A0A096MLM9_PAPAN Loading...

Leucine rich repeat and Ig domain containing 2

AlphaFold DB (F7HGM2), UniProt , Accession A0A096MLM9, Species PAPAN (Papio anubis, Olive baboon), Gene LINGO2, Length 606 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.3	Very low	42.8	Very low	243 Å²	243	158 Å²	158	100%	1.197	85%	0.848	S	S	*	*				0	90.6	0	-70.3	-174.2	-173.7	0	0	107.2
2	L	31.8	Very low	43.4	Very low	179 Å²	179	157.8 Å²	157.8	94%	0.937	83%	0.834	S	S	*	*			trans	-121.9	105.8	-176.9	-128.1	82.6	0	0	0	107.8
3	H	37.8	Very low	43.8	Very low	178 Å²	178	157.1 Å²	157.1	82%	0.824	83%	0.83	S	S	*	*			trans	-74.8	159.5	160.5	-100.2	-74.6	0	0	0	109.4
4	T	45.2	Very low	44	Very low	134 Å²	134	148.9 Å²	148.9	82%	0.822	80%	0.802	S	S	*	*			trans	75	92.6	164.5	68.5	0	0	0	0	118.5
5	A	36.6	Very low	44.4	Very low	101 Å²	101	146.3 Å²	146.3	84%	0.835	79%	0.787	S	S	*	*			trans	-176.9	65.6	135.1	0	0	0	0	0	110.2
6	I	48.4	Very low	44.6	Very low	177 Å²	177	140.1 Å²	140.1	91%	0.908	76%	0.762	S	S	*	*			trans	-105.8	87.3	167.6	-60.5	170	0	0	0	106.8
7	S	48.1	Very low	44.9	Very low	109 Å²	109	136.6 Å²	136.6	76%	0.762	75%	0.746	S	S	*	*			trans	173.9	101.4	154.4	60.5	0	0	0	0	108.9
8	C	45.1	Very low	45.1	Very low	107 Å²	107	134.3 Å²	134.3	72%	0.723	74%	0.736	S	S	*	*	S	Bend	trans	175.9	20.3	149.7	-101.4	0	0	0	0	115.4
9	W	42.4	Very low	45.1	Very low	238 Å²	238	133.1 Å²	133.1	90%	0.902	73%	0.728	S	S	*	*			trans	-129	44.5	179.8	-79.3	68	0	0	0	112.8
10	Q	46.4	Very low	45.2	Very low	190 Å²	190	132.9 Å²	132.9	89%	0.888	73%	0.725	S	S	*	*	S	Bend	trans	-121.2	5.3	169.1	-89.9	-168	-35.9	0	0	117.6
11	P	48.7	Very low	45	Very low	82 Å²	82	135.4 Å²	135.4	53%	0.532	73%	0.729	S	S	.	*	S	Bend	trans	-96.4	-15.8	170	35	-29.4	0	0	0	114.4
12	F	50.5	Low	45.1	Very low	155 Å²	155	130.2 Å²	130.2	68%	0.68	70%	0.704	S	S	*	*	H	α-helix	trans	-85.8	-22.7	-172.4	-77.2	-76.3	0	0	0	115.4
13	L	48.1	Very low	45.6	Very low	149 Å²	149	124.6 Å²	124.6	78%	0.78	69%	0.689	S	S	*	*	H	α-helix	trans	-79.7	-27.3	174.6	-128.2	86.1	0	0	0	112.5	V17	L13-V17 WeakPolarHBondContact O-CG2 3.41Å; L13-V17 PolarHBondContact O-N 2.97Å
14	G	46.7	Very low	45.8	Very low	42 Å²	42	121.8 Å²	121.8	43%	0.433	69%	0.689	S	S	.	*	H	α-helix	trans	-73.3	-35.4	175.1	0	0	0	0	0	112.9	V17 V18	G14-V17 PolarHBondContact O-N 2.84Å; G14-V18 WeakPolarHBondContact O-CG2 3.42Å; G14-V18 PolarHBondContact O-N 2.69Å
15	L	49.4	Very low	45.9	Very low	110 Å²	110	121.6 Å²	121.6	58%	0.576	69%	0.688	S	S	*	*	H	α-helix	trans	-71.3	-32.2	178.4	-133.2	96.5	0	0	0	112.4	L19	L15-L19 HydrophobicContact CD2-CD1 4.34Å; L15-L19 WeakPolarHBondContact O-CB 2.94Å; L15-L19 WeakPolarHBondContact O-CD1 3.38Å; L15-L19 WeakPolarHBondContact O-CG 3.32Å; L15-L19 PolarHBondContact O-N 2.8Å
16	A	49	Very low	46.9	Very low	47 Å²	47	125 Å²	125	39%	0.388	69%	0.691	S	S	.	*	H	α-helix	trans	-70.6	-35.8	175.3	0	0	0	0	0	112.1	L19 I20	A16-L19 PolarHBondContact O-N 3.23Å; A16-I20 WeakPolarHBondContact O-CB 3.42Å; A16-I20 VanDerWaalsContact O-CD1 3.32Å; A16-I20 WeakPolarHBondContact O-CD1 3.15Å; A16-I20 WeakPolarHBondContact O-CG1 3.29Å; A16-I20 PolarHBondContact O-N 2.92Å
17	V	49.1	Very low	47.9	Very low	82 Å²	82	118 Å²	118	50%	0.497	66%	0.662	S	S	.	*	H	α-helix	trans	-76.8	-29.7	176.6	178.4	0	0	0	0	112	L13 G14 I20 F21	L13-V17 WeakPolarHBondContact O-CG2 3.41Å; L13-V17 PolarHBondContact O-N 2.97Å; G14-V17 PolarHBondContact O-N 2.84Å; V17-I20 PolarHBondContact O-N 3.43Å; V17-F21 HydrophobicContact CG1-CD2 4.42Å; V17-F21 PolarHBondContact O-N 2.81Å; V17-F21 VanDerWaalsContact O-N 3.13Å
18	V	48.6	Very low	49.6	Very low	94 Å²	94	115.6 Å²	115.6	57%	0.57	65%	0.645	S	S	*	*	H	α-helix	trans	-73.2	-30.7	170.8	174.5	0	0	0	0	111.9	G14	G14-V18 WeakPolarHBondContact O-CG2 3.42Å; G14-V18 PolarHBondContact O-N 2.69Å
19	L	45.8	Very low	51.7	Low	112 Å²	112	111 Å²	111	59%	0.586	61%	0.613	S	S	*	*	H	α-helix	trans	-77.8	-24.4	171.9	-76.6	163.8	0	0	0	113.3	L15 A16 M22	L15-L19 HydrophobicContact CD2-CD1 4.34Å; L15-L19 WeakPolarHBondContact O-CB 2.94Å; L15-L19 WeakPolarHBondContact O-CD1 3.38Å; L15-L19 WeakPolarHBondContact O-CG 3.32Å; L15-L19 PolarHBondContact O-N 2.8Å; A16-L19 PolarHBondContact O-N 3.23Å; L19-M22 PolarHBondContact O-N 2.95Å
20	I	45.9	Very low	53.7	Low	129 Å²	129	105 Å²	105	66%	0.662	62%	0.615	S	S	*	*	H	α-helix	trans	-80.5	-21.5	173.6	-68.2	163.6	0	0	0	111.8	A16 V17 M22	A16-I20 WeakPolarHBondContact O-CB 3.42Å; A16-I20 VanDerWaalsContact O-CD1 3.32Å; A16-I20 WeakPolarHBondContact O-CD1 3.15Å; A16-I20 WeakPolarHBondContact O-CG1 3.29Å; A16-I20 PolarHBondContact O-N 2.92Å; V17-I20 PolarHBondContact O-N 3.43Å; I20-M22 PolarHBondContact O-N 3.27Å
21	F	41.8	Very low	55.7	Low	186 Å²	186	103.6 Å²	103.6	82%	0.816	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	5.8	163.5	-90.9	-79.2	0	0	0	114.2	V17	V17-F21 HydrophobicContact CG1-CD2 4.42Å; V17-F21 PolarHBondContact O-N 2.81Å; V17-F21 VanDerWaalsContact O-N 3.13Å
22	M	42.4	Very low	57.9	Low	134 Å²	134	100.4 Å²	100.4	66%	0.66	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.9	17.5	167.9	-66.4	-131.4	171.2	0	0	113	L19 I20	L19-M22 PolarHBondContact O-N 2.95Å; I20-M22 PolarHBondContact O-N 3.27Å
23	G	41.6	Very low	59.9	Low	61 Å²	61	99.1 Å²	99.1	63%	0.629	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.3	74	175.2	0	0	0	0	0	113.1
24	S	42.4	Very low	62	Low	118 Å²	118	94.4 Å²	94.4	83%	0.825	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	169.7	47.4	148.7	38.2	0	0	0	0	112.6
25	T	46.3	Very low	64.2	Low	131 Å²	131	94.4 Å²	94.4	80%	0.804	55%	0.549	S	S	*	.			trans	-102.1	51.5	169.8	51.4	0	0	0	0	110.9
26	I	59.1	Low	66.1	Low	172 Å²	172	93.7 Å²	93.7	88%	0.882	56%	0.559	S	S	*	*			trans	-127.4	110.1	165.5	-57.7	171.4	0	0	0	105.3
27	G	68.1	Low	67.9	Low	30 Å²	30	100.1 Å²	100.1	31%	0.309	58%	0.581	S	S	.	*	S	Bend	trans	157.5	-16.8	168.4	0	0	0	0	0	116	G54 P56	G27-G54 CarbonylContact C-O 3.6Å; G27-G54 VanDerWaalsContact C-O 3.29Å; G27-P56 WeakPolarHBondContact O-CD 3.37Å; G27-P56 WeakPolarHBondContact O-CG 3.3Å
28	C	83.8	Confident	69.9	Low	59 Å²	59	101.2 Å²	101.2	40%	0.399	58%	0.584	S	S	.	*	S	Bend	trans	-114.7	127.9	176.9	-165.3	0	0	0	0	111.2	A30 C32 C34	C28-A30 PolarHBondContact O-N 3.38Å; C28-C32 PolarHBondContact SG-O 3.08Å; C28-C32 VanDerWaalsContact SG-O 3.41Å; C28-C34 WeakPolarHBondContact CA-SG 3.46Å; C28-C34 HydrophobicContact CB-CB 3.67Å; C28-C34 WeakPolarHBondContact CB-SG 3.39Å; C28-C34 WeakPolarHBondContact SG-CB 3.35Å; C28-C34 PolarHBondContact SG-N 2.92Å; C28-C34 VanDerWaalsContact SG-N 3.37Å; C28-C34 CovalentContact SG-SG 2.03Å; C28-C34 PolarHBondContact SG-SG 2.9Å
29	P	90.1	Very high	72	Confident	9 Å²	9	101 Å²	101	6%	0.058	58%	0.575	C	S	.	*			trans	-58.3	137.7	174.7	-20.7	30.2	0	0	0	110.9	R31 C32 P52 G54 I55	P29-R31 PolarHBondContact O-N 2.79Å; P29-C32 HydrophobicContact CB-CB 4.08Å; P29-C32 HydrophobicContact CG-CB 4.28Å; P29-C32 PolarHBondContact O-N 2.94Å; P29-P52 HydrophobicContact CB-CB 4.03Å; P29-P52 HydrophobicContact CB-CG 4.22Å; P29-P52 HydrophobicContact CG-CB 4.39Å; P29-P52 HydrophobicContact CG-CG 4.2Å; P29-G54 WeakPolarHBondContact CD-O 3.25Å; P29-I55 HydrophobicContact CG-CG1 3.78Å
30	A	84.6	Confident	74.4	Confident	113 Å²	113	97 Å²	97	93%	0.934	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.8	-20.6	-170.6	0	0	0	0	0	115.4	C28	C28-A30 PolarHBondContact O-N 3.38Å
31	R	88.4	Confident	76.8	Confident	161 Å²	161	90.9 Å²	90.9	61%	0.608	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	-1	178.9	-64.7	-173.8	178	179.2	3.2	113.6	P29 R46	P29-R31 PolarHBondContact O-N 2.79Å; R31-R46 HydrophobicContact CB-CB 4.43Å; R31-R46 WeakPolarHBondContact O-CD 3Å; R31-R46 WeakPolarHBondContact O-CG 3.24Å; R31-R46 PolarHBondContact O-NE 2.9Å; R31-R46 VanDerWaalsContact O-NE 3.07Å
32	C	93.3	Very high	79.4	Confident	14 Å²	14	83.8 Å²	83.8	10%	0.095	50%	0.499	C	S	.	.	S	Bend	trans	-114	162	-173.3	-56.6	0	0	0	0	111.3	C28 P29 V41 S42 C43	C28-C32 PolarHBondContact SG-O 3.08Å; C28-C32 VanDerWaalsContact SG-O 3.41Å; P29-C32 HydrophobicContact CB-CB 4.08Å; P29-C32 HydrophobicContact CG-CB 4.28Å; P29-C32 PolarHBondContact O-N 2.94Å; C32-V41 HydrophobicContact CB-CG1 4.13Å; C32-S42 WeakPolarHBondContact CA-O 3.48Å; C32-S42 WeakPolarHBondContact CB-O 3.4Å; C32-C43 HydrophobicContact CB-CB 4.08Å; C32-C43 WeakPolarHBondContact CB-SG 3.2Å; C32-C43 WeakPolarHBondContact SG-CB 3.47Å; C32-C43 CovalentContact SG-SG 2.03Å; C32-C43 PolarHBondContact SG-SG 2.79Å
33	E	93	Very high	81.9	Confident	128 Å²	128	77.4 Å²	77.4	60%	0.598	47%	0.467	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.1	121.6	176	-70.5	170	-156.1	0	0	108.1	S42 R46	E33-S42 PolarHBondContact N-O 2.89Å; E33-S42 PolarHBondContact O-N 3.16Å; E33-R46 IonicContact OE1-CZ 2.97Å; E33-R46 IonicContact OE1-NH2 3.95Å; E33-R46 PolarHBondContact OE1-NH2 3.01Å
34	C	92.9	Very high	84.4	Confident	50 Å²	50	76.9 Å²	76.9	34%	0.338	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	135.6	-178.2	-52.6	0	0	0	0	110.4	C28 S40 V41	C28-C34 WeakPolarHBondContact CA-SG 3.46Å; C28-C34 HydrophobicContact CB-CB 3.67Å; C28-C34 WeakPolarHBondContact CB-SG 3.39Å; C28-C34 WeakPolarHBondContact SG-CB 3.35Å; C28-C34 PolarHBondContact SG-N 2.92Å; C28-C34 VanDerWaalsContact SG-N 3.37Å; C28-C34 CovalentContact SG-SG 2.03Å; C28-C34 PolarHBondContact SG-SG 2.9Å; C34-S40 CarbonylContact C-O 3.5Å; C34-S40 WeakPolarHBondContact CA-O 3.28Å; C34-V41 HydrophobicContact CB-CG2 4.29Å
35	S	92.9	Very high	86.9	Confident	42 Å²	42	79.2 Å²	79.2	29%	0.294	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	112.6	172.3	178.9	0	0	0	0	109.3	Q37 K39 S40	S35-Q37 VanDerWaalsContact C-N 3.3Å; S35-Q37 PolarHBondContact O-N 3.36Å; S35-K39 WeakPolarHBondContact O-CA 3.29Å; S35-K39 PolarHBondContact O-N 2.97Å; S35-S40 WeakPolarHBondContact CB-OG 3.49Å; S35-S40 PolarHBondContact N-O 3.13Å; S35-S40 PolarHBondContact O-N 3.34Å
36	A	88.1	Confident	89.2	Confident	95 Å²	95	77.2 Å²	77.2	79%	0.785	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-30.8	178	0	0	0	0	0	112.5	K39	A36-K39 PolarHBondContact O-N 2.97Å
37	Q	88.4	Confident	90.9	Very high	183 Å²	183	77.5 Å²	77.5	86%	0.855	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-45.8	-180	-67.7	-175.2	-14.4	0	0	111.9	S35	S35-Q37 VanDerWaalsContact C-N 3.3Å; S35-Q37 PolarHBondContact O-N 3.36Å
38	N	89.8	Confident	92.1	Very high	104 Å²	104	76.9 Å²	76.9	56%	0.556	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-1.9	-179.2	-65.6	-5	0	0	0	112.5	S40	N38-S40 PolarHBondContact O-N 2.99Å
39	K	94	Very high	92.6	Very high	89 Å²	89	79.9 Å²	79.9	39%	0.387	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.8	45	-171	-57.9	-177.5	175.2	-164.9	0	110.9	S35 A36 E58 T59 K60 I61	S35-K39 WeakPolarHBondContact O-CA 3.29Å; S35-K39 PolarHBondContact O-N 2.97Å; A36-K39 PolarHBondContact O-N 2.97Å; K39-E58 WeakPolarHBondContact CD-O 3.4Å; K39-T59 WeakPolarHBondContact O-CA 3.33Å; K39-K60 HydrophobicContact CB-CB 4.25Å; K39-K60 HydrophobicContact CB-CD 4.45Å; K39-K60 HydrophobicContact CB-CG 4.09Å; K39-K60 HydrophobicContact CD-CD 4.24Å; K39-K60 HydrophobicContact CD-CG 4.25Å; K39-K60 PolarHBondContact O-N 3.15Å; K39-I61 PolarHBondContact O-N 2.02Å
40	S	95.4	Very high	92.6	Very high	28 Å²	28	82.4 Å²	82.4	20%	0.196	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	139.8	-173.8	68.4	0	0	0	0	111.1	C34 S35 N38 I61	C34-S40 CarbonylContact C-O 3.5Å; C34-S40 WeakPolarHBondContact CA-O 3.28Å; S35-S40 WeakPolarHBondContact CB-OG 3.49Å; S35-S40 PolarHBondContact N-O 3.13Å; S35-S40 PolarHBondContact O-N 3.34Å; N38-S40 PolarHBondContact O-N 2.99Å; S40-I61 CarbonylContact C-O 3.59Å; S40-I61 VanDerWaalsContact CA-O 3.26Å; S40-I61 WeakPolarHBondContact CA-O 3.11Å
41	V	96	Very high	92.9	Very high	2 Å²	2	78.4 Å²	78.4	1%	0.012	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	119.3	174.8	179.2	0	0	0	0	108.5	C32 C34 I55 P56 T59 I61 L62 D63	C32-V41 HydrophobicContact CB-CG1 4.13Å; C34-V41 HydrophobicContact CB-CG2 4.29Å; V41-I55 HydrophobicContact CG2-CG2 4.27Å; V41-P56 HydrophobicContact CG2-CG 4.31Å; V41-T59 HydrophobicContact CB-CG2 4.25Å; V41-T59 HydrophobicContact CG2-CG2 3.84Å; V41-I61 PolarHBondContact N-O 2.84Å; V41-L62 HydrophobicContact CB-CD1 3.98Å; V41-L62 HydrophobicContact CG1-CD1 4.1Å; V41-D63 PolarHBondContact O-N 2.99Å
42	S	96.4	Very high	93	Very high	36 Å²	36	71.8 Å²	71.8	25%	0.252	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	123.1	174.5	-179	0	0	0	0	111.2	C32 E33 D63	C32-S42 WeakPolarHBondContact CA-O 3.48Å; C32-S42 WeakPolarHBondContact CB-O 3.4Å; E33-S42 PolarHBondContact N-O 2.89Å; E33-S42 PolarHBondContact O-N 3.16Å; S42-D63 PolarHBondContact OG-OD2 2.9Å
43	C	95.4	Very high	92.7	Very high	0 Å²	0	80 Å²	80	0%	0	41%	0.406	C	S	.	.			trans	-118.7	36.5	177.4	-57.7	0	0	0	0	110.3	C32 R45 R46 L48 D63 L64 N67	C32-C43 HydrophobicContact CB-CB 4.08Å; C32-C43 WeakPolarHBondContact CB-SG 3.2Å; C32-C43 WeakPolarHBondContact SG-CB 3.47Å; C32-C43 CovalentContact SG-SG 2.03Å; C32-C43 PolarHBondContact SG-SG 2.79Å; C43-R45 PolarHBondContact O-N 2.99Å; C43-R46 HydrophobicContact CB-CG 4.44Å; C43-R46 VanDerWaalsContact O-CG 3.31Å; C43-R46 WeakPolarHBondContact O-CG 3.17Å; C43-L48 HydrophobicContact CB-CD1 3.7Å; C43-D63 PolarHBondContact N-O 2.85Å; C43-L64 HydrophobicContact CB-CD2 3.87Å; C43-N67 PolarHBondContact O-ND2 3.41Å
44	H	94.2	Very high	92.4	Very high	51 Å²	51	76 Å²	76	24%	0.236	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	133.7	-177.9	-170.8	72.2	0	0	0	112.7	R46 S65 K66	H44-R46 VanDerWaalsContact C-N 3.29Å; H44-R46 WeakPolarHBondContact O-CD 3.09Å; H44-R46 WeakPolarHBondContact O-CG 3.27Å; H44-R46 PolarHBondContact O-N 2.84Å; H44-R46 PolarHBondContact O-NE 2.99Å; H44-S65 WeakPolarHBondContact CA-O 3.39Å; H44-S65 PolarHBondContact ND1-OG 2.8Å; H44-K66 WeakPolarHBondContact CE1-CD 3.49Å; H44-K66 VanDerWaalsContact CE1-CE 3.5Å; H44-K66 WeakPolarHBondContact CE1-CE 3.3Å
45	R	94.6	Very high	92.3	Very high	167 Å²	167	74.1 Å²	74.1	63%	0.63	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	31.4	174.1	-68.9	173	174.6	169.4	-0.6	115.1	C43 S65 K66	C43-R45 PolarHBondContact O-N 2.99Å; R45-S65 PolarHBondContact N-O 3.03Å; R45-K66 VanDerWaalsContact CA-O 3.32Å; R45-K66 WeakPolarHBondContact CA-O 3.47Å; R45-K66 HydrophobicContact CG-CB 3.65Å; R45-K66 HydrophobicContact CG-CD 4.02Å; R45-K66 HydrophobicContact CG-CG 4.42Å
46	R	95.1	Very high	92.3	Very high	88 Å²	88	73.3 Å²	73.3	33%	0.332	38%	0.38	S	S	.	.			trans	-94.6	3.7	-176.7	-56.4	-57	175.5	160.3	4.3	114.7	R31 E33 C43 H44 L48 N67	R31-R46 HydrophobicContact CB-CB 4.43Å; R31-R46 WeakPolarHBondContact O-CD 3Å; R31-R46 WeakPolarHBondContact O-CG 3.24Å; R31-R46 PolarHBondContact O-NE 2.9Å; R31-R46 VanDerWaalsContact O-NE 3.07Å; E33-R46 IonicContact OE1-CZ 2.97Å; E33-R46 IonicContact OE1-NH2 3.95Å; E33-R46 PolarHBondContact OE1-NH2 3.01Å; C43-R46 HydrophobicContact CB-CG 4.44Å; C43-R46 VanDerWaalsContact O-CG 3.31Å; C43-R46 WeakPolarHBondContact O-CG 3.17Å; H44-R46 VanDerWaalsContact C-N 3.29Å; H44-R46 WeakPolarHBondContact O-CD 3.09Å; H44-R46 WeakPolarHBondContact O-CG 3.27Å; H44-R46 PolarHBondContact O-N 2.84Å; H44-R46 PolarHBondContact O-NE 2.99Å; R46-L48 HydrophobicContact CB-CD1 4.18Å; R46-L48 HydrophobicContact CB-CD2 4.35Å; R46-L48 HydrophobicContact CB-CG 3.89Å; R46-L48 PolarHBondContact O-N 2.82Å; R46-N67 VanDerWaalsContact C-OD1 3.32Å; R46-N67 WeakPolarHBondContact CA-OD1 3.33Å; R46-N67 PolarHBondContact N-OD1 2.9Å
47	R	94.3	Very high	92.4	Very high	179 Å²	179	74.2 Å²	74.2	68%	0.675	37%	0.371	S	S	*	.			trans	56.1	34.2	-179.5	-54.8	177.8	179.2	178.7	-0.3	112.6	N67	R47-N67 PolarHBondContact N-OD1 3.24Å
48	L	93.6	Very high	92.5	Very high	16 Å²	16	70 Å²	70	8%	0.084	35%	0.351	C	S	.	.			trans	-68.9	141.1	179.3	-60.1	171	0	0	0	110.7	C43 R46 P52 L64 N67 R68 L69	C43-L48 HydrophobicContact CB-CD1 3.7Å; R46-L48 HydrophobicContact CB-CD1 4.18Å; R46-L48 HydrophobicContact CB-CD2 4.35Å; R46-L48 HydrophobicContact CB-CG 3.89Å; R46-L48 PolarHBondContact O-N 2.82Å; L48-P52 HydrophobicContact CD1-CG 4.09Å; L48-L64 HydrophobicContact CD1-CD2 4.18Å; L48-N67 HydrophobicContact CB-CB 4.11Å; L48-N67 PolarHBondContact N-OD1 2.85Å; L48-R68 CarbonylContact O-C 3.18Å; L48-R68 VanDerWaalsContact O-C 3.24Å; L48-R68 VanDerWaalsContact O-CA 3.26Å; L48-R68 WeakPolarHBondContact O-CA 2.93Å; L48-R68 WeakPolarHBondContact O-CB 3.33Å; L48-R68 PolarHBondContact O-N 2.99Å; L48-L69 PolarHBondContact O-N 2.74Å
49	I	93.4	Very high	92.8	Very high	122 Å²	122	65.2 Å²	65.2	63%	0.626	33%	0.326	S	S	*	.	S	Bend	trans	-104.6	-24.9	179.9	-54.9	169.1	0	0	0	110.8
50	A	91.9	Very high	92.9	Very high	63 Å²	63	64.4 Å²	64.4	52%	0.521	32%	0.322	S	S	.	.	S	Bend	trans	-136.5	167	173.1	0	0	0	0	0	109.1	L69	A50-L69 VanDerWaalsContact C-CD2 3.41Å
51	I	91	Very high	92.9	Very high	28 Å²	28	65.9 Å²	65.9	14%	0.144	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-64.9	129.1	174.3	-68.3	161.4	0	0	0	108.5	I55 L64 E76 F77	I51-I55 HydrophobicContact CG2-CD1 3.77Å; I51-L64 HydrophobicContact CD1-CD1 4.43Å; I51-L64 HydrophobicContact CG1-CD1 3.83Å; I51-E76 HydrophobicContact CD1-CB 3.65Å; I51-E76 HydrophobicContact CD1-CG 4.16Å; I51-E76 WeakPolarHBondContact CD1-OE2 2.96Å; I51-F77 HydrophobicContact CD1-CE1 3.76Å; I51-F77 HydrophobicContact CD1-CE2 3.94Å; I51-F77 HydrophobicContact CD1-CZ 3.44Å; I51-F77 VanDerWaalsContact CD1-CZ 3.44Å
52	P	89.4	Confident	93	Very high	23 Å²	23	65.9 Å²	65.9	15%	0.149	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-74	141.2	-173.5	29.5	-33.1	0	0	0	111.2	P29 L48 I55 L64	P29-P52 HydrophobicContact CB-CB 4.03Å; P29-P52 HydrophobicContact CB-CG 4.22Å; P29-P52 HydrophobicContact CG-CB 4.39Å; P29-P52 HydrophobicContact CG-CG 4.2Å; L48-P52 HydrophobicContact CD1-CG 4.09Å; P52-I55 HydrophobicContact CG-CD1 4.23Å; P52-I55 HydrophobicContact CG-CG1 4.42Å; P52-I55 WeakPolarHBondContact O-CD1 3.35Å; P52-L64 HydrophobicContact CG-CD2 4.48Å
53	E	87.3	Confident	93	Very high	185 Å²	185	65.7 Å²	65.7	86%	0.864	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	153.8	170.7	-64.5	-177.2	-179.2	0	0	111.2
54	G	86.8	Confident	93	Very high	46 Å²	46	65.7 Å²	65.7	47%	0.474	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	87	18.6	175.9	0	0	0	0	0	115.5	G27 P29	G27-G54 CarbonylContact C-O 3.6Å; G27-G54 VanDerWaalsContact C-O 3.29Å; P29-G54 WeakPolarHBondContact CD-O 3.25Å
55	I	91.2	Very high	93.2	Very high	9 Å²	9	63.7 Å²	63.7	5%	0.046	32%	0.315	C	S	.	.			trans	-68.9	135.9	166.3	-61.6	167.7	0	0	0	108.8	P29 V41 I51 P52 T59 L62 Y80	P29-I55 HydrophobicContact CG-CG1 3.78Å; V41-I55 HydrophobicContact CG2-CG2 4.27Å; I51-I55 HydrophobicContact CG2-CD1 3.77Å; P52-I55 HydrophobicContact CG-CD1 4.23Å; P52-I55 HydrophobicContact CG-CG1 4.42Å; P52-I55 WeakPolarHBondContact O-CD1 3.35Å; I55-T59 HydrophobicContact CG2-CG2 4.43Å; I55-L62 HydrophobicContact CD1-CD1 4.03Å; I55-L62 HydrophobicContact CD1-CD2 4.3Å; I55-Y80 HydrophobicContact CB-CE1 3.79Å; I55-Y80 HydrophobicContact CG2-CD1 4.18Å; I55-Y80 HydrophobicContact CG2-CE1 3.75Å; I55-Y80 WeakPolarHBondContact O-CE1 3.4Å
56	P	91.4	Very high	93.3	Very high	25 Å²	25	59.4 Å²	59.4	16%	0.162	30%	0.301	C	S	.	.			trans	-62.7	139.9	176.3	-11.5	22.4	0	0	0	112	G27 V41 E58 T59	G27-P56 WeakPolarHBondContact O-CD 3.37Å; G27-P56 WeakPolarHBondContact O-CG 3.3Å; V41-P56 HydrophobicContact CG2-CG 4.31Å; P56-E58 HydrophobicContact CB-CG 4.23Å; P56-E58 PolarHBondContact O-N 2.79Å; P56-T59 WeakPolarHBondContact CD-OG1 3.29Å; P56-T59 VanDerWaalsContact O-CB 3.28Å; P56-T59 WeakPolarHBondContact O-CB 3.46Å; P56-T59 PolarHBondContact O-N 2.87Å; P56-T59 VanDerWaalsContact O-N 3.17Å; P56-T59 PolarHBondContact O-OG1 2.97Å
57	I	90.6	Very high	93.4	Very high	115 Å²	115	55.6 Å²	55.6	59%	0.59	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-24.2	178.3	58.2	170.9	0	0	0	112.9	T59	I57-T59 VanDerWaalsContact C-N 3.25Å; I57-T59 PolarHBondContact O-N 2.85Å
58	E	92.1	Very high	93.5	Very high	95 Å²	95	53.6 Å²	53.6	44%	0.444	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	4.1	176.6	65.2	-91.8	-151.1	0	0	114.2	K39 P56 K60	K39-E58 WeakPolarHBondContact CD-O 3.4Å; P56-E58 HydrophobicContact CB-CG 4.23Å; P56-E58 PolarHBondContact O-N 2.79Å; E58-K60 PolarHBondContact O-N 3.41Å
59	T	94.3	Very high	93.6	Very high	2 Å²	2	53.1 Å²	53.1	1%	0.012	28%	0.277	C	S	.	.			trans	-60.4	132.7	179.9	-58.3	0	0	0	0	111.1	K39 V41 I55 P56 I57 I61 L62 L82 L83	K39-T59 WeakPolarHBondContact O-CA 3.33Å; V41-T59 HydrophobicContact CB-CG2 4.25Å; V41-T59 HydrophobicContact CG2-CG2 3.84Å; I55-T59 HydrophobicContact CG2-CG2 4.43Å; P56-T59 WeakPolarHBondContact CD-OG1 3.29Å; P56-T59 VanDerWaalsContact O-CB 3.28Å; P56-T59 WeakPolarHBondContact O-CB 3.46Å; P56-T59 PolarHBondContact O-N 2.87Å; P56-T59 VanDerWaalsContact O-N 3.17Å; P56-T59 PolarHBondContact O-OG1 2.97Å; I57-T59 VanDerWaalsContact C-N 3.25Å; I57-T59 PolarHBondContact O-N 2.85Å; T59-I61 WeakPolarHBondContact CG2-O 3.21Å; T59-L62 HydrophobicContact CG2-CB 4.41Å; T59-L82 CarbonylContact O-C 3.28Å; T59-L83 HydrophobicContact CG2-CD2 3.89Å; T59-L83 WeakPolarHBondContact O-CD2 3.44Å
60	K	96	Very high	93.7	Very high	73 Å²	73	53.7 Å²	53.7	32%	0.317	28%	0.275	S	S	.	.			trans	-105.2	-36	175.3	-70.1	-172.4	165.5	-143.5	0	112.9	K39 E58 E84 E85	K39-K60 HydrophobicContact CB-CB 4.25Å; K39-K60 HydrophobicContact CB-CD 4.45Å; K39-K60 HydrophobicContact CB-CG 4.09Å; K39-K60 HydrophobicContact CD-CD 4.24Å; K39-K60 HydrophobicContact CD-CG 4.25Å; K39-K60 PolarHBondContact O-N 3.15Å; E58-K60 PolarHBondContact O-N 3.41Å; K60-E84 WeakPolarHBondContact CD-OE1 3.32Å; K60-E84 WeakPolarHBondContact CE-OE1 3.45Å; K60-E84 IonicContact NZ-OE1 2.72Å; K60-E84 PolarHBondContact NZ-OE1 2.82Å; K60-E84 PolarHBondContact O-N 2.81Å; K60-E85 PolarHBondContact O-N 2.88Å
