A0A3B3UIV3_9TELE Loading...

Leucine rich repeat containing 4.2

AlphaFold DB , UniProt , Accession A0A3B3UIV3, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 666 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	41.9	Very low	34.1	Very low	239 Å²	239	136.6 Å²	136.6	100%	1.177	78%	0.779	S	S	*	*				0	118.9	0	-70.4	157.2	70.4	0	0	107.4
2	S	42.1	Very low	34	Very low	124 Å²	124	134.7 Å²	134.7	87%	0.867	77%	0.772	S	S	*	*			trans	-101	145.6	167.1	-47.4	0	0	0	0	108.4
3	P	49.3	Very low	33.9	Very low	113 Å²	113	140.8 Å²	140.8	73%	0.734	78%	0.775	S	S	*	*				-136.1	167	117.4	14.4	7.3	0	0	0	110.6
4	L	31.6	Very low	33.6	Very low	151 Å²	151	141.7 Å²	141.7	79%	0.791	78%	0.778	S	S	*	*			cis	-147.8	140.5	-12.7	-99.6	152	0	0	0	104
5	A	31.1	Very low	33.6	Very low	77 Å²	77	140.1 Å²	140.1	64%	0.636	77%	0.774	S	S	*	*				55.3	145.9	91.3	0	0	0	0	0	114.9
6	Q	31.8	Very low	33.3	Very low	166 Å²	166	137.3 Å²	137.3	78%	0.776	78%	0.775	S	S	*	*			cis	-158.7	138.9	18.7	-139	148.6	-9.4	0	0	111.3
7	V	29.3	Very low	33.1	Very low	116 Å²	116	138.4 Å²	138.4	70%	0.703	78%	0.778	S	S	*	*				59.5	117.8	124.2	167.7	0	0	0	0	119.8
8	N	28.1	Very low	33.3	Very low	140 Å²	140	139.2 Å²	139.2	75%	0.749	78%	0.779	S	S	*	*				81.9	158	82.1	-135.8	10	0	0	0	112.3
9	V	30.9	Very low	33	Very low	90 Å²	90	136.8 Å²	136.8	55%	0.545	78%	0.779	S	S	.	*			cis	-155.6	163.4	18	-149.3	0	0	0	0	111.3
10	Q	28.7	Very low	33	Very low	178 Å²	178	136.6 Å²	136.6	83%	0.832	78%	0.78	S	S	*	*			trans	68.2	159.9	143.5	-92	152.3	-14.6	0	0	121.1
11	S	30.7	Very low	33.3	Very low	109 Å²	109	136.5 Å²	136.5	76%	0.762	78%	0.782	S	S	*	*			cis	-141.6	173	-7.6	67.8	0	0	0	0	112.7
12	T	32.7	Very low	32.8	Very low	113 Å²	113	129.4 Å²	129.4	69%	0.693	76%	0.756	S	S	*	*			trans	-110.5	-179.8	176.3	39.9	0	0	0	0	112.5
13	W	32.6	Very low	32.3	Very low	215 Å²	215	130.5 Å²	130.5	81%	0.814	75%	0.751	S	S	*	*			trans	77.8	113.4	170	-56.5	87.1	0	0	0	118.5
14	N	30.3	Very low	31.5	Very low	153 Å²	153	132.7 Å²	132.7	82%	0.818	75%	0.753	S	S	*	*				-165.3	165.5	88.2	-110	-23.3	0	0	0	113.2
15	T	33	Very low	31.6	Very low	117 Å²	117	131.4 Å²	131.4	72%	0.718	75%	0.752	S	S	*	*			trans	-112.6	139.3	-170.7	50.1	0	0	0	0	114.3
16	A	29.1	Very low	32.5	Very low	95 Å²	95	133.3 Å²	133.3	79%	0.785	76%	0.758	S	S	*	*			trans	45.5	124.9	144.9	0	0	0	0	0	121.6
17	L	30.2	Very low	32.5	Very low	157 Å²	157	130.1 Å²	130.1	82%	0.822	76%	0.759	S	S	*	*			trans	-160.3	147.2	140.3	-136.2	74.7	0	0	0	111.4
18	L	35.9	Very low	32.6	Very low	152 Å²	152	132.6 Å²	132.6	80%	0.796	77%	0.768	S	S	*	*			trans	57.8	113.3	164.8	-49.8	175.6	0	0	0	117.2
19	A	28	Very low	32.8	Very low	95 Å²	95	131.2 Å²	131.2	79%	0.785	77%	0.769	S	S	*	*			cis	78.9	87.3	17.3	0	0	0	0	0	117.4
20	V	32.8	Very low	32.9	Very low	132 Å²	132	135.6 Å²	135.6	80%	0.8	79%	0.786	S	S	*	*			trans	-148.9	148.1	157.5	-158.7	0	0	0	0	109.3
21	V	39	Very low	32.9	Very low	134 Å²	134	133.4 Å²	133.4	81%	0.812	79%	0.789	S	S	*	*			trans	63.5	109.4	175.9	-162.2	0	0	0	0	114.9
22	S	31.6	Very low	32.9	Very low	91 Å²	91	137.1 Å²	137.1	64%	0.636	79%	0.794	S	S	*	*			cis	108.4	98.4	24.9	-177.4	0	0	0	0	113.5
23	L	31.9	Very low	32.9	Very low	147 Å²	147	137.6 Å²	137.6	77%	0.77	80%	0.802	S	S	*	*			trans	51.8	123.9	135.9	-58.7	162.4	0	0	0	118.7
24	M	31.7	Very low	33	Very low	158 Å²	158	134.5 Å²	134.5	78%	0.778	81%	0.807	S	S	*	*				-170.7	147	79	-93.9	-60.9	-166.2	0	0	114.8
25	V	34.7	Very low	33.1	Very low	124 Å²	124	130.2 Å²	130.2	75%	0.752	80%	0.799	S	S	*	*			trans	56.4	122.1	152.5	-176.2	0	0	0	0	121
26	P	50.5	Low	33.2	Very low	118 Å²	118	130.8 Å²	130.8	77%	0.766	81%	0.805	S	S	*	*			trans	-105	-179.4	160.7	40.4	-33	0	0	0	113.9
27	A	31.1	Very low	33.4	Very low	98 Å²	98	135.6 Å²	135.6	81%	0.81	81%	0.811	S	S	*	*			trans	87.3	106.6	159	0	0	0	0	0	120.8
28	L	31.8	Very low	33.6	Very low	168 Å²	168	136.1 Å²	136.1	88%	0.88	81%	0.814	S	S	*	*			trans	-144.5	107.8	135.6	-93.2	169.2	0	0	0	104.7
29	S	32.2	Very low	33.5	Very low	112 Å²	112	132 Å²	132	78%	0.783	81%	0.808	S	S	*	*				75.3	138.2	84.4	-161.9	0	0	0	0	113.6
30	M	32.1	Very low	33.7	Very low	182 Å²	182	133 Å²	133	90%	0.897	81%	0.809	S	S	*	*			trans	-82.9	150.4	-169.2	-52.6	-175.1	81.9	0	0	112.6
31	C	28.3	Very low	34	Very low	132 Å²	132	133.1 Å²	133.1	89%	0.892	81%	0.81	S	S	*	*			trans	-141.3	150.2	144.6	-159.9	0	0	0	0	109.7
32	Q	32.1	Very low	34.3	Very low	187 Å²	187	133.1 Å²	133.1	87%	0.874	80%	0.804	S	S	*	*			trans	-84.2	143.8	-175	-64	166.2	-18.1	0	0	111.3
33	S	31.3	Very low	35	Very low	122 Å²	122	133.2 Å²	133.2	85%	0.853	80%	0.803	S	S	*	*			trans	-142.2	120.8	145.5	57.7	0	0	0	0	109.9
34	T	35.8	Very low	36.5	Very low	151 Å²	151	131.1 Å²	131.1	93%	0.926	79%	0.789	S	S	*	*			trans	-82.5	113.6	171.2	36.6	0	0	0	0	108.8
35	G	31.4	Very low	38.7	Very low	63 Å²	63	129.2 Å²	129.2	65%	0.649	78%	0.782	S	S	*	*			trans	-123.9	128	170	0	0	0	0	0	109.3	E37	G35-E37 PolarHBondContact O-N 3.06Å
36	P	35.4	Very low	41.3	Very low	128 Å²	128	125.4 Å²	125.4	83%	0.831	76%	0.76	S	S	*	*			trans	-74.9	113.4	177.4	29.5	-31.8	0	0	0	109.5	L38	P36-L38 PolarHBondContact O-N 3.39Å; P36-L38 VanDerWaalsContact O-N 3.11Å
37	E	33.3	Very low	43.2	Very low	196 Å²	196	120.4 Å²	120.4	92%	0.916	73%	0.728	S	S	*	*			trans	-63.8	116.1	164.2	-74.7	-151.8	134.1	0	0	108.8	G35 G39	G35-E37 PolarHBondContact O-N 3.06Å; E37-G39 PolarHBondContact O-N 3.35Å
38	L	34.7	Very low	45.8	Very low	169 Å²	169	119.7 Å²	119.7	89%	0.885	73%	0.73	S	S	*	*			trans	-55.1	122.9	-178.1	-173.7	69	0	0	0	109.4	P36 S40	P36-L38 PolarHBondContact O-N 3.39Å; P36-L38 VanDerWaalsContact O-N 3.11Å; L38-S40 PolarHBondContact O-N 3.06Å
39	G	34.3	Very low	48.7	Very low	66 Å²	66	114.7 Å²	114.7	68%	0.68	71%	0.707	S	S	*	*			trans	-47.1	112.2	-166.3	0	0	0	0	0	113.3	E37 T41	E37-G39 PolarHBondContact O-N 3.35Å; G39-T41 PolarHBondContact O-N 3.46Å
40	S	32.1	Very low	51.7	Low	114 Å²	114	110 Å²	110	80%	0.797	67%	0.674	S	S	*	*			trans	-61.6	119.9	-178.5	44.6	0	0	0	0	109.8	L38 I42	L38-S40 PolarHBondContact O-N 3.06Å; S40-I42 PolarHBondContact O-N 2.64Å
41	T	38.7	Very low	54.6	Low	135 Å²	135	104.4 Å²	104.4	83%	0.828	65%	0.653	S	S	*	*			trans	-67.2	103.5	179.1	34.6	0	0	0	0	108.7	G39 P43	G39-T41 PolarHBondContact O-N 3.46Å; T41-P43 WeakPolarHBondContact O-CD 3.42Å; T41-P43 VanDerWaalsContact O-N 3.12Å
42	I	44.5	Very low	57.7	Low	134 Å²	134	99.5 Å²	99.5	69%	0.687	62%	0.619	S	S	*	*			trans	-47.9	122.3	172	-59.5	172.3	0	0	0	107.2	S40 Q44	S40-I42 PolarHBondContact O-N 2.64Å; I42-Q44 PolarHBondContact O-N 2.77Å
43	P	47	Very low	60.5	Low	93 Å²	93	93.3 Å²	93.3	60%	0.604	59%	0.594	S	S	*	*			trans	-51.1	120.3	177.7	-28.8	35.9	0	0	0	109.2	T41 N45	T41-P43 WeakPolarHBondContact O-CD 3.42Å; T41-P43 VanDerWaalsContact O-N 3.12Å; P43-N45 WeakPolarHBondContact CB-OD1 3.5Å; P43-N45 PolarHBondContact O-N 2.69Å
44	Q	62.8	Low	62.9	Low	104 Å²	104	93.3 Å²	93.3	49%	0.486	59%	0.585	S	S	.	*			trans	-72.2	60.2	-176.1	-72.9	-83.4	-65.5	0	0	110	I42 L56	I42-Q44 PolarHBondContact O-N 2.77Å; Q44-L56 HydrophobicContact CB-CD1 4.47Å; Q44-L56 WeakPolarHBondContact O-CD1 3.42Å
45	N	78.9	Confident	65.2	Low	117 Å²	117	95.1 Å²	95.1	63%	0.626	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-71.6	149.6	-175.2	-71.1	-7.3	0	0	0	110.1	P43	P43-N45 WeakPolarHBondContact CB-OD1 3.5Å; P43-N45 PolarHBondContact O-N 2.69Å
46	C	88.6	Confident	67.8	Low	44 Å²	44	94.5 Å²	94.5	30%	0.297	56%	0.564	S	S	.	*	P	Polyproline II helix	trans	-57.7	134.9	171.3	-167.4	0	0	0	0	110.3	G48 C52 L56	C46-G48 PolarHBondContact O-N 2.8Å; C46-C52 WeakPolarHBondContact CA-SG 3.43Å; C46-C52 HydrophobicContact CB-CB 3.64Å; C46-C52 WeakPolarHBondContact CB-SG 3.48Å; C46-C52 WeakPolarHBondContact SG-CB 3.43Å; C46-C52 PolarHBondContact SG-N 2.98Å; C46-C52 CovalentContact SG-SG 2.03Å; C46-C52 PolarHBondContact SG-SG 2.87Å; C46-L56 HydrophobicContact CB-CD2 4.49Å
47	P	90.3	Very high	70.4	Confident	13 Å²	13	89.9 Å²	89.9	8%	0.084	54%	0.535	C	S	.	.	P	Polyproline II helix	trans	-56.9	129.7	171.1	-22.6	32	0	0	0	109.7	V49 C50 P70 I73	P47-V49 HydrophobicContact CB-CG2 4.46Å; P47-V49 PolarHBondContact O-N 3.12Å; P47-C50 HydrophobicContact CB-CB 4.31Å; P47-C50 WeakPolarHBondContact O-CA 3.46Å; P47-C50 WeakPolarHBondContact O-CB 3.22Å; P47-C50 PolarHBondContact O-N 3.29Å; P47-P70 HydrophobicContact CB-CB 4.31Å; P47-I73 HydrophobicContact CG-CG1 4.46Å
48	G	87.3	Confident	73.4	Confident	83 Å²	83	84.3 Å²	84.3	86%	0.856	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-13.5	-171.8	0	0	0	0	0	115.7	C46	C46-G48 PolarHBondContact O-N 2.8Å
49	V	91.8	Very high	76.3	Confident	64 Å²	64	76.3 Å²	76.3	39%	0.388	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-7.5	172.3	-64.5	0	0	0	0	113.5	P47 R64 L66 P70	P47-V49 HydrophobicContact CB-CG2 4.46Å; P47-V49 PolarHBondContact O-N 3.12Å; V49-R64 WeakPolarHBondContact O-CG 3.48Å; V49-R64 PolarHBondContact O-NE 2.87Å; V49-R64 PolarHBondContact O-NH1 3.28Å; V49-L66 HydrophobicContact CB-CD2 4.4Å; V49-L66 HydrophobicContact CG2-CD2 4.08Å; V49-P70 HydrophobicContact CG2-CB 4.1Å; V49-P70 HydrophobicContact CG2-CG 3.99Å
50	C	94.3	Very high	79.3	Confident	13 Å²	13	74.9 Å²	74.9	9%	0.088	44%	0.444	C	S	.	.	S	Bend	trans	-113.3	170.8	-176	-59	0	0	0	0	111.5	P47 V59 V60 C61	P47-C50 HydrophobicContact CB-CB 4.31Å; P47-C50 WeakPolarHBondContact O-CA 3.46Å; P47-C50 WeakPolarHBondContact O-CB 3.22Å; P47-C50 PolarHBondContact O-N 3.29Å; C50-V59 HydrophobicContact CB-CG1 4.1Å; C50-V60 CarbonylContact C-O 3.46Å; C50-V60 WeakPolarHBondContact CA-O 3.34Å; C50-C61 HydrophobicContact CB-CB 4Å; C50-C61 WeakPolarHBondContact CB-SG 3.49Å; C50-C61 WeakPolarHBondContact SG-CB 2.98Å; C50-C61 CovalentContact SG-SG 2.04Å; C50-C61 PolarHBondContact SG-SG 3.43Å
51	S	93.7	Very high	82.4	Confident	65 Å²	65	69.4 Å²	69.4	46%	0.455	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	128.4	166.4	-177.1	0	0	0	0	108.8	V60	S51-V60 PolarHBondContact N-O 3.39Å; S51-V60 PolarHBondContact O-N 3.18Å
52	C	93.4	Very high	85.1	Confident	28 Å²	28	65.1 Å²	65.1	19%	0.189	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	137.8	-177.8	-54.3	0	0	0	0	110.5	C46 L56 K58 V59	C46-C52 WeakPolarHBondContact CA-SG 3.43Å; C46-C52 HydrophobicContact CB-CB 3.64Å; C46-C52 WeakPolarHBondContact CB-SG 3.48Å; C46-C52 WeakPolarHBondContact SG-CB 3.43Å; C46-C52 PolarHBondContact SG-N 2.98Å; C46-C52 CovalentContact SG-SG 2.03Å; C46-C52 PolarHBondContact SG-SG 2.87Å; C52-L56 HydrophobicContact CB-CD2 3.66Å; C52-K58 CarbonylContact C-O 3.15Å; C52-K58 WeakPolarHBondContact CA-O 3.37Å; C52-V59 HydrophobicContact CB-CG2 4.44Å
53	T	90.8	Very high	87.5	Confident	58 Å²	58	67.6 Å²	67.6	36%	0.356	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	168.8	-174.4	51.3	0	0	0	0	110.7	L56 S57 K58	T53-L56 WeakPolarHBondContact O-CA 3.42Å; T53-L56 PolarHBondContact O-N 2.96Å; T53-L56 VanDerWaalsContact O-N 3.17Å; T53-S57 PolarHBondContact O-N 3.29Å; T53-K58 PolarHBondContact N-O 2.81Å; T53-K58 PolarHBondContact O-N 3.48Å; T53-K58 WeakPolarHBondContact OG1-CB 3.17Å; T53-K58 WeakPolarHBondContact OG1-CG 3.48Å; T53-K58 PolarHBondContact OG1-O 2.99Å
54	N	82.2	Confident	89.8	Confident	121 Å²	121	69.4 Å²	69.4	65%	0.647	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.8	63.3	177	-62.8	1.6	0	0	0	113.4	L56 S57	N54-L56 PolarHBondContact O-N 3.06Å; N54-S57 WeakPolarHBondContact CB-OG 3.35Å; N54-S57 VanDerWaalsContact O-CB 3.32Å; N54-S57 WeakPolarHBondContact O-CB 3.31Å; N54-S57 PolarHBondContact O-N 3.31Å; N54-S57 PolarHBondContact O-OG 3.41Å
55	Q	83.3	Confident	91.3	Very high	189 Å²	189	66.7 Å²	66.7	88%	0.883	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	38.9	-178.6	-59	176.9	-11.4	0	0	113.1	S57	Q55-S57 PolarHBondContact O-N 2.9Å
56	L	85.7	Confident	92.1	Very high	51 Å²	51	62.2 Å²	62.2	27%	0.267	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	68	6.6	-177.3	-48.3	166.2	0	0	0	115.4	Q44 C46 C52 T53 N54 K58 P74	Q44-L56 HydrophobicContact CB-CD1 4.47Å; Q44-L56 WeakPolarHBondContact O-CD1 3.42Å; C46-L56 HydrophobicContact CB-CD2 4.49Å; C52-L56 HydrophobicContact CB-CD2 3.66Å; T53-L56 WeakPolarHBondContact O-CA 3.42Å; T53-L56 PolarHBondContact O-N 2.96Å; T53-L56 VanDerWaalsContact O-N 3.17Å; N54-L56 PolarHBondContact O-N 3.06Å; L56-K58 VanDerWaalsContact C-N 3.27Å; L56-K58 PolarHBondContact O-N 3.45Å; L56-P74 HydrophobicContact CB-CB 3.92Å; L56-P74 HydrophobicContact CB-CG 4.07Å; L56-P74 HydrophobicContact CD1-CB 4.19Å; L56-P74 HydrophobicContact CD1-CG 4.22Å; L56-P74 HydrophobicContact CD2-CG 4.37Å; L56-P74 HydrophobicContact CG-CG 4.46Å
57	S	91.5	Very high	92.4	Very high	31 Å²	31	65.7 Å²	65.7	22%	0.217	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-20.1	177	64.8	0	0	0	0	114	T53 N54 Q55 N76 R78 Y79	T53-S57 PolarHBondContact O-N 3.29Å; N54-S57 WeakPolarHBondContact CB-OG 3.35Å; N54-S57 VanDerWaalsContact O-CB 3.32Å; N54-S57 WeakPolarHBondContact O-CB 3.31Å; N54-S57 PolarHBondContact O-N 3.31Å; N54-S57 PolarHBondContact O-OG 3.41Å; Q55-S57 PolarHBondContact O-N 2.9Å; S57-N76 WeakPolarHBondContact CA-O 3.06Å; S57-R78 PolarHBondContact O-N 3.05Å; S57-Y79 PolarHBondContact O-N 3.03Å
58	K	95.6	Very high	92.6	Very high	79 Å²	79	73.7 Å²	73.7	34%	0.343	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	114.6	178	174.2	162.6	-171.1	168.8	0	111.1	C52 T53 L56 V60 Y79	C52-K58 CarbonylContact C-O 3.15Å; C52-K58 WeakPolarHBondContact CA-O 3.37Å; T53-K58 PolarHBondContact N-O 2.81Å; T53-K58 PolarHBondContact O-N 3.48Å; T53-K58 WeakPolarHBondContact OG1-CB 3.17Å; T53-K58 WeakPolarHBondContact OG1-CG 3.48Å; T53-K58 PolarHBondContact OG1-O 2.99Å; L56-K58 VanDerWaalsContact C-N 3.27Å; L56-K58 PolarHBondContact O-N 3.45Å; K58-V60 HydrophobicContact CG-CG2 4.3Å; K58-Y79 HydrophobicContact CD-CD1 4.07Å; K58-Y79 HydrophobicContact CD-CE1 4.35Å; K58-Y79 HydrophobicContact CG-CD1 3.71Å; K58-Y79 HydrophobicContact CG-CE1 4.26Å; K58-Y79 HydrophobicContact CG-CG 4.41Å
59	V	96.6	Very high	93	Very high	0 Å²	0	70.9 Å²	70.9	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	128.2	-177.1	-178.5	0	0	0	0	110	C50 C52 T77 Y79 L80 N81	C50-V59 HydrophobicContact CB-CG1 4.1Å; C52-V59 HydrophobicContact CB-CG2 4.44Å; V59-T77 HydrophobicContact CB-CG2 4.08Å; V59-T77 HydrophobicContact CG2-CG2 3.73Å; V59-T77 WeakPolarHBondContact CG2-OG1 3.22Å; V59-Y79 PolarHBondContact N-O 2.66Å; V59-L80 HydrophobicContact CB-CD1 3.95Å; V59-L80 HydrophobicContact CG1-CD1 3.82Å; V59-N81 PolarHBondContact O-N 3.45Å
60	V	97	Very high	93.1	Very high	36 Å²	36	68.3 Å²	68.3	22%	0.218	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	120.8	-175.7	-174.9	0	0	0	0	110.1	C50 S51 K58 T62 Y79	C50-V60 CarbonylContact C-O 3.46Å; C50-V60 WeakPolarHBondContact CA-O 3.34Å; S51-V60 PolarHBondContact N-O 3.39Å; S51-V60 PolarHBondContact O-N 3.18Å; K58-V60 HydrophobicContact CG-CG2 4.3Å; V60-T62 HydrophobicContact CG1-CG2 4.06Å; V60-Y79 HydrophobicContact CG2-CE1 4.27Å
61	C	96.3	Very high	92.8	Very high	0 Å²	0	72.3 Å²	72.3	0%	0	37%	0.371	C	S	.	.			trans	-128.2	31.3	-177.9	-34.9	0	0	0	0	111.7	C50 R64 L66 N81 L82 N85	C50-C61 HydrophobicContact CB-CB 4Å; C50-C61 WeakPolarHBondContact CB-SG 3.49Å; C50-C61 WeakPolarHBondContact SG-CB 2.98Å; C50-C61 CovalentContact SG-SG 2.04Å; C50-C61 PolarHBondContact SG-SG 3.43Å; C61-R64 WeakPolarHBondContact O-CG 3.26Å; C61-L66 HydrophobicContact CB-CD1 3.84Å; C61-N81 PolarHBondContact N-O 2.96Å; C61-L82 HydrophobicContact CB-CD2 3.8Å; C61-N85 PolarHBondContact O-ND2 2.92Å
62	T	96.4	Very high	92.6	Very high	44 Å²	44	75.6 Å²	75.6	27%	0.27	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	147.7	-176	51.2	0	0	0	0	113.2	V60 R64 N81 M83	V60-T62 HydrophobicContact CG1-CG2 4.06Å; T62-R64 VanDerWaalsContact C-N 3.34Å; T62-R64 WeakPolarHBondContact O-CG 3.39Å; T62-R64 PolarHBondContact O-N 3.46Å; T62-N81 WeakPolarHBondContact CG2-OD1 3.02Å; T62-M83 VanDerWaalsContact CA-O 3.26Å; T62-M83 WeakPolarHBondContact CA-O 3.4Å; T62-M83 HydrophobicContact CG2-CB 4.26Å; T62-M83 WeakPolarHBondContact CG2-O 3.2Å
63	R	95.1	Very high	92.6	Very high	187 Å²	187	75.2 Å²	75.2	71%	0.706	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.5	40.4	176.2	-56.9	-179.7	-179.3	175.5	0.2	113.9	E84	R63-E84 VanDerWaalsContact CA-O 3.22Å; R63-E84 WeakPolarHBondContact CA-O 3.38Å; R63-E84 HydrophobicContact CG-CB 4.01Å; R63-E84 IonicContact CZ-OE2 2.64Å; R63-E84 PolarHBondContact N-O 3.27Å; R63-E84 VanDerWaalsContact N-O 3.12Å; R63-E84 IonicContact NE-OE2 3.87Å; R63-E84 PolarHBondContact NE-OE2 3.1Å; R63-E84 IonicContact NH2-OE1 2.77Å; R63-E84 IonicContact NH2-OE2 3.17Å; R63-E84 PolarHBondContact NH2-OE2 2.98Å
64	R	94.7	Very high	92.8	Very high	130 Å²	130	72.5 Å²	72.5	49%	0.491	36%	0.362	S	S	.	.	S	Bend	trans	-109.6	-0.2	-177.4	-63.8	-58.4	-174.3	117.6	6.7	114.3	V49 C61 T62 L66 N85	V49-R64 WeakPolarHBondContact O-CG 3.48Å; V49-R64 PolarHBondContact O-NE 2.87Å; V49-R64 PolarHBondContact O-NH1 3.28Å; C61-R64 WeakPolarHBondContact O-CG 3.26Å; T62-R64 VanDerWaalsContact C-N 3.34Å; T62-R64 WeakPolarHBondContact O-CG 3.39Å; T62-R64 PolarHBondContact O-N 3.46Å; R64-L66 HydrophobicContact CB-CD1 4.08Å; R64-L66 HydrophobicContact CB-CD2 4.38Å; R64-L66 HydrophobicContact CB-CG 3.81Å; R64-L66 PolarHBondContact O-N 3.37Å; R64-N85 WeakPolarHBondContact CA-OD1 3.39Å; R64-N85 PolarHBondContact N-OD1 3.32Å
65	G	94.7	Very high	93.2	Very high	48 Å²	48	68.3 Å²	68.3	50%	0.495	34%	0.344	S	S	.	.			trans	66.2	26.2	-178.7	0	0	0	0	0	113.4	I67 N85	G65-I67 PolarHBondContact O-N 2.03Å; G65-N85 PolarHBondContact N-OD1 2.84Å
66	L	95.6	Very high	93.7	Very high	23 Å²	23	64 Å²	64	12%	0.12	33%	0.327	C	S	.	.			trans	-68.6	123.2	-175.5	-63.5	167.9	0	0	0	110.6	V49 C61 R64 P70 N85 S86 I87	V49-L66 HydrophobicContact CB-CD2 4.4Å; V49-L66 HydrophobicContact CG2-CD2 4.08Å; C61-L66 HydrophobicContact CB-CD1 3.84Å; R64-L66 HydrophobicContact CB-CD1 4.08Å; R64-L66 HydrophobicContact CB-CD2 4.38Å; R64-L66 HydrophobicContact CB-CG 3.81Å; R64-L66 PolarHBondContact O-N 3.37Å; L66-P70 HydrophobicContact CD1-CG 3.69Å; L66-P70 HydrophobicContact CD2-CG 4.25Å; L66-N85 HydrophobicContact CB-CB 4.12Å; L66-N85 PolarHBondContact N-OD1 3.03Å; L66-S86 CarbonylContact O-C 3.26Å; L66-S86 WeakPolarHBondContact O-CA 3.47Å; L66-S86 PolarHBondContact O-N 3.08Å; L66-I87 HydrophobicContact CB-CG1 4.41Å; L66-I87 VanDerWaalsContact O-CG1 3.31Å; L66-I87 WeakPolarHBondContact O-CG1 3.35Å; L66-I87 PolarHBondContact O-N 2.8Å
67	I	95.1	Very high	94.2	Very high	117 Å²	117	61.6 Å²	61.6	60%	0.6	32%	0.315	S	S	*	.	S	Bend	trans	-88.1	-18.4	177	-54	173.1	0	0	0	111.4	G65 I87	G65-I67 PolarHBondContact O-N 2.03Å; I67-I87 WeakPolarHBondContact O-CA 3.42Å
68	R	94.3	Very high	94.4	Very high	180 Å²	180	66.3 Å²	66.3	68%	0.679	33%	0.328	S	S	*	.	S	Bend	trans	-142.3	159.1	177.1	-67.6	-176.1	-68.9	-158.6	-2	109.7
69	V	95.4	Very high	94.5	Very high	25 Å²	25	65.3 Å²	65.3	15%	0.152	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-58.2	133.5	172.9	179	0	0	0	0	109.9	I73 L82 I87 T94 F95	V69-I73 HydrophobicContact CG1-CD1 3.71Å; V69-L82 HydrophobicContact CG1-CD1 4.06Å; V69-L82 HydrophobicContact CG2-CD1 4.12Å; V69-I87 HydrophobicContact CG2-CD1 4.24Å; V69-T94 HydrophobicContact CB-CG2 3.83Å; V69-T94 HydrophobicContact CG1-CG2 3.88Å; V69-T94 HydrophobicContact CG2-CG2 3.88Å; V69-F95 HydrophobicContact CG1-CE1 3.81Å; V69-F95 HydrophobicContact CG1-CZ 4.34Å; V69-F95 HydrophobicContact CG2-CE1 4.26Å; V69-F95 HydrophobicContact CG2-CZ 3.95Å
70	P	93.1	Very high	94.6	Very high	9 Å²	9	65.3 Å²	65.3	6%	0.058	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-62.5	137.6	177	-23.8	34.6	0	0	0	112.3	P47 V49 L66 I73 L82	P47-P70 HydrophobicContact CB-CB 4.31Å; V49-P70 HydrophobicContact CG2-CB 4.1Å; V49-P70 HydrophobicContact CG2-CG 3.99Å; L66-P70 HydrophobicContact CD1-CG 3.69Å; L66-P70 HydrophobicContact CD2-CG 4.25Å; P70-I73 WeakPolarHBondContact O-CD1 3.21Å; P70-I73 WeakPolarHBondContact O-CG1 3.03Å; P70-L82 HydrophobicContact CG-CD2 4.41Å
71	P	89.3	Confident	94.7	Very high	98 Å²	98	64.2 Å²	64.2	64%	0.636	32%	0.315	S	S	*	.	S	Bend	trans	-69.3	165.7	169.2	31.1	-35.2	0	0	0	111.3	I73	P71-I73 PolarHBondContact O-N 2.92Å
72	N	88.8	Confident	94.7	Very high	134 Å²	134	64.2 Å²	64.2	72%	0.717	32%	0.315	S	S	*	.			trans	61.4	36.8	173.7	-53.2	-18.7	0	0	0	114.9
73	I	93.8	Very high	94.8	Very high	20 Å²	20	63.7 Å²	63.7	10%	0.103	31%	0.31	C	S	.	.			trans	-66.3	129.9	169.3	-62.4	162.4	0	0	0	109	P47 V69 P70 P71 L80 L98	P47-I73 HydrophobicContact CG-CG1 4.46Å; V69-I73 HydrophobicContact CG1-CD1 3.71Å; P70-I73 WeakPolarHBondContact O-CD1 3.21Å; P70-I73 WeakPolarHBondContact O-CG1 3.03Å; P71-I73 PolarHBondContact O-N 2.92Å; I73-L80 HydrophobicContact CD1-CD1 4.32Å; I73-L80 HydrophobicContact CD1-CD2 3.8Å; I73-L80 HydrophobicContact CG2-CD1 4.33Å; I73-L80 HydrophobicContact CG2-CD2 4.37Å; I73-L98 HydrophobicContact CB-CD1 4.4Å; I73-L98 HydrophobicContact CB-CD2 4.34Å; I73-L98 HydrophobicContact CG2-CD1 3.87Å; I73-L98 HydrophobicContact CG2-CD2 3.95Å
74	P	93.8	Very high	94.9	Very high	1 Å²	1	57.6 Å²	57.6	1%	0.006	29%	0.289	C	S	.	.			trans	-60.1	135.3	-176.1	-28	36.2	0	0	0	114.4	L56 N76 T77 L98	L56-P74 HydrophobicContact CB-CB 3.92Å; L56-P74 HydrophobicContact CB-CG 4.07Å; L56-P74 HydrophobicContact CD1-CB 4.19Å; L56-P74 HydrophobicContact CD1-CG 4.22Å; L56-P74 HydrophobicContact CD2-CG 4.37Å; L56-P74 HydrophobicContact CG-CG 4.46Å; P74-N76 PolarHBondContact O-N 3.27Å; P74-N76 VanDerWaalsContact O-N 3.07Å; P74-T77 VanDerWaalsContact O-CB 3.27Å; P74-T77 WeakPolarHBondContact O-CB 3.43Å; P74-T77 PolarHBondContact O-N 2.97Å; P74-T77 PolarHBondContact O-OG1 3.03Å; P74-L98 WeakPolarHBondContact O-CD2 3.09Å
75	A	92.4	Very high	95	Very high	32 Å²	32	52 Å²	52	26%	0.264	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-14.6	-178.4	0	0	0	0	0	114.9	T77 H100	A75-T77 VanDerWaalsContact C-N 3.34Å; A75-H100 PolarHBondContact O-ND1 2.85Å; A75-H100 VanDerWaalsContact O-ND1 3.08Å
76	N	92.4	Very high	95.2	Very high	99 Å²	99	52.6 Å²	52.6	53%	0.529	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	1	175.7	-64.3	-5.7	0	0	0	113.2	S57 P74 R78	S57-N76 WeakPolarHBondContact CA-O 3.06Å; P74-N76 PolarHBondContact O-N 3.27Å; P74-N76 VanDerWaalsContact O-N 3.07Å; N76-R78 PolarHBondContact O-N 2.04Å
77	T	95.9	Very high	95.3	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.26	C	S	.	.			trans	-64.3	123.2	-178.9	-55.2	0	0	0	0	111	V59 P74 A75 Y79 L80 H100 L101	V59-T77 HydrophobicContact CB-CG2 4.08Å; V59-T77 HydrophobicContact CG2-CG2 3.73Å; V59-T77 WeakPolarHBondContact CG2-OG1 3.22Å; P74-T77 VanDerWaalsContact O-CB 3.27Å; P74-T77 WeakPolarHBondContact O-CB 3.43Å; P74-T77 PolarHBondContact O-N 2.97Å; P74-T77 PolarHBondContact O-OG1 3.03Å; A75-T77 VanDerWaalsContact C-N 3.34Å; T77-Y79 VanDerWaalsContact CG2-O 3.26Å; T77-Y79 WeakPolarHBondContact CG2-O 3.46Å; T77-L80 HydrophobicContact CG2-CB 4.04Å; T77-H100 CarbonylContact O-C 3.57Å; T77-L101 HydrophobicContact CG2-CD1 3.84Å; T77-L101 WeakPolarHBondContact O-CA 3.42Å; T77-L101 PolarHBondContact O-N 2.71Å
78	R	97	Very high	95.4	Very high	131 Å²	131	49.5 Å²	49.5	49%	0.494	25%	0.248	S	C	.	.	S	Bend	trans	-99.9	-32.5	171.2	-66	-178.2	178.9	-129.3	9.4	112.7	S57 N76 H100 E102 V103	S57-R78 PolarHBondContact O-N 3.05Å; N76-R78 PolarHBondContact O-N 2.04Å; R78-H100 WeakPolarHBondContact CA-O 3.2Å; R78-H100 HydrophobicContact CG-CB 4.45Å; R78-H100 WeakPolarHBondContact CG-O 3.35Å; R78-E102 WeakPolarHBondContact CD-OE1 3.44Å; R78-E102 IonicContact CZ-OE1 3.62Å; R78-E102 IonicContact NE-OE1 3.74Å; R78-E102 IonicContact NH1-OE1 2.77Å; R78-E102 PolarHBondContact NH1-OE1 3.27Å; R78-E102 PolarHBondContact O-N 3.47Å; R78-V103 PolarHBondContact O-N 3.28Å
79	Y	98	Very high	95.5	Very high	57 Å²	57	43.6 Å²	43.6	22%	0.224	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	120.1	177.7	174.5	-80.5	0	0	0	109.4	S57 K58 V59 V60 T77 N81 V103 Q105	S57-Y79 PolarHBondContact O-N 3.03Å; K58-Y79 HydrophobicContact CD-CD1 4.07Å; K58-Y79 HydrophobicContact CD-CE1 4.35Å; K58-Y79 HydrophobicContact CG-CD1 3.71Å; K58-Y79 HydrophobicContact CG-CE1 4.26Å; K58-Y79 HydrophobicContact CG-CG 4.41Å; V59-Y79 PolarHBondContact N-O 2.66Å; V60-Y79 HydrophobicContact CG2-CE1 4.27Å; T77-Y79 VanDerWaalsContact CG2-O 3.26Å; T77-Y79 WeakPolarHBondContact CG2-O 3.46Å; Y79-N81 HydrophobicContact CD1-CB 4.39Å; Y79-N81 HydrophobicContact CE1-CB 3.58Å; Y79-N81 PolarHBondContact OH-ND2 3.01Å; Y79-V103 HydrophobicContact CD2-CB 3.88Å; Y79-V103 HydrophobicContact CD2-CG1 3.87Å; Y79-V103 HydrophobicContact CD2-CG2 4.49Å; Y79-V103 HydrophobicContact CE2-CG1 4.1Å; Y79-Q105 HydrophobicContact CE2-CG 4.44Å; Y79-Q105 VanDerWaalsContact CZ-OE1 3.29Å; Y79-Q105 PolarHBondContact OH-OE1 3.25Å
80	L	98	Very high	95.6	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	118.7	176.5	177	59.2	0	0	0	109.7	V59 I73 T77 L82 F95 L98 L101 V103 L104 Q105	V59-L80 HydrophobicContact CB-CD1 3.95Å; V59-L80 HydrophobicContact CG1-CD1 3.82Å; I73-L80 HydrophobicContact CD1-CD1 4.32Å; I73-L80 HydrophobicContact CD1-CD2 3.8Å; I73-L80 HydrophobicContact CG2-CD1 4.33Å; I73-L80 HydrophobicContact CG2-CD2 4.37Å; T77-L80 HydrophobicContact CG2-CB 4.04Å; L80-L82 HydrophobicContact CD1-CD2 4.08Å; L80-L82 HydrophobicContact CD1-CG 4.15Å; L80-L82 HydrophobicContact CD2-CD1 4.15Å; L80-L82 HydrophobicContact CD2-CG 4.5Å; L80-L82 HydrophobicContact CG-CD1 4.27Å; L80-L82 HydrophobicContact CG-CG 4.08Å; L80-F95 HydrophobicContact CD2-CD1 4.19Å; L80-F95 HydrophobicContact CD2-CE1 3.91Å; L80-L98 HydrophobicContact CD2-CD1 4.16Å; L80-L101 HydrophobicContact CB-CD1 3.65Å; L80-V103 PolarHBondContact N-O 3.04Å; L80-L104 HydrophobicContact CB-CD1 4.22Å; L80-L104 HydrophobicContact CD2-CD1 3.86Å; L80-L104 HydrophobicContact CG-CD1 4.09Å; L80-Q105 PolarHBondContact O-N 2.91Å
81	N	98	Very high	95.7	Very high	13 Å²	13	47 Å²	47	7%	0.07	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	114.9	178	-179	-14.5	0	0	0	111.4	V59 C61 T62 Y79 M83 Q105	V59-N81 PolarHBondContact O-N 3.45Å; C61-N81 PolarHBondContact N-O 2.96Å; T62-N81 WeakPolarHBondContact CG2-OD1 3.02Å; Y79-N81 HydrophobicContact CD1-CB 4.39Å; Y79-N81 HydrophobicContact CE1-CB 3.58Å; Y79-N81 PolarHBondContact OH-ND2 3.01Å; N81-M83 WeakPolarHBondContact OD1-CB 3.35Å; N81-M83 WeakPolarHBondContact OD1-CG 3.37Å; N81-M83 PolarHBondContact OD1-N 3.22Å; N81-Q105 HydrophobicContact CB-CB 4.3Å; N81-Q105 VanDerWaalsContact CG-OE1 3.24Å; N81-Q105 PolarHBondContact ND2-OE1 2.86Å
82	L	97.6	Very high	96	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.234	C	C	.	.			trans	-116.7	16.6	179.8	-61	175	0	0	0	111.9	C61 V69 P70 L80 N85 I87 F95 Q105 L106 N109	C61-L82 HydrophobicContact CB-CD2 3.8Å; V69-L82 HydrophobicContact CG1-CD1 4.06Å; V69-L82 HydrophobicContact CG2-CD1 4.12Å; P70-L82 HydrophobicContact CG-CD2 4.41Å; L80-L82 HydrophobicContact CD1-CD2 4.08Å; L80-L82 HydrophobicContact CD1-CG 4.15Å; L80-L82 HydrophobicContact CD2-CD1 4.15Å; L80-L82 HydrophobicContact CD2-CG 4.5Å; L80-L82 HydrophobicContact CG-CD1 4.27Å; L80-L82 HydrophobicContact CG-CG 4.08Å; L82-N85 PolarHBondContact O-ND2 3.04Å; L82-I87 HydrophobicContact CB-CD1 4.24Å; L82-I87 HydrophobicContact CD1-CD1 4.36Å; L82-F95 HydrophobicContact CD1-CE1 4.41Å; L82-Q105 PolarHBondContact N-O 3.19Å; L82-L106 HydrophobicContact CB-CD2 4.2Å; L82-L106 HydrophobicContact CD1-CD2 3.83Å; L82-N109 PolarHBondContact O-ND2 3.06Å
83	M	97.8	Very high	96.2	Very high	34 Å²	34	40.6 Å²	40.6	17%	0.167	21%	0.213	C	C	.	.			trans	-67.1	158.4	-175.1	-63.7	-164.9	-70.9	0	0	114	T62 N81 N85 Q105 G107 F131	T62-M83 VanDerWaalsContact CA-O 3.26Å; T62-M83 WeakPolarHBondContact CA-O 3.4Å; T62-M83 HydrophobicContact CG2-CB 4.26Å; T62-M83 WeakPolarHBondContact CG2-O 3.2Å; N81-M83 WeakPolarHBondContact OD1-CB 3.35Å; N81-M83 WeakPolarHBondContact OD1-CG 3.37Å; N81-M83 PolarHBondContact OD1-N 3.22Å; M83-N85 PolarHBondContact O-ND2 3.01Å; M83-Q105 HydrophobicContact CE-CB 4.37Å; M83-Q105 HydrophobicContact CG-CB 3.79Å; M83-Q105 HydrophobicContact SD-CB 4.13Å; M83-G107 WeakPolarHBondContact CA-O 3.38Å; M83-G107 WeakPolarHBondContact CB-O 3.39Å; M83-G107 WeakPolarHBondContact CG-O 3.27Å; M83-F131 HydrophobicContact SD-CE1 4.21Å; M83-F131 HydrophobicContact SD-CE2 4.46Å; M83-F131 HydrophobicContact SD-CZ 3.62Å
84	E	97.1	Very high	96.3	Very high	58 Å²	58	41.8 Å²	41.8	27%	0.271	22%	0.221	S	C	.	.	S	Bend	trans	57.6	53.9	177.3	-59.8	-177.7	170.8	0	0	111.2	R63 R108	R63-E84 VanDerWaalsContact CA-O 3.22Å; R63-E84 WeakPolarHBondContact CA-O 3.38Å; R63-E84 HydrophobicContact CG-CB 4.01Å; R63-E84 IonicContact CZ-OE2 2.64Å; R63-E84 PolarHBondContact N-O 3.27Å; R63-E84 VanDerWaalsContact N-O 3.12Å; R63-E84 IonicContact NE-OE2 3.87Å; R63-E84 PolarHBondContact NE-OE2 3.1Å; R63-E84 IonicContact NH2-OE1 2.77Å; R63-E84 IonicContact NH2-OE2 3.17Å; R63-E84 PolarHBondContact NH2-OE2 2.98Å; E84-R108 WeakPolarHBondContact CA-O 3.33Å; E84-R108 HydrophobicContact CG-CB 3.8Å; E84-R108 HydrophobicContact CG-CG 4.38Å; E84-R108 PolarHBondContact N-O 2.64Å; E84-R108 WeakPolarHBondContact OE1-CD 3.34Å; E84-R108 IonicContact OE1-CZ 3.76Å; E84-R108 IonicContact OE1-NH1 3.42Å; E84-R108 PolarHBondContact OE1-NH1 2.68Å
85	N	97.8	Very high	96.4	Very high	14 Å²	14	41.8 Å²	41.8	8%	0.075	22%	0.221	C	C	.	.	S	Bend	trans	-132.1	-166	176.6	-79.9	-64.1	0	0	0	109.7	C61 R64 G65 L66 L82 M83 I87 R108 N109	C61-N85 PolarHBondContact O-ND2 2.92Å; R64-N85 WeakPolarHBondContact CA-OD1 3.39Å; R64-N85 PolarHBondContact N-OD1 3.32Å; G65-N85 PolarHBondContact N-OD1 2.84Å; L66-N85 HydrophobicContact CB-CB 4.12Å; L66-N85 PolarHBondContact N-OD1 3.03Å; L82-N85 PolarHBondContact O-ND2 3.04Å; M83-N85 PolarHBondContact O-ND2 3.01Å; N85-I87 HydrophobicContact CB-CG1 4.41Å; N85-R108 PolarHBondContact N-O 3Å; N85-N109 WeakPolarHBondContact CA-OD1 3.42Å; N85-N109 WeakPolarHBondContact CB-OD1 3.45Å; N85-N109 PolarHBondContact O-OD1 2.94Å
86	S	97.8	Very high	96.4	Very high	59 Å²	59	46.6 Å²	46.6	41%	0.413	23%	0.232	S	C	.	.			trans	-125.6	31.3	-174.2	-53	0	0	0	0	112	L66 E88 N109	L66-S86 CarbonylContact O-C 3.26Å; L66-S86 WeakPolarHBondContact O-CA 3.47Å; L66-S86 PolarHBondContact O-N 3.08Å; S86-E88 PolarHBondContact O-N 3.15Å; S86-N109 PolarHBondContact N-OD1 3.28Å
87	I	97.8	Very high	96.5	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.236	C	C	.	.			trans	-68.7	121.8	-177	-58.1	175	0	0	0	108.8	L66 I67 V69 L82 N85 T89 N109 A110 I111	L66-I87 HydrophobicContact CB-CG1 4.41Å; L66-I87 VanDerWaalsContact O-CG1 3.31Å; L66-I87 WeakPolarHBondContact O-CG1 3.35Å; L66-I87 PolarHBondContact O-N 2.8Å; I67-I87 WeakPolarHBondContact O-CA 3.42Å; V69-I87 HydrophobicContact CG2-CD1 4.24Å; L82-I87 HydrophobicContact CB-CD1 4.24Å; L82-I87 HydrophobicContact CD1-CD1 4.36Å; N85-I87 HydrophobicContact CB-CG1 4.41Å; I87-T89 WeakPolarHBondContact CG2-O 3.34Å; I87-N109 HydrophobicContact CB-CB 4.41Å; I87-N109 WeakPolarHBondContact CB-OD1 3.44Å; I87-N109 WeakPolarHBondContact CG1-OD1 3.5Å; I87-N109 PolarHBondContact N-OD1 2.95Å; I87-N109 VanDerWaalsContact N-OD1 3.08Å; I87-A110 CarbonylContact O-C 3.56Å; I87-A110 WeakPolarHBondContact O-CA 3.3Å; I87-A110 PolarHBondContact O-N 3.32Å; I87-I111 HydrophobicContact CB-CG1 4.43Å; I87-I111 HydrophobicContact CG2-CG1 4.32Å; I87-I111 WeakPolarHBondContact O-CA 3.24Å; I87-I111 VanDerWaalsContact O-CG1 3.27Å; I87-I111 WeakPolarHBondContact O-CG1 3.39Å; I87-I111 PolarHBondContact O-N 3.03Å
88	E	96.8	Very high	96.5	Very high	75 Å²	75	48.5 Å²	48.5	35%	0.35	24%	0.238	S	C	.	.			trans	-97.1	-29.8	-176.4	-58.3	-144.7	125.2	0	0	114.1	S86 A110 I111 R112	S86-E88 PolarHBondContact O-N 3.15Å; E88-A110 HydrophobicContact CG-CB 4.08Å; E88-I111 WeakPolarHBondContact O-CA 3.31Å; E88-R112 PolarHBondContact O-N 2.86Å; E88-R112 IonicContact OE1-CZ 2.71Å; E88-R112 IonicContact OE1-NE 3.76Å; E88-R112 PolarHBondContact OE1-NE 2.71Å; E88-R112 IonicContact OE1-NH2 2.75Å; E88-R112 PolarHBondContact OE1-NH2 3.09Å; E88-R112 IonicContact OE2-NH2 2.78Å
89	T	96.7	Very high	96.4	Very high	57 Å²	57	46.8 Å²	46.8	35%	0.35	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	152.4	-178.5	60.8	0	0	0	0	111.9	I87 Q113	I87-T89 WeakPolarHBondContact CG2-O 3.34Å; T89-Q113 WeakPolarHBondContact CA-O 3.46Å; T89-Q113 HydrophobicContact CG2-CB 4.29Å
90	I	97.3	Very high	96.3	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.005	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	121.7	168.8	-48.9	-178	0	0	0	108.2	T94 F95 L106 I111 Q113 I114 E115 A118 F119	I90-T94 HydrophobicContact CG2-CG2 4.39Å; I90-F95 HydrophobicContact CG2-CE2 3.73Å; I90-F95 HydrophobicContact CG2-CZ 4.41Å; I90-L106 HydrophobicContact CD1-CD1 3.59Å; I90-L106 HydrophobicContact CD1-CD2 4.2Å; I90-L106 HydrophobicContact CD1-CG 4.48Å; I90-I111 HydrophobicContact CD1-CD1 4.08Å; I90-I111 HydrophobicContact CG1-CD1 4.44Å; I90-I111 HydrophobicContact CG1-CG2 4.35Å; I90-Q113 PolarHBondContact N-O 3.26Å; I90-Q113 VanDerWaalsContact N-O 3.13Å; I90-I114 HydrophobicContact CB-CG1 4.33Å; I90-I114 HydrophobicContact CB-CG2 4.35Å; I90-I114 HydrophobicContact CD1-CD1 4.1Å; I90-I114 HydrophobicContact CD1-CG1 4.08Å; I90-I114 HydrophobicContact CG1-CG1 4.22Å; I90-E115 PolarHBondContact O-N 3.2Å; I90-A118 HydrophobicContact CB-CB 4.37Å; I90-A118 HydrophobicContact CG2-CB 3.85Å; I90-F119 HydrophobicContact CD1-CE1 4.32Å; I90-F119 HydrophobicContact CD1-CZ 4.26Å
91	Q	95.6	Very high	96.2	Very high	104 Å²	104	48.5 Å²	48.5	49%	0.486	25%	0.245	S	C	.	.			trans	-87.4	158.2	-174.9	-53.4	-168.5	-91	0	0	111.7	T94 E115 A118	Q91-T94 PolarHBondContact N-OG1 3.45Å; Q91-T94 WeakPolarHBondContact O-CB 3.35Å; Q91-T94 PolarHBondContact O-N 3.18Å; Q91-T94 PolarHBondContact O-OG1 3.27Å; Q91-E115 VanDerWaalsContact CA-OE2 3.3Å; Q91-E115 WeakPolarHBondContact CA-OE2 3.34Å; Q91-A118 WeakPolarHBondContact O-CA 3.46Å
92	A	95.6	Very high	96.2	Very high	47 Å²	47	51.2 Å²	51.2	39%	0.388	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.3	143.2	172.5	0	0	0	0	0	111.3	T94 E115	A92-T94 PolarHBondContact O-N 3.45Å; A92-E115 HydrophobicContact CB-CB 4.43Å; A92-E115 PolarHBondContact N-OE2 3.49Å
93	D	93.9	Very high	96.3	Very high	50 Å²	50	52.8 Å²	52.8	27%	0.267	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.3	8.3	179.1	-71.2	-9.6	0	0	0	117	F95 R96 G117 N120	D93-F95 PolarHBondContact O-N 2.64Å; D93-R96 HydrophobicContact CB-CB 3.9Å; D93-R96 WeakPolarHBondContact O-CB 3.03Å; D93-R96 PolarHBondContact O-N 2.98Å; D93-R96 VanDerWaalsContact OD2-CD 3.23Å; D93-R96 WeakPolarHBondContact OD2-CD 3.32Å; D93-R96 IonicContact OD2-CZ 3.81Å; D93-R96 IonicContact OD2-NE 3.87Å; D93-R96 IonicContact OD2-NH1 3.2Å; D93-R96 PolarHBondContact OD2-NH1 3.27Å; D93-G117 PolarHBondContact N-O 3.06Å; D93-N120 VanDerWaalsContact OD1-CB 3.26Å; D93-N120 WeakPolarHBondContact OD1-CB 3.41Å; D93-N120 PolarHBondContact OD1-ND2 3.39Å
94	T	95	Very high	96.3	Very high	46 Å²	46	51.1 Å²	51.1	28%	0.282	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.8	-37.6	-178.2	-65.9	0	0	0	0	113.2	V69 I90 Q91 A92	V69-T94 HydrophobicContact CB-CG2 3.83Å; V69-T94 HydrophobicContact CG1-CG2 3.88Å; V69-T94 HydrophobicContact CG2-CG2 3.88Å; I90-T94 HydrophobicContact CG2-CG2 4.39Å; Q91-T94 PolarHBondContact N-OG1 3.45Å; Q91-T94 WeakPolarHBondContact O-CB 3.35Å; Q91-T94 PolarHBondContact O-N 3.18Å; Q91-T94 PolarHBondContact O-OG1 3.27Å; A92-T94 PolarHBondContact O-N 3.45Å
95	F	95.4	Very high	96.4	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.6	12.7	-178.3	-51.5	-73.3	0	0	0	114.3	V69 L80 L82 I90 D93 H97 L98 L104 L106 F119 L122	V69-F95 HydrophobicContact CG1-CE1 3.81Å; V69-F95 HydrophobicContact CG1-CZ 4.34Å; V69-F95 HydrophobicContact CG2-CE1 4.26Å; V69-F95 HydrophobicContact CG2-CZ 3.95Å; L80-F95 HydrophobicContact CD2-CD1 4.19Å; L80-F95 HydrophobicContact CD2-CE1 3.91Å; L82-F95 HydrophobicContact CD1-CE1 4.41Å; I90-F95 HydrophobicContact CG2-CE2 3.73Å; I90-F95 HydrophobicContact CG2-CZ 4.41Å; D93-F95 PolarHBondContact O-N 2.64Å; F95-H97 PolarHBondContact O-N 3.31Å; F95-L98 HydrophobicContact CB-CD1 4.26Å; F95-L98 HydrophobicContact CD1-CD1 4.01Å; F95-L98 WeakPolarHBondContact O-CB 3.46Å; F95-L98 PolarHBondContact O-N 3.23Å; F95-L104 HydrophobicContact CD2-CD2 4.09Å; F95-L104 HydrophobicContact CE1-CD1 4.17Å; F95-L104 HydrophobicContact CE1-CD2 4.42Å; F95-L104 HydrophobicContact CE2-CD2 3.87Å; F95-L104 HydrophobicContact CG-CD2 4.45Å; F95-L104 HydrophobicContact CZ-CD1 4.21Å; F95-L104 HydrophobicContact CZ-CD2 4.05Å; F95-L106 HydrophobicContact CE2-CD1 4.49Å; F95-L106 HydrophobicContact CZ-CD1 4.33Å; F95-L106 HydrophobicContact CZ-CD2 4.48Å; F95-F119 AromaticContact CD2-CD1 3.99Å; F95-F119 HydrophobicContact CD2-CD1 3.99Å; F95-F119 HydrophobicContact CD2-CE1 4.33Å; F95-F119 HydrophobicContact CE2-CD1 4.12Å; F95-F119 AromaticContact CE2-CE1 3.99Å; F95-F119 HydrophobicContact CE2-CE1 3.99Å; F95-L122 HydrophobicContact CB-CD1 3.92Å; F95-L122 HydrophobicContact CB-CD2 3.73Å; F95-L122 HydrophobicContact CB-CG 3.98Å; F95-L122 HydrophobicContact CD2-CD1 4.33Å; F95-L122 HydrophobicContact CG-CD1 4.35Å
96	R	94.1	Very high	96.4	Very high	133 Å²	133	48.8 Å²	48.8	50%	0.502	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52	-28.1	-167.8	176.8	165.4	170.1	171	-0.1	116.1	D93 H99 N120	D93-R96 HydrophobicContact CB-CB 3.9Å; D93-R96 WeakPolarHBondContact O-CB 3.03Å; D93-R96 PolarHBondContact O-N 2.98Å; D93-R96 VanDerWaalsContact OD2-CD 3.23Å; D93-R96 WeakPolarHBondContact OD2-CD 3.32Å; D93-R96 IonicContact OD2-CZ 3.81Å; D93-R96 IonicContact OD2-NE 3.87Å; D93-R96 IonicContact OD2-NH1 3.2Å; D93-R96 PolarHBondContact OD2-NH1 3.27Å; R96-H99 PolarHBondContact O-CE1 3.2Å; R96-N120 WeakPolarHBondContact CA-O 3.5Å
97	H	93.4	Very high	96.4	Very high	133 Å²	133	46 Å²	46	62%	0.616	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-8.7	-176.9	-47.1	97.4	0	0	0	113.9	F95 H99	F95-H97 PolarHBondContact O-N 3.31Å; H97-H99 VanDerWaalsContact C-N 3.33Å; H97-H99 PolarHBondContact O-N 3.17Å; H97-H99 VanDerWaalsContact O-N 3.17Å
98	L	95.1	Very high	96.4	Very high	7 Å²	7	51.8 Å²	51.8	4%	0.037	25%	0.25	C	C	.	.			trans	-93	54	-169.5	-52.7	-175.9	0	0	0	112.1	I73 P74 L80 F95 H100 L101 L122	I73-L98 HydrophobicContact CB-CD1 4.4Å; I73-L98 HydrophobicContact CB-CD2 4.34Å; I73-L98 HydrophobicContact CG2-CD1 3.87Å; I73-L98 HydrophobicContact CG2-CD2 3.95Å; P74-L98 WeakPolarHBondContact O-CD2 3.09Å; L80-L98 HydrophobicContact CD2-CD1 4.16Å; F95-L98 HydrophobicContact CB-CD1 4.26Å; F95-L98 HydrophobicContact CD1-CD1 4.01Å; F95-L98 WeakPolarHBondContact O-CB 3.46Å; F95-L98 PolarHBondContact O-N 3.23Å; L98-H100 PolarHBondContact O-N 2.67Å; L98-L101 HydrophobicContact CB-CB 4.05Å; L98-L101 HydrophobicContact CB-CD2 4.49Å; L98-L101 HydrophobicContact CD1-CD2 4.28Å; L98-L101 VanDerWaalsContact O-CB 3.26Å; L98-L101 WeakPolarHBondContact O-CB 3.38Å; L98-L101 PolarHBondContact O-N 3.26Å; L98-L122 HydrophobicContact CB-CD2 3.87Å; L98-L122 WeakPolarHBondContact O-CD2 3.39Å
99	H	94.8	Very high	96.5	Very high	94 Å²	94	48.8 Å²	48.8	44%	0.435	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-20.7	-175.9	-54.4	-44.8	0	0	0	114.6	R96 H97 G121 S124	R96-H99 PolarHBondContact O-CE1 3.2Å; H97-H99 VanDerWaalsContact C-N 3.33Å; H97-H99 PolarHBondContact O-N 3.17Å; H97-H99 VanDerWaalsContact O-N 3.17Å; H99-G121 PolarHBondContact ND1-O 3.13Å; H99-S124 WeakPolarHBondContact O-CB 3.37Å; H99-S124 PolarHBondContact O-OG 2.81Å
100	H	95.9	Very high	96.5	Very high	93 Å²	93	47.1 Å²	47.1	43%	0.431	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-2.1	177.7	-58.6	109.6	0	0	0	114.1	A75 T77 R78 L98 E102	A75-H100 PolarHBondContact O-ND1 2.85Å; A75-H100 VanDerWaalsContact O-ND1 3.08Å; T77-H100 CarbonylContact O-C 3.57Å; R78-H100 WeakPolarHBondContact CA-O 3.2Å; R78-H100 HydrophobicContact CG-CB 4.45Å; R78-H100 WeakPolarHBondContact CG-O 3.35Å; L98-H100 PolarHBondContact O-N 2.67Å; H100-E102 PolarHBondContact O-N 3.38Å
101	L	97.5	Very high	96.6	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.227	C	C	.	.			trans	-69.1	120.5	-175.4	-165.6	70.5	0	0	0	110.6	T77 L80 L98 L104 L122 S124 L125	T77-L101 HydrophobicContact CG2-CD1 3.84Å; T77-L101 WeakPolarHBondContact O-CA 3.42Å; T77-L101 PolarHBondContact O-N 2.71Å; L80-L101 HydrophobicContact CB-CD1 3.65Å; L98-L101 HydrophobicContact CB-CB 4.05Å; L98-L101 HydrophobicContact CB-CD2 4.49Å; L98-L101 HydrophobicContact CD1-CD2 4.28Å; L98-L101 VanDerWaalsContact O-CB 3.26Å; L98-L101 WeakPolarHBondContact O-CB 3.38Å; L98-L101 PolarHBondContact O-N 3.26Å; L101-L104 HydrophobicContact CD2-CB 3.95Å; L101-L104 HydrophobicContact CD2-CD1 4.29Å; L101-L104 HydrophobicContact CD2-CD2 4.23Å; L101-L104 HydrophobicContact CD2-CG 4.39Å; L101-L122 HydrophobicContact CB-CD2 3.99Å; L101-L122 HydrophobicContact CD2-CD1 4.3Å; L101-L122 HydrophobicContact CD2-CD2 3.81Å; L101-S124 CarbonylContact O-C 3.29Å; L101-L125 HydrophobicContact CD2-CD1 4.37Å; L101-L125 HydrophobicContact CG-CD1 4.36Å; L101-L125 WeakPolarHBondContact O-CA 3.26Å; L101-L125 PolarHBondContact O-N 2.91Å
