30.7	Very low	184 Å²	184	155 Å²	155	86%	0.86	79%	0.787	S	S	*	*			trans	-150.1	136.1	138.2	-147.5	168.5	14.7	0	0	111.1
637	E	32.5	Very low	31	Very low	145 Å²	145	156.1 Å²	156.1	68%	0.678	79%	0.791	S	S	*	*			trans	-69.9	146.2	169.8	-66.7	171.2	87.6	0	0	110.7	Q639	E637-Q639 PolarHBondContact OE1-NE2 3.46Å
638	T	35.3	Very low	31.1	Very low	132 Å²	132	155.2 Å²	155.2	81%	0.81	79%	0.785	S	S	*	*			trans	-130.7	100.4	153.7	44.4	0	0	0	0	108.5	I640	T638-I640 PolarHBondContact O-N 3.43Å
639	Q	28	Very low	31.5	Very low	168 Å²	168	151.2 Å²	151.2	79%	0.785	79%	0.787	S	S	*	*			trans	-77	104.9	172	-65.1	178.5	6.4	0	0	109.1	E637	E637-Q639 PolarHBondContact OE1-NE2 3.46Å
640	I	32.4	Very low	31.6	Very low	150 Å²	150	148.1 Å²	148.1	77%	0.769	78%	0.776	S	S	*	*			trans	-142.4	0	166.1	-60.3	-176.7	0	0	0	108.3	M539 M543 T638	M539-I640 HydrophobicContact CE-CB 4.39Å; M539-I640 HydrophobicContact CE-CD1 4.17Å; M539-I640 HydrophobicContact CE-CG1 4.12Å; M539-I640 HydrophobicContact CE-CG2 3.53Å; M539-I640 HydrophobicContact SD-CD1 3.98Å; M539-I640 HydrophobicContact SD-CG2 3.71Å; M543-I640 HydrophobicContact CE-CG2 3.67Å; T638-I640 PolarHBondContact O-N 3.43Å

Retrieved 640 of 640 residues in 182.8 ms (Link to these results)

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