61	I	97.1	Very high	93.8	Very high	59 Å²	59	52.9 Å²	52.9	30%	0.303	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	120.2	-176.5	-58.2	172.8	0	0	0	107.9	K39 S40 V41 T59 E85	K39-I61 PolarHBondContact O-N 2.02Å; S40-I61 CarbonylContact C-O 3.59Å; S40-I61 VanDerWaalsContact CA-O 3.26Å; S40-I61 WeakPolarHBondContact CA-O 3.11Å; V41-I61 PolarHBondContact N-O 2.84Å; T59-I61 WeakPolarHBondContact CG2-O 3.21Å; I61-E85 HydrophobicContact CG1-CB 4.31Å; I61-E85 HydrophobicContact CG1-CG 4.45Å; I61-E85 HydrophobicContact CG2-CB 4.28Å
62	L	96.4	Very high	94	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.005	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	113	-179.8	179.5	60.6	0	0	0	110.3	V41 I55 T59 L64 F77 L83 E85 I86 D87	V41-L62 HydrophobicContact CB-CD1 3.98Å; V41-L62 HydrophobicContact CG1-CD1 4.1Å; I55-L62 HydrophobicContact CD1-CD1 4.03Å; I55-L62 HydrophobicContact CD1-CD2 4.3Å; T59-L62 HydrophobicContact CG2-CB 4.41Å; L62-L64 HydrophobicContact CD1-CD1 4.39Å; L62-L64 HydrophobicContact CD1-CD2 4.43Å; L62-L64 HydrophobicContact CD1-CG 4.09Å; L62-L64 HydrophobicContact CD2-CD1 3.89Å; L62-L64 HydrophobicContact CD2-CG 4.44Å; L62-L64 HydrophobicContact CG-CD1 4Å; L62-L64 HydrophobicContact CG-CG 4.02Å; L62-F77 HydrophobicContact CD2-CD1 4.42Å; L62-F77 HydrophobicContact CD2-CE1 3.81Å; L62-L83 HydrophobicContact CB-CD2 3.75Å; L62-L83 HydrophobicContact CD2-CD1 4.32Å; L62-E85 PolarHBondContact N-O 2.78Å; L62-I86 WeakPolarHBondContact O-CA 3.46Å; L62-D87 PolarHBondContact O-N 3.44Å
63	D	97.2	Very high	94.1	Very high	33 Å²	33	52.9 Å²	52.9	18%	0.176	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	109.4	176.3	168.9	23.6	0	0	0	110	V41 S42 C43 S65 D87	V41-D63 PolarHBondContact O-N 2.99Å; S42-D63 PolarHBondContact OG-OD2 2.9Å; C43-D63 PolarHBondContact N-O 2.85Å; D63-S65 WeakPolarHBondContact OD1-CB 3.42Å; D63-S65 PolarHBondContact OD1-N 2.83Å; D63-S65 PolarHBondContact OD1-OG 2.81Å; D63-D87 HydrophobicContact CB-CB 4.46Å
64	L	96.4	Very high	94.2	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.236	C	C	.	.			trans	-113.9	22.3	175.8	-69	166.2	0	0	0	110.8	C43 L48 I51 P52 L62 N67 L69 D87 L88 N91	C43-L64 HydrophobicContact CB-CD2 3.87Å; L48-L64 HydrophobicContact CD1-CD2 4.18Å; I51-L64 HydrophobicContact CD1-CD1 4.43Å; I51-L64 HydrophobicContact CG1-CD1 3.83Å; P52-L64 HydrophobicContact CG-CD2 4.48Å; L62-L64 HydrophobicContact CD1-CD1 4.39Å; L62-L64 HydrophobicContact CD1-CD2 4.43Å; L62-L64 HydrophobicContact CD1-CG 4.09Å; L62-L64 HydrophobicContact CD2-CD1 3.89Å; L62-L64 HydrophobicContact CD2-CG 4.44Å; L62-L64 HydrophobicContact CG-CD1 4Å; L62-L64 HydrophobicContact CG-CG 4.02Å; L64-N67 VanDerWaalsContact C-ND2 3.34Å; L64-N67 PolarHBondContact O-ND2 2.93Å; L64-L69 HydrophobicContact CB-CD1 4.22Å; L64-L69 HydrophobicContact CD1-CD1 4.44Å; L64-D87 CarbonylContact C-O 3.52Å; L64-D87 WeakPolarHBondContact CA-O 3.47Å; L64-D87 PolarHBondContact N-O 3.49Å; L64-L88 HydrophobicContact CB-CD2 3.93Å; L64-L88 HydrophobicContact CD1-CD2 3.88Å; L64-N91 PolarHBondContact O-ND2 2.83Å
65	S	97.3	Very high	94.1	Very high	8 Å²	8	50.7 Å²	50.7	6%	0.056	25%	0.245	C	C	.	.			trans	-69.2	156	-174.9	65.4	0	0	0	0	113.7	H44 R45 D63 N67 D87 S89	H44-S65 WeakPolarHBondContact CA-O 3.39Å; H44-S65 PolarHBondContact ND1-OG 2.8Å; R45-S65 PolarHBondContact N-O 3.03Å; D63-S65 WeakPolarHBondContact OD1-CB 3.42Å; D63-S65 PolarHBondContact OD1-N 2.83Å; D63-S65 PolarHBondContact OD1-OG 2.81Å; S65-N67 VanDerWaalsContact C-N 3.34Å; S65-N67 PolarHBondContact O-N 2.82Å; S65-N67 PolarHBondContact O-ND2 2.75Å; S65-D87 PolarHBondContact N-O 3.03Å; S65-S89 CarbonylContact C-O 3.48Å; S65-S89 WeakPolarHBondContact CA-O 3.38Å; S65-S89 WeakPolarHBondContact CB-O 3.28Å
66	K	97.1	Very high	93.8	Very high	77 Å²	77	52.4 Å²	52.4	34%	0.335	25%	0.253	S	S	.	.	S	Bend	trans	56.6	42.6	179.9	-61.8	-170.8	-163.8	153.4	0	113.5	H44 R45 S89 D90	H44-K66 WeakPolarHBondContact CE1-CD 3.49Å; H44-K66 VanDerWaalsContact CE1-CE 3.5Å; H44-K66 WeakPolarHBondContact CE1-CE 3.3Å; R45-K66 VanDerWaalsContact CA-O 3.32Å; R45-K66 WeakPolarHBondContact CA-O 3.47Å; R45-K66 HydrophobicContact CG-CB 3.65Å; R45-K66 HydrophobicContact CG-CD 4.02Å; R45-K66 HydrophobicContact CG-CG 4.42Å; K66-S89 PolarHBondContact N-O 3.01Å; K66-D90 VanDerWaalsContact CA-O 3.26Å; K66-D90 WeakPolarHBondContact CA-O 3.48Å; K66-D90 HydrophobicContact CB-CB 4.34Å; K66-D90 WeakPolarHBondContact CE-OD2 3.4Å; K66-D90 HydrophobicContact CG-CB 3.53Å; K66-D90 WeakPolarHBondContact CG-OD2 3.34Å
67	N	96.8	Very high	93.8	Very high	9 Å²	9	51.2 Å²	51.2	5%	0.048	25%	0.246	C	C	.	.	S	Bend	trans	-111.2	-157.8	174.8	-76.9	-63.8	0	0	0	111	C43 R46 R47 L48 L64 S65 L69 N91	C43-N67 PolarHBondContact O-ND2 3.41Å; R46-N67 VanDerWaalsContact C-OD1 3.32Å; R46-N67 WeakPolarHBondContact CA-OD1 3.33Å; R46-N67 PolarHBondContact N-OD1 2.9Å; R47-N67 PolarHBondContact N-OD1 3.24Å; L48-N67 HydrophobicContact CB-CB 4.11Å; L48-N67 PolarHBondContact N-OD1 2.85Å; L64-N67 VanDerWaalsContact C-ND2 3.34Å; L64-N67 PolarHBondContact O-ND2 2.93Å; S65-N67 VanDerWaalsContact C-N 3.34Å; S65-N67 PolarHBondContact O-N 2.82Å; S65-N67 PolarHBondContact O-ND2 2.75Å; N67-L69 HydrophobicContact CB-CG 4.44Å; N67-N91 WeakPolarHBondContact CA-OD1 3.38Å; N67-N91 WeakPolarHBondContact CB-OD1 3.3Å; N67-N91 PolarHBondContact N-OD1 2.93Å; N67-N91 PolarHBondContact O-OD1 3.37Å
68	R	96.8	Very high	93.6	Very high	137 Å²	137	49.6 Å²	49.6	52%	0.517	24%	0.237	S	C	.	.			trans	-129.6	33	-178.3	-61.2	-178.7	177.1	-175.4	-3.1	111.2	L48 N91 I92	L48-R68 CarbonylContact O-C 3.18Å; L48-R68 VanDerWaalsContact O-C 3.24Å; L48-R68 VanDerWaalsContact O-CA 3.26Å; L48-R68 WeakPolarHBondContact O-CA 2.93Å; L48-R68 WeakPolarHBondContact O-CB 3.33Å; L48-R68 PolarHBondContact O-N 2.99Å; R68-N91 PolarHBondContact N-OD1 3.19Å; R68-I92 HydrophobicContact CB-CD1 4.15Å; R68-I92 HydrophobicContact CB-CG1 4.49Å; R68-I92 WeakPolarHBondContact O-CD1 3.44Å; R68-I92 WeakPolarHBondContact O-CG1 3.39Å
69	L	96.1	Very high	93.5	Very high	5 Å²	5	48.3 Å²	48.3	3%	0.026	24%	0.239	C	C	.	.			trans	-64.1	133.8	175.7	-57.5	178.4	0	0	0	109.7	L48 A50 L64 N67 L88 N91 I92 I93	L48-L69 PolarHBondContact O-N 2.74Å; A50-L69 VanDerWaalsContact C-CD2 3.41Å; L64-L69 HydrophobicContact CB-CD1 4.22Å; L64-L69 HydrophobicContact CD1-CD1 4.44Å; N67-L69 HydrophobicContact CB-CG 4.44Å; L69-L88 HydrophobicContact CD1-CD2 3.64Å; L69-N91 HydrophobicContact CB-CB 4.23Å; L69-N91 WeakPolarHBondContact CB-OD1 3.26Å; L69-N91 WeakPolarHBondContact CG-OD1 3.27Å; L69-N91 PolarHBondContact N-OD1 2.03Å; L69-I92 CarbonylContact O-C 3.6Å; L69-I92 WeakPolarHBondContact O-CA 3.49Å; L69-I92 WeakPolarHBondContact O-CG1 3.42Å; L69-I92 PolarHBondContact O-N 3.3Å; L69-I93 HydrophobicContact CB-CD1 4.37Å; L69-I93 HydrophobicContact CB-CG1 4.01Å; L69-I93 WeakPolarHBondContact O-CG1 3.36Å; L69-I93 PolarHBondContact O-N 3.44Å
70	K	94.8	Very high	93.3	Very high	134 Å²	134	49.4 Å²	49.4	58%	0.583	24%	0.243	S	C	*	.			trans	-103.8	-31.5	-174.2	-71.2	-177.9	179.3	179	0	114.3	I92 I93 A94	K70-I92 HydrophobicContact CG-CD1 3.76Å; K70-I92 HydrophobicContact CG-CG1 3.94Å; K70-I93 WeakPolarHBondContact O-CA 3.4Å; K70-A94 PolarHBondContact O-N 2.95Å
71	S	94.4	Very high	93.1	Very high	47 Å²	47	48.3 Å²	48.3	33%	0.329	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	164.2	179.3	57.6	0	0	0	0	109.3	N95	S71-N95 VanDerWaalsContact CA-O 3.26Å; S71-N95 WeakPolarHBondContact CA-O 3.32Å
72	V	94.5	Very high	93	Very high	1 Å²	1	49.3 Å²	49.3	1%	0.006	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	124.3	170.3	-176.7	0	0	0	0	108.3	E76 F77 L88 I93 N95 V96 E97 A100 F101	V72-E76 WeakPolarHBondContact CA-OE2 3.41Å; V72-F77 HydrophobicContact CG1-CD2 4.07Å; V72-F77 HydrophobicContact CG1-CE2 3.54Å; V72-L88 HydrophobicContact CG2-CD1 4.2Å; V72-I93 HydrophobicContact CG2-CD1 3.95Å; V72-I93 HydrophobicContact CG2-CG2 4.18Å; V72-N95 PolarHBondContact N-O 2.93Å; V72-V96 HydrophobicContact CB-CG1 4.26Å; V72-V96 HydrophobicContact CB-CG2 4.35Å; V72-V96 HydrophobicContact CG2-CG2 4.41Å; V72-E97 PolarHBondContact O-N 2.83Å; V72-E97 VanDerWaalsContact O-N 3.08Å; V72-A100 HydrophobicContact CB-CB 4.44Å; V72-A100 HydrophobicContact CG1-CB 3.85Å; V72-F101 HydrophobicContact CG1-CE1 4.22Å; V72-F101 HydrophobicContact CG1-CZ 4.34Å
73	N	92.8	Very high	93	Very high	50 Å²	50	49.2 Å²	49.2	27%	0.267	25%	0.248	S	C	.	.			trans	-112.1	156.4	-173.6	-49.8	-48.2	0	0	0	111.2	E75 E76	N73-E75 VanDerWaalsContact C-N 3.27Å; N73-E75 PolarHBondContact O-N 2.93Å; N73-E76 HydrophobicContact CB-CG 4.18Å; N73-E76 PolarHBondContact N-OE2 3.05Å; N73-E76 VanDerWaalsContact N-OE2 3.09Å; N73-E76 PolarHBondContact ND2-OE1 3.21Å; N73-E76 WeakPolarHBondContact O-CB 3.01Å; N73-E76 PolarHBondContact O-N 3.26Å
74	P	88.8	Confident	93	Very high	39 Å²	39	49.9 Å²	49.9	25%	0.253	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-31.8	-176.9	-26.1	37.3	0	0	0	115.4	E76 E97	P74-E76 VanDerWaalsContact C-N 3.28Å; P74-E76 PolarHBondContact O-N 3.09Å; P74-E97 VanDerWaalsContact CD-OE2 3.28Å; P74-E97 WeakPolarHBondContact CD-OE2 2.97Å; P74-E97 HydrophobicContact CG-CB 4.32Å
75	E	84.6	Confident	93.1	Very high	145 Å²	145	53.7 Å²	53.7	68%	0.678	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-12.6	-176.4	-57.5	-59.7	155.7	0	0	113.4	N73	N73-E75 VanDerWaalsContact C-N 3.27Å; N73-E75 PolarHBondContact O-N 2.93Å
76	E	84.8	Confident	93.1	Very high	45 Å²	45	53.4 Å²	53.4	21%	0.21	27%	0.266	C	S	.	.	S	Bend	trans	-79	-30.2	-167.1	-70.5	174.9	176.9	0	0	114.2	I51 V72 N73 P74	I51-E76 HydrophobicContact CD1-CB 3.65Å; I51-E76 HydrophobicContact CD1-CG 4.16Å; I51-E76 WeakPolarHBondContact CD1-OE2 2.96Å; V72-E76 WeakPolarHBondContact CA-OE2 3.41Å; N73-E76 HydrophobicContact CB-CG 4.18Å; N73-E76 PolarHBondContact N-OE2 3.05Å; N73-E76 VanDerWaalsContact N-OE2 3.09Å; N73-E76 PolarHBondContact ND2-OE1 3.21Å; N73-E76 WeakPolarHBondContact O-CB 3.01Å; N73-E76 PolarHBondContact O-N 3.26Å; P74-E76 VanDerWaalsContact C-N 3.28Å; P74-E76 PolarHBondContact O-N 3.09Å
77	F	90.4	Very high	93.1	Very high	1 Å²	1	51 Å²	51	0%	0.004	26%	0.257	C	S	.	.	S	Bend	trans	-112.1	-1.5	-177	-65.3	-66.1	0	0	0	114.5	I51 L62 V72 S79 Y80 L83 I86 L88 F101 L104	I51-F77 HydrophobicContact CD1-CE1 3.76Å; I51-F77 HydrophobicContact CD1-CE2 3.94Å; I51-F77 HydrophobicContact CD1-CZ 3.44Å; I51-F77 VanDerWaalsContact CD1-CZ 3.44Å; L62-F77 HydrophobicContact CD2-CD1 4.42Å; L62-F77 HydrophobicContact CD2-CE1 3.81Å; V72-F77 HydrophobicContact CG1-CD2 4.07Å; V72-F77 HydrophobicContact CG1-CE2 3.54Å; F77-S79 PolarHBondContact O-N 3.27Å; F77-S79 VanDerWaalsContact O-N 3.11Å; F77-Y80 HydrophobicContact CD1-CD2 4.37Å; F77-Y80 PolarHBondContact O-N 3.39Å; F77-L83 HydrophobicContact CD1-CD1 4.16Å; F77-I86 HydrophobicContact CD1-CD1 4.35Å; F77-I86 HydrophobicContact CE1-CD1 4.37Å; F77-I86 HydrophobicContact CZ-CG2 4.45Å; F77-L88 HydrophobicContact CE2-CD1 4.45Å; F77-L88 HydrophobicContact CZ-CD1 4.27Å; F77-L88 HydrophobicContact CZ-CD2 4.47Å; F77-F101 HydrophobicContact CD2-CD1 4.05Å; F77-F101 HydrophobicContact CD2-CE1 4.13Å; F77-F101 HydrophobicContact CE2-CD1 4.25Å; F77-F101 AromaticContact CE2-CE1 3.85Å; F77-F101 HydrophobicContact CE2-CE1 3.85Å; F77-L104 HydrophobicContact CB-CD1 3.96Å; F77-L104 HydrophobicContact CB-CD2 4.25Å; F77-L104 HydrophobicContact CB-CG 4.39Å; F77-L104 HydrophobicContact CG-CD1 4.36Å
78	I	87.9	Confident	93.2	Very high	81 Å²	81	50.6 Å²	50.6	42%	0.415	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-29.5	-173.8	-161.1	166.1	0	0	0	113.1	Y80	I78-Y80 VanDerWaalsContact C-N 3.3Å; I78-Y80 PolarHBondContact O-N 3.42Å
79	S	88.6	Confident	93.2	Very high	68 Å²	68	44.5 Å²	44.5	48%	0.476	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-5.3	179.8	-53.2	0	0	0	0	114.6	F77 P81	F77-S79 PolarHBondContact O-N 3.27Å; F77-S79 VanDerWaalsContact O-N 3.11Å; S79-P81 WeakPolarHBondContact O-CD 3.08Å
80	Y	91.4	Very high	93.3	Very high	25 Å²	25	47.3 Å²	47.3	10%	0.098	25%	0.248	C	C	.	.			trans	-123.5	59	-172.1	-46.5	-66.1	0	0	0	113.3	I55 F77 I78 L82 L83 L104	I55-Y80 HydrophobicContact CB-CE1 3.79Å; I55-Y80 HydrophobicContact CG2-CD1 4.18Å; I55-Y80 HydrophobicContact CG2-CE1 3.75Å; I55-Y80 WeakPolarHBondContact O-CE1 3.4Å; F77-Y80 HydrophobicContact CD1-CD2 4.37Å; F77-Y80 PolarHBondContact O-N 3.39Å; I78-Y80 VanDerWaalsContact C-N 3.3Å; I78-Y80 PolarHBondContact O-N 3.42Å; Y80-L82 PolarHBondContact O-N 3.09Å; Y80-L82 VanDerWaalsContact O-N 3.09Å; Y80-L83 VanDerWaalsContact CB-CD1 3.5Å; Y80-L83 HydrophobicContact CG-CD1 4.31Å; Y80-L83 WeakPolarHBondContact O-CG 3.44Å; Y80-L83 PolarHBondContact O-N 2.88Å; Y80-L104 VanDerWaalsContact O-CD2 3.23Å; Y80-L104 WeakPolarHBondContact O-CD2 2.99Å
81	P	91.9	Very high	93.4	Very high	50 Å²	50	41.3 Å²	41.3	33%	0.325	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-11.4	-173.8	30	-37.3	0	0	0	114.6	S79 N106	S79-P81 WeakPolarHBondContact O-CD 3.08Å; P81-N106 PolarHBondContact O-ND2 2.69Å
82	L	94.9	Very high	93.5	Very high	79 Å²	79	41.4 Å²	41.4	41%	0.414	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91	1	-179.8	-63.6	178.7	0	0	0	113.5	T59 Y80 E84	T59-L82 CarbonylContact O-C 3.28Å; Y80-L82 PolarHBondContact O-N 3.09Å; Y80-L82 VanDerWaalsContact O-N 3.09Å; L82-E84 PolarHBondContact O-N 3.02Å
83	L	95.9	Very high	93.6	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.219	C	C	.	.			trans	-61.8	127.6	177.6	-73.8	172.6	0	0	0	111.2	T59 L62 F77 Y80 I86 L104 N106 L107	T59-L83 HydrophobicContact CG2-CD2 3.89Å; T59-L83 WeakPolarHBondContact O-CD2 3.44Å; L62-L83 HydrophobicContact CB-CD2 3.75Å; L62-L83 HydrophobicContact CD2-CD1 4.32Å; F77-L83 HydrophobicContact CD1-CD1 4.16Å; Y80-L83 VanDerWaalsContact CB-CD1 3.5Å; Y80-L83 HydrophobicContact CG-CD1 4.31Å; Y80-L83 WeakPolarHBondContact O-CG 3.44Å; Y80-L83 PolarHBondContact O-N 2.88Å; L83-I86 HydrophobicContact CB-CD1 4.42Å; L83-I86 HydrophobicContact CB-CG1 4.4Å; L83-I86 HydrophobicContact CD1-CD1 3.79Å; L83-I86 HydrophobicContact CD1-CG1 3.99Å; L83-L104 HydrophobicContact CB-CD2 4.32Å; L83-L104 HydrophobicContact CD1-CD2 4.28Å; L83-N106 CarbonylContact O-C 3.54Å; L83-N106 VanDerWaalsContact O-C 3.28Å; L83-L107 HydrophobicContact CB-CD1 4.36Å; L83-L107 WeakPolarHBondContact O-CA 3.35Å; L83-L107 PolarHBondContact O-N 2.74Å
84	E	97	Very high	93.7	Very high	47 Å²	47	40.8 Å²	40.8	22%	0.22	22%	0.221	C	C	.	.			trans	-106.5	-31.9	174.8	-64	-178.2	-154.6	0	0	110.7	K60 L82 N106 R108 S109	K60-E84 WeakPolarHBondContact CD-OE1 3.32Å; K60-E84 WeakPolarHBondContact CE-OE1 3.45Å; K60-E84 IonicContact NZ-OE1 2.72Å; K60-E84 PolarHBondContact NZ-OE1 2.82Å; K60-E84 PolarHBondContact O-N 2.81Å; L82-E84 PolarHBondContact O-N 3.02Å; E84-N106 HydrophobicContact CG-CB 4.42Å; E84-R108 WeakPolarHBondContact O-CA 3.31Å; E84-R108 PolarHBondContact O-N 3.04Å; E84-S109 PolarHBondContact O-N 3.22Å; E84-S109 VanDerWaalsContact O-N 3.1Å
85	E	97.9	Very high	94	Very high	79 Å²	79	44.3 Å²	44.3	37%	0.369	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	130.8	179.9	-54.9	-169.2	-177.2	0	0	111.8	K60 I61 L62 S109	K60-E85 PolarHBondContact O-N 2.88Å; I61-E85 HydrophobicContact CG1-CB 4.31Å; I61-E85 HydrophobicContact CG1-CG 4.45Å; I61-E85 HydrophobicContact CG2-CB 4.28Å; L62-E85 PolarHBondContact N-O 2.78Å; E85-S109 WeakPolarHBondContact CA-O 3.3Å
86	I	97.2	Very high	94.5	Very high	2 Å²	2	37.7 Å²	37.7	1%	0.01	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	122.3	174.3	-65.4	170.7	0	0	0	108.9	L62 F77 L83 L88 L104 L107 S109 L110 R111	L62-I86 WeakPolarHBondContact O-CA 3.46Å; F77-I86 HydrophobicContact CD1-CD1 4.35Å; F77-I86 HydrophobicContact CE1-CD1 4.37Å; F77-I86 HydrophobicContact CZ-CG2 4.45Å; L83-I86 HydrophobicContact CB-CD1 4.42Å; L83-I86 HydrophobicContact CB-CG1 4.4Å; L83-I86 HydrophobicContact CD1-CD1 3.79Å; L83-I86 HydrophobicContact CD1-CG1 3.99Å; I86-L88 HydrophobicContact CG2-CD1 3.82Å; I86-L88 HydrophobicContact CG2-CG 3.73Å; I86-L104 HydrophobicContact CD1-CD1 3.6Å; I86-L107 HydrophobicContact CB-CD1 4.21Å; I86-L107 HydrophobicContact CD1-CD1 3.63Å; I86-L107 HydrophobicContact CD1-CD2 4.21Å; I86-L107 HydrophobicContact CG1-CD1 3.65Å; I86-S109 PolarHBondContact N-O 2.93Å; I86-L110 HydrophobicContact CB-CD1 4.09Å; I86-L110 HydrophobicContact CG2-CD1 4.05Å; I86-R111 PolarHBondContact O-N 2.95Å
87	D	98	Very high	94.9	Very high	27 Å²	27	40.1 Å²	40.1	14%	0.144	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	107.4	172.6	-160.6	-27.6	0	0	0	110.4	L62 D63 L64 S65 S89 R111	L62-D87 PolarHBondContact O-N 3.44Å; D63-D87 HydrophobicContact CB-CB 4.46Å; L64-D87 CarbonylContact C-O 3.52Å; L64-D87 WeakPolarHBondContact CA-O 3.47Å; L64-D87 PolarHBondContact N-O 3.49Å; S65-D87 PolarHBondContact N-O 3.03Å; D87-S89 WeakPolarHBondContact OD1-CB 3.22Å; D87-S89 PolarHBondContact OD1-N 3.46Å; D87-S89 PolarHBondContact OD1-OG 3.08Å; D87-R111 WeakPolarHBondContact OD2-CD 3.42Å; D87-R111 IonicContact OD2-CZ 2.81Å; D87-R111 IonicContact OD2-NH1 2.75Å; D87-R111 PolarHBondContact OD2-NH1 2.85Å; D87-R111 VanDerWaalsContact OD2-NH1 3.11Å
88	L	97.3	Very high	95	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.241	C	C	.	.			trans	-109.4	19.6	176.3	-70.4	165.1	0	0	0	111.3	L64 L69 V72 F77 I86 N91 I93 F101 R111 L112 N115	L64-L88 HydrophobicContact CB-CD2 3.93Å; L64-L88 HydrophobicContact CD1-CD2 3.88Å; L69-L88 HydrophobicContact CD1-CD2 3.64Å; V72-L88 HydrophobicContact CG2-CD1 4.2Å; F77-L88 HydrophobicContact CE2-CD1 4.45Å; F77-L88 HydrophobicContact CZ-CD1 4.27Å; F77-L88 HydrophobicContact CZ-CD2 4.47Å; I86-L88 HydrophobicContact CG2-CD1 3.82Å; I86-L88 HydrophobicContact CG2-CG 3.73Å; L88-N91 PolarHBondContact O-ND2 2.86Å; L88-I93 HydrophobicContact CB-CD1 3.99Å; L88-I93 HydrophobicContact CD1-CD1 4.48Å; L88-I93 HydrophobicContact CD2-CD1 4.41Å; L88-F101 HydrophobicContact CD1-CE1 4.26Å; L88-F101 HydrophobicContact CD1-CZ 4.38Å; L88-R111 WeakPolarHBondContact CA-O 3.46Å; L88-R111 WeakPolarHBondContact CB-O 3.32Å; L88-R111 PolarHBondContact N-O 3.38Å; L88-L112 HydrophobicContact CB-CD2 3.9Å; L88-L112 HydrophobicContact CD1-CD2 3.87Å; L88-N115 PolarHBondContact O-ND2 3.15Å
89	S	97.8	Very high	95.2	Very high	10 Å²	10	40 Å²	40	7%	0.07	22%	0.223	C	C	.	.			trans	-66.9	155.7	-172.8	-49.4	0	0	0	0	113	S65 K66 D87 N91 R111 K113	S65-S89 CarbonylContact C-O 3.48Å; S65-S89 WeakPolarHBondContact CA-O 3.38Å; S65-S89 WeakPolarHBondContact CB-O 3.28Å; K66-S89 PolarHBondContact N-O 3.01Å; D87-S89 WeakPolarHBondContact OD1-CB 3.22Å; D87-S89 PolarHBondContact OD1-N 3.46Å; D87-S89 PolarHBondContact OD1-OG 3.08Å; S89-N91 VanDerWaalsContact C-N 3.32Å; S89-N91 PolarHBondContact O-N 3.05Å; S89-N91 PolarHBondContact O-ND2 2.97Å; S89-R111 WeakPolarHBondContact OG-CB 3.39Å; S89-K113 CarbonylContact C-O 3.32Å; S89-K113 WeakPolarHBondContact CA-O 3.41Å; S89-K113 WeakPolarHBondContact CB-O 3.23Å
90	D	97.2	Very high	95.4	Very high	63 Å²	63	36.8 Å²	36.8	34%	0.337	20%	0.201	S	C	.	.	S	Bend	trans	55.5	42.4	176.8	-60	-36	0	0	0	113.4	K66 K113 G114	K66-D90 VanDerWaalsContact CA-O 3.26Å; K66-D90 WeakPolarHBondContact CA-O 3.48Å; K66-D90 HydrophobicContact CB-CB 4.34Å; K66-D90 WeakPolarHBondContact CE-OD2 3.4Å; K66-D90 HydrophobicContact CG-CB 3.53Å; K66-D90 WeakPolarHBondContact CG-OD2 3.34Å; D90-K113 PolarHBondContact N-O 3.2Å; D90-G114 VanDerWaalsContact CA-O 3.31Å; D90-G114 WeakPolarHBondContact CA-O 3.35Å
91	N	97.4	Very high	95.5	Very high	8 Å²	8	35.6 Å²	35.6	4%	0.043	20%	0.197	C	C	.	.	S	Bend	trans	-105.5	-164.4	173.5	-85.5	-79.9	0	0	0	110.4	L64 N67 R68 L69 L88 S89 I93 G114 N115	L64-N91 PolarHBondContact O-ND2 2.83Å; N67-N91 WeakPolarHBondContact CA-OD1 3.38Å; N67-N91 WeakPolarHBondContact CB-OD1 3.3Å; N67-N91 PolarHBondContact N-OD1 2.93Å; N67-N91 PolarHBondContact O-OD1 3.37Å; R68-N91 PolarHBondContact N-OD1 3.19Å; L69-N91 HydrophobicContact CB-CB 4.23Å; L69-N91 WeakPolarHBondContact CB-OD1 3.26Å; L69-N91 WeakPolarHBondContact CG-OD1 3.27Å; L69-N91 PolarHBondContact N-OD1 2.03Å; L88-N91 PolarHBondContact O-ND2 2.86Å; S89-N91 VanDerWaalsContact C-N 3.32Å; S89-N91 PolarHBondContact O-N 3.05Å; S89-N91 PolarHBondContact O-ND2 2.97Å; N91-I93 HydrophobicContact CB-CD1 4.05Å; N91-I93 HydrophobicContact CB-CG1 3.9Å; N91-G114 PolarHBondContact N-O 3.37Å; N91-N115 VanDerWaalsContact CA-OD1 3.32Å; N91-N115 WeakPolarHBondContact CA-OD1 3.43Å; N91-N115 WeakPolarHBondContact CB-OD1 3.44Å; N91-N115 PolarHBondContact N-OD1 3.21Å; N91-N115 PolarHBondContact O-OD1 3.03Å
92	I	97.1	Very high	95.3	Very high	50 Å²	50	37 Å²	37	26%	0.256	20%	0.201	S	C	.	.			trans	-119	32.1	174.1	58.8	176.9	0	0	0	110.8	R68 L69 K70 A94	R68-I92 HydrophobicContact CB-CD1 4.15Å; R68-I92 HydrophobicContact CB-CG1 4.49Å; R68-I92 WeakPolarHBondContact O-CD1 3.44Å; R68-I92 WeakPolarHBondContact O-CG1 3.39Å; L69-I92 CarbonylContact O-C 3.6Å; L69-I92 WeakPolarHBondContact O-CA 3.49Å; L69-I92 WeakPolarHBondContact O-CG1 3.42Å; L69-I92 PolarHBondContact O-N 3.3Å; K70-I92 HydrophobicContact CG-CD1 3.76Å; K70-I92 HydrophobicContact CG-CG1 3.94Å; I92-A94 PolarHBondContact O-N 2.81Å
93	I	96.8	Very high	94.8	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.199	C	C	.	.			trans	-67.8	115.5	-175.2	-58.3	166.8	0	0	0	108.2	L69 K70 V72 L88 N91 V96 L112 N115 R116 L117	L69-I93 HydrophobicContact CB-CD1 4.37Å; L69-I93 HydrophobicContact CB-CG1 4.01Å; L69-I93 WeakPolarHBondContact O-CG1 3.36Å; L69-I93 PolarHBondContact O-N 3.44Å; K70-I93 WeakPolarHBondContact O-CA 3.4Å; V72-I93 HydrophobicContact CG2-CD1 3.95Å; V72-I93 HydrophobicContact CG2-CG2 4.18Å; L88-I93 HydrophobicContact CB-CD1 3.99Å; L88-I93 HydrophobicContact CD1-CD1 4.48Å; L88-I93 HydrophobicContact CD2-CD1 4.41Å; N91-I93 HydrophobicContact CB-CD1 4.05Å; N91-I93 HydrophobicContact CB-CG1 3.9Å; I93-V96 HydrophobicContact CG2-CG2 3.95Å; I93-L112 HydrophobicContact CD1-CD2 4.3Å; I93-N115 HydrophobicContact CB-CB 4.27Å; I93-N115 VanDerWaalsContact CB-OD1 3.27Å; I93-N115 WeakPolarHBondContact CB-OD1 3.44Å; I93-N115 WeakPolarHBondContact CG1-OD1 3.3Å; I93-N115 PolarHBondContact N-OD1 2.95Å; I93-R116 CarbonylContact O-C 3.47Å; I93-R116 VanDerWaalsContact O-C 3.29Å; I93-R116 WeakPolarHBondContact O-CA 3.49Å; I93-R116 PolarHBondContact O-N 2.9Å; I93-L117 HydrophobicContact CG2-CD2 3.9Å; I93-L117 PolarHBondContact O-N 3.41Å