102	E	97.9	Very high	96.6	Very high	71 Å²	71	49.2 Å²	49.2	33%	0.332	23%	0.231	S	C	.	.			trans	-100.9	-36.3	179.1	-67.7	167	-151.6	0	0	111	R78 H100 N126 T127	R78-E102 WeakPolarHBondContact CD-OE1 3.44Å; R78-E102 IonicContact CZ-OE1 3.62Å; R78-E102 IonicContact NE-OE1 3.74Å; R78-E102 IonicContact NH1-OE1 2.77Å; R78-E102 PolarHBondContact NH1-OE1 3.27Å; R78-E102 PolarHBondContact O-N 3.47Å; H100-E102 PolarHBondContact O-N 3.38Å; E102-N126 WeakPolarHBondContact O-CA 3.39Å; E102-N126 WeakPolarHBondContact O-CB 3.27Å; E102-N126 PolarHBondContact O-N 2.98Å; E102-T127 PolarHBondContact O-N 3.36Å; E102-T127 VanDerWaalsContact O-N 3.08Å
103	V	98.5	Very high	96.7	Very high	32 Å²	32	52.6 Å²	52.6	19%	0.194	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	125.1	-177.6	-177.7	0	0	0	0	110.8	R78 Y79 L80 Q105	R78-V103 PolarHBondContact O-N 3.28Å; Y79-V103 HydrophobicContact CD2-CB 3.88Å; Y79-V103 HydrophobicContact CD2-CG1 3.87Å; Y79-V103 HydrophobicContact CD2-CG2 4.49Å; Y79-V103 HydrophobicContact CE2-CG1 4.1Å; L80-V103 PolarHBondContact N-O 3.04Å; V103-Q105 HydrophobicContact CG1-CG 3.9Å
104	L	98.4	Very high	96.8	Very high	0 Å²	0	51 Å²	51	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	109.4	176.9	178.2	51	0	0	0	110.5	L80 F95 L101 L106 F119 L122 L125 T127 L128 E129	L80-L104 HydrophobicContact CB-CD1 4.22Å; L80-L104 HydrophobicContact CD2-CD1 3.86Å; L80-L104 HydrophobicContact CG-CD1 4.09Å; F95-L104 HydrophobicContact CD2-CD2 4.09Å; F95-L104 HydrophobicContact CE1-CD1 4.17Å; F95-L104 HydrophobicContact CE1-CD2 4.42Å; F95-L104 HydrophobicContact CE2-CD2 3.87Å; F95-L104 HydrophobicContact CG-CD2 4.45Å; F95-L104 HydrophobicContact CZ-CD1 4.21Å; F95-L104 HydrophobicContact CZ-CD2 4.05Å; L101-L104 HydrophobicContact CD2-CB 3.95Å; L101-L104 HydrophobicContact CD2-CD1 4.29Å; L101-L104 HydrophobicContact CD2-CD2 4.23Å; L101-L104 HydrophobicContact CD2-CG 4.39Å; L104-L106 HydrophobicContact CD1-CD1 4.05Å; L104-L106 HydrophobicContact CD1-CG 4.04Å; L104-L106 HydrophobicContact CD2-CD1 3.86Å; L104-L106 HydrophobicContact CG-CD1 3.74Å; L104-L106 HydrophobicContact CG-CG 4.14Å; L104-F119 HydrophobicContact CD2-CD1 4.09Å; L104-F119 HydrophobicContact CD2-CE1 3.94Å; L104-L122 HydrophobicContact CD2-CD1 4.04Å; L104-L125 HydrophobicContact CB-CD1 3.76Å; L104-T127 PolarHBondContact N-O 2.91Å; L104-L128 HydrophobicContact CB-CD1 4.1Å; L104-L128 HydrophobicContact CD2-CD1 3.96Å; L104-L128 HydrophobicContact CG-CD1 3.97Å; L104-E129 PolarHBondContact O-N 3.38Å
105	Q	98.6	Very high	96.9	Very high	22 Å²	22	52 Å²	52	10%	0.103	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	107.6	-179.8	-46.8	-168.5	-55.1	0	0	111.6	Y79 L80 N81 L82 M83 V103 E129	Y79-Q105 HydrophobicContact CE2-CG 4.44Å; Y79-Q105 VanDerWaalsContact CZ-OE1 3.29Å; Y79-Q105 PolarHBondContact OH-OE1 3.25Å; L80-Q105 PolarHBondContact O-N 2.91Å; N81-Q105 HydrophobicContact CB-CB 4.3Å; N81-Q105 VanDerWaalsContact CG-OE1 3.24Å; N81-Q105 PolarHBondContact ND2-OE1 2.86Å; L82-Q105 PolarHBondContact N-O 3.19Å; M83-Q105 HydrophobicContact CE-CB 4.37Å; M83-Q105 HydrophobicContact CG-CB 3.79Å; M83-Q105 HydrophobicContact SD-CB 4.13Å; V103-Q105 HydrophobicContact CG1-CG 3.9Å; Q105-E129 WeakPolarHBondContact CB-OE2 3.42Å; Q105-E129 VanDerWaalsContact CD-OE2 3.27Å; Q105-E129 VanDerWaalsContact CG-OE2 3.25Å; Q105-E129 WeakPolarHBondContact CG-OE2 3.45Å; Q105-E129 PolarHBondContact NE2-OE1 3.06Å; Q105-E129 PolarHBondContact NE2-OE2 3.19Å
106	L	98.1	Very high	96.8	Very high	0 Å²	0	57 Å²	57	0%	0	26%	0.262	C	S	.	.			trans	-118	5.9	179.2	-73.2	157.6	0	0	0	112.2	L82 I90 F95 L104 N109 I111 F119 L128 E129 L130 N133	L82-L106 HydrophobicContact CB-CD2 4.2Å; L82-L106 HydrophobicContact CD1-CD2 3.83Å; I90-L106 HydrophobicContact CD1-CD1 3.59Å; I90-L106 HydrophobicContact CD1-CD2 4.2Å; I90-L106 HydrophobicContact CD1-CG 4.48Å; F95-L106 HydrophobicContact CE2-CD1 4.49Å; F95-L106 HydrophobicContact CZ-CD1 4.33Å; F95-L106 HydrophobicContact CZ-CD2 4.48Å; L104-L106 HydrophobicContact CD1-CD1 4.05Å; L104-L106 HydrophobicContact CD1-CG 4.04Å; L104-L106 HydrophobicContact CD2-CD1 3.86Å; L104-L106 HydrophobicContact CG-CD1 3.74Å; L104-L106 HydrophobicContact CG-CG 4.14Å; L106-N109 PolarHBondContact O-ND2 3.48Å; L106-I111 HydrophobicContact CB-CD1 4.01Å; L106-I111 HydrophobicContact CD2-CD1 4.33Å; L106-F119 HydrophobicContact CD1-CE1 4.15Å; L106-L128 HydrophobicContact CD1-CD1 4.32Å; L106-E129 CarbonylContact C-O 3.09Å; L106-E129 WeakPolarHBondContact CA-O 3.38Å; L106-E129 WeakPolarHBondContact CB-O 3.14Å; L106-E129 PolarHBondContact N-O 2.95Å; L106-L130 HydrophobicContact CB-CD2 3.88Å; L106-L130 HydrophobicContact CD1-CD2 3.98Å; L106-N133 PolarHBondContact O-ND2 2.88Å
107	G	97.7	Very high	96.8	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	24%	0.24	C	C	.	.			trans	-58.8	156.9	177.8	0	0	0	0	0	113.6	M83 N109 E129 F131	M83-G107 WeakPolarHBondContact CA-O 3.38Å; M83-G107 WeakPolarHBondContact CB-O 3.39Å; M83-G107 WeakPolarHBondContact CG-O 3.27Å; G107-N109 PolarHBondContact O-ND2 2.94Å; G107-E129 PolarHBondContact N-O 3.01Å; G107-F131 CarbonylContact C-O 3.09Å; G107-F131 WeakPolarHBondContact CA-O 3.25Å
108	R	98	Very high	96.9	Very high	123 Å²	123	44.5 Å²	44.5	46%	0.464	21%	0.211	S	C	.	.	S	Bend	trans	53.9	57.1	-178	-64.1	177.9	180	172.5	3.5	112.7	E84 N85 F131 D132	E84-R108 WeakPolarHBondContact CA-O 3.33Å; E84-R108 HydrophobicContact CG-CB 3.8Å; E84-R108 HydrophobicContact CG-CG 4.38Å; E84-R108 PolarHBondContact N-O 2.64Å; E84-R108 WeakPolarHBondContact OE1-CD 3.34Å; E84-R108 IonicContact OE1-CZ 3.76Å; E84-R108 IonicContact OE1-NH1 3.42Å; E84-R108 PolarHBondContact OE1-NH1 2.68Å; N85-R108 PolarHBondContact N-O 3Å; R108-F131 HydrophobicContact CG-CE2 4.09Å; R108-F131 PolarHBondContact N-O 3.46Å; R108-D132 WeakPolarHBondContact CA-O 3.35Å; R108-D132 HydrophobicContact CB-CB 4.4Å; R108-D132 HydrophobicContact CG-CB 3.59Å; R108-D132 WeakPolarHBondContact CG-OD2 3.06Å; R108-D132 IonicContact CZ-OD2 2.69Å; R108-D132 IonicContact NE-OD2 3.45Å; R108-D132 PolarHBondContact NE-OD2 3.07Å; R108-D132 IonicContact NH2-OD2 2.66Å
109	N	98.4	Very high	97	Very high	11 Å²	11	44.2 Å²	44.2	6%	0.059	21%	0.209	C	C	.	.	S	Bend	trans	-128.1	-170.6	173.4	-88.4	-82.7	0	0	0	109.9	L82 N85 S86 I87 L106 G107 I111 N133	L82-N109 PolarHBondContact O-ND2 3.06Å; N85-N109 WeakPolarHBondContact CA-OD1 3.42Å; N85-N109 WeakPolarHBondContact CB-OD1 3.45Å; N85-N109 PolarHBondContact O-OD1 2.94Å; S86-N109 PolarHBondContact N-OD1 3.28Å; I87-N109 HydrophobicContact CB-CB 4.41Å; I87-N109 WeakPolarHBondContact CB-OD1 3.44Å; I87-N109 WeakPolarHBondContact CG1-OD1 3.5Å; I87-N109 PolarHBondContact N-OD1 2.95Å; I87-N109 VanDerWaalsContact N-OD1 3.08Å; L106-N109 PolarHBondContact O-ND2 3.48Å; G107-N109 PolarHBondContact O-ND2 2.94Å; N109-I111 HydrophobicContact CB-CD1 4.01Å; N109-I111 HydrophobicContact CB-CG1 3.89Å; N109-N133 WeakPolarHBondContact CA-OD1 3.41Å; N109-N133 WeakPolarHBondContact CB-OD1 3.47Å; N109-N133 PolarHBondContact N-OD1 2.82Å; N109-N133 PolarHBondContact O-OD1 3.01Å
110	A	97.9	Very high	97	Very high	22 Å²	22	42 Å²	42	18%	0.182	20%	0.201	C	C	.	.			trans	-104.4	20.4	178.8	0	0	0	0	0	112.3	I87 E88 R112	I87-A110 CarbonylContact O-C 3.56Å; I87-A110 WeakPolarHBondContact O-CA 3.3Å; I87-A110 PolarHBondContact O-N 3.32Å; E88-A110 HydrophobicContact CG-CB 4.08Å; A110-R112 VanDerWaalsContact O-CG 3.24Å; A110-R112 WeakPolarHBondContact O-CG 3.27Å; A110-R112 PolarHBondContact O-N 3.18Å; A110-R112 VanDerWaalsContact O-N 3.15Å
111	I	98.4	Very high	96.8	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.193	C	C	.	.			trans	-67.1	116.1	-163.1	-57	161.5	0	0	0	110.1	I87 E88 I90 L106 N109 I114 L130 N133 R134 L135	I87-I111 HydrophobicContact CB-CG1 4.43Å; I87-I111 HydrophobicContact CG2-CG1 4.32Å; I87-I111 WeakPolarHBondContact O-CA 3.24Å; I87-I111 VanDerWaalsContact O-CG1 3.27Å; I87-I111 WeakPolarHBondContact O-CG1 3.39Å; I87-I111 PolarHBondContact O-N 3.03Å; E88-I111 WeakPolarHBondContact O-CA 3.31Å; I90-I111 HydrophobicContact CD1-CD1 4.08Å; I90-I111 HydrophobicContact CG1-CD1 4.44Å; I90-I111 HydrophobicContact CG1-CG2 4.35Å; L106-I111 HydrophobicContact CB-CD1 4.01Å; L106-I111 HydrophobicContact CD2-CD1 4.33Å; N109-I111 HydrophobicContact CB-CD1 4.01Å; N109-I111 HydrophobicContact CB-CG1 3.89Å; I111-I114 HydrophobicContact CG2-CD1 4.13Å; I111-I114 HydrophobicContact CG2-CG1 3.73Å; I111-L130 HydrophobicContact CD1-CD2 4.21Å; I111-N133 HydrophobicContact CB-CB 4.49Å; I111-N133 VanDerWaalsContact CB-OD1 3.27Å; I111-N133 WeakPolarHBondContact CB-OD1 3.39Å; I111-N133 WeakPolarHBondContact CD1-OD1 3.44Å; I111-N133 VanDerWaalsContact CG1-OD1 3.3Å; I111-N133 WeakPolarHBondContact CG1-OD1 3.21Å; I111-N133 PolarHBondContact N-OD1 2.88Å; I111-R134 CarbonylContact O-C 3.51Å; I111-R134 VanDerWaalsContact O-CA 3.24Å; I111-R134 WeakPolarHBondContact O-CA 3.3Å; I111-R134 WeakPolarHBondContact O-CB 3.08Å; I111-R134 PolarHBondContact O-N 2.8Å; I111-L135 HydrophobicContact CG2-CD2 4.07Å; I111-L135 PolarHBondContact O-N 2.99Å; I111-L135 VanDerWaalsContact O-N 3.15Å
112	R	96.9	Very high	96.7	Very high	150 Å²	150	39 Å²	39	57%	0.566	19%	0.194	S	C	*	.			trans	-101.6	-32.2	178.9	-45.6	-176.1	-163.4	-165	6.5	112.1	E88 A110 R134	E88-R112 PolarHBondContact O-N 2.86Å; E88-R112 IonicContact OE1-CZ 2.71Å; E88-R112 IonicContact OE1-NE 3.76Å; E88-R112 PolarHBondContact OE1-NE 2.71Å; E88-R112 IonicContact OE1-NH2 2.75Å; E88-R112 PolarHBondContact OE1-NH2 3.09Å; E88-R112 IonicContact OE2-NH2 2.78Å; A110-R112 VanDerWaalsContact O-CG 3.24Å; A110-R112 WeakPolarHBondContact O-CG 3.27Å; A110-R112 PolarHBondContact O-N 3.18Å; A110-R112 VanDerWaalsContact O-N 3.15Å; R112-R134 HydrophobicContact CG-CB 3.91Å
113	Q	96.1	Very high	96.6	Very high	118 Å²	118	39.2 Å²	39.2	55%	0.551	20%	0.2	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-140.6	138	-174.1	-176.3	176.9	-8.5	0	0	111.3	T89 I90	T89-Q113 WeakPolarHBondContact CA-O 3.46Å; T89-Q113 HydrophobicContact CG2-CB 4.29Å; I90-Q113 PolarHBondContact N-O 3.26Å; I90-Q113 VanDerWaalsContact N-O 3.13Å
114	I	97.5	Very high	96.4	Very high	16 Å²	16	39 Å²	39	8%	0.082	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	123.5	172.8	-61.4	177.6	0	0	0	106.3	I90 I111 A118 F119 L130 L135 P139 A142	I90-I114 HydrophobicContact CB-CG1 4.33Å; I90-I114 HydrophobicContact CB-CG2 4.35Å; I90-I114 HydrophobicContact CD1-CD1 4.1Å; I90-I114 HydrophobicContact CD1-CG1 4.08Å; I90-I114 HydrophobicContact CG1-CG1 4.22Å; I111-I114 HydrophobicContact CG2-CD1 4.13Å; I111-I114 HydrophobicContact CG2-CG1 3.73Å; I114-A118 HydrophobicContact CG2-CB 3.58Å; I114-F119 HydrophobicContact CD1-CE2 4.43Å; I114-F119 HydrophobicContact CD1-CZ 4.17Å; I114-F119 HydrophobicContact CG2-CE2 3.84Å; I114-F119 HydrophobicContact CG2-CZ 4.09Å; I114-L130 HydrophobicContact CD1-CD1 3.93Å; I114-L130 HydrophobicContact CD1-CD2 3.81Å; I114-L135 HydrophobicContact CD1-CD1 4.34Å; I114-L135 HydrophobicContact CD1-CD2 4.14Å; I114-L135 HydrophobicContact CG1-CD2 4.17Å; I114-P139 HydrophobicContact CB-CB 4.18Å; I114-P139 HydrophobicContact CB-CG 4.43Å; I114-P139 HydrophobicContact CD1-CG 4.28Å; I114-A142 HydrophobicContact CG2-CB 3.57Å
115	E	95.7	Very high	96.4	Very high	66 Å²	66	39 Å²	39	31%	0.308	20%	0.2	S	C	.	.			trans	-74.1	155.9	-177.8	-70.7	173.6	-163.1	0	0	112.3	I90 Q91 A92 G117 A118	I90-E115 PolarHBondContact O-N 3.2Å; Q91-E115 VanDerWaalsContact CA-OE2 3.3Å; Q91-E115 WeakPolarHBondContact CA-OE2 3.34Å; A92-E115 HydrophobicContact CB-CB 4.43Å; A92-E115 PolarHBondContact N-OE2 3.49Å; E115-G117 PolarHBondContact O-N 3.11Å; E115-A118 WeakPolarHBondContact O-CB 3.38Å; E115-A118 PolarHBondContact O-N 3.42Å
116	V	95	Very high	96.4	Very high	105 Å²	105	40.8 Å²	40.8	64%	0.636	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	130.1	172	175.8	0	0	0	0	108.6	A118	V116-A118 VanDerWaalsContact C-N 3.31Å; V116-A118 PolarHBondContact O-N 3.15Å
117	G	93.3	Very high	96.4	Very high	5 Å²	5	41.3 Å²	41.3	5%	0.052	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.4	12.4	-174.4	0	0	0	0	0	115.7	D93 E115 F119 N120	D93-G117 PolarHBondContact N-O 3.06Å; E115-G117 PolarHBondContact O-N 3.11Å; G117-F119 PolarHBondContact O-N 3.44Å; G117-N120 WeakPolarHBondContact CA-OD1 3.24Å; G117-N120 VanDerWaalsContact O-CB 3.25Å; G117-N120 WeakPolarHBondContact O-CB 3.25Å; G117-N120 PolarHBondContact O-N 3.26Å; G117-N120 VanDerWaalsContact O-N 3.07Å; G117-N120 PolarHBondContact O-ND2 3.18Å
118	A	96.3	Very high	96.5	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-31.5	174.1	0	0	0	0	0	113.7	I90 Q91 I114 E115 V116	I90-A118 HydrophobicContact CB-CB 4.37Å; I90-A118 HydrophobicContact CG2-CB 3.85Å; Q91-A118 WeakPolarHBondContact O-CA 3.46Å; I114-A118 HydrophobicContact CG2-CB 3.58Å; E115-A118 WeakPolarHBondContact O-CB 3.38Å; E115-A118 PolarHBondContact O-N 3.42Å; V116-A118 VanDerWaalsContact C-N 3.31Å; V116-A118 PolarHBondContact O-N 3.15Å
119	F	96.7	Very high	96.5	Very high	1 Å²	1	36.7 Å²	36.7	0%	0.004	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.1	16.3	178.5	-56.2	-56.7	0	0	0	113.7	I90 F95 L104 L106 I114 G117 L122 L128 L130 A142 F143 L146	I90-F119 HydrophobicContact CD1-CE1 4.32Å; I90-F119 HydrophobicContact CD1-CZ 4.26Å; F95-F119 AromaticContact CD2-CD1 3.99Å; F95-F119 HydrophobicContact CD2-CD1 3.99Å; F95-F119 HydrophobicContact CD2-CE1 4.33Å; F95-F119 HydrophobicContact CE2-CD1 4.12Å; F95-F119 AromaticContact CE2-CE1 3.99Å; F95-F119 HydrophobicContact CE2-CE1 3.99Å; L104-F119 HydrophobicContact CD2-CD1 4.09Å; L104-F119 HydrophobicContact CD2-CE1 3.94Å; L106-F119 HydrophobicContact CD1-CE1 4.15Å; I114-F119 HydrophobicContact CD1-CE2 4.43Å; I114-F119 HydrophobicContact CD1-CZ 4.17Å; I114-F119 HydrophobicContact CG2-CE2 3.84Å; I114-F119 HydrophobicContact CG2-CZ 4.09Å; G117-F119 PolarHBondContact O-N 3.44Å; F119-L122 HydrophobicContact CB-CD1 4.07Å; F119-L122 HydrophobicContact CD1-CD1 4.06Å; F119-L122 WeakPolarHBondContact O-CB 3.4Å; F119-L122 WeakPolarHBondContact O-CG 3.3Å; F119-L122 PolarHBondContact O-N 2.97Å; F119-L128 HydrophobicContact CD2-CD2 4.24Å; F119-L128 HydrophobicContact CE1-CD1 4.11Å; F119-L128 HydrophobicContact CE1-CD2 4.38Å; F119-L128 HydrophobicContact CE2-CD2 3.87Å; F119-L128 HydrophobicContact CZ-CD1 4.17Å; F119-L128 HydrophobicContact CZ-CD2 3.95Å; F119-L130 HydrophobicContact CZ-CD1 4.32Å; F119-A142 HydrophobicContact CD2-CB 3.96Å; F119-A142 WeakPolarHBondContact CD2-O 3.43Å; F119-A142 HydrophobicContact CE2-CB 4.08Å; F119-F143 HydrophobicContact CD2-CD1 4.36Å; F119-F143 HydrophobicContact CE2-CD1 4.4Å; F119-F143 HydrophobicContact CE2-CE1 4.28Å; F119-L146 HydrophobicContact CB-CD1 4.09Å; F119-L146 HydrophobicContact CB-CD2 4.09Å; F119-L146 HydrophobicContact CD2-CD1 4.46Å
120	N	94.1	Very high	96.5	Very high	48 Å²	48	36.1 Å²	36.1	26%	0.257	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	149	174.8	-80.3	-14.5	0	0	0	112	D93 R96 G117 L122	D93-N120 VanDerWaalsContact OD1-CB 3.26Å; D93-N120 WeakPolarHBondContact OD1-CB 3.41Å; D93-N120 PolarHBondContact OD1-ND2 3.39Å; R96-N120 WeakPolarHBondContact CA-O 3.5Å; G117-N120 WeakPolarHBondContact CA-OD1 3.24Å; G117-N120 VanDerWaalsContact O-CB 3.25Å; G117-N120 WeakPolarHBondContact O-CB 3.25Å; G117-N120 PolarHBondContact O-N 3.26Å; G117-N120 VanDerWaalsContact O-N 3.07Å; G117-N120 PolarHBondContact O-ND2 3.18Å; N120-L122 PolarHBondContact O-N 2.96Å; N120-L122 VanDerWaalsContact O-N 3.17Å
121	G	92.1	Very high	96.5	Very high	26 Å²	26	36.6 Å²	36.6	27%	0.268	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.3	-8.8	176.7	0	0	0	0	0	115.7	H99 T123	H99-G121 PolarHBondContact ND1-O 3.13Å; G121-T123 PolarHBondContact O-N 3.27Å
122	L	96	Very high	96.5	Very high	4 Å²	4	38 Å²	38	2%	0.021	20%	0.2	C	C	.	.			trans	-78	54.5	-179.1	-64.6	-172.2	0	0	0	113.5	F95 L98 L101 L104 F119 N120 S124 L125 L146	F95-L122 HydrophobicContact CB-CD1 3.92Å; F95-L122 HydrophobicContact CB-CD2 3.73Å; F95-L122 HydrophobicContact CB-CG 3.98Å; F95-L122 HydrophobicContact CD2-CD1 4.33Å; F95-L122 HydrophobicContact CG-CD1 4.35Å; L98-L122 HydrophobicContact CB-CD2 3.87Å; L98-L122 WeakPolarHBondContact O-CD2 3.39Å; L101-L122 HydrophobicContact CB-CD2 3.99Å; L101-L122 HydrophobicContact CD2-CD1 4.3Å; L101-L122 HydrophobicContact CD2-CD2 3.81Å; L104-L122 HydrophobicContact CD2-CD1 4.04Å; F119-L122 HydrophobicContact CB-CD1 4.07Å; F119-L122 HydrophobicContact CD1-CD1 4.06Å; F119-L122 WeakPolarHBondContact O-CB 3.4Å; F119-L122 WeakPolarHBondContact O-CG 3.3Å; F119-L122 PolarHBondContact O-N 2.97Å; N120-L122 PolarHBondContact O-N 2.96Å; N120-L122 VanDerWaalsContact O-N 3.17Å; L122-S124 PolarHBondContact O-N 2.64Å; L122-L125 HydrophobicContact CB-CB 4.07Å; L122-L125 HydrophobicContact CB-CD2 4.42Å; L122-L125 HydrophobicContact CD1-CD2 3.97Å; L122-L125 WeakPolarHBondContact O-CB 3.49Å; L122-L125 PolarHBondContact O-N 3.31Å; L122-L125 VanDerWaalsContact O-N 3.14Å; L122-L146 HydrophobicContact CB-CD2 4.05Å
123	T	94	Very high	96.6	Very high	75 Å²	75	31 Å²	31	46%	0.46	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-3.1	-173.8	58.5	0	0	0	0	115.2	G121 K148	G121-T123 PolarHBondContact O-N 3.27Å; T123-K148 WeakPolarHBondContact O-CD 3.44Å; T123-K148 WeakPolarHBondContact O-CE 3.26Å; T123-K148 PolarHBondContact O-NZ 2.69Å
124	S	96.3	Very high	96.7	Very high	27 Å²	27	32.8 Å²	32.8	19%	0.189	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.6	-0.3	174.9	-60.1	0	0	0	0	114.4	H99 L101 L122 N126 K148	H99-S124 WeakPolarHBondContact O-CB 3.37Å; H99-S124 PolarHBondContact O-OG 2.81Å; L101-S124 CarbonylContact O-C 3.29Å; L122-S124 PolarHBondContact O-N 2.64Å; S124-N126 PolarHBondContact O-N 2.72Å; S124-K148 PolarHBondContact OG-NZ 3.47Å
125	L	97.9	Very high	96.7	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.005	17%	0.172	C	C	.	.			trans	-66.5	129.2	-171.2	-168.4	70.2	0	0	0	111.3	L101 L104 L122 L128 L146 K148 L149	L101-L125 HydrophobicContact CD2-CD1 4.37Å; L101-L125 HydrophobicContact CG-CD1 4.36Å; L101-L125 WeakPolarHBondContact O-CA 3.26Å; L101-L125 PolarHBondContact O-N 2.91Å; L104-L125 HydrophobicContact CB-CD1 3.76Å; L122-L125 HydrophobicContact CB-CB 4.07Å; L122-L125 HydrophobicContact CB-CD2 4.42Å; L122-L125 HydrophobicContact CD1-CD2 3.97Å; L122-L125 WeakPolarHBondContact O-CB 3.49Å; L122-L125 PolarHBondContact O-N 3.31Å; L122-L125 VanDerWaalsContact O-N 3.14Å; L125-L128 HydrophobicContact CD2-CB 4.25Å; L125-L146 HydrophobicContact CD2-CD1 4.43Å; L125-L146 HydrophobicContact CD2-CD2 4.31Å; L125-K148 CarbonylContact O-C 3.58Å; L125-L149 HydrophobicContact CD2-CD1 4.02Å; L125-L149 HydrophobicContact CG-CD1 4.01Å; L125-L149 VanDerWaalsContact O-CA 3.3Å; L125-L149 WeakPolarHBondContact O-CA 3.46Å; L125-L149 PolarHBondContact O-N 3.21Å; L125-L149 VanDerWaalsContact O-N 3.1Å
126	N	98.2	Very high	96.8	Very high	58 Å²	58	31.9 Å²	31.9	31%	0.31	18%	0.175	S	C	.	.			trans	-116	-45.1	-175.3	-173.1	15.9	0	0	0	110.3	E102 S124 R150 E151	E102-N126 WeakPolarHBondContact O-CA 3.39Å; E102-N126 WeakPolarHBondContact O-CB 3.27Å; E102-N126 PolarHBondContact O-N 2.98Å; S124-N126 PolarHBondContact O-N 2.72Å; N126-R150 PolarHBondContact O-N 3Å; N126-R150 WeakPolarHBondContact OD1-CB 3.32Å; N126-R150 WeakPolarHBondContact OD1-CD 3.14Å; N126-R150 WeakPolarHBondContact OD1-CG 3.47Å; N126-E151 PolarHBondContact O-N 3.49Å
127	T	98.7	Very high	96.9	Very high	12 Å²	12	31 Å²	31	7%	0.074	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	125.7	-179.2	-54.9	0	0	0	0	111.3	E102 L104 E129 E151	E102-T127 PolarHBondContact O-N 3.36Å; E102-T127 VanDerWaalsContact O-N 3.08Å; L104-T127 PolarHBondContact N-O 2.91Å; T127-E129 HydrophobicContact CG2-CG 4.3Å; T127-E151 HydrophobicContact CG2-CB 4Å; T127-E151 VanDerWaalsContact CG2-OE2 3.31Å; T127-E151 WeakPolarHBondContact CG2-OE2 3.21Å; T127-E151 PolarHBondContact OG1-OE2 3.38Å
128	L	98.5	Very high	97	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	115.5	175.7	177.9	56.4	0	0	0	110.5	L104 L106 F119 L125 L130 F143 L149 E151 L152 W153	L104-L128 HydrophobicContact CB-CD1 4.1Å; L104-L128 HydrophobicContact CD2-CD1 3.96Å; L104-L128 HydrophobicContact CG-CD1 3.97Å; L106-L128 HydrophobicContact CD1-CD1 4.32Å; F119-L128 HydrophobicContact CD2-CD2 4.24Å; F119-L128 HydrophobicContact CE1-CD1 4.11Å; F119-L128 HydrophobicContact CE1-CD2 4.38Å; F119-L128 HydrophobicContact CE2-CD2 3.87Å; F119-L128 HydrophobicContact CZ-CD1 4.17Å; F119-L128 HydrophobicContact CZ-CD2 3.95Å; L125-L128 HydrophobicContact CD2-CB 4.25Å; L128-L130 HydrophobicContact CD1-CD1 4.45Å; L128-L130 HydrophobicContact CD1-CG 4.23Å; L128-L130 HydrophobicContact CD2-CD1 4.05Å; L128-L130 HydrophobicContact CG-CD1 4.09Å; L128-L130 HydrophobicContact CG-CG 4.19Å; L128-F143 HydrophobicContact CD2-CD1 4.46Å; L128-F143 HydrophobicContact CD2-CE1 4.16Å; L128-L149 HydrophobicContact CB-CD1 3.78Å; L128-E151 PolarHBondContact N-O 2.88Å; L128-L152 HydrophobicContact CB-CD1 4.25Å; L128-L152 HydrophobicContact CD2-CD1 4.04Å; L128-L152 HydrophobicContact CG-CD1 4.11Å; L128-W153 PolarHBondContact O-N 2.92Å
129	E	98.6	Very high	97	Very high	25 Å²	25	32.1 Å²	32.1	12%	0.117	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	114.9	179.4	-68.1	161.4	-145	0	0	111.3	L104 Q105 L106 G107 T127 F131 W153	L104-E129 PolarHBondContact O-N 3.38Å; Q105-E129 WeakPolarHBondContact CB-OE2 3.42Å; Q105-E129 VanDerWaalsContact CD-OE2 3.27Å; Q105-E129 VanDerWaalsContact CG-OE2 3.25Å; Q105-E129 WeakPolarHBondContact CG-OE2 3.45Å; Q105-E129 PolarHBondContact NE2-OE1 3.06Å; Q105-E129 PolarHBondContact NE2-OE2 3.19Å; L106-E129 CarbonylContact C-O 3.09Å; L106-E129 WeakPolarHBondContact CA-O 3.38Å; L106-E129 WeakPolarHBondContact CB-O 3.14Å; L106-E129 PolarHBondContact N-O 2.95Å; G107-E129 PolarHBondContact N-O 3.01Å; T127-E129 HydrophobicContact CG2-CG 4.3Å; E129-F131 HydrophobicContact CB-CD1 3.83Å; E129-F131 HydrophobicContact CB-CE1 3.78Å; E129-F131 HydrophobicContact CG-CD1 4.22Å; E129-F131 HydrophobicContact CG-CE1 3.97Å; E129-F131 WeakPolarHBondContact OE2-CE1 3.33Å; E129-W153 HydrophobicContact CG-CB 4.33Å; E129-W153 HydrophobicContact CG-CG 4.13Å
130	L	98.3	Very high	96.8	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.186	C	C	.	.			trans	-123.5	17.9	179.7	-72.9	169.3	0	0	0	112.1	L106 I111 I114 F119 L128 N133 L135 F143 L152 W153 L154 N157	L106-L130 HydrophobicContact CB-CD2 3.88Å; L106-L130 HydrophobicContact CD1-CD2 3.98Å; I111-L130 HydrophobicContact CD1-CD2 4.21Å; I114-L130 HydrophobicContact CD1-CD1 3.93Å; I114-L130 HydrophobicContact CD1-CD2 3.81Å; F119-L130 HydrophobicContact CZ-CD1 4.32Å; L128-L130 HydrophobicContact CD1-CD1 4.45Å; L128-L130 HydrophobicContact CD1-CG 4.23Å; L128-L130 HydrophobicContact CD2-CD1 4.05Å; L128-L130 HydrophobicContact CG-CD1 4.09Å; L128-L130 HydrophobicContact CG-CG 4.19Å; L130-N133 WeakPolarHBondContact O-CB 3.08Å; L130-N133 PolarHBondContact O-ND2 3.03Å; L130-L135 HydrophobicContact CB-CD1 4.5Å; L130-F143 HydrophobicContact CD1-CE1 4.49Å; L130-L152 HydrophobicContact CD1-CD1 4.49Å; L130-W153 CarbonylContact C-O 3.1Å; L130-W153 WeakPolarHBondContact CA-O 3.33Å; L130-W153 PolarHBondContact N-O 2.85Å; L130-L154 HydrophobicContact CB-CD2 3.87Å; L130-L154 HydrophobicContact CD1-CD2 4.1Å; L130-N157 PolarHBondContact O-ND2 2.95Å
131	F	98.4	Very high	96.7	Very high	32 Å²	32	33 Å²	33	14%	0.14	19%	0.191	C	C	.	.			trans	-69.5	165.4	-176.6	64.3	-99.7	0	0	0	114.7	M83 G107 R108 E129 N133 W153 R155	M83-F131 HydrophobicContact SD-CE1 4.21Å; M83-F131 HydrophobicContact SD-CE2 4.46Å; M83-F131 HydrophobicContact SD-CZ 3.62Å; G107-F131 CarbonylContact C-O 3.09Å; G107-F131 WeakPolarHBondContact CA-O 3.25Å; R108-F131 HydrophobicContact CG-CE2 4.09Å; R108-F131 PolarHBondContact N-O 3.46Å; E129-F131 HydrophobicContact CB-CD1 3.83Å; E129-F131 HydrophobicContact CB-CE1 3.78Å; E129-F131 HydrophobicContact CG-CD1 4.22Å; E129-F131 HydrophobicContact CG-CE1 3.97Å; E129-F131 WeakPolarHBondContact OE2-CE1 3.33Å; F131-N133 VanDerWaalsContact C-N 3.32Å; F131-N133 PolarHBondContact O-N 3.49Å; F131-N133 PolarHBondContact O-ND2 2.9Å; F131-W153 HydrophobicContact CD1-CB 4.32Å; F131-W153 PolarHBondContact N-O 2.91Å; F131-R155 WeakPolarHBondContact CA-O 3.17Å; F131-R155 HydrophobicContact CB-CG 3.56Å; F131-R155 WeakPolarHBondContact CB-O 3.25Å; F131-R155 HydrophobicContact CG-CG 4.5Å
132	D	98.3	Very high	96.8	Very high	30 Å²	30	31.9 Å²	31.9	16%	0.16	18%	0.179	C	C	.	.	S	Bend	trans	49.6	49.6	178.8	-60.1	-14.9	0	0	0	111.7	R108 R155 N156	R108-D132 WeakPolarHBondContact CA-O 3.35Å; R108-D132 HydrophobicContact CB-CB 4.4Å; R108-D132 HydrophobicContact CG-CB 3.59Å; R108-D132 WeakPolarHBondContact CG-OD2 3.06Å; R108-D132 IonicContact CZ-OD2 2.69Å; R108-D132 IonicContact NE-OD2 3.45Å; R108-D132 PolarHBondContact NE-OD2 3.07Å; R108-D132 IonicContact NH2-OD2 2.66Å; D132-R155 PolarHBondContact N-O 3.48Å; D132-R155 IonicContact OD1-CZ 2.92Å; D132-R155 IonicContact OD1-NH2 2.71Å; D132-R155 PolarHBondContact OD1-NH2 3.08Å; D132-N156 WeakPolarHBondContact CA-O 3.45Å; D132-N156 PolarHBondContact N-O 3Å; D132-N156 WeakPolarHBondContact OD1-CB 3.48Å; D132-N156 PolarHBondContact OD1-ND2 2.99Å
133	N	98.6	Very high	96.6	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.005	18%	0.178	C	C	.	.	S	Bend	trans	-125.1	-162.5	-174.8	-95	-72.2	0	0	0	111.8	L106 N109 I111 L130 F131 N156 N157 P158	L106-N133 PolarHBondContact O-ND2 2.88Å; N109-N133 WeakPolarHBondContact CA-OD1 3.41Å; N109-N133 WeakPolarHBondContact CB-OD1 3.47Å; N109-N133 PolarHBondContact N-OD1 2.82Å; N109-N133 PolarHBondContact O-OD1 3.01Å; I111-N133 HydrophobicContact CB-CB 4.49Å; I111-N133 VanDerWaalsContact CB-OD1 3.27Å; I111-N133 WeakPolarHBondContact CB-OD1 3.39Å; I111-N133 WeakPolarHBondContact CD1-OD1 3.44Å; I111-N133 VanDerWaalsContact CG1-OD1 3.3Å; I111-N133 WeakPolarHBondContact CG1-OD1 3.21Å; I111-N133 PolarHBondContact N-OD1 2.88Å; L130-N133 WeakPolarHBondContact O-CB 3.08Å; L130-N133 PolarHBondContact O-ND2 3.03Å; F131-N133 VanDerWaalsContact C-N 3.32Å; F131-N133 PolarHBondContact O-N 3.49Å; F131-N133 PolarHBondContact O-ND2 2.9Å; N133-N156 PolarHBondContact N-O 2.94Å; N133-N157 WeakPolarHBondContact CA-OD1 3.34Å; N133-N157 WeakPolarHBondContact CB-OD1 3.42Å; N133-P158 WeakPolarHBondContact O-CD 3.06Å
134	R	98.1	Very high	96.3	Very high	157 Å²	157	31 Å²	31	59%	0.592	17%	0.169	S	C	*	.			trans	-123.3	22.4	-173.4	-57.7	-60.9	-176	-155	3.9	113.6	I111 R112 T136 N157	I111-R134 CarbonylContact O-C 3.51Å; I111-R134 VanDerWaalsContact O-CA 3.24Å; I111-R134 WeakPolarHBondContact O-CA 3.3Å; I111-R134 WeakPolarHBondContact O-CB 3.08Å; I111-R134 PolarHBondContact O-N 2.8Å; R112-R134 HydrophobicContact CG-CB 3.91Å; R134-T136 PolarHBondContact O-N 3.33Å; R134-N157 PolarHBondContact N-OD1 2.82Å
135	L	98.1	Very high	95.7	Very high	4 Å²	4	38.1 Å²	38.1	2%	0.021	19%	0.193	C	C	.	.			trans	-70.2	122.9	179.3	-62.2	171.3	0	0	0	110.9	I111 I114 L130 L154 N157 P158 I159	I111-L135 HydrophobicContact CG2-CD2 4.07Å; I111-L135 PolarHBondContact O-N 2.99Å; I111-L135 VanDerWaalsContact O-N 3.15Å; I114-L135 HydrophobicContact CD1-CD1 4.34Å; I114-L135 HydrophobicContact CD1-CD2 4.14Å; I114-L135 HydrophobicContact CG1-CD2 4.17Å; L130-L135 HydrophobicContact CB-CD1 4.5Å; L135-L154 HydrophobicContact CD1-CD2 3.95Å; L135-N157 HydrophobicContact CB-CB 4.3Å; L135-N157 WeakPolarHBondContact CB-OD1 3.42Å; L135-N157 PolarHBondContact N-OD1 2.89Å; L135-P158 CarbonylContact O-C 3.47Å; L135-P158 VanDerWaalsContact O-C 3.27Å; L135-P158 VanDerWaalsContact O-CD 3.25Å; L135-P158 WeakPolarHBondContact O-CD 3.32Å; L135-P158 WeakPolarHBondContact O-CG 3.35Å; L135-I159 WeakPolarHBondContact O-CG1 3.45Å; L135-I159 PolarHBondContact O-N 3.46Å
136	T	97.1	Very high	95.5	Very high	58 Å²	58	38.3 Å²	38.3	36%	0.356	19%	0.194	S	C	.	.	S	Bend	trans	-91.1	-16.7	174.6	53.9	0	0	0	0	113.8	R134 P158 I159 E160	R134-T136 PolarHBondContact O-N 3.33Å; T136-P158 WeakPolarHBondContact CA-O 3.32Å; T136-P158 HydrophobicContact CG2-CG 4.43Å; T136-I159 WeakPolarHBondContact O-CA 3.47Å; T136-E160 PolarHBondContact O-N 3.05Å
137	V	96.8	Very high	95.1	Very high	87 Å²	87	40 Å²	40	53%	0.527	21%	0.21	S	C	.	.	B	Isolated β-bridge	trans	-138.4	153.4	179.7	-65.1	0	0	0	0	110.5
138	I	96.9	Very high	95	Very high	11 Å²	11	44.4 Å²	44.4	6%	0.056	23%	0.229	C	C	.	.			trans	-73.7	124.3	172.2	-66.4	162.5	0	0	0	108.9	S140 F143 I159 I162 A166 F167	I138-S140 PolarHBondContact O-N 3.01Å; I138-F143 HydrophobicContact CG2-CE2 3.86Å; I138-I159 HydrophobicContact CG1-CD1 4.03Å; I138-I159 HydrophobicContact CG1-CG2 4.24Å; I138-I162 HydrophobicContact CD1-CB 4.11Å; I138-I162 HydrophobicContact CD1-CD1 4.5Å; I138-I162 HydrophobicContact CD1-CG1 3.84Å; I138-I162 HydrophobicContact CD1-CG2 3.74Å; I138-A166 HydrophobicContact CD1-CB 4.3Å; I138-A166 HydrophobicContact CG2-CB 4.42Å; I138-F167 HydrophobicContact CD1-CE1 4.35Å; I138-F167 HydrophobicContact CD1-CE2 4.2Å; I138-F167 HydrophobicContact CD1-CZ 3.61Å; I138-F167 HydrophobicContact CG1-CZ 4.41Å; I138-F167 HydrophobicContact CG2-CE1 3.9Å; I138-F167 HydrophobicContact CG2-CZ 4.24Å
139	P	95.1	Very high	94.9	Very high	18 Å²	18	44.4 Å²	44.4	12%	0.117	23%	0.229	C	C	.	.			trans	-83.4	63.8	-176.2	35.2	-36.7	0	0	0	111.2	I114 G141 A142 F143	I114-P139 HydrophobicContact CB-CB 4.18Å; I114-P139 HydrophobicContact CB-CG 4.43Å; I114-P139 HydrophobicContact CD1-CG 4.28Å; P139-G141 PolarHBondContact O-N 2.75Å; P139-A142 HydrophobicContact CB-CB 4.03Å; P139-A142 HydrophobicContact CG-CB 4.48Å; P139-A142 WeakPolarHBondContact O-CB 3.39Å; P139-A142 PolarHBondContact O-N 3.03Å; P139-F143 HydrophobicContact CG-CE1 4.23Å; P139-F143 HydrophobicContact CG-CE2 4.27Å; P139-F143 HydrophobicContact CG-CZ 3.75Å
140	S	93.4	Very high	94.9	Very high	34 Å²	34	49.2 Å²	49.2	24%	0.238	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-29.5	-174	-56.4	0	0	0	0	114.6	I138 A166	I138-S140 PolarHBondContact O-N 3.01Å; S140-A166 VanDerWaalsContact CB-O 3.27Å; S140-A166 WeakPolarHBondContact CB-O 3.19Å; S140-A166 WeakPolarHBondContact OG-CA 3.48Å; S140-A166 PolarHBondContact OG-O 3.06Å
141	G	92	Very high	94.9	Very high	34 Å²	34	51.9 Å²	51.9	35%	0.351	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-10.1	174.9	0	0	0	0	0	115.2	P139	P139-G141 PolarHBondContact O-N 2.75Å
142	A	93.6	Very high	94.9	Very high	2 Å²	2	50.3 Å²	50.3	2%	0.017	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-24.3	172.3	0	0	0	0	0	112.1	I114 F119 P139 E144	I114-A142 HydrophobicContact CG2-CB 3.57Å; F119-A142 HydrophobicContact CD2-CB 3.96Å; F119-A142 WeakPolarHBondContact CD2-O 3.43Å; F119-A142 HydrophobicContact CE2-CB 4.08Å; P139-A142 HydrophobicContact CB-CB 4.03Å; P139-A142 HydrophobicContact CG-CB 4.48Å; P139-A142 WeakPolarHBondContact O-CB 3.39Å; P139-A142 PolarHBondContact O-N 3.03Å; A142-E144 PolarHBondContact O-N 2.8Å
143	F	91.8	Very high	95	Very high	1 Å²	1	51.6 Å²	51.6	0%	0.004	25%	0.254	C	S	.	.	S	Bend	trans	-83.5	19.9	-177	-51.3	-44.6	0	0	0	114.2	F119 L128 L130 I138 P139 L146 L152 V170	F119-F143 HydrophobicContact CD2-CD1 4.36Å; F119-F143 HydrophobicContact CE2-CD1 4.4Å; F119-F143 HydrophobicContact CE2-CE1 4.28Å; L128-F143 HydrophobicContact CD2-CD1 4.46Å; L128-F143 HydrophobicContact CD2-CE1 4.16Å; L130-F143 HydrophobicContact CD1-CE1 4.49Å; I138-F143 HydrophobicContact CG2-CE2 3.86Å; P139-F143 HydrophobicContact CG-CE1 4.23Å; P139-F143 HydrophobicContact CG-CE2 4.27Å; P139-F143 HydrophobicContact CG-CZ 3.75Å; F143-L146 HydrophobicContact CB-CD1 4.37Å; F143-L146 HydrophobicContact CD1-CD1 4.37Å; F143-L152 HydrophobicContact CE1-CD1 4.19Å; F143-L152 HydrophobicContact CE1-CD2 4.33Å; F143-L152 HydrophobicContact CE2-CD2 4.11Å; F143-L152 HydrophobicContact CZ-CD1 4.27Å; F143-L152 HydrophobicContact CZ-CD2 3.91Å; F143-V170 HydrophobicContact CB-CG1 3.97Å; F143-V170 WeakPolarHBondContact O-CG1 3.23Å
144	E	87.9	Confident	94.9	Very high	59 Å²	59	51.6 Å²	51.6	28%	0.276	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	141.6	-177	-150.1	168.8	-156.7	0	0	111.7	A142 L146	A142-E144 PolarHBondContact O-N 2.8Å; E144-L146 PolarHBondContact O-N 3.28Å; E144-L146 VanDerWaalsContact O-N 3.09Å
145	Y	83.6	Confident	94.9	Very high	176 Å²	176	47.1 Å²	47.1	69%	0.69	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.5	9.7	179.3	-48.6	-68.7	0	0	0	117.5	S147	Y145-S147 PolarHBondContact O-N 3.08Å
146	L	93.3	Very high	94.9	Very high	5 Å²	5	49.6 Å²	49.6	3%	0.026	25%	0.25	C	S	.	.			trans	-76.5	53.9	178.1	-61.8	-177.6	0	0	0	113.5	F119 L122 L125 F143 E144 K148 L149 V170	F119-L146 HydrophobicContact CB-CD1 4.09Å; F119-L146 HydrophobicContact CB-CD2 4.09Å; F119-L146 HydrophobicContact CD2-CD1 4.46Å; L122-L146 HydrophobicContact CB-CD2 4.05Å; L125-L146 HydrophobicContact CD2-CD1 4.43Å; L125-L146 HydrophobicContact CD2-CD2 4.31Å; F143-L146 HydrophobicContact CB-CD1 4.37Å; F143-L146 HydrophobicContact CD1-CD1 4.37Å; E144-L146 PolarHBondContact O-N 3.28Å; E144-L146 VanDerWaalsContact O-N 3.09Å; L146-K148 PolarHBondContact O-N 2.78Å; L146-L149 HydrophobicContact CB-CB 4.1Å; L146-L149 HydrophobicContact CD1-CD2 4.25Å; L146-L149 WeakPolarHBondContact O-CB 3.22Å; L146-L149 PolarHBondContact O-N 3.2Å; L146-V170 HydrophobicContact CB-CG1 3.85Å
147	S	90.4	Very high	95	Very high	93 Å²	93	47 Å²	47	65%	0.65	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-8.1	-169	61.2	0	0	0	0	116.9	Y145 S172	Y145-S147 PolarHBondContact O-N 3.08Å; S147-S172 WeakPolarHBondContact O-CB 3.19Å
148	K	95.8	Very high	95.1	Very high	106 Å²	106	44.4 Å²	44.4	46%	0.461	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.3	-4.5	173.3	-64.8	-167.8	-160.9	142.5	0	113.9	T123 S124 L125 L146 R150	T123-K148 WeakPolarHBondContact O-CD 3.44Å; T123-K148 WeakPolarHBondContact O-CE 3.26Å; T123-K148 PolarHBondContact O-NZ 2.69Å; S124-K148 PolarHBondContact OG-NZ 3.47Å; L125-K148 CarbonylContact O-C 3.58Å; L146-K148 PolarHBondContact O-N 2.78Å; K148-R150 PolarHBondContact O-N 2.93Å
149	L	97.8	Very high	95.1	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.216	C	C	.	.			trans	-65.3	122.7	-176.1	-171.9	75.8	0	0	0	109.7	L125 L128 L146 L152 V170 S172 L173	L125-L149 HydrophobicContact CD2-CD1 4.02Å; L125-L149 HydrophobicContact CG-CD1 4.01Å; L125-L149 VanDerWaalsContact O-CA 3.3Å; L125-L149 WeakPolarHBondContact O-CA 3.46Å; L125-L149 PolarHBondContact O-N 3.21Å; L125-L149 VanDerWaalsContact O-N 3.1Å; L128-L149 HydrophobicContact CB-CD1 3.78Å; L146-L149 HydrophobicContact CB-CB 4.1Å; L146-L149 HydrophobicContact CD1-CD2 4.25Å; L146-L149 WeakPolarHBondContact O-CB 3.22Å; L146-L149 PolarHBondContact O-N 3.2Å; L149-L152 HydrophobicContact CD2-CB 4.49Å; L149-V170 HydrophobicContact CD2-CB 4.48Å; L149-V170 HydrophobicContact CD2-CG1 4.07Å; L149-S172 CarbonylContact O-C 3.27Å; L149-S172 WeakPolarHBondContact O-CB 3.16Å; L149-S172 PolarHBondContact O-OG 2.81Å; L149-L173 HydrophobicContact CD2-CD2 3.9Å; L149-L173 HydrophobicContact CG-CD2 3.87Å; L149-L173 PolarHBondContact O-N 3.02Å
150	R	98.2	Very high	95.2	Very high	126 Å²	126	46.5 Å²	46.5	48%	0.475	23%	0.227	S	C	.	.			trans	-110.6	-29.2	178.2	-59.8	-175.2	-176.2	-142.7	0.3	112.4	N126 K148 M174 R175	N126-R150 PolarHBondContact O-N 3Å; N126-R150 WeakPolarHBondContact OD1-CB 3.32Å; N126-R150 WeakPolarHBondContact OD1-CD 3.14Å; N126-R150 WeakPolarHBondContact OD1-CG 3.47Å; K148-R150 PolarHBondContact O-N 2.93Å; R150-M174 HydrophobicContact CB-CB 4.32Å; R150-M174 HydrophobicContact CB-CG 4.35Å; R150-M174 HydrophobicContact CB-SD 4.43Å; R150-M174 HydrophobicContact CG-CG 4.45Å; R150-M174 HydrophobicContact CG-SD 4.15Å; R150-M174 PolarHBondContact O-N 3.17Å; R150-R175 PolarHBondContact O-N 2.95Å
151	E	98.7	Very high	95.3	Very high	55 Å²	55	47 Å²	47	26%	0.257	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	124.7	-173.5	-53.8	-173.6	146	0	0	111.3	N126 T127 L128 W153 R175	N126-E151 PolarHBondContact O-N 3.49Å; T127-E151 HydrophobicContact CG2-CB 4Å; T127-E151 VanDerWaalsContact CG2-OE2 3.31Å; T127-E151 WeakPolarHBondContact CG2-OE2 3.21Å; T127-E151 PolarHBondContact OG1-OE2 3.38Å; L128-E151 PolarHBondContact N-O 2.88Å; E151-W153 HydrophobicContact CB-CZ2 4.49Å; E151-R175 WeakPolarHBondContact CA-O 3.44Å; E151-R175 HydrophobicContact CG-CB 4.16Å; E151-R175 HydrophobicContact CG-CG 4.18Å; E151-R175 WeakPolarHBondContact OE1-CD 3.44Å
152	L	98.6	Very high	95.6	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	115	177.4	177.1	58.9	0	0	0	110	L128 L130 F143 L149 L154 F167 L173 R175 L176 D177	L128-L152 HydrophobicContact CB-CD1 4.25Å; L128-L152 HydrophobicContact CD2-CD1 4.04Å; L128-L152 HydrophobicContact CG-CD1 4.11Å; L130-L152 HydrophobicContact CD1-CD1 4.49Å; F143-L152 HydrophobicContact CE1-CD1 4.19Å; F143-L152 HydrophobicContact CE1-CD2 4.33Å; F143-L152 HydrophobicContact CE2-CD2 4.11Å; F143-L152 HydrophobicContact CZ-CD1 4.27Å; F143-L152 HydrophobicContact CZ-CD2 3.91Å; L149-L152 HydrophobicContact CD2-CB 4.49Å; L152-L154 HydrophobicContact CD1-CD1 4.33Å; L152-L154 HydrophobicContact CD1-CG 4.16Å; L152-L154 HydrophobicContact CD2-CD1 3.92Å; L152-L154 HydrophobicContact CG-CD1 3.97Å; L152-L154 HydrophobicContact CG-CG 4.13Å; L152-F167 HydrophobicContact CD2-CD1 4.07Å; L152-F167 HydrophobicContact CD2-CE1 4.03Å; L152-L173 HydrophobicContact CB-CD1 4.22Å; L152-L173 HydrophobicContact CB-CD2 3.84Å; L152-L173 HydrophobicContact CD2-CD1 4.2Å; L152-R175 PolarHBondContact N-O 3.12Å; L152-L176 HydrophobicContact CB-CD1 4.12Å; L152-L176 HydrophobicContact CD2-CD1 4.06Å; L152-L176 HydrophobicContact CG-CD1 4.12Å; L152-D177 PolarHBondContact O-N 2.88Å
153	W	98.6	Very high	95.8	Very high	57 Å²	57	47.9 Å²	47.9	22%	0.216	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	104.1	-176.6	-49.5	88.2	0	0	0	110.2	L128 E129 L130 F131 E151 D177 Y200	L128-W153 PolarHBondContact O-N 2.92Å; E129-W153 HydrophobicContact CG-CB 4.33Å; E129-W153 HydrophobicContact CG-CG 4.13Å; L130-W153 CarbonylContact C-O 3.1Å; L130-W153 WeakPolarHBondContact CA-O 3.33Å; L130-W153 PolarHBondContact N-O 2.85Å; F131-W153 HydrophobicContact CD1-CB 4.32Å; F131-W153 PolarHBondContact N-O 2.91Å; E151-W153 HydrophobicContact CB-CZ2 4.49Å; W153-D177 HydrophobicContact CD2-CB 4.2Å; W153-D177 HydrophobicContact CE3-CB 3.34Å; W153-D177 HydrophobicContact CZ3-CB 3.8Å; W153-Y200 HydrophobicContact CZ3-CE1 4.41Å
154	L	98.3	Very high	96	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	25%	0.25	C	S	.	.			trans	-112.6	0.4	-178	-77	165.9	0	0	0	113.3	L130 L135 L152 N157 F167 D177 L178	L130-L154 HydrophobicContact CB-CD2 3.87Å; L130-L154 HydrophobicContact CD1-CD2 4.1Å; L135-L154 HydrophobicContact CD1-CD2 3.95Å; L152-L154 HydrophobicContact CD1-CD1 4.33Å; L152-L154 HydrophobicContact CD1-CG 4.16Å; L152-L154 HydrophobicContact CD2-CD1 3.92Å; L152-L154 HydrophobicContact CG-CD1 3.97Å; L152-L154 HydrophobicContact CG-CG 4.13Å; L154-N157 PolarHBondContact O-ND2 3.27Å; L154-F167 HydrophobicContact CD1-CE1 4.06Å; L154-D177 CarbonylContact C-O 3.37Å; L154-D177 WeakPolarHBondContact CA-O 3.37Å; L154-D177 PolarHBondContact N-O 3.12Å; L154-L178 HydrophobicContact CB-CD2 3.89Å; L154-L178 HydrophobicContact CD1-CD2 3.95Å
155	R	98.1	Very high	96.4	Very high	64 Å²	64	54.3 Å²	54.3	24%	0.242	26%	0.262	C	S	.	.			trans	-48.3	149	-178.8	50.2	156.1	-86.1	106	13.5	115	F131 D132 N157 D177 G179 E180	F131-R155 WeakPolarHBondContact CA-O 3.17Å; F131-R155 HydrophobicContact CB-CG 3.56Å; F131-R155 WeakPolarHBondContact CB-O 3.25Å; F131-R155 HydrophobicContact CG-CG 4.5Å; D132-R155 PolarHBondContact N-O 3.48Å; D132-R155 IonicContact OD1-CZ 2.92Å; D132-R155 IonicContact OD1-NH2 2.71Å; D132-R155 PolarHBondContact OD1-NH2 3.08Å; R155-N157 PolarHBondContact O-N 2.99Å; R155-D177 WeakPolarHBondContact CB-OD2 3.4Å; R155-D177 WeakPolarHBondContact CD-OD2 3.26Å; R155-D177 WeakPolarHBondContact CG-OD2 3.23Å; R155-D177 PolarHBondContact N-O 2.93Å; R155-G179 CarbonylContact C-O 3.49Å; R155-G179 WeakPolarHBondContact CA-O 3.38Å; R155-G179 VanDerWaalsContact CB-O 3.3Å; R155-G179 WeakPolarHBondContact CB-O 3.44Å; R155-E180 IonicContact CZ-OE1 2.88Å; R155-E180 IonicContact NH1-OE1 2.65Å; R155-E180 PolarHBondContact NH1-OE1 2.72Å; R155-E180 IonicContact NH2-OE1 3.63Å; R155-E180 PolarHBondContact NH2-OE1 3.08Å