94	A	95.2	Very high	94.7	Very high	38 Å²	38	36.5 Å²	36.5	31%	0.314	20%	0.199	S	C	.	.			trans	-97.6	-33.2	178.5	0	0	0	0	0	112.1	K70 I92 R116	K70-A94 PolarHBondContact O-N 2.95Å; I92-A94 PolarHBondContact O-N 2.81Å; A94-R116 HydrophobicContact CB-CB 4.43Å
95	N	93.8	Very high	94.4	Very high	112 Å²	112	39.7 Å²	39.7	60%	0.599	21%	0.213	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-133.2	139.1	-174.9	-62.4	-12.1	0	0	0	110.2	S71 V72	S71-N95 VanDerWaalsContact CA-O 3.26Å; S71-N95 WeakPolarHBondContact CA-O 3.32Å; V72-N95 PolarHBondContact N-O 2.93Å
96	V	95.3	Very high	94.2	Very high	7 Å²	7	39.2 Å²	39.2	4%	0.042	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	122	166.9	179.9	0	0	0	0	106.5	V72 I93 A100 F101 L117 V124	V72-V96 HydrophobicContact CB-CG1 4.26Å; V72-V96 HydrophobicContact CB-CG2 4.35Å; V72-V96 HydrophobicContact CG2-CG2 4.41Å; I93-V96 HydrophobicContact CG2-CG2 3.95Å; V96-A100 HydrophobicContact CG1-CB 3.52Å; V96-F101 HydrophobicContact CG1-CE2 3.77Å; V96-F101 HydrophobicContact CG1-CZ 4.24Å; V96-L117 HydrophobicContact CG2-CD2 3.87Å; V96-V124 HydrophobicContact CB-CG1 4.18Å; V96-V124 HydrophobicContact CB-CG2 4.29Å; V96-V124 HydrophobicContact CG1-CB 4.42Å; V96-V124 HydrophobicContact CG1-CG1 3.46Å; V96-V124 VanDerWaalsContact CG1-CG1 3.46Å; V96-V124 HydrophobicContact CG1-CG2 4.06Å; V96-V124 WeakPolarHBondContact O-CG2 3.23Å
97	E	93.4	Very high	94.2	Very high	95 Å²	95	39.1 Å²	39.1	44%	0.444	21%	0.212	S	C	.	.			trans	-76.3	147.6	-178.1	-66.9	-167.6	158.6	0	0	111.4	V72 P74 G99 A100	V72-E97 PolarHBondContact O-N 2.83Å; V72-E97 VanDerWaalsContact O-N 3.08Å; P74-E97 VanDerWaalsContact CD-OE2 3.28Å; P74-E97 WeakPolarHBondContact CD-OE2 2.97Å; P74-E97 HydrophobicContact CG-CB 4.32Å; E97-G99 PolarHBondContact O-N 2.95Å; E97-A100 WeakPolarHBondContact O-CB 3.13Å; E97-A100 PolarHBondContact O-N 2.95Å
98	P	93.4	Very high	94.1	Very high	74 Å²	74	44.4 Å²	44.4	48%	0.481	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	132.3	171.9	-25	34.8	0	0	0	111.2	A100 P121	P98-A100 VanDerWaalsContact C-N 3.33Å; P98-P121 HydrophobicContact CG-CB 4.26Å
99	G	91.1	Very high	94.2	Very high	5 Å²	5	45 Å²	45	5%	0.052	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.7	5.4	-175.5	0	0	0	0	0	116	E97 F101 N102 G123	E97-G99 PolarHBondContact O-N 2.95Å; G99-F101 PolarHBondContact O-N 2.84Å; G99-F101 VanDerWaalsContact O-N 3.08Å; G99-N102 VanDerWaalsContact CA-CG 3.44Å; G99-N102 WeakPolarHBondContact CA-ND2 3.28Å; G99-N102 WeakPolarHBondContact CA-OD1 3.44Å; G99-N102 VanDerWaalsContact O-CB 3.28Å; G99-N102 WeakPolarHBondContact O-CB 3.34Å; G99-N102 VanDerWaalsContact O-CG 3.3Å; G99-N102 PolarHBondContact O-N 2.93Å; G99-G123 PolarHBondContact N-O 3.47Å
100	A	93	Very high	94.2	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.008	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.1	-34.7	171.4	0	0	0	0	0	114.2	V72 V96 E97 P98	V72-A100 HydrophobicContact CB-CB 4.44Å; V72-A100 HydrophobicContact CG1-CB 3.85Å; V96-A100 HydrophobicContact CG1-CB 3.52Å; E97-A100 WeakPolarHBondContact O-CB 3.13Å; E97-A100 PolarHBondContact O-N 2.95Å; P98-A100 VanDerWaalsContact C-N 3.33Å
101	F	93.5	Very high	94.2	Very high	1 Å²	1	45.7 Å²	45.7	0%	0.004	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.5	22.3	-177.7	-53.9	-65	0	0	0	112.8	V72 F77 L88 V96 G99 L104 L110 V124 L128	V72-F101 HydrophobicContact CG1-CE1 4.22Å; V72-F101 HydrophobicContact CG1-CZ 4.34Å; F77-F101 HydrophobicContact CD2-CD1 4.05Å; F77-F101 HydrophobicContact CD2-CE1 4.13Å; F77-F101 HydrophobicContact CE2-CD1 4.25Å; F77-F101 AromaticContact CE2-CE1 3.85Å; F77-F101 HydrophobicContact CE2-CE1 3.85Å; L88-F101 HydrophobicContact CD1-CE1 4.26Å; L88-F101 HydrophobicContact CD1-CZ 4.38Å; V96-F101 HydrophobicContact CG1-CE2 3.77Å; V96-F101 HydrophobicContact CG1-CZ 4.24Å; G99-F101 PolarHBondContact O-N 2.84Å; G99-F101 VanDerWaalsContact O-N 3.08Å; F101-L104 HydrophobicContact CB-CD1 4.04Å; F101-L104 HydrophobicContact CD1-CD1 4.03Å; F101-L104 WeakPolarHBondContact O-CB 3.28Å; F101-L104 PolarHBondContact O-N 3.31Å; F101-L110 HydrophobicContact CD2-CD2 4.15Å; F101-L110 HydrophobicContact CE1-CD1 4.05Å; F101-L110 HydrophobicContact CE1-CD2 4.45Å; F101-L110 HydrophobicContact CE2-CD2 3.82Å; F101-L110 HydrophobicContact CZ-CD1 4.04Å; F101-L110 HydrophobicContact CZ-CD2 3.99Å; F101-V124 HydrophobicContact CD2-CG1 4.06Å; F101-V124 HydrophobicContact CE2-CG1 3.93Å; F101-L128 HydrophobicContact CB-CD1 3.91Å; F101-L128 HydrophobicContact CB-CD2 3.98Å; F101-L128 HydrophobicContact CB-CG 4.24Å; F101-L128 HydrophobicContact CD2-CD1 4.31Å; F101-L128 HydrophobicContact CG-CD1 4.34Å
102	N	88	Confident	94.2	Very high	79 Å²	79	45.5 Å²	45.5	42%	0.422	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	151.7	175	-81	-12.2	0	0	0	110.8	G99 L104	G99-N102 VanDerWaalsContact CA-CG 3.44Å; G99-N102 WeakPolarHBondContact CA-ND2 3.28Å; G99-N102 WeakPolarHBondContact CA-OD1 3.44Å; G99-N102 VanDerWaalsContact O-CB 3.28Å; G99-N102 WeakPolarHBondContact O-CB 3.34Å; G99-N102 VanDerWaalsContact O-CG 3.3Å; G99-N102 PolarHBondContact O-N 2.93Å; N102-L104 PolarHBondContact O-N 3.44Å; N102-L104 VanDerWaalsContact O-N 3.14Å
103	N	84.9	Confident	94.1	Very high	66 Å²	66	46.1 Å²	46.1	35%	0.353	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.3	3	179.2	-153.1	36.1	0	0	0	115.4	F105	N103-F105 VanDerWaalsContact C-N 3.31Å; N103-F105 PolarHBondContact O-N 3.17Å; N103-F105 WeakPolarHBondContact OD1-CE2 3.41Å
104	L	92.7	Very high	94.1	Very high	2 Å²	2	46.9 Å²	46.9	1%	0.01	24%	0.238	C	C	.	.			trans	-91.3	56	176.6	-58	-176.2	0	0	0	112.2	F77 Y80 L83 I86 F101 N102 N106 L107 L128	F77-L104 HydrophobicContact CB-CD1 3.96Å; F77-L104 HydrophobicContact CB-CD2 4.25Å; F77-L104 HydrophobicContact CB-CG 4.39Å; F77-L104 HydrophobicContact CG-CD1 4.36Å; Y80-L104 VanDerWaalsContact O-CD2 3.23Å; Y80-L104 WeakPolarHBondContact O-CD2 2.99Å; L83-L104 HydrophobicContact CB-CD2 4.32Å; L83-L104 HydrophobicContact CD1-CD2 4.28Å; I86-L104 HydrophobicContact CD1-CD1 3.6Å; F101-L104 HydrophobicContact CB-CD1 4.04Å; F101-L104 HydrophobicContact CD1-CD1 4.03Å; F101-L104 WeakPolarHBondContact O-CB 3.28Å; F101-L104 PolarHBondContact O-N 3.31Å; N102-L104 PolarHBondContact O-N 3.44Å; N102-L104 VanDerWaalsContact O-N 3.14Å; L104-N106 PolarHBondContact O-N 2.78Å; L104-L107 HydrophobicContact CB-CB 4.13Å; L104-L107 HydrophobicContact CB-CD2 4.49Å; L104-L107 HydrophobicContact CD1-CD2 4.26Å; L104-L107 VanDerWaalsContact O-CB 3.29Å; L104-L107 WeakPolarHBondContact O-CB 3.18Å; L104-L107 PolarHBondContact O-N 3.1Å; L104-L107 VanDerWaalsContact O-N 3.16Å; L104-L128 HydrophobicContact CB-CD2 4.13Å
105	F	90.6	Very high	94.2	Very high	115 Å²	115	45.4 Å²	45.4	50%	0.504	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-19.6	-174.3	-51	-63.6	0	0	0	114	N103 N130	N103-F105 VanDerWaalsContact C-N 3.31Å; N103-F105 PolarHBondContact O-N 3.17Å; N103-F105 WeakPolarHBondContact OD1-CE2 3.41Å; F105-N130 VanDerWaalsContact O-CB 3.3Å; F105-N130 WeakPolarHBondContact O-CB 3.43Å; F105-N130 PolarHBondContact O-ND2 3.36Å
106	N	94.5	Very high	94.3	Very high	69 Å²	69	47.3 Å²	47.3	37%	0.369	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-3.3	179.6	-64.8	-47.9	0	0	0	113.2	P81 L83 E84 L104 R108	P81-N106 PolarHBondContact O-ND2 2.69Å; L83-N106 CarbonylContact O-C 3.54Å; L83-N106 VanDerWaalsContact O-C 3.28Å; E84-N106 HydrophobicContact CG-CB 4.42Å; L104-N106 PolarHBondContact O-N 2.78Å; N106-R108 PolarHBondContact O-N 3.38Å
107	L	96.5	Very high	94.3	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	22%	0.222	C	C	.	.			trans	-66.2	125.6	-173.8	-163.4	70.8	0	0	0	110.6	L83 I86 L104 L110 L128 N130 L131	L83-L107 HydrophobicContact CB-CD1 4.36Å; L83-L107 WeakPolarHBondContact O-CA 3.35Å; L83-L107 PolarHBondContact O-N 2.74Å; I86-L107 HydrophobicContact CB-CD1 4.21Å; I86-L107 HydrophobicContact CD1-CD1 3.63Å; I86-L107 HydrophobicContact CD1-CD2 4.21Å; I86-L107 HydrophobicContact CG1-CD1 3.65Å; L104-L107 HydrophobicContact CB-CB 4.13Å; L104-L107 HydrophobicContact CB-CD2 4.49Å; L104-L107 HydrophobicContact CD1-CD2 4.26Å; L104-L107 VanDerWaalsContact O-CB 3.29Å; L104-L107 WeakPolarHBondContact O-CB 3.18Å; L104-L107 PolarHBondContact O-N 3.1Å; L104-L107 VanDerWaalsContact O-N 3.16Å; L107-L110 HydrophobicContact CD2-CB 4.27Å; L107-L128 HydrophobicContact CB-CD2 4.26Å; L107-L128 HydrophobicContact CD2-CD1 4.35Å; L107-L128 HydrophobicContact CD2-CD2 3.94Å; L107-N130 CarbonylContact O-C 3.54Å; L107-L131 HydrophobicContact CB-CD1 4.37Å; L107-L131 HydrophobicContact CD2-CD1 3.95Å; L107-L131 HydrophobicContact CG-CD1 3.85Å; L107-L131 VanDerWaalsContact O-CA 3.26Å; L107-L131 WeakPolarHBondContact O-CA 3.34Å; L107-L131 PolarHBondContact O-N 3.33Å; L107-L131 VanDerWaalsContact O-N 3.15Å
108	R	97.3	Very high	94.2	Very high	138 Å²	138	49.8 Å²	49.8	52%	0.521	23%	0.232	S	C	.	.			trans	-111.7	-38.4	-179	-66.3	177.1	-179.3	-171.9	-0.4	111.8	E84 N106 T132 K133	E84-R108 WeakPolarHBondContact O-CA 3.31Å; E84-R108 PolarHBondContact O-N 3.04Å; N106-R108 PolarHBondContact O-N 3.38Å; R108-T132 PolarHBondContact O-N 2.86Å; R108-T132 PolarHBondContact O-OG1 3.04Å; R108-T132 VanDerWaalsContact O-OG1 3.06Å; R108-K133 PolarHBondContact O-N 3.24Å
109	S	98.1	Very high	94	Very high	11 Å²	11	51.2 Å²	51.2	8%	0.077	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	125	-179.5	178.2	0	0	0	0	111.1	E84 E85 I86 K133	E84-S109 PolarHBondContact O-N 3.22Å; E84-S109 VanDerWaalsContact O-N 3.1Å; E85-S109 WeakPolarHBondContact CA-O 3.3Å; I86-S109 PolarHBondContact N-O 2.93Å; S109-K133 WeakPolarHBondContact CA-O 3.41Å
110	L	97.7	Very high	94	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	120.3	172.3	177.8	60.5	0	0	0	109.3	I86 F101 L107 L112 F125 L128 L131 K133 L134 D135	I86-L110 HydrophobicContact CB-CD1 4.09Å; I86-L110 HydrophobicContact CG2-CD1 4.05Å; F101-L110 HydrophobicContact CD2-CD2 4.15Å; F101-L110 HydrophobicContact CE1-CD1 4.05Å; F101-L110 HydrophobicContact CE1-CD2 4.45Å; F101-L110 HydrophobicContact CE2-CD2 3.82Å; F101-L110 HydrophobicContact CZ-CD1 4.04Å; F101-L110 HydrophobicContact CZ-CD2 3.99Å; L107-L110 HydrophobicContact CD2-CB 4.27Å; L110-L112 HydrophobicContact CD1-CG 4.4Å; L110-L112 HydrophobicContact CD2-CD1 4.18Å; L110-L112 HydrophobicContact CG-CD1 4.32Å; L110-L112 HydrophobicContact CG-CG 4.35Å; L110-F125 HydrophobicContact CD2-CD1 4.5Å; L110-F125 HydrophobicContact CD2-CE1 4.06Å; L110-L128 HydrophobicContact CD2-CD1 4.4Å; L110-L131 HydrophobicContact CB-CD1 3.85Å; L110-L131 HydrophobicContact CB-CD2 4.29Å; L110-K133 PolarHBondContact N-O 3.24Å; L110-L134 HydrophobicContact CB-CD1 4.17Å; L110-L134 HydrophobicContact CD2-CD1 4.06Å; L110-L134 HydrophobicContact CG-CD1 4.13Å; L110-L134 WeakPolarHBondContact O-CA 3.23Å; L110-D135 PolarHBondContact O-N 3.49Å; L110-D135 VanDerWaalsContact O-N 3.08Å
111	R	98.1	Very high	93.8	Very high	89 Å²	89	53.6 Å²	53.6	34%	0.336	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	121.2	176.1	-56.5	-177.1	-168.6	161.4	-0.7	110.5	I86 D87 L88 S89 D135	I86-R111 PolarHBondContact O-N 2.95Å; D87-R111 WeakPolarHBondContact OD2-CD 3.42Å; D87-R111 IonicContact OD2-CZ 2.81Å; D87-R111 IonicContact OD2-NH1 2.75Å; D87-R111 PolarHBondContact OD2-NH1 2.85Å; D87-R111 VanDerWaalsContact OD2-NH1 3.11Å; L88-R111 WeakPolarHBondContact CA-O 3.46Å; L88-R111 WeakPolarHBondContact CB-O 3.32Å; L88-R111 PolarHBondContact N-O 3.38Å; S89-R111 WeakPolarHBondContact OG-CB 3.39Å; R111-D135 HydrophobicContact CB-CB 4.47Å; R111-D135 HydrophobicContact CG-CB 4.33Å
112	L	96.6	Very high	93.5	Very high	3 Å²	3	59.7 Å²	59.7	2%	0.016	28%	0.281	C	S	.	.			trans	-120.8	20.3	176.6	-72	165.4	0	0	0	110.9	L88 I93 L110 N115 L117 D135 I136 N139	L88-L112 HydrophobicContact CB-CD2 3.9Å; L88-L112 HydrophobicContact CD1-CD2 3.87Å; I93-L112 HydrophobicContact CD1-CD2 4.3Å; L110-L112 HydrophobicContact CD1-CG 4.4Å; L110-L112 HydrophobicContact CD2-CD1 4.18Å; L110-L112 HydrophobicContact CG-CD1 4.32Å; L110-L112 HydrophobicContact CG-CG 4.35Å; L112-N115 PolarHBondContact O-ND2 3.28Å; L112-L117 HydrophobicContact CB-CD1 4.23Å; L112-L117 HydrophobicContact CD1-CD1 4.33Å; L112-D135 CarbonylContact C-O 3.34Å; L112-D135 WeakPolarHBondContact CA-O 3.38Å; L112-D135 PolarHBondContact N-O 3.5Å; L112-I136 HydrophobicContact CB-CG2 4.39Å; L112-I136 HydrophobicContact CD1-CG2 4.49Å; L112-N139 PolarHBondContact O-ND2 3.39Å
113	K	96.5	Very high	93.5	Very high	64 Å²	64	57 Å²	57	28%	0.278	27%	0.272	S	S	.	.			trans	-57.2	146.1	-179.1	175.4	173.4	177.8	165.1	0	112.3	S89 D90 N115 D135 S137 E138	S89-K113 CarbonylContact C-O 3.32Å; S89-K113 WeakPolarHBondContact CA-O 3.41Å; S89-K113 WeakPolarHBondContact CB-O 3.23Å; D90-K113 PolarHBondContact N-O 3.2Å; K113-N115 PolarHBondContact O-N 2.81Å; K113-N115 PolarHBondContact O-ND2 2.01Å; K113-D135 PolarHBondContact N-O 2.86Å; K113-S137 CarbonylContact C-O 3.3Å; K113-S137 WeakPolarHBondContact CA-O 3.43Å; K113-S137 WeakPolarHBondContact CD-OG 3.5Å; K113-S137 WeakPolarHBondContact CG-OG 3.3Å; K113-E138 WeakPolarHBondContact CE-OE1 3.29Å; K113-E138 VanDerWaalsContact CE-OE2 3.31Å; K113-E138 WeakPolarHBondContact CE-OE2 3.22Å; K113-E138 HydrophobicContact CG-CB 4.21Å; K113-E138 IonicContact NZ-OE1 2.71Å; K113-E138 PolarHBondContact NZ-OE1 3.44Å; K113-E138 IonicContact NZ-OE2 3.55Å
114	G	96.2	Very high	93.9	Very high	16 Å²	16	53.9 Å²	53.9	17%	0.165	26%	0.256	C	S	.	.	S	Bend	trans	70.4	36.5	168.9	0	0	0	0	0	113.2	D90 N91 S137 E138	D90-G114 VanDerWaalsContact CA-O 3.31Å; D90-G114 WeakPolarHBondContact CA-O 3.35Å; N91-G114 PolarHBondContact N-O 3.37Å; G114-S137 PolarHBondContact N-O 2.93Å; G114-E138 CarbonylContact C-O 3.54Å; G114-E138 WeakPolarHBondContact CA-O 3.41Å; G114-E138 PolarHBondContact N-O 2.83Å; G114-E138 VanDerWaalsContact N-O 3.14Å
115	N	97	Very high	93.9	Very high	7 Å²	7	54.1 Å²	54.1	4%	0.037	26%	0.257	C	S	.	.	S	Bend	trans	-114.8	-166.3	-179	-84.2	-70.7	0	0	0	111.1	L88 N91 I93 L112 K113 L117 E138 N139	L88-N115 PolarHBondContact O-ND2 3.15Å; N91-N115 VanDerWaalsContact CA-OD1 3.32Å; N91-N115 WeakPolarHBondContact CA-OD1 3.43Å; N91-N115 WeakPolarHBondContact CB-OD1 3.44Å; N91-N115 PolarHBondContact N-OD1 3.21Å; N91-N115 PolarHBondContact O-OD1 3.03Å; I93-N115 HydrophobicContact CB-CB 4.27Å; I93-N115 VanDerWaalsContact CB-OD1 3.27Å; I93-N115 WeakPolarHBondContact CB-OD1 3.44Å; I93-N115 WeakPolarHBondContact CG1-OD1 3.3Å; I93-N115 PolarHBondContact N-OD1 2.95Å; L112-N115 PolarHBondContact O-ND2 3.28Å; K113-N115 PolarHBondContact O-N 2.81Å; K113-N115 PolarHBondContact O-ND2 2.01Å; N115-L117 HydrophobicContact CB-CG 4.35Å; N115-E138 PolarHBondContact N-O 3.03Å; N115-N139 WeakPolarHBondContact CA-OD1 3.24Å; N115-N139 WeakPolarHBondContact CB-OD1 3.14Å; N115-N139 PolarHBondContact O-OD1 3.35Å
116	R	96.1	Very high	93.9	Very high	152 Å²	152	50.9 Å²	50.9	57%	0.574	25%	0.247	S	C	*	.			trans	-119.3	25.4	-177.2	-60.5	-175.9	-179.8	-161.3	-1.2	112.2	I93 A94 K118 N139	I93-R116 CarbonylContact O-C 3.47Å; I93-R116 VanDerWaalsContact O-C 3.29Å; I93-R116 WeakPolarHBondContact O-CA 3.49Å; I93-R116 PolarHBondContact O-N 2.9Å; A94-R116 HydrophobicContact CB-CB 4.43Å; R116-K118 PolarHBondContact O-N 3.21Å; R116-N139 PolarHBondContact N-OD1 3.01Å
117	L	94.8	Very high	93.5	Very high	2 Å²	2	49.3 Å²	49.3	1%	0.01	25%	0.247	C	C	.	.			trans	-64.8	121.1	-177.4	-59.8	174.9	0	0	0	109.7	I93 V96 L112 N115 N139 K140 I141	I93-L117 HydrophobicContact CG2-CD2 3.9Å; I93-L117 PolarHBondContact O-N 3.41Å; V96-L117 HydrophobicContact CG2-CD2 3.87Å; L112-L117 HydrophobicContact CB-CD1 4.23Å; L112-L117 HydrophobicContact CD1-CD1 4.33Å; N115-L117 HydrophobicContact CB-CG 4.35Å; L117-N139 HydrophobicContact CB-CB 4.29Å; L117-N139 VanDerWaalsContact CB-OD1 3.26Å; L117-N139 WeakPolarHBondContact CB-OD1 3.47Å; L117-N139 VanDerWaalsContact CG-OD1 3.25Å; L117-N139 WeakPolarHBondContact CG-OD1 2.97Å; L117-N139 PolarHBondContact N-OD1 3.12Å; L117-K140 CarbonylContact O-C 3.57Å; L117-K140 WeakPolarHBondContact O-CA 3.4Å; L117-K140 PolarHBondContact O-N 2.86Å; L117-I141 HydrophobicContact CB-CG1 4.42Å; L117-I141 WeakPolarHBondContact O-CG1 3.33Å; L117-I141 PolarHBondContact O-N 2.95Å
118	K	91.5	Very high	93.3	Very high	151 Å²	151	49.4 Å²	49.4	66%	0.657	25%	0.247	S	C	*	.	S	Bend	trans	-90.5	-29.9	175.9	-69.4	-175.8	177.9	-178	0	113.4	R116 K140 I141	R116-K118 PolarHBondContact O-N 3.21Å; K118-K140 WeakPolarHBondContact CA-O 3.34Å; K118-K140 HydrophobicContact CG-CB 4.2Å; K118-I141 WeakPolarHBondContact O-CA 3.44Å
119	L	90.4	Very high	93	Very high	104 Å²	104	45.4 Å²	45.4	55%	0.545	24%	0.24	S	C	.	.			trans	-154.5	151.4	179.4	63.7	96.6	0	0	0	107.7	P121	L119-P121 HydrophobicContact CD1-CB 4.45Å; L119-P121 HydrophobicContact CD1-CG 3.69Å
120	V	90.2	Very high	92.8	Very high	12 Å²	12	48.7 Å²	48.7	7%	0.073	26%	0.257	C	S	.	.			trans	-107.1	110.3	168.9	-177.1	0	0	0	0	107	V124 F125 I141 M148	V120-V124 HydrophobicContact CG1-CB 3.94Å; V120-V124 HydrophobicContact CG1-CG1 4.15Å; V120-V124 HydrophobicContact CG1-CG2 4.2Å; V120-F125 HydrophobicContact CG1-CD2 4.31Å; V120-F125 HydrophobicContact CG1-CE2 3.63Å; V120-F125 HydrophobicContact CG1-CZ 3.87Å; V120-I141 HydrophobicContact CG2-CD1 4.31Å; V120-M148 HydrophobicContact CB-SD 4.45Å
121	P	88.6	Confident	92.8	Very high	45 Å²	45	48.7 Å²	48.7	29%	0.292	26%	0.257	S	S	.	.			trans	-60.4	151	178	-21.2	30.8	0	0	0	112.2	P98 L119 G123 V124	P98-P121 HydrophobicContact CG-CB 4.26Å; L119-P121 HydrophobicContact CD1-CB 4.45Å; L119-P121 HydrophobicContact CD1-CG 3.69Å; P121-G123 PolarHBondContact O-N 3.4Å; P121-V124 HydrophobicContact CB-CG2 4.23Å; P121-V124 HydrophobicContact CG-CG2 4.28Å; P121-V124 WeakPolarHBondContact O-CG2 3.4Å; P121-V124 PolarHBondContact O-N 3.23Å
122	L	87.3	Confident	92.7	Very high	128 Å²	128	46.7 Å²	46.7	67%	0.67	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	137.9	166.4	-63.7	171	0	0	0	109
123	G	87.6	Confident	92.8	Very high	22 Å²	22	49.5 Å²	49.5	23%	0.227	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	95.3	-6.1	-177.4	0	0	0	0	0	115.6	G99 P121 T126	G99-G123 PolarHBondContact N-O 3.47Å; P121-G123 PolarHBondContact O-N 3.4Å; G123-T126 PolarHBondContact O-OG1 2.91Å
124	V	93.4	Very high	92.9	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.006	25%	0.254	C	S	.	.	S	Bend	trans	-70	-39.5	175.2	169.6	0	0	0	0	111.8	V96 F101 V120 P121	V96-V124 HydrophobicContact CB-CG1 4.18Å; V96-V124 HydrophobicContact CB-CG2 4.29Å; V96-V124 HydrophobicContact CG1-CB 4.42Å; V96-V124 HydrophobicContact CG1-CG1 3.46Å; V96-V124 VanDerWaalsContact CG1-CG1 3.46Å; V96-V124 HydrophobicContact CG1-CG2 4.06Å; V96-V124 WeakPolarHBondContact O-CG2 3.23Å; F101-V124 HydrophobicContact CD2-CG1 4.06Å; F101-V124 HydrophobicContact CE2-CG1 3.93Å; V120-V124 HydrophobicContact CG1-CB 3.94Å; V120-V124 HydrophobicContact CG1-CG1 4.15Å; V120-V124 HydrophobicContact CG1-CG2 4.2Å; P121-V124 HydrophobicContact CB-CG2 4.23Å; P121-V124 HydrophobicContact CG-CG2 4.28Å; P121-V124 WeakPolarHBondContact O-CG2 3.4Å; P121-V124 PolarHBondContact O-N 3.23Å
125	F	92.8	Very high	92.9	Very high	7 Å²	7	46.2 Å²	46.2	3%	0.031	25%	0.249	C	C	.	.	S	Bend	trans	-97.9	7.1	-176.4	-59	-47.3	0	0	0	114.1	L110 V120 G127 L128 L134 F149 L152	L110-F125 HydrophobicContact CD2-CD1 4.5Å; L110-F125 HydrophobicContact CD2-CE1 4.06Å; V120-F125 HydrophobicContact CG1-CD2 4.31Å; V120-F125 HydrophobicContact CG1-CE2 3.63Å; V120-F125 HydrophobicContact CG1-CZ 3.87Å; F125-G127 PolarHBondContact O-N 3.08Å; F125-L128 HydrophobicContact CD1-CD1 4.09Å; F125-L128 WeakPolarHBondContact O-CB 3.36Å; F125-L128 PolarHBondContact O-N 3.11Å; F125-L134 HydrophobicContact CE1-CD1 4.12Å; F125-L134 HydrophobicContact CE1-CD2 4.19Å; F125-L134 HydrophobicContact CE2-CD2 4.01Å; F125-L134 HydrophobicContact CZ-CD1 4.2Å; F125-L134 HydrophobicContact CZ-CD2 3.75Å; F125-F149 HydrophobicContact CD2-CD1 4.33Å; F125-F149 HydrophobicContact CE2-CD1 4.05Å; F125-F149 HydrophobicContact CE2-CE1 4.02Å; F125-L152 HydrophobicContact CB-CD1 4.24Å; F125-L152 HydrophobicContact CB-CD2 3.91Å; F125-L152 HydrophobicContact CB-CG 4.04Å; F125-L152 HydrophobicContact CD2-CD1 4.01Å; F125-L152 HydrophobicContact CG-CD1 4.06Å; F125-L152 HydrophobicContact CG-CD2 4.45Å; F125-L152 HydrophobicContact CG-CG 4.42Å
126	T	90.6	Very high	92.9	Very high	48 Å²	48	45.9 Å²	45.9	29%	0.294	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	135	179.9	47	0	0	0	0	110.8	G123 L128 D151	G123-T126 PolarHBondContact O-OG1 2.91Å; T126-L128 VanDerWaalsContact C-N 3.27Å; T126-L128 PolarHBondContact O-N 2.8Å; T126-D151 VanDerWaalsContact CG2-OD2 3.25Å; T126-D151 WeakPolarHBondContact CG2-OD2 3.21Å
127	G	86	Confident	92.8	Very high	36 Å²	36	39.2 Å²	39.2	37%	0.371	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.4	-6.4	179.4	0	0	0	0	0	115.1	F125 S129	F125-G127 PolarHBondContact O-N 3.08Å; G127-S129 PolarHBondContact O-N 2.97Å
128	L	92.8	Very high	92.8	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.01	24%	0.238	C	C	.	.			trans	-82.5	47	176.2	-62.5	-175.7	0	0	0	112.8	F101 L104 L107 L110 F125 T126 N130 L131 L152	F101-L128 HydrophobicContact CB-CD1 3.91Å; F101-L128 HydrophobicContact CB-CD2 3.98Å; F101-L128 HydrophobicContact CB-CG 4.24Å; F101-L128 HydrophobicContact CD2-CD1 4.31Å; F101-L128 HydrophobicContact CG-CD1 4.34Å; L104-L128 HydrophobicContact CB-CD2 4.13Å; L107-L128 HydrophobicContact CB-CD2 4.26Å; L107-L128 HydrophobicContact CD2-CD1 4.35Å; L107-L128 HydrophobicContact CD2-CD2 3.94Å; L110-L128 HydrophobicContact CD2-CD1 4.4Å; F125-L128 HydrophobicContact CD1-CD1 4.09Å; F125-L128 WeakPolarHBondContact O-CB 3.36Å; F125-L128 PolarHBondContact O-N 3.11Å; T126-L128 VanDerWaalsContact C-N 3.27Å; T126-L128 PolarHBondContact O-N 2.8Å; L128-N130 PolarHBondContact O-N 3.23Å; L128-L131 HydrophobicContact CB-CB 4.19Å; L128-L131 HydrophobicContact CD1-CD2 4.36Å; L128-L131 VanDerWaalsContact O-CB 3.31Å; L128-L131 WeakPolarHBondContact O-CB 3.16Å; L128-L131 PolarHBondContact O-N 3.05Å; L128-L131 VanDerWaalsContact O-N 3.17Å; L128-L152 HydrophobicContact CB-CD2 3.92Å