156	N	97.9	Very high	97	Very high	56 Å²	56	46 Å²	46	30%	0.299	23%	0.23	S	C	.	.	S	Bend	trans	53.2	51.3	179.3	-171.4	27.3	0	0	0	112.6	D132 N133 G179 E180	D132-N156 WeakPolarHBondContact CA-O 3.45Å; D132-N156 PolarHBondContact N-O 3Å; D132-N156 WeakPolarHBondContact OD1-CB 3.48Å; D132-N156 PolarHBondContact OD1-ND2 2.99Å; N133-N156 PolarHBondContact N-O 2.94Å; N156-G179 PolarHBondContact N-O 2.94Å; N156-E180 HydrophobicContact CB-CB 3.86Å
157	N	98.5	Very high	97.2	Very high	4 Å²	4	45.8 Å²	45.8	2%	0.021	23%	0.229	C	C	.	.			trans	-115	152	165.2	-85.6	-85.8	0	0	0	109.6	L130 N133 R134 L135 L154 R155 I159 L181	L130-N157 PolarHBondContact O-ND2 2.95Å; N133-N157 WeakPolarHBondContact CA-OD1 3.34Å; N133-N157 WeakPolarHBondContact CB-OD1 3.42Å; R134-N157 PolarHBondContact N-OD1 2.82Å; L135-N157 HydrophobicContact CB-CB 4.3Å; L135-N157 WeakPolarHBondContact CB-OD1 3.42Å; L135-N157 PolarHBondContact N-OD1 2.89Å; L154-N157 PolarHBondContact O-ND2 3.27Å; R155-N157 PolarHBondContact O-N 2.99Å; N157-I159 HydrophobicContact CB-CD1 4.04Å; N157-I159 HydrophobicContact CB-CG1 3.83Å; N157-I159 PolarHBondContact O-N 3.37Å; N157-L181 HydrophobicContact CB-CD2 4.13Å; N157-L181 VanDerWaalsContact O-CD2 3.22Å; N157-L181 WeakPolarHBondContact O-CD2 3.36Å
158	P	97.9	Very high	97.3	Very high	31 Å²	31	44.5 Å²	44.5	20%	0.201	21%	0.214	C	C	.	.			trans	-77.4	43.3	177.5	35.3	-37.9	0	0	0	112.7	N133 L135 T136 E160 K183	N133-P158 WeakPolarHBondContact O-CD 3.06Å; L135-P158 CarbonylContact O-C 3.47Å; L135-P158 VanDerWaalsContact O-C 3.27Å; L135-P158 VanDerWaalsContact O-CD 3.25Å; L135-P158 WeakPolarHBondContact O-CD 3.32Å; L135-P158 WeakPolarHBondContact O-CG 3.35Å; T136-P158 WeakPolarHBondContact CA-O 3.32Å; T136-P158 HydrophobicContact CG2-CG 4.43Å; P158-E160 PolarHBondContact O-N 3.25Å; P158-K183 HydrophobicContact CB-CD 4.12Å; P158-K183 HydrophobicContact CB-CG 4.16Å
159	I	98	Very high	97.2	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	22%	0.218	C	C	.	.			trans	-69.2	127.8	-177.3	-62.9	173	0	0	0	109.7	L135 T136 I138 N157 S161 L181 K183 L184	L135-I159 WeakPolarHBondContact O-CG1 3.45Å; L135-I159 PolarHBondContact O-N 3.46Å; T136-I159 WeakPolarHBondContact O-CA 3.47Å; I138-I159 HydrophobicContact CG1-CD1 4.03Å; I138-I159 HydrophobicContact CG1-CG2 4.24Å; N157-I159 HydrophobicContact CB-CD1 4.04Å; N157-I159 HydrophobicContact CB-CG1 3.83Å; N157-I159 PolarHBondContact O-N 3.37Å; I159-S161 WeakPolarHBondContact CG2-O 3.06Å; I159-L181 HydrophobicContact CB-CD1 4.36Å; I159-L181 HydrophobicContact CB-CD2 4.2Å; I159-L181 HydrophobicContact CD1-CD1 4.31Å; I159-L181 HydrophobicContact CD1-CD2 3.98Å; I159-L181 HydrophobicContact CG1-CD2 4.23Å; I159-K183 CarbonylContact O-C 3.47Å; I159-K183 VanDerWaalsContact O-C 3.28Å; I159-L184 WeakPolarHBondContact O-CA 3.35Å; I159-L184 PolarHBondContact O-N 3.16Å
160	E	96.4	Very high	97.1	Very high	74 Å²	74	46.2 Å²	46.2	35%	0.346	22%	0.218	S	C	.	.			trans	-93.4	-28.3	-172.7	-67.3	170.8	173	0	0	112.3	T136 P158 K183 E185	T136-E160 PolarHBondContact O-N 3.05Å; P158-E160 PolarHBondContact O-N 3.25Å; E160-K183 WeakPolarHBondContact CA-O 3.3Å; E160-K183 HydrophobicContact CG-CB 4.48Å; E160-K183 HydrophobicContact CG-CD 3.88Å; E160-K183 IonicContact OE1-NZ 3.8Å; E160-K183 PolarHBondContact OE1-NZ 3.43Å; E160-E185 PolarHBondContact O-N 3.22Å
161	S	96.5	Very high	96.9	Very high	43 Å²	43	43 Å²	43	30%	0.301	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	155.9	174.9	59.9	0	0	0	0	114.7	I159 Y186	I159-S161 WeakPolarHBondContact CG2-O 3.06Å; S161-Y186 CarbonylContact C-O 3.59Å; S161-Y186 VanDerWaalsContact CA-O 3.23Å; S161-Y186 WeakPolarHBondContact CA-O 3.17Å; S161-Y186 WeakPolarHBondContact CB-O 3.31Å
162	I	97.8	Very high	96.8	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	102.1	169.9	-50.7	-175.7	0	0	0	109	I138 A166 F167 L178 L184 Y186 I187 S188 A191 F192	I138-I162 HydrophobicContact CD1-CB 4.11Å; I138-I162 HydrophobicContact CD1-CD1 4.5Å; I138-I162 HydrophobicContact CD1-CG1 3.84Å; I138-I162 HydrophobicContact CD1-CG2 3.74Å; I162-A166 HydrophobicContact CG2-CB 4Å; I162-F167 HydrophobicContact CG2-CE2 4.14Å; I162-L178 HydrophobicContact CD1-CD1 4.09Å; I162-L184 HydrophobicContact CD1-CD2 4.07Å; I162-L184 HydrophobicContact CG1-CD1 3.94Å; I162-L184 HydrophobicContact CG1-CD2 4.34Å; I162-Y186 PolarHBondContact N-O 3.2Å; I162-I187 HydrophobicContact CB-CG1 4.46Å; I162-I187 HydrophobicContact CB-CG2 4.37Å; I162-I187 HydrophobicContact CD1-CD1 4.32Å; I162-I187 HydrophobicContact CD1-CG1 4.11Å; I162-I187 HydrophobicContact CG1-CG1 4.33Å; I162-S188 WeakPolarHBondContact O-CB 3.37Å; I162-S188 PolarHBondContact O-N 2.93Å; I162-A191 HydrophobicContact CB-CB 4.34Å; I162-A191 HydrophobicContact CG2-CB 3.62Å; I162-F192 HydrophobicContact CD1-CZ 4.47Å
163	P	96.9	Very high	96.7	Very high	56 Å²	56	41.5 Å²	41.5	36%	0.364	21%	0.209	S	C	.	.			trans	-73.7	164.9	-177.2	30.6	-35.5	0	0	0	112.5	Y165 A166 A191	P163-Y165 PolarHBondContact O-N 3.47Å; P163-A166 HydrophobicContact CG-CB 4.11Å; P163-A166 WeakPolarHBondContact O-CB 3.19Å; P163-A166 PolarHBondContact O-N 3.07Å; P163-A191 WeakPolarHBondContact O-CA 3.43Å
164	S	96.7	Very high	96.7	Very high	62 Å²	62	41.8 Å²	41.8	43%	0.434	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	138.8	173.9	-44.9	0	0	0	0	111.3	A166 S188	S164-A166 PolarHBondContact O-N 3.25Å; S164-S188 PolarHBondContact OG-OG 3.36Å
165	Y	96.1	Very high	96.7	Very high	132 Å²	132	45.2 Å²	45.2	52%	0.518	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	60	23.2	179.3	-52.1	-81.8	0	0	0	114.9	P163 F167 N168 G190 E193	P163-Y165 PolarHBondContact O-N 3.47Å; Y165-F167 PolarHBondContact O-N 2.68Å; Y165-N168 HydrophobicContact CD1-CB 4.46Å; Y165-N168 PolarHBondContact O-N 3.19Å; Y165-N168 PolarHBondContact O-OD1 2.95Å; Y165-G190 PolarHBondContact N-O 3.41Å; Y165-E193 HydrophobicContact CD1-CB 3.45Å; Y165-E193 VanDerWaalsContact CD1-CB 3.45Å; Y165-E193 HydrophobicContact CD1-CG 4.31Å; Y165-E193 HydrophobicContact CE1-CB 3.59Å; Y165-E193 HydrophobicContact CE1-CG 3.97Å; Y165-E193 HydrophobicContact CG-CB 4.39Å
166	A	96.8	Very high	96.8	Very high	2 Å²	2	42.2 Å²	42.2	2%	0.017	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-28.3	-172.8	0	0	0	0	0	115	I138 S140 I162 P163 S164 A191	I138-A166 HydrophobicContact CD1-CB 4.3Å; I138-A166 HydrophobicContact CG2-CB 4.42Å; S140-A166 VanDerWaalsContact CB-O 3.27Å; S140-A166 WeakPolarHBondContact CB-O 3.19Å; S140-A166 WeakPolarHBondContact OG-CA 3.48Å; S140-A166 PolarHBondContact OG-O 3.06Å; I162-A166 HydrophobicContact CG2-CB 4Å; P163-A166 HydrophobicContact CG-CB 4.11Å; P163-A166 WeakPolarHBondContact O-CB 3.19Å; P163-A166 PolarHBondContact O-N 3.07Å; S164-A166 PolarHBondContact O-N 3.25Å; A166-A191 PolarHBondContact N-O 3.26Å
167	F	96.3	Very high	96.8	Very high	1 Å²	1	39.9 Å²	39.9	0%	0.004	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.4	9.5	-176.8	-51.8	-78.5	0	0	0	113.9	I138 L152 L154 I162 Y165 R169 V170 L176 L178 F192 L195	I138-F167 HydrophobicContact CD1-CE1 4.35Å; I138-F167 HydrophobicContact CD1-CE2 4.2Å; I138-F167 HydrophobicContact CD1-CZ 3.61Å; I138-F167 HydrophobicContact CG1-CZ 4.41Å; I138-F167 HydrophobicContact CG2-CE1 3.9Å; I138-F167 HydrophobicContact CG2-CZ 4.24Å; L152-F167 HydrophobicContact CD2-CD1 4.07Å; L152-F167 HydrophobicContact CD2-CE1 4.03Å; L154-F167 HydrophobicContact CD1-CE1 4.06Å; I162-F167 HydrophobicContact CG2-CE2 4.14Å; Y165-F167 PolarHBondContact O-N 2.68Å; F167-R169 PolarHBondContact O-N 2.77Å; F167-V170 HydrophobicContact CB-CG2 4.31Å; F167-V170 VanDerWaalsContact O-CG2 3.3Å; F167-V170 WeakPolarHBondContact O-CG2 3.04Å; F167-V170 PolarHBondContact O-N 2.99Å; F167-L176 HydrophobicContact CD1-CD1 4.45Å; F167-L176 HydrophobicContact CD1-CD2 4.46Å; F167-L176 HydrophobicContact CD2-CD2 4.06Å; F167-L176 HydrophobicContact CE1-CD1 3.99Å; F167-L176 HydrophobicContact CE1-CD2 4.33Å; F167-L176 HydrophobicContact CE2-CD2 3.93Å; F167-L176 HydrophobicContact CG-CD2 4.32Å; F167-L176 HydrophobicContact CZ-CD1 4.21Å; F167-L176 HydrophobicContact CZ-CD2 4.07Å; F167-L178 HydrophobicContact CE2-CD1 4.06Å; F167-L178 HydrophobicContact CZ-CD1 3.84Å; F167-L178 HydrophobicContact CZ-CD2 4.05Å; F167-L178 HydrophobicContact CZ-CG 4.47Å; F167-F192 HydrophobicContact CE2-CD1 4.47Å; F167-F192 HydrophobicContact CE2-CE1 4.37Å; F167-L195 HydrophobicContact CB-CD1 3.9Å; F167-L195 HydrophobicContact CB-CD2 3.79Å; F167-L195 HydrophobicContact CB-CG 4.02Å; F167-L195 HydrophobicContact CD2-CD1 3.98Å; F167-L195 HydrophobicContact CG-CD1 4.18Å
168	N	94.3	Very high	96.8	Very high	65 Å²	65	39.7 Å²	39.7	35%	0.348	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-11.5	-171	80.6	-12.3	0	0	0	115.1	Y165	Y165-N168 HydrophobicContact CD1-CB 4.46Å; Y165-N168 PolarHBondContact O-N 3.19Å; Y165-N168 PolarHBondContact O-OD1 2.95Å
169	R	93.1	Very high	96.8	Very high	142 Å²	142	38.2 Å²	38.2	54%	0.536	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-14.5	174.9	-57.5	-50	-169.8	171.3	6.7	113.6	F167 P171	F167-R169 PolarHBondContact O-N 2.77Å; R169-P171 WeakPolarHBondContact O-CD 3.36Å
170	V	95.3	Very high	96.8	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.199	C	C	.	.			trans	-124.4	59.6	179.9	-73	0	0	0	0	112.1	F143 L146 L149 F167 S172 L173	F143-V170 HydrophobicContact CB-CG1 3.97Å; F143-V170 WeakPolarHBondContact O-CG1 3.23Å; L146-V170 HydrophobicContact CB-CG1 3.85Å; L149-V170 HydrophobicContact CD2-CB 4.48Å; L149-V170 HydrophobicContact CD2-CG1 4.07Å; F167-V170 HydrophobicContact CB-CG2 4.31Å; F167-V170 VanDerWaalsContact O-CG2 3.3Å; F167-V170 WeakPolarHBondContact O-CG2 3.04Å; F167-V170 PolarHBondContact O-N 2.99Å; V170-S172 PolarHBondContact O-N 3.43Å; V170-L173 HydrophobicContact CB-CD1 4.32Å; V170-L173 HydrophobicContact CB-CG 4.11Å; V170-L173 HydrophobicContact CG2-CD1 3.59Å; V170-L173 HydrophobicContact CG2-CG 3.93Å; V170-L173 WeakPolarHBondContact O-CG 3.38Å; V170-L173 PolarHBondContact O-N 3.22Å; V170-L173 VanDerWaalsContact O-N 3.13Å
171	P	94.6	Very high	96.8	Very high	58 Å²	58	36 Å²	36	38%	0.377	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-4.6	177.2	32.2	-38.2	0	0	0	113.5	R169 L173 G194 N197	R169-P171 WeakPolarHBondContact O-CD 3.36Å; P171-L173 VanDerWaalsContact C-N 3.32Å; P171-G194 WeakPolarHBondContact CB-O 3.34Å; P171-N197 PolarHBondContact O-ND2 2.82Å
172	S	95.9	Very high	96.7	Very high	24 Å²	24	42.1 Å²	42.1	17%	0.168	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-10.4	172	53.6	0	0	0	0	114.3	S147 L149 V170	S147-S172 WeakPolarHBondContact O-CB 3.19Å; L149-S172 CarbonylContact O-C 3.27Å; L149-S172 WeakPolarHBondContact O-CB 3.16Å; L149-S172 PolarHBondContact O-OG 2.81Å; V170-S172 PolarHBondContact O-N 3.43Å
173	L	97.6	Very high	96.7	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	22%	0.22	C	C	.	.			trans	-59.5	136.5	-179.1	-78.9	-179.9	0	0	0	112.3	L149 L152 V170 P171 L195 N197 L198	L149-L173 HydrophobicContact CD2-CD2 3.9Å; L149-L173 HydrophobicContact CG-CD2 3.87Å; L149-L173 PolarHBondContact O-N 3.02Å; L152-L173 HydrophobicContact CB-CD1 4.22Å; L152-L173 HydrophobicContact CB-CD2 3.84Å; L152-L173 HydrophobicContact CD2-CD1 4.2Å; V170-L173 HydrophobicContact CB-CD1 4.32Å; V170-L173 HydrophobicContact CB-CG 4.11Å; V170-L173 HydrophobicContact CG2-CD1 3.59Å; V170-L173 HydrophobicContact CG2-CG 3.93Å; V170-L173 WeakPolarHBondContact O-CG 3.38Å; V170-L173 PolarHBondContact O-N 3.22Å; V170-L173 VanDerWaalsContact O-N 3.13Å; P171-L173 VanDerWaalsContact C-N 3.32Å; L173-L195 HydrophobicContact CB-CD2 4.06Å; L173-L195 HydrophobicContact CD1-CD2 4.06Å; L173-N197 CarbonylContact O-C 3.46Å; L173-N197 VanDerWaalsContact O-C 3.29Å; L173-L198 HydrophobicContact CB-CD1 4.1Å; L173-L198 WeakPolarHBondContact O-CA 3.49Å; L173-L198 PolarHBondContact O-N 3.5Å
174	M	98.3	Very high	96.6	Very high	63 Å²	63	45.2 Å²	45.2	31%	0.31	21%	0.207	S	C	.	.	S	Bend	trans	-118.5	-29.2	176.5	-63.4	-179.1	176.5	0	0	111.8	R150 K199 Y200	R150-M174 HydrophobicContact CB-CB 4.32Å; R150-M174 HydrophobicContact CB-CG 4.35Å; R150-M174 HydrophobicContact CB-SD 4.43Å; R150-M174 HydrophobicContact CG-CG 4.45Å; R150-M174 HydrophobicContact CG-SD 4.15Å; R150-M174 PolarHBondContact O-N 3.17Å; M174-K199 WeakPolarHBondContact O-CA 3.48Å; M174-K199 WeakPolarHBondContact O-CB 3.45Å; M174-K199 PolarHBondContact O-N 3.28Å; M174-Y200 PolarHBondContact O-N 2.93Å
175	R	98.8	Very high	96.4	Very high	73 Å²	73	50.8 Å²	50.8	28%	0.275	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	126.3	176.2	-44	-165.5	80.9	88.2	2.5	109.9	R150 E151 L152 Y200 E222	R150-R175 PolarHBondContact O-N 2.95Å; E151-R175 WeakPolarHBondContact CA-O 3.44Å; E151-R175 HydrophobicContact CG-CB 4.16Å; E151-R175 HydrophobicContact CG-CG 4.18Å; E151-R175 WeakPolarHBondContact OE1-CD 3.44Å; L152-R175 PolarHBondContact N-O 3.12Å; R175-Y200 WeakPolarHBondContact CA-O 3.41Å; R175-Y200 HydrophobicContact CB-CD1 4.02Å; R175-Y200 HydrophobicContact CB-CG 4.47Å; R175-E222 IonicContact CZ-OE2 3.58Å; R175-E222 IonicContact NH1-OE2 2.68Å; R175-E222 IonicContact NH2-OE2 3.8Å; R175-E222 PolarHBondContact NH2-OE2 2.92Å
176	L	98.8	Very high	96.3	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	117.3	178.8	176.8	57.7	0	0	0	109.2	L152 F167 L178 L195 L198 Y200 L201 N202	L152-L176 HydrophobicContact CB-CD1 4.12Å; L152-L176 HydrophobicContact CD2-CD1 4.06Å; L152-L176 HydrophobicContact CG-CD1 4.12Å; F167-L176 HydrophobicContact CD1-CD1 4.45Å; F167-L176 HydrophobicContact CD1-CD2 4.46Å; F167-L176 HydrophobicContact CD2-CD2 4.06Å; F167-L176 HydrophobicContact CE1-CD1 3.99Å; F167-L176 HydrophobicContact CE1-CD2 4.33Å; F167-L176 HydrophobicContact CE2-CD2 3.93Å; F167-L176 HydrophobicContact CG-CD2 4.32Å; F167-L176 HydrophobicContact CZ-CD1 4.21Å; F167-L176 HydrophobicContact CZ-CD2 4.07Å; L176-L178 HydrophobicContact CD1-CD1 4.17Å; L176-L178 HydrophobicContact CD1-CG 4.04Å; L176-L178 HydrophobicContact CD2-CD1 3.8Å; L176-L178 HydrophobicContact CG-CD1 3.82Å; L176-L178 HydrophobicContact CG-CG 4.03Å; L176-L195 HydrophobicContact CD2-CD1 3.85Å; L176-L198 HydrophobicContact CB-CD1 3.71Å; L176-L198 HydrophobicContact CB-CD2 4.28Å; L176-Y200 PolarHBondContact N-O 3.14Å; L176-L201 HydrophobicContact CB-CD1 4.29Å; L176-L201 HydrophobicContact CD2-CD1 4.18Å; L176-L201 HydrophobicContact CG-CD1 4.16Å; L176-L201 WeakPolarHBondContact O-CA 3.38Å; L176-N202 PolarHBondContact O-N 3.05Å
177	D	98.7	Very high	96.4	Very high	7 Å²	7	52 Å²	52	4%	0.037	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	110.8	177.7	-177.3	9.7	0	0	0	111.1	L152 W153 L154 R155 G179 N202	L152-D177 PolarHBondContact O-N 2.88Å; W153-D177 HydrophobicContact CD2-CB 4.2Å; W153-D177 HydrophobicContact CE3-CB 3.34Å; W153-D177 HydrophobicContact CZ3-CB 3.8Å; L154-D177 CarbonylContact C-O 3.37Å; L154-D177 WeakPolarHBondContact CA-O 3.37Å; L154-D177 PolarHBondContact N-O 3.12Å; R155-D177 WeakPolarHBondContact CB-OD2 3.4Å; R155-D177 WeakPolarHBondContact CD-OD2 3.26Å; R155-D177 WeakPolarHBondContact CG-OD2 3.23Å; R155-D177 PolarHBondContact N-O 2.93Å; D177-G179 PolarHBondContact OD1-N 2.68Å; D177-N202 HydrophobicContact CB-CB 4.45Å; D177-N202 WeakPolarHBondContact OD1-CB 3.46Å; D177-N202 PolarHBondContact OD1-ND2 2.88Å
178	L	98.2	Very high	96.4	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	24%	0.235	C	C	.	.			trans	-122.1	30.6	178	-67.4	163.4	0	0	0	110.3	L154 I162 F167 L176 L181 F192 L201 N202 L203 C206	L154-L178 HydrophobicContact CB-CD2 3.89Å; L154-L178 HydrophobicContact CD1-CD2 3.95Å; I162-L178 HydrophobicContact CD1-CD1 4.09Å; F167-L178 HydrophobicContact CE2-CD1 4.06Å; F167-L178 HydrophobicContact CZ-CD1 3.84Å; F167-L178 HydrophobicContact CZ-CD2 4.05Å; F167-L178 HydrophobicContact CZ-CG 4.47Å; L176-L178 HydrophobicContact CD1-CD1 4.17Å; L176-L178 HydrophobicContact CD1-CG 4.04Å; L176-L178 HydrophobicContact CD2-CD1 3.8Å; L176-L178 HydrophobicContact CG-CD1 3.82Å; L176-L178 HydrophobicContact CG-CG 4.03Å; L178-L181 HydrophobicContact CB-CD1 3.92Å; L178-L181 HydrophobicContact CD2-CD1 3.99Å; L178-L181 WeakPolarHBondContact O-CD1 3.45Å; L178-L181 VanDerWaalsContact O-CG 3.3Å; L178-L181 WeakPolarHBondContact O-CG 3.5Å; L178-F192 HydrophobicContact CD1-CE1 3.97Å; L178-L201 HydrophobicContact CD1-CD1 4.41Å; L178-N202 CarbonylContact C-O 3.28Å; L178-N202 VanDerWaalsContact C-O 3.26Å; L178-N202 WeakPolarHBondContact CA-O 3.46Å; L178-N202 WeakPolarHBondContact CB-O 3.38Å; L178-N202 PolarHBondContact N-O 3.28Å; L178-L203 HydrophobicContact CB-CD2 3.81Å; L178-L203 HydrophobicContact CD1-CD2 4.22Å; L178-C206 PolarHBondContact O-SG 2.91Å
179	G	97.5	Very high	96.4	Very high	1 Å²	1	55.4 Å²	55.4	1%	0.01	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	166.2	176.2	0	0	0	0	0	114.2	R155 N156 D177 L181 N202 G204	R155-G179 CarbonylContact C-O 3.49Å; R155-G179 WeakPolarHBondContact CA-O 3.38Å; R155-G179 VanDerWaalsContact CB-O 3.3Å; R155-G179 WeakPolarHBondContact CB-O 3.44Å; N156-G179 PolarHBondContact N-O 2.94Å; D177-G179 PolarHBondContact OD1-N 2.68Å; G179-L181 PolarHBondContact O-N 2.83Å; G179-L181 VanDerWaalsContact O-N 3.12Å; G179-N202 PolarHBondContact N-O 3.3Å; G179-G204 CarbonylContact C-O 3.41Å; G179-G204 WeakPolarHBondContact CA-O 3.28Å
180	E	97.6	Very high	96.5	Very high	27 Å²	27	49.3 Å²	49.3	13%	0.126	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.6	25.8	179.6	-67.5	-163.6	-100.2	0	0	115	R155 N156 R182 G204 M205	R155-E180 IonicContact CZ-OE1 2.88Å; R155-E180 IonicContact NH1-OE1 2.65Å; R155-E180 PolarHBondContact NH1-OE1 2.72Å; R155-E180 IonicContact NH2-OE1 3.63Å; R155-E180 PolarHBondContact NH2-OE1 3.08Å; N156-E180 HydrophobicContact CB-CB 3.86Å; E180-R182 PolarHBondContact O-N 3.27Å; E180-R182 IonicContact OE2-CZ 3.94Å; E180-R182 IonicContact OE2-NE 3.67Å; E180-R182 IonicContact OE2-NH2 3.82Å; E180-R182 PolarHBondContact OE2-NH2 3Å; E180-G204 PolarHBondContact N-O 3.23Å; E180-M205 HydrophobicContact CG-CB 3.91Å; E180-M205 HydrophobicContact CG-CG 4.37Å; E180-M205 HydrophobicContact CG-SD 3.53Å; E180-M205 VanDerWaalsContact CG-SD 3.53Å
181	L	97.5	Very high	96.6	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	23%	0.229	C	C	.	.			trans	-79.5	66.1	174.8	-57.7	-178.9	0	0	0	110.4	N157 I159 L178 G179 K183 L184 C206	N157-L181 HydrophobicContact CB-CD2 4.13Å; N157-L181 VanDerWaalsContact O-CD2 3.22Å; N157-L181 WeakPolarHBondContact O-CD2 3.36Å; I159-L181 HydrophobicContact CB-CD1 4.36Å; I159-L181 HydrophobicContact CB-CD2 4.2Å; I159-L181 HydrophobicContact CD1-CD1 4.31Å; I159-L181 HydrophobicContact CD1-CD2 3.98Å; I159-L181 HydrophobicContact CG1-CD2 4.23Å; L178-L181 HydrophobicContact CB-CD1 3.92Å; L178-L181 HydrophobicContact CD2-CD1 3.99Å; L178-L181 WeakPolarHBondContact O-CD1 3.45Å; L178-L181 VanDerWaalsContact O-CG 3.3Å; L178-L181 WeakPolarHBondContact O-CG 3.5Å; G179-L181 PolarHBondContact O-N 2.83Å; G179-L181 VanDerWaalsContact O-N 3.12Å; L181-K183 PolarHBondContact O-N 2.97Å; L181-L184 HydrophobicContact CB-CB 4.01Å; L181-L184 HydrophobicContact CB-CD2 4.28Å; L181-L184 HydrophobicContact CD1-CD2 4.24Å; L181-L184 WeakPolarHBondContact O-CB 3.47Å; L181-L184 PolarHBondContact O-N 2.88Å; L181-C206 PolarHBondContact N-SG 3.38Å; L181-C206 VanDerWaalsContact N-SG 3.38Å
182	R	95.1	Very high	96.8	Very high	171 Å²	171	46.7 Å²	46.7	65%	0.645	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64	6.3	-174.3	-52.5	179.5	-163.7	-159.2	2.3	115.5	E180	E180-R182 PolarHBondContact O-N 3.27Å; E180-R182 IonicContact OE2-CZ 3.94Å; E180-R182 IonicContact OE2-NE 3.67Å; E180-R182 IonicContact OE2-NH2 3.82Å; E180-R182 PolarHBondContact OE2-NH2 3Å
183	K	95.8	Very high	96.8	Very high	105 Å²	105	48.6 Å²	48.6	46%	0.457	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.9	-1	179.3	-95.4	-126.3	-177.5	-170.1	0	112.7	P158 I159 E160 L181 E185	P158-K183 HydrophobicContact CB-CD 4.12Å; P158-K183 HydrophobicContact CB-CG 4.16Å; I159-K183 CarbonylContact O-C 3.47Å; I159-K183 VanDerWaalsContact O-C 3.28Å; E160-K183 WeakPolarHBondContact CA-O 3.3Å; E160-K183 HydrophobicContact CG-CB 4.48Å; E160-K183 HydrophobicContact CG-CD 3.88Å; E160-K183 IonicContact OE1-NZ 3.8Å; E160-K183 PolarHBondContact OE1-NZ 3.43Å; L181-K183 PolarHBondContact O-N 2.97Å; K183-E185 PolarHBondContact O-N 3.05Å
184	L	96.6	Very high	96.6	Very high	16 Å²	16	49.3 Å²	49.3	8%	0.084	23%	0.225	C	C	.	.			trans	-74	107.9	-171.3	-179.8	52.2	0	0	0	111.1	I159 I162 L181 Y186 I187 C206 L208	I159-L184 WeakPolarHBondContact O-CA 3.35Å; I159-L184 PolarHBondContact O-N 3.16Å; I162-L184 HydrophobicContact CD1-CD2 4.07Å; I162-L184 HydrophobicContact CG1-CD1 3.94Å; I162-L184 HydrophobicContact CG1-CD2 4.34Å; L181-L184 HydrophobicContact CB-CB 4.01Å; L181-L184 HydrophobicContact CB-CD2 4.28Å; L181-L184 HydrophobicContact CD1-CD2 4.24Å; L181-L184 WeakPolarHBondContact O-CB 3.47Å; L181-L184 PolarHBondContact O-N 2.88Å; L184-Y186 WeakPolarHBondContact CD1-O 3.46Å; L184-I187 HydrophobicContact CD1-CG1 4.26Å; L184-I187 HydrophobicContact CD2-CD1 3.99Å; L184-I187 HydrophobicContact CD2-CG1 3.95Å; L184-I187 HydrophobicContact CG-CG1 4.27Å; L184-C206 HydrophobicContact CD2-CB 4.48Å; L184-L208 HydrophobicContact CD2-CD2 4.09Å; L184-L208 HydrophobicContact CG-CD2 4.35Å
185	E	92.8	Very high	96.5	Very high	179 Å²	179	46.3 Å²	46.3	84%	0.836	21%	0.21	S	C	*	.			trans	-93.5	-28.2	-179.8	-63.9	-175.2	178.4	0	0	112.5	E160 K183	E160-E185 PolarHBondContact O-N 3.22Å; K183-E185 PolarHBondContact O-N 3.05Å
186	Y	93.9	Very high	96.2	Very high	134 Å²	134	47.7 Å²	47.7	53%	0.525	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	130.9	-173.2	178.5	-106.7	0	0	0	114	S161 I162 L184	S161-Y186 CarbonylContact C-O 3.59Å; S161-Y186 VanDerWaalsContact CA-O 3.23Å; S161-Y186 WeakPolarHBondContact CA-O 3.17Å; S161-Y186 WeakPolarHBondContact CB-O 3.31Å; I162-Y186 PolarHBondContact N-O 3.2Å; L184-Y186 WeakPolarHBondContact CD1-O 3.46Å
187	I	97	Very high	96	Very high	26 Å²	26	52 Å²	52	13%	0.133	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	131	165	-57.8	179.3	0	0	0	107.6	I162 L184 A191 F192 L208 P212	I162-I187 HydrophobicContact CB-CG1 4.46Å; I162-I187 HydrophobicContact CB-CG2 4.37Å; I162-I187 HydrophobicContact CD1-CD1 4.32Å; I162-I187 HydrophobicContact CD1-CG1 4.11Å; I162-I187 HydrophobicContact CG1-CG1 4.33Å; L184-I187 HydrophobicContact CD1-CG1 4.26Å; L184-I187 HydrophobicContact CD2-CD1 3.99Å; L184-I187 HydrophobicContact CD2-CG1 3.95Å; L184-I187 HydrophobicContact CG-CG1 4.27Å; I187-A191 HydrophobicContact CG2-CB 3.7Å; I187-F192 HydrophobicContact CG2-CE2 4.07Å; I187-F192 HydrophobicContact CG2-CZ 4.47Å; I187-L208 HydrophobicContact CD1-CD1 4.05Å; I187-L208 HydrophobicContact CD1-CD2 3.73Å; I187-L208 HydrophobicContact CG1-CD2 4.38Å; I187-P212 HydrophobicContact CB-CB 4.41Å; I187-P212 HydrophobicContact CD1-CB 4.02Å; I187-P212 HydrophobicContact CD1-CG 4.28Å; I187-P212 HydrophobicContact CG2-CB 3.98Å
188	S	96.8	Very high	96	Very high	10 Å²	10	51.7 Å²	51.7	7%	0.07	24%	0.241	C	C	.	.			trans	-77	144.9	175.4	-169.9	0	0	0	0	112.9	I162 S164 G190 A191	I162-S188 WeakPolarHBondContact O-CB 3.37Å; I162-S188 PolarHBondContact O-N 2.93Å; S164-S188 PolarHBondContact OG-OG 3.36Å; S188-G190 PolarHBondContact O-N 3.38Å; S188-A191 WeakPolarHBondContact O-CB 3.37Å; S188-A191 PolarHBondContact O-N 2.85Å
189	E	94.4	Very high	96	Very high	127 Å²	127	54.9 Å²	54.9	59%	0.593	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.5	-30	170.4	-73.6	-61.3	106.7	0	0	114.1	N213	E189-N213 PolarHBondContact O-ND2 3.18Å
190	G	96.1	Very high	96	Very high	14 Å²	14	56.5 Å²	56.5	14%	0.144	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	16	176.5	0	0	0	0	0	114.3	Y165 S188 F192 E193	Y165-G190 PolarHBondContact N-O 3.41Å; S188-G190 PolarHBondContact O-N 3.38Å; G190-F192 VanDerWaalsContact C-N 3.35Å; G190-F192 PolarHBondContact O-N 2.87Å; G190-E193 WeakPolarHBondContact O-CB 3.43Å; G190-E193 PolarHBondContact O-N 2.75Å
191	A	97.6	Very high	96.1	Very high	1 Å²	1	55.2 Å²	55.2	1%	0.008	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-44.3	-172.5	0	0	0	0	0	113.6	I162 P163 A166 I187 S188	I162-A191 HydrophobicContact CB-CB 4.34Å; I162-A191 HydrophobicContact CG2-CB 3.62Å; P163-A191 WeakPolarHBondContact O-CA 3.43Å; A166-A191 PolarHBondContact N-O 3.26Å; I187-A191 HydrophobicContact CG2-CB 3.7Å; S188-A191 WeakPolarHBondContact O-CB 3.37Å; S188-A191 PolarHBondContact O-N 2.85Å
192	F	97.3	Very high	96.1	Very high	2 Å²	2	56.2 Å²	56.2	1%	0.009	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	13.6	-173.9	-55.9	-68.2	0	0	0	113.7	I162 F167 L178 I187 G190 L195 L201 L203 P212 L214 L217	I162-F192 HydrophobicContact CD1-CZ 4.47Å; F167-F192 HydrophobicContact CE2-CD1 4.47Å; F167-F192 HydrophobicContact CE2-CE1 4.37Å; L178-F192 HydrophobicContact CD1-CE1 3.97Å; I187-F192 HydrophobicContact CG2-CE2 4.07Å; I187-F192 HydrophobicContact CG2-CZ 4.47Å; G190-F192 VanDerWaalsContact C-N 3.35Å; G190-F192 PolarHBondContact O-N 2.87Å; F192-L195 HydrophobicContact CB-CD1 4.29Å; F192-L195 HydrophobicContact CD1-CD1 4.12Å; F192-L195 WeakPolarHBondContact O-CB 3.37Å; F192-L195 PolarHBondContact O-N 2.99Å; F192-L201 HydrophobicContact CE1-CD1 4.26Å; F192-L201 HydrophobicContact CE1-CD2 4.44Å; F192-L203 HydrophobicContact CE2-CD1 4.4Å; F192-L203 HydrophobicContact CZ-CD1 3.98Å; F192-L203 HydrophobicContact CZ-CD2 4.27Å; F192-P212 HydrophobicContact CE2-CB 4.4Å; F192-L214 HydrophobicContact CD2-CD2 4Å; F192-L214 HydrophobicContact CE2-CD2 3.94Å; F192-L217 HydrophobicContact CB-CD1 4.3Å; F192-L217 HydrophobicContact CB-CD2 3.98Å; F192-L217 HydrophobicContact CB-CG 4.17Å; F192-L217 HydrophobicContact CG-CD1 4.38Å
193	E	96.2	Very high	96.2	Very high	65 Å²	65	48.1 Å²	48.1	30%	0.304	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	138.4	-179.6	-86.1	-69.9	-170.7	0	0	113.3	Y165 G190 P216	Y165-E193 HydrophobicContact CD1-CB 3.45Å; Y165-E193 VanDerWaalsContact CD1-CB 3.45Å; Y165-E193 HydrophobicContact CD1-CG 4.31Å; Y165-E193 HydrophobicContact CE1-CB 3.59Å; Y165-E193 HydrophobicContact CE1-CG 3.97Å; Y165-E193 HydrophobicContact CG-CB 4.39Å; G190-E193 WeakPolarHBondContact O-CB 3.43Å; G190-E193 PolarHBondContact O-N 2.75Å; E193-P216 HydrophobicContact CG-CG 4.21Å
194	G	93.7	Very high	96.3	Very high	15 Å²	15	43.3 Å²	43.3	16%	0.155	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.8	-8.6	-174.2	0	0	0	0	0	116	P171 H196	P171-G194 WeakPolarHBondContact CB-O 3.34Å; G194-H196 PolarHBondContact O-N 3.47Å
195	L	96	Very high	96.4	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.223	C	C	.	.			trans	-82.5	43.2	-177.8	-68.6	179.5	0	0	0	114.1	F167 L173 L176 F192 N197 L198 L217	F167-L195 HydrophobicContact CB-CD1 3.9Å; F167-L195 HydrophobicContact CB-CD2 3.79Å; F167-L195 HydrophobicContact CB-CG 4.02Å; F167-L195 HydrophobicContact CD2-CD1 3.98Å; F167-L195 HydrophobicContact CG-CD1 4.18Å; L173-L195 HydrophobicContact CB-CD2 4.06Å; L173-L195 HydrophobicContact CD1-CD2 4.06Å; L176-L195 HydrophobicContact CD2-CD1 3.85Å; F192-L195 HydrophobicContact CB-CD1 4.29Å; F192-L195 HydrophobicContact CD1-CD1 4.12Å; F192-L195 WeakPolarHBondContact O-CB 3.37Å; F192-L195 PolarHBondContact O-N 2.99Å; L195-N197 PolarHBondContact O-N 2.92Å; L195-N197 VanDerWaalsContact O-N 3.14Å; L195-L198 HydrophobicContact CB-CB 4.24Å; L195-L198 HydrophobicContact CD1-CD2 4.36Å; L195-L198 VanDerWaalsContact O-CB 3.31Å; L195-L198 WeakPolarHBondContact O-CB 3.23Å; L195-L198 PolarHBondContact O-N 2.99Å; L195-L198 VanDerWaalsContact O-N 3.08Å; L195-L217 HydrophobicContact CB-CD2 3.64Å; L195-L217 HydrophobicContact CD1-CD2 4.47Å
196	H	91.9	Very high	96.5	Very high	102 Å²	102	37.4 Å²	37.4	47%	0.472	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-22.1	-171.4	-48.9	-52.5	0	0	0	114.7	G194	G194-H196 PolarHBondContact O-N 3.47Å
197	N	95.3	Very high	96.6	Very high	90 Å²	90	34.5 Å²	34.5	48%	0.481	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-1.7	178.1	-65	-64.6	0	0	0	114	P171 L173 L195 K199	P171-N197 PolarHBondContact O-ND2 2.82Å; L173-N197 CarbonylContact O-C 3.46Å; L173-N197 VanDerWaalsContact O-C 3.29Å; L195-N197 PolarHBondContact O-N 2.92Å; L195-N197 VanDerWaalsContact O-N 3.14Å; N197-K199 PolarHBondContact O-N 2.99Å
198	L	98	Very high	96.5	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.18	C	C	.	.			trans	-66	131.7	-174.3	-163.5	75.5	0	0	0	111	L173 L176 L195 L201 L217 G219 L220	L173-L198 HydrophobicContact CB-CD1 4.1Å; L173-L198 WeakPolarHBondContact O-CA 3.49Å; L173-L198 PolarHBondContact O-N 3.5Å; L176-L198 HydrophobicContact CB-CD1 3.71Å; L176-L198 HydrophobicContact CB-CD2 4.28Å; L195-L198 HydrophobicContact CB-CB 4.24Å; L195-L198 HydrophobicContact CD1-CD2 4.36Å; L195-L198 VanDerWaalsContact O-CB 3.31Å; L195-L198 WeakPolarHBondContact O-CB 3.23Å; L195-L198 PolarHBondContact O-N 2.99Å; L195-L198 VanDerWaalsContact O-N 3.08Å; L198-L201 HydrophobicContact CD2-CB 4.03Å; L198-L201 HydrophobicContact CD2-CD1 4.4Å; L198-L217 HydrophobicContact CB-CD2 4.13Å; L198-L217 HydrophobicContact CD2-CD1 4.26Å; L198-L217 HydrophobicContact CD2-CD2 3.82Å; L198-G219 CarbonylContact O-C 3.53Å; L198-L220 HydrophobicContact CD2-CD1 4.23Å; L198-L220 HydrophobicContact CG-CD1 4.34Å; L198-L220 VanDerWaalsContact O-CA 3.29Å; L198-L220 WeakPolarHBondContact O-CA 3.36Å; L198-L220 PolarHBondContact O-N 3.36Å
199	K	98.3	Very high	96.3	Very high	67 Å²	67	43.2 Å²	43.2	29%	0.291	21%	0.213	S	C	.	.			trans	-111.6	-35.1	-178.5	-64.3	-50.1	-161.3	155.2	0	113.2	M174 N197 G219 E221 E222	M174-K199 WeakPolarHBondContact O-CA 3.48Å; M174-K199 WeakPolarHBondContact O-CB 3.45Å; M174-K199 PolarHBondContact O-N 3.28Å; N197-K199 PolarHBondContact O-N 2.99Å; K199-G219 WeakPolarHBondContact CD-O 3.32Å; K199-G219 WeakPolarHBondContact CE-O 3.29Å; K199-G219 PolarHBondContact NZ-O 2.92Å; K199-E221 HydrophobicContact CD-CG 4.24Å; K199-E221 WeakPolarHBondContact CD-OE1 3.4Å; K199-E221 VanDerWaalsContact CE-OE1 3.24Å; K199-E221 WeakPolarHBondContact CE-OE1 3.26Å; K199-E221 IonicContact NZ-OE1 3.51Å; K199-E221 PolarHBondContact NZ-OE1 3.11Å; K199-E221 PolarHBondContact O-N 3.06Å; K199-E222 PolarHBondContact O-N 3.06Å
200	Y	98.8	Very high	96.1	Very high	35 Å²	35	45 Å²	45	14%	0.137	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	129.2	179.4	172.4	-89.7	0	0	0	110.5	W153 M174 R175 L176 N202 E222	W153-Y200 HydrophobicContact CZ3-CE1 4.41Å; M174-Y200 PolarHBondContact O-N 2.93Å; R175-Y200 WeakPolarHBondContact CA-O 3.41Å; R175-Y200 HydrophobicContact CB-CD1 4.02Å; R175-Y200 HydrophobicContact CB-CG 4.47Å; L176-Y200 PolarHBondContact N-O 3.14Å; Y200-N202 HydrophobicContact CE1-CB 3.99Å; Y200-E222 WeakPolarHBondContact CA-O 3.5Å; Y200-E222 HydrophobicContact CD2-CB 3.84Å
201	L	98.7	Very high	96	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	128.8	172.4	178	60.2	0	0	0	109.8	L176 L178 F192 L198 L203 L214 L217 L220 E222 L223 E224	L176-L201 HydrophobicContact CB-CD1 4.29Å; L176-L201 HydrophobicContact CD2-CD1 4.18Å; L176-L201 HydrophobicContact CG-CD1 4.16Å; L176-L201 WeakPolarHBondContact O-CA 3.38Å; L178-L201 HydrophobicContact CD1-CD1 4.41Å; F192-L201 HydrophobicContact CE1-CD1 4.26Å; F192-L201 HydrophobicContact CE1-CD2 4.44Å; L198-L201 HydrophobicContact CD2-CB 4.03Å; L198-L201 HydrophobicContact CD2-CD1 4.4Å; L201-L203 HydrophobicContact CD1-CG 4.18Å; L201-L203 HydrophobicContact CD2-CD1 3.89Å; L201-L203 HydrophobicContact CD2-CG 4.37Å; L201-L203 HydrophobicContact CG-CD1 4.21Å; L201-L203 HydrophobicContact CG-CG 4.14Å; L201-L214 HydrophobicContact CD2-CD2 3.87Å; L201-L217 HydrophobicContact CD2-CD1 3.6Å; L201-L220 HydrophobicContact CB-CD1 3.87Å; L201-E222 PolarHBondContact N-O 2.98Å; L201-L223 HydrophobicContact CB-CD1 4.18Å; L201-L223 HydrophobicContact CD2-CD1 4.18Å; L201-L223 HydrophobicContact CG-CD1 4.19Å; L201-E224 PolarHBondContact O-N 3.01Å
202	N	98.6	Very high	95.8	Very high	22 Å²	22	46.9 Å²	46.9	12%	0.118	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	125.5	169.1	-178.7	17.4	0	0	0	110.7	L176 D177 L178 G179 Y200 G204 E224	L176-N202 PolarHBondContact O-N 3.05Å; D177-N202 HydrophobicContact CB-CB 4.45Å; D177-N202 WeakPolarHBondContact OD1-CB 3.46Å; D177-N202 PolarHBondContact OD1-ND2 2.88Å; L178-N202 CarbonylContact C-O 3.28Å; L178-N202 VanDerWaalsContact C-O 3.26Å; L178-N202 WeakPolarHBondContact CA-O 3.46Å; L178-N202 WeakPolarHBondContact CB-O 3.38Å; L178-N202 PolarHBondContact N-O 3.28Å; G179-N202 PolarHBondContact N-O 3.3Å; Y200-N202 HydrophobicContact CE1-CB 3.99Å; N202-G204 PolarHBondContact OD1-N 2.97Å; N202-E224 HydrophobicContact CB-CB 4.28Å; N202-E224 WeakPolarHBondContact OD1-CG 3.38Å
203	L	97.7	Very high	95.7	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.238	C	C	.	.			trans	-131.8	21.3	173.1	-70.7	170.7	0	0	0	110.9	L178 F192 L201 C206 L208 P212 L214 E224 I225 N228	L178-L203 HydrophobicContact CB-CD2 3.81Å; L178-L203 HydrophobicContact CD1-CD2 4.22Å; F192-L203 HydrophobicContact CE2-CD1 4.4Å; F192-L203 HydrophobicContact CZ-CD1 3.98Å; F192-L203 HydrophobicContact CZ-CD2 4.27Å; L201-L203 HydrophobicContact CD1-CG 4.18Å; L201-L203 HydrophobicContact CD2-CD1 3.89Å; L201-L203 HydrophobicContact CD2-CG 4.37Å; L201-L203 HydrophobicContact CG-CD1 4.21Å; L201-L203 HydrophobicContact CG-CG 4.14Å; L203-C206 WeakPolarHBondContact O-CB 3.41Å; L203-L208 HydrophobicContact CB-CD1 4.35Å; L203-P212 HydrophobicContact CD1-CG 4.03Å; L203-L214 HydrophobicContact CD1-CD2 4.47Å; L203-E224 PolarHBondContact N-O 3.22Å; L203-I225 HydrophobicContact CB-CD1 4.37Å; L203-I225 HydrophobicContact CB-CG1 3.99Å; L203-N228 PolarHBondContact O-ND2 2.86Å
204	G	97.6	Very high	95.7	Very high	5 Å²	5	46 Å²	46	5%	0.052	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	154.5	179.7	0	0	0	0	0	113.7	G179 E180 N202 C206 S226	G179-G204 CarbonylContact C-O 3.41Å; G179-G204 WeakPolarHBondContact CA-O 3.28Å; E180-G204 PolarHBondContact N-O 3.23Å; N202-G204 PolarHBondContact OD1-N 2.97Å; G204-C206 PolarHBondContact O-N 2.91Å; G204-C206 PolarHBondContact O-SG 3.08Å; G204-C206 VanDerWaalsContact O-SG 3.41Å; G204-S226 CarbonylContact C-O 3.09Å; G204-S226 WeakPolarHBondContact CA-O 3.27Å
205	M	97	Very high	95.7	Very high	71 Å²	71	47.8 Å²	47.8	35%	0.35	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.1	25.2	-176.9	-58.4	173.1	176.1	0	0	114.5	E180 S226 E227	E180-M205 HydrophobicContact CG-CB 3.91Å; E180-M205 HydrophobicContact CG-CG 4.37Å; E180-M205 HydrophobicContact CG-SD 3.53Å; E180-M205 VanDerWaalsContact CG-SD 3.53Å; M205-S226 PolarHBondContact N-O 3.39Å; M205-E227 WeakPolarHBondContact CA-O 3.44Å; M205-E227 HydrophobicContact CB-CB 4.38Å; M205-E227 VanDerWaalsContact CE-CD 3.45Å; M205-E227 WeakPolarHBondContact CE-OE1 3.28Å; M205-E227 HydrophobicContact CG-CB 3.69Å; M205-E227 HydrophobicContact CG-CG 4.23Å
206	C	96.8	Very high	95.6	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.238	C	C	.	.	S	Bend	trans	-97.3	2.4	-176.9	-70.1	0	0	0	0	114.1	L178 L181 L184 L203 G204 L208 N228	L178-C206 PolarHBondContact O-SG 2.91Å; L181-C206 PolarHBondContact N-SG 3.38Å; L181-C206 VanDerWaalsContact N-SG 3.38Å; L184-C206 HydrophobicContact CD2-CB 4.48Å; L203-C206 WeakPolarHBondContact O-CB 3.41Å; G204-C206 PolarHBondContact O-N 2.91Å; G204-C206 PolarHBondContact O-SG 3.08Å; G204-C206 VanDerWaalsContact O-SG 3.41Å; C206-L208 HydrophobicContact CB-CD1 4.28Å; C206-L208 HydrophobicContact CB-CD2 4.3Å; C206-L208 HydrophobicContact CB-CG 3.86Å; C206-L208 PolarHBondContact O-N 3.44Å; C206-N228 VanDerWaalsContact C-OD1 3.31Å; C206-N228 WeakPolarHBondContact CA-OD1 3.33Å; C206-N228 PolarHBondContact N-OD1 2.78Å
207	S	94.8	Very high	95.8	Very high	72 Å²	72	43.4 Å²	43.4	50%	0.503	22%	0.215	S	C	.	.			trans	57.3	24.4	-179.9	-54.2	0	0	0	0	114.9	N228	S207-N228 PolarHBondContact N-OD1 3.05Å
208	L	94.3	Very high	95.7	Very high	16 Å²	16	44 Å²	44	8%	0.084	22%	0.217	C	C	.	.			trans	-63.2	137.9	-179.3	-59	176.2	0	0	0	111	L184 I187 L203 C206 I225 N228 V229 F230	L184-L208 HydrophobicContact CD2-CD2 4.09Å; L184-L208 HydrophobicContact CG-CD2 4.35Å; I187-L208 HydrophobicContact CD1-CD1 4.05Å; I187-L208 HydrophobicContact CD1-CD2 3.73Å; I187-L208 HydrophobicContact CG1-CD2 4.38Å; L203-L208 HydrophobicContact CB-CD1 4.35Å; C206-L208 HydrophobicContact CB-CD1 4.28Å; C206-L208 HydrophobicContact CB-CD2 4.3Å; C206-L208 HydrophobicContact CB-CG 3.86Å; C206-L208 PolarHBondContact O-N 3.44Å; L208-I225 HydrophobicContact CD1-CD1 4.41Å; L208-N228 HydrophobicContact CB-CB 4.22Å; L208-N228 WeakPolarHBondContact CB-OD1 3.17Å; L208-N228 WeakPolarHBondContact CG-OD1 3.38Å; L208-N228 PolarHBondContact N-OD1 3.48Å; L208-V229 CarbonylContact O-C 3.58Å; L208-V229 WeakPolarHBondContact O-CA 3.32Å; L208-V229 PolarHBondContact O-N 3.08Å; L208-F230 HydrophobicContact CB-CE1 3.73Å; L208-F230 HydrophobicContact CB-CZ 3.9Å; L208-F230 HydrophobicContact CD1-CZ 4.43Å
209	R	92.5	Very high	95.6	Very high	204 Å²	204	44.5 Å²	44.5	77%	0.77	22%	0.223	S	C	*	.	S	Bend	trans	-101.8	-20.9	179.6	-62.1	-176	-176.7	-174	1.7	114.2	V229	R209-V229 WeakPolarHBondContact CA-O 3.21Å
210	E	91.6	Very high	95.6	Very high	164 Å²	164	41.3 Å²	41.3	77%	0.766	21%	0.209	S	C	*	.	S	Bend	trans	-132.8	147.9	-176.5	-64.5	179.7	-177.1	0	0	108.2	F230	E210-F230 WeakPolarHBondContact O-CE1 3.2Å
211	F	92.8	Very high	95.5	Very high	41 Å²	41	42.1 Å²	42.1	18%	0.18	21%	0.214	C	C	.	.			trans	-72.3	125.8	177	-91.9	-91.4	0	0	0	110.1	I225 F230 L233 A237 F238 I249	F211-I225 HydrophobicContact CD1-CD1 4.2Å; F211-I225 HydrophobicContact CE1-CD1 4.04Å; F211-I225 HydrophobicContact CE1-CG2 4.14Å; F211-F230 HydrophobicContact CD2-CB 4.32Å; F211-F230 AromaticContact CD2-CD1 3.85Å; F211-F230 HydrophobicContact CD2-CD1 3.85Å; F211-F230 HydrophobicContact CD2-CD2 4.27Å; F211-F230 HydrophobicContact CD2-CE1 4.18Å; F211-F230 AromaticContact CD2-CG 3.9Å; F211-F230 HydrophobicContact CD2-CG 3.9Å; F211-F230 HydrophobicContact CE1-CD2 4.39Å; F211-F230 HydrophobicContact CE1-CE2 4.15Å; F211-F230 HydrophobicContact CE1-CZ 4.49Å; F211-F230 HydrophobicContact CE2-CB 3.66Å; F211-F230 AromaticContact CE2-CD1 3.8Å; F211-F230 HydrophobicContact CE2-CD1 3.8Å; F211-F230 AromaticContact CE2-CD2 3.43Å; F211-F230 HydrophobicContact CE2-CD2 3.43Å; F211-F230 VanDerWaalsContact CE2-CD2 3.43Å; F211-F230 HydrophobicContact CE2-CE1 4.27Å; F211-F230 AromaticContact CE2-CE2 3.94Å; F211-F230 HydrophobicContact CE2-CE2 3.94Å; F211-F230 AromaticContact CE2-CG 3.35Å; F211-F230 HydrophobicContact CE2-CG 3.35Å; F211-F230 HydrophobicContact CE2-CZ 4.33Å; F211-F230 HydrophobicContact CZ-CB 4.5Å; F211-F230 AromaticContact CZ-CD2 3.5Å; F211-F230 HydrophobicContact CZ-CD2 3.5Å; F211-F230 VanDerWaalsContact CZ-CD2 3.5Å; F211-F230 AromaticContact CZ-CE2 3.7Å; F211-F230 HydrophobicContact CZ-CE2 3.7Å; F211-F230 AromaticContact CZ-CG 3.94Å; F211-F230 HydrophobicContact CZ-CG 3.94Å; F211-F230 HydrophobicContact CZ-CZ 4.3Å; F211-L233 HydrophobicContact CD2-CD1 3.97Å; F211-L233 HydrophobicContact CE1-CD1 4.19Å; F211-L233 HydrophobicContact CE2-CD1 3.26Å; F211-L233 HydrophobicContact CZ-CD1 3.4Å; F211-L233 VanDerWaalsContact CZ-CD1 3.4Å; F211-A237 HydrophobicContact CB-CB 4.05Å; F211-A237 HydrophobicContact CD1-CB 3.96Å; F211-A237 HydrophobicContact CD2-CB 4.27Å; F211-A237 HydrophobicContact CG-CB 3.82Å; F211-F238 AromaticContact CE1-CE1 3.98Å; F211-F238 HydrophobicContact CE1-CE1 3.98Å; F211-F238 HydrophobicContact CE1-CZ 4.08Å; F211-F238 HydrophobicContact CZ-CZ 4.33Å; F211-I249 HydrophobicContact CZ-CD1 4.36Å; F211-I249 HydrophobicContact CZ-CG2 4.45Å
212	P	94.7	Very high	95.5	Very high	13 Å²	13	44.1 Å²	44.1	8%	0.084	22%	0.223	C	C	.	.			trans	-70.3	155.3	176.4	29.9	-34.6	0	0	0	111.1	I187 F192 L203 L214	I187-P212 HydrophobicContact CB-CB 4.41Å; I187-P212 HydrophobicContact CD1-CB 4.02Å; I187-P212 HydrophobicContact CD1-CG 4.28Å; I187-P212 HydrophobicContact CG2-CB 3.98Å; F192-P212 HydrophobicContact CE2-CB 4.4Å; L203-P212 HydrophobicContact CD1-CG 4.03Å; P212-L214 HydrophobicContact CG-CD2 4.08Å; P212-L214 HydrophobicContact CG-CG 4.47Å; P212-L214 PolarHBondContact O-N 3.17Å; P212-L214 VanDerWaalsContact O-N 3.08Å
213	N	94.9	Very high	95.5	Very high	45 Å²	45	43.2 Å²	43.2	24%	0.241	22%	0.218	C	C	.	.			trans	-65.5	109.6	172.4	179.7	25.3	0	0	0	111.7	E189 S215	E189-N213 PolarHBondContact O-ND2 3.18Å; N213-S215 WeakPolarHBondContact OD1-CB 3.31Å; N213-S215 PolarHBondContact OD1-N 2.83Å; N213-S215 PolarHBondContact OD1-OG 3.05Å; N213-S215 VanDerWaalsContact OD1-OG 3.04Å