129	S	90.1	Very high	93	Very high	53 Å²	53	35.1 Å²	35.1	37%	0.371	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-20.5	-174.5	-53.9	0	0	0	0	113.6	G127 N154	G127-S129 PolarHBondContact O-N 2.97Å; S129-N154 VanDerWaalsContact O-CB 3.26Å; S129-N154 WeakPolarHBondContact O-CB 3.09Å; S129-N154 PolarHBondContact O-ND2 3.1Å
130	N	94.8	Very high	93.2	Very high	80 Å²	80	34.5 Å²	34.5	43%	0.428	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	1.3	177.9	-74.7	-17.8	0	0	0	113.9	F105 L107 L128 T132	F105-N130 VanDerWaalsContact O-CB 3.3Å; F105-N130 WeakPolarHBondContact O-CB 3.43Å; F105-N130 PolarHBondContact O-ND2 3.36Å; L107-N130 CarbonylContact O-C 3.54Å; L128-N130 PolarHBondContact O-N 3.23Å; N130-T132 PolarHBondContact O-N 3.09Å
131	L	96.9	Very high	93.4	Very high	0 Å²	0	34 Å²	34	0%	0	20%	0.196	C	C	.	.			trans	-67.3	126.9	-179.5	-162.5	75.3	0	0	0	109.8	L107 L110 L128 L134 L152 N154 L155	L107-L131 HydrophobicContact CB-CD1 4.37Å; L107-L131 HydrophobicContact CD2-CD1 3.95Å; L107-L131 HydrophobicContact CG-CD1 3.85Å; L107-L131 VanDerWaalsContact O-CA 3.26Å; L107-L131 WeakPolarHBondContact O-CA 3.34Å; L107-L131 PolarHBondContact O-N 3.33Å; L107-L131 VanDerWaalsContact O-N 3.15Å; L110-L131 HydrophobicContact CB-CD1 3.85Å; L110-L131 HydrophobicContact CB-CD2 4.29Å; L128-L131 HydrophobicContact CB-CB 4.19Å; L128-L131 HydrophobicContact CD1-CD2 4.36Å; L128-L131 VanDerWaalsContact O-CB 3.31Å; L128-L131 WeakPolarHBondContact O-CB 3.16Å; L128-L131 PolarHBondContact O-N 3.05Å; L128-L131 VanDerWaalsContact O-N 3.17Å; L131-L134 HydrophobicContact CD2-CB 4.17Å; L131-L134 HydrophobicContact CD2-CD1 4.46Å; L131-L152 HydrophobicContact CB-CD2 4.18Å; L131-L152 HydrophobicContact CD2-CD1 4.4Å; L131-L152 HydrophobicContact CD2-CD2 3.86Å; L131-N154 CarbonylContact O-C 3.2Å; L131-L155 HydrophobicContact CB-CD1 4.45Å; L131-L155 HydrophobicContact CD2-CD1 4.07Å; L131-L155 HydrophobicContact CG-CD1 4.08Å; L131-L155 VanDerWaalsContact O-CA 3.24Å; L131-L155 WeakPolarHBondContact O-CA 3.49Å; L131-L155 PolarHBondContact O-N 2.95Å
132	T	97.7	Very high	93.6	Very high	48 Å²	48	35 Å²	35	29%	0.294	20%	0.201	S	C	.	.			trans	-111.7	-28.1	-179	59.8	0	0	0	0	112.5	R108 N130 K156 S157	R108-T132 PolarHBondContact O-N 2.86Å; R108-T132 PolarHBondContact O-OG1 3.04Å; R108-T132 VanDerWaalsContact O-OG1 3.06Å; N130-T132 PolarHBondContact O-N 3.09Å; T132-K156 WeakPolarHBondContact O-CA 3.14Å; T132-K156 PolarHBondContact O-N 3.21Å; T132-S157 PolarHBondContact O-N 3.3Å
133	K	98.3	Very high	93.8	Very high	62 Å²	62	32.4 Å²	32.4	27%	0.27	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	127.6	177.7	-174.8	166.2	-177.2	161.6	0	111.4	R108 S109 L110 S157 E159	R108-K133 PolarHBondContact O-N 3.24Å; S109-K133 WeakPolarHBondContact CA-O 3.41Å; L110-K133 PolarHBondContact N-O 3.24Å; K133-S157 WeakPolarHBondContact CA-O 3.3Å; K133-E159 VanDerWaalsContact CE-OE1 3.22Å; K133-E159 WeakPolarHBondContact CE-OE1 3.48Å; K133-E159 IonicContact NZ-OE1 2.79Å; K133-E159 PolarHBondContact NZ-OE1 2.74Å
134	L	97.8	Very high	94.1	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	126	173.8	177.8	61.9	0	0	0	109.6	L110 F125 L131 I136 F149 L152 L155 S157 L158 E159	L110-L134 HydrophobicContact CB-CD1 4.17Å; L110-L134 HydrophobicContact CD2-CD1 4.06Å; L110-L134 HydrophobicContact CG-CD1 4.13Å; L110-L134 WeakPolarHBondContact O-CA 3.23Å; F125-L134 HydrophobicContact CE1-CD1 4.12Å; F125-L134 HydrophobicContact CE1-CD2 4.19Å; F125-L134 HydrophobicContact CE2-CD2 4.01Å; F125-L134 HydrophobicContact CZ-CD1 4.2Å; F125-L134 HydrophobicContact CZ-CD2 3.75Å; L131-L134 HydrophobicContact CD2-CB 4.17Å; L131-L134 HydrophobicContact CD2-CD1 4.46Å; L134-I136 HydrophobicContact CD1-CG2 3.97Å; L134-I136 HydrophobicContact CD2-CG2 4.45Å; L134-I136 HydrophobicContact CG-CG2 4.12Å; L134-F149 HydrophobicContact CD2-CD1 4.16Å; L134-F149 HydrophobicContact CD2-CE1 4.01Å; L134-L152 HydrophobicContact CD2-CD1 3.67Å; L134-L155 HydrophobicContact CB-CD1 3.77Å; L134-L155 HydrophobicContact CB-CD2 4.14Å; L134-S157 PolarHBondContact N-O 3.41Å; L134-L158 HydrophobicContact CB-CD1 4.11Å; L134-L158 HydrophobicContact CD2-CD1 3.95Å; L134-L158 HydrophobicContact CG-CD1 4.05Å; L134-L158 WeakPolarHBondContact O-CA 3.4Å; L134-E159 PolarHBondContact O-N 2.88Å
135	D	97.4	Very high	94.1	Very high	11 Å²	11	36 Å²	36	6%	0.059	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	114	174.1	-176.7	-1.7	0	0	0	109.9	L110 R111 L112 K113 S137 E159	L110-D135 PolarHBondContact O-N 3.49Å; L110-D135 VanDerWaalsContact O-N 3.08Å; R111-D135 HydrophobicContact CB-CB 4.47Å; R111-D135 HydrophobicContact CG-CB 4.33Å; L112-D135 CarbonylContact C-O 3.34Å; L112-D135 WeakPolarHBondContact CA-O 3.38Å; L112-D135 PolarHBondContact N-O 3.5Å; K113-D135 PolarHBondContact N-O 2.86Å; D135-S137 VanDerWaalsContact OD1-CB 3.23Å; D135-S137 WeakPolarHBondContact OD1-CB 3.32Å; D135-S137 PolarHBondContact OD1-N 2.8Å; D135-S137 PolarHBondContact OD1-OG 3.2Å; D135-E159 HydrophobicContact CB-CB 4.29Å
136	I	95.6	Very high	94.2	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.217	C	C	.	.			trans	-119.9	22.9	175.6	57.4	170.3	0	0	0	111.1	L112 L134 N139 I141 F149 E159 V160 N163	L112-I136 HydrophobicContact CB-CG2 4.39Å; L112-I136 HydrophobicContact CD1-CG2 4.49Å; L134-I136 HydrophobicContact CD1-CG2 3.97Å; L134-I136 HydrophobicContact CD2-CG2 4.45Å; L134-I136 HydrophobicContact CG-CG2 4.12Å; I136-N139 PolarHBondContact O-ND2 3.04Å; I136-I141 HydrophobicContact CB-CD1 4.45Å; I136-I141 HydrophobicContact CD1-CD1 4.01Å; I136-F149 HydrophobicContact CD1-CE1 3.99Å; I136-F149 HydrophobicContact CD1-CZ 3.75Å; I136-E159 PolarHBondContact N-O 2.96Å; I136-V160 HydrophobicContact CD1-CG1 4.35Å; I136-V160 HydrophobicContact CD1-CG2 3.97Å; I136-V160 HydrophobicContact CG1-CB 4.48Å; I136-V160 HydrophobicContact CG1-CG1 4.43Å; I136-V160 HydrophobicContact CG1-CG2 3.99Å; I136-N163 PolarHBondContact O-ND2 2.75Å
137	S	95.3	Very high	94.3	Very high	12 Å²	12	40.6 Å²	40.6	8%	0.084	22%	0.219	C	C	.	.			trans	-68.8	166.1	177.3	66	0	0	0	0	112.7	K113 G114 D135 N139 G161	K113-S137 CarbonylContact C-O 3.3Å; K113-S137 WeakPolarHBondContact CA-O 3.43Å; K113-S137 WeakPolarHBondContact CD-OG 3.5Å; K113-S137 WeakPolarHBondContact CG-OG 3.3Å; G114-S137 PolarHBondContact N-O 2.93Å; D135-S137 VanDerWaalsContact OD1-CB 3.23Å; D135-S137 WeakPolarHBondContact OD1-CB 3.32Å; D135-S137 PolarHBondContact OD1-N 2.8Å; D135-S137 PolarHBondContact OD1-OG 3.2Å; S137-N139 PolarHBondContact O-N 2.82Å; S137-N139 PolarHBondContact O-ND2 2.88Å; S137-G161 CarbonylContact C-O 3.59Å; S137-G161 VanDerWaalsContact C-O 3.29Å; S137-G161 WeakPolarHBondContact CA-O 3.34Å
138	E	94.5	Very high	94.6	Very high	66 Å²	66	39.6 Å²	39.6	31%	0.308	20%	0.204	S	C	.	.	S	Bend	trans	53	48.9	178.7	-65.5	176.7	-150.2	0	0	112.8	K113 G114 N115 G161 D162	K113-E138 WeakPolarHBondContact CE-OE1 3.29Å; K113-E138 VanDerWaalsContact CE-OE2 3.31Å; K113-E138 WeakPolarHBondContact CE-OE2 3.22Å; K113-E138 HydrophobicContact CG-CB 4.21Å; K113-E138 IonicContact NZ-OE1 2.71Å; K113-E138 PolarHBondContact NZ-OE1 3.44Å; K113-E138 IonicContact NZ-OE2 3.55Å; G114-E138 CarbonylContact C-O 3.54Å; G114-E138 WeakPolarHBondContact CA-O 3.41Å; G114-E138 PolarHBondContact N-O 2.83Å; G114-E138 VanDerWaalsContact N-O 3.14Å; N115-E138 PolarHBondContact N-O 3.03Å; E138-G161 PolarHBondContact N-O 2.99Å; E138-D162 CarbonylContact C-O 3.57Å; E138-D162 VanDerWaalsContact CA-O 3.24Å; E138-D162 WeakPolarHBondContact CA-O 3.38Å; E138-D162 HydrophobicContact CB-CB 4.28Å; E138-D162 HydrophobicContact CG-CB 3.56Å
139	N	95.3	Very high	94.7	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.204	C	C	.	.	S	Bend	trans	-120.9	-162.6	179.7	-90	-78	0	0	0	111.1	L112 N115 R116 L117 I136 S137 I141 D162 N163	L112-N139 PolarHBondContact O-ND2 3.39Å; N115-N139 WeakPolarHBondContact CA-OD1 3.24Å; N115-N139 WeakPolarHBondContact CB-OD1 3.14Å; N115-N139 PolarHBondContact O-OD1 3.35Å; R116-N139 PolarHBondContact N-OD1 3.01Å; L117-N139 HydrophobicContact CB-CB 4.29Å; L117-N139 VanDerWaalsContact CB-OD1 3.26Å; L117-N139 WeakPolarHBondContact CB-OD1 3.47Å; L117-N139 VanDerWaalsContact CG-OD1 3.25Å; L117-N139 WeakPolarHBondContact CG-OD1 2.97Å; L117-N139 PolarHBondContact N-OD1 3.12Å; I136-N139 PolarHBondContact O-ND2 3.04Å; S137-N139 PolarHBondContact O-N 2.82Å; S137-N139 PolarHBondContact O-ND2 2.88Å; N139-I141 HydrophobicContact CB-CD1 4.4Å; N139-I141 HydrophobicContact CB-CG1 4.26Å; N139-D162 PolarHBondContact N-O 2.64Å; N139-N163 VanDerWaalsContact CA-OD1 3.27Å; N139-N163 WeakPolarHBondContact CA-OD1 3.33Å; N139-N163 WeakPolarHBondContact CB-OD1 3.43Å
140	K	94.4	Very high	94.9	Very high	92 Å²	92	41.2 Å²	41.2	40%	0.4	21%	0.206	S	C	.	.			trans	-121.5	26.8	-179.8	-61	-66.3	162.8	-152.3	0	112.4	L117 K118 V142 N163 D164	L117-K140 CarbonylContact O-C 3.57Å; L117-K140 WeakPolarHBondContact O-CA 3.4Å; L117-K140 PolarHBondContact O-N 2.86Å; K118-K140 WeakPolarHBondContact CA-O 3.34Å; K118-K140 HydrophobicContact CG-CB 4.2Å; K140-V142 PolarHBondContact O-N 3.17Å; K140-N163 PolarHBondContact N-OD1 3.33Å; K140-D164 WeakPolarHBondContact CD-OD2 3.39Å; K140-D164 IonicContact NZ-OD1 2.79Å; K140-D164 IonicContact NZ-OD2 2.68Å
141	I	93.8	Very high	94.7	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.201	C	C	.	.			trans	-72	123.2	-176.9	-57.9	170.1	0	0	0	109	L117 K118 V120 I136 N139 L144 N163 D164 L165	L117-I141 HydrophobicContact CB-CG1 4.42Å; L117-I141 WeakPolarHBondContact O-CG1 3.33Å; L117-I141 PolarHBondContact O-N 2.95Å; K118-I141 WeakPolarHBondContact O-CA 3.44Å; V120-I141 HydrophobicContact CG2-CD1 4.31Å; I136-I141 HydrophobicContact CB-CD1 4.45Å; I136-I141 HydrophobicContact CD1-CD1 4.01Å; N139-I141 HydrophobicContact CB-CD1 4.4Å; N139-I141 HydrophobicContact CB-CG1 4.26Å; I141-L144 HydrophobicContact CG2-CD2 4.1Å; I141-N163 HydrophobicContact CB-CB 4.28Å; I141-N163 WeakPolarHBondContact CB-OD1 3.38Å; I141-N163 VanDerWaalsContact CG1-OD1 3.29Å; I141-N163 WeakPolarHBondContact CG1-OD1 3.36Å; I141-N163 PolarHBondContact N-OD1 2.61Å; I141-N163 WeakPolarHBondContact O-CB 3.43Å; I141-D164 CarbonylContact O-C 3.59Å; I141-D164 VanDerWaalsContact O-C 3.22Å; I141-D164 PolarHBondContact O-N 3.44Å; I141-L165 WeakPolarHBondContact O-CA 3.24Å; I141-L165 PolarHBondContact O-N 3.34Å; I141-L165 VanDerWaalsContact O-N 3.09Å
142	V	92.3	Very high	94.6	Very high	67 Å²	67	40.3 Å²	40.3	41%	0.406	20%	0.201	S	C	.	.			trans	-93.4	-34	-177.4	-174.4	0	0	0	0	112.2	K140 D164 L165 V166	K140-V142 PolarHBondContact O-N 3.17Å; V142-D164 WeakPolarHBondContact CA-O 3.33Å; V142-D164 HydrophobicContact CG2-CB 4.28Å; V142-L165 WeakPolarHBondContact O-CA 3.4Å; V142-V166 HydrophobicContact CG1-CG2 4.41Å; V142-V166 PolarHBondContact O-N 2.93Å
143	I	91.9	Very high	94.4	Very high	73 Å²	73	41.6 Å²	41.6	37%	0.374	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	136.6	-175.2	-57	178.3	0	0	0	109.9	L145 Y167	I143-L145 HydrophobicContact CG2-CD2 4.08Å; I143-Y167 WeakPolarHBondContact CA-O 3.24Å; I143-Y167 HydrophobicContact CG2-CD1 3.98Å
144	L	94	Very high	94.4	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	119.5	162.1	-59.8	-178.2	0	0	0	109	I141 M148 F149 V160 L165 Y167 I168 S169 A172 F173	I141-L144 HydrophobicContact CG2-CD2 4.1Å; L144-M148 HydrophobicContact CD2-CE 4.35Å; L144-M148 HydrophobicContact CD2-SD 3.64Å; L144-F149 HydrophobicContact CD1-CE2 4.39Å; L144-F149 HydrophobicContact CD2-CE2 4.38Å; L144-F149 HydrophobicContact CD2-CZ 4.3Å; L144-V160 HydrophobicContact CD1-CG1 4.39Å; L144-L165 HydrophobicContact CD1-CD2 4.36Å; L144-L165 HydrophobicContact CD2-CD1 4.5Å; L144-L165 HydrophobicContact CG-CD1 3.88Å; L144-L165 HydrophobicContact CG-CD2 4.37Å; L144-Y167 PolarHBondContact N-O 3.25Å; L144-Y167 VanDerWaalsContact N-O 3.16Å; L144-I168 HydrophobicContact CB-CG1 4.49Å; L144-I168 HydrophobicContact CB-CG2 4.31Å; L144-I168 HydrophobicContact CD1-CD1 4.24Å; L144-I168 HydrophobicContact CD1-CG1 4.04Å; L144-I168 HydrophobicContact CD1-CG2 4.26Å; L144-I168 HydrophobicContact CG-CG1 4.37Å; L144-S169 WeakPolarHBondContact O-CB 3.48Å; L144-S169 PolarHBondContact O-N 3.35Å; L144-S169 PolarHBondContact O-OG 3.09Å; L144-S169 VanDerWaalsContact O-OG 3.13Å; L144-A172 HydrophobicContact CB-CB 3.88Å; L144-F173 HydrophobicContact CD1-CE1 3.93Å; L144-F173 HydrophobicContact CD1-CZ 3.95Å
145	L	93.3	Very high	94.4	Very high	100 Å²	100	42.1 Å²	42.1	52%	0.524	21%	0.21	S	C	.	.	P	Polyproline II helix	trans	-86.7	160.6	-178.2	-63.4	173.4	0	0	0	111.4	I143 Y147 M148 A172	I143-L145 HydrophobicContact CG2-CD2 4.08Å; L145-Y147 PolarHBondContact O-N 3Å; L145-M148 HydrophobicContact CB-CE 4.28Å; L145-M148 HydrophobicContact CG-CE 4.48Å; L145-M148 WeakPolarHBondContact O-CB 3.17Å; L145-M148 PolarHBondContact O-N 2.98Å; L145-A172 WeakPolarHBondContact O-CA 3.25Å
146	D	94.7	Very high	94.4	Very high	69 Å²	69	46.1 Å²	46.1	37%	0.369	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	137.1	177.1	-75.8	-16.2	0	0	0	110.6	M148 S169 R171	D146-M148 PolarHBondContact O-N 2.96Å; D146-M148 VanDerWaalsContact O-N 3.14Å; D146-S169 WeakPolarHBondContact CA-OG 3.33Å; D146-S169 PolarHBondContact N-OG 3.18Å; D146-S169 WeakPolarHBondContact OD1-CB 3.27Å; D146-S169 PolarHBondContact OD1-OG 3.15Å; D146-R171 HydrophobicContact CB-CB 4.07Å; D146-R171 WeakPolarHBondContact OD1-CA 3.32Å; D146-R171 WeakPolarHBondContact OD1-CB 3.26Å; D146-R171 PolarHBondContact OD1-N 2.98Å
147	Y	94.1	Very high	94.5	Very high	82 Å²	82	46.9 Å²	46.9	32%	0.322	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.3	14.1	176.3	-49.2	-70.3	0	0	0	115.7	L145 F149 Q150 R171	L145-Y147 PolarHBondContact O-N 3Å; Y147-F149 PolarHBondContact O-N 3.43Å; Y147-F149 VanDerWaalsContact O-N 3.12Å; Y147-Q150 VanDerWaalsContact O-CB 3.24Å; Y147-Q150 WeakPolarHBondContact O-CB 3.27Å; Y147-Q150 PolarHBondContact O-N 2.86Å; Y147-R171 HydrophobicContact CE1-CB 4.29Å; Y147-R171 PolarHBondContact N-O 3.34Å; Y147-R171 WeakPolarHBondContact OH-CD 3.32Å; Y147-R171 PolarHBondContact OH-NH1 3.12Å
148	M	92.7	Very high	94.6	Very high	15 Å²	15	46.3 Å²	46.3	7%	0.074	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-35.5	-179.7	177.4	177.6	-77.6	0	0	113.5	V120 L144 L145 D146	V120-M148 HydrophobicContact CB-SD 4.45Å; L144-M148 HydrophobicContact CD2-CE 4.35Å; L144-M148 HydrophobicContact CD2-SD 3.64Å; L145-M148 HydrophobicContact CB-CE 4.28Å; L145-M148 HydrophobicContact CG-CE 4.48Å; L145-M148 WeakPolarHBondContact O-CB 3.17Å; L145-M148 PolarHBondContact O-N 2.98Å; D146-M148 PolarHBondContact O-N 2.96Å; D146-M148 VanDerWaalsContact O-N 3.14Å
149	F	94.4	Very high	94.7	Very high	1 Å²	1	45.4 Å²	45.4	0%	0.004	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.6	21.8	-179.6	-52	-71.5	0	0	0	113.1	F125 L134 I136 L144 Y147 D151 L152 L158 F173 L176	F125-F149 HydrophobicContact CD2-CD1 4.33Å; F125-F149 HydrophobicContact CE2-CD1 4.05Å; F125-F149 HydrophobicContact CE2-CE1 4.02Å; L134-F149 HydrophobicContact CD2-CD1 4.16Å; L134-F149 HydrophobicContact CD2-CE1 4.01Å; I136-F149 HydrophobicContact CD1-CE1 3.99Å; I136-F149 HydrophobicContact CD1-CZ 3.75Å; L144-F149 HydrophobicContact CD1-CE2 4.39Å; L144-F149 HydrophobicContact CD2-CE2 4.38Å; L144-F149 HydrophobicContact CD2-CZ 4.3Å; Y147-F149 PolarHBondContact O-N 3.43Å; Y147-F149 VanDerWaalsContact O-N 3.12Å; F149-D151 VanDerWaalsContact C-N 3.29Å; F149-D151 PolarHBondContact O-N 2.88Å; F149-L152 HydrophobicContact CB-CD1 4.39Å; F149-L152 HydrophobicContact CD1-CD1 4.04Å; F149-L152 PolarHBondContact O-N 2.95Å; F149-L152 VanDerWaalsContact O-N 3.16Å; F149-L158 HydrophobicContact CD2-CD2 4.32Å; F149-L158 HydrophobicContact CE1-CD1 4.36Å; F149-L158 HydrophobicContact CE2-CD2 4.17Å; F149-L158 HydrophobicContact CZ-CD2 4.33Å; F149-F173 HydrophobicContact CD2-CD1 4.2Å; F149-F173 HydrophobicContact CE2-CD1 4.31Å; F149-F173 HydrophobicContact CE2-CE1 4.24Å; F149-L176 HydrophobicContact CB-CD1 3.93Å; F149-L176 HydrophobicContact CB-CD2 3.7Å; F149-L176 HydrophobicContact CB-CG 3.82Å; F149-L176 HydrophobicContact CD2-CD1 4.2Å; F149-L176 HydrophobicContact CG-CD1 4.27Å
150	Q	93.3	Very high	94.6	Very high	88 Å²	88	45.5 Å²	45.5	41%	0.411	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-40.5	-170	177.5	174.5	-27.2	0	0	112.7	Y147 L152 H153	Y147-Q150 VanDerWaalsContact O-CB 3.24Å; Y147-Q150 WeakPolarHBondContact O-CB 3.27Å; Y147-Q150 PolarHBondContact O-N 2.86Å; Q150-L152 VanDerWaalsContact C-N 3.27Å; Q150-L152 PolarHBondContact O-N 3.3Å; Q150-H153 PolarHBondContact O-CE1 3.12Å; Q150-H153 PolarHBondContact O-ND1 3.47Å
151	D	91.1	Very high	94.1	Very high	60 Å²	60	41.2 Å²	41.2	32%	0.321	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-13	-175.3	-59.2	-48.5	0	0	0	114.1	T126 F149 H153	T126-D151 VanDerWaalsContact CG2-OD2 3.25Å; T126-D151 WeakPolarHBondContact CG2-OD2 3.21Å; F149-D151 VanDerWaalsContact C-N 3.29Å; F149-D151 PolarHBondContact O-N 2.88Å; D151-H153 PolarHBondContact O-N 3.07Å
152	L	95	Very high	93.5	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.005	22%	0.22	C	C	.	.			trans	-87.5	54.2	-173.9	-62.6	-177.6	0	0	0	111.9	F125 L128 L131 L134 F149 Q150 N154 L155 L176	F125-L152 HydrophobicContact CB-CD1 4.24Å; F125-L152 HydrophobicContact CB-CD2 3.91Å; F125-L152 HydrophobicContact CB-CG 4.04Å; F125-L152 HydrophobicContact CD2-CD1 4.01Å; F125-L152 HydrophobicContact CG-CD1 4.06Å; F125-L152 HydrophobicContact CG-CD2 4.45Å; F125-L152 HydrophobicContact CG-CG 4.42Å; L128-L152 HydrophobicContact CB-CD2 3.92Å; L131-L152 HydrophobicContact CB-CD2 4.18Å; L131-L152 HydrophobicContact CD2-CD1 4.4Å; L131-L152 HydrophobicContact CD2-CD2 3.86Å; L134-L152 HydrophobicContact CD2-CD1 3.67Å; F149-L152 HydrophobicContact CB-CD1 4.39Å; F149-L152 HydrophobicContact CD1-CD1 4.04Å; F149-L152 PolarHBondContact O-N 2.95Å; F149-L152 VanDerWaalsContact O-N 3.16Å; Q150-L152 VanDerWaalsContact C-N 3.27Å; Q150-L152 PolarHBondContact O-N 3.3Å; L152-N154 VanDerWaalsContact C-N 3.32Å; L152-N154 PolarHBondContact O-N 3.25Å; L152-L155 HydrophobicContact CB-CB 4.04Å; L152-L155 HydrophobicContact CB-CD2 4.39Å; L152-L155 HydrophobicContact CD1-CD2 4.12Å; L152-L155 VanDerWaalsContact O-CB 3.28Å; L152-L155 WeakPolarHBondContact O-CB 3.33Å; L152-L155 PolarHBondContact O-N 3.17Å; L152-L176 HydrophobicContact CB-CD2 3.94Å; L152-L176 WeakPolarHBondContact O-CD2 3.37Å
153	H	94.3	Very high	93.1	Very high	74 Å²	74	41 Å²	41	34%	0.343	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-30.3	-171.5	-56	-56.8	0	0	0	114.9	Q150 D151 G175 S178	Q150-H153 PolarHBondContact O-CE1 3.12Å; Q150-H153 PolarHBondContact O-ND1 3.47Å; D151-H153 PolarHBondContact O-N 3.07Å; H153-G175 PolarHBondContact ND1-O 3.17Å; H153-S178 VanDerWaalsContact O-CB 3.22Å; H153-S178 WeakPolarHBondContact O-CB 3.37Å; H153-S178 PolarHBondContact O-N 3.47Å; H153-S178 PolarHBondContact O-OG 2.87Å
154	N	96.3	Very high	92.9	Very high	74 Å²	74	41.5 Å²	41.5	40%	0.396	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.7	6.5	-180	-64.6	-39.1	0	0	0	113.4	S129 L131 L152 K156	S129-N154 VanDerWaalsContact O-CB 3.26Å; S129-N154 WeakPolarHBondContact O-CB 3.09Å; S129-N154 PolarHBondContact O-ND2 3.1Å; L131-N154 CarbonylContact O-C 3.2Å; L152-N154 VanDerWaalsContact C-N 3.32Å; L152-N154 PolarHBondContact O-N 3.25Å; N154-K156 PolarHBondContact O-N 3.23Å
155	L	97.8	Very high	92.8	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.206	C	C	.	.			trans	-63.2	127.7	178.2	-164.1	74.7	0	0	0	109.5	L131 L134 L152 L158 L176 S178 L179	L131-L155 HydrophobicContact CB-CD1 4.45Å; L131-L155 HydrophobicContact CD2-CD1 4.07Å; L131-L155 HydrophobicContact CG-CD1 4.08Å; L131-L155 VanDerWaalsContact O-CA 3.24Å; L131-L155 WeakPolarHBondContact O-CA 3.49Å; L131-L155 PolarHBondContact O-N 2.95Å; L134-L155 HydrophobicContact CB-CD1 3.77Å; L134-L155 HydrophobicContact CB-CD2 4.14Å; L152-L155 HydrophobicContact CB-CB 4.04Å; L152-L155 HydrophobicContact CB-CD2 4.39Å; L152-L155 HydrophobicContact CD1-CD2 4.12Å; L152-L155 VanDerWaalsContact O-CB 3.28Å; L152-L155 WeakPolarHBondContact O-CB 3.33Å; L152-L155 PolarHBondContact O-N 3.17Å; L155-L158 HydrophobicContact CD2-CB 3.96Å; L155-L158 HydrophobicContact CD2-CD1 4.22Å; L155-L158 HydrophobicContact CD2-CG 4.47Å; L155-L176 HydrophobicContact CB-CD2 4.03Å; L155-L176 HydrophobicContact CD2-CD2 3.78Å; L155-S178 CarbonylContact O-C 3.15Å; L155-L179 HydrophobicContact CB-CD1 4.33Å; L155-L179 HydrophobicContact CD2-CD1 3.98Å; L155-L179 HydrophobicContact CG-CD1 4.04Å; L155-L179 WeakPolarHBondContact O-CA 3.39Å; L155-L179 PolarHBondContact O-N 2.87Å; L155-L179 VanDerWaalsContact O-N 3.1Å
156	K	98	Very high	92.7	Very high	95 Å²	95	40.2 Å²	40.2	41%	0.413	20%	0.202	S	C	.	.			trans	-103.2	-36.5	-178.8	-64.2	-170	165.7	-123.9	0	112.3	T132 N154 E180 Q181	T132-K156 WeakPolarHBondContact O-CA 3.14Å; T132-K156 PolarHBondContact O-N 3.21Å; N154-K156 PolarHBondContact O-N 3.23Å; K156-E180 IonicContact NZ-OE1 2.96Å; K156-E180 PolarHBondContact NZ-OE1 3.42Å; K156-E180 PolarHBondContact O-N 3.2Å; K156-Q181 PolarHBondContact O-N 3.21Å
157	S	98.4	Very high	92.5	Very high	15 Å²	15	42.3 Å²	42.3	11%	0.105	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	123.9	-176.1	-178.7	0	0	0	0	110	T132 K133 L134 Q181	T132-S157 PolarHBondContact O-N 3.3Å; K133-S157 WeakPolarHBondContact CA-O 3.3Å; L134-S157 PolarHBondContact N-O 3.41Å; S157-Q181 WeakPolarHBondContact CA-O 3.47Å