214	L	95.8	Very high	95.6	Very high	3 Å²	3	45 Å²	45	2%	0.016	23%	0.227	C	C	.	.			trans	-101.7	1.3	176.2	-57.9	-176.1	0	0	0	113.5	F192 L201 L203 P212 P216 L217 L223 L241	F192-L214 HydrophobicContact CD2-CD2 4Å; F192-L214 HydrophobicContact CE2-CD2 3.94Å; L201-L214 HydrophobicContact CD2-CD2 3.87Å; L203-L214 HydrophobicContact CD1-CD2 4.47Å; P212-L214 HydrophobicContact CG-CD2 4.08Å; P212-L214 HydrophobicContact CG-CG 4.47Å; P212-L214 PolarHBondContact O-N 3.17Å; P212-L214 VanDerWaalsContact O-N 3.08Å; L214-P216 VanDerWaalsContact C-N 3.32Å; L214-P216 VanDerWaalsContact O-N 3.14Å; L214-L217 HydrophobicContact CB-CD1 4.34Å; L214-L217 HydrophobicContact CD2-CD1 3.95Å; L214-L217 VanDerWaalsContact O-CB 3.32Å; L214-L217 WeakPolarHBondContact O-CB 3.14Å; L214-L217 PolarHBondContact O-N 2.92Å; L214-L223 HydrophobicContact CD1-CD1 4.16Å; L214-L223 HydrophobicContact CD1-CD2 3.5Å; L214-L223 VanDerWaalsContact CD1-CD2 3.5Å; L214-L241 HydrophobicContact CB-CD1 4.1Å; L214-L241 HydrophobicContact CB-CD2 4.27Å; L214-L241 HydrophobicContact CD1-CD1 4.17Å
215	S	93.5	Very high	95.5	Very high	54 Å²	54	44.8 Å²	44.8	38%	0.378	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-25.2	-174.1	78.1	0	0	0	0	116.5	N213 L217 L218	N213-S215 WeakPolarHBondContact OD1-CB 3.31Å; N213-S215 PolarHBondContact OD1-N 2.83Å; N213-S215 PolarHBondContact OD1-OG 3.05Å; N213-S215 VanDerWaalsContact OD1-OG 3.04Å; S215-L217 PolarHBondContact O-N 2.87Å; S215-L218 WeakPolarHBondContact O-CD2 3.37Å
216	P	94.7	Very high	95.6	Very high	10 Å²	10	41.9 Å²	41.9	7%	0.065	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-17.6	172.9	-22.4	35.3	0	0	0	114.6	E193 L214 L218	E193-P216 HydrophobicContact CG-CG 4.21Å; L214-P216 VanDerWaalsContact C-N 3.32Å; L214-P216 VanDerWaalsContact O-N 3.14Å; P216-L218 PolarHBondContact O-N 3.23Å
217	L	96.2	Very high	95.6	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.229	C	C	.	.			trans	-86.5	49.6	-171.5	-58.4	178.5	0	0	0	112.7	F192 L195 L198 L201 L214 S215 G219 L220 L241	F192-L217 HydrophobicContact CB-CD1 4.3Å; F192-L217 HydrophobicContact CB-CD2 3.98Å; F192-L217 HydrophobicContact CB-CG 4.17Å; F192-L217 HydrophobicContact CG-CD1 4.38Å; L195-L217 HydrophobicContact CB-CD2 3.64Å; L195-L217 HydrophobicContact CD1-CD2 4.47Å; L198-L217 HydrophobicContact CB-CD2 4.13Å; L198-L217 HydrophobicContact CD2-CD1 4.26Å; L198-L217 HydrophobicContact CD2-CD2 3.82Å; L201-L217 HydrophobicContact CD2-CD1 3.6Å; L214-L217 HydrophobicContact CB-CD1 4.34Å; L214-L217 HydrophobicContact CD2-CD1 3.95Å; L214-L217 VanDerWaalsContact O-CB 3.32Å; L214-L217 WeakPolarHBondContact O-CB 3.14Å; L214-L217 PolarHBondContact O-N 2.92Å; S215-L217 PolarHBondContact O-N 2.87Å; L217-G219 PolarHBondContact O-N 2.93Å; L217-L220 HydrophobicContact CB-CB 4.18Å; L217-L220 HydrophobicContact CB-CD2 4.49Å; L217-L220 HydrophobicContact CD1-CD2 4.32Å; L217-L220 VanDerWaalsContact O-CB 3.29Å; L217-L220 WeakPolarHBondContact O-CB 3.47Å; L217-L220 PolarHBondContact O-N 2.74Å; L217-L241 HydrophobicContact CB-CD2 4.12Å
218	L	92.8	Very high	95.7	Very high	101 Å²	101	42.7 Å²	42.7	53%	0.529	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-25.8	-175.6	-57.7	177.4	0	0	0	114	S215 P216 N243	S215-L218 WeakPolarHBondContact O-CD2 3.37Å; P216-L218 PolarHBondContact O-N 3.23Å; L218-N243 PolarHBondContact O-ND2 2.84Å
219	G	95.1	Very high	95.8	Very high	11 Å²	11	45.4 Å²	45.4	11%	0.113	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-9.9	179.6	0	0	0	0	0	116.1	L198 K199 L217	L198-G219 CarbonylContact O-C 3.53Å; K199-G219 WeakPolarHBondContact CD-O 3.32Å; K199-G219 WeakPolarHBondContact CE-O 3.29Å; K199-G219 PolarHBondContact NZ-O 2.92Å; L217-G219 PolarHBondContact O-N 2.93Å
220	L	98.2	Very high	95.9	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	19%	0.188	C	C	.	.			trans	-62.6	134.8	-165.2	-163.4	70.4	0	0	0	113	L198 L201 L217 L223 L241 N243 L244	L198-L220 HydrophobicContact CD2-CD1 4.23Å; L198-L220 HydrophobicContact CG-CD1 4.34Å; L198-L220 VanDerWaalsContact O-CA 3.29Å; L198-L220 WeakPolarHBondContact O-CA 3.36Å; L198-L220 PolarHBondContact O-N 3.36Å; L201-L220 HydrophobicContact CB-CD1 3.87Å; L217-L220 HydrophobicContact CB-CB 4.18Å; L217-L220 HydrophobicContact CB-CD2 4.49Å; L217-L220 HydrophobicContact CD1-CD2 4.32Å; L217-L220 VanDerWaalsContact O-CB 3.29Å; L217-L220 WeakPolarHBondContact O-CB 3.47Å; L217-L220 PolarHBondContact O-N 2.74Å; L220-L223 HydrophobicContact CD2-CB 4.15Å; L220-L223 HydrophobicContact CD2-CD1 4.43Å; L220-L241 HydrophobicContact CB-CD2 4.33Å; L220-L241 HydrophobicContact CD2-CD1 4.42Å; L220-L241 HydrophobicContact CD2-CD2 4.26Å; L220-N243 CarbonylContact O-C 3.58Å; L220-N243 WeakPolarHBondContact O-CB 3.13Å; L220-N243 VanDerWaalsContact O-O 3.14Å; L220-L244 HydrophobicContact CD2-CD1 4.14Å; L220-L244 HydrophobicContact CG-CD1 4.16Å; L220-L244 WeakPolarHBondContact O-CA 3.44Å; L220-L244 PolarHBondContact O-N 2.92Å; L220-L244 VanDerWaalsContact O-N 3.16Å
221	E	98.3	Very high	96	Very high	51 Å²	51	31.4 Å²	31.4	24%	0.238	17%	0.174	C	C	.	.			trans	-117.3	-31.2	179.7	-76.9	-178.4	-123.7	0	0	113	K199 R245 K246	K199-E221 HydrophobicContact CD-CG 4.24Å; K199-E221 WeakPolarHBondContact CD-OE1 3.4Å; K199-E221 VanDerWaalsContact CE-OE1 3.24Å; K199-E221 WeakPolarHBondContact CE-OE1 3.26Å; K199-E221 IonicContact NZ-OE1 3.51Å; K199-E221 PolarHBondContact NZ-OE1 3.11Å; K199-E221 PolarHBondContact O-N 3.06Å; E221-R245 WeakPolarHBondContact O-CA 3.38Å; E221-R245 PolarHBondContact O-N 2.58Å; E221-R245 IonicContact OE2-CZ 3.57Å; E221-R245 IonicContact OE2-NH1 3.94Å; E221-R245 PolarHBondContact OE2-NH1 2.86Å; E221-K246 PolarHBondContact O-N 2.85Å
222	E	98.6	Very high	96.1	Very high	43 Å²	43	32.7 Å²	32.7	20%	0.201	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	120.9	-176.8	-60.1	-177.1	128.6	0	0	109.9	R175 K199 Y200 L201 K246	R175-E222 IonicContact CZ-OE2 3.58Å; R175-E222 IonicContact NH1-OE2 2.68Å; R175-E222 IonicContact NH2-OE2 3.8Å; R175-E222 PolarHBondContact NH2-OE2 2.92Å; K199-E222 PolarHBondContact O-N 3.06Å; Y200-E222 WeakPolarHBondContact CA-O 3.5Å; Y200-E222 HydrophobicContact CD2-CB 3.84Å; L201-E222 PolarHBondContact N-O 2.98Å; E222-K246 HydrophobicContact CB-CB 4.5Å; E222-K246 HydrophobicContact CG-CB 4.3Å; E222-K246 HydrophobicContact CG-CD 4.04Å; E222-K246 HydrophobicContact CG-CG 4.21Å; E222-K246 WeakPolarHBondContact OE1-CD 3.34Å; E222-K246 WeakPolarHBondContact OE1-CE 3.3Å; E222-K246 IonicContact OE1-NZ 3.65Å; E222-K246 PolarHBondContact OE1-NZ 3.4Å
223	L	98.6	Very high	96.1	Very high	2 Å²	2	32.1 Å²	32.1	1%	0.01	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	118.7	177.1	178.8	57	0	0	0	110.9	L201 L214 L220 F238 L241 L244 K246 L247 W248	L201-L223 HydrophobicContact CB-CD1 4.18Å; L201-L223 HydrophobicContact CD2-CD1 4.18Å; L201-L223 HydrophobicContact CG-CD1 4.19Å; L214-L223 HydrophobicContact CD1-CD1 4.16Å; L214-L223 HydrophobicContact CD1-CD2 3.5Å; L214-L223 VanDerWaalsContact CD1-CD2 3.5Å; L220-L223 HydrophobicContact CD2-CB 4.15Å; L220-L223 HydrophobicContact CD2-CD1 4.43Å; L223-F238 HydrophobicContact CD2-CE1 4.46Å; L223-L241 HydrophobicContact CD2-CD1 4.48Å; L223-L244 HydrophobicContact CB-CD1 3.75Å; L223-K246 PolarHBondContact N-O 2.97Å; L223-L247 HydrophobicContact CB-CD1 4.25Å; L223-L247 HydrophobicContact CD2-CD1 3.95Å; L223-L247 HydrophobicContact CG-CD1 4.18Å; L223-W248 PolarHBondContact O-N 2.78Å
224	E	98.4	Very high	96	Very high	38 Å²	38	34.3 Å²	34.3	18%	0.178	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	120.9	168.6	174.6	60.2	-75.6	0	0	109.7	L201 N202 L203 S226 W248	L201-E224 PolarHBondContact O-N 3.01Å; N202-E224 HydrophobicContact CB-CB 4.28Å; N202-E224 WeakPolarHBondContact OD1-CG 3.38Å; L203-E224 PolarHBondContact N-O 3.22Å; E224-S226 WeakPolarHBondContact OE1-CB 3.19Å; E224-S226 PolarHBondContact OE1-N 2.85Å; E224-S226 PolarHBondContact OE1-OG 3.36Å; E224-W248 HydrophobicContact CB-CE3 4.17Å; E224-W248 HydrophobicContact CG-CE3 4.42Å; E224-W248 WeakPolarHBondContact OE1-CB 3.44Å
225	I	96.9	Very high	95.8	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.189	C	C	.	.			trans	-145.4	24.8	177.6	-155.2	173.4	0	0	0	111.9	L203 L208 F211 N228 F230 W248 I249 S252	L203-I225 HydrophobicContact CB-CD1 4.37Å; L203-I225 HydrophobicContact CB-CG1 3.99Å; L208-I225 HydrophobicContact CD1-CD1 4.41Å; F211-I225 HydrophobicContact CD1-CD1 4.2Å; F211-I225 HydrophobicContact CE1-CD1 4.04Å; F211-I225 HydrophobicContact CE1-CG2 4.14Å; I225-N228 PolarHBondContact O-ND2 3.05Å; I225-F230 HydrophobicContact CD1-CE2 3.96Å; I225-F230 HydrophobicContact CD1-CZ 3.69Å; I225-F230 HydrophobicContact CG1-CE2 3.8Å; I225-F230 HydrophobicContact CG1-CZ 3.82Å; I225-F230 HydrophobicContact CG2-CE2 4.25Å; I225-W248 PolarHBondContact N-O 2.72Å; I225-I249 HydrophobicContact CG2-CB 4.46Å; I225-I249 HydrophobicContact CG2-CG1 4.06Å; I225-I249 HydrophobicContact CG2-CG2 4.02Å; I225-S252 PolarHBondContact O-OG 3.37Å
226	S	98.1	Very high	95.4	Very high	10 Å²	10	35 Å²	35	7%	0.07	20%	0.198	C	C	.	.			trans	-62.1	161.4	172	-57.2	0	0	0	0	113.3	G204 M205 E224 N228 W248 M250	G204-S226 CarbonylContact C-O 3.09Å; G204-S226 WeakPolarHBondContact CA-O 3.27Å; M205-S226 PolarHBondContact N-O 3.39Å; E224-S226 WeakPolarHBondContact OE1-CB 3.19Å; E224-S226 PolarHBondContact OE1-N 2.85Å; E224-S226 PolarHBondContact OE1-OG 3.36Å; S226-N228 VanDerWaalsContact C-N 3.32Å; S226-N228 PolarHBondContact O-N 3.34Å; S226-N228 PolarHBondContact O-ND2 2.78Å; S226-W248 PolarHBondContact N-O 3.37Å; S226-W248 PolarHBondContact OG-O 3.18Å; S226-M250 CarbonylContact C-O 3.39Å; S226-M250 VanDerWaalsContact CA-O 3.23Å; S226-M250 WeakPolarHBondContact CA-O 3.3Å; S226-M250 WeakPolarHBondContact CB-O 3.3Å; S226-M250 PolarHBondContact OG-N 3.04Å
227	E	96.9	Very high	95.3	Very high	83 Å²	83	35.2 Å²	35.2	39%	0.388	20%	0.2	S	C	.	.	S	Bend	trans	56.9	42.1	178.6	-57	-166.7	-143.3	0	0	113.9	M205 M250 N251 S252	M205-E227 WeakPolarHBondContact CA-O 3.44Å; M205-E227 HydrophobicContact CB-CB 4.38Å; M205-E227 VanDerWaalsContact CE-CD 3.45Å; M205-E227 WeakPolarHBondContact CE-OE1 3.28Å; M205-E227 HydrophobicContact CG-CB 3.69Å; M205-E227 HydrophobicContact CG-CG 4.23Å; E227-M250 PolarHBondContact N-O 3.13Å; E227-N251 HydrophobicContact CG-CB 4.15Å; E227-S252 PolarHBondContact N-OG 3.14Å
228	N	96.7	Very high	95.2	Very high	6 Å²	6	35.3 Å²	35.3	3%	0.032	20%	0.2	C	C	.	.	S	Bend	trans	-113.9	-162.2	169.2	-74.6	-63.7	0	0	0	110.2	L203 C206 S207 L208 I225 S226 F230 S252	L203-N228 PolarHBondContact O-ND2 2.86Å; C206-N228 VanDerWaalsContact C-OD1 3.31Å; C206-N228 WeakPolarHBondContact CA-OD1 3.33Å; C206-N228 PolarHBondContact N-OD1 2.78Å; S207-N228 PolarHBondContact N-OD1 3.05Å; L208-N228 HydrophobicContact CB-CB 4.22Å; L208-N228 WeakPolarHBondContact CB-OD1 3.17Å; L208-N228 WeakPolarHBondContact CG-OD1 3.38Å; L208-N228 PolarHBondContact N-OD1 3.48Å; I225-N228 PolarHBondContact O-ND2 3.05Å; S226-N228 VanDerWaalsContact C-N 3.32Å; S226-N228 PolarHBondContact O-N 3.34Å; S226-N228 PolarHBondContact O-ND2 2.78Å; N228-F230 HydrophobicContact CB-CD2 4.09Å; N228-F230 HydrophobicContact CB-CE1 4.12Å; N228-F230 HydrophobicContact CB-CE2 3.47Å; N228-F230 VanDerWaalsContact CB-CE2 3.47Å; N228-F230 HydrophobicContact CB-CZ 3.49Å; N228-F230 VanDerWaalsContact CB-CZ 3.49Å; N228-S252 PolarHBondContact N-OG 2.95Å; N228-S252 CarbonylContact O-C 3.55Å; N228-S252 VanDerWaalsContact O-CA 3.24Å; N228-S252 WeakPolarHBondContact O-CA 3.24Å
229	V	95.7	Very high	95.1	Very high	73 Å²	73	37.2 Å²	37.2	44%	0.442	20%	0.2	S	C	.	.			trans	-135.5	73.3	-176	-168.9	0	0	0	0	110.3	L208 R209 P231	L208-V229 CarbonylContact O-C 3.58Å; L208-V229 WeakPolarHBondContact O-CA 3.32Å; L208-V229 PolarHBondContact O-N 3.08Å; R209-V229 WeakPolarHBondContact CA-O 3.21Å; V229-P231 VanDerWaalsContact O-CD 3.24Å; V229-P231 WeakPolarHBondContact O-CD 3.38Å
230	F	94.9	Very high	94.8	Very high	2 Å²	2	37.7 Å²	37.7	1%	0.009	21%	0.205	C	C	.	.			trans	-106	91.1	-178.7	-52	-50.9	0	0	0	110.5	L208 E210 F211 I225 N228 E232 I249 S252 I254	L208-F230 HydrophobicContact CB-CE1 3.73Å; L208-F230 HydrophobicContact CB-CZ 3.9Å; L208-F230 HydrophobicContact CD1-CZ 4.43Å; E210-F230 WeakPolarHBondContact O-CE1 3.2Å; F211-F230 HydrophobicContact CD2-CB 4.32Å; F211-F230 AromaticContact CD2-CD1 3.85Å; F211-F230 HydrophobicContact CD2-CD1 3.85Å; F211-F230 HydrophobicContact CD2-CD2 4.27Å; F211-F230 HydrophobicContact CD2-CE1 4.18Å; F211-F230 AromaticContact CD2-CG 3.9Å; F211-F230 HydrophobicContact CD2-CG 3.9Å; F211-F230 HydrophobicContact CE1-CD2 4.39Å; F211-F230 HydrophobicContact CE1-CE2 4.15Å; F211-F230 HydrophobicContact CE1-CZ 4.49Å; F211-F230 HydrophobicContact CE2-CB 3.66Å; F211-F230 AromaticContact CE2-CD1 3.8Å; F211-F230 HydrophobicContact CE2-CD1 3.8Å; F211-F230 AromaticContact CE2-CD2 3.43Å; F211-F230 HydrophobicContact CE2-CD2 3.43Å; F211-F230 VanDerWaalsContact CE2-CD2 3.43Å; F211-F230 HydrophobicContact CE2-CE1 4.27Å; F211-F230 AromaticContact CE2-CE2 3.94Å; F211-F230 HydrophobicContact CE2-CE2 3.94Å; F211-F230 AromaticContact CE2-CG 3.35Å; F211-F230 HydrophobicContact CE2-CG 3.35Å; F211-F230 HydrophobicContact CE2-CZ 4.33Å; F211-F230 HydrophobicContact CZ-CB 4.5Å; F211-F230 AromaticContact CZ-CD2 3.5Å; F211-F230 HydrophobicContact CZ-CD2 3.5Å; F211-F230 VanDerWaalsContact CZ-CD2 3.5Å; F211-F230 AromaticContact CZ-CE2 3.7Å; F211-F230 HydrophobicContact CZ-CE2 3.7Å; F211-F230 AromaticContact CZ-CG 3.94Å; F211-F230 HydrophobicContact CZ-CG 3.94Å; F211-F230 HydrophobicContact CZ-CZ 4.3Å; I225-F230 HydrophobicContact CD1-CE2 3.96Å; I225-F230 HydrophobicContact CD1-CZ 3.69Å; I225-F230 HydrophobicContact CG1-CE2 3.8Å; I225-F230 HydrophobicContact CG1-CZ 3.82Å; I225-F230 HydrophobicContact CG2-CE2 4.25Å; N228-F230 HydrophobicContact CB-CD2 4.09Å; N228-F230 HydrophobicContact CB-CE1 4.12Å; N228-F230 HydrophobicContact CB-CE2 3.47Å; N228-F230 VanDerWaalsContact CB-CE2 3.47Å; N228-F230 HydrophobicContact CB-CZ 3.49Å; N228-F230 VanDerWaalsContact CB-CZ 3.49Å; F230-E232 PolarHBondContact O-N 2.99Å; F230-I249 HydrophobicContact CD2-CG2 4.1Å; F230-I249 HydrophobicContact CE2-CG2 4.4Å; F230-S252 PolarHBondContact N-O 3.26Å; F230-I254 HydrophobicContact CB-CG1 4.48Å; F230-I254 WeakPolarHBondContact O-CA 3.38Å; F230-I254 WeakPolarHBondContact O-CG1 3.34Å
231	P	93.8	Very high	94.6	Very high	72 Å²	72	37.7 Å²	37.7	47%	0.468	21%	0.205	S	C	.	.	S	Bend	trans	-65.4	-27.5	-175.2	26.5	-35.3	0	0	0	113.4	V229 T255 I256	V229-P231 VanDerWaalsContact O-CD 3.24Å; V229-P231 WeakPolarHBondContact O-CD 3.38Å; P231-T255 PolarHBondContact O-N 2.97Å; P231-T255 PolarHBondContact O-OG1 3.07Å; P231-I256 PolarHBondContact O-N 2.96Å
232	E	94.6	Very high	94.4	Very high	68 Å²	68	41.3 Å²	41.3	32%	0.318	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	140.6	-176.9	-179.1	173.3	-124.1	0	0	110.4	F230 K234 I256 E258	F230-E232 PolarHBondContact O-N 2.99Å; E232-K234 VanDerWaalsContact CD-NZ 3.27Å; E232-K234 HydrophobicContact CG-CG 4.5Å; E232-K234 IonicContact OE1-NZ 2.72Å; E232-K234 WeakPolarHBondContact OE2-CE 3.14Å; E232-K234 IonicContact OE2-NZ 3.01Å; E232-K234 PolarHBondContact OE2-NZ 2.71Å; E232-I256 CarbonylContact C-O 3.47Å; E232-I256 WeakPolarHBondContact CA-O 3.27Å; E232-I256 HydrophobicContact CG-CB 4.41Å; E232-I256 HydrophobicContact CG-CG2 4.35Å; E232-E258 HydrophobicContact CG-CG 4Å
233	L	95.5	Very high	94.3	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.005	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	120	-179.9	-173.3	64.5	0	0	0	112	F211 A237 F238 I249 I254 I256 I257 E258 F262	F211-L233 HydrophobicContact CD2-CD1 3.97Å; F211-L233 HydrophobicContact CE1-CD1 4.19Å; F211-L233 HydrophobicContact CE2-CD1 3.26Å; F211-L233 HydrophobicContact CZ-CD1 3.4Å; F211-L233 VanDerWaalsContact CZ-CD1 3.4Å; L233-A237 HydrophobicContact CD1-CB 4.12Å; L233-F238 HydrophobicContact CD1-CE2 3.76Å; L233-F238 HydrophobicContact CD1-CZ 3.7Å; L233-F238 HydrophobicContact CD2-CE2 3.97Å; L233-F238 HydrophobicContact CD2-CZ 4.2Å; L233-F238 HydrophobicContact CG-CE2 4.08Å; L233-F238 HydrophobicContact CG-CZ 4.41Å; L233-I249 HydrophobicContact CD2-CD1 4.31Å; L233-I254 HydrophobicContact CB-CG2 4.49Å; L233-I256 PolarHBondContact N-O 2.84Å; L233-I257 HydrophobicContact CB-CB 4.45Å; L233-I257 HydrophobicContact CB-CG1 4.05Å; L233-I257 HydrophobicContact CB-CG2 4.4Å; L233-I257 HydrophobicContact CD2-CD1 4.2Å; L233-I257 HydrophobicContact CD2-CG1 4.1Å; L233-I257 HydrophobicContact CD2-CG2 4.24Å; L233-E258 WeakPolarHBondContact O-CB 3.32Å; L233-E258 WeakPolarHBondContact O-CG 3.31Å; L233-E258 PolarHBondContact O-N 2.79Å; L233-F262 HydrophobicContact CD2-CE1 3.62Å; L233-F262 HydrophobicContact CD2-CZ 3.69Å
234	K	94	Very high	94.3	Very high	92 Å²	92	43.2 Å²	43.2	40%	0.4	23%	0.231	S	C	.	.			trans	-107.9	152.1	-169.6	-45.7	-160.2	159.3	-83.5	0	112.4	E232 G236 A237 E258	E232-K234 VanDerWaalsContact CD-NZ 3.27Å; E232-K234 HydrophobicContact CG-CG 4.5Å; E232-K234 IonicContact OE1-NZ 2.72Å; E232-K234 WeakPolarHBondContact OE2-CE 3.14Å; E232-K234 IonicContact OE2-NZ 3.01Å; E232-K234 PolarHBondContact OE2-NZ 2.71Å; K234-G236 PolarHBondContact O-N 2.97Å; K234-G236 VanDerWaalsContact O-N 3.11Å; K234-A237 VanDerWaalsContact O-CB 3.27Å; K234-A237 WeakPolarHBondContact O-CB 3.5Å; K234-A237 PolarHBondContact O-N 2.71Å; K234-E258 WeakPolarHBondContact CA-OE2 3.45Å; K234-E258 WeakPolarHBondContact CB-OE2 3.43Å; K234-E258 WeakPolarHBondContact CD-OE2 3.42Å; K234-E258 WeakPolarHBondContact CG-OE2 3.26Å; K234-E258 IonicContact NZ-OE1 3.16Å; K234-E258 PolarHBondContact NZ-OE1 2.97Å; K234-E258 IonicContact NZ-OE2 2.78Å; K234-E258 PolarHBondContact NZ-OE2 2.73Å
235	P	89.8	Confident	94.3	Very high	17 Å²	17	47.1 Å²	47.1	11%	0.11	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-61.1	-24.2	179.8	-22.5	34.2	0	0	0	114.9	A237 R259	P235-A237 PolarHBondContact O-N 3.02Å; P235-R259 VanDerWaalsContact CG-O 3.28Å; P235-R259 WeakPolarHBondContact CG-O 3.41Å
236	G	86.1	Confident	94.3	Very high	55 Å²	55	50 Å²	50	57%	0.567	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-66.5	-21.7	174.9	0	0	0	0	0	114.5	K234 F238 R239	K234-G236 PolarHBondContact O-N 2.97Å; K234-G236 VanDerWaalsContact O-N 3.11Å; G236-F238 VanDerWaalsContact C-N 3.31Å; G236-F238 PolarHBondContact O-N 3.41Å; G236-R239 WeakPolarHBondContact O-CB 3.19Å; G236-R239 PolarHBondContact O-N 3.44Å
237	A	92.1	Very high	94.3	Very high	13 Å²	13	49.5 Å²	49.5	11%	0.107	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-64.4	-29.8	-169.6	0	0	0	0	0	114.3	F211 L233 K234 P235	F211-A237 HydrophobicContact CB-CB 4.05Å; F211-A237 HydrophobicContact CD1-CB 3.96Å; F211-A237 HydrophobicContact CD2-CB 4.27Å; F211-A237 HydrophobicContact CG-CB 3.82Å; L233-A237 HydrophobicContact CD1-CB 4.12Å; K234-A237 VanDerWaalsContact O-CB 3.27Å; K234-A237 WeakPolarHBondContact O-CB 3.5Å; K234-A237 PolarHBondContact O-N 2.71Å; P235-A237 PolarHBondContact O-N 3.02Å
238	F	93.3	Very high	94.4	Very high	2 Å²	2	49 Å²	49	1%	0.009	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-114.9	17	-179	-47.7	-68.3	0	0	0	113.1	F211 L223 L233 G236 G240 L241 L247 I249 F262 I265	F211-F238 AromaticContact CE1-CE1 3.98Å; F211-F238 HydrophobicContact CE1-CE1 3.98Å; F211-F238 HydrophobicContact CE1-CZ 4.08Å; F211-F238 HydrophobicContact CZ-CZ 4.33Å; L223-F238 HydrophobicContact CD2-CE1 4.46Å; L233-F238 HydrophobicContact CD1-CE2 3.76Å; L233-F238 HydrophobicContact CD1-CZ 3.7Å; L233-F238 HydrophobicContact CD2-CE2 3.97Å; L233-F238 HydrophobicContact CD2-CZ 4.2Å; L233-F238 HydrophobicContact CG-CE2 4.08Å; L233-F238 HydrophobicContact CG-CZ 4.41Å; G236-F238 VanDerWaalsContact C-N 3.31Å; G236-F238 PolarHBondContact O-N 3.41Å; F238-G240 PolarHBondContact O-N 3.08Å; F238-L241 HydrophobicContact CB-CD1 4.16Å; F238-L241 HydrophobicContact CD1-CD1 4.27Å; F238-L241 WeakPolarHBondContact O-CB 3.4Å; F238-L241 WeakPolarHBondContact O-CG 3.33Å; F238-L241 PolarHBondContact O-N 3.1Å; F238-L247 HydrophobicContact CD1-CD2 4.24Å; F238-L247 HydrophobicContact CE1-CD1 3.8Å; F238-L247 HydrophobicContact CE1-CD2 3.77Å; F238-L247 HydrophobicContact CE1-CG 4.44Å; F238-L247 HydrophobicContact CE2-CD2 4.22Å; F238-L247 HydrophobicContact CZ-CD1 4.35Å; F238-L247 HydrophobicContact CZ-CD2 3.76Å; F238-I249 HydrophobicContact CE1-CD1 4.36Å; F238-I249 HydrophobicContact CZ-CD1 3.76Å; F238-F262 HydrophobicContact CD2-CD1 4.06Å; F238-F262 HydrophobicContact CD2-CE1 4.34Å; F238-F262 AromaticContact CE2-CD1 3.82Å; F238-F262 HydrophobicContact CE2-CD1 3.82Å; F238-F262 AromaticContact CE2-CE1 3.63Å; F238-F262 HydrophobicContact CE2-CE1 3.63Å; F238-F262 HydrophobicContact CZ-CE1 4.26Å; F238-I265 HydrophobicContact CB-CG2 3.56Å; F238-I265 HydrophobicContact CD2-CD1 4.44Å; F238-I265 HydrophobicContact CG-CG2 4.3Å
239	R	91.8	Very high	94.4	Very high	142 Å²	142	48.8 Å²	48.8	54%	0.536	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	122.5	-169.1	-175.7	175.6	171.9	-171.6	-6.6	111.8	G236 D264	G236-R239 WeakPolarHBondContact O-CB 3.19Å; G236-R239 PolarHBondContact O-N 3.44Å; R239-D264 VanDerWaalsContact CA-OD2 3.32Å; R239-D264 WeakPolarHBondContact CA-OD2 3.24Å
240	G	88.8	Confident	94.5	Very high	20 Å²	20	48 Å²	48	21%	0.206	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.8	-4.3	-178.9	0	0	0	0	0	116	F238 K242 D264	F238-G240 PolarHBondContact O-N 3.08Å; G240-K242 PolarHBondContact O-N 2.96Å; G240-D264 PolarHBondContact N-OD2 2.91Å
241	L	94.8	Very high	94.6	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.005	26%	0.259	C	S	.	.			trans	-76.8	47.3	180	-59.7	-177.7	0	0	0	113.1	L214 L217 L220 L223 F238 N243 L244 I265	L214-L241 HydrophobicContact CB-CD1 4.1Å; L214-L241 HydrophobicContact CB-CD2 4.27Å; L214-L241 HydrophobicContact CD1-CD1 4.17Å; L217-L241 HydrophobicContact CB-CD2 4.12Å; L220-L241 HydrophobicContact CB-CD2 4.33Å; L220-L241 HydrophobicContact CD2-CD1 4.42Å; L220-L241 HydrophobicContact CD2-CD2 4.26Å; L223-L241 HydrophobicContact CD2-CD1 4.48Å; F238-L241 HydrophobicContact CB-CD1 4.16Å; F238-L241 HydrophobicContact CD1-CD1 4.27Å; F238-L241 WeakPolarHBondContact O-CB 3.4Å; F238-L241 WeakPolarHBondContact O-CG 3.33Å; F238-L241 PolarHBondContact O-N 3.1Å; L241-N243 PolarHBondContact O-N 3.24Å; L241-L244 HydrophobicContact CB-CB 4.21Å; L241-L244 HydrophobicContact CD1-CD2 4.46Å; L241-L244 WeakPolarHBondContact O-CB 3.47Å; L241-L244 PolarHBondContact O-N 2.89Å; L241-I265 HydrophobicContact CB-CG2 4.05Å
242	K	93.4	Very high	94.8	Very high	128 Å²	128	48.3 Å²	48.3	56%	0.557	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-16.3	-171	-62.9	-172.2	176.1	-170.7	0	115.1	G240 A267	G240-K242 PolarHBondContact O-N 2.96Å; K242-A267 WeakPolarHBondContact O-CB 3.3Å
243	N	96.4	Very high	94.9	Very high	84 Å²	84	47.4 Å²	47.4	45%	0.449	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	0.4	176.6	-68.9	-58.6	0	0	0	113.2	L218 L220 L241 R245	L218-N243 PolarHBondContact O-ND2 2.84Å; L220-N243 CarbonylContact O-C 3.58Å; L220-N243 WeakPolarHBondContact O-CB 3.13Å; L220-N243 VanDerWaalsContact O-O 3.14Å; L241-N243 PolarHBondContact O-N 3.24Å; N243-R245 WeakPolarHBondContact O-CG 3.48Å; N243-R245 PolarHBondContact O-N 3.47Å
244	L	97.9	Very high	94.9	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.241	C	C	.	.			trans	-68.6	122.8	-175.4	-168.1	71.4	0	0	0	110.8	L220 L223 L241 K246 L247 I265 A267 L268	L220-L244 HydrophobicContact CD2-CD1 4.14Å; L220-L244 HydrophobicContact CG-CD1 4.16Å; L220-L244 WeakPolarHBondContact O-CA 3.44Å; L220-L244 PolarHBondContact O-N 2.92Å; L220-L244 VanDerWaalsContact O-N 3.16Å; L223-L244 HydrophobicContact CB-CD1 3.75Å; L241-L244 HydrophobicContact CB-CB 4.21Å; L241-L244 HydrophobicContact CD1-CD2 4.46Å; L241-L244 WeakPolarHBondContact O-CB 3.47Å; L241-L244 PolarHBondContact O-N 2.89Å; L244-K246 WeakPolarHBondContact CD1-O 3.33Å; L244-L247 HydrophobicContact CD2-CB 4.09Å; L244-L247 HydrophobicContact CD2-CD1 4.29Å; L244-L247 HydrophobicContact CD2-CD2 4.25Å; L244-L247 HydrophobicContact CD2-CG 4.45Å; L244-I265 HydrophobicContact CB-CG2 4.23Å; L244-I265 HydrophobicContact CD2-CD1 4.47Å; L244-I265 HydrophobicContact CD2-CG2 4.02Å; L244-A267 CarbonylContact O-C 3.57Å; L244-L268 HydrophobicContact CD2-CD1 4.36Å; L244-L268 HydrophobicContact CG-CD1 4.23Å; L244-L268 VanDerWaalsContact O-CA 3.31Å; L244-L268 WeakPolarHBondContact O-CA 3.09Å; L244-L268 PolarHBondContact O-N 3.28Å; L244-L268 VanDerWaalsContact O-N 3.17Å
245	R	98.1	Very high	95.1	Very high	121 Å²	121	45.7 Å²	45.7	46%	0.457	24%	0.238	S	C	.	.			trans	-111.1	-29.9	-176.1	-68.8	170.6	64.8	-141.4	-5.7	112.5	E221 N243 V269 E270	E221-R245 WeakPolarHBondContact O-CA 3.38Å; E221-R245 PolarHBondContact O-N 2.58Å; E221-R245 IonicContact OE2-CZ 3.57Å; E221-R245 IonicContact OE2-NH1 3.94Å; E221-R245 PolarHBondContact OE2-NH1 2.86Å; N243-R245 WeakPolarHBondContact O-CG 3.48Å; N243-R245 PolarHBondContact O-N 3.47Å; R245-V269 HydrophobicContact CB-CG2 4.21Å; R245-V269 HydrophobicContact CG-CG2 4.35Å; R245-V269 WeakPolarHBondContact O-CA 3.03Å; R245-V269 WeakPolarHBondContact O-CB 3Å; R245-V269 PolarHBondContact O-N 2.94Å; R245-E270 PolarHBondContact O-N 3.44Å
246	K	98.5	Very high	95.4	Very high	60 Å²	60	48.6 Å²	48.6	26%	0.261	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	134.1	173.2	-54.8	-172.7	179.4	159.6	0	111.5	E221 E222 L223 L244 W248 E270	E221-K246 PolarHBondContact O-N 2.85Å; E222-K246 HydrophobicContact CB-CB 4.5Å; E222-K246 HydrophobicContact CG-CB 4.3Å; E222-K246 HydrophobicContact CG-CD 4.04Å; E222-K246 HydrophobicContact CG-CG 4.21Å; E222-K246 WeakPolarHBondContact OE1-CD 3.34Å; E222-K246 WeakPolarHBondContact OE1-CE 3.3Å; E222-K246 IonicContact OE1-NZ 3.65Å; E222-K246 PolarHBondContact OE1-NZ 3.4Å; L223-K246 PolarHBondContact N-O 2.97Å; L244-K246 WeakPolarHBondContact CD1-O 3.33Å; K246-W248 HydrophobicContact CD-CZ2 4.16Å; K246-E270 WeakPolarHBondContact CA-O 3.44Å; K246-E270 HydrophobicContact CB-CB 4.36Å; K246-E270 WeakPolarHBondContact CD-OE2 3.43Å; K246-E270 WeakPolarHBondContact CE-OE2 3.09Å; K246-E270 HydrophobicContact CG-CB 4Å; K246-E270 WeakPolarHBondContact CG-OE2 3.37Å
247	L	98.3	Very high	95.9	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	111.9	177.1	178.3	52.7	0	0	0	110.2	L223 F238 L244 I249 F262 I265 L268 E270 L271 N272	L223-L247 HydrophobicContact CB-CD1 4.25Å; L223-L247 HydrophobicContact CD2-CD1 3.95Å; L223-L247 HydrophobicContact CG-CD1 4.18Å; F238-L247 HydrophobicContact CD1-CD2 4.24Å; F238-L247 HydrophobicContact CE1-CD1 3.8Å; F238-L247 HydrophobicContact CE1-CD2 3.77Å; F238-L247 HydrophobicContact CE1-CG 4.44Å; F238-L247 HydrophobicContact CE2-CD2 4.22Å; F238-L247 HydrophobicContact CZ-CD1 4.35Å; F238-L247 HydrophobicContact CZ-CD2 3.76Å; L244-L247 HydrophobicContact CD2-CB 4.09Å; L244-L247 HydrophobicContact CD2-CD1 4.29Å; L244-L247 HydrophobicContact CD2-CD2 4.25Å; L244-L247 HydrophobicContact CD2-CG 4.45Å; L247-I249 HydrophobicContact CD1-CD1 3.87Å; L247-I249 HydrophobicContact CD1-CG1 3.73Å; L247-I249 HydrophobicContact CD2-CD1 4.11Å; L247-I249 HydrophobicContact CG-CD1 3.92Å; L247-I249 HydrophobicContact CG-CG1 3.9Å; L247-F262 HydrophobicContact CD2-CD1 4.48Å; L247-F262 HydrophobicContact CD2-CE1 4.13Å; L247-I265 HydrophobicContact CD2-CD1 3.61Å; L247-L268 HydrophobicContact CB-CD1 3.73Å; L247-L268 HydrophobicContact CB-CD2 4.45Å; L247-E270 PolarHBondContact N-O 3.33Å; L247-L271 HydrophobicContact CB-CD1 4.09Å; L247-L271 HydrophobicContact CD2-CD1 4.03Å; L247-L271 HydrophobicContact CG-CD1 4.01Å; L247-N272 PolarHBondContact O-N 3.48Å
248	W	98.4	Very high	96.1	Very high	73 Å²	73	46.1 Å²	46.1	28%	0.277	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	116.9	178.4	-62.6	-23.7	0	0	0	110.7	L223 E224 I225 S226 K246 E270 N272	L223-W248 PolarHBondContact O-N 2.78Å; E224-W248 HydrophobicContact CB-CE3 4.17Å; E224-W248 HydrophobicContact CG-CE3 4.42Å; E224-W248 WeakPolarHBondContact OE1-CB 3.44Å; I225-W248 PolarHBondContact N-O 2.72Å; S226-W248 PolarHBondContact N-O 3.37Å; S226-W248 PolarHBondContact OG-O 3.18Å; K246-W248 HydrophobicContact CD-CZ2 4.16Å; W248-E270 WeakPolarHBondContact CZ2-OE1 3.49Å; W248-E270 PolarHBondContact NE1-OE1 3.42Å; W248-N272 HydrophobicContact CB-CB 4.48Å; W248-N272 HydrophobicContact CG-CB 4.29Å
249	I	97	Very high	96.2	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.225	C	C	.	.			trans	-137	45.8	178.6	-28.4	175.5	0	0	0	109.6	F211 I225 F230 L233 F238 L247 I254 N272 L273 N276	F211-I249 HydrophobicContact CZ-CD1 4.36Å; F211-I249 HydrophobicContact CZ-CG2 4.45Å; I225-I249 HydrophobicContact CG2-CB 4.46Å; I225-I249 HydrophobicContact CG2-CG1 4.06Å; I225-I249 HydrophobicContact CG2-CG2 4.02Å; F230-I249 HydrophobicContact CD2-CG2 4.1Å; F230-I249 HydrophobicContact CE2-CG2 4.4Å; L233-I249 HydrophobicContact CD2-CD1 4.31Å; F238-I249 HydrophobicContact CE1-CD1 4.36Å; F238-I249 HydrophobicContact CZ-CD1 3.76Å; L247-I249 HydrophobicContact CD1-CD1 3.87Å; L247-I249 HydrophobicContact CD1-CG1 3.73Å; L247-I249 HydrophobicContact CD2-CD1 4.11Å; L247-I249 HydrophobicContact CG-CD1 3.92Å; L247-I249 HydrophobicContact CG-CG1 3.9Å; I249-I254 HydrophobicContact CB-CD1 4.26Å; I249-I254 HydrophobicContact CG2-CD1 3.84Å; I249-N272 CarbonylContact C-O 3.19Å; I249-N272 PolarHBondContact N-O 2.86Å; I249-L273 HydrophobicContact CB-CD2 4.29Å; I249-L273 HydrophobicContact CD1-CD2 4.19Å; I249-L273 HydrophobicContact CG1-CD2 4.46Å; I249-N276 PolarHBondContact O-ND2 2.91Å
250	M	96.8	Very high	96.4	Very high	57 Å²	57	40.9 Å²	40.9	28%	0.281	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	144.2	178.9	170	163.2	138.8	0	0	111	S226 E227 S252 A274 H275	S226-M250 CarbonylContact C-O 3.39Å; S226-M250 VanDerWaalsContact CA-O 3.23Å; S226-M250 WeakPolarHBondContact CA-O 3.3Å; S226-M250 WeakPolarHBondContact CB-O 3.3Å; S226-M250 PolarHBondContact OG-N 3.04Å; E227-M250 PolarHBondContact N-O 3.13Å; M250-S252 PolarHBondContact O-N 2.97Å; M250-S252 VanDerWaalsContact O-N 3.16Å; M250-S252 PolarHBondContact O-OG 3.18Å; M250-A274 CarbonylContact C-O 3.49Å; M250-A274 VanDerWaalsContact CA-O 3.28Å; M250-A274 WeakPolarHBondContact CA-O 3.47Å; M250-A274 HydrophobicContact CG-CB 4.14Å; M250-A274 WeakPolarHBondContact CG-O 3.49Å; M250-A274 HydrophobicContact SD-CB 3.96Å; M250-H275 VanDerWaalsContact CE-ND1 3.35Å; M250-H275 WeakPolarHBondContact CE-ND1 3.49Å; M250-H275 HydrophobicContact CG-CB 4.23Å; M250-H275 PolarHBondContact SD-ND1 2.99Å
251	N	97.2	Very high	96.8	Very high	80 Å²	80	40.1 Å²	40.1	43%	0.428	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	55	34.8	172.9	-168.8	43.7	0	0	0	113.9	E227 A274 H275	E227-N251 HydrophobicContact CG-CB 4.15Å; N251-A274 PolarHBondContact N-O 3.22Å; N251-H275 WeakPolarHBondContact CA-O 3.39Å; N251-H275 HydrophobicContact CB-CB 4.08Å
252	S	97.4	Very high	96.9	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.197	C	C	.	.	S	Bend	trans	-103.3	21.4	-178.6	-66.6	0	0	0	0	113.7	I225 E227 N228 F230 M250 I254 N276	I225-S252 PolarHBondContact O-OG 3.37Å; E227-S252 PolarHBondContact N-OG 3.14Å; N228-S252 PolarHBondContact N-OG 2.95Å; N228-S252 CarbonylContact O-C 3.55Å; N228-S252 VanDerWaalsContact O-CA 3.24Å; N228-S252 WeakPolarHBondContact O-CA 3.24Å; F230-S252 PolarHBondContact N-O 3.26Å; M250-S252 PolarHBondContact O-N 2.97Å; M250-S252 VanDerWaalsContact O-N 3.16Å; M250-S252 PolarHBondContact O-OG 3.18Å; S252-I254 PolarHBondContact O-N 2.82Å; S252-N276 WeakPolarHBondContact CA-OD1 3.41Å; S252-N276 PolarHBondContact N-OD1 2.76Å
253	A	96.6	Very high	96.9	Very high	49 Å²	49	35.6 Å²	35.6	41%	0.405	18%	0.179	S	C	.	.			trans	57.1	23.3	178.2	0	0	0	0	0	116.5	T255 N276	A253-T255 PolarHBondContact O-N 2.9Å; A253-N276 PolarHBondContact N-OD1 3.28Å; A253-N276 VanDerWaalsContact N-OD1 3.13Å
254	I	97.2	Very high	96.7	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.17	C	C	.	.			trans	-64	126.3	-177.7	-48.8	168.5	0	0	0	110.8	F230 L233 I249 S252 I256 I257 L273 N276 N277 L278	F230-I254 HydrophobicContact CB-CG1 4.48Å; F230-I254 WeakPolarHBondContact O-CA 3.38Å; F230-I254 WeakPolarHBondContact O-CG1 3.34Å; L233-I254 HydrophobicContact CB-CG2 4.49Å; I249-I254 HydrophobicContact CB-CD1 4.26Å; I249-I254 HydrophobicContact CG2-CD1 3.84Å; S252-I254 PolarHBondContact O-N 2.82Å; I254-I256 WeakPolarHBondContact CG2-O 3.49Å; I254-I257 HydrophobicContact CG2-CG1 3.96Å; I254-L273 HydrophobicContact CD1-CD2 4.14Å; I254-N276 HydrophobicContact CB-CB 4.12Å; I254-N276 WeakPolarHBondContact CG1-OD1 3.37Å; I254-N276 PolarHBondContact N-OD1 3.08Å; I254-N277 CarbonylContact O-C 3.21Å; I254-N277 VanDerWaalsContact O-C 3.27Å; I254-N277 VanDerWaalsContact O-CA 3.32Å; I254-N277 WeakPolarHBondContact O-CA 3.49Å; I254-N277 PolarHBondContact O-N 3.05Å; I254-L278 HydrophobicContact CB-CD2 4.19Å; I254-L278 HydrophobicContact CG2-CD2 3.73Å; I254-L278 PolarHBondContact O-N 3.22Å
255	T	96.6	Very high	96.6	Very high	57 Å²	57	33.9 Å²	33.9	35%	0.35	17%	0.17	S	C	.	.			trans	-105.3	-36.3	177	70.4	0	0	0	0	112.2	P231 A253 N277	P231-T255 PolarHBondContact O-N 2.97Å; P231-T255 PolarHBondContact O-OG1 3.07Å; A253-T255 PolarHBondContact O-N 2.9Å; T255-N277 HydrophobicContact CG2-CB 4.2Å
256	I	95.8	Very high	96.4	Very high	79 Å²	79	31.1 Å²	31.1	41%	0.405	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	137.2	-175.5	-64	173.3	0	0	0	108.9	P231 E232 L233 I254	P231-I256 PolarHBondContact O-N 2.96Å; E232-I256 CarbonylContact C-O 3.47Å; E232-I256 WeakPolarHBondContact CA-O 3.27Å; E232-I256 HydrophobicContact CG-CB 4.41Å; E232-I256 HydrophobicContact CG-CG2 4.35Å; L233-I256 PolarHBondContact N-O 2.84Å; I254-I256 WeakPolarHBondContact CG2-O 3.49Å
257	I	97.3	Very high	96.3	Very high	2 Å²	2	29.5 Å²	29.5	1%	0.01	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	124.4	163.1	-61.8	178.3	0	0	0	106	L233 I254 A261 F262 L273 L278 L281 P282 L285	L233-I257 HydrophobicContact CB-CB 4.45Å; L233-I257 HydrophobicContact CB-CG1 4.05Å; L233-I257 HydrophobicContact CB-CG2 4.4Å; L233-I257 HydrophobicContact CD2-CD1 4.2Å; L233-I257 HydrophobicContact CD2-CG1 4.1Å; L233-I257 HydrophobicContact CD2-CG2 4.24Å; I254-I257 HydrophobicContact CG2-CG1 3.96Å; I257-A261 HydrophobicContact CG2-CB 3.46Å; I257-A261 VanDerWaalsContact CG2-CB 3.46Å; I257-F262 HydrophobicContact CD1-CE2 4.33Å; I257-F262 HydrophobicContact CD1-CZ 4.18Å; I257-F262 HydrophobicContact CG2-CE2 4.39Å; I257-F262 HydrophobicContact CG2-CZ 4.5Å; I257-L273 HydrophobicContact CD1-CD1 3.82Å; I257-L273 HydrophobicContact CD1-CD2 4.39Å; I257-L278 HydrophobicContact CD1-CD1 4.12Å; I257-L278 HydrophobicContact CD1-CD2 4Å; I257-L278 HydrophobicContact CG1-CD2 3.9Å; I257-L281 HydrophobicContact CD1-CD2 3.86Å; I257-P282 WeakPolarHBondContact O-CD 3.45Å; I257-P282 WeakPolarHBondContact O-CG 3.46Å; I257-L285 HydrophobicContact CG2-CD1 4.39Å; I257-L285 HydrophobicContact CG2-CD2 3.99Å
258	E	96.8	Very high	96.3	Very high	14 Å²	14	29.5 Å²	29.5	7%	0.065	17%	0.165	C	C	.	.			trans	-70.1	163	-178.9	-59.9	-162.3	109.3	0	0	111.2	E232 L233 K234 N260 A261 H394 N405	E232-E258 HydrophobicContact CG-CG 4Å; L233-E258 WeakPolarHBondContact O-CB 3.32Å; L233-E258 WeakPolarHBondContact O-CG 3.31Å; L233-E258 PolarHBondContact O-N 2.79Å; K234-E258 WeakPolarHBondContact CA-OE2 3.45Å; K234-E258 WeakPolarHBondContact CB-OE2 3.43Å; K234-E258 WeakPolarHBondContact CD-OE2 3.42Å; K234-E258 WeakPolarHBondContact CG-OE2 3.26Å; K234-E258 IonicContact NZ-OE1 3.16Å; K234-E258 PolarHBondContact NZ-OE1 2.97Å; K234-E258 IonicContact NZ-OE2 2.78Å; K234-E258 PolarHBondContact NZ-OE2 2.73Å; E258-N260 PolarHBondContact O-N 3.1Å; E258-A261 WeakPolarHBondContact O-CB 3.37Å; E258-A261 PolarHBondContact O-N 3.27Å; E258-H394 IonicContact OE1-NE2 2.78Å; E258-H394 IonicContact OE2-NE2 2.65Å; E258-N405 VanDerWaalsContact CG-ND2 3.28Å; E258-N405 WeakPolarHBondContact CG-ND2 3.48Å; E258-N405 WeakPolarHBondContact OE1-CB 3.49Å; E258-N405 VanDerWaalsContact OE1-CG 3.28Å; E258-N405 PolarHBondContact OE1-ND2 3.38Å
259	R	96.1	Very high	96.2	Very high	9 Å²	9	28.2 Å²	28.2	3%	0.034	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	142.9	175.8	-66.4	178.6	-175	86	-15.9	110.1	P235 A261 P282 A377 A378 S380 H394 N405	P235-R259 VanDerWaalsContact CG-O 3.28Å; P235-R259 WeakPolarHBondContact CG-O 3.41Å; R259-A261 PolarHBondContact O-N 3.26Å; R259-A261 VanDerWaalsContact O-N 3.17Å; R259-P282 HydrophobicContact CG-CB 4.26Å; R259-A377 PolarHBondContact NH2-O 3.35Å; R259-A378 PolarHBondContact NE-O 2.93Å; R259-A378 PolarHBondContact NH2-O 2.88Å; R259-S380 PolarHBondContact NE-O 3.48Å; R259-H394 HydrophobicContact CB-CB 4.2Å; R259-H394 PolarHBondContact O-CD2 3.48Å; R259-H394 VanDerWaalsContact O-CD2 3.24Å; R259-N405 PolarHBondContact NH1-O 3.3Å; R259-N405 PolarHBondContact NH1-OD1 3.03Å
260	N	96.2	Very high	96.2	Very high	25 Å²	25	29.4 Å²	29.4	13%	0.134	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.3	16.9	175.6	-58	104.4	0	0	0	115.5	E258 F262 D263 H394 S395	E258-N260 PolarHBondContact O-N 3.1Å; N260-F262 PolarHBondContact O-N 2.85Å; N260-D263 VanDerWaalsContact CA-OD1 3.23Å; N260-D263 WeakPolarHBondContact CA-OD1 3.28Å; N260-D263 WeakPolarHBondContact CB-OD2 3.45Å; N260-D263 PolarHBondContact ND2-OD1 3.09Å; N260-D263 PolarHBondContact ND2-OD2 2.94Å; N260-D263 PolarHBondContact O-N 3.05Å; N260-H394 HydrophobicContact CB-CB 4.31Å; N260-H394 PolarHBondContact OD1-N 3.31Å; N260-S395 WeakPolarHBondContact CB-OG 3.39Å
261	A	96.6	Very high	96.2	Very high	3 Å²	3	26.7 Å²	26.7	3%	0.025	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-21.2	-172.7	0	0	0	0	0	115.5	I257 E258 R259 L285	I257-A261 HydrophobicContact CG2-CB 3.46Å; I257-A261 VanDerWaalsContact CG2-CB 3.46Å; E258-A261 WeakPolarHBondContact O-CB 3.37Å; E258-A261 PolarHBondContact O-N 3.27Å; R259-A261 PolarHBondContact O-N 3.26Å; R259-A261 VanDerWaalsContact O-N 3.17Å; A261-L285 HydrophobicContact CB-CD1 4.36Å
262	F	96.3	Very high	96.1	Very high	1 Å²	1	24.1 Å²	24.1	0%	0.004	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.5	6.8	-178.7	-57.6	-48.8	0	0	0	114.2	L233 F238 L247 I257 N260 D264 I265 L271 L273 L285 F286 L289	L233-F262 HydrophobicContact CD2-CE1 3.62Å; L233-F262 HydrophobicContact CD2-CZ 3.69Å; F238-F262 HydrophobicContact CD2-CD1 4.06Å; F238-F262 HydrophobicContact CD2-CE1 4.34Å; F238-F262 AromaticContact CE2-CD1 3.82Å; F238-F262 HydrophobicContact CE2-CD1 3.82Å; F238-F262 AromaticContact CE2-CE1 3.63Å; F238-F262 HydrophobicContact CE2-CE1 3.63Å; F238-F262 HydrophobicContact CZ-CE1 4.26Å; L247-F262 HydrophobicContact CD2-CD1 4.48Å; L247-F262 HydrophobicContact CD2-CE1 4.13Å; I257-F262 HydrophobicContact CD1-CE2 4.33Å; I257-F262 HydrophobicContact CD1-CZ 4.18Å; I257-F262 HydrophobicContact CG2-CE2 4.39Å; I257-F262 HydrophobicContact CG2-CZ 4.5Å; N260-F262 PolarHBondContact O-N 2.85Å; F262-D264 PolarHBondContact O-N 2.8Å; F262-D264 VanDerWaalsContact O-N 3.12Å; F262-I265 HydrophobicContact CB-CD1 4.06Å; F262-I265 HydrophobicContact CB-CG1 3.96Å; F262-I265 HydrophobicContact CD1-CD1 3.66Å; F262-I265 HydrophobicContact CD1-CG1 4.43Å; F262-I265 HydrophobicContact CE1-CD1 4.49Å; F262-I265 HydrophobicContact CG-CD1 4.19Å; F262-I265 WeakPolarHBondContact O-CG1 3.28Å; F262-I265 PolarHBondContact O-N 2.86Å; F262-L271 HydrophobicContact CD2-CD2 4.39Å; F262-L271 HydrophobicContact CE2-CD2 3.98Å; F262-L271 HydrophobicContact CZ-CD1 4.42Å; F262-L271 HydrophobicContact CZ-CD2 4.29Å; F262-L273 HydrophobicContact CE2-CD1 4.26Å; F262-L273 HydrophobicContact CZ-CD1 4.17Å; F262-L273 HydrophobicContact CZ-CD2 4.42Å; F262-L285 HydrophobicContact CD2-CD1 3.75Å; F262-L285 HydrophobicContact CD2-CD2 3.95Å; F262-L285 HydrophobicContact CD2-CG 3.76Å; F262-L285 HydrophobicContact CE2-CD1 4.38Å; F262-L285 HydrophobicContact CE2-CD2 3.87Å; F262-L285 HydrophobicContact CE2-CG 4.22Å; F262-L285 HydrophobicContact CG-CD1 4.39Å; F262-F286 HydrophobicContact CD2-CD1 4.42Å; F262-F286 HydrophobicContact CD2-CE1 4.15Å; F262-F286 HydrophobicContact CE2-CE1 4.11Å; F262-L289 HydrophobicContact CB-CD1 4.07Å; F262-L289 HydrophobicContact CB-CD2 4.28Å; F262-L289 WeakPolarHBondContact O-CD2 3.41Å
263	D	93.9	Very high	96.1	Very high	33 Å²	33	24.1 Å²	24.1	18%	0.176	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-30.7	-174.5	-76.2	21.7	0	0	0	114	N260 T266 S395	N260-D263 VanDerWaalsContact CA-OD1 3.23Å; N260-D263 WeakPolarHBondContact CA-OD1 3.28Å; N260-D263 WeakPolarHBondContact CB-OD2 3.45Å; N260-D263 PolarHBondContact ND2-OD1 3.09Å; N260-D263 PolarHBondContact ND2-OD2 2.94Å; N260-D263 PolarHBondContact O-N 3.05Å; D263-T266 VanDerWaalsContact O-CG2 3.29Å; D263-T266 WeakPolarHBondContact O-CG2 3.07Å; D263-S395 PolarHBondContact OD2-OG 2.68Å
264	D	92.1	Very high	96.1	Very high	48 Å²	48	21.8 Å²	21.8	26%	0.257	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-18.1	-175.2	-119.6	27.4	0	0	0	113.4	R239 G240 F262 T266	R239-D264 VanDerWaalsContact CA-OD2 3.32Å; R239-D264 WeakPolarHBondContact CA-OD2 3.24Å; G240-D264 PolarHBondContact N-OD2 2.91Å; F262-D264 PolarHBondContact O-N 2.8Å; F262-D264 VanDerWaalsContact O-N 3.12Å; D264-T266 PolarHBondContact O-N 3.32Å
265	I	95.4	Very high	96.1	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.139	C	C	.	.			trans	-98.9	48.8	-176.3	56.9	174.1	0	0	0	112.1	F238 L241 L244 L247 F262 A267 L268 L289	F238-I265 HydrophobicContact CB-CG2 3.56Å; F238-I265 HydrophobicContact CD2-CD1 4.44Å; F238-I265 HydrophobicContact CG-CG2 4.3Å; L241-I265 HydrophobicContact CB-CG2 4.05Å; L244-I265 HydrophobicContact CB-CG2 4.23Å; L244-I265 HydrophobicContact CD2-CD1 4.47Å; L244-I265 HydrophobicContact CD2-CG2 4.02Å; L247-I265 HydrophobicContact CD2-CD1 3.61Å; F262-I265 HydrophobicContact CB-CD1 4.06Å; F262-I265 HydrophobicContact CB-CG1 3.96Å; F262-I265 HydrophobicContact CD1-CD1 3.66Å; F262-I265 HydrophobicContact CD1-CG1 4.43Å; F262-I265 HydrophobicContact CE1-CD1 4.49Å; F262-I265 HydrophobicContact CG-CD1 4.19Å; F262-I265 WeakPolarHBondContact O-CG1 3.28Å; F262-I265 PolarHBondContact O-N 2.86Å; I265-A267 PolarHBondContact O-N 2.96Å; I265-L268 HydrophobicContact CD1-CD1 4.4Å; I265-L268 HydrophobicContact CD1-CD2 3.92Å; I265-L268 WeakPolarHBondContact O-CB 3.49Å; I265-L268 PolarHBondContact O-N 3.49Å; I265-L268 VanDerWaalsContact O-N 3.1Å; I265-L289 HydrophobicContact CG1-CD2 4.24Å; I265-L289 WeakPolarHBondContact O-CD2 3.41Å
266	T	94.2	Very high	96.1	Very high	64 Å²	64	22.7 Å²	22.7	39%	0.393	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-18.3	-172	56.9	0	0	0	0	115.5	D263 D264 L268 Y291	D263-T266 VanDerWaalsContact O-CG2 3.29Å; D263-T266 WeakPolarHBondContact O-CG2 3.07Å; D264-T266 PolarHBondContact O-N 3.32Å; T266-L268 VanDerWaalsContact C-N 3.31Å; T266-Y291 WeakPolarHBondContact O-CD2 3.21Å
267	A	96.9	Very high	96.2	Very high	26 Å²	26	23.2 Å²	23.2	22%	0.215	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	5	176.8	0	0	0	0	0	114.6	K242 L244 I265 V269	K242-A267 WeakPolarHBondContact O-CB 3.3Å; L244-A267 CarbonylContact O-C 3.57Å; I265-A267 PolarHBondContact O-N 2.96Å; A267-V269 PolarHBondContact O-N 3.35Å
268	L	97.6	Very high	96.2	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.127	C	C	.	.			trans	-65.4	131.2	-173.8	-160.5	73.4	0	0	0	112.2	L244 L247 I265 T266 L271 L289 Y291 L292	L244-L268 HydrophobicContact CD2-CD1 4.36Å; L244-L268 HydrophobicContact CG-CD1 4.23Å; L244-L268 VanDerWaalsContact O-CA 3.31Å; L244-L268 WeakPolarHBondContact O-CA 3.09Å; L244-L268 PolarHBondContact O-N 3.28Å; L244-L268 VanDerWaalsContact O-N 3.17Å; L247-L268 HydrophobicContact CB-CD1 3.73Å; L247-L268 HydrophobicContact CB-CD2 4.45Å; I265-L268 HydrophobicContact CD1-CD1 4.4Å; I265-L268 HydrophobicContact CD1-CD2 3.92Å; I265-L268 WeakPolarHBondContact O-CB 3.49Å; I265-L268 PolarHBondContact O-N 3.49Å; I265-L268 VanDerWaalsContact O-N 3.1Å; T266-L268 VanDerWaalsContact C-N 3.31Å; L268-L271 HydrophobicContact CD2-CB 3.83Å; L268-L271 HydrophobicContact CD2-CD1 4.18Å; L268-L271 HydrophobicContact CD2-CD2 4.26Å; L268-L271 HydrophobicContact CD2-CG 4.3Å; L268-L289 HydrophobicContact CB-CD2 4.38Å; L268-L289 HydrophobicContact CD2-CD1 4.29Å; L268-Y291 CarbonylContact O-C 3.46Å; L268-L292 HydrophobicContact CD2-CD1 4.41Å; L268-L292 WeakPolarHBondContact O-CA 3.39Å; L268-L292 PolarHBondContact O-N 2.75Å; L268-L292 VanDerWaalsContact O-N 3.1Å
269	V	96.5	Very high	96.1	Very high	45 Å²	45	24.8 Å²	24.8	27%	0.273	14%	0.14	S	C	.	.			trans	-111.4	-35.1	-178.9	-175.6	0	0	0	0	111.2	R245 A267 Y291 V293 E294	R245-V269 HydrophobicContact CB-CG2 4.21Å; R245-V269 HydrophobicContact CG-CG2 4.35Å; R245-V269 WeakPolarHBondContact O-CA 3.03Å; R245-V269 WeakPolarHBondContact O-CB 3Å; R245-V269 PolarHBondContact O-N 2.94Å; A267-V269 PolarHBondContact O-N 3.35Å; V269-Y291 WeakPolarHBondContact CA-O 3.34Å; V269-V293 HydrophobicContact CG1-CG2 3.77Å; V269-V293 PolarHBondContact O-N 2.95Å; V269-E294 PolarHBondContact O-N 3.06Å; V269-E294 VanDerWaalsContact O-N 3.11Å
270	E	96.1	Very high	96.1	Very high	26 Å²	26	25.3 Å²	25.3	12%	0.121	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	125.3	-174.7	-169.5	-173	153.6	0	0	110.8	R245 K246 L247 W248 E294	R245-E270 PolarHBondContact O-N 3.44Å; K246-E270 WeakPolarHBondContact CA-O 3.44Å; K246-E270 HydrophobicContact CB-CB 4.36Å; K246-E270 WeakPolarHBondContact CD-OE2 3.43Å; K246-E270 WeakPolarHBondContact CE-OE2 3.09Å; K246-E270 HydrophobicContact CG-CB 4Å; K246-E270 WeakPolarHBondContact CG-OE2 3.37Å; L247-E270 PolarHBondContact N-O 3.33Å; W248-E270 WeakPolarHBondContact CZ2-OE1 3.49Å; W248-E270 PolarHBondContact NE1-OE1 3.42Å; E270-E294 VanDerWaalsContact CA-O 3.31Å; E270-E294 WeakPolarHBondContact CA-O 3.06Å; E270-E294 HydrophobicContact CB-CB 4.39Å; E270-E294 HydrophobicContact CG-CB 4.06Å; E270-E294 HydrophobicContact CG-CG 4.03Å
271	L	96.6	Very high	96.1	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	122.4	178.4	178.9	56.1	0	0	0	111.2	L247 F262 L268 L273 F286 L292 E294 L295 H296	L247-L271 HydrophobicContact CB-CD1 4.09Å; L247-L271 HydrophobicContact CD2-CD1 4.03Å; L247-L271 HydrophobicContact CG-CD1 4.01Å; F262-L271 HydrophobicContact CD2-CD2 4.39Å; F262-L271 HydrophobicContact CE2-CD2 3.98Å; F262-L271 HydrophobicContact CZ-CD1 4.42Å; F262-L271 HydrophobicContact CZ-CD2 4.29Å; L268-L271 HydrophobicContact CD2-CB 3.83Å; L268-L271 HydrophobicContact CD2-CD1 4.18Å; L268-L271 HydrophobicContact CD2-CD2 4.26Å; L268-L271 HydrophobicContact CD2-CG 4.3Å; L271-L273 HydrophobicContact CD1-CD1 4.41Å; L271-L273 HydrophobicContact CD1-CD2 4.25Å; L271-L273 HydrophobicContact CD1-CG 4.01Å; L271-L273 HydrophobicContact CD2-CD1 4.05Å; L271-L273 HydrophobicContact CD2-CG 4.45Å; L271-L273 HydrophobicContact CG-CD1 4.22Å; L271-L273 HydrophobicContact CG-CG 4.08Å; L271-F286 HydrophobicContact CD2-CE1 3.77Å; L271-F286 HydrophobicContact CD2-CZ 4.33Å; L271-L292 HydrophobicContact CB-CD1 3.81Å; L271-E294 PolarHBondContact N-O 2.91Å; L271-L295 HydrophobicContact CB-CD1 3.87Å; L271-L295 HydrophobicContact CD2-CD1 3.93Å; L271-L295 HydrophobicContact CG-CD1 3.95Å; L271-L295 WeakPolarHBondContact O-CA 3.46Å; L271-H296 PolarHBondContact O-N 2.89Å
272	N	96.7	Very high	96.1	Very high	25 Å²	25	24.2 Å²	24.2	13%	0.134	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	111.9	174.8	-171.9	-6	0	0	0	111.5	L247 W248 I249 A274 H296	L247-N272 PolarHBondContact O-N 3.48Å; W248-N272 HydrophobicContact CB-CB 4.48Å; W248-N272 HydrophobicContact CG-CB 4.29Å; I249-N272 CarbonylContact C-O 3.19Å; I249-N272 PolarHBondContact N-O 2.86Å; N272-A274 WeakPolarHBondContact OD1-CB 3.12Å; N272-A274 PolarHBondContact OD1-N 2.94Å; N272-H296 HydrophobicContact CB-CB 4.2Å; N272-H296 WeakPolarHBondContact OD1-CB 3.39Å
273	L	96.7	Very high	96.2	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.144	C	C	.	.			trans	-119	20.8	174.9	-63.1	172.6	0	0	0	111.2	I249 I254 I257 F262 L271 N276 L278 H296 L297 N300	I249-L273 HydrophobicContact CB-CD2 4.29Å; I249-L273 HydrophobicContact CD1-CD2 4.19Å; I249-L273 HydrophobicContact CG1-CD2 4.46Å; I254-L273 HydrophobicContact CD1-CD2 4.14Å; I257-L273 HydrophobicContact CD1-CD1 3.82Å; I257-L273 HydrophobicContact CD1-CD2 4.39Å; F262-L273 HydrophobicContact CE2-CD1 4.26Å; F262-L273 HydrophobicContact CZ-CD1 4.17Å; F262-L273 HydrophobicContact CZ-CD2 4.42Å; L271-L273 HydrophobicContact CD1-CD1 4.41Å; L271-L273 HydrophobicContact CD1-CD2 4.25Å; L271-L273 HydrophobicContact CD1-CG 4.01Å; L271-L273 HydrophobicContact CD2-CD1 4.05Å; L271-L273 HydrophobicContact CD2-CG 4.45Å; L271-L273 HydrophobicContact CG-CD1 4.22Å; L271-L273 HydrophobicContact CG-CG 4.08Å; L273-N276 VanDerWaalsContact C-ND2 3.34Å; L273-N276 PolarHBondContact O-ND2 3.39Å; L273-L278 HydrophobicContact CB-CD1 4.12Å; L273-L278 HydrophobicContact CD1-CD1 4.38Å; L273-H296 CarbonylContact C-O 3.51Å; L273-H296 PolarHBondContact N-O 2.89Å; L273-L297 HydrophobicContact CB-CD2 4.22Å; L273-L297 HydrophobicContact CD1-CD2 4.26Å; L273-N300 PolarHBondContact O-ND2 2.9Å
274	A	96.4	Very high	96.1	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	157.6	-177.2	0	0	0	0	0	113.5	M250 N251 N272 N276 H296 H298	M250-A274 CarbonylContact C-O 3.49Å; M250-A274 VanDerWaalsContact CA-O 3.28Å; M250-A274 WeakPolarHBondContact CA-O 3.47Å; M250-A274 HydrophobicContact CG-CB 4.14Å; M250-A274 WeakPolarHBondContact CG-O 3.49Å; M250-A274 HydrophobicContact SD-CB 3.96Å; N251-A274 PolarHBondContact N-O 3.22Å; N272-A274 WeakPolarHBondContact OD1-CB 3.12Å; N272-A274 PolarHBondContact OD1-N 2.94Å; A274-N276 PolarHBondContact O-N 3.49Å; A274-N276 VanDerWaalsContact O-N 3.1Å; A274-N276 PolarHBondContact O-ND2 3.23Å; A274-H296 HydrophobicContact CB-CB 4.42Å; A274-H296 PolarHBondContact N-O 2.92Å; A274-H298 VanDerWaalsContact CA-O 3.29Å; A274-H298 WeakPolarHBondContact CA-O 3.49Å; A274-H298 WeakPolarHBondContact CB-CE1 3.31Å; A274-H298 VanDerWaalsContact CB-ND1 3.32Å; A274-H298 WeakPolarHBondContact CB-ND1 3.45Å
275	H	96.6	Very high	96.4	Very high	68 Å²	68	23.6 Å²	23.6	32%	0.315	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	25	174.2	-54.5	96.9	0	0	0	114.6	M250 N251 H298 H299	M250-H275 VanDerWaalsContact CE-ND1 3.35Å; M250-H275 WeakPolarHBondContact CE-ND1 3.49Å; M250-H275 HydrophobicContact CG-CB 4.23Å; M250-H275 PolarHBondContact SD-ND1 2.99Å; N251-H275 WeakPolarHBondContact CA-O 3.39Å; N251-H275 HydrophobicContact CB-CB 4.08Å; H275-H298 AromaticContact CE1-CE1 3.64Å; H275-H298 AromaticContact CE1-ND1 3.97Å; H275-H298 PolarHBondContact N-O 3.27Å; H275-H299 WeakPolarHBondContact CA-O 3.33Å; H275-H299 HydrophobicContact CB-CB 4.44Å; H275-H299 WeakPolarHBondContact CD2-CB 3.45Å; H275-H299 AromaticContact CD2-CG 3.56Å; H275-H299 AromaticContact CD2-ND1 3.74Å; H275-H299 AromaticContact CE1-ND1 3.7Å; H275-H299 AromaticContact NE2-CE1 3.8Å; H275-H299 AromaticContact NE2-CG 3.45Å; H275-H299 AromaticContact NE2-ND1 3.12Å; H275-H299 PolarHBondContact NE2-ND1 2.97Å; H275-H299 VanDerWaalsContact NE2-ND1 3.12Å
276	N	97.8	Very high	96.4	Very high	9 Å²	9	23.6 Å²	23.6	5%	0.048	14%	0.135	C	C	.	.	S	Bend	trans	-94.7	-174.1	171.4	-73.5	-68.3	0	0	0	110.8	I249 S252 A253 I254 L273 A274 L278 N300	I249-N276 PolarHBondContact O-ND2 2.91Å; S252-N276 WeakPolarHBondContact CA-OD1 3.41Å; S252-N276 PolarHBondContact N-OD1 2.76Å; A253-N276 PolarHBondContact N-OD1 3.28Å; A253-N276 VanDerWaalsContact N-OD1 3.13Å; I254-N276 HydrophobicContact CB-CB 4.12Å; I254-N276 WeakPolarHBondContact CG1-OD1 3.37Å; I254-N276 PolarHBondContact N-OD1 3.08Å; L273-N276 VanDerWaalsContact C-ND2 3.34Å; L273-N276 PolarHBondContact O-ND2 3.39Å; A274-N276 PolarHBondContact O-N 3.49Å; A274-N276 VanDerWaalsContact O-N 3.1Å; A274-N276 PolarHBondContact O-ND2 3.23Å; N276-L278 HydrophobicContact CB-CD1 4.44Å; N276-L278 HydrophobicContact CB-CG 4.15Å; N276-N300 VanDerWaalsContact CA-OD1 3.3Å; N276-N300 WeakPolarHBondContact CA-OD1 3.42Å; N276-N300 WeakPolarHBondContact CB-OD1 3.44Å; N276-N300 PolarHBondContact N-OD1 3.04Å; N276-N300 PolarHBondContact O-OD1 3.06Å
277	N	97.3	Very high	96.3	Very high	90 Å²	90	24 Å²	24	48%	0.481	14%	0.138	S	C	.	.			trans	-106.7	27.8	-178.5	-163.5	37.5	0	0	0	111.9	I254 T255 S279 P301	I254-N277 CarbonylContact O-C 3.21Å; I254-N277 VanDerWaalsContact O-C 3.27Å; I254-N277 VanDerWaalsContact O-CA 3.32Å; I254-N277 WeakPolarHBondContact O-CA 3.49Å; I254-N277 PolarHBondContact O-N 3.05Å; T255-N277 HydrophobicContact CG2-CB 4.2Å; N277-S279 PolarHBondContact O-N 3.34Å; N277-P301 WeakPolarHBondContact OD1-CG 3.23Å
278	L	96.8	Very high	96.1	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.139	C	C	.	.			trans	-68.8	126.2	-175.9	-60.1	170.4	0	0	0	111.3	I254 I257 L273 N276 L281 N300 P301 W302	I254-L278 HydrophobicContact CB-CD2 4.19Å; I254-L278 HydrophobicContact CG2-CD2 3.73Å; I254-L278 PolarHBondContact O-N 3.22Å; I257-L278 HydrophobicContact CD1-CD1 4.12Å; I257-L278 HydrophobicContact CD1-CD2 4Å; I257-L278 HydrophobicContact CG1-CD2 3.9Å; L273-L278 HydrophobicContact CB-CD1 4.12Å; L273-L278 HydrophobicContact CD1-CD1 4.38Å; N276-L278 HydrophobicContact CB-CD1 4.44Å; N276-L278 HydrophobicContact CB-CG 4.15Å; L278-L281 HydrophobicContact CD1-CD2 4.37Å; L278-N300 HydrophobicContact CB-CB 4.19Å; L278-N300 VanDerWaalsContact CB-OD1 3.27Å; L278-N300 WeakPolarHBondContact CB-OD1 3.45Å; L278-N300 WeakPolarHBondContact CG-OD1 3.41Å; L278-N300 PolarHBondContact N-OD1 2.97Å; L278-N300 VanDerWaalsContact N-OD1 3.08Å; L278-P301 CarbonylContact O-C 3.19Å; L278-P301 VanDerWaalsContact O-CD 3.26Å; L278-P301 WeakPolarHBondContact O-CD 3.17Å; L278-W302 HydrophobicContact CB-CH2 3.63Å; L278-W302 HydrophobicContact CB-CZ2 4.23Å; L278-W302 HydrophobicContact CB-CZ3 3.85Å; L278-W302 HydrophobicContact CD1-CH2 3.95Å; L278-W302 HydrophobicContact CD1-CZ2 4.43Å; L278-W302 HydrophobicContact CG-CH2 4.44Å
279	S	96.1	Very high	96	Very high	48 Å²	48	24.7 Å²	24.7	34%	0.336	14%	0.14	S	C	.	.			trans	-97	-32.7	175.4	-65	0	0	0	0	113.2	N277 R303	N277-S279 PolarHBondContact O-N 3.34Å; S279-R303 WeakPolarHBondContact O-CB 3.42Å; S279-R303 PolarHBondContact O-N 3.38Å
280	S	95.7	Very high	95.8	Very high	20 Å²	20	30.2 Å²	30.2	14%	0.14	16%	0.163	C	C	.	.			trans	-157.8	173	176.5	-169	0	0	0	0	109.5
281	L	96.6	Very high	95.7	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.005	18%	0.184	C	C	.	.			trans	-127.9	140	177	-66.7	-179.6	0	0	0	110.5	I257 L278 H283 L285 F286 W302 W310 L311 M379	I257-L281 HydrophobicContact CD1-CD2 3.86Å; L278-L281 HydrophobicContact CD1-CD2 4.37Å; L281-H283 PolarHBondContact O-N 3.47Å; L281-L285 HydrophobicContact CB-CD2 4.23Å; L281-L285 HydrophobicContact CD1-CD2 4.41Å; L281-L285 HydrophobicContact CD2-CD2 4.07Å; L281-L285 HydrophobicContact CG-CD2 4.47Å; L281-F286 HydrophobicContact CD1-CE1 4.42Å; L281-F286 HydrophobicContact CD1-CE2 3.87Å; L281-F286 HydrophobicContact CD1-CZ 3.54Å; L281-W302 HydrophobicContact CD1-CH2 4.1Å; L281-W302 HydrophobicContact CD1-CZ3 4.5Å; L281-W302 HydrophobicContact CD2-CH2 4.16Å; L281-W302 HydrophobicContact CD2-CZ3 4.39Å; L281-W302 HydrophobicContact CG-CH2 3.85Å; L281-W302 HydrophobicContact CG-CZ3 3.88Å; L281-W310 HydrophobicContact CB-CZ2 3.93Å; L281-W310 PolarHBondContact O-NE1 3.37Å; L281-L311 HydrophobicContact CD1-CD1 4.44Å; L281-L311 HydrophobicContact CD1-CD2 4.1Å; L281-M379 VanDerWaalsContact C-SD 3.55Å
282	P	96.8	Very high	95.6	Very high	4 Å²	4	36.1 Å²	36.1	3%	0.026	19%	0.185	C	C	.	.			trans	-50.7	138.3	172.6	-28.7	34.2	0	0	0	113.6	I257 R259 N284 L285 W310 M379	I257-P282 WeakPolarHBondContact O-CD 3.45Å; I257-P282 WeakPolarHBondContact O-CG 3.46Å; R259-P282 HydrophobicContact CG-CB 4.26Å; P282-N284 PolarHBondContact O-N 2.86Å; P282-L285 WeakPolarHBondContact O-CB 3.42Å; P282-L285 PolarHBondContact O-N 3.34Å; P282-W310 WeakPolarHBondContact O-CZ2 3.49Å; P282-M379 HydrophobicContact CG-CE 4.32Å
283	H	96.6	Very high	95.4	Very high	22 Å²	22	38.9 Å²	38.9	10%	0.102	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51	135.3	177.6	-175.7	-122	0	0	0	111.6	L281 L285 W310 M379 S381 S427 N428 M429	L281-H283 PolarHBondContact O-N 3.47Å; H283-L285 PolarHBondContact O-N 3.2Å; H283-W310 AromaticContact CD2-CD1 3.82Å; H283-W310 AromaticContact CD2-CG 3.66Å; H283-M379 VanDerWaalsContact CB-O 3.24Å; H283-M379 WeakPolarHBondContact CB-O 3.48Å; H283-M379 PolarHBondContact N-O 2.86Å; H283-S381 PolarHBondContact ND1-OG 3.08Å; H283-S381 WeakPolarHBondContact O-CB 3.4Å; H283-S427 PolarHBondContact ND1-O 3.34Å; H283-S427 VanDerWaalsContact ND1-O 3.09Å; H283-N428 VanDerWaalsContact CE1-C 3.41Å; H283-N428 VanDerWaalsContact CE1-CA 3.46Å; H283-N428 WeakPolarHBondContact CE1-CA 3.26Å; H283-M429 PolarHBondContact NE2-N 2.93Å
284	N	93.8	Very high	95.2	Very high	44 Å²	44	43.1 Å²	43.1	24%	0.235	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.3	14.7	179.7	-69	-31.9	0	0	0	116.2	P282 F286 T287	P282-N284 PolarHBondContact O-N 2.86Å; N284-F286 PolarHBondContact O-N 2.79Å; N284-F286 VanDerWaalsContact O-N 3.08Å; N284-T287 WeakPolarHBondContact CA-OG1 3.4Å; N284-T287 VanDerWaalsContact CB-OG1 3.23Å; N284-T287 WeakPolarHBondContact CB-OG1 3.31Å; N284-T287 VanDerWaalsContact O-CB 3.29Å; N284-T287 WeakPolarHBondContact O-CB 3.42Å; N284-T287 PolarHBondContact O-N 2.94Å; N284-T287 PolarHBondContact O-OG1 2.89Å; N284-T287 PolarHBondContact OD1-OG1 2.9Å
285	L	96.6	Very high	95	Very high	3 Å²	3	43.3 Å²	43.3	2%	0.016	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-31.1	-179.3	178.2	66.5	0	0	0	114.4	I257 A261 F262 L281 P282 H283 W310	I257-L285 HydrophobicContact CG2-CD1 4.39Å; I257-L285 HydrophobicContact CG2-CD2 3.99Å; A261-L285 HydrophobicContact CB-CD1 4.36Å; F262-L285 HydrophobicContact CD2-CD1 3.75Å; F262-L285 HydrophobicContact CD2-CD2 3.95Å; F262-L285 HydrophobicContact CD2-CG 3.76Å; F262-L285 HydrophobicContact CE2-CD1 4.38Å; F262-L285 HydrophobicContact CE2-CD2 3.87Å; F262-L285 HydrophobicContact CE2-CG 4.22Å; F262-L285 HydrophobicContact CG-CD1 4.39Å; L281-L285 HydrophobicContact CB-CD2 4.23Å; L281-L285 HydrophobicContact CD1-CD2 4.41Å; L281-L285 HydrophobicContact CD2-CD2 4.07Å; L281-L285 HydrophobicContact CG-CD2 4.47Å; P282-L285 WeakPolarHBondContact O-CB 3.42Å; P282-L285 PolarHBondContact O-N 3.34Å; H283-L285 PolarHBondContact O-N 3.2Å; L285-W310 HydrophobicContact CB-CH2 4.09Å; L285-W310 HydrophobicContact CB-CZ2 4.32Å
286	F	95.6	Very high	94.9	Very high	1 Å²	1	42 Å²	42	0%	0.004	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-2.5	178.7	-56	-33.3	0	0	0	114.3	F262 L271 L281 N284 P288 L289 L292 L295 W310 L311 W314	F262-F286 HydrophobicContact CD2-CD1 4.42Å; F262-F286 HydrophobicContact CD2-CE1 4.15Å; F262-F286 HydrophobicContact CE2-CE1 4.11Å; L271-F286 HydrophobicContact CD2-CE1 3.77Å; L271-F286 HydrophobicContact CD2-CZ 4.33Å; L281-F286 HydrophobicContact CD1-CE1 4.42Å; L281-F286 HydrophobicContact CD1-CE2 3.87Å; L281-F286 HydrophobicContact CD1-CZ 3.54Å; N284-F286 PolarHBondContact O-N 2.79Å; N284-F286 VanDerWaalsContact O-N 3.08Å; F286-P288 VanDerWaalsContact C-CD 3.46Å; F286-L289 HydrophobicContact CD1-CD1 3.92Å; F286-L289 WeakPolarHBondContact O-CB 3.39Å; F286-L289 PolarHBondContact O-N 2.03Å; F286-L292 HydrophobicContact CB-CD2 4.48Å; F286-L292 HydrophobicContact CD1-CD2 4.32Å; F286-L292 HydrophobicContact CG-CD2 4.31Å; F286-L295 HydrophobicContact CD2-CD2 4.22Å; F286-L295 HydrophobicContact CE2-CD1 4.47Å; F286-L295 HydrophobicContact CE2-CD2 3.69Å; F286-L295 HydrophobicContact CZ-CD1 4.19Å; F286-L295 HydrophobicContact CZ-CD2 4.23Å; F286-W310 HydrophobicContact CB-CZ3 4.48Å; F286-W310 AromaticContact CD2-CH2 3.93Å; F286-W310 HydrophobicContact CD2-CH2 3.93Å; F286-W310 HydrophobicContact CD2-CZ3 4.26Å; F286-W310 HydrophobicContact CE2-CH2 4.4Å; F286-W310 HydrophobicContact CG-CH2 4.26Å; F286-L311 HydrophobicContact CD2-CD1 4.04Å; F286-L311 HydrophobicContact CE2-CD1 3.63Å; F286-W314 HydrophobicContact CB-CD2 4.18Å; F286-W314 HydrophobicContact CB-CH2 4.44Å; F286-W314 HydrophobicContact CB-CZ2 3.9Å; F286-W314 HydrophobicContact CD2-CD2 4.2Å; F286-W314 AromaticContact CD2-CE3 3.96Å; F286-W314 HydrophobicContact CD2-CE3 3.96Å; F286-W314 HydrophobicContact CD2-CH2 4.48Å; F286-W314 HydrophobicContact CD2-CZ3 4.12Å
287	T	92.1	Very high	94.8	Very high	73 Å²	73	41.5 Å²	41.5	45%	0.448	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-32.9	-178.9	-49	0	0	0	0	114.2	N284 L289	N284-T287 WeakPolarHBondContact CA-OG1 3.4Å; N284-T287 VanDerWaalsContact CB-OG1 3.23Å; N284-T287 WeakPolarHBondContact CB-OG1 3.31Å; N284-T287 VanDerWaalsContact O-CB 3.29Å; N284-T287 WeakPolarHBondContact O-CB 3.42Å; N284-T287 PolarHBondContact O-N 2.94Å; N284-T287 PolarHBondContact O-OG1 2.89Å; N284-T287 PolarHBondContact OD1-OG1 2.9Å; T287-L289 VanDerWaalsContact C-N 3.27Å; T287-L289 PolarHBondContact O-N 3.23Å
288	P	93.3	Very high	94.6	Very high	36 Å²	36	39.5 Å²	39.5	23%	0.234	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-18	172.7	-20	34	0	0	0	114.5	F286 Q290	F286-P288 VanDerWaalsContact C-CD 3.46Å; P288-Q290 PolarHBondContact O-N 2.96Å; P288-Q290 VanDerWaalsContact O-N 3.1Å
289	L	94.9	Very high	94.6	Very high	4 Å²	4	45.4 Å²	45.4	2%	0.021	23%	0.23	C	C	.	.			trans	-91.9	64.2	-166.3	-52.9	-178.4	0	0	0	111.3	F262 I265 L268 F286 T287 Y291 L292	F262-L289 HydrophobicContact CB-CD1 4.07Å; F262-L289 HydrophobicContact CB-CD2 4.28Å; F262-L289 WeakPolarHBondContact O-CD2 3.41Å; I265-L289 HydrophobicContact CG1-CD2 4.24Å; I265-L289 WeakPolarHBondContact O-CD2 3.41Å; L268-L289 HydrophobicContact CB-CD2 4.38Å; L268-L289 HydrophobicContact CD2-CD1 4.29Å; F286-L289 HydrophobicContact CD1-CD1 3.92Å; F286-L289 WeakPolarHBondContact O-CB 3.39Å; F286-L289 PolarHBondContact O-N 2.03Å; T287-L289 VanDerWaalsContact C-N 3.27Å; T287-L289 PolarHBondContact O-N 3.23Å; L289-Y291 PolarHBondContact O-N 3.01Å; L289-L292 HydrophobicContact CB-CB 3.91Å; L289-L292 HydrophobicContact CB-CD2 4.23Å; L289-L292 HydrophobicContact CD1-CD2 3.88Å; L289-L292 WeakPolarHBondContact O-CB 3.42Å; L289-L292 PolarHBondContact O-N 2.79Å; L289-L292 VanDerWaalsContact O-N 3.08Å
290	Q	92.9	Very high	94.7	Very high	161 Å²	161	43.6 Å²	43.6	75%	0.752	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-13.9	-169.9	-63	-179.6	4.5	0	0	115.3	P288	P288-Q290 PolarHBondContact O-N 2.96Å; P288-Q290 VanDerWaalsContact O-N 3.1Å
291	Y	95	Very high	94.7	Very high	145 Å²	145	44.1 Å²	44.1	57%	0.569	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108.9	2.3	-179.7	-54.7	-76.6	0	0	0	113.7	T266 L268 V269 L289 V293	T266-Y291 WeakPolarHBondContact O-CD2 3.21Å; L268-Y291 CarbonylContact O-C 3.46Å; V269-Y291 WeakPolarHBondContact CA-O 3.34Å; L289-Y291 PolarHBondContact O-N 3.01Å; Y291-V293 PolarHBondContact O-N 3.02Å
292	L	94.3	Very high	94.7	Very high	5 Å²	5	44.1 Å²	44.1	3%	0.026	22%	0.219	C	C	.	.			trans	-74.2	107.7	-174.7	-179.2	63.9	0	0	0	110.9	L268 L271 F286 L289 E294 W314	L268-L292 HydrophobicContact CD2-CD1 4.41Å; L268-L292 WeakPolarHBondContact O-CA 3.39Å; L268-L292 PolarHBondContact O-N 2.75Å; L268-L292 VanDerWaalsContact O-N 3.1Å; L271-L292 HydrophobicContact CB-CD1 3.81Å; F286-L292 HydrophobicContact CB-CD2 4.48Å; F286-L292 HydrophobicContact CD1-CD2 4.32Å; F286-L292 HydrophobicContact CG-CD2 4.31Å; L289-L292 HydrophobicContact CB-CB 3.91Å; L289-L292 HydrophobicContact CB-CD2 4.23Å; L289-L292 HydrophobicContact CD1-CD2 3.88Å; L289-L292 WeakPolarHBondContact O-CB 3.42Å; L289-L292 PolarHBondContact O-N 2.79Å; L289-L292 VanDerWaalsContact O-N 3.08Å; L292-E294 WeakPolarHBondContact CD1-O 3.48Å; L292-W314 HydrophobicContact CB-CH2 4.38Å; L292-W314 HydrophobicContact CD2-CH2 3.75Å; L292-W314 HydrophobicContact CD2-CZ2 4.21Å; L292-W314 HydrophobicContact CG-CH2 4Å
293	V	91.2	Very high	94.7	Very high	83 Å²	83	50.1 Å²	50.1	50%	0.503	24%	0.242	S	C	.	.			trans	-118.7	-18.7	-177.4	-65.7	0	0	0	0	113.4	V269 Y291 I319	V269-V293 HydrophobicContact CG1-CG2 3.77Å; V269-V293 PolarHBondContact O-N 2.95Å; Y291-V293 PolarHBondContact O-N 3.02Å; V293-I319 WeakPolarHBondContact O-CD1 3.39Å
294	E	92.6	Very high	94.7	Very high	89 Å²	89	49.1 Å²	49.1	42%	0.416	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	124.9	176.5	-174.3	168.8	166.2	0	0	110.7	V269 E270 L271 L292 H296	V269-E294 PolarHBondContact O-N 3.06Å; V269-E294 VanDerWaalsContact O-N 3.11Å; E270-E294 VanDerWaalsContact CA-O 3.31Å; E270-E294 WeakPolarHBondContact CA-O 3.06Å; E270-E294 HydrophobicContact CB-CB 4.39Å; E270-E294 HydrophobicContact CG-CB 4.06Å; E270-E294 HydrophobicContact CG-CG 4.03Å; L271-E294 PolarHBondContact N-O 2.91Å; L292-E294 WeakPolarHBondContact CD1-O 3.48Å; E294-H296 IonicContact OE1-CE1 2.8Å; E294-H296 PolarHBondContact OE1-CE1 2.79Å; E294-H296 IonicContact OE1-NE2 2.92Å; E294-H296 PolarHBondContact OE1-NE2 3.42Å
295	L	93.4	Very high	94.7	Very high	3 Å²	3	49.2 Å²	49.2	2%	0.016	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	122.7	-170	176.6	61.8	0	0	0	110.9	L271 F286 L297 W314 L315 I319 C325	L271-L295 HydrophobicContact CB-CD1 3.87Å; L271-L295 HydrophobicContact CD2-CD1 3.93Å; L271-L295 HydrophobicContact CG-CD1 3.95Å; L271-L295 WeakPolarHBondContact O-CA 3.46Å; F286-L295 HydrophobicContact CD2-CD2 4.22Å; F286-L295 HydrophobicContact CE2-CD1 4.47Å; F286-L295 HydrophobicContact CE2-CD2 3.69Å; F286-L295 HydrophobicContact CZ-CD1 4.19Å; F286-L295 HydrophobicContact CZ-CD2 4.23Å; L295-L297 HydrophobicContact CD1-CD2 3.96Å; L295-L297 HydrophobicContact CD1-CG 4.15Å; L295-L297 HydrophobicContact CD2-CD1 4.13Å; L295-L297 HydrophobicContact CD2-CG 4.26Å; L295-L297 HydrophobicContact CG-CD1 4.4Å; L295-L297 HydrophobicContact CG-CD2 4.36Å; L295-L297 HydrophobicContact CG-CG 3.98Å; L295-W314 HydrophobicContact CD2-CE3 4.42Å; L295-W314 HydrophobicContact CD2-CH2 4.38Å; L295-W314 HydrophobicContact CD2-CZ3 3.65Å; L295-L315 HydrophobicContact CD2-CD2 3.72Å; L295-I319 HydrophobicContact CB-CD1 3.97Å; L295-C325 VanDerWaalsContact O-CA 3.3Å; L295-C325 WeakPolarHBondContact O-CA 3.06Å; L295-C325 WeakPolarHBondContact O-CB 3.19Å
296	H	94.8	Very high	94.5	Very high	40 Å²	40	50.9 Å²	50.9	19%	0.185	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	105.5	-179	-56.1	-87.8	0	0	0	110.7	L271 N272 L273 A274 E294	L271-H296 PolarHBondContact O-N 2.89Å; N272-H296 HydrophobicContact CB-CB 4.2Å; N272-H296 WeakPolarHBondContact OD1-CB 3.39Å; L273-H296 CarbonylContact C-O 3.51Å; L273-H296 PolarHBondContact N-O 2.89Å; A274-H296 HydrophobicContact CB-CB 4.42Å; A274-H296 PolarHBondContact N-O 2.92Å; E294-H296 IonicContact OE1-CE1 2.8Å; E294-H296 PolarHBondContact OE1-CE1 2.79Å; E294-H296 IonicContact OE1-NE2 2.92Å; E294-H296 PolarHBondContact OE1-NE2 3.42Å
297	L	95	Very high	94.4	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.26	C	S	.	.			trans	-113.4	0.5	180	-65.1	-174	0	0	0	113.4	L273 L295 N300 W302 L311 C325	L273-L297 HydrophobicContact CB-CD2 4.22Å; L273-L297 HydrophobicContact CD1-CD2 4.26Å; L295-L297 HydrophobicContact CD1-CD2 3.96Å; L295-L297 HydrophobicContact CD1-CG 4.15Å; L295-L297 HydrophobicContact CD2-CD1 4.13Å; L295-L297 HydrophobicContact CD2-CG 4.26Å; L295-L297 HydrophobicContact CG-CD1 4.4Å; L295-L297 HydrophobicContact CG-CD2 4.36Å; L295-L297 HydrophobicContact CG-CG 3.98Å; L297-N300 PolarHBondContact O-ND2 3.3Å; L297-N300 VanDerWaalsContact O-ND2 3.08Å; L297-W302 HydrophobicContact CB-CZ2 3.86Å; L297-W302 HydrophobicContact CD1-CZ2 4.22Å; L297-W302 HydrophobicContact CD2-CH2 4.43Å; L297-W302 HydrophobicContact CD2-CZ2 4.04Å; L297-W302 HydrophobicContact CG-CZ2 4.25Å; L297-W302 PolarHBondContact O-NE1 3.13Å; L297-L311 HydrophobicContact CD1-CD1 4.11Å; L297-L311 HydrophobicContact CD1-CD2 4.1Å; L297-C325 PolarHBondContact N-O 2.94Å
298	H	93.8	Very high	94.5	Very high	47 Å²	47	49.6 Å²	49.6	22%	0.218	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	156.4	-175.2	66.5	34.9	0	0	0	113.7	A274 H275 N300 C325	A274-H298 VanDerWaalsContact CA-O 3.29Å; A274-H298 WeakPolarHBondContact CA-O 3.49Å; A274-H298 WeakPolarHBondContact CB-CE1 3.31Å; A274-H298 VanDerWaalsContact CB-ND1 3.32Å; A274-H298 WeakPolarHBondContact CB-ND1 3.45Å; H275-H298 AromaticContact CE1-CE1 3.64Å; H275-H298 AromaticContact CE1-ND1 3.97Å; H275-H298 PolarHBondContact N-O 3.27Å; H298-N300 VanDerWaalsContact C-N 3.32Å; H298-N300 PolarHBondContact O-N 2.73Å; H298-C325 PolarHBondContact N-O 3.32Å
299	H	95.9	Very high	94.5	Very high	125 Å²	125	47.9 Å²	47.9	58%	0.579	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.2	35.8	-176.6	-57.1	103.4	0	0	0	114.5	H275	H275-H299 WeakPolarHBondContact CA-O 3.33Å; H275-H299 HydrophobicContact CB-CB 4.44Å; H275-H299 WeakPolarHBondContact CD2-CB 3.45Å; H275-H299 AromaticContact CD2-CG 3.56Å; H275-H299 AromaticContact CD2-ND1 3.74Å; H275-H299 AromaticContact CE1-ND1 3.7Å; H275-H299 AromaticContact NE2-CE1 3.8Å; H275-H299 AromaticContact NE2-CG 3.45Å; H275-H299 AromaticContact NE2-ND1 3.12Å; H275-H299 PolarHBondContact NE2-ND1 2.97Å; H275-H299 VanDerWaalsContact NE2-ND1 3.12Å
300	N	97.1	Very high	94.5	Very high	10 Å²	10	48 Å²	48	5%	0.053	23%	0.228	C	C	.	.	S	Bend	trans	-111.2	147.6	164.6	-77	-83.8	0	0	0	109.8	L273 N276 L278 L297 H298 W302	L273-N300 PolarHBondContact O-ND2 2.9Å; N276-N300 VanDerWaalsContact CA-OD1 3.3Å; N276-N300 WeakPolarHBondContact CA-OD1 3.42Å; N276-N300 WeakPolarHBondContact CB-OD1 3.44Å; N276-N300 PolarHBondContact N-OD1 3.04Å; N276-N300 PolarHBondContact O-OD1 3.06Å; L278-N300 HydrophobicContact CB-CB 4.19Å; L278-N300 VanDerWaalsContact CB-OD1 3.27Å; L278-N300 WeakPolarHBondContact CB-OD1 3.45Å; L278-N300 WeakPolarHBondContact CG-OD1 3.41Å; L278-N300 PolarHBondContact N-OD1 2.97Å; L278-N300 VanDerWaalsContact N-OD1 3.08Å; L297-N300 PolarHBondContact O-ND2 3.3Å; L297-N300 VanDerWaalsContact O-ND2 3.08Å; H298-N300 VanDerWaalsContact C-N 3.32Å; H298-N300 PolarHBondContact O-N 2.73Å; N300-W302 HydrophobicContact CB-CD2 4.19Å; N300-W302 HydrophobicContact CB-CG 4.46Å; N300-W302 HydrophobicContact CB-CZ2 3.74Å; N300-W302 PolarHBondContact O-N 3.37Å
301	P	96.9	Very high	94.6	Very high	31 Å²	31	40.4 Å²	40.4	20%	0.201	19%	0.193	C	C	.	.			trans	-80.6	53.3	-176.9	35.6	-39.7	0	0	0	113.6	N277 L278 R303 H330	N277-P301 WeakPolarHBondContact OD1-CG 3.23Å; L278-P301 CarbonylContact O-C 3.19Å; L278-P301 VanDerWaalsContact O-CD 3.26Å; L278-P301 WeakPolarHBondContact O-CD 3.17Å; P301-R303 PolarHBondContact O-N 3.08Å; P301-H330 HydrophobicContact CB-CB 4.26Å
302	W	97	Very high	94.5	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.166	C	C	.	.			trans	-51.2	134.2	-172.2	-63.6	112.9	0	0	0	114.5	L278 L281 L297 N300 H330 T331 L340	L278-W302 HydrophobicContact CB-CH2 3.63Å; L278-W302 HydrophobicContact CB-CZ2 4.23Å; L278-W302 HydrophobicContact CB-CZ3 3.85Å; L278-W302 HydrophobicContact CD1-CH2 3.95Å; L278-W302 HydrophobicContact CD1-CZ2 4.43Å; L278-W302 HydrophobicContact CG-CH2 4.44Å; L281-W302 HydrophobicContact CD1-CH2 4.1Å; L281-W302 HydrophobicContact CD1-CZ3 4.5Å; L281-W302 HydrophobicContact CD2-CH2 4.16Å; L281-W302 HydrophobicContact CD2-CZ3 4.39Å; L281-W302 HydrophobicContact CG-CH2 3.85Å; L281-W302 HydrophobicContact CG-CZ3 3.88Å; L297-W302 HydrophobicContact CB-CZ2 3.86Å; L297-W302 HydrophobicContact CD1-CZ2 4.22Å; L297-W302 HydrophobicContact CD2-CH2 4.43Å; L297-W302 HydrophobicContact CD2-CZ2 4.04Å; L297-W302 HydrophobicContact CG-CZ2 4.25Å; L297-W302 PolarHBondContact O-NE1 3.13Å; N300-W302 HydrophobicContact CB-CD2 4.19Å; N300-W302 HydrophobicContact CB-CG 4.46Å; N300-W302 HydrophobicContact CB-CZ2 3.74Å; N300-W302 PolarHBondContact O-N 3.37Å; W302-H330 PolarHBondContact O-N 2.84Å; W302-T331 PolarHBondContact O-N 3.01Å; W302-T331 VanDerWaalsContact O-N 3.14Å; W302-L340 HydrophobicContact CB-CD2 3.92Å; W302-L340 HydrophobicContact CD2-CD1 3.96Å; W302-L340 HydrophobicContact CG-CD1 3.88Å; W302-L340 HydrophobicContact CG-CD2 4.07Å; W302-L340 HydrophobicContact CG-CG 4.34Å
303	R	96.5	Very high	94.4	Very high	131 Å²	131	38.4 Å²	38.4	49%	0.494	18%	0.184	S	C	.	.	B	Isolated β-bridge	trans	-95.1	116	168.2	-174	-174.5	-62.1	175.8	1.9	108.7	S279 P301 D305 T331	S279-R303 WeakPolarHBondContact O-CB 3.42Å; S279-R303 PolarHBondContact O-N 3.38Å; P301-R303 PolarHBondContact O-N 3.08Å; R303-D305 WeakPolarHBondContact CD-OD2 3.43Å; R303-D305 WeakPolarHBondContact CG-OD2 3.5Å; R303-D305 PolarHBondContact O-N 3.43Å; R303-T331 WeakPolarHBondContact CA-O 3.49Å; R303-T331 WeakPolarHBondContact CA-OG1 3.27Å; R303-T331 WeakPolarHBondContact CB-OG1 3.47Å
304	C	95.5	Very high	94.5	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	16%	0.163	C	C	.	.			trans	-97.6	84.4	179.5	-65.7	0	0	0	0	110.2	V308 C329 T331 P332 M335 L340 V343 F348	C304-V308 HydrophobicContact CB-CG1 4.05Å; C304-C329 HydrophobicContact CB-CB 3.83Å; C304-C329 WeakPolarHBondContact CB-SG 3.28Å; C304-C329 VanDerWaalsContact SG-CA 3.54Å; C304-C329 WeakPolarHBondContact SG-CB 3.29Å; C304-C329 CovalentContact SG-SG 2.03Å; C304-C329 PolarHBondContact SG-SG 2.97Å; C304-T331 PolarHBondContact N-O 3.19Å; C304-P332 WeakPolarHBondContact O-CD 3.49Å; C304-M335 HydrophobicContact CB-CB 4.14Å; C304-M335 HydrophobicContact CB-CG 4.38Å; C304-L340 WeakPolarHBondContact SG-CD2 3.17Å; C304-V343 HydrophobicContact CB-CG2 4.45Å; C304-F348 VanDerWaalsContact O-CE1 3.31Å; C304-F348 WeakPolarHBondContact O-CE1 3.49Å; C304-F348 WeakPolarHBondContact O-CZ 3.42Å
305	D	93.5	Very high	94.5	Very high	46 Å²	46	31 Å²	31	25%	0.246	14%	0.144	C	C	.	.	S	Bend	trans	-125.4	-162.4	168.1	60.4	32.3	0	0	0	109.6	R303 D307 V308	R303-D305 WeakPolarHBondContact CD-OD2 3.43Å; R303-D305 WeakPolarHBondContact CG-OD2 3.5Å; R303-D305 PolarHBondContact O-N 3.43Å; D305-D307 PolarHBondContact O-N 3.04Å; D305-D307 VanDerWaalsContact O-N 3.14Å; D305-D307 WeakPolarHBondContact OD1-CB 3.31Å; D305-D307 PolarHBondContact OD1-N 2.85Å; D305-V308 PolarHBondContact O-N 2.96Å; D305-V308 VanDerWaalsContact O-N 3.1Å
306	C	93.1	Very high	94.3	Very high	38 Å²	38	35.5 Å²	35.5	26%	0.257	16%	0.16	S	C	.	.	G	3₁₀ helix	trans	-54.8	-28.7	179.4	-70	0	0	0	0	114.8	V308 V309 C350	C306-V308 VanDerWaalsContact C-N 3.29Å; C306-V308 PolarHBondContact O-N 2.7Å; C306-V309 PolarHBondContact O-N 3Å; C306-C350 VanDerWaalsContact CA-SG 3.58Å; C306-C350 HydrophobicContact CB-CB 3.84Å; C306-C350 WeakPolarHBondContact CB-SG 3.38Å; C306-C350 WeakPolarHBondContact SG-CA 3.39Å; C306-C350 WeakPolarHBondContact SG-CB 3.31Å; C306-C350 CovalentContact SG-SG 2.04Å; C306-C350 PolarHBondContact SG-SG 3.34Å
307	D	94.4	Very high	94.2	Very high	46 Å²	46	39.6 Å²	39.6	25%	0.246	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-75.3	-17.9	-178.4	-70.7	-21.9	0	0	0	112.3	D305 W310 M379	D305-D307 PolarHBondContact O-N 3.04Å; D305-D307 VanDerWaalsContact O-N 3.14Å; D305-D307 WeakPolarHBondContact OD1-CB 3.31Å; D305-D307 PolarHBondContact OD1-N 2.85Å; D307-W310 PolarHBondContact O-NE1 3.05Å; D307-M379 HydrophobicContact CB-CB 3.97Å; D307-M379 HydrophobicContact CB-CG 4.04Å; D307-M379 WeakPolarHBondContact OD2-CB 3.29Å; D307-M379 VanDerWaalsContact OD2-CG 3.29Å; D307-M379 WeakPolarHBondContact OD2-CG 3.36Å
308	V	94	Very high	93.9	Very high	1 Å²	1	43 Å²	43	1%	0.006	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-88.6	-14.2	176	97.5	0	0	0	0	113.6	C304 D305 C306 W310 L311 S312 L340 V343	C304-V308 HydrophobicContact CB-CG1 4.05Å; D305-V308 PolarHBondContact O-N 2.96Å; D305-V308 VanDerWaalsContact O-N 3.1Å; C306-V308 VanDerWaalsContact C-N 3.29Å; C306-V308 PolarHBondContact O-N 2.7Å; V308-W310 PolarHBondContact O-N 2.81Å; V308-L311 HydrophobicContact CG2-CD2 4.1Å; V308-L311 WeakPolarHBondContact O-CB 3.47Å; V308-L311 PolarHBondContact O-N 3.47Å; V308-L311 VanDerWaalsContact O-N 3.14Å; V308-S312 PolarHBondContact O-N 3.42Å; V308-L340 HydrophobicContact CG2-CD1 4.46Å; V308-L340 HydrophobicContact CG2-CD2 4.08Å; V308-V343 HydrophobicContact CG1-CB 4.47Å; V308-V343 HydrophobicContact CG1-CG1 3.88Å
309	V	93.1	Very high	93.6	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.006	19%	0.191	C	C	.	.	H	α-helix	trans	-65.5	-38.1	-169.6	179.9	0	0	0	0	111.9	C306 L311 S312 W313 Q345 F348 M429	C306-V309 PolarHBondContact O-N 3Å; V309-L311 VanDerWaalsContact C-N 3.32Å; V309-L311 PolarHBondContact O-N 3.48Å; V309-S312 PolarHBondContact O-N 3.33Å; V309-W313 PolarHBondContact O-N 2.86Å; V309-Q345 HydrophobicContact CG1-CB 3.73Å; V309-Q345 HydrophobicContact CG1-CG 4.09Å; V309-F348 HydrophobicContact CG2-CD2 3.78Å; V309-F348 HydrophobicContact CG2-CE2 4.13Å; V309-M429 HydrophobicContact CB-CG 3.96Å; V309-M429 HydrophobicContact CG1-CE 4.21Å; V309-M429 HydrophobicContact CG1-CG 3.77Å; V309-M429 HydrophobicContact CG1-SD 4.44Å
310	W	94.7	Very high	92.9	Very high	6 Å²	6	39.3 Å²	39.3	2%	0.023	19%	0.188	C	C	.	.	H	α-helix	trans	-61.8	-41.2	175.1	80.4	-92.4	0	0	0	111.5	L281 P282 H283 L285 F286 D307 V308 W313 W314 M429	L281-W310 HydrophobicContact CB-CZ2 3.93Å; L281-W310 PolarHBondContact O-NE1 3.37Å; P282-W310 WeakPolarHBondContact O-CZ2 3.49Å; H283-W310 AromaticContact CD2-CD1 3.82Å; H283-W310 AromaticContact CD2-CG 3.66Å; L285-W310 HydrophobicContact CB-CH2 4.09Å; L285-W310 HydrophobicContact CB-CZ2 4.32Å; F286-W310 HydrophobicContact CB-CZ3 4.48Å; F286-W310 AromaticContact CD2-CH2 3.93Å; F286-W310 HydrophobicContact CD2-CH2 3.93Å; F286-W310 HydrophobicContact CD2-CZ3 4.26Å; F286-W310 HydrophobicContact CE2-CH2 4.4Å; F286-W310 HydrophobicContact CG-CH2 4.26Å; D307-W310 PolarHBondContact O-NE1 3.05Å; V308-W310 PolarHBondContact O-N 2.81Å; W310-W313 PolarHBondContact O-N 3.22Å; W310-W314 HydrophobicContact CE3-CB 4.37Å; W310-W314 HydrophobicContact CZ3-CB 4.36Å; W310-W314 HydrophobicContact CZ3-CG 4.47Å; W310-W314 WeakPolarHBondContact O-CB 3.45Å; W310-W314 PolarHBondContact O-N 3.37Å; W310-M429 HydrophobicContact CB-CB 4.4Å; W310-M429 HydrophobicContact CB-SD 4.01Å
311	L	94.7	Very high	91.6	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.005	23%	0.226	C	C	.	.	H	α-helix	trans	-67	-44.7	179.2	172.6	63	0	0	0	110	L281 F286 L297 V308 V309 W313 W314 L315 L340	L281-L311 HydrophobicContact CD1-CD1 4.44Å; L281-L311 HydrophobicContact CD1-CD2 4.1Å; F286-L311 HydrophobicContact CD2-CD1 4.04Å; F286-L311 HydrophobicContact CE2-CD1 3.63Å; L297-L311 HydrophobicContact CD1-CD1 4.11Å; L297-L311 HydrophobicContact CD1-CD2 4.1Å; V308-L311 HydrophobicContact CG2-CD2 4.1Å; V308-L311 WeakPolarHBondContact O-CB 3.47Å; V308-L311 PolarHBondContact O-N 3.47Å; V308-L311 VanDerWaalsContact O-N 3.14Å; V309-L311 VanDerWaalsContact C-N 3.32Å; V309-L311 PolarHBondContact O-N 3.48Å; L311-W313 VanDerWaalsContact C-N 3.33Å; L311-W313 PolarHBondContact O-N 2.91Å; L311-W314 PolarHBondContact O-N 3.11Å; L311-L315 HydrophobicContact CD1-CD1 4.06Å; L311-L315 HydrophobicContact CD1-CD2 4.39Å; L311-L315 HydrophobicContact CD1-CG 3.99Å; L311-L315 HydrophobicContact CG-CD1 3.97Å; L311-L315 HydrophobicContact CG-CG 4.35Å; L311-L315 WeakPolarHBondContact O-CB 3.24Å; L311-L315 WeakPolarHBondContact O-CG 2.9Å; L311-L315 PolarHBondContact O-N 2.89Å; L311-L340 HydrophobicContact CD2-CD1 3.95Å
312	S	93.3	Very high	90	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-58.7	-43.3	176.6	-171.6	0	0	0	0	112.8	V308 V309 R316 L340 V343	V308-S312 PolarHBondContact O-N 3.42Å; V309-S312 PolarHBondContact O-N 3.33Å; S312-R316 PolarHBondContact O-N 3.49Å; S312-R316 PolarHBondContact OG-NH1 2.76Å; S312-L340 VanDerWaalsContact CB-O 3.23Å; S312-L340 WeakPolarHBondContact CB-O 3.49Å; S312-L340 PolarHBondContact OG-O 3.05Å; S312-V343 WeakPolarHBondContact CB-O 3.4Å; S312-V343 PolarHBondContact OG-O 3.04Å
313	W	92.2	Very high	88.5	Confident	109 Å²	109	54.1 Å²	54.1	41%	0.413	27%	0.274	S	S	.	.	H	α-helix	trans	-64.3	-49	173.7	171.3	74.6	0	0	0	111.9	V309 W310 L311 L315 R316 E317	V309-W313 PolarHBondContact O-N 2.86Å; W310-W313 PolarHBondContact O-N 3.22Å; L311-W313 VanDerWaalsContact C-N 3.33Å; L311-W313 PolarHBondContact O-N 2.91Å; W313-L315 VanDerWaalsContact C-N 3.3Å; W313-L315 PolarHBondContact O-N 3.49Å; W313-R316 WeakPolarHBondContact O-CB 3.5Å; W313-R316 PolarHBondContact O-N 3.19Å; W313-E317 VanDerWaalsContact CE2-CD 3.45Å; W313-E317 VanDerWaalsContact CE2-OE1 3.31Å; W313-E317 VanDerWaalsContact CZ2-CD 3.42Å; W313-E317 WeakPolarHBondContact CZ2-OE1 3.32Å; W313-E317 WeakPolarHBondContact CZ2-OE2 3.2Å; W313-E317 VanDerWaalsContact NE1-CD 3.28Å; W313-E317 PolarHBondContact NE1-OE1 3.21Å; W313-E317 PolarHBondContact O-N 3.11Å