158	L	97.9	Very high	92.5	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	121.3	175.8	177.7	60.5	0	0	0	109.4	L134 F149 L155 V160 F173 L176 L179 Q181 L182 T183	L134-L158 HydrophobicContact CB-CD1 4.11Å; L134-L158 HydrophobicContact CD2-CD1 3.95Å; L134-L158 HydrophobicContact CG-CD1 4.05Å; L134-L158 WeakPolarHBondContact O-CA 3.4Å; F149-L158 HydrophobicContact CD2-CD2 4.32Å; F149-L158 HydrophobicContact CE1-CD1 4.36Å; F149-L158 HydrophobicContact CE2-CD2 4.17Å; F149-L158 HydrophobicContact CZ-CD2 4.33Å; L155-L158 HydrophobicContact CD2-CB 3.96Å; L155-L158 HydrophobicContact CD2-CD1 4.22Å; L155-L158 HydrophobicContact CD2-CG 4.47Å; L158-V160 HydrophobicContact CD1-CG2 3.95Å; L158-V160 HydrophobicContact CD2-CG2 4.06Å; L158-V160 HydrophobicContact CG-CG2 3.78Å; L158-F173 HydrophobicContact CD2-CD1 4.33Å; L158-F173 HydrophobicContact CD2-CE1 4.16Å; L158-L176 HydrophobicContact CD2-CD1 3.86Å; L158-L179 HydrophobicContact CB-CD1 3.72Å; L158-L179 HydrophobicContact CB-CD2 4.27Å; L158-Q181 PolarHBondContact N-O 2.87Å; L158-L182 HydrophobicContact CB-CD1 4.16Å; L158-L182 HydrophobicContact CD2-CD1 4.07Å; L158-L182 HydrophobicContact CG-CD1 4.1Å; L158-T183 PolarHBondContact O-N 3.3Å
159	E	96.7	Very high	92.6	Very high	48 Å²	48	38.6 Å²	38.6	22%	0.224	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	112.9	174.6	-63.7	-179.5	-140.8	0	0	108.9	K133 L134 D135 I136	K133-E159 VanDerWaalsContact CE-OE1 3.22Å; K133-E159 WeakPolarHBondContact CE-OE1 3.48Å; K133-E159 IonicContact NZ-OE1 2.79Å; K133-E159 PolarHBondContact NZ-OE1 2.74Å; L134-E159 PolarHBondContact O-N 2.88Å; D135-E159 HydrophobicContact CB-CB 4.29Å; I136-E159 PolarHBondContact N-O 2.96Å
160	V	93	Very high	92.7	Very high	2 Å²	2	43.6 Å²	43.6	1%	0.012	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	111.9	173.3	-170.3	0	0	0	0	107.4	I136 L144 L158 L165 T183 L184 E185	I136-V160 HydrophobicContact CD1-CG1 4.35Å; I136-V160 HydrophobicContact CD1-CG2 3.97Å; I136-V160 HydrophobicContact CG1-CB 4.48Å; I136-V160 HydrophobicContact CG1-CG1 4.43Å; I136-V160 HydrophobicContact CG1-CG2 3.99Å; L144-V160 HydrophobicContact CD1-CG1 4.39Å; L158-V160 HydrophobicContact CD1-CG2 3.95Å; L158-V160 HydrophobicContact CD2-CG2 4.06Å; L158-V160 HydrophobicContact CG-CG2 3.78Å; V160-L165 HydrophobicContact CG1-CD2 4.36Å; V160-T183 PolarHBondContact N-O 3.37Å; V160-L184 HydrophobicContact CB-CD2 3.97Å; V160-L184 VanDerWaalsContact O-CA 3.24Å; V160-L184 WeakPolarHBondContact O-CA 3.26Å; V160-E185 PolarHBondContact O-N 3.39Å; V160-E185 VanDerWaalsContact O-N 3.13Å
161	G	82.9	Confident	92.9	Very high	2 Å²	2	45.4 Å²	45.4	2%	0.021	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.7	171.4	176.8	0	0	0	0	0	114.3	S137 E138 N163 E185	S137-G161 CarbonylContact C-O 3.59Å; S137-G161 VanDerWaalsContact C-O 3.29Å; S137-G161 WeakPolarHBondContact CA-O 3.34Å; E138-G161 PolarHBondContact N-O 2.99Å; G161-N163 PolarHBondContact O-N 3.26Å; G161-N163 VanDerWaalsContact O-N 3.14Å; G161-N163 PolarHBondContact O-ND2 3.22Å; G161-E185 CarbonylContact C-O 3.45Å; G161-E185 VanDerWaalsContact C-O 3.3Å; G161-E185 WeakPolarHBondContact CA-O 3.25Å
162	D	80.9	Confident	93.1	Very high	56 Å²	56	42.5 Å²	42.5	30%	0.299	20%	0.203	S	C	.	.	S	Bend	trans	48.8	44.5	179.4	-152.1	-13.3	0	0	0	112.2	E138 N139 E185 K186	E138-D162 CarbonylContact C-O 3.57Å; E138-D162 VanDerWaalsContact CA-O 3.24Å; E138-D162 WeakPolarHBondContact CA-O 3.38Å; E138-D162 HydrophobicContact CB-CB 4.28Å; E138-D162 HydrophobicContact CG-CB 3.56Å; N139-D162 PolarHBondContact N-O 2.64Å; D162-E185 PolarHBondContact N-O 3.38Å; D162-K186 HydrophobicContact CB-CB 4.07Å; D162-K186 HydrophobicContact CB-CD 3.8Å; D162-K186 VanDerWaalsContact CG-CD 3.41Å; D162-K186 WeakPolarHBondContact OD2-CD 3.33Å; D162-K186 IonicContact OD2-NZ 3.04Å; D162-K186 PolarHBondContact OD2-NZ 3.31Å
163	N	83.5	Confident	93.2	Very high	7 Å²	7	42.5 Å²	42.5	4%	0.037	20%	0.203	C	C	.	.	S	Bend	trans	-112.1	162.8	176.6	-87.8	-81.4	0	0	0	107.8	I136 N139 K140 I141 G161 L165	I136-N163 PolarHBondContact O-ND2 2.75Å; N139-N163 VanDerWaalsContact CA-OD1 3.27Å; N139-N163 WeakPolarHBondContact CA-OD1 3.33Å; N139-N163 WeakPolarHBondContact CB-OD1 3.43Å; K140-N163 PolarHBondContact N-OD1 3.33Å; I141-N163 HydrophobicContact CB-CB 4.28Å; I141-N163 WeakPolarHBondContact CB-OD1 3.38Å; I141-N163 VanDerWaalsContact CG1-OD1 3.29Å; I141-N163 WeakPolarHBondContact CG1-OD1 3.36Å; I141-N163 PolarHBondContact N-OD1 2.61Å; I141-N163 WeakPolarHBondContact O-CB 3.43Å; G161-N163 PolarHBondContact O-N 3.26Å; G161-N163 VanDerWaalsContact O-N 3.14Å; G161-N163 PolarHBondContact O-ND2 3.22Å; N163-L165 HydrophobicContact CB-CB 4.03Å; N163-L165 PolarHBondContact O-N 3.47Å
164	D	89.7	Confident	93.3	Very high	82 Å²	82	40.5 Å²	40.5	44%	0.439	20%	0.197	S	C	.	.			trans	-75.2	32.7	170.9	-58.4	-40.8	0	0	0	111.2	K140 I141 V142 V166	K140-D164 WeakPolarHBondContact CD-OD2 3.39Å; K140-D164 IonicContact NZ-OD1 2.79Å; K140-D164 IonicContact NZ-OD2 2.68Å; I141-D164 CarbonylContact O-C 3.59Å; I141-D164 VanDerWaalsContact O-C 3.22Å; I141-D164 PolarHBondContact O-N 3.44Å; V142-D164 WeakPolarHBondContact CA-O 3.33Å; V142-D164 HydrophobicContact CG2-CB 4.28Å; D164-V166 WeakPolarHBondContact O-CG2 3.49Å; D164-V166 PolarHBondContact O-N 3.14Å
165	L	90.4	Very high	93.1	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.186	C	C	.	.			trans	-73.5	113.5	-167.3	-174.4	68.2	0	0	0	110.1	I141 V142 L144 V160 N163 Y167 I168 C187 N188 L189	I141-L165 WeakPolarHBondContact O-CA 3.24Å; I141-L165 PolarHBondContact O-N 3.34Å; I141-L165 VanDerWaalsContact O-N 3.09Å; V142-L165 WeakPolarHBondContact O-CA 3.4Å; L144-L165 HydrophobicContact CD1-CD2 4.36Å; L144-L165 HydrophobicContact CD2-CD1 4.5Å; L144-L165 HydrophobicContact CG-CD1 3.88Å; L144-L165 HydrophobicContact CG-CD2 4.37Å; V160-L165 HydrophobicContact CG1-CD2 4.36Å; N163-L165 HydrophobicContact CB-CB 4.03Å; N163-L165 PolarHBondContact O-N 3.47Å; L165-Y167 WeakPolarHBondContact CD1-O 3.35Å; L165-I168 HydrophobicContact CD1-CG1 4.39Å; L165-I168 HydrophobicContact CD2-CD1 3.86Å; L165-I168 HydrophobicContact CD2-CG1 3.82Å; L165-I168 HydrophobicContact CG-CG1 4.3Å; L165-C187 HydrophobicContact CB-CB 4.18Å; L165-C187 HydrophobicContact CD2-CB 4.29Å; L165-N188 CarbonylContact O-C 3.48Å; L165-N188 PolarHBondContact O-N 3.28Å; L165-L189 HydrophobicContact CG-CD2 4.47Å
166	V	91.1	Very high	93	Very high	74 Å²	74	37.9 Å²	37.9	45%	0.448	19%	0.187	S	C	.	.			trans	-104.2	-30.2	179.6	-177.1	0	0	0	0	111.4	V142 D164	V142-V166 HydrophobicContact CG1-CG2 4.41Å; V142-V166 PolarHBondContact O-N 2.93Å; D164-V166 WeakPolarHBondContact O-CG2 3.49Å; D164-V166 PolarHBondContact O-N 3.14Å
167	Y	91.3	Very high	92.9	Very high	112 Å²	112	38.9 Å²	38.9	44%	0.439	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	138.5	-172.9	-176.6	-106.8	0	0	0	112.6	I143 L144 L165	I143-Y167 WeakPolarHBondContact CA-O 3.24Å; I143-Y167 HydrophobicContact CG2-CD1 3.98Å; L144-Y167 PolarHBondContact N-O 3.25Å; L144-Y167 VanDerWaalsContact N-O 3.16Å; L165-Y167 WeakPolarHBondContact CD1-O 3.35Å
168	I	94.8	Very high	92.8	Very high	9 Å²	9	40.1 Å²	40.1	5%	0.046	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	118	172.1	-60.3	176.1	0	0	0	106.8	L144 L165 A172 F173 L184 L189 P193 A196	L144-I168 HydrophobicContact CB-CG1 4.49Å; L144-I168 HydrophobicContact CB-CG2 4.31Å; L144-I168 HydrophobicContact CD1-CD1 4.24Å; L144-I168 HydrophobicContact CD1-CG1 4.04Å; L144-I168 HydrophobicContact CD1-CG2 4.26Å; L144-I168 HydrophobicContact CG-CG1 4.37Å; L165-I168 HydrophobicContact CD1-CG1 4.39Å; L165-I168 HydrophobicContact CD2-CD1 3.86Å; L165-I168 HydrophobicContact CD2-CG1 3.82Å; L165-I168 HydrophobicContact CG-CG1 4.3Å; I168-A172 HydrophobicContact CG2-CB 3.72Å; I168-F173 HydrophobicContact CD1-CZ 4.36Å; I168-F173 HydrophobicContact CG2-CE2 3.92Å; I168-F173 HydrophobicContact CG2-CZ 4.16Å; I168-L184 HydrophobicContact CD1-CD1 4.21Å; I168-L189 HydrophobicContact CD1-CD1 4.03Å; I168-L189 HydrophobicContact CD1-CD2 4.24Å; I168-L189 HydrophobicContact CG1-CD2 4.15Å; I168-P193 HydrophobicContact CB-CB 4.25Å; I168-P193 HydrophobicContact CD1-CB 4.29Å; I168-P193 HydrophobicContact CD1-CG 4.07Å; I168-A196 HydrophobicContact CG2-CB 3.73Å
169	S	95	Very high	92.8	Very high	11 Å²	11	40.1 Å²	40.1	8%	0.077	21%	0.205	C	C	.	.			trans	-67.4	156.7	179	75.1	0	0	0	0	111.8	L144 D146 R171 A172 A196	L144-S169 WeakPolarHBondContact O-CB 3.48Å; L144-S169 PolarHBondContact O-N 3.35Å; L144-S169 PolarHBondContact O-OG 3.09Å; L144-S169 VanDerWaalsContact O-OG 3.13Å; D146-S169 WeakPolarHBondContact CA-OG 3.33Å; D146-S169 PolarHBondContact N-OG 3.18Å; D146-S169 WeakPolarHBondContact OD1-CB 3.27Å; D146-S169 PolarHBondContact OD1-OG 3.15Å; S169-R171 PolarHBondContact O-N 3.13Å; S169-A172 WeakPolarHBondContact O-CB 3.46Å; S169-A172 PolarHBondContact O-N 3.23Å; S169-A172 VanDerWaalsContact O-N 3.15Å; S169-A172 PolarHBondContact OG-N 3.21Å; S169-A196 WeakPolarHBondContact O-CB 3.49Å
170	H	95.9	Very high	92.9	Very high	106 Å²	106	41.2 Å²	41.2	49%	0.491	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-26	-172.3	-61.3	-32.1	0	0	0	114.2	E195 A196 H199	H170-E195 HydrophobicContact CB-CB 4.37Å; H170-A196 WeakPolarHBondContact O-CA 3.44Å; H170-H199 PolarHBondContact O-CE1 2.78Å; H170-H199 PolarHBondContact O-ND1 2.99Å
171	R	96.7	Very high	93.1	Very high	125 Å²	125	44.8 Å²	44.8	47%	0.472	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.3	18.3	178.6	-53.5	-176.9	-179.6	174.4	1.5	112.4	D146 Y147 S169 F173 S174	D146-R171 HydrophobicContact CB-CB 4.07Å; D146-R171 WeakPolarHBondContact OD1-CA 3.32Å; D146-R171 WeakPolarHBondContact OD1-CB 3.26Å; D146-R171 PolarHBondContact OD1-N 2.98Å; Y147-R171 HydrophobicContact CE1-CB 4.29Å; Y147-R171 PolarHBondContact N-O 3.34Å; Y147-R171 WeakPolarHBondContact OH-CD 3.32Å; Y147-R171 PolarHBondContact OH-NH1 3.12Å; S169-R171 PolarHBondContact O-N 3.13Å; R171-F173 VanDerWaalsContact C-N 3.27Å; R171-F173 PolarHBondContact O-N 2.91Å; R171-S174 WeakPolarHBondContact O-CB 3.42Å; R171-S174 PolarHBondContact O-N 2.84Å
172	A	95.8	Very high	93.8	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-42.4	179.9	0	0	0	0	0	112.9	L144 L145 I168 S169 S174	L144-A172 HydrophobicContact CB-CB 3.88Å; L145-A172 WeakPolarHBondContact O-CA 3.25Å; I168-A172 HydrophobicContact CG2-CB 3.72Å; S169-A172 WeakPolarHBondContact O-CB 3.46Å; S169-A172 PolarHBondContact O-N 3.23Å; S169-A172 VanDerWaalsContact O-N 3.15Å; S169-A172 PolarHBondContact OG-N 3.21Å; A172-S174 VanDerWaalsContact C-N 3.35Å
173	F	96.7	Very high	94.6	Very high	1 Å²	1	42.8 Å²	42.8	0%	0.004	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	9.7	179.7	-57.1	-51.6	0	0	0	113.9	L144 F149 L158 I168 R171 G175 L176 L182 L184 A196 L197 L200	L144-F173 HydrophobicContact CD1-CE1 3.93Å; L144-F173 HydrophobicContact CD1-CZ 3.95Å; F149-F173 HydrophobicContact CD2-CD1 4.2Å; F149-F173 HydrophobicContact CE2-CD1 4.31Å; F149-F173 HydrophobicContact CE2-CE1 4.24Å; L158-F173 HydrophobicContact CD2-CD1 4.33Å; L158-F173 HydrophobicContact CD2-CE1 4.16Å; I168-F173 HydrophobicContact CD1-CZ 4.36Å; I168-F173 HydrophobicContact CG2-CE2 3.92Å; I168-F173 HydrophobicContact CG2-CZ 4.16Å; R171-F173 VanDerWaalsContact C-N 3.27Å; R171-F173 PolarHBondContact O-N 2.91Å; F173-G175 PolarHBondContact O-N 3.41Å; F173-L176 HydrophobicContact CB-CD1 4.18Å; F173-L176 HydrophobicContact CD1-CD1 3.96Å; F173-L176 PolarHBondContact O-N 2.74Å; F173-L182 HydrophobicContact CE2-CD2 4.31Å; F173-L182 HydrophobicContact CZ-CD2 4.28Å; F173-L184 HydrophobicContact CZ-CD2 4.33Å; F173-A196 HydrophobicContact CD2-CB 3.89Å; F173-A196 HydrophobicContact CE2-CB 4.14Å; F173-L197 HydrophobicContact CE2-CD2 4.34Å; F173-L200 HydrophobicContact CB-CD1 4.3Å; F173-L200 HydrophobicContact CB-CD2 3.78Å; F173-L200 HydrophobicContact CB-CG 3.98Å; F173-L200 HydrophobicContact CD2-CD1 4.12Å; F173-L200 HydrophobicContact CG-CD1 4.21Å; F173-L200 HydrophobicContact CG-CD2 4.44Å; F173-L200 HydrophobicContact CG-CG 4.43Å
174	S	95.9	Very high	95.2	Very high	31 Å²	31	42.5 Å²	42.5	22%	0.217	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	128.9	177.6	-175.5	0	0	0	0	110.5	R171 A172	R171-S174 WeakPolarHBondContact O-CB 3.42Å; R171-S174 PolarHBondContact O-N 2.84Å; A172-S174 VanDerWaalsContact C-N 3.35Å
175	G	93.3	Very high	95.4	Very high	16 Å²	16	41.1 Å²	41.1	17%	0.165	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	105.2	-15.7	-178.5	0	0	0	0	0	114.4	H153 F173 L177	H153-G175 PolarHBondContact ND1-O 3.17Å; F173-G175 PolarHBondContact O-N 3.41Å; G175-L177 PolarHBondContact O-N 3.13Å
176	L	96.3	Very high	95.4	Very high	3 Å²	3	45.2 Å²	45.2	2%	0.016	22%	0.223	C	C	.	.			trans	-77.3	66.6	174.4	-66.5	178.9	0	0	0	111.8	F149 L152 L155 L158 F173 S178 L179 L200	F149-L176 HydrophobicContact CB-CD1 3.93Å; F149-L176 HydrophobicContact CB-CD2 3.7Å; F149-L176 HydrophobicContact CB-CG 3.82Å; F149-L176 HydrophobicContact CD2-CD1 4.2Å; F149-L176 HydrophobicContact CG-CD1 4.27Å; L152-L176 HydrophobicContact CB-CD2 3.94Å; L152-L176 WeakPolarHBondContact O-CD2 3.37Å; L155-L176 HydrophobicContact CB-CD2 4.03Å; L155-L176 HydrophobicContact CD2-CD2 3.78Å; L158-L176 HydrophobicContact CD2-CD1 3.86Å; F173-L176 HydrophobicContact CB-CD1 4.18Å; F173-L176 HydrophobicContact CD1-CD1 3.96Å; F173-L176 PolarHBondContact O-N 2.74Å; L176-S178 PolarHBondContact O-N 3.43Å; L176-L179 HydrophobicContact CB-CB 4.14Å; L176-L179 HydrophobicContact CD1-CD2 4.12Å; L176-L200 HydrophobicContact CB-CD2 3.84Å; L176-L200 HydrophobicContact CD1-CD2 4.24Å
177	L	94.1	Very high	95.3	Very high	116 Å²	116	41.9 Å²	41.9	61%	0.607	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71	-28.4	-171.9	-59.8	178.8	0	0	0	113.8	G175 S202	G175-L177 PolarHBondContact O-N 3.13Å; L177-S202 WeakPolarHBondContact O-CB 3.23Å; L177-S202 PolarHBondContact O-OG 3.43Å
178	S	96.7	Very high	95.2	Very high	41 Å²	41	41 Å²	41	29%	0.287	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.2	10.6	-176	-50.1	0	0	0	0	113.9	H153 L155 L176 E180	H153-S178 VanDerWaalsContact O-CB 3.22Å; H153-S178 WeakPolarHBondContact O-CB 3.37Å; H153-S178 PolarHBondContact O-N 3.47Å; H153-S178 PolarHBondContact O-OG 2.87Å; L155-S178 CarbonylContact O-C 3.15Å; L176-S178 PolarHBondContact O-N 3.43Å; S178-E180 PolarHBondContact O-N 2.91Å
179	L	98	Very high	94.9	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.205	C	C	.	.			trans	-70.1	118.5	-174.5	-161.6	78.6	0	0	0	110.7	L155 L158 L176 L182 L200 S202 L203	L155-L179 HydrophobicContact CB-CD1 4.33Å; L155-L179 HydrophobicContact CD2-CD1 3.98Å; L155-L179 HydrophobicContact CG-CD1 4.04Å; L155-L179 WeakPolarHBondContact O-CA 3.39Å; L155-L179 PolarHBondContact O-N 2.87Å; L155-L179 VanDerWaalsContact O-N 3.1Å; L158-L179 HydrophobicContact CB-CD1 3.72Å; L158-L179 HydrophobicContact CB-CD2 4.27Å; L176-L179 HydrophobicContact CB-CB 4.14Å; L176-L179 HydrophobicContact CD1-CD2 4.12Å; L179-L182 HydrophobicContact CD2-CB 4.13Å; L179-L182 HydrophobicContact CD2-CD1 4.5Å; L179-L200 HydrophobicContact CB-CD2 4.18Å; L179-L200 HydrophobicContact CD2-CD1 4.14Å; L179-L200 HydrophobicContact CD2-CD2 3.63Å; L179-L200 HydrophobicContact CD2-CG 4.49Å; L179-S202 CarbonylContact O-C 3.53Å; L179-L203 HydrophobicContact CD2-CD1 4.14Å; L179-L203 HydrophobicContact CG-CD1 4.33Å; L179-L203 VanDerWaalsContact O-CA 3.29Å; L179-L203 WeakPolarHBondContact O-CA 3.47Å; L179-L203 PolarHBondContact O-N 3.41Å
180	E	98.2	Very high	94.5	Very high	72 Å²	72	46 Å²	46	34%	0.336	24%	0.236	S	C	.	.			trans	-99.8	-33.9	-178.6	-67.3	173.6	-158.8	0	0	111	K156 S178 I204 S205	K156-E180 IonicContact NZ-OE1 2.96Å; K156-E180 PolarHBondContact NZ-OE1 3.42Å; K156-E180 PolarHBondContact O-N 3.2Å; S178-E180 PolarHBondContact O-N 2.91Å; E180-I204 HydrophobicContact CB-CD1 4.1Å; E180-I204 HydrophobicContact CB-CG1 4.32Å; E180-I204 HydrophobicContact CG-CD1 3.93Å; E180-I204 HydrophobicContact CG-CG1 4.46Å; E180-I204 WeakPolarHBondContact O-CA 3.41Å; E180-I204 PolarHBondContact O-N 3.11Å; E180-S205 PolarHBondContact O-N 2.79Å
181	Q	98.4	Very high	94.3	Very high	76 Å²	76	43.1 Å²	43.1	36%	0.355	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	129.3	-176.9	-174.5	175.5	4	0	0	111.8	K156 S157 L158 S205 H207	K156-Q181 PolarHBondContact O-N 3.21Å; S157-Q181 WeakPolarHBondContact CA-O 3.47Å; L158-Q181 PolarHBondContact N-O 2.87Å; Q181-S205 WeakPolarHBondContact CA-O 3.45Å; Q181-H207 PolarHBondContact NE2-NE2 2.9Å; Q181-H207 VanDerWaalsContact NE2-NE2 3.18Å
182	L	98.2	Very high	94.2	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	128.6	172.9	176.7	64.5	0	0	0	109.9	L158 F173 L179 L184 L197 L200 L203 S205 L206 H207	L158-L182 HydrophobicContact CB-CD1 4.16Å; L158-L182 HydrophobicContact CD2-CD1 4.07Å; L158-L182 HydrophobicContact CG-CD1 4.1Å; F173-L182 HydrophobicContact CE2-CD2 4.31Å; F173-L182 HydrophobicContact CZ-CD2 4.28Å; L179-L182 HydrophobicContact CD2-CB 4.13Å; L179-L182 HydrophobicContact CD2-CD1 4.5Å; L182-L184 HydrophobicContact CD1-CD2 4.09Å; L182-L184 HydrophobicContact CD1-CG 4.45Å; L182-L184 HydrophobicContact CD2-CD1 4.37Å; L182-L184 HydrophobicContact CD2-CD2 4.47Å; L182-L184 HydrophobicContact CD2-CG 4.22Å; L182-L184 HydrophobicContact CG-CD2 4.37Å; L182-L184 HydrophobicContact CG-CG 4.19Å; L182-L197 HydrophobicContact CD2-CD2 3.58Å; L182-L200 HydrophobicContact CD2-CD1 3.58Å; L182-L203 HydrophobicContact CB-CD1 3.8Å; L182-L203 HydrophobicContact CB-CD2 4.41Å; L182-S205 PolarHBondContact N-O 3.32Å; L182-L206 HydrophobicContact CB-CD1 4.11Å; L182-L206 HydrophobicContact CD2-CD1 3.97Å; L182-L206 HydrophobicContact CG-CD1 4.14Å; L182-H207 PolarHBondContact O-N 2.63Å
183	T	97.4	Very high	94.1	Very high	17 Å²	17	38.5 Å²	38.5	10%	0.104	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	121.7	169.5	-59	0	0	0	0	109.4	L158 V160 E185 H207	L158-T183 PolarHBondContact O-N 3.3Å; V160-T183 PolarHBondContact N-O 3.37Å; T183-E185 HydrophobicContact CG2-CB 4.32Å; T183-H207 WeakPolarHBondContact CA-O 3.24Å; T183-H207 HydrophobicContact CG2-CB 4.15Å
184	L	95.3	Very high	94	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	111.9	168.3	-61.2	-178.4	0	0	0	108.6	V160 I168 F173 L182 P193 H207 L208 K209	V160-L184 HydrophobicContact CB-CD2 3.97Å; V160-L184 VanDerWaalsContact O-CA 3.24Å; V160-L184 WeakPolarHBondContact O-CA 3.26Å; I168-L184 HydrophobicContact CD1-CD1 4.21Å; F173-L184 HydrophobicContact CZ-CD2 4.33Å; L182-L184 HydrophobicContact CD1-CD2 4.09Å; L182-L184 HydrophobicContact CD1-CG 4.45Å; L182-L184 HydrophobicContact CD2-CD1 4.37Å; L182-L184 HydrophobicContact CD2-CD2 4.47Å; L182-L184 HydrophobicContact CD2-CG 4.22Å; L182-L184 HydrophobicContact CG-CD2 4.37Å; L182-L184 HydrophobicContact CG-CG 4.19Å; L184-P193 HydrophobicContact CD1-CG 4.18Å; L184-H207 PolarHBondContact N-O 3.1Å; L184-L208 HydrophobicContact CB-CD2 3.89Å; L184-L208 HydrophobicContact CD1-CD2 3.91Å; L184-L208 HydrophobicContact CG-CD2 4.2Å; L184-L208 CarbonylContact O-C 3.37Å; L184-L208 WeakPolarHBondContact O-CA 3.46Å; L184-K209 PolarHBondContact O-N 3.04Å
185	E	93.3	Very high	94	Very high	54 Å²	54	41.7 Å²	41.7	25%	0.252	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	144.2	-175	176.8	166.5	-178.7	0	0	113.1	V160 G161 D162 T183 C187 K209 H210	V160-E185 PolarHBondContact O-N 3.39Å; V160-E185 VanDerWaalsContact O-N 3.13Å; G161-E185 CarbonylContact C-O 3.45Å; G161-E185 VanDerWaalsContact C-O 3.3Å; G161-E185 WeakPolarHBondContact CA-O 3.25Å; D162-E185 PolarHBondContact N-O 3.38Å; T183-E185 HydrophobicContact CG2-CB 4.32Å; E185-C187 PolarHBondContact O-N 3.11Å; E185-C187 PolarHBondContact O-SG 3.13Å; E185-K209 CarbonylContact C-O 3.58Å; E185-K209 WeakPolarHBondContact CA-O 3.2Å; E185-K209 HydrophobicContact CB-CB 4.09Å; E185-K209 HydrophobicContact CG-CB 3.93Å; E185-H210 HydrophobicContact CG-CB 4.37Å; E185-H210 IonicContact OE1-CE1 3.92Å; E185-H210 PolarHBondContact OE1-CE1 3.43Å; E185-H210 IonicContact OE1-CG 3.4Å; E185-H210 IonicContact OE1-ND1 3.92Å; E185-H210 PolarHBondContact OE1-ND1 2.97Å
186	K	90.8	Very high	94.2	Very high	86 Å²	86	41 Å²	41	37%	0.374	22%	0.223	S	C	.	.	S	Bend	trans	50	40.8	170.9	-67.8	175.8	-164.5	177.1	0	113.5	D162 K209 H210	D162-K186 HydrophobicContact CB-CB 4.07Å; D162-K186 HydrophobicContact CB-CD 3.8Å; D162-K186 VanDerWaalsContact CG-CD 3.41Å; D162-K186 WeakPolarHBondContact OD2-CD 3.33Å; D162-K186 IonicContact OD2-NZ 3.04Å; D162-K186 PolarHBondContact OD2-NZ 3.31Å; K186-K209 PolarHBondContact N-O 2.99Å; K186-H210 WeakPolarHBondContact CA-O 3.5Å; K186-H210 HydrophobicContact CB-CB 4.3Å; K186-H210 HydrophobicContact CG-CB 3.49Å; K186-H210 VanDerWaalsContact CG-CB 3.49Å; K186-H210 PolarHBondContact N-O 2.96Å
187	C	89	Confident	94.2	Very high	3 Å²	3	40.9 Å²	40.9	2%	0.02	22%	0.222	C	C	.	.			trans	-99.8	145	176.4	-59.6	0	0	0	0	109.6	L165 E185 L189 L211	L165-C187 HydrophobicContact CB-CB 4.18Å; L165-C187 HydrophobicContact CD2-CB 4.29Å; E185-C187 PolarHBondContact O-N 3.11Å; E185-C187 PolarHBondContact O-SG 3.13Å; C187-L189 HydrophobicContact CB-CD1 4.03Å; C187-L189 HydrophobicContact CB-CG 3.74Å; C187-L189 PolarHBondContact O-N 3.5Å; C187-L211 HydrophobicContact CB-CD2 3.8Å
188	N	89.5	Confident	94.3	Very high	93 Å²	93	35.5 Å²	35.5	50%	0.497	19%	0.194	S	C	.	.			trans	-87.7	49.5	177.2	-162	27.1	0	0	0	111.3	L165	L165-N188 CarbonylContact O-C 3.48Å; L165-N188 PolarHBondContact O-N 3.28Å
189	L	89	Confident	94.3	Very high	7 Å²	7	36.7 Å²	36.7	4%	0.037	20%	0.195	C	C	.	.			trans	-78.9	133.5	179.4	-61	174.9	0	0	0	109.8	L165 I168 C187 I213	L165-L189 HydrophobicContact CG-CD2 4.47Å; I168-L189 HydrophobicContact CD1-CD1 4.03Å; I168-L189 HydrophobicContact CD1-CD2 4.24Å; I168-L189 HydrophobicContact CG1-CD2 4.15Å; C187-L189 HydrophobicContact CB-CD1 4.03Å; C187-L189 HydrophobicContact CB-CG 3.74Å; C187-L189 PolarHBondContact O-N 3.5Å; L189-I213 WeakPolarHBondContact O-CG1 3.18Å