314	W	93.1	Very high	87	Confident	16 Å²	16	53.9 Å²	53.9	6%	0.061	29%	0.288	C	S	.	.	H	α-helix	trans	-57.1	-42.3	178.4	-173.6	92.7	0	0	0	112.1	F286 L292 L295 W310 L311 R316 E317 N318 I319	F286-W314 HydrophobicContact CB-CD2 4.18Å; F286-W314 HydrophobicContact CB-CH2 4.44Å; F286-W314 HydrophobicContact CB-CZ2 3.9Å; F286-W314 HydrophobicContact CD2-CD2 4.2Å; F286-W314 AromaticContact CD2-CE3 3.96Å; F286-W314 HydrophobicContact CD2-CE3 3.96Å; F286-W314 HydrophobicContact CD2-CH2 4.48Å; F286-W314 HydrophobicContact CD2-CZ3 4.12Å; L292-W314 HydrophobicContact CB-CH2 4.38Å; L292-W314 HydrophobicContact CD2-CH2 3.75Å; L292-W314 HydrophobicContact CD2-CZ2 4.21Å; L292-W314 HydrophobicContact CG-CH2 4Å; L295-W314 HydrophobicContact CD2-CE3 4.42Å; L295-W314 HydrophobicContact CD2-CH2 4.38Å; L295-W314 HydrophobicContact CD2-CZ3 3.65Å; W310-W314 HydrophobicContact CE3-CB 4.37Å; W310-W314 HydrophobicContact CZ3-CB 4.36Å; W310-W314 HydrophobicContact CZ3-CG 4.47Å; W310-W314 WeakPolarHBondContact O-CB 3.45Å; W310-W314 PolarHBondContact O-N 3.37Å; L311-W314 PolarHBondContact O-N 3.11Å; W314-R316 PolarHBondContact O-N 2.7Å; W314-E317 PolarHBondContact O-N 3.05Å; W314-N318 HydrophobicContact CD2-CB 4.18Å; W314-N318 HydrophobicContact CE3-CB 4.3Å; W314-N318 HydrophobicContact CH2-CB 3.86Å; W314-N318 HydrophobicContact CZ2-CB 3.75Å; W314-N318 HydrophobicContact CZ3-CB 4.15Å; W314-N318 PolarHBondContact NE1-ND2 3.14Å; W314-N318 WeakPolarHBondContact O-CB 3.49Å; W314-N318 PolarHBondContact O-N 3.43Å; W314-N318 PolarHBondContact O-ND2 3.1Å; W314-I319 HydrophobicContact CE3-CG1 4.48Å; W314-I319 HydrophobicContact CH2-CD1 4.01Å; W314-I319 HydrophobicContact CH2-CG1 4.33Å; W314-I319 HydrophobicContact CZ3-CD1 3.84Å; W314-I319 HydrophobicContact CZ3-CG1 3.7Å
315	L	92.4	Very high	85.8	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.005	29%	0.291	C	S	.	.	H	α-helix	trans	-62.8	-37.8	176.7	-69.7	171.1	0	0	0	112.6	L295 L311 W313 E317 I319 C326 L340 V341	L295-L315 HydrophobicContact CD2-CD2 3.72Å; L311-L315 HydrophobicContact CD1-CD1 4.06Å; L311-L315 HydrophobicContact CD1-CD2 4.39Å; L311-L315 HydrophobicContact CD1-CG 3.99Å; L311-L315 HydrophobicContact CG-CD1 3.97Å; L311-L315 HydrophobicContact CG-CG 4.35Å; L311-L315 WeakPolarHBondContact O-CB 3.24Å; L311-L315 WeakPolarHBondContact O-CG 2.9Å; L311-L315 PolarHBondContact O-N 2.89Å; W313-L315 VanDerWaalsContact C-N 3.3Å; W313-L315 PolarHBondContact O-N 3.49Å; L315-E317 VanDerWaalsContact C-N 3.33Å; L315-E317 PolarHBondContact O-N 3.28Å; L315-I319 HydrophobicContact CD2-CG1 3.82Å; L315-I319 WeakPolarHBondContact O-CB 3.45Å; L315-I319 PolarHBondContact O-N 2.8Å; L315-C326 HydrophobicContact CD1-CB 4.02Å; L315-L340 HydrophobicContact CD1-CB 4.1Å; L315-V341 HydrophobicContact CB-CG2 4.25Å; L315-V341 HydrophobicContact CD1-CG2 4.38Å
316	R	90.4	Very high	84.9	Confident	97 Å²	97	52.4 Å²	52.4	37%	0.366	28%	0.281	S	S	.	.	H	α-helix	trans	-67.3	-30.8	177.4	-77.7	-172.6	-68.5	-95.8	2.9	113.5	S312 W313 W314 V341 V343	S312-R316 PolarHBondContact O-N 3.49Å; S312-R316 PolarHBondContact OG-NH1 2.76Å; W313-R316 WeakPolarHBondContact O-CB 3.5Å; W313-R316 PolarHBondContact O-N 3.19Å; W314-R316 PolarHBondContact O-N 2.7Å; R316-V341 HydrophobicContact CG-CG1 3.52Å; R316-V341 PolarHBondContact NH1-O 3.04Å; R316-V343 PolarHBondContact NH1-O 3.22Å; R316-V343 PolarHBondContact NH2-O 2.56Å
317	E	90.7	Very high	84.6	Confident	126 Å²	126	51 Å²	51	59%	0.589	27%	0.273	S	S	*	.	H	α-helix	trans	-91.8	-33.2	-177.5	-64.6	-164.9	173.4	0	0	113.5	W313 W314 L315	W313-E317 VanDerWaalsContact CE2-CD 3.45Å; W313-E317 VanDerWaalsContact CE2-OE1 3.31Å; W313-E317 VanDerWaalsContact CZ2-CD 3.42Å; W313-E317 WeakPolarHBondContact CZ2-OE1 3.32Å; W313-E317 WeakPolarHBondContact CZ2-OE2 3.2Å; W313-E317 VanDerWaalsContact NE1-CD 3.28Å; W313-E317 PolarHBondContact NE1-OE1 3.21Å; W313-E317 PolarHBondContact O-N 3.11Å; W314-E317 PolarHBondContact O-N 3.05Å; L315-E317 VanDerWaalsContact C-N 3.33Å; L315-E317 PolarHBondContact O-N 3.28Å
318	N	90.5	Very high	84.6	Confident	72 Å²	72	54.9 Å²	54.9	39%	0.385	28%	0.284	S	S	.	.	H	α-helix	trans	-105.4	-24.4	-169.8	-61.9	-91.6	0	0	0	114.2	W314	W314-N318 HydrophobicContact CD2-CB 4.18Å; W314-N318 HydrophobicContact CE3-CB 4.3Å; W314-N318 HydrophobicContact CH2-CB 3.86Å; W314-N318 HydrophobicContact CZ2-CB 3.75Å; W314-N318 HydrophobicContact CZ3-CB 4.15Å; W314-N318 PolarHBondContact NE1-ND2 3.14Å; W314-N318 WeakPolarHBondContact O-CB 3.49Å; W314-N318 PolarHBondContact O-N 3.43Å; W314-N318 PolarHBondContact O-ND2 3.1Å
319	I	87.2	Confident	84.7	Confident	13 Å²	13	55 Å²	55	7%	0.067	29%	0.285	C	S	.	.	S	Bend	trans	-108.4	127.7	-172.5	-57.8	-60.2	0	0	0	111.6	V293 L295 W314 L315 T321 S323 C325	V293-I319 WeakPolarHBondContact O-CD1 3.39Å; L295-I319 HydrophobicContact CB-CD1 3.97Å; W314-I319 HydrophobicContact CE3-CG1 4.48Å; W314-I319 HydrophobicContact CH2-CD1 4.01Å; W314-I319 HydrophobicContact CH2-CG1 4.33Å; W314-I319 HydrophobicContact CZ3-CD1 3.84Å; W314-I319 HydrophobicContact CZ3-CG1 3.7Å; L315-I319 HydrophobicContact CD2-CG1 3.82Å; L315-I319 WeakPolarHBondContact O-CB 3.45Å; L315-I319 PolarHBondContact O-N 2.8Å; I319-T321 PolarHBondContact O-N 3.14Å; I319-S323 VanDerWaalsContact CG2-OG 3.26Å; I319-S323 WeakPolarHBondContact CG2-OG 3.42Å; I319-C325 HydrophobicContact CG2-CB 4.06Å
320	P	81.4	Confident	84.9	Confident	80 Å²	80	58.9 Å²	58.9	52%	0.519	30%	0.303	S	S	.	.			trans	-60.2	136.1	179.9	-26.5	35.3	0	0	0	114.1	N322 S323	P320-N322 PolarHBondContact O-N 2.99Å; P320-S323 WeakPolarHBondContact O-CB 3.47Å; P320-S323 PolarHBondContact O-N 2.82Å; P320-S323 VanDerWaalsContact O-N 3.08Å; P320-S323 PolarHBondContact O-OG 2.95Å
321	T	68.8	Low	84.9	Confident	141 Å²	141	61.2 Å²	61.2	87%	0.865	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-18.5	-176.7	50.6	0	0	0	0	115.4	I319 S323	I319-T321 PolarHBondContact O-N 3.14Å; T321-S323 VanDerWaalsContact C-N 3.29Å; T321-S323 PolarHBondContact O-N 3.38Å
322	N	64.2	Low	85	Confident	161 Å²	161	63.4 Å²	63.4	86%	0.861	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	0.1	177.8	-68.8	-13.6	0	0	0	113.7	P320	P320-N322 PolarHBondContact O-N 2.99Å
323	S	65.5	Low	85	Confident	50 Å²	50	69.1 Å²	69.1	35%	0.35	37%	0.367	S	S	.	.			trans	-94.1	142.3	-175.3	67.2	0	0	0	0	113.3	I319 P320 T321 C325	I319-S323 VanDerWaalsContact CG2-OG 3.26Å; I319-S323 WeakPolarHBondContact CG2-OG 3.42Å; P320-S323 WeakPolarHBondContact O-CB 3.47Å; P320-S323 PolarHBondContact O-N 2.82Å; P320-S323 VanDerWaalsContact O-N 3.08Å; P320-S323 PolarHBondContact O-OG 2.95Å; T321-S323 VanDerWaalsContact C-N 3.29Å; T321-S323 PolarHBondContact O-N 3.38Å; S323-C325 PolarHBondContact O-N 3.45Å; S323-C325 PolarHBondContact OG-SG 2.92Å
324	T	64.9	Low	85	Confident	126 Å²	126	71.1 Å²	71.1	77%	0.773	38%	0.381	S	S	*	.			trans	-86.4	26.8	174.1	51.3	0	0	0	0	113	C326	T324-C326 PolarHBondContact O-N 2.71Å
325	C	70.6	Confident	85	Confident	10 Å²	10	71.3 Å²	71.3	7%	0.068	38%	0.382	C	S	.	.			trans	-50.4	-51.8	-171.8	50.8	0	0	0	0	115.3	L295 L297 H298 I319 S323 G327	L295-C325 VanDerWaalsContact O-CA 3.3Å; L295-C325 WeakPolarHBondContact O-CA 3.06Å; L295-C325 WeakPolarHBondContact O-CB 3.19Å; L297-C325 PolarHBondContact N-O 2.94Å; H298-C325 PolarHBondContact N-O 3.32Å; I319-C325 HydrophobicContact CG2-CB 4.06Å; S323-C325 PolarHBondContact O-N 3.45Å; S323-C325 PolarHBondContact OG-SG 2.92Å; C325-G327 PolarHBondContact O-N 2.8Å
326	C	74.6	Confident	85.2	Confident	6 Å²	6	78.6 Å²	78.6	4%	0.041	41%	0.41	C	S	.	.	S	Bend	trans	-104.4	6	-130.3	-67.5	0	0	0	0	115.2	L315 T324 L340 V341	L315-C326 HydrophobicContact CD1-CB 4.02Å; T324-C326 PolarHBondContact O-N 2.71Å; C326-L340 WeakPolarHBondContact O-CB 3.38Å; C326-L340 VanDerWaalsContact O-CD1 3.28Å; C326-L340 WeakPolarHBondContact O-CD1 3.44Å; C326-L340 WeakPolarHBondContact O-CG 3.47Å; C326-V341 HydrophobicContact CB-CG2 3.51Å; C326-V341 VanDerWaalsContact SG-CG2 3.53Å
327	G	86.6	Confident	85.3	Confident	8 Å²	8	76.1 Å²	76.1	8%	0.082	41%	0.414	C	S	.	.			trans	63.3	-167.7	-179.2	0	0	0	0	0	114.5	C325	C325-G327 PolarHBondContact O-N 2.8Å
328	R	93.9	Very high	85.4	Confident	127 Å²	127	76 Å²	76	48%	0.479	41%	0.409	S	S	.	.	B	Isolated β-bridge	trans	-143.2	150.5	-176.5	-65	178.3	-175.5	99.5	-2.8	110.5	G337 R338 Y339	R328-G337 WeakPolarHBondContact CD-O 3.03Å; R328-R338 CarbonylContact C-O 3.01Å; R328-R338 WeakPolarHBondContact CA-O 3.33Å; R328-R338 VanDerWaalsContact CB-O 3.31Å; R328-R338 WeakPolarHBondContact CB-O 3.29Å; R328-Y339 HydrophobicContact CG-CD1 3.94Å; R328-Y339 HydrophobicContact CG-CE1 4.27Å; R328-Y339 HydrophobicContact CG-CG 4.31Å; R328-Y339 PolarHBondContact NH2-OH 3.16Å
329	C	96	Very high	85.5	Confident	4 Å²	4	77.8 Å²	77.8	3%	0.027	41%	0.411	C	S	.	.			trans	-60.6	133.3	174.1	-59.4	0	0	0	0	111.3	C304 M335 R336 G337 R338	C304-C329 HydrophobicContact CB-CB 3.83Å; C304-C329 WeakPolarHBondContact CB-SG 3.28Å; C304-C329 VanDerWaalsContact SG-CA 3.54Å; C304-C329 WeakPolarHBondContact SG-CB 3.29Å; C304-C329 CovalentContact SG-SG 2.03Å; C304-C329 PolarHBondContact SG-SG 2.97Å; C329-M335 HydrophobicContact CB-CB 4.07Å; C329-M335 VanDerWaalsContact CB-O 3.28Å; C329-M335 WeakPolarHBondContact CB-O 3.32Å; C329-R336 CarbonylContact O-C 3.03Å; C329-R336 WeakPolarHBondContact O-CA 3.34Å; C329-G337 PolarHBondContact O-N 3.02Å; C329-R338 PolarHBondContact N-O 2.98Å
330	H	97.1	Very high	85.7	Confident	83 Å²	83	77.2 Å²	77.2	38%	0.384	41%	0.407	S	S	.	.			trans	-101	-36.8	170.5	-165.9	91.8	0	0	0	112	P301 W302 R336	P301-H330 HydrophobicContact CB-CB 4.26Å; W302-H330 PolarHBondContact O-N 2.84Å; H330-R336 PolarHBondContact NE2-NH1 3.11Å
331	T	95.8	Very high	86.2	Confident	54 Å²	54	75.7 Å²	75.7	33%	0.331	40%	0.397	S	S	.	.	B	Isolated β-bridge	trans	-132.2	160	174.6	50.1	0	0	0	0	110.2	W302 R303 C304	W302-T331 PolarHBondContact O-N 3.01Å; W302-T331 VanDerWaalsContact O-N 3.14Å; R303-T331 WeakPolarHBondContact CA-O 3.49Å; R303-T331 WeakPolarHBondContact CA-OG1 3.27Å; R303-T331 WeakPolarHBondContact CB-OG1 3.47Å; C304-T331 PolarHBondContact N-O 3.19Å
332	P	95.5	Very high	87.1	Confident	47 Å²	47	74.4 Å²	74.4	31%	0.305	38%	0.381	S	S	.	.	S	Bend	cis	-69.2	173.3	-13.8	35.1	-38.1	0	0	0	111.2	C304 Q334 M335 R336	C304-P332 WeakPolarHBondContact O-CD 3.49Å; P332-Q334 VanDerWaalsContact C-N 3.25Å; P332-Q334 PolarHBondContact O-N 3.08Å; P332-M335 HydrophobicContact CG-CB 4.5Å; P332-M335 HydrophobicContact CG-CG 4.28Å; P332-M335 PolarHBondContact O-N 2.81Å; P332-R336 PolarHBondContact O-N 2.88Å
333	V	93.6	Very high	88.4	Confident	121 Å²	121	67 Å²	67	73%	0.733	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-32.9	-171.1	-178.2	0	0	0	0	112.6	M335 R336	V333-M335 VanDerWaalsContact C-N 3.27Å; V333-M335 PolarHBondContact O-N 3.14Å; V333-R336 PolarHBondContact O-N 2.99Å
334	Q	92.9	Very high	89.4	Confident	151 Å²	151	67.6 Å²	67.6	71%	0.706	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-25.2	178.4	-54.5	89.1	-23.1	0	0	113.6	P332	P332-Q334 VanDerWaalsContact C-N 3.25Å; P332-Q334 PolarHBondContact O-N 3.08Å
335	M	93.3	Very high	90.3	Very high	19 Å²	19	65.7 Å²	65.7	9%	0.094	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-12.3	179.6	-64.7	-57.1	-168.7	0	0	113	C304 C329 P332 V333 G337 R338 T347 F348	C304-M335 HydrophobicContact CB-CB 4.14Å; C304-M335 HydrophobicContact CB-CG 4.38Å; C329-M335 HydrophobicContact CB-CB 4.07Å; C329-M335 VanDerWaalsContact CB-O 3.28Å; C329-M335 WeakPolarHBondContact CB-O 3.32Å; P332-M335 HydrophobicContact CG-CB 4.5Å; P332-M335 HydrophobicContact CG-CG 4.28Å; P332-M335 PolarHBondContact O-N 2.81Å; V333-M335 VanDerWaalsContact C-N 3.27Å; V333-M335 PolarHBondContact O-N 3.14Å; M335-G337 PolarHBondContact O-N 3.27Å; M335-R338 WeakPolarHBondContact O-CB 3.38Å; M335-R338 WeakPolarHBondContact O-CG 3.21Å; M335-R338 PolarHBondContact O-N 3.36Å; M335-T347 HydrophobicContact CE-CG2 4.37Å; M335-T347 WeakPolarHBondContact CE-OG1 3.21Å; M335-F348 HydrophobicContact CE-CE1 4.16Å; M335-F348 HydrophobicContact CE-CE2 4.26Å; M335-F348 HydrophobicContact CE-CZ 3.69Å; M335-F348 HydrophobicContact CG-CZ 4.46Å
336	R	95.7	Very high	91	Very high	155 Å²	155	71.1 Å²	71.1	59%	0.585	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	122.6	-172.8	-178.4	173.7	172.5	133.8	-5.4	111.9	C329 H330 P332 V333	C329-R336 CarbonylContact O-C 3.03Å; C329-R336 WeakPolarHBondContact O-CA 3.34Å; H330-R336 PolarHBondContact NE2-NH1 3.11Å; P332-R336 PolarHBondContact O-N 2.88Å; V333-R336 PolarHBondContact O-N 2.99Å
337	G	92.9	Very high	91.5	Very high	44 Å²	44	74 Å²	74	45%	0.454	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.2	-14.7	-179.8	0	0	0	0	0	115.8	R328 C329 M335	R328-G337 WeakPolarHBondContact CD-O 3.03Å; C329-G337 PolarHBondContact O-N 3.02Å; M335-G337 PolarHBondContact O-N 3.27Å
338	R	92.6	Very high	91.6	Very high	125 Å²	125	75.7 Å²	75.7	47%	0.472	38%	0.378	S	S	.	.			trans	-67.3	150.8	171.1	-61.7	-175.8	-173.5	-145.5	1.5	111.1	R328 C329 M335	R328-R338 CarbonylContact C-O 3.01Å; R328-R338 WeakPolarHBondContact CA-O 3.33Å; R328-R338 VanDerWaalsContact CB-O 3.31Å; R328-R338 WeakPolarHBondContact CB-O 3.29Å; C329-R338 PolarHBondContact N-O 2.98Å; M335-R338 WeakPolarHBondContact O-CB 3.38Å; M335-R338 WeakPolarHBondContact O-CG 3.21Å; M335-R338 PolarHBondContact O-N 3.36Å
339	Y	92.2	Very high	91.5	Very high	109 Å²	109	79.3 Å²	79.3	43%	0.427	40%	0.401	S	S	.	.	B	Isolated β-bridge	trans	-76.6	147.6	175.7	-66.1	-92.8	0	0	0	110.9	R328 V341 E342	R328-Y339 HydrophobicContact CG-CD1 3.94Å; R328-Y339 HydrophobicContact CG-CE1 4.27Å; R328-Y339 HydrophobicContact CG-CG 4.31Å; R328-Y339 PolarHBondContact NH2-OH 3.16Å; Y339-V341 PolarHBondContact O-N 3.36Å; Y339-E342 WeakPolarHBondContact CD2-OE2 3.08Å; Y339-E342 PolarHBondContact N-OE2 2.65Å; Y339-E342 PolarHBondContact O-N 3.01Å; Y339-E342 VanDerWaalsContact O-N 3.11Å
340	L	92.6	Very high	91.3	Very high	0 Å²	0	80.8 Å²	80.8	0%	0	41%	0.411	C	S	.	.	G	3₁₀ helix	trans	-58.4	-35.4	178.5	-68.9	-166	0	0	0	112.5	W302 C304 V308 L311 S312 L315 C326 E342 V343	W302-L340 HydrophobicContact CB-CD2 3.92Å; W302-L340 HydrophobicContact CD2-CD1 3.96Å; W302-L340 HydrophobicContact CG-CD1 3.88Å; W302-L340 HydrophobicContact CG-CD2 4.07Å; W302-L340 HydrophobicContact CG-CG 4.34Å; C304-L340 WeakPolarHBondContact SG-CD2 3.17Å; V308-L340 HydrophobicContact CG2-CD1 4.46Å; V308-L340 HydrophobicContact CG2-CD2 4.08Å; L311-L340 HydrophobicContact CD2-CD1 3.95Å; S312-L340 VanDerWaalsContact CB-O 3.23Å; S312-L340 WeakPolarHBondContact CB-O 3.49Å; S312-L340 PolarHBondContact OG-O 3.05Å; L315-L340 HydrophobicContact CD1-CB 4.1Å; C326-L340 WeakPolarHBondContact O-CB 3.38Å; C326-L340 VanDerWaalsContact O-CD1 3.28Å; C326-L340 WeakPolarHBondContact O-CD1 3.44Å; C326-L340 WeakPolarHBondContact O-CG 3.47Å; L340-E342 PolarHBondContact O-N 3.3Å; L340-V343 WeakPolarHBondContact O-CB 3.39Å; L340-V343 WeakPolarHBondContact O-CG2 3.43Å; L340-V343 PolarHBondContact O-N 3.2Å
341	V	90.1	Very high	91.1	Very high	48 Å²	48	81 Å²	81	29%	0.291	42%	0.422	S	S	.	.	G	3₁₀ helix	trans	-66.7	-21.8	-178.6	-166.4	0	0	0	0	112.7	L315 R316 C326 Y339	L315-V341 HydrophobicContact CB-CG2 4.25Å; L315-V341 HydrophobicContact CD1-CG2 4.38Å; R316-V341 HydrophobicContact CG-CG1 3.52Å; R316-V341 PolarHBondContact NH1-O 3.04Å; C326-V341 HydrophobicContact CB-CG2 3.51Å; C326-V341 VanDerWaalsContact SG-CG2 3.53Å; Y339-V341 PolarHBondContact O-N 3.36Å
342	E	88.6	Confident	91	Very high	115 Å²	115	80.6 Å²	80.6	54%	0.537	42%	0.424	S	S	.	.	G	3₁₀ helix	trans	-88.1	-6.1	179.4	-61	169.7	152.6	0	0	113.2	Y339 L340 D344	Y339-E342 WeakPolarHBondContact CD2-OE2 3.08Å; Y339-E342 PolarHBondContact N-OE2 2.65Å; Y339-E342 PolarHBondContact O-N 3.01Å; Y339-E342 VanDerWaalsContact O-N 3.11Å; L340-E342 PolarHBondContact O-N 3.3Å; E342-D344 PolarHBondContact O-N 2.88Å
343	V	90.7	Very high	90.9	Very high	4 Å²	4	78.6 Å²	78.6	2%	0.024	41%	0.411	C	S	.	.			trans	-75.5	117.9	-177.1	-177.9	0	0	0	0	109.8	C304 V308 S312 R316 L340 F348	C304-V343 HydrophobicContact CB-CG2 4.45Å; V308-V343 HydrophobicContact CG1-CB 4.47Å; V308-V343 HydrophobicContact CG1-CG1 3.88Å; S312-V343 WeakPolarHBondContact CB-O 3.4Å; S312-V343 PolarHBondContact OG-O 3.04Å; R316-V343 PolarHBondContact NH1-O 3.22Å; R316-V343 PolarHBondContact NH2-O 2.56Å; L340-V343 WeakPolarHBondContact O-CB 3.39Å; L340-V343 WeakPolarHBondContact O-CG2 3.43Å; L340-V343 PolarHBondContact O-N 3.2Å; V343-F348 HydrophobicContact CG1-CE2 3.59Å; V343-F348 HydrophobicContact CG1-CZ 4.24Å
344	D	87.1	Confident	91	Very high	64 Å²	64	77.4 Å²	77.4	34%	0.342	40%	0.403	S	S	.	.			trans	-110.2	145.5	-177.6	-175.8	39.6	0	0	0	112.9	E342 T346 T347	E342-D344 PolarHBondContact O-N 2.88Å; D344-T346 PolarHBondContact O-N 3.28Å; D344-T346 VanDerWaalsContact OD2-CB 3.3Å; D344-T346 WeakPolarHBondContact OD2-CB 3.3Å; D344-T346 WeakPolarHBondContact OD2-CG2 3.49Å; D344-T346 PolarHBondContact OD2-N 2.91Å; D344-T346 PolarHBondContact OD2-OG1 2.86Å; D344-T347 PolarHBondContact O-N 2.85Å; D344-T347 VanDerWaalsContact O-N 3.09Å; D344-T347 PolarHBondContact O-OG1 2.99Å
345	Q	82.9	Confident	91.1	Very high	85 Å²	85	71.6 Å²	71.6	40%	0.397	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-59.9	-33	179.9	-173.2	173.2	7.3	0	0	111.8	V309 T347 F348	V309-Q345 HydrophobicContact CG1-CB 3.73Å; V309-Q345 HydrophobicContact CG1-CG 4.09Å; Q345-T347 PolarHBondContact O-N 3.24Å; Q345-F348 PolarHBondContact O-N 3.47Å; Q345-F348 VanDerWaalsContact O-N 3.09Å; Q345-F348 VanDerWaalsContact O-O 3.09Å
346	T	85.4	Confident	91.1	Very high	124 Å²	124	76.7 Å²	76.7	76%	0.761	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-61.9	-16.1	178.2	66.3	0	0	0	0	113.7	D344	D344-T346 PolarHBondContact O-N 3.28Å; D344-T346 VanDerWaalsContact OD2-CB 3.3Å; D344-T346 WeakPolarHBondContact OD2-CB 3.3Å; D344-T346 WeakPolarHBondContact OD2-CG2 3.49Å; D344-T346 PolarHBondContact OD2-N 2.91Å; D344-T346 PolarHBondContact OD2-OG1 2.86Å
347	T	86.6	Confident	91.1	Very high	66 Å²	66	72.3 Å²	72.3	41%	0.405	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-84.7	-5.7	178.2	68.3	0	0	0	0	114.3	M335 D344 Q345	M335-T347 HydrophobicContact CE-CG2 4.37Å; M335-T347 WeakPolarHBondContact CE-OG1 3.21Å; D344-T347 PolarHBondContact O-N 2.85Å; D344-T347 VanDerWaalsContact O-N 3.09Å; D344-T347 PolarHBondContact O-OG1 2.99Å; Q345-T347 PolarHBondContact O-N 3.24Å
348	F	89.1	Confident	91.2	Very high	44 Å²	44	72.4 Å²	72.4	19%	0.193	39%	0.389	C	S	.	.			trans	-133.8	140.2	-179.5	-55	-78.6	0	0	0	113	C304 V309 M335 V343 Q345 C350	C304-F348 VanDerWaalsContact O-CE1 3.31Å; C304-F348 WeakPolarHBondContact O-CE1 3.49Å; C304-F348 WeakPolarHBondContact O-CZ 3.42Å; V309-F348 HydrophobicContact CG2-CD2 3.78Å; V309-F348 HydrophobicContact CG2-CE2 4.13Å; M335-F348 HydrophobicContact CE-CE1 4.16Å; M335-F348 HydrophobicContact CE-CE2 4.26Å; M335-F348 HydrophobicContact CE-CZ 3.69Å; M335-F348 HydrophobicContact CG-CZ 4.46Å; V343-F348 HydrophobicContact CG1-CE2 3.59Å; V343-F348 HydrophobicContact CG1-CZ 4.24Å; Q345-F348 PolarHBondContact O-N 3.47Å; Q345-F348 VanDerWaalsContact O-N 3.09Å; Q345-F348 VanDerWaalsContact O-O 3.09Å; F348-C350 VanDerWaalsContact CB-SG 3.59Å; F348-C350 PolarHBondContact O-N 2.56Å
349	Q	90.8	Very high	91.4	Very high	204 Å²	204	67.1 Å²	67.1	95%	0.953	37%	0.37	S	S	*	.			trans	-95.5	87.7	171.7	-168.9	169.4	10.1	0	0	110.1
350	C	91.8	Very high	91.7	Very high	35 Å²	35	71.8 Å²	71.8	24%	0.236	39%	0.387	C	S	.	.			trans	-90.3	147.2	-174.2	-55.4	0	0	0	0	113.1	C306 F348 A430	C306-C350 VanDerWaalsContact CA-SG 3.58Å; C306-C350 HydrophobicContact CB-CB 3.84Å; C306-C350 WeakPolarHBondContact CB-SG 3.38Å; C306-C350 WeakPolarHBondContact SG-CA 3.39Å; C306-C350 WeakPolarHBondContact SG-CB 3.31Å; C306-C350 CovalentContact SG-SG 2.04Å; C306-C350 PolarHBondContact SG-SG 3.34Å; F348-C350 VanDerWaalsContact CB-SG 3.59Å; F348-C350 PolarHBondContact O-N 2.56Å; C350-A430 HydrophobicContact CB-CB 3.87Å
351	S	92.5	Very high	91.9	Very high	88 Å²	88	77.6 Å²	77.6	62%	0.615	42%	0.418	S	S	*	.			trans	-111.2	149.5	178.1	60.9	0	0	0	0	112.5	N428 A430	S351-N428 PolarHBondContact O-ND2 3.44Å; S351-A430 VanDerWaalsContact C-CB 3.44Å; S351-A430 WeakPolarHBondContact O-CB 3.26Å
352	A	93.5	Very high	92.1	Very high	45 Å²	45	77.8 Å²	77.8	37%	0.372	42%	0.418	S	S	.	.			trans	-54.1	153.6	169.2	0	0	0	0	0	111.7	V354	A352-V354 PolarHBondContact O-N 2.98Å
353	P	95.1	Very high	92.5	Very high	4 Å²	4	78.4 Å²	78.4	3%	0.026	42%	0.424	C	S	.	.			trans	-78.6	115.4	-166.5	30.6	-33.7	0	0	0	111.8	I355 V426 N428 G431 S433	P353-I355 PolarHBondContact O-N 2.85Å; P353-V426 HydrophobicContact CB-CG1 3.68Å; P353-V426 HydrophobicContact CG-CB 4.22Å; P353-V426 HydrophobicContact CG-CG1 3.81Å; P353-N428 HydrophobicContact CB-CB 4.29Å; P353-N428 HydrophobicContact CG-CB 4.49Å; P353-G431 VanDerWaalsContact CD-O 3.26Å; P353-G431 WeakPolarHBondContact CD-O 3.38Å; P353-S433 VanDerWaalsContact O-CB 3.27Å; P353-S433 WeakPolarHBondContact O-CB 3.38Å; P353-S433 PolarHBondContact O-OG 2.87Å
354	V	94.4	Very high	92.6	Very high	96 Å²	96	79.3 Å²	79.3	58%	0.582	43%	0.429	S	S	*	.			trans	-71	130.5	179.2	-176.2	0	0	0	0	110.5	A352 L356 T376	A352-V354 PolarHBondContact O-N 2.98Å; V354-L356 HydrophobicContact CG1-CD2 4.06Å; V354-T376 WeakPolarHBondContact O-CB 3.19Å; V354-T376 PolarHBondContact O-OG1 3.45Å
355	I	95.8	Very high	92.9	Very high	30 Å²	30	77 Å²	77	15%	0.154	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	110.9	166.4	-56	175.4	0	0	0	106.8	P353 A358 R375 V426 A435	P353-I355 PolarHBondContact O-N 2.85Å; I355-A358 HydrophobicContact CG2-CB 4.06Å; I355-R375 CarbonylContact C-O 3.58Å; I355-V426 HydrophobicContact CD1-CG2 3.99Å; I355-V426 HydrophobicContact CG1-CB 4.45Å; I355-V426 HydrophobicContact CG1-CG2 3.88Å; I355-A435 HydrophobicContact CD1-CB 3.69Å
356	L	93.5	Very high	93.4	Very high	126 Å²	126	74.2 Å²	74.2	66%	0.66	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.7	-55.5	-174.5	-60	171.7	0	0	0	111.1	V354 R375	V354-L356 HydrophobicContact CG1-CD2 4.06Å; L356-R375 PolarHBondContact N-O 3.3Å
357	D	94.7	Very high	93.7	Very high	63 Å²	63	72.1 Å²	72.1	34%	0.337	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	91.3	170.8	-68.6	-42.1	0	0	0	107.9	K373 C374 R375	D357-K373 HydrophobicContact CB-CB 4.14Å; D357-K373 CarbonylContact O-C 3.51Å; D357-C374 CarbonylContact O-C 3.57Å; D357-C374 WeakPolarHBondContact O-CA 3.06Å; D357-C374 PolarHBondContact O-N 2.89Å; D357-R375 HydrophobicContact CB-CB 3.91Å; D357-R375 HydrophobicContact CB-CG 4.05Å; D357-R375 PolarHBondContact O-N 3.41Å; D357-R375 VanDerWaalsContact O-N 3.09Å; D357-R375 VanDerWaalsContact OD2-CD 3.24Å; D357-R375 WeakPolarHBondContact OD2-CD 3.49Å; D357-R375 IonicContact OD2-CZ 3.29Å; D357-R375 IonicContact OD2-NE 3.62Å; D357-R375 IonicContact OD2-NH1 3.48Å; D357-R375 PolarHBondContact OD2-NH1 3.25Å
358	A	95.5	Very high	93.9	Very high	46 Å²	46	76.5 Å²	76.5	38%	0.38	41%	0.413	S	S	.	.			trans	-70	149.1	174	0	0	0	0	0	111.5	I355 K373 A435	I355-A358 HydrophobicContact CG2-CB 4.06Å; A358-K373 CarbonylContact C-O 3.59Å; A358-A435 HydrophobicContact CB-CB 4.28Å
359	P	97.3	Very high	94.2	Very high	13 Å²	13	79 Å²	79	8%	0.084	43%	0.432	C	S	.	.			trans	-64.9	155.5	176.8	27.8	-34.7	0	0	0	111.1	M372 K373 W384 A435 A437	P359-M372 HydrophobicContact CB-CB 4.48Å; P359-K373 WeakPolarHBondContact CA-O 3.34Å; P359-K373 VanDerWaalsContact CB-O 3.29Å; P359-K373 WeakPolarHBondContact CB-O 3.31Å; P359-K373 VanDerWaalsContact CD-O 3.24Å; P359-K373 WeakPolarHBondContact CD-O 3.19Å; P359-W384 HydrophobicContact CB-CH2 3.95Å; P359-W384 HydrophobicContact CG-CH2 4.11Å; P359-A435 HydrophobicContact CG-CB 4.13Å; P359-A437 HydrophobicContact CB-CB 3.83Å; P359-A437 HydrophobicContact CG-CB 4.23Å
360	R	97.1	Very high	94.4	Very high	208 Å²	208	69.5 Å²	69.5	79%	0.785	39%	0.389	S	S	*	.			trans	-131.9	153.3	-179.1	-57.3	-176.1	-172.9	-173.4	1.6	109.4
361	D	97.5	Very high	94.6	Very high	122 Å²	122	72.2 Å²	72.2	65%	0.652	40%	0.398	S	S	*	.			trans	-61.5	137	178.9	-56	-32.5	0	0	0	110.6	A437 Y438	D361-A437 WeakPolarHBondContact OD1-CA 3.41Å; D361-Y438 VanDerWaalsContact CA-O 3.29Å; D361-Y438 WeakPolarHBondContact CA-O 3.45Å; D361-Y438 PolarHBondContact OD1-N 3.46Å
362	L	95.5	Very high	94.8	Very high	52 Å²	52	68.2 Å²	68.2	27%	0.272	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	112.5	-171.1	-176.7	63.2	0	0	0	111.1	I364 A370 Y438 L439 N440	L362-I364 HydrophobicContact CG-CB 4.33Å; L362-I364 HydrophobicContact CG-CG2 4.4Å; L362-A370 HydrophobicContact CD2-CB 3.99Å; L362-Y438 PolarHBondContact N-O 2.73Å; L362-L439 HydrophobicContact CB-CD1 4Å; L362-L439 HydrophobicContact CD2-CD1 3.94Å; L362-L439 HydrophobicContact CG-CD1 4.13Å; L362-N440 PolarHBondContact O-N 3.06Å
363	N	95.3	Very high	95	Very high	127 Å²	127	68.8 Å²	68.8	68%	0.679	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.8	119.1	167.5	-65	-42.7	0	0	0	108.9	N440	N363-N440 VanDerWaalsContact OD1-CB 3.32Å; N363-N440 WeakPolarHBondContact OD1-CB 3.46Å; N363-N440 PolarHBondContact OD1-ND2 3.35Å
364	I	93.9	Very high	95.1	Very high	23 Å²	23	68.6 Å²	68.6	12%	0.118	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	147.2	-177	-169.9	165.7	0	0	0	111.8	L362 R368 V369 A370 V414 L439 N440 V441 S442	L362-I364 HydrophobicContact CG-CB 4.33Å; L362-I364 HydrophobicContact CG-CG2 4.4Å; I364-R368 HydrophobicContact CD1-CB 3.79Å; I364-R368 HydrophobicContact CG1-CB 4.05Å; I364-V369 VanDerWaalsContact CD1-O 3.3Å; I364-V369 WeakPolarHBondContact CD1-O 3.38Å; I364-A370 HydrophobicContact CD1-CB 3.98Å; I364-V414 HydrophobicContact CG1-CG2 4.48Å; I364-V414 HydrophobicContact CG2-CG2 3.99Å; I364-L439 HydrophobicContact CG2-CD1 3.86Å; I364-N440 PolarHBondContact N-O 2.81Å; I364-V441 HydrophobicContact CG2-CG2 4.2Å; I364-V441 VanDerWaalsContact O-CA 3.32Å; I364-V441 WeakPolarHBondContact O-CA 3.25Å; I364-S442 PolarHBondContact O-N 3.23Å
365	S	93.6	Very high	95.1	Very high	17 Å²	17	69.1 Å²	69.1	12%	0.119	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	144.3	173.2	66.3	0	0	0	0	111.8	R368 S442	S365-R368 VanDerWaalsContact OG-CD 3.26Å; S365-R368 WeakPolarHBondContact OG-CD 3.01Å; S365-R368 PolarHBondContact OG-NE 3.05Å; S365-S442 CarbonylContact C-O 3.56Å; S365-S442 VanDerWaalsContact CA-O 3.29Å; S365-S442 WeakPolarHBondContact CA-O 3Å
366	A	92.8	Very high	95.1	Very high	26 Å²	26	68.4 Å²	68.4	22%	0.215	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-45.9	152.6	173.1	0	0	0	0	0	114	R368 P416 V441 S442	A366-R368 PolarHBondContact O-N 3.09Å; A366-P416 HydrophobicContact CB-CG 4.27Å; A366-V441 HydrophobicContact CB-CG1 4.19Å; A366-S442 PolarHBondContact N-O 3.43Å
367	A	90.8	Very high	95	Very high	79 Å²	79	64.8 Å²	64.8	65%	0.653	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.6	5.9	-178.3	0	0	0	0	0	117	V414	A367-V414 PolarHBondContact N-O 2.96Å
368	R	92.6	Very high	94.8	Very high	158 Å²	158	64.9 Å²	64.9	60%	0.596	35%	0.349	S	S	*	.	S	Bend	trans	-85.4	159.5	170	-67.4	-171.1	-178.7	173.3	7.7	112.8	I364 S365 A366 N413 V414	I364-R368 HydrophobicContact CD1-CB 3.79Å; I364-R368 HydrophobicContact CG1-CB 4.05Å; S365-R368 VanDerWaalsContact OG-CD 3.26Å; S365-R368 WeakPolarHBondContact OG-CD 3.01Å; S365-R368 PolarHBondContact OG-NE 3.05Å; A366-R368 PolarHBondContact O-N 3.09Å; R368-N413 CarbonylContact O-C 3.48Å; R368-N413 WeakPolarHBondContact O-CA 3.29Å; R368-V414 WeakPolarHBondContact O-CG2 3.49Å; R368-V414 PolarHBondContact O-N 3.43Å
369	V	94.7	Very high	94.8	Very high	97 Å²	97	64.2 Å²	64.2	59%	0.588	34%	0.338	S	S	*	.			trans	-70	142.6	165.5	176.8	0	0	0	0	109.3	I364 F411 S412	I364-V369 VanDerWaalsContact CD1-O 3.3Å; I364-V369 WeakPolarHBondContact CD1-O 3.38Å; V369-F411 WeakPolarHBondContact CA-O 3.46Å; V369-F411 WeakPolarHBondContact CG1-O 3.24Å; V369-S412 WeakPolarHBondContact CG2-O 3.49Å
370	A	95.1	Very high	94.7	Very high	5 Å²	5	63.7 Å²	63.7	4%	0.041	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	150.1	174.2	0	0	0	0	0	111.7	L362 I364 F411 V414	L362-A370 HydrophobicContact CD2-CB 3.99Å; I364-A370 HydrophobicContact CD1-CB 3.98Å; A370-F411 HydrophobicContact CB-CB 4.12Å; A370-F411 HydrophobicContact CB-CD2 4.06Å; A370-F411 HydrophobicContact CB-CG 4.29Å; A370-F411 PolarHBondContact N-O 3.24Å; A370-F411 PolarHBondContact O-N 2.77Å; A370-V414 HydrophobicContact CB-CG1 3.49Å; A370-V414 VanDerWaalsContact CB-CG1 3.49Å
371	E	96.2	Very high	94.7	Very high	92 Å²	92	54.3 Å²	54.3	43%	0.43	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	126.9	174.6	-65.5	-168.9	126.6	0	0	110.6	K373 T408 L409	E371-K373 IonicContact OE1-NZ 3.53Å; E371-K373 PolarHBondContact OE1-NZ 3.28Å; E371-K373 VanDerWaalsContact OE2-CE 3.25Å; E371-K373 WeakPolarHBondContact OE2-CE 3.42Å; E371-K373 IonicContact OE2-NZ 3.85Å; E371-K373 PolarHBondContact OE2-NZ 3.26Å; E371-T408 HydrophobicContact CB-CG2 3.92Å; E371-T408 HydrophobicContact CG-CG2 4.34Å; E371-L409 CarbonylContact C-O 3.58Å; E371-L409 WeakPolarHBondContact CA-O 3.47Å
372	M	96.7	Very high	94.7	Very high	3 Å²	3	48.6 Å²	48.6	2%	0.015	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	105.3	170.5	-56.4	-176.8	78	0	0	108.3	P359 W384 T408 L409 F411 Y422 A437 L439	P359-M372 HydrophobicContact CB-CB 4.48Å; M372-W384 HydrophobicContact CB-CH2 3.68Å; M372-W384 HydrophobicContact CB-CZ2 4.29Å; M372-W384 HydrophobicContact CB-CZ3 4.33Å; M372-W384 VanDerWaalsContact O-CZ2 3.31Å; M372-W384 WeakPolarHBondContact O-CZ2 3.23Å; M372-T408 WeakPolarHBondContact O-CA 3.42Å; M372-L409 HydrophobicContact CB-CB 4.31Å; M372-L409 PolarHBondContact N-O 3.09Å; M372-L409 PolarHBondContact O-N 2.67Å; M372-F411 HydrophobicContact CG-CE2 4.15Å; M372-F411 HydrophobicContact SD-CE2 4.1Å; M372-F411 HydrophobicContact SD-CZ 4.32Å; M372-Y422 HydrophobicContact CE-CD2 4.37Å; M372-Y422 HydrophobicContact CE-CG 4.35Å; M372-Y422 HydrophobicContact SD-CD1 4.38Å; M372-Y422 HydrophobicContact SD-CD2 4.02Å; M372-Y422 HydrophobicContact SD-CG 3.85Å; M372-A437 HydrophobicContact CE-CB 3.78Å; M372-L439 HydrophobicContact CE-CB 4.47Å; M372-L439 HydrophobicContact SD-CB 4.28Å
373	K	96.9	Very high	94.8	Very high	58 Å²	58	51 Å²	51	25%	0.252	28%	0.276	S	S	.	.			trans	-67.2	141.1	-176.5	-59.4	-59.1	173.7	-170.5	0	111.1	D357 A358 P359 E371 T408	D357-K373 HydrophobicContact CB-CB 4.14Å; D357-K373 CarbonylContact O-C 3.51Å; A358-K373 CarbonylContact C-O 3.59Å; P359-K373 WeakPolarHBondContact CA-O 3.34Å; P359-K373 VanDerWaalsContact CB-O 3.29Å; P359-K373 WeakPolarHBondContact CB-O 3.31Å; P359-K373 VanDerWaalsContact CD-O 3.24Å; P359-K373 WeakPolarHBondContact CD-O 3.19Å; E371-K373 IonicContact OE1-NZ 3.53Å; E371-K373 PolarHBondContact OE1-NZ 3.28Å; E371-K373 VanDerWaalsContact OE2-CE 3.25Å; E371-K373 WeakPolarHBondContact OE2-CE 3.42Å; E371-K373 IonicContact OE2-NZ 3.85Å; E371-K373 PolarHBondContact OE2-NZ 3.26Å; K373-T408 HydrophobicContact CD-CG2 3.86Å; K373-T408 VanDerWaalsContact CD-OG1 3.24Å; K373-T408 WeakPolarHBondContact CD-OG1 3.23Å
374	C	96.9	Very high	94.9	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.244	C	C	.	.			trans	-149.8	65.8	167.5	-173.6	0	0	0	0	109.5	D357 W384 G407 C424	D357-C374 CarbonylContact O-C 3.57Å; D357-C374 WeakPolarHBondContact O-CA 3.06Å; D357-C374 PolarHBondContact O-N 2.89Å; C374-W384 HydrophobicContact CB-CH2 4.33Å; C374-W384 HydrophobicContact CB-CZ2 3.52Å; C374-G407 WeakPolarHBondContact O-CA 3.09Å; C374-C424 HydrophobicContact CB-CB 3.62Å; C374-C424 WeakPolarHBondContact CB-SG 3.39Å; C374-C424 WeakPolarHBondContact SG-CB 3.18Å; C374-C424 CovalentContact SG-SG 2.02Å; C374-C424 PolarHBondContact SG-SG 3.3Å
375	R	95.8	Very high	95.1	Very high	106 Å²	106	46.8 Å²	46.8	40%	0.4	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	136.4	-176.6	-64.3	-158.9	-177.2	126.4	-14.1	111.6	I355 L356 D357 D406	I355-R375 CarbonylContact C-O 3.58Å; L356-R375 PolarHBondContact N-O 3.3Å; D357-R375 HydrophobicContact CB-CB 3.91Å; D357-R375 HydrophobicContact CB-CG 4.05Å; D357-R375 PolarHBondContact O-N 3.41Å; D357-R375 VanDerWaalsContact O-N 3.09Å; D357-R375 VanDerWaalsContact OD2-CD 3.24Å; D357-R375 WeakPolarHBondContact OD2-CD 3.49Å; D357-R375 IonicContact OD2-CZ 3.29Å; D357-R375 IonicContact OD2-NE 3.62Å; D357-R375 IonicContact OD2-NH1 3.48Å; D357-R375 PolarHBondContact OD2-NH1 3.25Å; R375-D406 WeakPolarHBondContact CA-O 3.4Å; R375-D406 IonicContact CZ-OD2 2.69Å; R375-D406 IonicContact NE-OD2 2.68Å; R375-D406 PolarHBondContact NE-OD2 3.03Å; R375-D406 IonicContact NH2-OD2 3.64Å
376	T	94.6	Very high	95.3	Very high	15 Å²	15	46.5 Å²	46.5	9%	0.092	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	179.1	-179.7	-169.6	0	0	0	0	110.2	V354 V382 V426	V354-T376 WeakPolarHBondContact O-CB 3.19Å; V354-T376 PolarHBondContact O-OG1 3.45Å; T376-V382 HydrophobicContact CG2-CG2 3.59Å; T376-V426 HydrophobicContact CG2-CG1 3.73Å; T376-V426 HydrophobicContact CG2-CG2 4.16Å
377	A	92.5	Very high	95.5	Very high	51 Å²	51	48.3 Å²	48.3	42%	0.421	26%	0.26	S	S	.	.			trans	-56.6	138.6	178.8	0	0	0	0	0	111.8	R259 M379 S380	R259-A377 PolarHBondContact NH2-O 3.35Å; A377-M379 PolarHBondContact O-N 3.45Å; A377-M379 VanDerWaalsContact O-N 3.15Å; A377-S380 PolarHBondContact O-N 2.86Å
378	A	90.5	Very high	95.6	Very high	64 Å²	64	49.9 Å²	49.9	53%	0.529	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-35.4	-171.8	0	0	0	0	0	113.7	R259	R259-A378 PolarHBondContact NE-O 2.93Å; R259-A378 PolarHBondContact NH2-O 2.88Å
379	M	94.4	Very high	95.7	Very high	33 Å²	33	44.9 Å²	44.9	16%	0.163	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-12.3	-179.6	-57.2	-64.5	95	0	0	113.7	L281 P282 H283 D307 A377	L281-M379 VanDerWaalsContact C-SD 3.55Å; P282-M379 HydrophobicContact CG-CE 4.32Å; H283-M379 VanDerWaalsContact CB-O 3.24Å; H283-M379 WeakPolarHBondContact CB-O 3.48Å; H283-M379 PolarHBondContact N-O 2.86Å; D307-M379 HydrophobicContact CB-CB 3.97Å; D307-M379 HydrophobicContact CB-CG 4.04Å; D307-M379 WeakPolarHBondContact OD2-CB 3.29Å; D307-M379 VanDerWaalsContact OD2-CG 3.29Å; D307-M379 WeakPolarHBondContact OD2-CG 3.36Å; A377-M379 PolarHBondContact O-N 3.45Å; A377-M379 VanDerWaalsContact O-N 3.15Å
380	S	96.1	Very high	95.8	Very high	2 Å²	2	43.3 Å²	43.3	1%	0.014	25%	0.246	C	C	.	.	S	Bend	trans	-72.8	132.7	177.3	-64.9	0	0	0	0	110.9	R259 A377	R259-S380 PolarHBondContact NE-O 3.48Å; A377-S380 PolarHBondContact O-N 2.86Å
381	S	96.8	Very high	95.9	Very high	10 Å²	10	46.4 Å²	46.4	7%	0.07	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	130.7	-179.6	51.3	0	0	0	0	111	H283 V426 S427	H283-S381 PolarHBondContact ND1-OG 3.08Å; H283-S381 WeakPolarHBondContact O-CB 3.4Å; S381-V426 WeakPolarHBondContact O-CA 3.45Å; S381-S427 PolarHBondContact N-O 3.43Å; S381-S427 PolarHBondContact O-N 2.93Å; S381-S427 PolarHBondContact OG-O 3.2Å; S381-S427 VanDerWaalsContact OG-O 3.08Å; S381-S427 PolarHBondContact OG-OG 3.1Å
382	V	97.4	Very high	95.9	Very high	2 Å²	2	42.7 Å²	42.7	1%	0.012	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	135.5	-177.7	-177.8	0	0	0	0	109.9	T376 V426	T376-V382 HydrophobicContact CG2-CG2 3.59Å; V382-V426 HydrophobicContact CG2-CG1 4.46Å; V382-V426 HydrophobicContact CG2-CG2 4.26Å
383	R	97.4	Very high	95.9	Very high	104 Å²	104	43.4 Å²	43.4	39%	0.392	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	148.6	173.8	-53.6	-175.3	-172.3	167.4	2.9	109.4	V391 L392 T393 M425	R383-V391 HydrophobicContact CB-CG1 3.9Å; R383-L392 CarbonylContact C-O 3.53Å; R383-L392 WeakPolarHBondContact CA-O 3.32Å; R383-T393 HydrophobicContact CG-CG2 4.3Å; R383-M425 HydrophobicContact CB-CE 4.07Å; R383-M425 PolarHBondContact N-O 3.46Å; R383-M425 PolarHBondContact O-N 2.98Å
384	W	98.1	Very high	95.8	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	123.1	177.4	-83	90.1	0	0	0	111	P359 M372 C374 L386 V391 L392 V403 G407 L409 T423 C424	P359-W384 HydrophobicContact CB-CH2 3.95Å; P359-W384 HydrophobicContact CG-CH2 4.11Å; M372-W384 HydrophobicContact CB-CH2 3.68Å; M372-W384 HydrophobicContact CB-CZ2 4.29Å; M372-W384 HydrophobicContact CB-CZ3 4.33Å; M372-W384 VanDerWaalsContact O-CZ2 3.31Å; M372-W384 WeakPolarHBondContact O-CZ2 3.23Å; C374-W384 HydrophobicContact CB-CH2 4.33Å; C374-W384 HydrophobicContact CB-CZ2 3.52Å; W384-L386 HydrophobicContact CB-CD1 4.36Å; W384-V391 CarbonylContact O-C 3.46Å; W384-V391 VanDerWaalsContact O-CA 3.29Å; W384-V391 WeakPolarHBondContact O-CA 3.36Å; W384-L392 PolarHBondContact N-O 3.26Å; W384-L392 PolarHBondContact O-N 2.04Å; W384-V403 HydrophobicContact CB-CG2 4.39Å; W384-V403 HydrophobicContact CG-CG2 4.34Å; W384-G407 PolarHBondContact NE1-O 2.84Å; W384-L409 HydrophobicContact CB-CD1 4.12Å; W384-L409 HydrophobicContact CD2-CB 3.86Å; W384-L409 HydrophobicContact CD2-CD1 4.37Å; W384-L409 HydrophobicContact CD2-CD2 4.06Å; W384-L409 HydrophobicContact CD2-CG 4.34Å; W384-L409 HydrophobicContact CE3-CB 4.33Å; W384-L409 HydrophobicContact CE3-CD2 3.94Å; W384-L409 HydrophobicContact CG-CB 4.24Å; W384-L409 HydrophobicContact CG-CD1 3.96Å; W384-L409 HydrophobicContact CG-CD2 4.37Å; W384-L409 HydrophobicContact CG-CG 4.44Å; W384-L409 HydrophobicContact CH2-CB 4.26Å; W384-L409 HydrophobicContact CZ2-CB 3.81Å; W384-L409 HydrophobicContact CZ3-CD2 4.39Å; W384-T423 WeakPolarHBondContact CA-O 3.4Å; W384-C424 HydrophobicContact CD2-CB 4.03Å; W384-C424 HydrophobicContact CE3-CB 4.12Å; W384-C424 HydrophobicContact CH2-CB 3.89Å; W384-C424 HydrophobicContact CZ2-CB 3.77Å; W384-C424 HydrophobicContact CZ3-CB 4.04Å
385	L	98.2	Very high	95.7	Very high	60 Å²	60	44 Å²	44	31%	0.314	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	123.7	168.6	-177.8	66.1	0	0	0	109.1	V391 T423 M425	L385-V391 HydrophobicContact CD1-CG2 3.89Å; L385-T423 PolarHBondContact N-O 3.35Å; L385-T423 PolarHBondContact O-N 2.91Å; L385-M425 HydrophobicContact CB-CE 3.8Å; L385-M425 HydrophobicContact CB-SD 4.32Å
386	L	97.1	Very high	95.6	Very high	11 Å²	11	40.7 Å²	40.7	6%	0.058	25%	0.251	C	S	.	.			trans	-88.5	160.6	177	-86.8	55.3	0	0	0	111.2	W384 N388 G389 T390 L392 I401 Y422	W384-L386 HydrophobicContact CB-CD1 4.36Å; L386-N388 WeakPolarHBondContact CB-OD1 3.28Å; L386-N388 PolarHBondContact O-N 3.43Å; L386-G389 PolarHBondContact O-N 3.03Å; L386-T390 PolarHBondContact N-O 3.44Å; L386-L392 HydrophobicContact CD1-CB 4.44Å; L386-L392 HydrophobicContact CD1-CD1 3.83Å; L386-L392 HydrophobicContact CD1-CG 3.85Å; L386-L392 HydrophobicContact CD2-CD1 3.87Å; L386-L392 HydrophobicContact CD2-CG 4.17Å; L386-I401 HydrophobicContact CD2-CD1 4.38Å; L386-Y422 HydrophobicContact CB-CE1 4.45Å; L386-Y422 HydrophobicContact CD1-CD1 4.17Å; L386-Y422 HydrophobicContact CD1-CE1 4.22Å; L386-Y422 HydrophobicContact CG-CD1 4.09Å; L386-Y422 HydrophobicContact CG-CE1 3.73Å
387	P	95.8	Very high	95.4	Very high	64 Å²	64	43.1 Å²	43.1	42%	0.416	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-24.3	178.5	-24.4	31.4	0	0	0	114.7	G389 V421 Y422	P387-G389 VanDerWaalsContact C-N 3.32Å; P387-V421 WeakPolarHBondContact CG-O 3.05Å; P387-Y422 VanDerWaalsContact CD-CZ 3.46Å; P387-Y422 HydrophobicContact CG-CD2 3.9Å; P387-Y422 HydrophobicContact CG-CE1 4.44Å; P387-Y422 HydrophobicContact CG-CE2 3.47Å; P387-Y422 VanDerWaalsContact CG-CE2 3.47Å; P387-Y422 HydrophobicContact CG-CG 4.5Å
388	N	94.3	Very high	95.4	Very high	112 Å²	112	44.1 Å²	44.1	60%	0.599	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	3.6	177.5	68.7	-5.4	0	0	0	114.1	L386 T390	L386-N388 WeakPolarHBondContact CB-OD1 3.28Å; L386-N388 PolarHBondContact O-N 3.43Å; N388-T390 VanDerWaalsContact C-N 3.32Å; N388-T390 PolarHBondContact ND2-OG1 3.1Å; N388-T390 PolarHBondContact O-N 3Å; N388-T390 WeakPolarHBondContact OD1-CB 3.39Å; N388-T390 PolarHBondContact OD1-N 3.17Å; N388-T390 PolarHBondContact OD1-OG1 3.2Å
389	G	94.7	Very high	95.5	Very high	53 Å²	53	46.7 Å²	46.7	55%	0.546	28%	0.281	S	S	.	.	S	Bend	trans	81.5	-2.8	-177	0	0	0	0	0	115.6	L386 P387	L386-G389 PolarHBondContact O-N 3.03Å; P387-G389 VanDerWaalsContact C-N 3.32Å
390	T	96.1	Very high	95.5	Very high	64 Å²	64	47.5 Å²	47.5	39%	0.393	28%	0.282	S	S	.	.			trans	-76	143.1	176.1	63.3	0	0	0	0	111.3	L386 N388	L386-T390 PolarHBondContact N-O 3.44Å; N388-T390 VanDerWaalsContact C-N 3.32Å; N388-T390 PolarHBondContact ND2-OG1 3.1Å; N388-T390 PolarHBondContact O-N 3Å; N388-T390 WeakPolarHBondContact OD1-CB 3.39Å; N388-T390 PolarHBondContact OD1-N 3.17Å; N388-T390 PolarHBondContact OD1-OG1 3.2Å
391	V	96.8	Very high	95.5	Very high	70 Å²	70	47.6 Å²	47.6	42%	0.424	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	124.4	178.3	-179.7	0	0	0	0	109.7	R383 W384 L385 M425	R383-V391 HydrophobicContact CB-CG1 3.9Å; W384-V391 CarbonylContact O-C 3.46Å; W384-V391 VanDerWaalsContact O-CA 3.29Å; W384-V391 WeakPolarHBondContact O-CA 3.36Å; L385-V391 HydrophobicContact CD1-CG2 3.89Å; V391-M425 HydrophobicContact CG1-CE 4.17Å; V391-M425 HydrophobicContact CG2-CE 4.3Å