190	T	86.4	Confident	94.3	Very high	118 Å²	118	36.7 Å²	36.7	72%	0.724	20%	0.195	S	C	*	.	S	Bend	trans	-79.4	-22.2	176.5	57.1	0	0	0	0	113
191	A	91.1	Very high	94.1	Very high	47 Å²	47	40.9 Å²	40.9	39%	0.388	21%	0.208	S	C	.	.	S	Bend	trans	-152.9	162	-178.3	0	0	0	0	0	110.8
192	V	94.1	Very high	93.9	Very high	9 Å²	9	39.5 Å²	39.5	6%	0.055	21%	0.207	C	C	.	.			trans	-62.7	129.9	172.4	179.9	0	0	0	0	109.4	T194 L197 I213 M216 P217 F221 W235	V192-T194 PolarHBondContact O-N 2.77Å; V192-T194 PolarHBondContact O-OG1 2.89Å; V192-L197 HydrophobicContact CG1-CD1 3.96Å; V192-I213 HydrophobicContact CG2-CD1 3.92Å; V192-M216 HydrophobicContact CG2-CE 4.09Å; V192-M216 HydrophobicContact CG2-SD 3.58Å; V192-M216 VanDerWaalsContact CG2-SD 3.58Å; V192-P217 HydrophobicContact CB-CG 4.5Å; V192-F221 HydrophobicContact CG1-CE1 4.14Å; V192-W235 HydrophobicContact CG2-CH2 3.71Å; V192-W235 HydrophobicContact CG2-CZ3 4.26Å
193	P	94.5	Very high	93.9	Very high	19 Å²	19	39.5 Å²	39.5	12%	0.123	21%	0.207	C	C	.	.			trans	-78	63.2	-177.1	32.8	-37.2	0	0	0	111.8	I168 L184 E195 A196 L197	I168-P193 HydrophobicContact CB-CB 4.25Å; I168-P193 HydrophobicContact CD1-CB 4.29Å; I168-P193 HydrophobicContact CD1-CG 4.07Å; L184-P193 HydrophobicContact CD1-CG 4.18Å; P193-E195 PolarHBondContact O-N 2.54Å; P193-A196 HydrophobicContact CB-CB 4.26Å; P193-A196 PolarHBondContact O-N 2.82Å; P193-L197 HydrophobicContact CG-CD1 4.06Å; P193-L197 HydrophobicContact CG-CG 4.1Å; P193-L197 WeakPolarHBondContact O-CG 3.18Å; P193-L197 PolarHBondContact O-N 3.43Å
194	T	95.6	Very high	94	Very high	20 Å²	20	41.8 Å²	41.8	12%	0.123	22%	0.217	C	C	.	.	H	α-helix	trans	-52.3	-48.2	-171.7	-60.5	0	0	0	0	113.8	V192 S198 A220 K222	V192-T194 PolarHBondContact O-N 2.77Å; V192-T194 PolarHBondContact O-OG1 2.89Å; T194-S198 PolarHBondContact O-N 3.42Å; T194-A220 VanDerWaalsContact CB-O 3.31Å; T194-A220 WeakPolarHBondContact CB-O 3.47Å; T194-A220 WeakPolarHBondContact CG2-O 3.4Å; T194-A220 PolarHBondContact OG1-O 2.99Å; T194-K222 HydrophobicContact CG2-CB 4.38Å; T194-K222 HydrophobicContact CG2-CD 3.79Å; T194-K222 HydrophobicContact CG2-CG 3.77Å
195	E	95.6	Very high	94.1	Very high	79 Å²	79	42.6 Å²	42.6	37%	0.369	22%	0.223	S	C	.	.	H	α-helix	trans	-69.1	-39.2	-177.2	-64.3	-57.3	135.7	0	0	111.9	H170 P193 S198 H199 K222	H170-E195 HydrophobicContact CB-CB 4.37Å; P193-E195 PolarHBondContact O-N 2.54Å; E195-S198 WeakPolarHBondContact O-CB 3.47Å; E195-S198 PolarHBondContact O-N 3.39Å; E195-S198 PolarHBondContact O-OG 2.97Å; E195-H199 PolarHBondContact O-CE1 2.8Å; E195-H199 PolarHBondContact O-ND1 3.29Å; E195-K222 IonicContact OE1-NZ 3.85Å; E195-K222 PolarHBondContact OE1-NZ 3.24Å
196	A	96.6	Very high	94.4	Very high	1 Å²	1	40 Å²	40	1%	0.008	21%	0.211	C	C	.	.	H	α-helix	trans	-64.9	-47.1	176.4	0	0	0	0	0	111.3	I168 S169 H170 F173 P193 S198 H199	I168-A196 HydrophobicContact CG2-CB 3.73Å; S169-A196 WeakPolarHBondContact O-CB 3.49Å; H170-A196 WeakPolarHBondContact O-CA 3.44Å; F173-A196 HydrophobicContact CD2-CB 3.89Å; F173-A196 HydrophobicContact CE2-CB 4.14Å; P193-A196 HydrophobicContact CB-CB 4.26Å; P193-A196 PolarHBondContact O-N 2.82Å; A196-S198 PolarHBondContact O-N 3.37Å; A196-H199 PolarHBondContact O-N 3.44Å
197	L	96.9	Very high	94.7	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-60.9	-30.8	177.1	-68.2	172.2	0	0	0	112.2	F173 L182 V192 P193 H199 L200 L206 F221 L224	F173-L197 HydrophobicContact CE2-CD2 4.34Å; L182-L197 HydrophobicContact CD2-CD2 3.58Å; V192-L197 HydrophobicContact CG1-CD1 3.96Å; P193-L197 HydrophobicContact CG-CD1 4.06Å; P193-L197 HydrophobicContact CG-CG 4.1Å; P193-L197 WeakPolarHBondContact O-CG 3.18Å; P193-L197 PolarHBondContact O-N 3.43Å; L197-H199 PolarHBondContact O-N 3.31Å; L197-L200 HydrophobicContact CD2-CD1 4.06Å; L197-L200 WeakPolarHBondContact O-CB 3.49Å; L197-L200 PolarHBondContact O-N 2.81Å; L197-L206 HydrophobicContact CD1-CD2 4.24Å; L197-L206 HydrophobicContact CD2-CD1 4.24Å; L197-F221 HydrophobicContact CD1-CD1 4.43Å; L197-F221 HydrophobicContact CD1-CE1 4.38Å; L197-L224 VanDerWaalsContact O-CD2 3.31Å; L197-L224 WeakPolarHBondContact O-CD2 3.18Å
198	S	96.6	Very high	95.1	Very high	4 Å²	4	37 Å²	37	3%	0.028	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-13.2	-178.6	82	0	0	0	0	115.3	T194 E195 A196 K222	T194-S198 PolarHBondContact O-N 3.42Å; E195-S198 WeakPolarHBondContact O-CB 3.47Å; E195-S198 PolarHBondContact O-N 3.39Å; E195-S198 PolarHBondContact O-OG 2.97Å; A196-S198 PolarHBondContact O-N 3.37Å; S198-K222 VanDerWaalsContact CA-O 3.31Å; S198-K222 WeakPolarHBondContact CA-O 3.27Å; S198-K222 WeakPolarHBondContact CB-O 3.28Å
199	H	96.4	Very high	95.3	Very high	65 Å²	65	34.8 Å²	34.8	30%	0.301	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-18.8	175.7	-66	67.4	0	0	0	112.3	H170 E195 A196 L197 R201	H170-H199 PolarHBondContact O-CE1 2.78Å; H170-H199 PolarHBondContact O-ND1 2.99Å; E195-H199 PolarHBondContact O-CE1 2.8Å; E195-H199 PolarHBondContact O-ND1 3.29Å; A196-H199 PolarHBondContact O-N 3.44Å; L197-H199 PolarHBondContact O-N 3.31Å; H199-R201 PolarHBondContact O-N 2.8Å; H199-R201 VanDerWaalsContact O-N 3.09Å
200	L	96.6	Very high	95.6	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.005	20%	0.196	C	C	.	.			trans	-86.5	70.6	-176.2	-61.5	173.6	0	0	0	111.8	F173 L176 L179 L182 L197 S202 L203 L224	F173-L200 HydrophobicContact CB-CD1 4.3Å; F173-L200 HydrophobicContact CB-CD2 3.78Å; F173-L200 HydrophobicContact CB-CG 3.98Å; F173-L200 HydrophobicContact CD2-CD1 4.12Å; F173-L200 HydrophobicContact CG-CD1 4.21Å; F173-L200 HydrophobicContact CG-CD2 4.44Å; F173-L200 HydrophobicContact CG-CG 4.43Å; L176-L200 HydrophobicContact CB-CD2 3.84Å; L176-L200 HydrophobicContact CD1-CD2 4.24Å; L179-L200 HydrophobicContact CB-CD2 4.18Å; L179-L200 HydrophobicContact CD2-CD1 4.14Å; L179-L200 HydrophobicContact CD2-CD2 3.63Å; L179-L200 HydrophobicContact CD2-CG 4.49Å; L182-L200 HydrophobicContact CD2-CD1 3.58Å; L197-L200 HydrophobicContact CD2-CD1 4.06Å; L197-L200 WeakPolarHBondContact O-CB 3.49Å; L197-L200 PolarHBondContact O-N 2.81Å; L200-S202 VanDerWaalsContact C-N 3.31Å; L200-S202 PolarHBondContact O-N 2.79Å; L200-L203 HydrophobicContact CB-CB 4.09Å; L200-L203 HydrophobicContact CB-CD2 4.37Å; L200-L203 HydrophobicContact CD1-CD1 4.5Å; L200-L203 HydrophobicContact CD1-CD2 4.21Å; L200-L203 WeakPolarHBondContact O-CB 3.09Å; L200-L203 PolarHBondContact O-N 2.65Å; L200-L224 HydrophobicContact CB-CD2 4.24Å; L200-L224 VanDerWaalsContact O-CD2 3.22Å; L200-L224 WeakPolarHBondContact O-CD2 3.24Å
201	R	93.9	Very high	95.9	Very high	159 Å²	159	31.8 Å²	31.8	60%	0.6	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-28.7	-172.4	-61.1	-177.7	-172.7	-178.2	3.7	114	H199 H226	H199-R201 PolarHBondContact O-N 2.8Å; H199-R201 VanDerWaalsContact O-N 3.09Å; R201-H226 PolarHBondContact O-CD2 3.02Å; R201-H226 VanDerWaalsContact O-CD2 3.27Å
202	S	96.3	Very high	95.8	Very high	47 Å²	47	33.4 Å²	33.4	33%	0.329	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	3.1	-177.1	-53.4	0	0	0	0	113.6	L177 L179 L200 I204	L177-S202 WeakPolarHBondContact O-CB 3.23Å; L177-S202 PolarHBondContact O-OG 3.43Å; L179-S202 CarbonylContact O-C 3.53Å; L200-S202 VanDerWaalsContact C-N 3.31Å; L200-S202 PolarHBondContact O-N 2.79Å; S202-I204 WeakPolarHBondContact O-CG1 3.47Å; S202-I204 PolarHBondContact O-N 3.31Å
203	L	98.1	Very high	95.7	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.161	C	C	.	.			trans	-65.2	128.8	-173.4	-161.3	70.3	0	0	0	111.3	L179 L182 L200 L206 L224 H226 L227	L179-L203 HydrophobicContact CD2-CD1 4.14Å; L179-L203 HydrophobicContact CG-CD1 4.33Å; L179-L203 VanDerWaalsContact O-CA 3.29Å; L179-L203 WeakPolarHBondContact O-CA 3.47Å; L179-L203 PolarHBondContact O-N 3.41Å; L182-L203 HydrophobicContact CB-CD1 3.8Å; L182-L203 HydrophobicContact CB-CD2 4.41Å; L200-L203 HydrophobicContact CB-CB 4.09Å; L200-L203 HydrophobicContact CB-CD2 4.37Å; L200-L203 HydrophobicContact CD1-CD1 4.5Å; L200-L203 HydrophobicContact CD1-CD2 4.21Å; L200-L203 WeakPolarHBondContact O-CB 3.09Å; L200-L203 PolarHBondContact O-N 2.65Å; L203-L206 HydrophobicContact CD2-CB 4Å; L203-L206 HydrophobicContact CD2-CD1 4.17Å; L203-L206 HydrophobicContact CD2-CG 4.46Å; L203-L224 HydrophobicContact CB-CD2 4.33Å; L203-L224 HydrophobicContact CD2-CD2 4.28Å; L203-H226 CarbonylContact O-C 3.1Å; L203-L227 HydrophobicContact CB-CD1 4.36Å; L203-L227 HydrophobicContact CD2-CD1 4Å; L203-L227 HydrophobicContact CG-CD1 3.97Å; L203-L227 VanDerWaalsContact O-CA 3.23Å; L203-L227 WeakPolarHBondContact O-CA 3.26Å; L203-L227 PolarHBondContact O-N 3.41Å; L203-L227 VanDerWaalsContact O-N 3.08Å
204	I	98.3	Very high	95.4	Very high	65 Å²	65	36.6 Å²	36.6	33%	0.333	18%	0.179	S	C	.	.			trans	-107.2	-40.6	-178.6	-55.7	178.3	0	0	0	110.3	E180 S202 K228 H229	E180-I204 HydrophobicContact CB-CD1 4.1Å; E180-I204 HydrophobicContact CB-CG1 4.32Å; E180-I204 HydrophobicContact CG-CD1 3.93Å; E180-I204 HydrophobicContact CG-CG1 4.46Å; E180-I204 WeakPolarHBondContact O-CA 3.41Å; E180-I204 PolarHBondContact O-N 3.11Å; S202-I204 WeakPolarHBondContact O-CG1 3.47Å; S202-I204 PolarHBondContact O-N 3.31Å; I204-K228 HydrophobicContact CG2-CB 4.19Å; I204-K228 HydrophobicContact CG2-CG 4.32Å; I204-K228 PolarHBondContact O-N 2.91Å; I204-H229 PolarHBondContact O-N 3.03Å
205	S	98.5	Very high	94.8	Very high	17 Å²	17	40.3 Å²	40.3	12%	0.119	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	127	-179	-163.5	0	0	0	0	111.7	E180 Q181 L182 H207 H229	E180-S205 PolarHBondContact O-N 2.79Å; Q181-S205 WeakPolarHBondContact CA-O 3.45Å; L182-S205 PolarHBondContact N-O 3.32Å; S205-H207 PolarHBondContact OG-CE1 2.91Å; S205-H207 PolarHBondContact OG-NE2 2.99Å; S205-H229 WeakPolarHBondContact CA-O 3.49Å
206	L	98.4	Very high	94.6	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	121	176.7	179	59.5	0	0	0	109.7	L182 L197 L203 L208 F221 L224 L227 H229 L230 E231	L182-L206 HydrophobicContact CB-CD1 4.11Å; L182-L206 HydrophobicContact CD2-CD1 3.97Å; L182-L206 HydrophobicContact CG-CD1 4.14Å; L197-L206 HydrophobicContact CD1-CD2 4.24Å; L197-L206 HydrophobicContact CD2-CD1 4.24Å; L203-L206 HydrophobicContact CD2-CB 4Å; L203-L206 HydrophobicContact CD2-CD1 4.17Å; L203-L206 HydrophobicContact CD2-CG 4.46Å; L206-L208 HydrophobicContact CD1-CD2 3.83Å; L206-L208 HydrophobicContact CD1-CG 4.35Å; L206-L208 HydrophobicContact CD2-CD1 4.41Å; L206-L208 HydrophobicContact CD2-CD2 4.46Å; L206-L208 HydrophobicContact CD2-CG 4.42Å; L206-L208 HydrophobicContact CG-CD2 4.12Å; L206-L208 HydrophobicContact CG-CG 4.1Å; L206-F221 HydrophobicContact CD2-CD1 4.05Å; L206-F221 HydrophobicContact CD2-CE1 3.61Å; L206-L224 HydrophobicContact CD2-CD1 4.35Å; L206-L227 HydrophobicContact CB-CD1 3.77Å; L206-L227 HydrophobicContact CB-CD2 4.3Å; L206-H229 PolarHBondContact N-O 3.38Å; L206-L230 HydrophobicContact CB-CD1 4.17Å; L206-L230 HydrophobicContact CD2-CD1 4.03Å; L206-L230 HydrophobicContact CG-CD1 4.13Å; L206-E231 PolarHBondContact O-N 3.19Å
207	H	97.9	Very high	94.4	Very high	26 Å²	26	38.6 Å²	38.6	12%	0.12	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	119.5	177.4	-49.8	-84.4	0	0	0	109.4	Q181 L182 T183 L184 S205 K209 E231	Q181-H207 PolarHBondContact NE2-NE2 2.9Å; Q181-H207 VanDerWaalsContact NE2-NE2 3.18Å; L182-H207 PolarHBondContact O-N 2.63Å; T183-H207 WeakPolarHBondContact CA-O 3.24Å; T183-H207 HydrophobicContact CG2-CB 4.15Å; L184-H207 PolarHBondContact N-O 3.1Å; S205-H207 PolarHBondContact OG-CE1 2.91Å; S205-H207 PolarHBondContact OG-NE2 2.99Å; H207-K209 HydrophobicContact CB-CG 4.44Å; H207-E231 IonicContact CE1-OE2 3.2Å; H207-E231 IonicContact CG-OE2 2.77Å; H207-E231 IonicContact ND1-OE2 3.25Å; H207-E231 PolarHBondContact ND1-OE2 2.82Å
208	L	96.3	Very high	94.2	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.005	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	95.6	177.1	-54.9	178.2	0	0	0	108.9	L184 L206 L211 F221 E231 D233 W235	L184-L208 HydrophobicContact CB-CD2 3.89Å; L184-L208 HydrophobicContact CD1-CD2 3.91Å; L184-L208 HydrophobicContact CG-CD2 4.2Å; L184-L208 CarbonylContact O-C 3.37Å; L184-L208 WeakPolarHBondContact O-CA 3.46Å; L206-L208 HydrophobicContact CD1-CD2 3.83Å; L206-L208 HydrophobicContact CD1-CG 4.35Å; L206-L208 HydrophobicContact CD2-CD1 4.41Å; L206-L208 HydrophobicContact CD2-CD2 4.46Å; L206-L208 HydrophobicContact CD2-CG 4.42Å; L206-L208 HydrophobicContact CG-CD2 4.12Å; L206-L208 HydrophobicContact CG-CG 4.1Å; L208-L211 HydrophobicContact CB-CD1 4Å; L208-F221 HydrophobicContact CD1-CE1 4.13Å; L208-F221 HydrophobicContact CD1-CZ 4.12Å; L208-E231 PolarHBondContact N-O 2.81Å; L208-D233 PolarHBondContact O-N 3.07Å; L208-W235 HydrophobicContact CB-CZ2 3.61Å; L208-W235 HydrophobicContact CD1-CH2 4.06Å; L208-W235 HydrophobicContact CD1-CZ2 3.75Å; L208-W235 HydrophobicContact CG-CZ2 4.33Å; L208-W235 PolarHBondContact O-NE1 3.1Å
209	K	95.2	Very high	94.1	Very high	46 Å²	46	47 Å²	47	20%	0.2	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	144.7	-169.8	-52.4	-167.2	-174.2	-146.4	0	111.8	L184 E185 K186 H207 L211 E231 D233	L184-K209 PolarHBondContact O-N 3.04Å; E185-K209 CarbonylContact C-O 3.58Å; E185-K209 WeakPolarHBondContact CA-O 3.2Å; E185-K209 HydrophobicContact CB-CB 4.09Å; E185-K209 HydrophobicContact CG-CB 3.93Å; K186-K209 PolarHBondContact N-O 2.99Å; H207-K209 HydrophobicContact CB-CG 4.44Å; K209-L211 PolarHBondContact O-N 2.85Å; K209-E231 VanDerWaalsContact CE-CD 3.41Å; K209-E231 VanDerWaalsContact CE-OE1 3.3Å; K209-E231 WeakPolarHBondContact CE-OE1 3.31Å; K209-E231 WeakPolarHBondContact CE-OE2 3.5Å; K209-E231 IonicContact NZ-OE1 3.7Å; K209-E231 PolarHBondContact NZ-OE1 2.96Å; K209-E231 IonicContact NZ-OE2 2.8Å; K209-E231 PolarHBondContact NZ-OE2 3.48Å; K209-D233 CarbonylContact C-O 3.38Å; K209-D233 VanDerWaalsContact CA-O 3.27Å; K209-D233 WeakPolarHBondContact CA-O 2.86Å; K209-D233 HydrophobicContact CG-CB 4.32Å
210	H	94.1	Very high	94	Very high	61 Å²	61	44 Å²	44	28%	0.282	22%	0.22	S	C	.	.	S	Bend	trans	52.5	51.7	172.2	-57.4	96.6	0	0	0	113.6	E185 K186 D233 Y234	E185-H210 HydrophobicContact CG-CB 4.37Å; E185-H210 IonicContact OE1-CE1 3.92Å; E185-H210 PolarHBondContact OE1-CE1 3.43Å; E185-H210 IonicContact OE1-CG 3.4Å; E185-H210 IonicContact OE1-ND1 3.92Å; E185-H210 PolarHBondContact OE1-ND1 2.97Å; K186-H210 WeakPolarHBondContact CA-O 3.5Å; K186-H210 HydrophobicContact CB-CB 4.3Å; K186-H210 HydrophobicContact CG-CB 3.49Å; K186-H210 VanDerWaalsContact CG-CB 3.49Å; K186-H210 PolarHBondContact N-O 2.96Å; H210-D233 PolarHBondContact N-O 2.89Å; H210-Y234 VanDerWaalsContact CA-O 3.24Å; H210-Y234 WeakPolarHBondContact CA-O 3.44Å; H210-Y234 HydrophobicContact CB-CD1 4.24Å; H210-Y234 AromaticContact CD2-CD1 3.32Å; H210-Y234 WeakPolarHBondContact CD2-CD1 3.46Å; H210-Y234 AromaticContact CD2-CE1 3.94Å; H210-Y234 AromaticContact CD2-CG 3.4Å; H210-Y234 VanDerWaalsContact CD2-CG 3.4Å; H210-Y234 PolarHBondContact N-O 3.45Å; H210-Y234 AromaticContact NE2-CG 3.91Å
211	L	92.3	Very high	94	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.005	22%	0.221	C	C	.	.			trans	-110.1	144.2	179.9	-55.4	-177.6	0	0	0	111.4	C187 L208 K209 I213 Y234 W235	C187-L211 HydrophobicContact CB-CD2 3.8Å; L208-L211 HydrophobicContact CB-CD1 4Å; K209-L211 PolarHBondContact O-N 2.85Å; L211-I213 HydrophobicContact CB-CD1 4.07Å; L211-I213 HydrophobicContact CB-CG1 4.12Å; L211-I213 HydrophobicContact CD1-CD1 3.75Å; L211-I213 PolarHBondContact O-N 2.9Å; L211-Y234 PolarHBondContact N-O 3.06Å; L211-W235 HydrophobicContact CB-CD2 4.37Å; L211-W235 HydrophobicContact CB-CG 4.42Å; L211-W235 HydrophobicContact CB-CZ2 4.47Å; L211-W235 HydrophobicContact CD1-CZ2 3.76Å; L211-W235 WeakPolarHBondContact O-CA 3.39Å
212	N	90.3	Very high	94	Very high	81 Å²	81	40.6 Å²	40.6	43%	0.433	21%	0.21	S	C	.	.			trans	-90	38.6	178.4	-68.4	-23.2	0	0	0	112.5	L237	N212-L237 HydrophobicContact CB-CD1 4.39Å
213	I	91.1	Very high	93.9	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.22	C	C	.	.			trans	-85.9	124.4	-180	-61.4	168.9	0	0	0	108.5	L189 V192 L211 W235	L189-I213 WeakPolarHBondContact O-CG1 3.18Å; V192-I213 HydrophobicContact CG2-CD1 3.92Å; L211-I213 HydrophobicContact CB-CD1 4.07Å; L211-I213 HydrophobicContact CB-CG1 4.12Å; L211-I213 HydrophobicContact CD1-CD1 3.75Å; L211-I213 PolarHBondContact O-N 2.9Å; I213-W235 HydrophobicContact CB-CD2 4.37Å; I213-W235 HydrophobicContact CB-CE3 3.84Å; I213-W235 HydrophobicContact CB-CH2 4.49Å; I213-W235 HydrophobicContact CB-CZ3 3.91Å; I213-W235 HydrophobicContact CD1-CH2 3.83Å; I213-W235 HydrophobicContact CD1-CZ2 4.03Å; I213-W235 HydrophobicContact CD1-CZ3 4.12Å; I213-W235 HydrophobicContact CG2-CE3 4.17Å; I213-W235 HydrophobicContact CG2-CZ3 3.88Å
214	N	87.8	Confident	93.8	Very high	94 Å²	94	45.3 Å²	45.3	50%	0.503	22%	0.221	S	C	.	.			trans	-91.1	-38.6	-179.5	64	-8.5	0	0	0	113.3	L237	N214-L237 HydrophobicContact CB-CB 3.86Å
215	N	84.3	Confident	93.5	Very high	98 Å²	98	48.6 Å²	48.6	52%	0.524	23%	0.233	S	C	.	.			trans	-125.7	126.4	-173.5	-171.3	7.1	0	0	0	110.5
216	M	91.3	Very high	93.4	Very high	1 Å²	1	53.3 Å²	53.3	1%	0.005	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-83.4	118.9	175.9	-166.3	64.2	163.8	0	0	109.9	V192 A220 F221 I232 W235 L238 M241 P242	V192-M216 HydrophobicContact CG2-CE 4.09Å; V192-M216 HydrophobicContact CG2-SD 3.58Å; V192-M216 VanDerWaalsContact CG2-SD 3.58Å; M216-A220 HydrophobicContact CE-CB 3.61Å; M216-A220 HydrophobicContact CG-CB 4.32Å; M216-A220 HydrophobicContact SD-CB 4.09Å; M216-F221 HydrophobicContact CE-CD2 4.16Å; M216-F221 HydrophobicContact CE-CE2 3.16Å; M216-F221 HydrophobicContact CE-CZ 3.41Å; M216-F221 VanDerWaalsContact CE-CZ 3.41Å; M216-I232 HydrophobicContact CE-CD1 4.21Å; M216-W235 HydrophobicContact SD-CH2 4.15Å; M216-W235 HydrophobicContact SD-CZ3 3.91Å; M216-L238 HydrophobicContact CB-CD1 4.16Å; M216-M241 HydrophobicContact CG-CE 4.41Å; M216-P242 WeakPolarHBondContact O-CD 3.02Å; M216-P242 WeakPolarHBondContact O-CG 3.21Å
217	P	91.3	Very high	93.4	Very high	43 Å²	43	53.3 Å²	53.3	28%	0.279	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-66	153.5	-178.9	25.1	-30.1	0	0	0	111.6	V192 A220	V192-P217 HydrophobicContact CB-CG 4.5Å; P217-A220 HydrophobicContact CG-CB 3.77Å; P217-A220 WeakPolarHBondContact O-CB 3.19Å; P217-A220 PolarHBondContact O-N 2.64Å
218	V	92.8	Very high	93.4	Very high	77 Å²	77	55.3 Å²	55.3	47%	0.467	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	135.5	169.6	-163	0	0	0	0	108.3	A220 P242 N244	V218-A220 VanDerWaalsContact C-N 3.33Å; V218-A220 PolarHBondContact O-N 3.01Å; V218-P242 HydrophobicContact CG2-CB 4.29Å; V218-N244 HydrophobicContact CG1-CB 3.57Å
219	Y	94.6	Very high	93.5	Very high	105 Å²	105	58.9 Å²	58.9	41%	0.412	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.4	42.5	-174.4	-43.5	-73.8	0	0	0	112.9	F221 N244 Y247	Y219-F221 PolarHBondContact O-N 3.18Å; Y219-F221 VanDerWaalsContact O-N 3.15Å; Y219-N244 HydrophobicContact CD1-CB 4.33Å; Y219-N244 HydrophobicContact CE1-CB 3.79Å; Y219-N244 PolarHBondContact N-O 3.17Å; Y219-N244 PolarHBondContact OH-ND2 2.91Å; Y219-Y247 AromaticContact CD1-CD1 3.81Å; Y219-Y247 HydrophobicContact CD1-CD1 3.81Å; Y219-Y247 HydrophobicContact CD1-CG 4.04Å; Y219-Y247 AromaticContact CE1-CD1 3.85Å; Y219-Y247 HydrophobicContact CE1-CD1 3.85Å; Y219-Y247 AromaticContact CE1-CG 3.92Å; Y219-Y247 HydrophobicContact CE1-CG 3.92Å
220	A	95.5	Very high	93.7	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	27%	0.268	C	S	.	.			trans	-58.4	-27.1	-176.5	0	0	0	0	0	113.7	T194 M216 P217 V218 S245	T194-A220 VanDerWaalsContact CB-O 3.31Å; T194-A220 WeakPolarHBondContact CB-O 3.47Å; T194-A220 WeakPolarHBondContact CG2-O 3.4Å; T194-A220 PolarHBondContact OG1-O 2.99Å; M216-A220 HydrophobicContact CE-CB 3.61Å; M216-A220 HydrophobicContact CG-CB 4.32Å; M216-A220 HydrophobicContact SD-CB 4.09Å; P217-A220 HydrophobicContact CG-CB 3.77Å; P217-A220 WeakPolarHBondContact O-CB 3.19Å; P217-A220 PolarHBondContact O-N 2.64Å; V218-A220 VanDerWaalsContact C-N 3.33Å; V218-A220 PolarHBondContact O-N 3.01Å; A220-S245 PolarHBondContact N-O 2.88Å; A220-S245 VanDerWaalsContact N-O 3.17Å
221	F	95.8	Very high	93.9	Very high	4 Å²	4	55.9 Å²	55.9	2%	0.018	26%	0.264	C	S	.	.	S	Bend	trans	-120.3	108.2	-177.3	-57.4	-73.6	0	0	0	110.4	V192 L197 L206 L208 M216 Y219 L224 L230 L246 L249	V192-F221 HydrophobicContact CG1-CE1 4.14Å; L197-F221 HydrophobicContact CD1-CD1 4.43Å; L197-F221 HydrophobicContact CD1-CE1 4.38Å; L206-F221 HydrophobicContact CD2-CD1 4.05Å; L206-F221 HydrophobicContact CD2-CE1 3.61Å; L208-F221 HydrophobicContact CD1-CE1 4.13Å; L208-F221 HydrophobicContact CD1-CZ 4.12Å; M216-F221 HydrophobicContact CE-CD2 4.16Å; M216-F221 HydrophobicContact CE-CE2 3.16Å; M216-F221 HydrophobicContact CE-CZ 3.41Å; M216-F221 VanDerWaalsContact CE-CZ 3.41Å; Y219-F221 PolarHBondContact O-N 3.18Å; Y219-F221 VanDerWaalsContact O-N 3.15Å; F221-L224 HydrophobicContact CB-CD1 4.14Å; F221-L224 HydrophobicContact CD1-CD1 3.97Å; F221-L224 HydrophobicContact CG-CD1 4.48Å; F221-L230 HydrophobicContact CD2-CD2 4.48Å; F221-L230 HydrophobicContact CE1-CD1 4.3Å; F221-L230 HydrophobicContact CE2-CD2 3.77Å; F221-L230 HydrophobicContact CZ-CD1 3.94Å; F221-L230 HydrophobicContact CZ-CD2 3.98Å; F221-L246 HydrophobicContact CD2-CD2 3.92Å; F221-L246 HydrophobicContact CE2-CD2 3.63Å; F221-L249 HydrophobicContact CB-CD1 3.97Å; F221-L249 HydrophobicContact CB-CD2 3.81Å; F221-L249 HydrophobicContact CB-CG 4.03Å; F221-L249 HydrophobicContact CD2-CD1 3.65Å; F221-L249 HydrophobicContact CE2-CD1 4.34Å; F221-L249 HydrophobicContact CG-CD1 3.95Å