392	L	96.9	Very high	95.5	Very high	14 Å²	14	49.3 Å²	49.3	7%	0.073	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	150.5	172.6	-59	-175.4	0	0	0	111.6	R383 W384 L386 H398 I401 V403 L409	R383-L392 CarbonylContact C-O 3.53Å; R383-L392 WeakPolarHBondContact CA-O 3.32Å; W384-L392 PolarHBondContact N-O 3.26Å; W384-L392 PolarHBondContact O-N 2.04Å; L386-L392 HydrophobicContact CD1-CB 4.44Å; L386-L392 HydrophobicContact CD1-CD1 3.83Å; L386-L392 HydrophobicContact CD1-CG 3.85Å; L386-L392 HydrophobicContact CD2-CD1 3.87Å; L386-L392 HydrophobicContact CD2-CG 4.17Å; L392-H398 HydrophobicContact CD1-CB 4.47Å; L392-H398 HydrophobicContact CD2-CB 4.17Å; L392-I401 HydrophobicContact CD1-CB 4.16Å; L392-I401 HydrophobicContact CD1-CG2 3.89Å; L392-V403 HydrophobicContact CB-CG2 3.99Å; L392-L409 HydrophobicContact CD1-CD1 4.35Å
393	T	96	Very high	95.5	Very high	18 Å²	18	49.5 Å²	49.5	11%	0.11	30%	0.295	C	S	.	.			trans	-132.5	175.7	-179.7	57.1	0	0	0	0	109.1	R383 S395 S396	R383-T393 HydrophobicContact CG-CG2 4.3Å; T393-S395 PolarHBondContact O-N 2.78Å; T393-S395 PolarHBondContact OG1-OG 3.18Å; T393-S396 PolarHBondContact N-OG 3.06Å; T393-S396 WeakPolarHBondContact O-CB 3.49Å; T393-S396 PolarHBondContact O-N 3.19Å; T393-S396 VanDerWaalsContact O-N 3.16Å; T393-S396 PolarHBondContact OG1-N 3.47Å; T393-S396 PolarHBondContact OG1-OG 3.19Å
394	H	95.5	Very high	95.4	Very high	40 Å²	40	47.2 Å²	47.2	19%	0.185	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-24	176.7	-172.7	33.7	0	0	0	113	E258 R259 N260 V403	E258-H394 IonicContact OE1-NE2 2.78Å; E258-H394 IonicContact OE2-NE2 2.65Å; R259-H394 HydrophobicContact CB-CB 4.2Å; R259-H394 PolarHBondContact O-CD2 3.48Å; R259-H394 VanDerWaalsContact O-CD2 3.24Å; N260-H394 HydrophobicContact CB-CB 4.31Å; N260-H394 PolarHBondContact OD1-N 3.31Å; H394-V403 PolarHBondContact ND1-O 3.44Å
395	S	94.1	Very high	95.3	Very high	31 Å²	31	49.3 Å²	49.3	22%	0.217	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-13.1	173.1	54.8	0	0	0	0	114.1	N260 D263 T393 A397	N260-S395 WeakPolarHBondContact CB-OG 3.39Å; D263-S395 PolarHBondContact OD2-OG 2.68Å; T393-S395 PolarHBondContact O-N 2.78Å; T393-S395 PolarHBondContact OG1-OG 3.18Å; S395-A397 PolarHBondContact O-N 3.08Å; S395-A397 VanDerWaalsContact O-N 3.14Å
396	S	94.1	Very high	95.1	Very high	36 Å²	36	48.7 Å²	48.7	25%	0.252	30%	0.299	S	S	.	.			trans	-69.5	110	-170.8	-68.8	0	0	0	0	113.9	T393 H398	T393-S396 PolarHBondContact N-OG 3.06Å; T393-S396 WeakPolarHBondContact O-CB 3.49Å; T393-S396 PolarHBondContact O-N 3.19Å; T393-S396 VanDerWaalsContact O-N 3.16Å; T393-S396 PolarHBondContact OG1-N 3.47Å; T393-S396 PolarHBondContact OG1-OG 3.19Å; S396-H398 VanDerWaalsContact C-N 3.25Å; S396-H398 PolarHBondContact O-N 3.12Å
397	A	89.9	Confident	95	Very high	67 Å²	67	48.1 Å²	48.1	55%	0.554	30%	0.296	S	S	*	.			trans	-77.1	51.6	-179.9	0	0	0	0	0	115.3	S395	S395-A397 PolarHBondContact O-N 3.08Å; S395-A397 VanDerWaalsContact O-N 3.14Å
398	H	92.8	Very high	95.1	Very high	72 Å²	72	45.1 Å²	45.1	33%	0.333	28%	0.276	S	S	.	.			trans	-83.5	134.7	176.7	177.8	-90.8	0	0	0	111.4	L392 S396 R400 I401	L392-H398 HydrophobicContact CD1-CB 4.47Å; L392-H398 HydrophobicContact CD2-CB 4.17Å; S396-H398 VanDerWaalsContact C-N 3.25Å; S396-H398 PolarHBondContact O-N 3.12Å; H398-R400 VanDerWaalsContact C-N 3.33Å; H398-R400 PolarHBondContact O-N 2.8Å; H398-I401 WeakPolarHBondContact CB-O 3.37Å; H398-I401 WeakPolarHBondContact ND1-CB 3.21Å; H398-I401 PolarHBondContact ND1-N 3.4Å; H398-I401 VanDerWaalsContact ND1-N 3.19Å
399	P	92.4	Very high	95.2	Very high	118 Å²	118	39.8 Å²	39.8	77%	0.766	25%	0.248	S	C	*	.	S	Bend	trans	-72.1	-14	-163.1	26.9	-37.2	0	0	0	116.6
400	R	95	Very high	95.3	Very high	49 Å²	49	39.1 Å²	39.1	19%	0.185	23%	0.231	C	C	.	.	S	Bend	trans	-126.7	-12	179.6	-63.5	-171.1	-59.5	105.9	0.8	115.3	H398 F411 S412 N413 D418	H398-R400 VanDerWaalsContact C-N 3.33Å; H398-R400 PolarHBondContact O-N 2.8Å; R400-F411 CarbonylContact O-C 3.59Å; R400-F411 WeakPolarHBondContact O-CA 3.29Å; R400-S412 WeakPolarHBondContact CA-OG 3.49Å; R400-S412 PolarHBondContact O-N 3.06Å; R400-S412 PolarHBondContact O-OG 3.15Å; R400-N413 WeakPolarHBondContact CD-OD1 3.32Å; R400-N413 PolarHBondContact NH1-O 2.79Å; R400-D418 IonicContact CZ-OD1 3.73Å; R400-D418 IonicContact CZ-OD2 2.68Å; R400-D418 IonicContact NH1-OD1 3.61Å; R400-D418 IonicContact NH1-OD2 2.7Å; R400-D418 PolarHBondContact NH1-OD2 3.18Å; R400-D418 IonicContact NH2-OD1 2.73Å; R400-D418 PolarHBondContact NH2-OD1 2.89Å; R400-D418 IonicContact NH2-OD2 3.36Å; R400-D418 PolarHBondContact NH2-OD2 3.49Å
401	I	96.4	Very high	95.4	Very high	4 Å²	4	36 Å²	36	2%	0.021	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	128.1	-167.9	-49.7	173	0	0	0	107	L386 L392 H398 L409 N410 F411	L386-I401 HydrophobicContact CD2-CD1 4.38Å; L392-I401 HydrophobicContact CD1-CB 4.16Å; L392-I401 HydrophobicContact CD1-CG2 3.89Å; H398-I401 WeakPolarHBondContact CB-O 3.37Å; H398-I401 WeakPolarHBondContact ND1-CB 3.21Å; H398-I401 PolarHBondContact ND1-N 3.4Å; H398-I401 VanDerWaalsContact ND1-N 3.19Å; I401-L409 HydrophobicContact CG2-CD1 3.55Å; I401-L409 HydrophobicContact CG2-CD2 4.17Å; I401-L409 HydrophobicContact CG2-CG 3.76Å; I401-N410 CarbonylContact C-O 3.59Å; I401-N410 VanDerWaalsContact CA-O 3.31Å; I401-N410 WeakPolarHBondContact CA-O 3.33Å; I401-F411 HydrophobicContact CD1-CD1 3.84Å; I401-F411 HydrophobicContact CD1-CE1 3.66Å; I401-F411 HydrophobicContact CG1-CD1 3.66Å; I401-F411 HydrophobicContact CG1-CE1 3.97Å; I401-F411 HydrophobicContact CG1-CG 4.36Å; I401-F411 HydrophobicContact CG2-CD1 4.28Å; I401-F411 HydrophobicContact CG2-CE1 4.23Å; I401-F411 HydrophobicContact CG2-CG 4.48Å; I401-F411 HydrophobicContact CG2-CZ 4.38Å
402	S	96.2	Very high	95.3	Very high	47 Å²	47	35.7 Å²	35.7	33%	0.329	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	145.4	-177.1	56.2	0	0	0	0	110.6	N410	S402-N410 PolarHBondContact N-O 2.9Å; S402-N410 PolarHBondContact O-N 3.24Å
403	V	97.1	Very high	95.1	Very high	6 Å²	6	37.8 Å²	37.8	4%	0.036	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	127.3	169	-173.8	0	0	0	0	107.5	W384 L392 H394 T408 L409	W384-V403 HydrophobicContact CB-CG2 4.39Å; W384-V403 HydrophobicContact CG-CG2 4.34Å; L392-V403 HydrophobicContact CB-CG2 3.99Å; H394-V403 PolarHBondContact ND1-O 3.44Å; V403-T408 WeakPolarHBondContact CA-O 3.46Å; V403-L409 HydrophobicContact CG2-CD1 3.85Å
404	L	95.9	Very high	95.1	Very high	55 Å²	55	37 Å²	37	29%	0.288	22%	0.22	S	C	.	.			trans	-83.9	159.9	176.1	-55.6	-174.5	0	0	0	111	D406 G407 T408 N410	L404-D406 PolarHBondContact O-N 3.05Å; L404-D406 VanDerWaalsContact O-N 3.14Å; L404-G407 WeakPolarHBondContact O-CA 3.46Å; L404-G407 PolarHBondContact O-N 3.19Å; L404-T408 HydrophobicContact CD1-CG2 4.31Å; L404-T408 PolarHBondContact N-O 3.49Å; L404-N410 HydrophobicContact CD1-CB 4.24Å; L404-N410 HydrophobicContact CD2-CB 4.16Å; L404-N410 HydrophobicContact CG-CB 4.09Å
405	N	94.9	Very high	95	Very high	44 Å²	44	38 Å²	38	24%	0.235	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	1	176.7	-164.7	29.5	0	0	0	114.3	E258 R259	E258-N405 VanDerWaalsContact CG-ND2 3.28Å; E258-N405 WeakPolarHBondContact CG-ND2 3.48Å; E258-N405 WeakPolarHBondContact OE1-CB 3.49Å; E258-N405 VanDerWaalsContact OE1-CG 3.28Å; E258-N405 PolarHBondContact OE1-ND2 3.38Å; R259-N405 PolarHBondContact NH1-O 3.3Å; R259-N405 PolarHBondContact NH1-OD1 3.03Å
406	D	94.6	Very high	95	Very high	47 Å²	47	39.2 Å²	39.2	25%	0.251	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-4.2	162.9	85.9	-20.3	0	0	0	113	R375 L404 T408	R375-D406 WeakPolarHBondContact CA-O 3.4Å; R375-D406 IonicContact CZ-OD2 2.69Å; R375-D406 IonicContact NE-OD2 2.68Å; R375-D406 PolarHBondContact NE-OD2 3.03Å; R375-D406 IonicContact NH2-OD2 3.64Å; L404-D406 PolarHBondContact O-N 3.05Å; L404-D406 VanDerWaalsContact O-N 3.14Å; D406-T408 VanDerWaalsContact CG-OG1 3.29Å; D406-T408 WeakPolarHBondContact OD1-CB 3.42Å; D406-T408 PolarHBondContact OD1-N 3.01Å; D406-T408 PolarHBondContact OD1-OG1 3.17Å; D406-T408 PolarHBondContact OD2-OG1 3.2Å
407	G	95.6	Very high	95	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	25%	0.254	C	S	.	.	S	Bend	trans	96.4	-10.9	-176.7	0	0	0	0	0	114.7	C374 W384 L404	C374-G407 WeakPolarHBondContact O-CA 3.09Å; W384-G407 PolarHBondContact NE1-O 2.84Å; L404-G407 WeakPolarHBondContact O-CA 3.46Å; L404-G407 PolarHBondContact O-N 3.19Å
408	T	96.9	Very high	95.2	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	23%	0.23	C	C	.	.			trans	-62.3	137.7	177.9	-60	0	0	0	0	112.4	E371 M372 K373 V403 L404 D406	E371-T408 HydrophobicContact CB-CG2 3.92Å; E371-T408 HydrophobicContact CG-CG2 4.34Å; M372-T408 WeakPolarHBondContact O-CA 3.42Å; K373-T408 HydrophobicContact CD-CG2 3.86Å; K373-T408 VanDerWaalsContact CD-OG1 3.24Å; K373-T408 WeakPolarHBondContact CD-OG1 3.23Å; V403-T408 WeakPolarHBondContact CA-O 3.46Å; L404-T408 HydrophobicContact CD1-CG2 4.31Å; L404-T408 PolarHBondContact N-O 3.49Å; D406-T408 VanDerWaalsContact CG-OG1 3.29Å; D406-T408 WeakPolarHBondContact OD1-CB 3.42Å; D406-T408 PolarHBondContact OD1-N 3.01Å; D406-T408 PolarHBondContact OD1-OG1 3.17Å; D406-T408 PolarHBondContact OD2-OG1 3.2Å
409	L	97.7	Very high	95.4	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	121.2	165	-167.3	69.7	0	0	0	109.6	E371 M372 W384 L392 I401 V403 F411 Y422	E371-L409 CarbonylContact C-O 3.58Å; E371-L409 WeakPolarHBondContact CA-O 3.47Å; M372-L409 HydrophobicContact CB-CB 4.31Å; M372-L409 PolarHBondContact N-O 3.09Å; M372-L409 PolarHBondContact O-N 2.67Å; W384-L409 HydrophobicContact CB-CD1 4.12Å; W384-L409 HydrophobicContact CD2-CB 3.86Å; W384-L409 HydrophobicContact CD2-CD1 4.37Å; W384-L409 HydrophobicContact CD2-CD2 4.06Å; W384-L409 HydrophobicContact CD2-CG 4.34Å; W384-L409 HydrophobicContact CE3-CB 4.33Å; W384-L409 HydrophobicContact CE3-CD2 3.94Å; W384-L409 HydrophobicContact CG-CB 4.24Å; W384-L409 HydrophobicContact CG-CD1 3.96Å; W384-L409 HydrophobicContact CG-CD2 4.37Å; W384-L409 HydrophobicContact CG-CG 4.44Å; W384-L409 HydrophobicContact CH2-CB 4.26Å; W384-L409 HydrophobicContact CZ2-CB 3.81Å; W384-L409 HydrophobicContact CZ3-CD2 4.39Å; L392-L409 HydrophobicContact CD1-CD1 4.35Å; I401-L409 HydrophobicContact CG2-CD1 3.55Å; I401-L409 HydrophobicContact CG2-CD2 4.17Å; I401-L409 HydrophobicContact CG2-CG 3.76Å; V403-L409 HydrophobicContact CG2-CD1 3.85Å; L409-F411 HydrophobicContact CB-CE2 4.48Å; L409-F411 HydrophobicContact CD2-CE2 3.69Å; L409-F411 HydrophobicContact CD2-CZ 3.71Å; L409-F411 HydrophobicContact CG-CE2 3.88Å; L409-F411 HydrophobicContact CG-CZ 4.3Å; L409-Y422 HydrophobicContact CD2-CD1 3.48Å; L409-Y422 VanDerWaalsContact CD2-CD1 3.48Å; L409-Y422 HydrophobicContact CD2-CE1 3.9Å; L409-Y422 HydrophobicContact CD2-CG 4.43Å
410	N	97.3	Very high	95.6	Very high	39 Å²	39	33 Å²	33	21%	0.209	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	133.1	-178	178.5	15.3	0	0	0	110.6	I401 S402 L404	I401-N410 CarbonylContact C-O 3.59Å; I401-N410 VanDerWaalsContact CA-O 3.31Å; I401-N410 WeakPolarHBondContact CA-O 3.33Å; S402-N410 PolarHBondContact N-O 2.9Å; S402-N410 PolarHBondContact O-N 3.24Å; L404-N410 HydrophobicContact CD1-CB 4.24Å; L404-N410 HydrophobicContact CD2-CB 4.16Å; L404-N410 HydrophobicContact CG-CB 4.09Å
411	F	97.1	Very high	95.8	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	119.8	177.8	-60.9	-112.8	0	0	0	109.6	V369 A370 M372 R400 I401 L409 N413 V414 D418 Y422 L439	V369-F411 WeakPolarHBondContact CA-O 3.46Å; V369-F411 WeakPolarHBondContact CG1-O 3.24Å; A370-F411 HydrophobicContact CB-CB 4.12Å; A370-F411 HydrophobicContact CB-CD2 4.06Å; A370-F411 HydrophobicContact CB-CG 4.29Å; A370-F411 PolarHBondContact N-O 3.24Å; A370-F411 PolarHBondContact O-N 2.77Å; M372-F411 HydrophobicContact CG-CE2 4.15Å; M372-F411 HydrophobicContact SD-CE2 4.1Å; M372-F411 HydrophobicContact SD-CZ 4.32Å; R400-F411 CarbonylContact O-C 3.59Å; R400-F411 WeakPolarHBondContact O-CA 3.29Å; I401-F411 HydrophobicContact CD1-CD1 3.84Å; I401-F411 HydrophobicContact CD1-CE1 3.66Å; I401-F411 HydrophobicContact CG1-CD1 3.66Å; I401-F411 HydrophobicContact CG1-CE1 3.97Å; I401-F411 HydrophobicContact CG1-CG 4.36Å; I401-F411 HydrophobicContact CG2-CD1 4.28Å; I401-F411 HydrophobicContact CG2-CE1 4.23Å; I401-F411 HydrophobicContact CG2-CG 4.48Å; I401-F411 HydrophobicContact CG2-CZ 4.38Å; L409-F411 HydrophobicContact CB-CE2 4.48Å; L409-F411 HydrophobicContact CD2-CE2 3.69Å; L409-F411 HydrophobicContact CD2-CZ 3.71Å; L409-F411 HydrophobicContact CG-CE2 3.88Å; L409-F411 HydrophobicContact CG-CZ 4.3Å; F411-N413 VanDerWaalsContact C-N 3.27Å; F411-N413 PolarHBondContact O-N 3.29Å; F411-V414 HydrophobicContact CB-CG1 3.78Å; F411-V414 HydrophobicContact CD1-CG1 3.96Å; F411-V414 HydrophobicContact CG-CG1 3.94Å; F411-D418 HydrophobicContact CE1-CB 4.41Å; F411-Y422 AromaticContact CE1-CE1 3.99Å; F411-Y422 HydrophobicContact CE1-CE1 3.99Å; F411-Y422 AromaticContact CE1-CZ 3.98Å; F411-Y422 HydrophobicContact CZ-CD1 4.15Å; F411-Y422 AromaticContact CZ-CE1 3.52Å; F411-Y422 HydrophobicContact CZ-CE1 3.52Å; F411-Y422 HydrophobicContact CZ-CE2 4.49Å; F411-Y422 AromaticContact CZ-CZ 3.75Å; F411-L439 HydrophobicContact CE1-CD2 3.82Å; F411-L439 HydrophobicContact CE2-CD2 4.31Å; F411-L439 HydrophobicContact CZ-CD2 3.69Å
412	S	95.1	Very high	95.8	Very high	63 Å²	63	34.3 Å²	34.3	44%	0.441	21%	0.209	S	C	.	.	S	Bend	trans	-63.8	-35	175.4	56.5	0	0	0	0	112.7	V369 R400	V369-S412 WeakPolarHBondContact CG2-O 3.49Å; R400-S412 WeakPolarHBondContact CA-OG 3.49Å; R400-S412 PolarHBondContact O-N 3.06Å; R400-S412 PolarHBondContact O-OG 3.15Å
413	N	93.3	Very high	95.9	Very high	58 Å²	58	33 Å²	33	31%	0.31	20%	0.199	S	C	.	.	S	Bend	trans	-161.5	115.6	177.8	58.2	-51.3	0	0	0	109.2	R368 R400 F411	R368-N413 CarbonylContact O-C 3.48Å; R368-N413 WeakPolarHBondContact O-CA 3.29Å; R400-N413 WeakPolarHBondContact CD-OD1 3.32Å; R400-N413 PolarHBondContact NH1-O 2.79Å; F411-N413 VanDerWaalsContact C-N 3.27Å; F411-N413 PolarHBondContact O-N 3.29Å
414	V	94.6	Very high	96	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	20%	0.197	C	C	.	.			trans	-74.2	143.7	176.4	-62.2	0	0	0	0	112	I364 A367 R368 A370 F411 D418 L439 V441	I364-V414 HydrophobicContact CG1-CG2 4.48Å; I364-V414 HydrophobicContact CG2-CG2 3.99Å; A367-V414 PolarHBondContact N-O 2.96Å; R368-V414 WeakPolarHBondContact O-CG2 3.49Å; R368-V414 PolarHBondContact O-N 3.43Å; A370-V414 HydrophobicContact CB-CG1 3.49Å; A370-V414 VanDerWaalsContact CB-CG1 3.49Å; F411-V414 HydrophobicContact CB-CG1 3.78Å; F411-V414 HydrophobicContact CD1-CG1 3.96Å; F411-V414 HydrophobicContact CG-CG1 3.94Å; V414-D418 WeakPolarHBondContact CA-OD2 3.42Å; V414-L439 HydrophobicContact CG1-CD2 4.5Å; V414-V441 HydrophobicContact CB-CG1 4.12Å; V414-V441 HydrophobicContact CB-CG2 4.06Å; V414-V441 HydrophobicContact CG2-CG1 3.74Å; V414-V441 HydrophobicContact CG2-CG2 4.31Å
415	L	94.9	Very high	96.1	Very high	63 Å²	63	32.4 Å²	32.4	33%	0.33	19%	0.194	S	C	.	.			trans	-115.9	154.6	174.5	-59.4	179.6	0	0	0	110	S417 D418 V441	L415-S417 WeakPolarHBondContact CB-OG 3.44Å; L415-S417 PolarHBondContact O-N 2.97Å; L415-S417 VanDerWaalsContact O-N 3.11Å; L415-D418 PolarHBondContact N-OD2 3.13Å; L415-D418 VanDerWaalsContact O-CB 3.27Å; L415-D418 WeakPolarHBondContact O-CB 3.24Å; L415-D418 PolarHBondContact O-N 3.19Å; L415-V441 WeakPolarHBondContact O-CB 3.36Å; L415-V441 WeakPolarHBondContact O-CG1 3.36Å
416	P	93	Very high	96.2	Very high	56 Å²	56	30.3 Å²	30.3	36%	0.364	18%	0.184	S	C	.	.	G	3₁₀ helix	trans	-53.6	-32.4	174.4	-28.5	36.8	0	0	0	113.7	A366 D418 T419 N443	A366-P416 HydrophobicContact CB-CG 4.27Å; P416-D418 PolarHBondContact O-N 3.42Å; P416-T419 VanDerWaalsContact O-CB 3.3Å; P416-T419 WeakPolarHBondContact O-CB 3.5Å; P416-T419 PolarHBondContact O-N 3.09Å; P416-T419 PolarHBondContact O-OG1 2.76Å; P416-N443 VanDerWaalsContact CG-OD1 3.25Å; P416-N443 WeakPolarHBondContact CG-OD1 3.31Å
417	S	93.8	Very high	96.3	Very high	97 Å²	97	28.9 Å²	28.9	68%	0.678	18%	0.177	S	C	*	.	G	3₁₀ helix	trans	-65.9	-14.7	174.1	57.8	0	0	0	0	115.1	L415	L415-S417 WeakPolarHBondContact CB-OG 3.44Å; L415-S417 PolarHBondContact O-N 2.97Å; L415-S417 VanDerWaalsContact O-N 3.11Å
418	D	95.4	Very high	96.3	Very high	11 Å²	11	30 Å²	30	6%	0.059	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-84	-0.9	177.4	-56.4	-20.4	0	0	0	111.5	R400 F411 V414 L415 P416 Y422 L439 V441	R400-D418 IonicContact CZ-OD1 3.73Å; R400-D418 IonicContact CZ-OD2 2.68Å; R400-D418 IonicContact NH1-OD1 3.61Å; R400-D418 IonicContact NH1-OD2 2.7Å; R400-D418 PolarHBondContact NH1-OD2 3.18Å; R400-D418 IonicContact NH2-OD1 2.73Å; R400-D418 PolarHBondContact NH2-OD1 2.89Å; R400-D418 IonicContact NH2-OD2 3.36Å; R400-D418 PolarHBondContact NH2-OD2 3.49Å; F411-D418 HydrophobicContact CE1-CB 4.41Å; V414-D418 WeakPolarHBondContact CA-OD2 3.42Å; L415-D418 PolarHBondContact N-OD2 3.13Å; L415-D418 VanDerWaalsContact O-CB 3.27Å; L415-D418 WeakPolarHBondContact O-CB 3.24Å; L415-D418 PolarHBondContact O-N 3.19Å; P416-D418 PolarHBondContact O-N 3.42Å; D418-Y422 WeakPolarHBondContact O-CE2 3.4Å; D418-Y422 PolarHBondContact O-OH 3.12Å; D418-L439 HydrophobicContact CB-CD2 4.3Å; D418-V441 HydrophobicContact CB-CG2 4.43Å
419	T	96.2	Very high	96	Very high	44 Å²	44	32.4 Å²	32.4	27%	0.27	20%	0.195	S	C	.	.			trans	-64.8	131	178.1	-62.9	0	0	0	0	111.7	P416 Y438 L439 V441	P416-T419 VanDerWaalsContact O-CB 3.3Å; P416-T419 WeakPolarHBondContact O-CB 3.5Å; P416-T419 PolarHBondContact O-N 3.09Å; P416-T419 PolarHBondContact O-OG1 2.76Å; T419-Y438 HydrophobicContact CG2-CE1 4.02Å; T419-Y438 WeakPolarHBondContact CG2-OH 3.47Å; T419-L439 CarbonylContact C-O 3.27Å; T419-L439 VanDerWaalsContact CA-O 3.29Å; T419-L439 WeakPolarHBondContact CA-O 3.49Å; T419-V441 PolarHBondContact OG1-N 3.14Å
420	G	96.8	Very high	95.8	Very high	10 Å²	10	34.2 Å²	34.2	10%	0.103	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	151.2	-170.5	175.8	0	0	0	0	0	114.4	Y422 L439	G420-Y422 WeakPolarHBondContact O-CD2 3.24Å; G420-L439 PolarHBondContact N-O 3.16Å; G420-L439 PolarHBondContact O-N 3.38Å
421	V	98	Very high	95.6	Very high	76 Å²	76	33.5 Å²	33.5	46%	0.461	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	122.8	178.1	-178.6	0	0	0	0	110.8	P387 Y438	P387-V421 WeakPolarHBondContact CG-O 3.05Å; V421-Y438 HydrophobicContact CG2-CD2 3.82Å; V421-Y438 HydrophobicContact CG2-CE2 4.39Å
422	Y	98.3	Very high	95.6	Very high	5 Å²	5	39.1 Å²	39.1	2%	0.02	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	135.2	170.1	-68.8	-108	0	0	0	108.8	M372 L386 P387 L409 F411 D418 G420 S436 A437 L439	M372-Y422 HydrophobicContact CE-CD2 4.37Å; M372-Y422 HydrophobicContact CE-CG 4.35Å; M372-Y422 HydrophobicContact SD-CD1 4.38Å; M372-Y422 HydrophobicContact SD-CD2 4.02Å; M372-Y422 HydrophobicContact SD-CG 3.85Å; L386-Y422 HydrophobicContact CB-CE1 4.45Å; L386-Y422 HydrophobicContact CD1-CD1 4.17Å; L386-Y422 HydrophobicContact CD1-CE1 4.22Å; L386-Y422 HydrophobicContact CG-CD1 4.09Å; L386-Y422 HydrophobicContact CG-CE1 3.73Å; P387-Y422 VanDerWaalsContact CD-CZ 3.46Å; P387-Y422 HydrophobicContact CG-CD2 3.9Å; P387-Y422 HydrophobicContact CG-CE1 4.44Å; P387-Y422 HydrophobicContact CG-CE2 3.47Å; P387-Y422 VanDerWaalsContact CG-CE2 3.47Å; P387-Y422 HydrophobicContact CG-CG 4.5Å; L409-Y422 HydrophobicContact CD2-CD1 3.48Å; L409-Y422 VanDerWaalsContact CD2-CD1 3.48Å; L409-Y422 HydrophobicContact CD2-CE1 3.9Å; L409-Y422 HydrophobicContact CD2-CG 4.43Å; F411-Y422 AromaticContact CE1-CE1 3.99Å; F411-Y422 HydrophobicContact CE1-CE1 3.99Å; F411-Y422 AromaticContact CE1-CZ 3.98Å; F411-Y422 HydrophobicContact CZ-CD1 4.15Å; F411-Y422 AromaticContact CZ-CE1 3.52Å; F411-Y422 HydrophobicContact CZ-CE1 3.52Å; F411-Y422 HydrophobicContact CZ-CE2 4.49Å; F411-Y422 AromaticContact CZ-CZ 3.75Å; D418-Y422 WeakPolarHBondContact O-CE2 3.4Å; D418-Y422 PolarHBondContact O-OH 3.12Å; G420-Y422 WeakPolarHBondContact O-CD2 3.24Å; Y422-S436 VanDerWaalsContact O-CA 3.28Å; Y422-S436 WeakPolarHBondContact O-CA 3.24Å; Y422-A437 PolarHBondContact N-O 2.96Å; Y422-A437 PolarHBondContact O-N 3.37Å; Y422-L439 HydrophobicContact CD2-CB 3.89Å; Y422-L439 HydrophobicContact CE2-CB 3.71Å; Y422-L439 HydrophobicContact CE2-CD2 3.87Å; Y422-L439 HydrophobicContact CE2-CG 4.42Å
423	T	98.3	Very high	95.7	Very high	20 Å²	20	38 Å²	38	12%	0.123	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	116.2	179.2	-58.6	0	0	0	0	110.7	W384 L385 M425 N434 S436	W384-T423 WeakPolarHBondContact CA-O 3.4Å; L385-T423 PolarHBondContact N-O 3.35Å; L385-T423 PolarHBondContact O-N 2.91Å; T423-M425 HydrophobicContact CG2-CG 4.09Å; T423-N434 HydrophobicContact CG2-CB 4.19Å; T423-S436 WeakPolarHBondContact CG2-OG 3.18Å; T423-S436 WeakPolarHBondContact OG1-CB 3.29Å; T423-S436 PolarHBondContact OG1-OG 2.77Å
424	C	98.3	Very high	95.9	Very high	0 Å²	0	40 Å²	40	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	130.7	165	-175.2	0	0	0	0	109.2	C374 W384 N434 A435	C374-C424 HydrophobicContact CB-CB 3.62Å; C374-C424 WeakPolarHBondContact CB-SG 3.39Å; C374-C424 WeakPolarHBondContact SG-CB 3.18Å; C374-C424 CovalentContact SG-SG 2.02Å; C374-C424 PolarHBondContact SG-SG 3.3Å; W384-C424 HydrophobicContact CD2-CB 4.03Å; W384-C424 HydrophobicContact CE3-CB 4.12Å; W384-C424 HydrophobicContact CH2-CB 3.89Å; W384-C424 HydrophobicContact CZ2-CB 3.77Å; W384-C424 HydrophobicContact CZ3-CB 4.04Å; C424-N434 CarbonylContact O-C 3.59Å; C424-N434 VanDerWaalsContact O-CA 3.26Å; C424-N434 WeakPolarHBondContact O-CA 3.39Å; C424-A435 PolarHBondContact N-O 2.77Å; C424-A435 PolarHBondContact O-N 3.27Å
425	M	97.6	Very high	96	Very high	47 Å²	47	40.9 Å²	40.9	23%	0.232	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	116.7	178.2	-59	176.6	-67.3	0	0	108.3	R383 L385 V391 T423 N434	R383-M425 HydrophobicContact CB-CE 4.07Å; R383-M425 PolarHBondContact N-O 3.46Å; R383-M425 PolarHBondContact O-N 2.98Å; L385-M425 HydrophobicContact CB-CE 3.8Å; L385-M425 HydrophobicContact CB-SD 4.32Å; V391-M425 HydrophobicContact CG1-CE 4.17Å; V391-M425 HydrophobicContact CG2-CE 4.3Å; T423-M425 HydrophobicContact CG2-CG 4.09Å; M425-N434 WeakPolarHBondContact CA-OD1 3.18Å
426	V	97.8	Very high	96.2	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.006	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	140.1	179.5	-171.8	0	0	0	0	109.3	P353 I355 T376 S381 V382 N432 S433	P353-V426 HydrophobicContact CB-CG1 3.68Å; P353-V426 HydrophobicContact CG-CB 4.22Å; P353-V426 HydrophobicContact CG-CG1 3.81Å; I355-V426 HydrophobicContact CD1-CG2 3.99Å; I355-V426 HydrophobicContact CG1-CB 4.45Å; I355-V426 HydrophobicContact CG1-CG2 3.88Å; T376-V426 HydrophobicContact CG2-CG1 3.73Å; T376-V426 HydrophobicContact CG2-CG2 4.16Å; S381-V426 WeakPolarHBondContact O-CA 3.45Å; V382-V426 HydrophobicContact CG2-CG1 4.46Å; V382-V426 HydrophobicContact CG2-CG2 4.26Å; V426-N432 CarbonylContact O-C 3.53Å; V426-N432 VanDerWaalsContact O-CA 3.29Å; V426-N432 WeakPolarHBondContact O-CA 3Å; V426-S433 PolarHBondContact N-O 2.94Å; V426-S433 PolarHBondContact O-N 3.1Å
427	S	96.4	Very high	96.4	Very high	17 Å²	17	38.9 Å²	38.9	12%	0.119	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	146.9	174.6	48.6	0	0	0	0	112.8	H283 S381 G431 N432	H283-S427 PolarHBondContact ND1-O 3.34Å; H283-S427 VanDerWaalsContact ND1-O 3.09Å; S381-S427 PolarHBondContact N-O 3.43Å; S381-S427 PolarHBondContact O-N 2.93Å; S381-S427 PolarHBondContact OG-O 3.2Å; S381-S427 VanDerWaalsContact OG-O 3.08Å; S381-S427 PolarHBondContact OG-OG 3.1Å; S427-G431 WeakPolarHBondContact CA-O 2.99Å; S427-N432 VanDerWaalsContact CB-OD1 3.26Å; S427-N432 WeakPolarHBondContact CB-OD1 3.38Å
428	N	94.9	Very high	96.6	Very high	22 Å²	22	39.3 Å²	39.3	12%	0.118	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	-177.1	169.1	75	4.9	0	0	0	109.4	H283 S351 P353 A430 G431	H283-N428 VanDerWaalsContact CE1-C 3.41Å; H283-N428 VanDerWaalsContact CE1-CA 3.46Å; H283-N428 WeakPolarHBondContact CE1-CA 3.26Å; S351-N428 PolarHBondContact O-ND2 3.44Å; P353-N428 HydrophobicContact CB-CB 4.29Å; P353-N428 HydrophobicContact CG-CB 4.49Å; N428-A430 PolarHBondContact O-N 2.94Å; N428-A430 VanDerWaalsContact O-N 3.12Å; N428-A430 WeakPolarHBondContact OD1-CA 3.38Å; N428-A430 WeakPolarHBondContact OD1-CB 3.27Å; N428-A430 PolarHBondContact OD1-N 2.95Å; N428-G431 PolarHBondContact N-O 2.78Å; N428-G431 PolarHBondContact O-N 3.01Å; N428-G431 VanDerWaalsContact O-N 3.12Å; N428-G431 PolarHBondContact OD1-N 3.08Å; N428-G431 PolarHBondContact OD1-O 3.09Å
429	M	91.4	Very high	96.7	Very high	51 Å²	51	38.8 Å²	38.8	25%	0.251	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-21.3	-178.8	-173.2	63.7	-162.3	0	0	114.3	H283 V309 W310	H283-M429 PolarHBondContact NE2-N 2.93Å; V309-M429 HydrophobicContact CB-CG 3.96Å; V309-M429 HydrophobicContact CG1-CE 4.21Å; V309-M429 HydrophobicContact CG1-CG 3.77Å; V309-M429 HydrophobicContact CG1-SD 4.44Å; W310-M429 HydrophobicContact CB-CB 4.4Å; W310-M429 HydrophobicContact CB-SD 4.01Å
430	A	92.8	Very high	96.7	Very high	39 Å²	39	39.7 Å²	39.7	32%	0.322	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-9.1	-179.7	0	0	0	0	0	113.6	C350 S351 N428	C350-A430 HydrophobicContact CB-CB 3.87Å; S351-A430 VanDerWaalsContact C-CB 3.44Å; S351-A430 WeakPolarHBondContact O-CB 3.26Å; N428-A430 PolarHBondContact O-N 2.94Å; N428-A430 VanDerWaalsContact O-N 3.12Å; N428-A430 WeakPolarHBondContact OD1-CA 3.38Å; N428-A430 WeakPolarHBondContact OD1-CB 3.27Å; N428-A430 PolarHBondContact OD1-N 2.95Å
431	G	94.1	Very high	96.6	Very high	24 Å²	24	39.6 Å²	39.6	25%	0.247	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	144.3	-162.3	173.9	0	0	0	0	0	114.4	P353 S427 N428	P353-G431 VanDerWaalsContact CD-O 3.26Å; P353-G431 WeakPolarHBondContact CD-O 3.38Å; S427-G431 WeakPolarHBondContact CA-O 2.99Å; N428-G431 PolarHBondContact N-O 2.78Å; N428-G431 PolarHBondContact O-N 3.01Å; N428-G431 VanDerWaalsContact O-N 3.12Å; N428-G431 PolarHBondContact OD1-N 3.08Å; N428-G431 PolarHBondContact OD1-O 3.09Å
432	N	96.3	Very high	96.2	Very high	117 Å²	117	39 Å²	39	63%	0.626	23%	0.229	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-115.6	156.9	-174	-61.2	8.4	0	0	0	110.9	V426 S427	V426-N432 CarbonylContact O-C 3.53Å; V426-N432 VanDerWaalsContact O-CA 3.29Å; V426-N432 WeakPolarHBondContact O-CA 3Å; S427-N432 VanDerWaalsContact CB-OD1 3.26Å; S427-N432 WeakPolarHBondContact CB-OD1 3.38Å
433	S	97.1	Very high	95.5	Very high	39 Å²	39	43.9 Å²	43.9	27%	0.273	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	132.8	169.3	-71.6	0	0	0	0	109.5	P353 V426	P353-S433 VanDerWaalsContact O-CB 3.27Å; P353-S433 WeakPolarHBondContact O-CB 3.38Å; P353-S433 PolarHBondContact O-OG 2.87Å; V426-S433 PolarHBondContact N-O 2.94Å; V426-S433 PolarHBondContact O-N 3.1Å
434	N	97.5	Very high	93.9	Very high	100 Å²	100	46.4 Å²	46.4	54%	0.535	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	145.4	-174.1	-63	-9.1	0	0	0	109.8	T423 C424 M425	T423-N434 HydrophobicContact CG2-CB 4.19Å; C424-N434 CarbonylContact O-C 3.59Å; C424-N434 VanDerWaalsContact O-CA 3.26Å; C424-N434 WeakPolarHBondContact O-CA 3.39Å; M425-N434 WeakPolarHBondContact CA-OD1 3.18Å
435	A	97.7	Very high	92	Very high	20 Å²	20	54.4 Å²	54.4	17%	0.165	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	133.8	170.3	0	0	0	0	0	110.2	I355 A358 P359 C424	I355-A435 HydrophobicContact CD1-CB 3.69Å; A358-A435 HydrophobicContact CB-CB 4.28Å; P359-A435 HydrophobicContact CG-CB 4.13Å; C424-A435 PolarHBondContact N-O 2.77Å; C424-A435 PolarHBondContact O-N 3.27Å
436	S	97.9	Very high	89.7	Confident	71 Å²	71	59.1 Å²	59.1	50%	0.497	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	147.2	-174.9	-52.8	0	0	0	0	110.9	Y422 T423	Y422-S436 VanDerWaalsContact O-CA 3.28Å; Y422-S436 WeakPolarHBondContact O-CA 3.24Å; T423-S436 WeakPolarHBondContact CG2-OG 3.18Å; T423-S436 WeakPolarHBondContact OG1-CB 3.29Å; T423-S436 PolarHBondContact OG1-OG 2.77Å
437	A	98.1	Very high	87.2	Confident	5 Å²	5	64.3 Å²	64.3	4%	0.041	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	156.9	172.1	0	0	0	0	0	111.1	P359 D361 M372 Y422	P359-A437 HydrophobicContact CB-CB 3.83Å; P359-A437 HydrophobicContact CG-CB 4.23Å; D361-A437 WeakPolarHBondContact OD1-CA 3.41Å; M372-A437 HydrophobicContact CE-CB 3.78Å; Y422-A437 PolarHBondContact N-O 2.96Å; Y422-A437 PolarHBondContact O-N 3.37Å
438	Y	97.8	Very high	85.1	Confident	106 Å²	106	67.2 Å²	67.2	42%	0.416	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	121.4	-179.5	-163.2	-88	0	0	0	111.5	D361 L362 T419 V421 N440	D361-Y438 VanDerWaalsContact CA-O 3.29Å; D361-Y438 WeakPolarHBondContact CA-O 3.45Å; D361-Y438 PolarHBondContact OD1-N 3.46Å; L362-Y438 PolarHBondContact N-O 2.73Å; T419-Y438 HydrophobicContact CG2-CE1 4.02Å; T419-Y438 WeakPolarHBondContact CG2-OH 3.47Å; V421-Y438 HydrophobicContact CG2-CD2 3.82Å; V421-Y438 HydrophobicContact CG2-CE2 4.39Å; Y438-N440 HydrophobicContact CD1-CB 4.03Å; Y438-N440 HydrophobicContact CE1-CB 3.93Å
439	L	97.4	Very high	83.1	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	125	168.1	-178.4	62.7	0	0	0	108.7	L362 I364 M372 F411 V414 D418 T419 G420 Y422 V441	L362-L439 HydrophobicContact CB-CD1 4Å; L362-L439 HydrophobicContact CD2-CD1 3.94Å; L362-L439 HydrophobicContact CG-CD1 4.13Å; I364-L439 HydrophobicContact CG2-CD1 3.86Å; M372-L439 HydrophobicContact CE-CB 4.47Å; M372-L439 HydrophobicContact SD-CB 4.28Å; F411-L439 HydrophobicContact CE1-CD2 3.82Å; F411-L439 HydrophobicContact CE2-CD2 4.31Å; F411-L439 HydrophobicContact CZ-CD2 3.69Å; V414-L439 HydrophobicContact CG1-CD2 4.5Å; D418-L439 HydrophobicContact CB-CD2 4.3Å; T419-L439 CarbonylContact C-O 3.27Å; T419-L439 VanDerWaalsContact CA-O 3.29Å; T419-L439 WeakPolarHBondContact CA-O 3.49Å; G420-L439 PolarHBondContact N-O 3.16Å; G420-L439 PolarHBondContact O-N 3.38Å; Y422-L439 HydrophobicContact CD2-CB 3.89Å; Y422-L439 HydrophobicContact CE2-CB 3.71Å; Y422-L439 HydrophobicContact CE2-CD2 3.87Å; Y422-L439 HydrophobicContact CE2-CG 4.42Å; L439-V441 HydrophobicContact CD1-CG2 4.3Å; L439-V441 HydrophobicContact CD2-CG2 4.07Å; L439-V441 HydrophobicContact CG-CG2 3.82Å
440	N	96.4	Very high	81.1	Confident	64 Å²	64	75.5 Å²	75.5	34%	0.342	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	108.7	178.4	-178.5	21.3	0	0	0	109.5	L362 N363 I364 Y438	L362-N440 PolarHBondContact O-N 3.06Å; N363-N440 VanDerWaalsContact OD1-CB 3.32Å; N363-N440 WeakPolarHBondContact OD1-CB 3.46Å; N363-N440 PolarHBondContact OD1-ND2 3.35Å; I364-N440 PolarHBondContact N-O 2.81Å; Y438-N440 HydrophobicContact CD1-CB 4.03Å; Y438-N440 HydrophobicContact CE1-CB 3.93Å
441	V	94.8	Very high	79	Confident	8 Å²	8	78.4 Å²	78.4	5%	0.048	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	96	-175.5	-170.5	0	0	0	0	110.5	I364 A366 V414 L415 D418 T419 L439	I364-V441 HydrophobicContact CG2-CG2 4.2Å; I364-V441 VanDerWaalsContact O-CA 3.32Å; I364-V441 WeakPolarHBondContact O-CA 3.25Å; A366-V441 HydrophobicContact CB-CG1 4.19Å; V414-V441 HydrophobicContact CB-CG1 4.12Å; V414-V441 HydrophobicContact CB-CG2 4.06Å; V414-V441 HydrophobicContact CG2-CG1 3.74Å; V414-V441 HydrophobicContact CG2-CG2 4.31Å; L415-V441 WeakPolarHBondContact O-CB 3.36Å; L415-V441 WeakPolarHBondContact O-CG1 3.36Å; D418-V441 HydrophobicContact CB-CG2 4.43Å; T419-V441 PolarHBondContact OG1-N 3.14Å; L439-V441 HydrophobicContact CD1-CG2 4.3Å; L439-V441 HydrophobicContact CD2-CG2 4.07Å; L439-V441 HydrophobicContact CG-CG2 3.82Å
442	S	90.7	Very high	76.4	Confident	62 Å²	62	81.9 Å²	81.9	43%	0.434	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	147.7	172.2	60.2	0	0	0	0	110.7	I364 S365 A366	I364-S442 PolarHBondContact O-N 3.23Å; S365-S442 CarbonylContact C-O 3.56Å; S365-S442 VanDerWaalsContact CA-O 3.29Å; S365-S442 WeakPolarHBondContact CA-O 3Å; A366-S442 PolarHBondContact N-O 3.43Å
443	N	83.2	Confident	73.9	Confident	109 Å²	109	84.1 Å²	84.1	58%	0.583	47%	0.47	S	S	*	.			trans	-65.5	139.4	154	-77	-30	0	0	0	107.6	P416 E445	P416-N443 VanDerWaalsContact CG-OD1 3.25Å; P416-N443 WeakPolarHBondContact CG-OD1 3.31Å; N443-E445 VanDerWaalsContact C-N 3.32Å; N443-E445 PolarHBondContact O-N 2.89Å
444	A	64.6	Low	71.3	Confident	72 Å²	72	90.9 Å²	90.9	60%	0.595	50%	0.495	S	S	*	.			trans	-67.6	98.6	165.9	0	0	0	0	0	107.6	L446	A444-L446 PolarHBondContact O-N 2.92Å
445	E	56.8	Low	68.5	Low	169 Å²	169	92 Å²	92	79%	0.79	51%	0.506	S	S	*	.			trans	-59.7	106.2	168.1	-69.7	-175.1	165.7	0	0	107.7	N443 N447	N443-E445 VanDerWaalsContact C-N 3.32Å; N443-E445 PolarHBondContact O-N 2.89Å; E445-N447 PolarHBondContact O-N 3.14Å
446	L	51.2	Low	66	Low	145 Å²	145	96.9 Å²	96.9	76%	0.759	53%	0.533	S	S	*	.			trans	-60	97.2	161.7	-84.7	162.3	0	0	0	105.9	A444 T448	A444-L446 PolarHBondContact O-N 2.92Å; L446-T448 HydrophobicContact CB-CG2 4.41Å; L446-T448 WeakPolarHBondContact O-CG2 3.32Å; L446-T448 PolarHBondContact O-N 2.63Å
447	N	43.5	Very low	63.2	Low	110 Å²	110	99.2 Å²	99.2	59%	0.588	55%	0.545	S	S	*	.			trans	-76.8	73.1	-172.6	-157.6	-8.4	0	0	0	109.5	E445 S449 N450	E445-N447 PolarHBondContact O-N 3.14Å; N447-S449 PolarHBondContact O-N 2.77Å; N447-S449 PolarHBondContact OD1-OG 2.83Å; N447-N450 PolarHBondContact O-N 2.77Å
448	T	52.7	Low	60.5	Low	79 Å²	79	104.8 Å²	104.8	49%	0.485	58%	0.578	S	S	.	*	G	3₁₀ helix	trans	-62.7	-7.4	-176.4	49.8	0	0	0	0	113.7	L446 N450 Y453	L446-T448 HydrophobicContact CB-CG2 4.41Å; L446-T448 WeakPolarHBondContact O-CG2 3.32Å; L446-T448 PolarHBondContact O-N 2.63Å; T448-N450 PolarHBondContact O-N 2.78Å; T448-Y453 VanDerWaalsContact CB-OH 3.27Å; T448-Y453 WeakPolarHBondContact CB-OH 3.47Å; T448-Y453 WeakPolarHBondContact CG2-OH 3.29Å
449	S	53.9	Low	57.7	Low	96 Å²	96	105.2 Å²	105.2	67%	0.671	59%	0.592	S	S	*	*	G	3₁₀ helix	trans	-62.3	-21.6	171	67.2	0	0	0	0	114.2	N447	N447-S449 PolarHBondContact O-N 2.77Å; N447-S449 PolarHBondContact OD1-OG 2.83Å
450	N	49.2	Very low	54.8	Low	151 Å²	151	113.4 Å²	113.4	81%	0.807	63%	0.63	S	S	*	*	G	3₁₀ helix	trans	-127.9	23.9	-177.1	-150.2	11.7	0	0	0	113.6	N447 T448	N447-N450 PolarHBondContact O-N 2.77Å; T448-N450 PolarHBondContact O-N 2.78Å
451	L	47.9	Very low	52.1	Low	100 Å²	100	116 Å²	116	52%	0.524	65%	0.647	S	S	.	*			trans	-106.6	102.3	170	-83.1	163.8	0	0	0	109.1	Y453	L451-Y453 VanDerWaalsContact O-CD2 3.31Å; L451-Y453 WeakPolarHBondContact O-CD2 3.48Å; L451-Y453 VanDerWaalsContact O-CE2 3.3Å; L451-Y453 WeakPolarHBondContact O-CE2 3.32Å; L451-Y453 PolarHBondContact O-N 3.26Å; L451-Y453 VanDerWaalsContact O-N 3.11Å
452	S	40.2	Very low	49.7	Very low	97 Å²	97	123 Å²	123	68%	0.678	68%	0.684	S	S	*	*			trans	-72.9	100.1	175.3	55	0	0	0	0	110.7	F454	S452-F454 PolarHBondContact O-N 2.65Å
453	Y	43.8	Very low	46.9	Very low	163 Å²	163	128.6 Å²	128.6	64%	0.639	70%	0.703	S	S	*	*			trans	-67.2	95.1	176.3	-50.6	-83.7	0	0	0	111.4	T448 L451 T455	T448-Y453 VanDerWaalsContact CB-OH 3.27Å; T448-Y453 WeakPolarHBondContact CB-OH 3.47Å; T448-Y453 WeakPolarHBondContact CG2-OH 3.29Å; L451-Y453 VanDerWaalsContact O-CD2 3.31Å; L451-Y453 WeakPolarHBondContact O-CD2 3.48Å; L451-Y453 VanDerWaalsContact O-CE2 3.3Å; L451-Y453 WeakPolarHBondContact O-CE2 3.32Å; L451-Y453 PolarHBondContact O-N 3.26Å; L451-Y453 VanDerWaalsContact O-N 3.11Å; Y453-T455 PolarHBondContact O-N 3.19Å; Y453-T455 VanDerWaalsContact O-N 3.14Å
454	F	41.4	Very low	44.5	Very low	182 Å²	182	129 Å²	129	80%	0.798	71%	0.712	S	S	*	*			trans	-79.6	86	164.6	-80	-80.7	0	0	0	110	S452 T456	S452-F454 PolarHBondContact O-N 2.65Å; F454-T456 PolarHBondContact O-N 3.29Å
455	T	39.3	Very low	43.1	Very low	124 Å²	124	131.7 Å²	131.7	76%	0.761	72%	0.721	S	S	*	*			trans	-69.9	92.3	169.5	10.4	0	0	0	0	110.2	Y453 V457	Y453-T455 PolarHBondContact O-N 3.19Å; Y453-T455 VanDerWaalsContact O-N 3.14Å; T455-V457 PolarHBondContact O-N 2.98Å
456	T	45.3	Very low	42	Very low	121 Å²	121	130.5 Å²	130.5	74%	0.742	73%	0.725	S	S	*	*			trans	-69.5	96	168.6	50.4	0	0	0	0	109.7	F454 T458	F454-T456 PolarHBondContact O-N 3.29Å; T456-T458 PolarHBondContact O-N 3.46Å
457	V	39.8	Very low	41.2	Very low	121 Å²	121	131.9 Å²	131.9	73%	0.733	73%	0.728	S	S	*	*			trans	-73	96.9	175.1	-176.8	0	0	0	0	109.2	T455 V459	T455-V457 PolarHBondContact O-N 2.98Å; V457-V459 HydrophobicContact CG1-CG2 4Å; V457-V459 PolarHBondContact O-N 3.12Å
458	T	40.3	Very low	40.6	Very low	122 Å²	122	135.6 Å²	135.6	75%	0.748	74%	0.742	S	S	*	*			trans	-76	97	170.8	48.9	0	0	0	0	109.7	T456 E460	T456-T458 PolarHBondContact O-N 3.46Å; T458-E460 PolarHBondContact O-N 3.14Å
459	V	38.4	Very low	39.7	Very low	115 Å²	115	137.9 Å²	137.9	70%	0.697	76%	0.755	S	S	*	*			trans	-80.4	106.9	170	-175.2	0	0	0	0	108.3	V457 V461	V457-V459 HydrophobicContact CG1-CG2 4Å; V457-V459 PolarHBondContact O-N 3.12Å; V459-V461 HydrophobicContact CG1-CG2 4.07Å; V459-V461 PolarHBondContact O-N 3.3Å
460	E	37.7	Very low	39.3	Very low	171 Å²	171	138.1 Å²	138.1	80%	0.799	76%	0.755	S	S	*	*			trans	-75.3	106.9	170.9	-68.3	-170.4	149	0	0	109.9	T458	T458-E460 PolarHBondContact O-N 3.14Å
461	V	38.7	Very low	38.6	Very low	118 Å²	118	140.6 Å²	140.6	72%	0.715	76%	0.758	S	S	*	*			trans	-101.3	110.9	166.1	-177.6	0	0	0	0	107.6	V459	V459-V461 HydrophobicContact CG1-CG2 4.07Å; V459-V461 PolarHBondContact O-N 3.3Å
462	L	44.5	Very low	38.2	Very low	157 Å²	157	141.8 Å²	141.8	82%	0.822	77%	0.772	S	S	*	*			trans	-82.4	114.5	170.7	-92.1	72.9	0	0	0	109.8
463	E	31.8	Very low	37.8	Very low	178 Å²	178	146.5 Å²	146.5	83%	0.832	78%	0.78	S	S	*	*			trans	-130.1	152.1	154.2	-73.7	-160.3	151	0	0	110
464	P	33.5	Very low	38.1	Very low	117 Å²	117	144.1 Å²	144.1	76%	0.76	79%	0.785	S	S	*	*			trans	-92.3	159.5	-155.8	35.1	-37	0	0	0	116.1
465	T	36.1	Very low	37.4	Very low	130 Å²	130	140.7 Å²	140.7	80%	0.798	78%	0.779	S	S	*	*			trans	-13.8	139.2	159.2	54.6	0	0	0	0	119.2
466	V	32.2	Very low	37.1	Very low	143 Å²	143	142.2 Å²	142.2	87%	0.867	78%	0.782	S	S	*	*				-155.4	161	123.9	130.1	0	0	0	0	110.2
467	E	35.9	Very low	36.9	Very low	174 Å²	174	141.7 Å²	141.7	81%	0.813	78%	0.78	S	S	*	*			trans	-83.4	153.3	-172.8	-60.4	158.8	110.1	0	0	113.6
468	E	30.7	Very low	36.3	Very low	189 Å²	189	140.7 Å²	140.7	88%	0.883	79%	0.785	S	S	*	*				164.3	172.6	112.5	-85.2	-151.6	125	0	0	113
469	T	32.7	Very low	35.7	Very low	126 Å²	126	140.2 Å²	140.2	77%	0.773	79%	0.786	S	S	*	*			trans	-124.6	-173.5	178	70.8	0	0	0	0	108.7
470	P	45.4	Very low	35.7	Very low	101 Å²	101	141 Å²	141	66%	0.656	79%	0.794	S	S	*	*			cis	-142	144.8	-5.7	35.1	-13.9	0	0	0	117.6
471	K	34.1	Very low	35.3	Very low	203 Å²	203	138.1 Å²	138.1	88%	0.883	79%	0.792	S	S	*	*			trans	63	177.4	153.1	-67.2	175.9	179	171.2	0	116.6
472	P	40.8	Very low	34.7	Very low	126 Å²	126	138.6 Å²	138.6	82%	0.818	80%	0.796	S	S	*	*			cis	-123	-174	-7.3	39	-21.7	0	0	0	115.9
473	K	30.7	Very low	33.7	Very low	196 Å²	196	139.1 Å²	139.1	85%	0.852	79%	0.791	S	S	*	*			trans	-70.1	172.6	167.8	-81.4	-177.3	177.7	-178.4	0	112.4
474	P	50.3	Low	33.6	Very low	112 Å²	112	138.5 Å²	138.5	73%	0.727	79%	0.788	S	S	*	*			cis	-125.2	-148.1	16	27	0.4	0	0	0	113
475	T	28.2	Very low	33.9	Very low	110 Å²	110	138 Å²	138	68%	0.675	79%	0.785	S	S	*	*			cis	-163	131.1	15.9	-24.5	0	0	0	0	113.1
476	L	31.5	Very low	33.5	Very low	157 Å²	157	136.5 Å²	136.5	82%	0.822	78%	0.776	S	S	*	*			trans	24.3	168.5	136.6	-59.4	176	0	0	0	123.9
477	P	42.5	Very low	33.2	Very low	109 Å²	109	138.6 Å²	138.6	71%	0.708	77%	0.774	S	S	*	*			cis	-138.7	178.7	-23.7	31.8	-11	0	0	0	116.5
478	A	26	Very low	32.7	Very low	101 Å²	101	136 Å²	136	84%	0.835	76%	0.764	S	S	*	*			trans	71.2	145.5	154.1	0	0	0	0	0	118.3
479	S	28.6	Very low	32.6	Very low	111 Å²	111	131.4 Å²	131.4	78%	0.776	75%	0.753	S	S	*	*			cis	-150.7	163.7	6.6	58.6	0	0	0	0	112
480	P	38	Very low	32.5	Very low	132 Å²	132	131.2 Å²	131.2	86%	0.857	75%	0.752	S	S	*	*			trans	-139	158.6	158.6	39.4	-25.8	0	0	0	115.1
481	S	29	Very low	32.4	Very low	110 Å²	110	131.4 Å²	131.4	77%	0.769	75%	0.753	S	S	*	*			trans	-153.1	128.8	173.7	60.3	0	0	0	0	114.9
482	V	26.1	Very low	32.1	Very low	129 Å²	129	127.5 Å²	127.5	78%	0.782	75%	0.746	S	S	*	*			trans	73.9	115.3	146.1	177.3	0	0	0	0	120.4
483	F	23.3	Very low	31.4	Very low	167 Å²	167	127.5 Å²	127.5	73%	0.732	74%	0.744	S	S	*	*			trans	46	115.5	144.6	-78.3	-107	0	0	0	120.8
484	Q	30.8	Very low	31.1	Very low	165 Å²	165	124.9 Å²	124.9	77%	0.771	74%	0.738	S	S	*	*				78.8	154.2	88.4	-83.3	-165.7	-3.1	0	0	114.4
485	P	39.7	Very low	29.8	Very low	107 Å²	107	129.1 Å²	129.1	70%	0.695	75%	0.746	S	S	*	*			cis	-149.6	-174.3	35.2	44.6	-24.1	0	0	0	119.2
486	V	26.1	Very low	29.7	Very low	99 Å²	99	131.3 Å²	131.3	60%	0.6	75%	0.748	S	S	*	*			trans	66.8	144	149	155.5	0	0	0	0	117.9	I488	V486-I488 HydrophobicContact CG1-CD1 4.02Å; V486-I488 HydrophobicContact CG1-CG1 4.47Å; V486-I488 HydrophobicContact CG2-CD1 4.23Å; V486-I488 HydrophobicContact CG2-CG1 4.33Å