222	K	93.9	Very high	94.1	Very high	86 Å²	86	55.9 Å²	55.9	37%	0.374	26%	0.264	S	S	.	.			trans	-109	140.5	-179.4	-63	179.2	-170.5	168.5	0	110.2	T194 E195 S198 L224	T194-K222 HydrophobicContact CG2-CB 4.38Å; T194-K222 HydrophobicContact CG2-CD 3.79Å; T194-K222 HydrophobicContact CG2-CG 3.77Å; E195-K222 IonicContact OE1-NZ 3.85Å; E195-K222 PolarHBondContact OE1-NZ 3.24Å; S198-K222 VanDerWaalsContact CA-O 3.31Å; S198-K222 WeakPolarHBondContact CA-O 3.27Å; S198-K222 WeakPolarHBondContact CB-O 3.28Å; K222-L224 PolarHBondContact O-N 3.4Å; K222-L224 VanDerWaalsContact O-N 3.11Å
223	R	94.4	Very high	94.4	Very high	143 Å²	143	53.2 Å²	53.2	54%	0.54	25%	0.25	S	C	.	.	S	Bend	trans	60.6	17	170.9	-55.9	176.3	176.2	168.4	-2.1	115.8	F225	R223-F225 VanDerWaalsContact C-N 3.28Å; R223-F225 HydrophobicContact CB-CE2 3.91Å; R223-F225 HydrophobicContact CB-CZ 3.94Å; R223-F225 HydrophobicContact CG-CE2 4.38Å; R223-F225 HydrophobicContact CG-CZ 4.05Å; R223-F225 WeakPolarHBondContact O-CD2 3.31Å; R223-F225 PolarHBondContact O-N 2.93Å
224	L	96.2	Very high	94.7	Very high	3 Å²	3	58.7 Å²	58.7	2%	0.016	27%	0.272	C	S	.	.			trans	-88.7	60.6	174.2	-62.7	-176.5	0	0	0	110.8	L197 L200 L203 L206 F221 K222 H226 L227 L249	L197-L224 VanDerWaalsContact O-CD2 3.31Å; L197-L224 WeakPolarHBondContact O-CD2 3.18Å; L200-L224 HydrophobicContact CB-CD2 4.24Å; L200-L224 VanDerWaalsContact O-CD2 3.22Å; L200-L224 WeakPolarHBondContact O-CD2 3.24Å; L203-L224 HydrophobicContact CB-CD2 4.33Å; L203-L224 HydrophobicContact CD2-CD2 4.28Å; L206-L224 HydrophobicContact CD2-CD1 4.35Å; F221-L224 HydrophobicContact CB-CD1 4.14Å; F221-L224 HydrophobicContact CD1-CD1 3.97Å; F221-L224 HydrophobicContact CG-CD1 4.48Å; K222-L224 PolarHBondContact O-N 3.4Å; K222-L224 VanDerWaalsContact O-N 3.11Å; L224-H226 VanDerWaalsContact C-N 3.28Å; L224-H226 PolarHBondContact O-N 2.94Å; L224-L227 HydrophobicContact CB-CB 4.08Å; L224-L227 HydrophobicContact CB-CD2 4.48Å; L224-L227 HydrophobicContact CD1-CD2 4.1Å; L224-L227 WeakPolarHBondContact O-CB 3.29Å; L224-L227 PolarHBondContact O-N 3.38Å; L224-L249 HydrophobicContact CB-CD2 3.97Å
225	F	92.6	Very high	95	Very high	134 Å²	134	54.2 Å²	54.2	59%	0.588	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68	-25.6	-168.7	-51.7	-64.2	0	0	0	114.2	R223	R223-F225 VanDerWaalsContact C-N 3.28Å; R223-F225 HydrophobicContact CB-CE2 3.91Å; R223-F225 HydrophobicContact CB-CZ 3.94Å; R223-F225 HydrophobicContact CG-CE2 4.38Å; R223-F225 HydrophobicContact CG-CZ 4.05Å; R223-F225 WeakPolarHBondContact O-CD2 3.31Å; R223-F225 PolarHBondContact O-N 2.93Å
226	H	96.2	Very high	95.4	Very high	116 Å²	116	52.2 Å²	52.2	54%	0.537	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-2.4	-178.7	-68.9	-81.6	0	0	0	113.5	R201 L203 L224 K228	R201-H226 PolarHBondContact O-CD2 3.02Å; R201-H226 VanDerWaalsContact O-CD2 3.27Å; L203-H226 CarbonylContact O-C 3.1Å; L224-H226 VanDerWaalsContact C-N 3.28Å; L224-H226 PolarHBondContact O-N 2.94Å; H226-K228 WeakPolarHBondContact O-CG 3.46Å; H226-K228 PolarHBondContact O-N 3.21Å
227	L	98	Very high	95.6	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	26%	0.263	C	S	.	.			trans	-65.2	126.3	-175.7	-164.2	74.1	0	0	0	110.4	L203 L206 L224 L249 L251	L203-L227 HydrophobicContact CB-CD1 4.36Å; L203-L227 HydrophobicContact CD2-CD1 4Å; L203-L227 HydrophobicContact CG-CD1 3.97Å; L203-L227 VanDerWaalsContact O-CA 3.23Å; L203-L227 WeakPolarHBondContact O-CA 3.26Å; L203-L227 PolarHBondContact O-N 3.41Å; L203-L227 VanDerWaalsContact O-N 3.08Å; L206-L227 HydrophobicContact CB-CD1 3.77Å; L206-L227 HydrophobicContact CB-CD2 4.3Å; L224-L227 HydrophobicContact CB-CB 4.08Å; L224-L227 HydrophobicContact CB-CD2 4.48Å; L224-L227 HydrophobicContact CD1-CD2 4.1Å; L224-L227 WeakPolarHBondContact O-CB 3.29Å; L224-L227 PolarHBondContact O-N 3.38Å; L227-L249 HydrophobicContact CB-CD2 4.32Å; L227-L249 HydrophobicContact CD2-CD1 4.3Å; L227-L249 HydrophobicContact CD2-CD2 3.86Å; L227-L251 HydrophobicContact CB-CD2 4.33Å; L227-L251 HydrophobicContact CD2-CD2 4.01Å; L227-L251 HydrophobicContact CG-CD2 3.97Å
228	K	98	Very high	95.7	Very high	67 Å²	67	54.7 Å²	54.7	29%	0.291	25%	0.25	S	S	.	.			trans	-115.4	-33	-179.8	-65.2	-52.2	176.3	-171.5	0	112.9	I204 H226 N250 L251 T252 S253	I204-K228 HydrophobicContact CG2-CB 4.19Å; I204-K228 HydrophobicContact CG2-CG 4.32Å; I204-K228 PolarHBondContact O-N 2.91Å; H226-K228 WeakPolarHBondContact O-CG 3.46Å; H226-K228 PolarHBondContact O-N 3.21Å; K228-N250 PolarHBondContact NZ-O 3.47Å; K228-L251 WeakPolarHBondContact O-CA 3.05Å; K228-T252 HydrophobicContact CD-CG2 4.19Å; K228-T252 PolarHBondContact O-N 3.21Å; K228-T252 PolarHBondContact O-OG1 3.33Å; K228-S253 PolarHBondContact O-N 3.06Å
229	H	98.5	Very high	95.7	Very high	76 Å²	76	55.4 Å²	55.4	35%	0.352	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	122.3	-176.7	-54.4	-79.8	0	0	0	109.5	I204 S205 L206 S253	I204-H229 PolarHBondContact O-N 3.03Å; S205-H229 WeakPolarHBondContact CA-O 3.49Å; L206-H229 PolarHBondContact N-O 3.38Å; H229-S253 WeakPolarHBondContact ND1-CB 3.39Å
230	L	98.5	Very high	95.6	Very high	2 Å²	2	56.1 Å²	56.1	1%	0.01	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	120.1	172.1	178.1	61.4	0	0	0	108.9	L206 F221 I232 L246 L249 L251 S253 L254 S255	L206-L230 HydrophobicContact CB-CD1 4.17Å; L206-L230 HydrophobicContact CD2-CD1 4.03Å; L206-L230 HydrophobicContact CG-CD1 4.13Å; F221-L230 HydrophobicContact CD2-CD2 4.48Å; F221-L230 HydrophobicContact CE1-CD1 4.3Å; F221-L230 HydrophobicContact CE2-CD2 3.77Å; F221-L230 HydrophobicContact CZ-CD1 3.94Å; F221-L230 HydrophobicContact CZ-CD2 3.98Å; L230-I232 HydrophobicContact CD1-CG1 4.37Å; L230-I232 HydrophobicContact CD2-CD1 4.37Å; L230-I232 HydrophobicContact CG-CG1 4.37Å; L230-L246 HydrophobicContact CD2-CD2 3.8Å; L230-L249 HydrophobicContact CD2-CD1 4.07Å; L230-L251 HydrophobicContact CB-CD1 3.72Å; L230-L251 HydrophobicContact CB-CD2 4.14Å; L230-L251 HydrophobicContact CD2-CD1 4.15Å; L230-S253 PolarHBondContact N-O 3.5Å; L230-S253 VanDerWaalsContact N-O 3.13Å; L230-L254 HydrophobicContact CB-CD1 4.13Å; L230-L254 HydrophobicContact CD2-CD1 3.99Å; L230-L254 HydrophobicContact CG-CD1 4.16Å; L230-S255 PolarHBondContact O-N 3.35Å
231	E	98.4	Very high	95.5	Very high	43 Å²	43	56.8 Å²	56.8	20%	0.201	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	119	174	-174.8	-177.6	177.4	0	0	109.3	L206 H207 L208 K209 D233	L206-E231 PolarHBondContact O-N 3.19Å; H207-E231 IonicContact CE1-OE2 3.2Å; H207-E231 IonicContact CG-OE2 2.77Å; H207-E231 IonicContact ND1-OE2 3.25Å; H207-E231 PolarHBondContact ND1-OE2 2.82Å; L208-E231 PolarHBondContact N-O 2.81Å; K209-E231 VanDerWaalsContact CE-CD 3.41Å; K209-E231 VanDerWaalsContact CE-OE1 3.3Å; K209-E231 WeakPolarHBondContact CE-OE1 3.31Å; K209-E231 WeakPolarHBondContact CE-OE2 3.5Å; K209-E231 IonicContact NZ-OE1 3.7Å; K209-E231 PolarHBondContact NZ-OE1 2.96Å; K209-E231 IonicContact NZ-OE2 2.8Å; K209-E231 PolarHBondContact NZ-OE2 3.48Å; E231-D233 HydrophobicContact CG-CB 4.35Å
232	I	96.9	Very high	95.4	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	110.8	169.3	-65.3	174.7	0	0	0	105.6	M216 L230 W235 S255 I256 T257	M216-I232 HydrophobicContact CE-CD1 4.21Å; L230-I232 HydrophobicContact CD1-CG1 4.37Å; L230-I232 HydrophobicContact CD2-CD1 4.37Å; L230-I232 HydrophobicContact CG-CG1 4.37Å; I232-W235 HydrophobicContact CD1-CH2 4.43Å; I232-W235 HydrophobicContact CG1-CZ2 4.36Å; I232-W235 HydrophobicContact CG2-CD2 3.62Å; I232-W235 HydrophobicContact CG2-CE3 4.02Å; I232-W235 HydrophobicContact CG2-CG 3.92Å; I232-W235 HydrophobicContact CG2-CH2 4.29Å; I232-W235 HydrophobicContact CG2-CZ2 3.94Å; I232-W235 HydrophobicContact CG2-CZ3 4.33Å; I232-S255 PolarHBondContact N-O 2.98Å; I232-I256 HydrophobicContact CB-CG1 4.46Å; I232-I256 HydrophobicContact CG2-CG2 4.42Å; I232-I256 CarbonylContact O-C 3.48Å; I232-I256 VanDerWaalsContact O-CA 3.28Å; I232-I256 WeakPolarHBondContact O-CA 3.07Å; I232-T257 PolarHBondContact O-N 2.98Å
233	D	97	Very high	95.4	Very high	25 Å²	25	55.6 Å²	55.6	13%	0.134	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	137.3	-176.2	-174	46.2	0	0	0	111.3	L208 K209 H210 E231 T257 N258	L208-D233 PolarHBondContact O-N 3.07Å; K209-D233 CarbonylContact C-O 3.38Å; K209-D233 VanDerWaalsContact CA-O 3.27Å; K209-D233 WeakPolarHBondContact CA-O 2.86Å; K209-D233 HydrophobicContact CG-CB 4.32Å; H210-D233 PolarHBondContact N-O 2.89Å; E231-D233 HydrophobicContact CG-CB 4.35Å; D233-T257 WeakPolarHBondContact CA-O 3.38Å; D233-T257 WeakPolarHBondContact OD1-CB 3.3Å; D233-T257 PolarHBondContact OD1-OG1 2.86Å; D233-N258 PolarHBondContact OD1-ND2 2.81Å
234	Y	95.8	Very high	95.5	Very high	116 Å²	116	52 Å²	52	46%	0.455	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	58.2	63.4	177.5	-158.3	-87.8	0	0	0	112.8	H210 L211 P236 T257 N258	H210-Y234 VanDerWaalsContact CA-O 3.24Å; H210-Y234 WeakPolarHBondContact CA-O 3.44Å; H210-Y234 HydrophobicContact CB-CD1 4.24Å; H210-Y234 AromaticContact CD2-CD1 3.32Å; H210-Y234 WeakPolarHBondContact CD2-CD1 3.46Å; H210-Y234 AromaticContact CD2-CE1 3.94Å; H210-Y234 AromaticContact CD2-CG 3.4Å; H210-Y234 VanDerWaalsContact CD2-CG 3.4Å; H210-Y234 PolarHBondContact N-O 3.45Å; H210-Y234 AromaticContact NE2-CG 3.91Å; L211-Y234 PolarHBondContact N-O 3.06Å; Y234-P236 WeakPolarHBondContact O-CD 3.24Å; Y234-T257 PolarHBondContact N-O 2.9Å; Y234-N258 CarbonylContact C-O 3.24Å; Y234-N258 VanDerWaalsContact CA-O 3.25Å; Y234-N258 WeakPolarHBondContact CA-O 3.22Å; Y234-N258 HydrophobicContact CD2-CB 4.11Å
235	W	95.4	Very high	95.5	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	81.9	171.6	-71.4	26.4	0	0	0	108.8	V192 L208 L211 I213 M216 I232 L237 L238 N258 T259	V192-W235 HydrophobicContact CG2-CH2 3.71Å; V192-W235 HydrophobicContact CG2-CZ3 4.26Å; L208-W235 HydrophobicContact CB-CZ2 3.61Å; L208-W235 HydrophobicContact CD1-CH2 4.06Å; L208-W235 HydrophobicContact CD1-CZ2 3.75Å; L208-W235 HydrophobicContact CG-CZ2 4.33Å; L208-W235 PolarHBondContact O-NE1 3.1Å; L211-W235 HydrophobicContact CB-CD2 4.37Å; L211-W235 HydrophobicContact CB-CG 4.42Å; L211-W235 HydrophobicContact CB-CZ2 4.47Å; L211-W235 HydrophobicContact CD1-CZ2 3.76Å; L211-W235 WeakPolarHBondContact O-CA 3.39Å; I213-W235 HydrophobicContact CB-CD2 4.37Å; I213-W235 HydrophobicContact CB-CE3 3.84Å; I213-W235 HydrophobicContact CB-CH2 4.49Å; I213-W235 HydrophobicContact CB-CZ3 3.91Å; I213-W235 HydrophobicContact CD1-CH2 3.83Å; I213-W235 HydrophobicContact CD1-CZ2 4.03Å; I213-W235 HydrophobicContact CD1-CZ3 4.12Å; I213-W235 HydrophobicContact CG2-CE3 4.17Å; I213-W235 HydrophobicContact CG2-CZ3 3.88Å; M216-W235 HydrophobicContact SD-CH2 4.15Å; M216-W235 HydrophobicContact SD-CZ3 3.91Å; I232-W235 HydrophobicContact CD1-CH2 4.43Å; I232-W235 HydrophobicContact CG1-CZ2 4.36Å; I232-W235 HydrophobicContact CG2-CD2 3.62Å; I232-W235 HydrophobicContact CG2-CE3 4.02Å; I232-W235 HydrophobicContact CG2-CG 3.92Å; I232-W235 HydrophobicContact CG2-CH2 4.29Å; I232-W235 HydrophobicContact CG2-CZ2 3.94Å; I232-W235 HydrophobicContact CG2-CZ3 4.33Å; W235-L237 PolarHBondContact O-N 3.41Å; W235-L237 VanDerWaalsContact O-N 3.11Å; W235-L238 HydrophobicContact CB-CB 3.89Å; W235-L238 HydrophobicContact CE3-CB 4.24Å; W235-L238 HydrophobicContact CE3-CD1 4.43Å; W235-L238 HydrophobicContact CE3-CD2 3.85Å; W235-L238 HydrophobicContact CE3-CG 4.4Å; W235-L238 HydrophobicContact CZ3-CD2 4.4Å; W235-L238 PolarHBondContact O-N 2.69Å; W235-L238 VanDerWaalsContact O-N 3.1Å; W235-N258 PolarHBondContact N-O 3.21Å; W235-N258 VanDerWaalsContact N-O 3.13Å; W235-T259 HydrophobicContact CB-CG2 4.04Å; W235-T259 WeakPolarHBondContact O-CA 3.32Å
236	P	93.4	Very high	95.6	Very high	56 Å²	56	45.5 Å²	45.5	36%	0.364	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-19.5	-167.7	26.3	-35.7	0	0	0	113.7	Y234	Y234-P236 WeakPolarHBondContact O-CD 3.24Å
237	L	93.6	Very high	95.5	Very high	95 Å²	95	46.4 Å²	46.4	50%	0.497	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-9.1	179.9	-59.3	178.7	0	0	0	113.4	N212 N214 W235 D239	N212-L237 HydrophobicContact CB-CD1 4.39Å; N214-L237 HydrophobicContact CB-CB 3.86Å; W235-L237 PolarHBondContact O-N 3.41Å; W235-L237 VanDerWaalsContact O-N 3.11Å; L237-D239 PolarHBondContact O-N 2.76Å
238	L	94.3	Very high	95.3	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.253	C	S	.	.			trans	-80.3	107.4	-178.2	-177.9	72	0	0	0	110	M216 W235 M240 M241 T259 N260 L261	M216-L238 HydrophobicContact CB-CD1 4.16Å; W235-L238 HydrophobicContact CB-CB 3.89Å; W235-L238 HydrophobicContact CE3-CB 4.24Å; W235-L238 HydrophobicContact CE3-CD1 4.43Å; W235-L238 HydrophobicContact CE3-CD2 3.85Å; W235-L238 HydrophobicContact CE3-CG 4.4Å; W235-L238 HydrophobicContact CZ3-CD2 4.4Å; W235-L238 PolarHBondContact O-N 2.69Å; W235-L238 VanDerWaalsContact O-N 3.1Å; L238-M240 WeakPolarHBondContact CD1-O 3.41Å; L238-M241 HydrophobicContact CD2-CG 4.35Å; L238-T259 HydrophobicContact CD2-CG2 4.29Å; L238-N260 CarbonylContact O-C 3.55Å; L238-N260 VanDerWaalsContact O-C 3.3Å; L238-N260 VanDerWaalsContact O-CA 3.3Å; L238-N260 WeakPolarHBondContact O-CA 3.33Å; L238-N260 WeakPolarHBondContact O-CB 3.45Å; L238-N260 PolarHBondContact O-N 3.11Å; L238-L261 PolarHBondContact O-N 2.94Å
239	D	93.4	Very high	95.2	Very high	92 Å²	92	45.8 Å²	45.8	49%	0.492	24%	0.241	S	C	.	.			trans	-110.2	-19.6	-178.5	64	-9.5	0	0	0	113.8	L237 N260	L237-D239 PolarHBondContact O-N 2.76Å; D239-N260 HydrophobicContact CB-CB 4.48Å
240	M	91.3	Very high	95.1	Very high	120 Å²	120	45 Å²	45	59%	0.591	24%	0.239	S	C	*	.			trans	-139.9	143.1	-178.6	-173.8	-177.9	178.4	0	0	112.3	L238	L238-M240 WeakPolarHBondContact CD1-O 3.41Å
241	M	94	Very high	95	Very high	15 Å²	15	44.9 Å²	44.9	7%	0.074	24%	0.239	C	C	.	.			trans	-120.2	116.5	168.2	-73	-169.7	74.3	0	0	111.2	M216 L238 L246 I256 L261 P265 A268	M216-M241 HydrophobicContact CG-CE 4.41Å; L238-M241 HydrophobicContact CD2-CG 4.35Å; M241-L246 HydrophobicContact CE-CD1 4.3Å; M241-L246 HydrophobicContact CE-CD2 4.05Å; M241-L246 HydrophobicContact CE-CG 4.11Å; M241-I256 HydrophobicContact CE-CD1 4.28Å; M241-I256 HydrophobicContact SD-CD1 3.65Å; M241-L261 HydrophobicContact CG-CD2 4.15Å; M241-L261 HydrophobicContact SD-CD1 4.44Å; M241-P265 HydrophobicContact CB-CB 3.85Å; M241-P265 HydrophobicContact CB-CG 4.44Å; M241-P265 HydrophobicContact SD-CG 4.22Å; M241-A268 HydrophobicContact CB-CB 4.37Å
242	P	94.4	Very high	95	Very high	25 Å²	25	44.7 Å²	44.7	16%	0.162	24%	0.241	C	C	.	.			trans	-62.3	151	174.8	-24.6	35.4	0	0	0	113.2	M216 V218 N244 S245	M216-P242 WeakPolarHBondContact O-CD 3.02Å; M216-P242 WeakPolarHBondContact O-CG 3.21Å; V218-P242 HydrophobicContact CG2-CB 4.29Å; P242-N244 VanDerWaalsContact C-N 3.31Å; P242-N244 PolarHBondContact O-N 2.83Å; P242-S245 VanDerWaalsContact O-CB 3.27Å; P242-S245 WeakPolarHBondContact O-CB 3.41Å; P242-S245 PolarHBondContact O-N 3.07Å; P242-S245 PolarHBondContact O-OG 3.26Å
243	A	94.1	Very high	95.1	Very high	39 Å²	39	46.2 Å²	46.2	32%	0.322	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-36.1	-175.9	0	0	0	0	0	115	L267 A268	A243-L267 HydrophobicContact CB-CB 3.72Å; A243-L267 HydrophobicContact CB-CD1 4.44Å; A243-A268 WeakPolarHBondContact O-CA 3.4Å
244	N	95.2	Very high	95.2	Very high	69 Å²	69	45 Å²	45	37%	0.369	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.3	17.2	-179	-64.7	-22.7	0	0	0	112.7	V218 Y219 P242 L246 Y247	V218-N244 HydrophobicContact CG1-CB 3.57Å; Y219-N244 HydrophobicContact CD1-CB 4.33Å; Y219-N244 HydrophobicContact CE1-CB 3.79Å; Y219-N244 PolarHBondContact N-O 3.17Å; Y219-N244 PolarHBondContact OH-ND2 2.91Å; P242-N244 VanDerWaalsContact C-N 3.31Å; P242-N244 PolarHBondContact O-N 2.83Å; N244-L246 VanDerWaalsContact C-N 3.34Å; N244-L246 PolarHBondContact O-N 2.92Å; N244-Y247 WeakPolarHBondContact O-CB 3.5Å; N244-Y247 PolarHBondContact O-N 3.31Å
245	S	95.6	Very high	95.3	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-41.4	178.8	53.4	0	0	0	0	112.7	A220 P242	A220-S245 PolarHBondContact N-O 2.88Å; A220-S245 VanDerWaalsContact N-O 3.17Å; P242-S245 VanDerWaalsContact O-CB 3.27Å; P242-S245 WeakPolarHBondContact O-CB 3.41Å; P242-S245 PolarHBondContact O-N 3.07Å; P242-S245 PolarHBondContact O-OG 3.26Å
246	L	96.2	Very high	95.4	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	8.6	-179.4	-56.5	-177.6	0	0	0	113.8	F221 L230 M241 N244 G248 L249 L254 F269 H271 L272	F221-L246 HydrophobicContact CD2-CD2 3.92Å; F221-L246 HydrophobicContact CE2-CD2 3.63Å; L230-L246 HydrophobicContact CD2-CD2 3.8Å; M241-L246 HydrophobicContact CE-CD1 4.3Å; M241-L246 HydrophobicContact CE-CD2 4.05Å; M241-L246 HydrophobicContact CE-CG 4.11Å; N244-L246 VanDerWaalsContact C-N 3.34Å; N244-L246 PolarHBondContact O-N 2.92Å; L246-G248 PolarHBondContact O-N 2.96Å; L246-L249 HydrophobicContact CB-CD1 4.36Å; L246-L249 HydrophobicContact CD2-CD1 4.21Å; L246-L249 WeakPolarHBondContact O-CB 3.17Å; L246-L249 WeakPolarHBondContact O-CG 3.47Å; L246-L249 PolarHBondContact O-N 2.94Å; L246-L254 HydrophobicContact CD1-CD1 4.45Å; L246-L254 HydrophobicContact CD1-CD2 3.98Å; L246-F269 HydrophobicContact CD1-CB 4.41Å; L246-H271 PolarHBondContact O-CE1 3.49Å; L246-H271 PolarHBondContact O-NE2 3.26Å; L246-L272 HydrophobicContact CD1-CD1 4.37Å
247	Y	94.7	Very high	95.6	Very high	135 Å²	135	38 Å²	38	53%	0.529	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	134.5	-174.8	-179	-86.9	0	0	0	112	Y219 N244	Y219-Y247 AromaticContact CD1-CD1 3.81Å; Y219-Y247 HydrophobicContact CD1-CD1 3.81Å; Y219-Y247 HydrophobicContact CD1-CG 4.04Å; Y219-Y247 AromaticContact CE1-CD1 3.85Å; Y219-Y247 HydrophobicContact CE1-CD1 3.85Å; Y219-Y247 AromaticContact CE1-CG 3.92Å; Y219-Y247 HydrophobicContact CE1-CG 3.92Å; N244-Y247 WeakPolarHBondContact O-CB 3.5Å; N244-Y247 PolarHBondContact O-N 3.31Å
248	G	92.2	Very high	95.8	Very high	46 Å²	46	36.3 Å²	36.3	47%	0.474	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	93	-6.1	-179.3	0	0	0	0	0	113.9	L246	L246-G248 PolarHBondContact O-N 2.96Å
249	L	96.1	Very high	95.9	Very high	7 Å²	7	36.7 Å²	36.7	4%	0.037	21%	0.208	C	C	.	.			trans	-86	149.3	171.4	-59.6	-177.5	0	0	0	111.3	F221 L224 L227 L230 L246 L251 L272	F221-L249 HydrophobicContact CB-CD1 3.97Å; F221-L249 HydrophobicContact CB-CD2 3.81Å; F221-L249 HydrophobicContact CB-CG 4.03Å; F221-L249 HydrophobicContact CD2-CD1 3.65Å; F221-L249 HydrophobicContact CE2-CD1 4.34Å; F221-L249 HydrophobicContact CG-CD1 3.95Å; L224-L249 HydrophobicContact CB-CD2 3.97Å; L227-L249 HydrophobicContact CB-CD2 4.32Å; L227-L249 HydrophobicContact CD2-CD1 4.3Å; L227-L249 HydrophobicContact CD2-CD2 3.86Å; L230-L249 HydrophobicContact CD2-CD1 4.07Å; L246-L249 HydrophobicContact CB-CD1 4.36Å; L246-L249 HydrophobicContact CD2-CD1 4.21Å; L246-L249 WeakPolarHBondContact O-CB 3.17Å; L246-L249 WeakPolarHBondContact O-CG 3.47Å; L246-L249 PolarHBondContact O-N 2.94Å; L249-L251 HydrophobicContact CB-CD2 4.29Å; L249-L251 HydrophobicContact CB-CG 4.05Å; L249-L251 HydrophobicContact CD1-CD1 4.26Å; L249-L251 HydrophobicContact CD1-CD2 4.43Å; L249-L251 HydrophobicContact CD1-CG 4.47Å; L249-L272 HydrophobicContact CB-CD2 4.5Å; L249-L272 WeakPolarHBondContact O-CD2 3.3Å
250	N	95.9	Very high	96	Very high	59 Å²	59	36.2 Å²	36.2	32%	0.316	21%	0.205	S	C	.	.			trans	-133.7	70.3	174.2	-172.1	6.6	0	0	0	110.1	K228 Y274	K228-N250 PolarHBondContact NZ-O 3.47Å; N250-Y274 WeakPolarHBondContact OD1-CD2 3.48Å
251	L	97.9	Very high	96.2	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	18%	0.178	C	C	.	.			trans	-77.8	151.3	-172.1	-56.2	178.2	0	0	0	112.4	L227 K228 L230 L249 L254 L272 Y274 L275	L227-L251 HydrophobicContact CB-CD2 4.33Å; L227-L251 HydrophobicContact CD2-CD2 4.01Å; L227-L251 HydrophobicContact CG-CD2 3.97Å; K228-L251 WeakPolarHBondContact O-CA 3.05Å; L230-L251 HydrophobicContact CB-CD1 3.72Å; L230-L251 HydrophobicContact CB-CD2 4.14Å; L230-L251 HydrophobicContact CD2-CD1 4.15Å; L249-L251 HydrophobicContact CB-CD2 4.29Å; L249-L251 HydrophobicContact CB-CG 4.05Å; L249-L251 HydrophobicContact CD1-CD1 4.26Å; L249-L251 HydrophobicContact CD1-CD2 4.43Å; L249-L251 HydrophobicContact CD1-CG 4.47Å; L251-L254 HydrophobicContact CD1-CB 4.32Å; L251-L254 HydrophobicContact CD1-CD1 4.06Å; L251-L272 HydrophobicContact CB-CD1 4.36Å; L251-L272 HydrophobicContact CB-CD2 4.39Å; L251-L272 HydrophobicContact CD1-CD1 4.01Å; L251-L272 HydrophobicContact CG-CD1 4.42Å; L251-L272 HydrophobicContact CG-CD2 4.36Å; L251-Y274 CarbonylContact O-C 3.54Å; L251-L275 HydrophobicContact CB-CD1 3.94Å; L251-L275 PolarHBondContact O-N 3.26Å
252	T	98.1	Very high	96.1	Very high	39 Å²	39	33 Å²	33	24%	0.239	20%	0.196	C	C	.	.	S	Bend	trans	-104.6	-26.3	165.6	52.5	0	0	0	0	111.4	K228 T276 H277	K228-T252 HydrophobicContact CD-CG2 4.19Å; K228-T252 PolarHBondContact O-N 3.21Å; K228-T252 PolarHBondContact O-OG1 3.33Å; T252-T276 PolarHBondContact O-N 2.7Å; T252-T276 PolarHBondContact O-OG1 3.07Å; T252-H277 PolarHBondContact O-N 3.49Å; T252-H277 VanDerWaalsContact O-N 3.1Å
253	S	98.6	Very high	96.1	Very high	32 Å²	32	35.7 Å²	35.7	22%	0.224	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	130.6	177.6	-176.2	0	0	0	0	111	K228 H229 L230 H277	K228-S253 PolarHBondContact O-N 3.06Å; H229-S253 WeakPolarHBondContact ND1-CB 3.39Å; L230-S253 PolarHBondContact N-O 3.5Å; L230-S253 VanDerWaalsContact N-O 3.13Å; S253-H277 WeakPolarHBondContact CA-O 3.47Å