487	F	26.5	Very low	29.4	Very low	187 Å²	187	130.4 Å²	130.4	82%	0.82	74%	0.744	S	S	*	*			cis	-108.7	141.4	23.4	-71.5	-99.8	0	0	0	113.4
488	I	25.8	Very low	28.7	Very low	118 Å²	118	130.4 Å²	130.4	61%	0.605	74%	0.743	S	S	*	*				65.2	105.6	68.1	-60.2	171	0	0	0	110.6	V486	V486-I488 HydrophobicContact CG1-CD1 4.02Å; V486-I488 HydrophobicContact CG1-CG1 4.47Å; V486-I488 HydrophobicContact CG2-CD1 4.23Å; V486-I488 HydrophobicContact CG2-CG1 4.33Å
489	S	29.5	Very low	28.8	Very low	94 Å²	94	134.6 Å²	134.6	66%	0.657	75%	0.745	S	S	*	*			cis	78.1	155.8	41.2	96.8	0	0	0	0	112.9
490	T	29.5	Very low	29.1	Very low	121 Å²	121	135.8 Å²	135.8	74%	0.742	75%	0.748	S	S	*	*			cis	-165.7	-161	9.8	4.9	0	0	0	0	106.7
491	P	43.9	Very low	28.8	Very low	106 Å²	106	135.2 Å²	135.2	69%	0.688	74%	0.744	S	S	*	*			cis	-114.1	-127	-21.4	20.9	4.1	0	0	0	109.7
492	T	26.5	Very low	28.6	Very low	120 Å²	120	141.5 Å²	141.5	74%	0.736	75%	0.751	S	S	*	*			cis	-165.1	141.8	-4.3	-5.8	0	0	0	0	105.2
493	V	26.1	Very low	28.8	Very low	127 Å²	127	144.6 Å²	144.6	77%	0.77	76%	0.757	S	S	*	*			cis	-156.3	168.2	-16	111.8	0	0	0	0	108.2
494	L	24.7	Very low	29	Very low	141 Å²	141	143.5 Å²	143.5	74%	0.738	76%	0.763	S	S	*	*			trans	-102.4	162.7	-179.5	-158.5	92.4	0	0	0	112.3
495	F	22.8	Very low	29.1	Very low	200 Å²	200	140.7 Å²	140.7	88%	0.877	76%	0.762	S	S	*	*			trans	-129.3	148	147	-102.2	-78.3	0	0	0	112.2
496	Q	27.5	Very low	28.6	Very low	156 Å²	156	143.5 Å²	143.5	73%	0.729	77%	0.769	S	S	*	*			trans	-75.1	171.8	-178.4	-75.7	172.5	-50.5	0	0	111.5
497	N	23.8	Very low	28.9	Very low	138 Å²	138	144 Å²	144	74%	0.738	78%	0.775	S	S	*	*			cis	-155.3	175	29.4	-146.5	-11.5	0	0	0	114.3
498	T	28.8	Very low	29.2	Very low	110 Å²	110	141.6 Å²	141.6	68%	0.675	78%	0.775	S	S	*	*			trans	-96.6	150.2	178.2	56	0	0	0	0	112.8
499	Q	27.1	Very low	29.3	Very low	189 Å²	189	140.7 Å²	140.7	88%	0.883	79%	0.786	S	S	*	*				176.4	158.9	118.7	-93.8	172.3	23.4	0	0	111.9
500	T	34.9	Very low	29.3	Very low	136 Å²	136	147.8 Å²	147.8	83%	0.834	80%	0.798	S	S	*	*			trans	-105.2	161.8	175.4	55.9	0	0	0	0	110.7
501	P	31.6	Very low	29.7	Very low	120 Å²	120	147.9 Å²	147.9	78%	0.779	80%	0.798	S	S	*	*				-147.8	152.7	118.7	36.4	-20.9	0	0	0	117
502	R	25.5	Very low	29.2	Very low	241 Å²	241	148.4 Å²	148.4	91%	0.909	80%	0.802	S	S	*	*			trans	25.5	130.1	148.6	-68.4	-179.5	170	166.1	-3.1	121.4
503	Q	30.1	Very low	29.5	Very low	195 Å²	195	147.6 Å²	147.6	91%	0.911	80%	0.801	S	S	*	*			trans	-74.1	153.4	161.9	-64.8	172.3	-48.7	0	0	112.9
504	V	27	Very low	30	Very low	143 Å²	143	144.6 Å²	144.6	87%	0.867	80%	0.796	S	S	*	*			trans	-135.5	148.6	165.2	178.5	0	0	0	0	108.6
505	S	33.6	Very low	30.8	Very low	107 Å²	107	144 Å²	144	75%	0.748	80%	0.801	S	S	*	*			trans	-93	146.3	-167.2	54.7	0	0	0	0	115.6
506	I	28.6	Very low	31.8	Very low	165 Å²	165	140.6 Å²	140.6	85%	0.846	80%	0.798	S	S	*	*			trans	-134.8	144.5	161.2	-65.2	-175.7	0	0	0	108.9
507	P	33	Very low	32.4	Very low	111 Å²	111	137.2 Å²	137.2	72%	0.721	80%	0.797	S	S	*	*			trans	-114.5	156.6	-158.6	40.9	-32.4	0	0	0	117.9
508	T	32.6	Very low	33.7	Very low	135 Å²	135	134.6 Å²	134.6	83%	0.828	79%	0.79	S	S	*	*			trans	40.9	119.3	141.8	-44.9	0	0	0	0	121.7
509	A	28.4	Very low	34.9	Very low	100 Å²	100	136 Å²	136	83%	0.826	79%	0.792	S	S	*	*			trans	-125.3	160.1	149.4	0	0	0	0	0	110.3
510	R	28.8	Very low	36.1	Very low	243 Å²	243	130.9 Å²	130.9	92%	0.917	77%	0.771	S	S	*	*			trans	-94.3	154.5	-162.8	-71.1	179.3	176	156.6	-2.3	115.4
511	V	37.9	Very low	37.1	Very low	122 Å²	122	130.6 Å²	130.6	74%	0.739	76%	0.76	S	S	*	*			trans	-97	147.9	172.8	-174.9	0	0	0	0	109.8
512	P	35	Very low	38.1	Very low	117 Å²	117	131.4 Å²	131.4	76%	0.76	76%	0.755	S	S	*	*				-138.7	110.4	118.9	33	-18.9	0	0	0	111.2
513	S	31.9	Very low	39.5	Very low	103 Å²	103	125 Å²	125	72%	0.72	74%	0.737	S	S	*	*				61	72.5	67.4	78	0	0	0	0	114.9
514	G	36.3	Very low	40.9	Very low	65 Å²	65	121.6 Å²	121.6	67%	0.67	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-77.3	165.8	146.9	0	0	0	0	0	111
515	P	40.9	Very low	42.5	Very low	129 Å²	129	118.4 Å²	118.4	84%	0.838	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-71	148.1	-179.3	30	-35.1	0	0	0	112.2
516	P	44.7	Very low	43.8	Very low	127 Å²	127	116.8 Å²	116.8	83%	0.825	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-76.6	143.1	-179	31.1	-35	0	0	0	112.9
517	A	40.7	Very low	45.7	Very low	86 Å²	86	116 Å²	116	71%	0.711	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-68.9	161.3	163.3	0	0	0	0	0	111.2
518	S	49.6	Very low	47.8	Very low	82 Å²	82	116 Å²	116	57%	0.573	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-80.7	151.4	-164.7	61.7	0	0	0	0	114.6	D520 E521	S518-D520 PolarHBondContact O-N 3.46Å; S518-E521 PolarHBondContact O-N 3.44Å
519	L	55.1	Low	49.8	Very low	140 Å²	140	115.1 Å²	115.1	73%	0.733	66%	0.658	S	S	*	*	H	α-helix	trans	-60.1	-19.1	-178.9	-139.5	78.1	0	0	0	114.2	M522 M523	L519-M522 PolarHBondContact O-N 3.31Å; L519-M523 PolarHBondContact O-N 3.12Å
520	D	52.4	Low	52.2	Low	82 Å²	82	115.2 Å²	115.2	44%	0.439	64%	0.644	S	S	.	*	H	α-helix	trans	-71.1	-29.9	-174	-169.8	61.1	0	0	0	113.2	S518 M523 K524	S518-D520 PolarHBondContact O-N 3.46Å; D520-M523 PolarHBondContact O-N 3.3Å; D520-K524 PolarHBondContact O-N 3.42Å; D520-K524 VanDerWaalsContact O-N 3.1Å; D520-K524 WeakPolarHBondContact OD2-CE 3.26Å; D520-K524 IonicContact OD2-NZ 3.34Å; D520-K524 PolarHBondContact OD2-NZ 3.35Å
521	E	56.2	Low	54.8	Low	129 Å²	129	105.6 Å²	105.6	60%	0.603	62%	0.621	S	S	*	*	H	α-helix	trans	-68.9	-38.4	175.2	-66.9	-159.4	126.3	0	0	112.2	S518 M523 K524 T525	S518-E521 PolarHBondContact O-N 3.44Å; E521-M523 VanDerWaalsContact C-N 3.32Å; E521-M523 PolarHBondContact O-N 3.42Å; E521-K524 PolarHBondContact O-N 3.47Å; E521-T525 PolarHBondContact O-N 3.02Å; E521-T525 PolarHBondContact O-OG1 2.84Å
522	M	53	Low	56.8	Low	137 Å²	137	103.3 Å²	103.3	68%	0.675	61%	0.609	S	S	*	*	H	α-helix	trans	-64.9	-35.5	174.1	-79	-169.3	164.4	0	0	112.1	L519 T525 T526	L519-M522 PolarHBondContact O-N 3.31Å; M522-T525 WeakPolarHBondContact CA-OG1 3.5Å; M522-T525 PolarHBondContact O-OG1 2.96Å; M522-T526 VanDerWaalsContact O-CB 3.31Å; M522-T526 WeakPolarHBondContact O-CB 3.29Å; M522-T526 PolarHBondContact O-N 2.96Å; M522-T526 VanDerWaalsContact O-N 3.09Å; M522-T526 PolarHBondContact O-OG1 2.89Å
523	M	54.3	Low	59.1	Low	106 Å²	106	104.9 Å²	104.9	52%	0.522	60%	0.604	S	S	.	*	H	α-helix	trans	-70.5	-31.3	175.2	-74.3	-177.6	59.7	0	0	113.2	L519 D520 E521 K527	L519-M523 PolarHBondContact O-N 3.12Å; D520-M523 PolarHBondContact O-N 3.3Å; E521-M523 VanDerWaalsContact C-N 3.32Å; E521-M523 PolarHBondContact O-N 3.42Å; M523-K527 WeakPolarHBondContact O-CG 3.31Å; M523-K527 PolarHBondContact O-N 2.75Å
524	K	59.4	Low	61.8	Low	124 Å²	124	103.6 Å²	103.6	54%	0.539	59%	0.592	S	S	.	*	H	α-helix	trans	-72.5	-50.3	173.9	-78.5	165.9	177	150.4	0	112.2	D520 E521 T526 K527 I528	D520-K524 PolarHBondContact O-N 3.42Å; D520-K524 VanDerWaalsContact O-N 3.1Å; D520-K524 WeakPolarHBondContact OD2-CE 3.26Å; D520-K524 IonicContact OD2-NZ 3.34Å; D520-K524 PolarHBondContact OD2-NZ 3.35Å; E521-K524 PolarHBondContact O-N 3.47Å; K524-T526 PolarHBondContact O-N 2.86Å; K524-K527 PolarHBondContact O-N 2.02Å; K524-I528 WeakPolarHBondContact O-CG1 3.5Å; K524-I528 PolarHBondContact O-N 2.79Å
525	T	59.9	Low	64.1	Low	76 Å²	76	102.9 Å²	102.9	47%	0.466	58%	0.579	S	S	.	*	H	α-helix	trans	-60.9	-43.4	179.7	47.2	0	0	0	0	112.2	E521 M522 K527 I528 I529	E521-T525 PolarHBondContact O-N 3.02Å; E521-T525 PolarHBondContact O-OG1 2.84Å; M522-T525 WeakPolarHBondContact CA-OG1 3.5Å; M522-T525 PolarHBondContact O-OG1 2.96Å; T525-K527 VanDerWaalsContact C-N 3.35Å; T525-K527 PolarHBondContact O-N 2.86Å; T525-I528 PolarHBondContact O-N 2.9Å; T525-I529 WeakPolarHBondContact O-CG1 3.36Å; T525-I529 PolarHBondContact O-N 2.93Å
526	T	61.5	Low	66.3	Low	74 Å²	74	101.4 Å²	101.4	45%	0.454	57%	0.568	S	S	.	*	H	α-helix	trans	-61.2	-40.2	177.4	-54.2	0	0	0	0	112.4	M522 K524 I528 I529 I530	M522-T526 VanDerWaalsContact O-CB 3.31Å; M522-T526 WeakPolarHBondContact O-CB 3.29Å; M522-T526 PolarHBondContact O-N 2.96Å; M522-T526 VanDerWaalsContact O-N 3.09Å; M522-T526 PolarHBondContact O-OG1 2.89Å; K524-T526 PolarHBondContact O-N 2.86Å; T526-I528 PolarHBondContact O-N 3.09Å; T526-I529 PolarHBondContact O-N 2.85Å; T526-I530 HydrophobicContact CG2-CD1 4.02Å; T526-I530 WeakPolarHBondContact O-CG1 3.35Å; T526-I530 PolarHBondContact O-N 2.89Å; T526-I530 VanDerWaalsContact O-N 3.08Å
527	K	68.6	Low	68.3	Low	147 Å²	147	98.7 Å²	98.7	64%	0.639	55%	0.549	S	S	*	.	H	α-helix	trans	-64.8	-37.7	176.3	-77.5	176.6	178.4	179	0	112.7	M523 K524 T525 G531	M523-K527 WeakPolarHBondContact O-CG 3.31Å; M523-K527 PolarHBondContact O-N 2.75Å; K524-K527 PolarHBondContact O-N 2.02Å; T525-K527 VanDerWaalsContact C-N 3.35Å; T525-K527 PolarHBondContact O-N 2.86Å; K527-G531 PolarHBondContact O-N 3.18Å
528	I	75.8	Confident	70.5	Confident	113 Å²	113	100 Å²	100	58%	0.579	54%	0.544	S	S	*	.	H	α-helix	trans	-64.9	-45.7	176.1	-66	165.6	0	0	0	110.3	K524 T525 T526 I530 G531 C532	K524-I528 WeakPolarHBondContact O-CG1 3.5Å; K524-I528 PolarHBondContact O-N 2.79Å; T525-I528 PolarHBondContact O-N 2.9Å; T526-I528 PolarHBondContact O-N 3.09Å; I528-I530 PolarHBondContact O-N 3.45Å; I528-G531 PolarHBondContact O-N 2.91Å; I528-C532 PolarHBondContact O-N 2.83Å; I528-C532 PolarHBondContact O-SG 2.83Å
529	I	75.5	Confident	72.3	Confident	115 Å²	115	101.8 Å²	101.8	59%	0.59	55%	0.546	S	S	*	.	H	α-helix	trans	-60.5	-46.1	179.3	-66.7	164.1	0	0	0	111.3	T525 T526 G531 C532 F533	T525-I529 WeakPolarHBondContact O-CG1 3.36Å; T525-I529 PolarHBondContact O-N 2.93Å; T526-I529 PolarHBondContact O-N 2.85Å; I529-G531 PolarHBondContact O-N 2.85Å; I529-C532 PolarHBondContact O-N 2.91Å; I529-F533 PolarHBondContact O-N 3.2Å
530	I	79.5	Confident	73.8	Confident	102 Å²	102	97.5 Å²	97.5	52%	0.523	53%	0.531	S	S	.	.	H	α-helix	trans	-62.2	-43.1	176.1	-66	167.1	0	0	0	110.7	T526 I528 C532 F533 V534	T526-I530 HydrophobicContact CG2-CD1 4.02Å; T526-I530 WeakPolarHBondContact O-CG1 3.35Å; T526-I530 PolarHBondContact O-N 2.89Å; T526-I530 VanDerWaalsContact O-N 3.08Å; I528-I530 PolarHBondContact O-N 3.45Å; I530-C532 PolarHBondContact O-N 3.18Å; I530-F533 PolarHBondContact O-N 3.29Å; I530-V534 WeakPolarHBondContact O-CG2 3.3Å; I530-V534 PolarHBondContact O-N 3.44Å
531	G	81.8	Confident	75.6	Confident	42 Å²	42	95.8 Å²	95.8	43%	0.433	53%	0.528	S	S	.	.	H	α-helix	trans	-59	-45.2	176	0	0	0	0	0	113.1	K527 I528 I529 F533 V534 A535	K527-G531 PolarHBondContact O-N 3.18Å; I528-G531 PolarHBondContact O-N 2.91Å; I529-G531 PolarHBondContact O-N 2.85Å; G531-F533 PolarHBondContact O-N 3.29Å; G531-V534 PolarHBondContact O-N 3.44Å; G531-A535 WeakPolarHBondContact O-CB 3.26Å; G531-A535 PolarHBondContact O-N 3.12Å
532	C	79.9	Confident	77	Confident	74 Å²	74	92.3 Å²	92.3	50%	0.5	52%	0.522	S	S	.	.	H	α-helix	trans	-62	-41.6	174.4	-72.4	0	0	0	0	112.2	I528 I529 I530 A535 V536	I528-C532 PolarHBondContact O-N 2.83Å; I528-C532 PolarHBondContact O-SG 2.83Å; I529-C532 PolarHBondContact O-N 2.91Å; I530-C532 PolarHBondContact O-N 3.18Å; C532-A535 PolarHBondContact O-N 3.46Å; C532-V536 WeakPolarHBondContact O-CG2 3.32Å; C532-V536 PolarHBondContact O-N 3.4Å
533	F	83.9	Confident	78.7	Confident	150 Å²	150	91.1 Å²	91.1	66%	0.658	52%	0.516	S	S	*	.	H	α-helix	trans	-66.3	-38.7	179.8	-153.4	-89.5	0	0	0	112.3	I529 I530 G531 T537	I529-F533 PolarHBondContact O-N 3.2Å; I530-F533 PolarHBondContact O-N 3.29Å; G531-F533 PolarHBondContact O-N 3.29Å; F533-T537 HydrophobicContact CD1-CG2 4.14Å; F533-T537 HydrophobicContact CE1-CG2 4.04Å; F533-T537 WeakPolarHBondContact O-CB 3.42Å; F533-T537 WeakPolarHBondContact O-CG2 3.16Å; F533-T537 PolarHBondContact O-N 2.79Å; F533-T537 PolarHBondContact O-OG1 2.85Å
534	V	88.3	Confident	80.4	Confident	76 Å²	76	92.1 Å²	92.1	46%	0.461	52%	0.522	S	S	.	.	H	α-helix	trans	-67.1	-40.3	172.9	174.1	0	0	0	0	111.4	I530 G531 T537 L538	I530-V534 WeakPolarHBondContact O-CG2 3.3Å; I530-V534 PolarHBondContact O-N 3.44Å; G531-V534 PolarHBondContact O-N 3.44Å; V534-T537 WeakPolarHBondContact CA-OG1 3.47Å; V534-T537 PolarHBondContact O-OG1 2.82Å; V534-T537 VanDerWaalsContact O-OG1 3.11Å; V534-L538 HydrophobicContact CG1-CD1 3.89Å; V534-L538 HydrophobicContact CG1-CG 4.46Å; V534-L538 WeakPolarHBondContact O-CB 3.28Å; V534-L538 VanDerWaalsContact O-CG 3.28Å; V534-L538 WeakPolarHBondContact O-CG 3.47Å; V534-L538 PolarHBondContact O-N 3.19Å
535	A	84.4	Confident	81.8	Confident	49 Å²	49	90.9 Å²	90.9	41%	0.405	52%	0.521	S	S	.	.	H	α-helix	trans	-65.2	-43.3	177.1	0	0	0	0	0	112.7	G531 C532 L539	G531-A535 WeakPolarHBondContact O-CB 3.26Å; G531-A535 PolarHBondContact O-N 3.12Å; C532-A535 PolarHBondContact O-N 3.46Å; A535-L539 WeakPolarHBondContact O-CB 3.44Å; A535-L539 PolarHBondContact O-N 2.91Å
536	V	88.4	Confident	83	Confident	99 Å²	99	89.3 Å²	89.3	60%	0.6	52%	0.515	S	S	*	.	H	α-helix	trans	-66.2	-42.5	178	169.8	0	0	0	0	111.4	C532 L539 A540	C532-V536 WeakPolarHBondContact O-CG2 3.32Å; C532-V536 PolarHBondContact O-N 3.4Å; V536-L539 PolarHBondContact O-N 2.84Å; V536-A540 WeakPolarHBondContact O-CB 3.48Å; V536-A540 PolarHBondContact O-N 2.94Å
537	T	86.1	Confident	84.2	Confident	69 Å²	69	92.5 Å²	92.5	42%	0.423	52%	0.523	S	S	.	.	H	α-helix	trans	-67.8	-37.4	178.3	46.9	0	0	0	0	112.4	F533 V534 A540 A541	F533-T537 HydrophobicContact CD1-CG2 4.14Å; F533-T537 HydrophobicContact CE1-CG2 4.04Å; F533-T537 WeakPolarHBondContact O-CB 3.42Å; F533-T537 WeakPolarHBondContact O-CG2 3.16Å; F533-T537 PolarHBondContact O-N 2.79Å; F533-T537 PolarHBondContact O-OG1 2.85Å; V534-T537 WeakPolarHBondContact CA-OG1 3.47Å; V534-T537 PolarHBondContact O-OG1 2.82Å; V534-T537 VanDerWaalsContact O-OG1 3.11Å; T537-A540 PolarHBondContact O-N 2.97Å; T537-A541 WeakPolarHBondContact O-CB 3.47Å; T537-A541 PolarHBondContact O-N 3.04Å
538	L	86.4	Confident	85.2	Confident	115 Å²	115	92.8 Å²	92.8	60%	0.602	52%	0.521	S	S	*	.	H	α-helix	trans	-65.4	-41.2	171.8	-74.1	170.8	0	0	0	112.8	V534 A541 A542	V534-L538 HydrophobicContact CG1-CD1 3.89Å; V534-L538 HydrophobicContact CG1-CG 4.46Å; V534-L538 WeakPolarHBondContact O-CB 3.28Å; V534-L538 VanDerWaalsContact O-CG 3.28Å; V534-L538 WeakPolarHBondContact O-CG 3.47Å; V534-L538 PolarHBondContact O-N 3.19Å; L538-A541 PolarHBondContact O-N 2.92Å; L538-A542 WeakPolarHBondContact O-CB 3.46Å; L538-A542 PolarHBondContact O-N 2.93Å
539	L	88	Confident	85.4	Confident	118 Å²	118	94 Å²	94	62%	0.618	52%	0.522	S	S	*	.	H	α-helix	trans	-63.1	-43	174.1	-83.8	165	0	0	0	112	A535 V536 A542 M543	A535-L539 WeakPolarHBondContact O-CB 3.44Å; A535-L539 PolarHBondContact O-N 2.91Å; V536-L539 PolarHBondContact O-N 2.84Å; L539-A542 PolarHBondContact O-N 2.8Å; L539-M543 WeakPolarHBondContact O-CB 3.41Å; L539-M543 VanDerWaalsContact O-CG 3.31Å; L539-M543 WeakPolarHBondContact O-CG 3.29Å; L539-M543 PolarHBondContact O-N 3.21Å
540	A	87.2	Confident	85.6	Confident	51 Å²	51	93.4 Å²	93.4	42%	0.421	52%	0.52	S	S	.	.	H	α-helix	trans	-61.3	-44	175.5	0	0	0	0	0	111.9	V536 T537 M543 L544	V536-A540 WeakPolarHBondContact O-CB 3.48Å; V536-A540 PolarHBondContact O-N 2.94Å; T537-A540 PolarHBondContact O-N 2.97Å; A540-M543 PolarHBondContact O-N 2.75Å; A540-L544 WeakPolarHBondContact O-CG 3.17Å; A540-L544 PolarHBondContact O-N 2.98Å
541	A	88.7	Confident	85.6	Confident	46 Å²	46	97.3 Å²	97.3	38%	0.38	53%	0.528	S	S	.	.	H	α-helix	trans	-62.5	-43.8	175.3	0	0	0	0	0	112.3	T537 L538 M543 L544 I545	T537-A541 WeakPolarHBondContact O-CB 3.47Å; T537-A541 PolarHBondContact O-N 3.04Å; L538-A541 PolarHBondContact O-N 2.92Å; A541-M543 PolarHBondContact O-N 2.69Å; A541-L544 PolarHBondContact O-N 3.24Å; A541-I545 VanDerWaalsContact O-CG1 3.31Å; A541-I545 WeakPolarHBondContact O-CG1 3.27Å; A541-I545 PolarHBondContact O-N 2.97Å
542	A	87.1	Confident	85.4	Confident	56 Å²	56	100.8 Å²	100.8	46%	0.463	53%	0.531	S	S	.	.	H	α-helix	trans	-61.9	-41.8	175.9	0	0	0	0	0	112.2	L538 L539 I545 A546	L538-A542 WeakPolarHBondContact O-CB 3.46Å; L538-A542 PolarHBondContact O-N 2.93Å; L539-A542 PolarHBondContact O-N 2.8Å; A542-I545 PolarHBondContact O-N 2.9Å; A542-A546 WeakPolarHBondContact O-CB 3.47Å; A542-A546 PolarHBondContact O-N 2.89Å
543	M	88	Confident	85.2	Confident	112 Å²	112	105.8 Å²	105.8	55%	0.552	54%	0.54	S	S	*	.	H	α-helix	trans	-64.2	-42.4	175.4	-74	-67.3	-75.6	0	0	112.3	L539 A540 A541 I545 A546 F547	L539-M543 WeakPolarHBondContact O-CB 3.41Å; L539-M543 VanDerWaalsContact O-CG 3.31Å; L539-M543 WeakPolarHBondContact O-CG 3.29Å; L539-M543 PolarHBondContact O-N 3.21Å; A540-M543 PolarHBondContact O-N 2.75Å; A541-M543 PolarHBondContact O-N 2.69Å; M543-I545 PolarHBondContact O-N 2.76Å; M543-A546 WeakPolarHBondContact O-CB 3.49Å; M543-A546 PolarHBondContact O-N 2.97Å; M543-F547 HydrophobicContact CE-CE2 4.31Å; M543-F547 WeakPolarHBondContact O-CD2 3.29Å; M543-F547 PolarHBondContact O-N 2.71Å
544	L	89.8	Confident	84.4	Confident	126 Å²	126	105.4 Å²	105.4	66%	0.66	54%	0.539	S	S	*	.	H	α-helix	trans	-62.4	-41.2	174.9	-73.3	168.3	0	0	0	112	A540 A541 A546 F547 Y548	A540-L544 WeakPolarHBondContact O-CG 3.17Å; A540-L544 PolarHBondContact O-N 2.98Å; A541-L544 PolarHBondContact O-N 3.24Å; L544-A546 VanDerWaalsContact C-N 3.34Å; L544-F547 PolarHBondContact O-N 2.93Å; L544-Y548 WeakPolarHBondContact O-CB 3.46Å; L544-Y548 PolarHBondContact O-N 3.44Å
545	I	89.1	Confident	83.3	Confident	99 Å²	99	107.6 Å²	107.6	51%	0.508	55%	0.545	S	S	.	.	H	α-helix	trans	-64.8	-38.8	174.7	-67.6	165.1	0	0	0	111.1	A541 A542 M543 K549	A541-I545 VanDerWaalsContact O-CG1 3.31Å; A541-I545 WeakPolarHBondContact O-CG1 3.27Å; A541-I545 PolarHBondContact O-N 2.97Å; A542-I545 PolarHBondContact O-N 2.9Å; M543-I545 PolarHBondContact O-N 2.76Å; I545-K549 HydrophobicContact CG2-CD 4.42Å; I545-K549 WeakPolarHBondContact O-CB 3.44Å; I545-K549 WeakPolarHBondContact O-CG 3.3Å; I545-K549 PolarHBondContact O-N 3.36Å
546	A	86.2	Confident	82.2	Confident	43 Å²	43	110.8 Å²	110.8	36%	0.355	55%	0.551	S	S	.	*	H	α-helix	trans	-65.2	-46.8	175.2	0	0	0	0	0	111.8	A542 M543 L544 Y548 K549 L550	A542-A546 WeakPolarHBondContact O-CB 3.47Å; A542-A546 PolarHBondContact O-N 2.89Å; M543-A546 WeakPolarHBondContact O-CB 3.49Å; M543-A546 PolarHBondContact O-N 2.97Å; L544-A546 VanDerWaalsContact C-N 3.34Å; A546-Y548 PolarHBondContact O-N 2.7Å; A546-K549 PolarHBondContact O-N 2.73Å; A546-L550 WeakPolarHBondContact O-CD1 3.32Å; A546-L550 PolarHBondContact O-N 3.29Å
547	F	85.3	Confident	80.6	Confident	141 Å²	141	115.4 Å²	115.4	62%	0.618	56%	0.558	S	S	*	*	H	α-helix	trans	-59.8	-42.9	174.4	-96.6	-79.2	0	0	0	112.3	M543 L544 L550 R551	M543-F547 HydrophobicContact CE-CE2 4.31Å; M543-F547 WeakPolarHBondContact O-CD2 3.29Å; M543-F547 PolarHBondContact O-N 2.71Å; L544-F547 PolarHBondContact O-N 2.93Å; F547-L550 PolarHBondContact O-N 2.85Å; F547-R551 WeakPolarHBondContact O-CB 3.29Å; F547-R551 PolarHBondContact O-N 2.82Å
548	Y	90	Very high	79.1	Confident	153 Å²	153	116 Å²	116	60%	0.6	57%	0.565	S	S	*	*	H	α-helix	trans	-62.3	-42.8	175.5	-177.8	-114.8	0	0	0	112	L544 A546 R551 K552	L544-Y548 WeakPolarHBondContact O-CB 3.46Å; L544-Y548 PolarHBondContact O-N 3.44Å; A546-Y548 PolarHBondContact O-N 2.7Å; Y548-R551 PolarHBondContact O-N 2.8Å; Y548-K552 WeakPolarHBondContact O-CB 3.25Å; Y548-K552 PolarHBondContact O-N 2.92Å
549	K	79.5	Confident	77.5	Confident	137 Å²	137	115.1 Å²	115.1	60%	0.596	56%	0.564	S	S	*	*	H	α-helix	trans	-65.4	-37.9	174.1	-76	179.9	178.4	178.3	0	112.8	I545 A546 R553	I545-K549 HydrophobicContact CG2-CD 4.42Å; I545-K549 WeakPolarHBondContact O-CB 3.44Å; I545-K549 WeakPolarHBondContact O-CG 3.3Å; I545-K549 PolarHBondContact O-N 3.36Å; A546-K549 PolarHBondContact O-N 2.73Å; K549-R553 WeakPolarHBondContact O-CB 3.35Å; K549-R553 WeakPolarHBondContact O-CG 3.27Å; K549-R553 PolarHBondContact O-N 2.97Å; K549-R553 VanDerWaalsContact O-N 3.09Å
550	L	79.2	Confident	75.7	Confident	104 Å²	104	114 Å²	114	55%	0.545	56%	0.563	S	S	.	*	H	α-helix	trans	-64.4	-48.3	172.8	-101.4	79.8	0	0	0	111.5	A546 F547 K552 R553 H554	A546-L550 WeakPolarHBondContact O-CD1 3.32Å; A546-L550 PolarHBondContact O-N 3.29Å; F547-L550 PolarHBondContact O-N 2.85Å; L550-K552 PolarHBondContact O-N 3.25Å; L550-R553 WeakPolarHBondContact O-CB 3.32Å; L550-R553 PolarHBondContact O-N 2.87Å; L550-H554 PolarHBondContact O-N 3.11Å
551	R	81.2	Confident	73.6	Confident	184 Å²	184	115.1 Å²	115.1	69%	0.694	57%	0.572	S	S	*	*	H	α-helix	trans	-60.1	-43.8	179.8	-169.3	173.1	-176.4	166.5	1.8	111.6	F547 Y548 H554 Q555	F547-R551 WeakPolarHBondContact O-CB 3.29Å; F547-R551 PolarHBondContact O-N 2.82Å; Y548-R551 PolarHBondContact O-N 2.8Å; R551-H554 PolarHBondContact O-N 2.8Å; R551-Q555 PolarHBondContact O-N 3.06Å
552	K	77.5	Confident	71.3	Confident	114 Å²	114	117.2 Å²	117.2	50%	0.496	59%	0.589	S	S	.	*	H	α-helix	trans	-62.9	-41.3	175.1	-170	167	-176.4	171.5	0	112.4	Y548 L550 H554 Q555 Q556	Y548-K552 WeakPolarHBondContact O-CB 3.25Å; Y548-K552 PolarHBondContact O-N 2.92Å; L550-K552 PolarHBondContact O-N 3.25Å; K552-H554 VanDerWaalsContact C-N 3.34Å; K552-H554 PolarHBondContact O-N 2.86Å; K552-Q555 PolarHBondContact O-N 3.02Å; K552-Q556 WeakPolarHBondContact O-CG 3.42Å; K552-Q556 PolarHBondContact O-N 2.84Å
553	R	74.7	Confident	69.1	Low	180 Å²	180	118.2 Å²	118.2	68%	0.679	60%	0.597	S	S	*	*	H	α-helix	trans	-63.2	-36.5	172.7	-77.9	176.5	170.4	-176.7	-3.2	112.7	K549 L550 R557	K549-R553 WeakPolarHBondContact O-CB 3.35Å; K549-R553 WeakPolarHBondContact O-CG 3.27Å; K549-R553 PolarHBondContact O-N 2.97Å; K549-R553 VanDerWaalsContact O-N 3.09Å; L550-R553 WeakPolarHBondContact O-CB 3.32Å; L550-R553 PolarHBondContact O-N 2.87Å; R553-R557 PolarHBondContact O-N 3.07Å; R553-R557 VanDerWaalsContact O-N 3.13Å
554	H	66.7	Low	67	Low	141 Å²	141	123.2 Å²	123.2	65%	0.653	61%	0.61	S	S	*	*	H	α-helix	trans	-67.5	-45	175.4	-113.2	-86.7	0	0	0	112.3	L550 R551 K552 Q556 R557 S558	L550-H554 PolarHBondContact O-N 3.11Å; R551-H554 PolarHBondContact O-N 2.8Å; K552-H554 VanDerWaalsContact C-N 3.34Å; K552-H554 PolarHBondContact O-N 2.86Å; H554-Q556 PolarHBondContact O-N 2.92Å; H554-R557 PolarHBondContact O-N 2.95Å; H554-S558 PolarHBondContact O-N 2.85Å
555	Q	65.3	Low	64.6	Low	122 Å²	122	123.3 Å²	123.3	57%	0.57	62%	0.616	S	S	*	*	H	α-helix	trans	-61.2	-42.4	175	-75.8	176.9	-79.4	0	0	111.9	R551 K552 R557 S558 T559	R551-Q555 PolarHBondContact O-N 3.06Å; K552-Q555 PolarHBondContact O-N 3.02Å; Q555-R557 VanDerWaalsContact C-N 3.29Å; Q555-R557 PolarHBondContact O-N 2.98Å; Q555-S558 WeakPolarHBondContact O-CB 3.31Å; Q555-S558 PolarHBondContact O-N 3.26Å; Q555-S558 VanDerWaalsContact O-N 3.14Å; Q555-T559 PolarHBondContact O-N 2.63Å; Q555-T559 VanDerWaalsContact O-N 3.12Å; Q555-T559 PolarHBondContact O-OG1 3.14Å
556	Q	61.3	Low	62	Low	116 Å²	116	125.6 Å²	125.6	54%	0.542	63%	0.628	S	S	.	*	H	α-helix	trans	-65.1	-27.1	176.1	-73	-178.5	-54.3	0	0	113.8	K552 H554 T559 V560	K552-Q556 WeakPolarHBondContact O-CG 3.42Å; K552-Q556 PolarHBondContact O-N 2.84Å; H554-Q556 PolarHBondContact O-N 2.92Å; Q556-T559 PolarHBondContact O-OG1 3.01Å; Q556-V560 WeakPolarHBondContact O-CG2 3.3Å
557	R	56.5	Low	59.4	Low	196 Å²	196	132.9 Å²	132.9	74%	0.74	65%	0.654	S	S	*	*	H	α-helix	trans	-75.9	-38	170.1	-78.6	-177.1	168	-177.3	-5.5	112.2	R553 H554 Q555 T559 V560 A561	R553-R557 PolarHBondContact O-N 3.07Å; R553-R557 VanDerWaalsContact O-N 3.13Å; H554-R557 PolarHBondContact O-N 2.95Å; Q555-R557 VanDerWaalsContact C-N 3.29Å; Q555-R557 PolarHBondContact O-N 2.98Å; R557-T559 PolarHBondContact O-N 3.06Å; R557-V560 PolarHBondContact O-N 3.18Å; R557-A561 PolarHBondContact O-N 3.4Å; R557-A561 VanDerWaalsContact O-N 3.12Å
558	S	53.7	Low	57	Low	82 Å²	82	132.9 Å²	132.9	57%	0.573	66%	0.659	S	S	*	*	H	α-helix	trans	-60.3	-43.1	178.1	-162.2	0	0	0	0	112.4	H554 Q555 V560 A561 A562	H554-S558 PolarHBondContact O-N 2.85Å; Q555-S558 WeakPolarHBondContact O-CB 3.31Å; Q555-S558 PolarHBondContact O-N 3.26Å; Q555-S558 VanDerWaalsContact O-N 3.14Å; S558-V560 VanDerWaalsContact C-N 3.32Å; S558-V560 PolarHBondContact O-N 2.75Å; S558-A561 PolarHBondContact O-N 3.26Å; S558-A562 PolarHBondContact O-N 3.11Å
559	T	53.3	Low	54.3	Low	96 Å²	96	132.8 Å²	132.8	59%	0.589	67%	0.668	S	S	*	*	H	α-helix	trans	-71.2	-24.2	-179.5	53.3	0	0	0	0	113.7	Q555 Q556 R557	Q555-T559 PolarHBondContact O-N 2.63Å; Q555-T559 VanDerWaalsContact O-N 3.12Å; Q555-T559 PolarHBondContact O-OG1 3.14Å; Q556-T559 PolarHBondContact O-OG1 3.01Å; R557-T559 PolarHBondContact O-N 3.06Å
560	V	49.7	Very low	51.9	Low	96 Å²	96	133.8 Å²	133.8	58%	0.582	67%	0.674	S	S	*	*	H	α-helix	trans	-82.9	-32.4	176.3	175.4	0	0	0	0	111.6	Q556 R557 S558 A563	Q556-V560 WeakPolarHBondContact O-CG2 3.3Å; R557-V560 PolarHBondContact O-N 3.18Å; S558-V560 VanDerWaalsContact C-N 3.32Å; S558-V560 PolarHBondContact O-N 2.75Å; V560-A563 PolarHBondContact O-N 3.34Å
561	A	42.2	Very low	49.6	Very low	74 Å²	74	137.5 Å²	137.5	61%	0.612	69%	0.691	S	S	*	*	H	α-helix	trans	-68.1	-36.6	175.4	0	0	0	0	0	112.7	R557 S558 A563	R557-A561 PolarHBondContact O-N 3.4Å; R557-A561 VanDerWaalsContact O-N 3.12Å; S558-A561 PolarHBondContact O-N 3.26Å; A561-A563 PolarHBondContact O-N 3.03Å
562	A	42.1	Very low	47.2	Very low	89 Å²	89	137.3 Å²	137.3	74%	0.736	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	-4.3	179	0	0	0	0	0	114.7	S558	S558-A562 PolarHBondContact O-N 3.11Å
563	A	40	Very low	45.2	Very low	78 Å²	78	141.3 Å²	141.3	65%	0.645	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.6	15.6	-174.1	0	0	0	0	0	113.8	V560 A561	V560-A563 PolarHBondContact O-N 3.34Å; A561-A563 PolarHBondContact O-N 3.03Å
564	R	44.8	Very low	43	Very low	217 Å²	217	141.2 Å²	141.2	82%	0.819	73%	0.726	S	S	*	*	S	Bend	trans	-143.1	71.2	179.5	-76.3	-168.5	169.7	-174.8	-4.7	113.1
565	T	38.4	Very low	41.4	Very low	128 Å²	128	140.7 Å²	140.7	79%	0.785	73%	0.732	S	S	*	*			trans	-162.4	157.2	156.7	5.3	0	0	0	0	108.5
566	I	35.2	Very low	40	Very low	147 Å²	147	140.2 Å²	140.2	75%	0.754	74%	0.74	S	S	*	*			trans	69.7	76.6	-174.5	-42.6	172.2	0	0	0	113.5	I568	I566-I568 HydrophobicContact CG2-CD1 4.09Å; I566-I568 HydrophobicContact CG2-CG1 3.91Å
567	E	30.7	Very low	39.4	Very low	195 Å²	195	140.3 Å²	140.3	91%	0.911	75%	0.751	S	S	*	*			trans	-105.4	137.3	135.5	-77.2	-176.3	143.1	0	0	106.8
568	I	34.6	Very low	38.3	Very low	142 Å²	142	138 Å²	138	73%	0.728	76%	0.758	S	S	*	*			trans	-108.1	116.8	-178.4	-62	172.2	0	0	0	107.4	I566	I566-I568 HydrophobicContact CG2-CD1 4.09Å; I566-I568 HydrophobicContact CG2-CG1 3.91Å
569	I	33.5	Very low	37.6	Very low	151 Å²	151	139.5 Å²	139.5	77%	0.774	77%	0.765	S	S	*	*			trans	-89.3	110.8	173	-61.3	176.9	0	0	0	107.7
570	Q	28.4	Very low	37.2	Very low	158 Å²	158	140.5 Å²	140.5	74%	0.738	77%	0.774	S	S	*	*			trans	-77.1	143.8	162.5	-68.8	174.5	-105.9	0	0	109.3
571	M	31.3	Very low	36.8	Very low	181 Å²	181	141.3 Å²	141.3	89%	0.892	78%	0.781	S	S	*	*			trans	-126.1	123.9	159.4	-81.1	-178.9	158	0	0	107.4
572	E	30.6	Very low	36.1	Very low	180 Å²	180	143.5 Å²	143.5	84%	0.841	79%	0.787	S	S	*	*			trans	-101.3	142.2	169.9	-67.3	174.3	121.5	0	0	108.2
573	E	35.6	Very low	35.6	Very low	199 Å²	199	145.3 Å²	145.3	93%	0.93	79%	0.794	S	S	*	*			trans	-136	132.6	170.5	-166.1	166.9	-167.1	0	0	107.5
574	E	28.8	Very low	35	Very low	177 Å²	177	145.5 Å²	145.5	83%	0.827	80%	0.804	S	S	*	*			trans	-94.5	-174.1	-165.5	-76.9	-166.2	100.3	0	0	114.1
575	V	33.1	Very low	34.3	Very low	130 Å²	130	140.4 Å²	140.4	79%	0.788	80%	0.801	S	S	*	*			trans	85.9	132	154.6	-167.8	0	0	0	0	116.3
576	P	37.1	Very low	34	Very low	113 Å²	113	140.5 Å²	140.5	73%	0.734	81%	0.807	S	S	*	*			cis	-133.4	-177.1	-34.6	39.1	-20.3	0	0	0	112.8
577	P	47.8	Very low	33.7	Very low	118 Å²	118	136.4 Å²	136.4	77%	0.766	80%	0.801	S	S	*	*			trans	-103.2	164.4	-178.4	38.9	-34.9	0	0	0	115.4
578	V	33.4	Very low	33.7	Very low	148 Å²	148	132 Å²	132	90%	0.897	79%	0.792	S	S	*	*			trans	176.2	157	149.8	140.4	0	0	0	0	110.3
579	P	38.3	Very low	33.5	Very low	112 Å²	112	132.8 Å²	132.8	73%	0.727	80%	0.797	S	S	*	*			trans	-113.8	-177.1	-141.9	44.6	-36.1	0	0	0	116.4
580	P	45.6	Very low	33.5	Very low	118 Å²	118	133.5 Å²	133.5	77%	0.766	80%	0.798	S	S	*	*			trans	-91.4	172.9	-170.8	39.6	-36.5	0	0	0	113.7
581	P	40.9	Very low	33.7	Very low	112 Å²	112	132.1 Å²	132.1	73%	0.727	80%	0.8	S	S	*	*				-154.6	153.6	99.2	41.5	-23.7	0	0	0	118.8
582	T	28.9	Very low	33.5	Very low	121 Å²	121	126.8 Å²	126.8	74%	0.742	79%	0.791	S	S	*	*			trans	48.7	131.7	142	59.1	0	0	0	0	124.9
583	S	30	Very low	33.3	Very low	127 Å²	127	126.1 Å²	126.1	89%	0.888	79%	0.793	S	S	*	*			trans	77.7	147	138.1	75.6	0	0	0	0	120.7
584	G	28.6	Very low	33	Very low	82 Å²	82	122.5 Å²	122.5	85%	0.845	78%	0.784	S	S	*	*			trans	149.9	132.7	172.9	0	0	0	0	0	113
585	S	29.7	Very low	32.9	Very low	109 Å²	109	121.7 Å²	121.7	76%	0.762	79%	0.785	S	S	*	*			trans	-136.2	156.7	178.6	58.2	0	0	0	0	111.5
586	S	30.8	Very low	33	Very low	131 Å²	131	120.6 Å²	120.6	92%	0.916	78%	0.78	S	S	*	*			trans	66.7	154.4	-176.7	74.8	0	0	0	0	115.2
587	G	29	Very low	32.4	Very low	60 Å²	60	121.9 Å²	121.9	62%	0.619	79%	0.786	S	S	*	*			cis	160.1	147.7	-7.9	0	0	0	0	0	111.8
588	S	30.5	Very low	31.4	Very low	102 Å²	102	124.4 Å²	124.4	71%	0.713	79%	0.792	S	S	*	*			trans	56.7	110.2	176.7	48.8	0	0	0	0	116.9
589	D	31.1	Very low	31.1	Very low	159 Å²	159	123.8 Å²	123.8	85%	0.85	79%	0.789	S	S	*	*				92.5	146.6	89.4	-63.2	-30.5	0	0	0	111.2
590	E	34.1	Very low	30.8	Very low	167 Å²	167	126.3 Å²	126.3	78%	0.78	79%	0.791	S	S	*	*			cis	-153.2	131.2	0.1	-153.7	-166.5	175.4	0	0	107.6
591	T	31.8	Very low	29.9	Very low	128 Å²	128	129.2 Å²	129.2	79%	0.785	79%	0.794	S	S	*	*				160.7	153.2	95.8	38.5	0	0	0	0	109.4
592	G	26.6	Very low	29.3	Very low	69 Å²	69	130.9 Å²	130.9	71%	0.711	80%	0.796	S	S	*	*			trans	133.5	107.7	152.4	0	0	0	0	0	120.6
593	L	27.9	Very low	29.1	Very low	167 Å²	167	130.1 Å²	130.1	87%	0.874	80%	0.796	S	S	*	*			trans	73	118.1	142.7	-67.6	164.7	0	0	0	123.1
594	V	28.3	Very low	29	Very low	123 Å²	123	131.1 Å²	131.1	75%	0.745	79%	0.791	S	S	*	*			trans	80.2	95.2	137.4	-176.3	0	0	0	0	120.7
595	L	27.5	Very low	28.9	Very low	160 Å²	160	133.7 Å²	133.7	84%	0.838	79%	0.791	S	S	*	*				62	156.5	122	-114.7	79.8	0	0	0	121.7
596	P	35.6	Very low	29	Very low	107 Å²	107	138.2 Å²	138.2	70%	0.695	80%	0.797	S	S	*	*				-129.2	170.3	-83.5	42.1	-28.9	0	0	0	114.5
597	T	24	Very low	28.7	Very low	140 Å²	140	141.4 Å²	141.4	86%	0.859	79%	0.794	S	S	*	*			trans	-100	157.8	164.2	46	0	0	0	0	112.1
598	L	27.6	Very low	29.3	Very low	171 Å²	171	144.6 Å²	144.6	90%	0.895	80%	0.804	S	S	*	*			trans	-117.3	134.5	177.1	-82.8	166.4	0	0	0	110.6
599	V	27.1	Very low	29	Very low	135 Å²	135	142.5 Å²	142.5	82%	0.818	80%	0.799	S	S	*	*			trans	-135	140.4	162.1	178.9	0	0	0	0	109
600	E	30.8	Very low	28.9	Very low	165 Å²	165	145.8 Å²	145.8	77%	0.771	80%	0.801	S	S	*	*			trans	-17.7	137.6	177	-53.3	-179.7	151.6	0	0	120
601	H	27.9	Very low	28.6	Very low	179 Å²	179	144.1 Å²	144.1	83%	0.829	80%	0.802	S	S	*	*				-162.9	120.5	117.6	-100.4	-20.2	0	0	0	114.1
602	N	26.6	Very low	28.4	Very low	147 Å²	147	143.5 Å²	143.5	79%	0.786	80%	0.803	S	S	*	*			trans	52.4	143	131.5	-126.3	-12.5	0	0	0	123.8
603	S	26	Very low	28.5	Very low	104 Å²	104	145.6 Å²	145.6	73%	0.727	81%	0.806	S	S	*	*			trans	91.5	142.4	145.4	81.4	0	0	0	0	122.8
604	N	28.1	Very low	28.5	Very low	148 Å²	148	143.7 Å²	143.7	79%	0.791	81%	0.807	S	S	*	*			trans	-36.6	142.9	172.2	-53.6	-37.3	0	0	0	117.2
605	T	26.2	Very low	28.4	Very low	136 Å²	136	143.2 Å²	143.2	83%	0.834	81%	0.809	S	S	*	*				-168.5	143	107.9	15	0	0	0	0	114.4
606	F	30.6	Very low	28.4	Very low	205 Å²	205	141.5 Å²	141.5	90%	0.899	81%	0.81	S	S	*	*			trans	-64.2	148.8	158.5	-113.4	-116.3	0	0	0	110.4
607	K	25.4	Very low	28	Very low	197 Å²	197	141.2 Å²	141.2	86%	0.857	81%	0.811	S	S	*	*			trans	-135.7	131.4	167.1	-104.2	-175.8	177.8	176.9	0	112.4
608	P	40.8	Very low	28.1	Very low	127 Å²	127	146.2 Å²	146.2	83%	0.825	81%	0.814	S	S	*	*			trans	-110	172.6	-178.3	41.1	-35.6	0	0	0	114.7
609	G	25.9	Very low	28.2	Very low	58 Å²	58	147.5 Å²	147.5	60%	0.598	82%	0.816	S	S	*	*			trans	-157	125.4	158.1	0	0	0	0	0	109.1
610	Y	28.3	Very low	28.3	Very low	229 Å²	229	144.5 Å²	144.5	90%	0.898	81%	0.812	S	S	*	*				63.3	128	92	-65.3	-52.5	0	0	0	113
611	V	28.4	Very low	28.1	Very low	132 Å²	132	142 Å²	142	80%	0.8	81%	0.812	S	S	*	*			cis	-150.7	150.7	9.5	121	0	0	0	0	107.1
612	S	27.3	Very low	28.2	Very low	115 Å²	115	145 Å²	145	80%	0.804	82%	0.818	S	S	*	*				-159.7	-143.8	56.6	63.4	0	0	0	0	112.8
613	S	27.9	Very low	28.2	Very low	112 Å²	112	141.6 Å²	141.6	78%	0.783	82%	0.818	S	S	*	*			trans	-148.6	148.5	-179.6	58.8	0	0	0	0	113.3
614	S	27.3	Very low	28.2	Very low	127 Å²	127	141.8 Å²	141.8	89%	0.888	83%	0.826	S	S	*	*			trans	-157.3	164.9	149.9	61.6	0	0	0	0	110.8
615	S	27.5	Very low	28.1	Very low	114 Å²	114	142.2 Å²	142.2	80%	0.797	82%	0.823	S	S	*	*			trans	-125.8	146.1	-160	56	0	0	0	0	114.5
616	S	27	Very low	28	Very low	123 Å²	123	144.5 Å²	144.5	86%	0.86	82%	0.817	S	S	*	*				-175.2	149.8	128.7	38.8	0	0	0	0	114.8
617	S	26.7	Very low	27.8	Very low	101 Å²	101	142 Å²	142	71%	0.706	82%	0.818	S	S	*	*			trans	-55.5	153.1	-178.1	55.1	0	0	0	0	118.7
618	R	27.3	Very low	27.9	Very low	246 Å²	246	139.5 Å²	139.5	93%	0.928	81%	0.81	S	S	*	*				-162.6	167.4	109	-105.4	169.2	-176.4	-173.9	0.6	113.2
619	Q	29.4	Very low	27.2	Very low	198 Å²	198	140.3 Å²	140.3	93%	0.925	81%	0.807	S	S	*	*			trans	-110.7	169.1	-161.9	-65.9	162.5	-81.6	0	0	114.4
620	G	27.9	Very low	27.2	Very low	72 Å²	72	145 Å²	145	74%	0.742	82%	0.819	S	S	*	*			trans	121.9	93.7	166.8	0	0	0	0	0	111.6
621	S	26.9	Very low	27.1	Very low	112 Å²	112	139.2 Å²	139.2	78%	0.783	81%	0.811	S	S	*	*			cis	68.6	92.2	21.2	-159.9	0	0	0	0	115.2
622	Y	31.4	Very low	27.1	Very low	241 Å²	241	141.5 Å²	141.5	95%	0.945	82%	0.818	S	S	*	*			trans	-134.1	137.8	140.7	-88.9	-78.6	0	0	0	107.5
623	G	25.1	Very low	27.1	Very low	77 Å²	77	144.3 Å²	144.3	79%	0.794	82%	0.818	S	S	*	*			trans	-138.1	152.6	175.8	0	0	0	0	0	110.8
624	A	27.6	Very low	27	Very low	108 Å²	108	150.1 Å²	150.1	89%	0.893	82%	0.823	S	S	*	*			trans	-131.7	141.2	167.4	0	0	0	0	0	107.5
625	H	26	Very low	26.9	Very low	156 Å²	156	149 Å²	149	72%	0.722	82%	0.815	S	S	*	*			trans	-153.4	143.6	-156.7	-147.9	-48.6	0	0	0	110.4
626	W	23.8	Very low	27	Very low	185 Å²	185	149.1 Å²	149.1	70%	0.701	81%	0.811	S	S	*	*			trans	71.4	120.4	173.7	-53.7	93.4	0	0	0	118.3	Q628	W626-Q628 HydrophobicContact CE3-CB 4.42Å
627	T	26.3	Very low	26.9	Very low	151 Å²	151	153.7 Å²	153.7	93%	0.926	81%	0.809	S	S	*	*				-137.5	160.6	97	36.7	0	0	0	0	108.8
628	Q	26.6	Very low	26.9	Very low	146 Å²	146	156.6 Å²	156.6	68%	0.682	81%	0.812	S	S	*	*			trans	-134.4	170.7	-175.5	-155.5	177.8	24.7	0	0	109.9	W626	W626-Q628 HydrophobicContact CE3-CB 4.42Å
629	N	26.6	Very low	26.9	Very low	143 Å²	143	152.5 Å²	152.5	77%	0.765	80%	0.803	S	S	*	*			trans	76.8	144.7	-170.9	-52	-22.2	0	0	0	112.9
630	N	26.5	Very low	26.8	Very low	158 Å²	158	150.6 Å²	150.6	85%	0.845	79%	0.793	S	S	*	*			cis	-133.8	158	17.1	-133.1	-3.1	0	0	0	112.8
631	S	26.1	Very low	26.8	Very low	107 Å²	107	152.3 Å²	152.3	75%	0.748	79%	0.794	S	S	*	*			trans	-101.8	147.8	178.7	54.3	0	0	0	0	112.6
632	L	27.8	Very low	26.8	Very low	180 Å²	180	155.4 Å²	155.4	94%	0.942	80%	0.796	S	S	*	*			trans	-157.2	166.6	158.6	-112.2	166	0	0	0	110.8
633	H	27.8	Very low	26.7	Very low	173 Å²	173	151.7 Å²	151.7	80%	0.801	79%	0.791	S	S	*	*			trans	-101.9	164.8	-152.1	-114.6	-63.7	0	0	0	115.8
634	R	25.7	Very low	26.7	Very low	235 Å²	235	152.7 Å²	152.7	89%	0.887	79%	0.786	S	S	*	*			trans	75.3	146.9	160.3	-77.8	176.8	175.6	-178.5	-1.6	116.5
635	S	25.7	Very low	26.8	Very low	102 Å²	102	155.5 Å²	155.5	71%	0.713	78%	0.784	S	S	*	*			cis	-149.5	142	-10.6	-168.3	0	0	0	0	110.5
636	V	28.1	Very low	27	Very low	118 Å²	118	155.7 Å²	155.7	72%	0.715	79%	0.788	S	S	*	*			trans	-69.2	137.7	164.5	178.3	0	0	0	0	109	Q638	V636-Q638 HydrophobicContact CG1-CG 4.09Å
637	R	25.7	Very low	27.2	Very low	218 Å²	218	150.8 Å²	150.8	82%	0.823	79%	0.787	S	S	*	*			trans	-126.2	96.5	159.3	-86.4	-168.3	175.1	-175.9	-0.8	108.7
638	Q	27.3	Very low	27.3	Very low	163 Å²	163	151.1 Å²	151.1	76%	0.762	78%	0.783	S	S	*	*			trans	-78.3	126	157.4	-71.8	171.5	-33.7	0	0	107.3	V636	V636-Q638 HydrophobicContact CG1-CG 4.09Å
639	H	26.7	Very low	27.7	Very low	160 Å²	160	149.2 Å²	149.2	74%	0.741	78%	0.784	S	S	*	*			trans	-109.4	109.6	161.8	-95.2	-72.8	0	0	0	108.5
640	H	27	Very low	27.8	Very low	157 Å²	157	153.4 Å²	153.4	73%	0.727	79%	0.79	S	S	*	*			trans	-73.5	138.9	153.7	-67.4	7.4	0	0	0	108
641	S	27.8	Very low	27.8	Very low	109 Å²	109	151.8 Å²	151.8	76%	0.762	79%	0.786	S	S	*	*			trans	-119.4	106.1	168	54.6	0	0	0	0	108.7
642	H	27.7	Very low	27.9	Very low	176 Å²	176	154.4 Å²	154.4	82%	0.815	79%	0.79	S	S	*	*			trans	-61.8	139.5	169.4	-74.5	-105.9	0	0	0	109.8
643	I	28	Very low	27.8	Very low	164 Å²	164	153.8 Å²	153.8	84%	0.841	78%	0.784	S	S	*	*			trans	-94.7	110.3	163.9	-63.6	177.8	0	0	0	107.1
644	S	26.8	Very low	27.8	Very low	98 Å²	98	152.3 Å²	152.3	69%	0.685	79%	0.788	S	S	*	*			trans	-84.3	130.3	177.6	-57.4	0	0	0	0	110.5
645	I	29.7	Very low	27.9	Very low	167 Å²	167	146.6 Å²	146.6	86%	0.856	78%	0.783	S	S	*	*			trans	-83.4	115.3	172	-58.9	171.3	0	0	0	108.5
646	I	28.8	Very low	28	Very low	159 Å²	159	151.1 Å²	151.1	82%	0.815	79%	0.793	S	S	*	*			trans	-136	133.3	159.5	-58.7	-177.6	0	0	0	106.9
647	A	27.7	Very low	28	Very low	82 Å²	82	149.2 Å²	149.2	68%	0.678	80%	0.797	S	S	*	*			trans	-114.5	145	168.8	0	0	0	0	0	108.8
648	D	28.4	Very low	28.2	Very low	158 Å²	158	148.4 Å²	148.4	85%	0.845	80%	0.8	S	S	*	*			trans	-163.3	157.4	142.9	-106.5	-25.5	0	0	0	110.5
649	P	35.3	Very low	28.3	Very low	107 Å²	107	147.8 Å²	147.8	70%	0.695	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-94.7	147.4	-162	35.4	-35.7	0	0	0	114.5
650	Y	28.7	Very low	28.3	Very low	230 Å²	230	147.8 Å²	147.8	90%	0.902	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-95	116.4	164.8	-93	-85.7	0	0	0	111.7
651	V	26.4	Very low	28.3	Very low	124 Å²	124	146.5 Å²	146.5	75%	0.752	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-77.5	133.7	167.7	176.7	0	0	0	0	109.2
652	I	29.1	Very low	28.3	Very low	162 Å²	162	149.7 Å²	149.7	83%	0.831	80%	0.8	S	S	*	*			trans	-122.2	133.8	165.2	-62.9	-177.8	0	0	0	108.3
653	M	25.8	Very low	28.3	Very low	168 Å²	168	149.6 Å²	149.6	83%	0.828	80%	0.8	S	S	*	*			trans	-79.3	149.1	-170.1	-58.1	177.4	78.3	0	0	112.4
654	T	27	Very low	28.4	Very low	142 Å²	142	148 Å²	148	87%	0.871	80%	0.798	S	S	*	*			trans	-74.9	124	166.1	40.8	0	0	0	0	110.7
655	S	27.5	Very low	28.5	Very low	114 Å²	114	152.3 Å²	152.3	80%	0.797	81%	0.807	S	S	*	*			trans	-121.4	104.6	171.5	59	0	0	0	0	110.6	G657	S655-G657 PolarHBondContact O-N 3.16Å; S655-G657 VanDerWaalsContact O-N 3.16Å
656	H	28.4	Very low	28.8	Very low	198 Å²	198	156 Å²	156	92%	0.917	83%	0.826	S	S	*	*			trans	-71.4	104.5	174.5	-83.4	-60	0	0	0	111.4
657	G	29	Very low	28.8	Very low	77 Å²	77	155.9 Å²	155.9	79%	0.794	83%	0.827	S	S	*	*			trans	-95.1	113.8	160.2	0	0	0	0	0	110.5	S655	S655-G657 PolarHBondContact O-N 3.16Å; S655-G657 VanDerWaalsContact O-N 3.16Å
658	K	29.9	Very low	28.9	Very low	202 Å²	202	159.8 Å²	159.8	88%	0.878	84%	0.835	S	S	*	*			trans	-91.4	133.9	163.7	-66.1	179.6	-179.7	178.8	0	108.3
659	E	29.1	Very low	28.9	Very low	149 Å²	149	159.9 Å²	159.9	70%	0.696	83%	0.834	S	S	*	*				-175	154.1	117.8	-103.6	-160.3	149	0	0	114.6
660	K	27.3	Very low	28.5	Very low	161 Å²	161	163 Å²	163	70%	0.7	84%	0.843	S	S	*	*			trans	56	91.5	150.1	-69.7	164	-174.5	147.2	0	119
661	V	27.1	Very low	28.5	Very low	129 Å²	129	158.8 Å²	158.8	78%	0.782	84%	0.839	S	S	*	*			trans	-39.2	138.3	136.8	176.5	0	0	0	0	111.1	E663	V661-E663 HydrophobicContact CG1-CG 4.22Å
662	Q	27.5	Very low	28.6	Very low	176 Å²	176	161.1 Å²	161.1	82%	0.822	85%	0.845	S	S	*	*			trans	-139.6	116.9	149.4	-168.7	165.4	12.4	0	0	109.1
663	E	26.8	Very low	28.6	Very low	175 Å²	175	161.1 Å²	161.1	82%	0.818	85%	0.846	S	S	*	*			trans	-76.8	135.4	172.3	-63	172.5	117.3	0	0	109.6	V661	V661-E663 HydrophobicContact CG1-CG 4.22Å
664	T	29.5	Very low	28.8	Very low	129 Å²	129	160.5 Å²	160.5	79%	0.791	85%	0.847	S	S	*	*			trans	-131.8	114.6	160.8	51	0	0	0	0	108.6
665	Q	30.3	Very low	29	Very low	189 Å²	189	162.1 Å²	162.1	88%	0.883	85%	0.845	S	S	*	*			trans	-68.3	144	175.8	-62.6	167	-25	0	0	111.1
666	I	35.2	Very low	29.1	Very low	246 Å²	246	166.5 Å²	166.5	100%	1.262	85%	0.849	S	S	*	*			trans	-165.1	0	134.6	-95.1	151.1	0	0	0	107.3

Retrieved 666 of 666 residues in 1068.9 ms (Link to these results)

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