254	L	98.6	Very high	96.2	Very high	1 Å²	1	34 Å²	34	1%	0.005	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	122.9	176.1	176.6	61.5	0	0	0	108.8	L230 L246 L251 I256 F269 L272 L275 H277 L278 N279	L230-L254 HydrophobicContact CB-CD1 4.13Å; L230-L254 HydrophobicContact CD2-CD1 3.99Å; L230-L254 HydrophobicContact CG-CD1 4.16Å; L246-L254 HydrophobicContact CD1-CD1 4.45Å; L246-L254 HydrophobicContact CD1-CD2 3.98Å; L251-L254 HydrophobicContact CD1-CB 4.32Å; L251-L254 HydrophobicContact CD1-CD1 4.06Å; L254-I256 HydrophobicContact CD1-CD1 4.09Å; L254-I256 HydrophobicContact CD1-CG1 3.96Å; L254-I256 HydrophobicContact CD2-CD1 4.06Å; L254-I256 HydrophobicContact CG-CD1 4.13Å; L254-I256 HydrophobicContact CG-CG1 4.21Å; L254-F269 HydrophobicContact CD2-CB 4.06Å; L254-F269 HydrophobicContact CD2-CD1 4.26Å; L254-F269 HydrophobicContact CD2-CG 4.48Å; L254-L272 HydrophobicContact CD2-CD1 4.12Å; L254-L275 HydrophobicContact CB-CD1 3.76Å; L254-L275 HydrophobicContact CB-CD2 4.24Å; L254-H277 PolarHBondContact N-O 3.13Å; L254-L278 HydrophobicContact CB-CD1 4.12Å; L254-L278 HydrophobicContact CD2-CD1 4.01Å; L254-L278 HydrophobicContact CG-CD1 4.08Å; L254-L278 WeakPolarHBondContact O-CA 3.49Å; L254-N279 PolarHBondContact O-N 3.16Å
255	S	98.5	Very high	96.1	Very high	16 Å²	16	31.3 Å²	31.3	11%	0.112	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	123.6	172.1	-168.3	0	0	0	0	109.1	L230 I232 T257 N279	L230-S255 PolarHBondContact O-N 3.35Å; I232-S255 PolarHBondContact N-O 2.98Å; S255-T257 WeakPolarHBondContact OG-CG2 3.46Å; S255-N279 WeakPolarHBondContact CA-O 3.46Å
256	I	97.4	Very high	96.1	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	95.7	172.2	-55.3	162	0	0	0	106	I232 M241 L254 T259 L261 N279 L280 N283	I232-I256 HydrophobicContact CB-CG1 4.46Å; I232-I256 HydrophobicContact CG2-CG2 4.42Å; I232-I256 CarbonylContact O-C 3.48Å; I232-I256 VanDerWaalsContact O-CA 3.28Å; I232-I256 WeakPolarHBondContact O-CA 3.07Å; M241-I256 HydrophobicContact CE-CD1 4.28Å; M241-I256 HydrophobicContact SD-CD1 3.65Å; L254-I256 HydrophobicContact CD1-CD1 4.09Å; L254-I256 HydrophobicContact CD1-CG1 3.96Å; L254-I256 HydrophobicContact CD2-CD1 4.06Å; L254-I256 HydrophobicContact CG-CD1 4.13Å; L254-I256 HydrophobicContact CG-CG1 4.21Å; I256-T259 HydrophobicContact CG2-CG2 3.95Å; I256-L261 HydrophobicContact CG2-CD1 3.66Å; I256-N279 PolarHBondContact N-O 3.16Å; I256-L280 HydrophobicContact CB-CD2 4.02Å; I256-L280 HydrophobicContact CD1-CD2 4.21Å; I256-L280 WeakPolarHBondContact O-CA 3.27Å; I256-N283 PolarHBondContact O-ND2 3.27Å
257	T	97.9	Very high	96	Very high	8 Å²	8	39.7 Å²	39.7	5%	0.049	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	152.8	-169.9	47.5	0	0	0	0	112.1	I232 D233 Y234 S255 T259 N279 S281	I232-T257 PolarHBondContact O-N 2.98Å; D233-T257 WeakPolarHBondContact CA-O 3.38Å; D233-T257 WeakPolarHBondContact OD1-CB 3.3Å; D233-T257 PolarHBondContact OD1-OG1 2.86Å; Y234-T257 PolarHBondContact N-O 2.9Å; S255-T257 WeakPolarHBondContact OG-CG2 3.46Å; T257-T259 WeakPolarHBondContact O-CG2 3.4Å; T257-T259 PolarHBondContact O-N 3.11Å; T257-N279 HydrophobicContact CG2-CB 4.42Å; T257-S281 VanDerWaalsContact CA-O 3.25Å; T257-S281 WeakPolarHBondContact CA-O 3.27Å
258	N	96.7	Very high	96	Very high	60 Å²	60	33.3 Å²	33.3	32%	0.321	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	54.3	49.1	178.9	-58.9	-71.6	0	0	0	112.3	D233 Y234 W235 S281 Y282	D233-N258 PolarHBondContact OD1-ND2 2.81Å; Y234-N258 CarbonylContact C-O 3.24Å; Y234-N258 VanDerWaalsContact CA-O 3.25Å; Y234-N258 WeakPolarHBondContact CA-O 3.22Å; Y234-N258 HydrophobicContact CD2-CB 4.11Å; W235-N258 PolarHBondContact N-O 3.21Å; W235-N258 VanDerWaalsContact N-O 3.13Å; N258-S281 PolarHBondContact N-O 2.98Å; N258-Y282 VanDerWaalsContact CA-O 3.29Å; N258-Y282 WeakPolarHBondContact CA-O 3.09Å; N258-Y282 PolarHBondContact N-O 3.26Å; N258-Y282 VanDerWaalsContact OD1-CB 3.24Å; N258-Y282 WeakPolarHBondContact OD1-CB 3.48Å
259	T	96.3	Very high	96.1	Very high	8 Å²	8	31.2 Å²	31.2	5%	0.049	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	177.7	175.6	79.1	0	0	0	0	110.6	W235 L238 I256 T257 L261 N283 P284	W235-T259 HydrophobicContact CB-CG2 4.04Å; W235-T259 WeakPolarHBondContact O-CA 3.32Å; L238-T259 HydrophobicContact CD2-CG2 4.29Å; I256-T259 HydrophobicContact CG2-CG2 3.95Å; T257-T259 WeakPolarHBondContact O-CG2 3.4Å; T257-T259 PolarHBondContact O-N 3.11Å; T259-L261 WeakPolarHBondContact OG1-CD1 3.49Å; T259-L261 VanDerWaalsContact OG1-CG 3.27Å; T259-L261 WeakPolarHBondContact OG1-CG 3.44Å; T259-N283 WeakPolarHBondContact CA-OD1 3.42Å; T259-N283 WeakPolarHBondContact CB-OD1 3.48Å; T259-N283 PolarHBondContact N-OD1 3.3Å; T259-N283 PolarHBondContact O-OD1 3.35Å; T259-N283 PolarHBondContact OG1-OD1 2.72Å; T259-P284 VanDerWaalsContact O-CD 3.22Å; T259-P284 WeakPolarHBondContact O-CD 3.4Å
260	N	96	Very high	96	Very high	82 Å²	82	35.7 Å²	35.7	44%	0.439	20%	0.197	S	C	.	.			trans	-99.2	25.4	-178.8	-163	33.5	0	0	0	112.9	L238 D239 S262	L238-N260 CarbonylContact O-C 3.55Å; L238-N260 VanDerWaalsContact O-C 3.3Å; L238-N260 VanDerWaalsContact O-CA 3.3Å; L238-N260 WeakPolarHBondContact O-CA 3.33Å; L238-N260 WeakPolarHBondContact O-CB 3.45Å; L238-N260 PolarHBondContact O-N 3.11Å; D239-N260 HydrophobicContact CB-CB 4.48Å; N260-S262 PolarHBondContact O-N 2.68Å
261	L	94.9	Very high	96	Very high	3 Å²	3	36.3 Å²	36.3	2%	0.016	20%	0.197	C	C	.	.			trans	-65.9	114.7	178	-68.2	171.9	0	0	0	111.2	L238 M241 I256 T259 P265 N283 P284 I285	L238-L261 PolarHBondContact O-N 2.94Å; M241-L261 HydrophobicContact CG-CD2 4.15Å; M241-L261 HydrophobicContact SD-CD1 4.44Å; I256-L261 HydrophobicContact CG2-CD1 3.66Å; T259-L261 WeakPolarHBondContact OG1-CD1 3.49Å; T259-L261 VanDerWaalsContact OG1-CG 3.27Å; T259-L261 WeakPolarHBondContact OG1-CG 3.44Å; L261-P265 HydrophobicContact CD1-CG 4.25Å; L261-N283 HydrophobicContact CB-CB 4.23Å; L261-P284 CarbonylContact O-C 3.29Å; L261-P284 VanDerWaalsContact O-CD 3.24Å; L261-P284 WeakPolarHBondContact O-CD 3.34Å; L261-P284 WeakPolarHBondContact O-CG 3.07Å; L261-I285 WeakPolarHBondContact O-CG1 3.4Å
262	S	93.5	Very high	95.9	Very high	65 Å²	65	36.3 Å²	36.3	46%	0.455	20%	0.197	S	C	.	.			trans	-79.7	-19.9	178.8	56	0	0	0	0	113.9	N260 P284	N260-S262 PolarHBondContact O-N 2.68Å; S262-P284 WeakPolarHBondContact CA-O 3.37Å
263	T	93.9	Very high	95.7	Very high	81 Å²	81	36.9 Å²	36.9	50%	0.497	20%	0.201	S	C	.	.	S	Bend	trans	-139.7	157.7	-176.7	57.4	0	0	0	0	110.2	P265	T263-P265 WeakPolarHBondContact O-CD 3.2Å
264	V	95.3	Very high	95.6	Very high	2 Å²	2	40.5 Å²	40.5	1%	0.012	21%	0.211	C	C	.	.			trans	-68.2	120.3	173.9	177.3	0	0	0	0	109.2	F266 F269 L280 I285 I288 M292 F293	V264-F266 HydrophobicContact CG1-CB 4.49Å; V264-F266 PolarHBondContact O-N 2.79Å; V264-F269 HydrophobicContact CG1-CE1 4.17Å; V264-F269 HydrophobicContact CG1-CE2 4.5Å; V264-F269 HydrophobicContact CG1-CZ 3.5Å; V264-F269 VanDerWaalsContact CG1-CZ 3.5Å; V264-L280 HydrophobicContact CG1-CD1 4.03Å; V264-L280 HydrophobicContact CG2-CD1 4.43Å; V264-I285 HydrophobicContact CG2-CD1 4.19Å; V264-I285 HydrophobicContact CG2-CG2 3.9Å; V264-I288 HydrophobicContact CG2-CG1 4.35Å; V264-M292 HydrophobicContact CB-SD 3.83Å; V264-M292 HydrophobicContact CG1-SD 4.43Å; V264-M292 HydrophobicContact CG2-SD 4.18Å; V264-F293 HydrophobicContact CG1-CE1 3.76Å; V264-F293 HydrophobicContact CG1-CZ 3.69Å; V264-F293 HydrophobicContact CG2-CZ 4.19Å
265	P	94.9	Very high	95.6	Very high	14 Å²	14	40.5 Å²	40.5	9%	0.091	21%	0.21	C	C	.	.			trans	-79.8	59.1	-177.5	32.1	-34.3	0	0	0	112	M241 L261 T263 L267 A268 F269	M241-P265 HydrophobicContact CB-CB 3.85Å; M241-P265 HydrophobicContact CB-CG 4.44Å; M241-P265 HydrophobicContact SD-CG 4.22Å; L261-P265 HydrophobicContact CD1-CG 4.25Å; T263-P265 WeakPolarHBondContact O-CD 3.2Å; P265-L267 VanDerWaalsContact C-N 3.28Å; P265-L267 PolarHBondContact O-N 3.43Å; P265-A268 HydrophobicContact CB-CB 4.24Å; P265-A268 VanDerWaalsContact O-CB 3.3Å; P265-A268 WeakPolarHBondContact O-CB 3.34Å; P265-A268 PolarHBondContact O-N 3.42Å; P265-F269 HydrophobicContact CG-CD1 4.25Å; P265-F269 HydrophobicContact CG-CE1 3.79Å; P265-F269 VanDerWaalsContact O-CD1 3.29Å; P265-F269 WeakPolarHBondContact O-CD1 3.29Å; P265-F269 VanDerWaalsContact O-CE1 3.31Å; P265-F269 WeakPolarHBondContact O-CE1 3.19Å
266	F	93.8	Very high	95.6	Very high	79 Å²	79	41.1 Å²	41.1	35%	0.346	21%	0.214	S	C	.	.	H	α-helix	trans	-58	-36.3	-171	70	-85.6	0	0	0	113.7	V264 A268 F269 K270 M292	V264-F266 HydrophobicContact CG1-CB 4.49Å; V264-F266 PolarHBondContact O-N 2.79Å; F266-A268 PolarHBondContact O-N 3.03Å; F266-F269 HydrophobicContact CB-CE2 4.28Å; F266-F269 HydrophobicContact CB-CZ 4.39Å; F266-F269 PolarHBondContact O-N 2.9Å; F266-K270 WeakPolarHBondContact O-CB 2.98Å; F266-K270 PolarHBondContact O-N 3.29Å; F266-M292 HydrophobicContact CB-CB 4.11Å; F266-M292 HydrophobicContact CB-CG 4.38Å; F266-M292 VanDerWaalsContact CB-O 3.24Å; F266-M292 WeakPolarHBondContact CB-O 3.1Å; F266-M292 HydrophobicContact CD1-CE 4.29Å; F266-M292 HydrophobicContact CD1-CG 4.14Å; F266-M292 HydrophobicContact CG-CG 4.33Å
267	L	94.8	Very high	95.6	Very high	97 Å²	97	44.1 Å²	44.1	51%	0.508	23%	0.228	S	C	.	.	H	α-helix	trans	-63	-31.5	176.9	-66	175.3	0	0	0	112.5	A243 P265	A243-L267 HydrophobicContact CB-CB 3.72Å; A243-L267 HydrophobicContact CB-CD1 4.44Å; P265-L267 VanDerWaalsContact C-N 3.28Å; P265-L267 PolarHBondContact O-N 3.43Å
268	A	95.3	Very high	95.6	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.008	23%	0.226	C	C	.	.	H	α-helix	trans	-69	-37.5	-178.2	0	0	0	0	0	112.4	M241 A243 P265 F266 H271	M241-A268 HydrophobicContact CB-CB 4.37Å; A243-A268 WeakPolarHBondContact O-CA 3.4Å; P265-A268 HydrophobicContact CB-CB 4.24Å; P265-A268 VanDerWaalsContact O-CB 3.3Å; P265-A268 WeakPolarHBondContact O-CB 3.34Å; P265-A268 PolarHBondContact O-N 3.42Å; F266-A268 PolarHBondContact O-N 3.03Å; A268-H271 PolarHBondContact O-CE1 3.15Å; A268-H271 VanDerWaalsContact O-CE1 3.3Å; A268-H271 PolarHBondContact O-ND1 3.1Å
269	F	94.1	Very high	95.7	Very high	1 Å²	1	43.1 Å²	43.1	0%	0.004	22%	0.222	C	C	.	.	H	α-helix	trans	-111.1	4.2	-175.7	53.4	-112.6	0	0	0	114.7	L246 L254 V264 P265 F266 H271 L272 L278 F293 L296	L246-F269 HydrophobicContact CD1-CB 4.41Å; L254-F269 HydrophobicContact CD2-CB 4.06Å; L254-F269 HydrophobicContact CD2-CD1 4.26Å; L254-F269 HydrophobicContact CD2-CG 4.48Å; V264-F269 HydrophobicContact CG1-CE1 4.17Å; V264-F269 HydrophobicContact CG1-CE2 4.5Å; V264-F269 HydrophobicContact CG1-CZ 3.5Å; V264-F269 VanDerWaalsContact CG1-CZ 3.5Å; P265-F269 HydrophobicContact CG-CD1 4.25Å; P265-F269 HydrophobicContact CG-CE1 3.79Å; P265-F269 VanDerWaalsContact O-CD1 3.29Å; P265-F269 WeakPolarHBondContact O-CD1 3.29Å; P265-F269 VanDerWaalsContact O-CE1 3.31Å; P265-F269 WeakPolarHBondContact O-CE1 3.19Å; F266-F269 HydrophobicContact CB-CE2 4.28Å; F266-F269 HydrophobicContact CB-CZ 4.39Å; F266-F269 PolarHBondContact O-N 2.9Å; F269-H271 PolarHBondContact O-N 2.93Å; F269-L272 HydrophobicContact CB-CD1 3.7Å; F269-L272 HydrophobicContact CB-CG 4.24Å; F269-L272 WeakPolarHBondContact O-CB 3.27Å; F269-L272 PolarHBondContact O-N 2.95Å; F269-L278 HydrophobicContact CE2-CD2 4.42Å; F269-L278 HydrophobicContact CZ-CD2 4.3Å; F269-F293 HydrophobicContact CE2-CD1 4.06Å; F269-F293 HydrophobicContact CE2-CE1 4.12Å; F269-F293 HydrophobicContact CZ-CD1 4.36Å; F269-F293 AromaticContact CZ-CE1 3.95Å; F269-F293 HydrophobicContact CZ-CE1 3.95Å; F269-L296 HydrophobicContact CD2-CD1 3.98Å; F269-L296 HydrophobicContact CD2-CD2 4.35Å; F269-L296 HydrophobicContact CE2-CD1 3.99Å
270	K	94.1	Very high	95.8	Very high	102 Å²	102	42.8 Å²	42.8	44%	0.443	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.4	-37	178.8	-172.8	-178.7	-178.9	179.7	0	114	F266 L272 D295	F266-K270 WeakPolarHBondContact O-CB 2.98Å; F266-K270 PolarHBondContact O-N 3.29Å; K270-L272 VanDerWaalsContact C-N 3.3Å; K270-L272 PolarHBondContact O-N 3.5Å; K270-D295 WeakPolarHBondContact CE-OD1 3.39Å; K270-D295 WeakPolarHBondContact CE-OD2 3.41Å; K270-D295 HydrophobicContact CG-CB 3.93Å; K270-D295 WeakPolarHBondContact CG-OD2 3.46Å; K270-D295 WeakPolarHBondContact O-CB 3.27Å
271	H	94.9	Very high	95.9	Very high	71 Å²	71	39.1 Å²	39.1	33%	0.329	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-7.8	-177.1	68.1	-82.5	0	0	0	114.1	L246 A268 F269 V273	L246-H271 PolarHBondContact O-CE1 3.49Å; L246-H271 PolarHBondContact O-NE2 3.26Å; A268-H271 PolarHBondContact O-CE1 3.15Å; A268-H271 VanDerWaalsContact O-CE1 3.3Å; A268-H271 PolarHBondContact O-ND1 3.1Å; F269-H271 PolarHBondContact O-N 2.93Å; H271-V273 PolarHBondContact O-N 2.98Å
272	L	95.9	Very high	96	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.219	C	C	.	.			trans	-81.1	60.7	-177.1	-57.9	-178.9	0	0	0	111.6	L246 L249 L251 L254 F269 K270 Y274 L275 L296	L246-L272 HydrophobicContact CD1-CD1 4.37Å; L249-L272 HydrophobicContact CB-CD2 4.5Å; L249-L272 WeakPolarHBondContact O-CD2 3.3Å; L251-L272 HydrophobicContact CB-CD1 4.36Å; L251-L272 HydrophobicContact CB-CD2 4.39Å; L251-L272 HydrophobicContact CD1-CD1 4.01Å; L251-L272 HydrophobicContact CG-CD1 4.42Å; L251-L272 HydrophobicContact CG-CD2 4.36Å; L254-L272 HydrophobicContact CD2-CD1 4.12Å; F269-L272 HydrophobicContact CB-CD1 3.7Å; F269-L272 HydrophobicContact CB-CG 4.24Å; F269-L272 WeakPolarHBondContact O-CB 3.27Å; F269-L272 PolarHBondContact O-N 2.95Å; K270-L272 VanDerWaalsContact C-N 3.3Å; K270-L272 PolarHBondContact O-N 3.5Å; L272-Y274 PolarHBondContact O-N 3.02Å; L272-L275 HydrophobicContact CB-CB 4.15Å; L272-L275 HydrophobicContact CD1-CD1 4.39Å; L272-L275 WeakPolarHBondContact O-CB 3.35Å; L272-L275 PolarHBondContact O-N 3.48Å; L272-L296 HydrophobicContact CB-CD2 4.45Å
273	V	94.8	Very high	96.2	Very high	52 Å²	52	40.9 Å²	40.9	32%	0.315	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-8.4	-176.5	-59	0	0	0	0	114.6	H271 R298	H271-V273 PolarHBondContact O-N 2.98Å; V273-R298 PolarHBondContact O-NH1 3.02Å
274	Y	96.6	Very high	96.3	Very high	108 Å²	108	38.8 Å²	38.8	42%	0.424	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-0.2	175.1	-66.7	-91.4	0	0	0	113.1	N250 L251 L272 T276	N250-Y274 WeakPolarHBondContact OD1-CD2 3.48Å; L251-Y274 CarbonylContact O-C 3.54Å; L272-Y274 PolarHBondContact O-N 3.02Å; Y274-T276 PolarHBondContact O-N 3Å
275	L	97.7	Very high	96.3	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.185	C	C	.	.			trans	-64.3	126.8	-179.5	-157.9	74.6	0	0	0	110.3	L251 L254 L272 L278 L296 R298 L299	L251-L275 HydrophobicContact CB-CD1 3.94Å; L251-L275 PolarHBondContact O-N 3.26Å; L254-L275 HydrophobicContact CB-CD1 3.76Å; L254-L275 HydrophobicContact CB-CD2 4.24Å; L272-L275 HydrophobicContact CB-CB 4.15Å; L272-L275 HydrophobicContact CD1-CD1 4.39Å; L272-L275 WeakPolarHBondContact O-CB 3.35Å; L272-L275 PolarHBondContact O-N 3.48Å; L275-L278 HydrophobicContact CD2-CB 4.01Å; L275-L278 HydrophobicContact CD2-CD1 4.21Å; L275-L278 HydrophobicContact CD2-CG 4.48Å; L275-L296 HydrophobicContact CB-CD2 4.5Å; L275-L296 HydrophobicContact CD2-CD1 4.27Å; L275-L296 HydrophobicContact CD2-CD2 4.5Å; L275-R298 CarbonylContact O-C 3.46Å; L275-L299 HydrophobicContact CB-CD1 4.47Å; L275-L299 HydrophobicContact CD2-CD1 4.1Å; L275-L299 HydrophobicContact CG-CD1 4.19Å; L275-L299 WeakPolarHBondContact O-CA 3.14Å; L275-L299 PolarHBondContact O-N 3.36Å
276	T	97.9	Very high	96.4	Very high	29 Å²	29	40.5 Å²	40.5	18%	0.178	20%	0.198	C	C	.	.			trans	-110	-30.5	177.1	53.8	0	0	0	0	111.7	T252 Y274 Q300 E301	T252-T276 PolarHBondContact O-N 2.7Å; T252-T276 PolarHBondContact O-OG1 3.07Å; Y274-T276 PolarHBondContact O-N 3Å; T276-Q300 PolarHBondContact O-N 3.19Å; T276-E301 PolarHBondContact O-N 2.94Å
277	H	98.5	Very high	96.4	Very high	64 Å²	64	39 Å²	39	30%	0.296	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	126	-179.3	-57.8	70	0	0	0	110.2	T252 S253 L254 E301	T252-H277 PolarHBondContact O-N 3.49Å; T252-H277 VanDerWaalsContact O-N 3.1Å; S253-H277 WeakPolarHBondContact CA-O 3.47Å; L254-H277 PolarHBondContact N-O 3.13Å; H277-E301 VanDerWaalsContact CD2-CD 3.42Å; H277-E301 IonicContact CD2-OE2 3.11Å; H277-E301 PolarHBondContact CD2-OE2 3.03Å; H277-E301 IonicContact NE2-OE1 2.64Å; H277-E301 IonicContact NE2-OE2 3.98Å
278	L	98.3	Very high	96.5	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.005	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	125.5	174.4	179.2	58.4	0	0	0	110.1	L254 F269 L275 L280 F293 L296 L299 E301 L302 H303	L254-L278 HydrophobicContact CB-CD1 4.12Å; L254-L278 HydrophobicContact CD2-CD1 4.01Å; L254-L278 HydrophobicContact CG-CD1 4.08Å; L254-L278 WeakPolarHBondContact O-CA 3.49Å; F269-L278 HydrophobicContact CE2-CD2 4.42Å; F269-L278 HydrophobicContact CZ-CD2 4.3Å; L275-L278 HydrophobicContact CD2-CB 4.01Å; L275-L278 HydrophobicContact CD2-CD1 4.21Å; L275-L278 HydrophobicContact CD2-CG 4.48Å; L278-L280 HydrophobicContact CD1-CD2 4.08Å; L278-L280 HydrophobicContact CD1-CG 4.07Å; L278-L280 HydrophobicContact CD2-CD1 4.26Å; L278-L280 HydrophobicContact CG-CD1 4.43Å; L278-L280 HydrophobicContact CG-CG 4.15Å; L278-F293 HydrophobicContact CD2-CD1 4.09Å; L278-F293 HydrophobicContact CD2-CE1 3.69Å; L278-L296 HydrophobicContact CD2-CD1 4.07Å; L278-L299 HydrophobicContact CB-CD1 3.74Å; L278-L299 HydrophobicContact CB-CD2 4.36Å; L278-E301 PolarHBondContact N-O 3.04Å; L278-L302 HydrophobicContact CB-CD1 3.99Å; L278-L302 HydrophobicContact CD2-CD1 3.89Å; L278-L302 HydrophobicContact CG-CD1 3.91Å; L278-L302 WeakPolarHBondContact O-CA 3.43Å; L278-H303 PolarHBondContact O-N 3.43Å
279	N	98.6	Very high	96.4	Very high	46 Å²	46	38.9 Å²	38.9	25%	0.246	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	117.3	175.3	-171.5	-0.3	0	0	0	110.1	L254 S255 I256 T257 S281 H303	L254-N279 PolarHBondContact O-N 3.16Å; S255-N279 WeakPolarHBondContact CA-O 3.46Å; I256-N279 PolarHBondContact N-O 3.16Å; T257-N279 HydrophobicContact CG2-CB 4.42Å; N279-S281 WeakPolarHBondContact OD1-CB 3.35Å; N279-S281 PolarHBondContact OD1-N 3.27Å; N279-S281 PolarHBondContact OD1-OG 3.14Å; N279-H303 CarbonylContact C-O 3.21Å; N279-H303 WeakPolarHBondContact CA-O 3.38Å; N279-H303 HydrophobicContact CB-CB 4.16Å; N279-H303 WeakPolarHBondContact OD1-CB 3.26Å; N279-H303 PolarHBondContact OD1-O 2.84Å
280	L	97.7	Very high	96.3	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.214	C	C	.	.			trans	-120.9	27.3	175.8	-59.3	176	0	0	0	111	I256 V264 L278 N283 I285 F293 H303 I304	I256-L280 HydrophobicContact CB-CD2 4.02Å; I256-L280 HydrophobicContact CD1-CD2 4.21Å; I256-L280 WeakPolarHBondContact O-CA 3.27Å; V264-L280 HydrophobicContact CG1-CD1 4.03Å; V264-L280 HydrophobicContact CG2-CD1 4.43Å; L278-L280 HydrophobicContact CD1-CD2 4.08Å; L278-L280 HydrophobicContact CD1-CG 4.07Å; L278-L280 HydrophobicContact CD2-CD1 4.26Å; L278-L280 HydrophobicContact CG-CD1 4.43Å; L278-L280 HydrophobicContact CG-CG 4.15Å; L280-N283 PolarHBondContact O-ND2 3.33Å; L280-I285 HydrophobicContact CB-CD1 4.26Å; L280-F293 HydrophobicContact CD1-CE1 4.46Å; L280-H303 PolarHBondContact N-O 3.3Å; L280-I304 HydrophobicContact CB-CG1 4.37Å
281	S	98.1	Very high	96	Very high	5 Å²	5	37.9 Å²	37.9	4%	0.035	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	151.5	-178.1	-56.6	0	0	0	0	112.6	T257 N258 N279 N283 V305	T257-S281 VanDerWaalsContact CA-O 3.25Å; T257-S281 WeakPolarHBondContact CA-O 3.27Å; N258-S281 PolarHBondContact N-O 2.98Å; N279-S281 WeakPolarHBondContact OD1-CB 3.35Å; N279-S281 PolarHBondContact OD1-N 3.27Å; N279-S281 PolarHBondContact OD1-OG 3.14Å; S281-N283 VanDerWaalsContact C-N 3.28Å; S281-N283 PolarHBondContact O-N 3.4Å; S281-N283 PolarHBondContact O-ND2 3.09Å; S281-V305 CarbonylContact C-O 3.11Å; S281-V305 VanDerWaalsContact CA-O 3.26Å; S281-V305 WeakPolarHBondContact CA-O 3.38Å; S281-V305 WeakPolarHBondContact CB-O 3.47Å; S281-V305 PolarHBondContact OG-N 2.87Å
282	Y	97.4	Very high	95.8	Very high	105 Å²	105	35.3 Å²	35.3	41%	0.412	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.8	38.2	177.5	-48.1	-73.3	0	0	0	113.5	N258 V305	N258-Y282 VanDerWaalsContact CA-O 3.29Å; N258-Y282 WeakPolarHBondContact CA-O 3.09Å; N258-Y282 PolarHBondContact N-O 3.26Å; N258-Y282 VanDerWaalsContact OD1-CB 3.24Å; N258-Y282 WeakPolarHBondContact OD1-CB 3.48Å; Y282-V305 HydrophobicContact CE1-CG1 4.48Å; Y282-V305 PolarHBondContact N-O 3.21Å
283	N	96.9	Very high	95.8	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.005	19%	0.194	C	C	.	.	S	Bend	trans	-115.3	141.7	168.2	-61.7	-57.2	0	0	0	108.8	I256 T259 L261 L280 S281 I285 A307	I256-N283 PolarHBondContact O-ND2 3.27Å; T259-N283 WeakPolarHBondContact CA-OD1 3.42Å; T259-N283 WeakPolarHBondContact CB-OD1 3.48Å; T259-N283 PolarHBondContact N-OD1 3.3Å; T259-N283 PolarHBondContact O-OD1 3.35Å; T259-N283 PolarHBondContact OG1-OD1 2.72Å; L261-N283 HydrophobicContact CB-CB 4.23Å; L280-N283 PolarHBondContact O-ND2 3.33Å; S281-N283 VanDerWaalsContact C-N 3.28Å; S281-N283 PolarHBondContact O-N 3.4Å; S281-N283 PolarHBondContact O-ND2 3.09Å; N283-I285 HydrophobicContact CB-CD1 3.88Å; N283-I285 HydrophobicContact CB-CG1 3.9Å; N283-I285 PolarHBondContact O-N 3.42Å; N283-A307 CarbonylContact O-C 3.58Å; N283-A307 VanDerWaalsContact O-C 3.32Å; N283-A307 WeakPolarHBondContact O-CA 3.32Å; N283-A307 WeakPolarHBondContact O-CB 3.35Å
284	P	96.4	Very high	95.7	Very high	37 Å²	37	35 Å²	35	24%	0.24	19%	0.194	C	C	.	.			trans	-72.9	57.2	-177.2	32.1	-37.4	0	0	0	113.6	T259 L261 S262 A307	T259-P284 VanDerWaalsContact O-CD 3.22Å; T259-P284 WeakPolarHBondContact O-CD 3.4Å; L261-P284 CarbonylContact O-C 3.29Å; L261-P284 VanDerWaalsContact O-CD 3.24Å; L261-P284 WeakPolarHBondContact O-CD 3.34Å; L261-P284 WeakPolarHBondContact O-CG 3.07Å; S262-P284 WeakPolarHBondContact CA-O 3.37Å; P284-A307 CarbonylContact C-O 3.46Å
285	I	96.4	Very high	95.5	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.19	C	C	.	.			trans	-89.8	105.9	-179	-58.4	171.3	0	0	0	109.6	L261 V264 L280 N283 A307 L309	L261-I285 WeakPolarHBondContact O-CG1 3.4Å; V264-I285 HydrophobicContact CG2-CD1 4.19Å; V264-I285 HydrophobicContact CG2-CG2 3.9Å; L280-I285 HydrophobicContact CB-CD1 4.26Å; N283-I285 HydrophobicContact CB-CD1 3.88Å; N283-I285 HydrophobicContact CB-CG1 3.9Å; N283-I285 PolarHBondContact O-N 3.42Å; I285-A307 CarbonylContact C-O 3.5Å; I285-A307 HydrophobicContact CB-CB 4.4Å; I285-A307 PolarHBondContact N-O 3.06Å; I285-L309 WeakPolarHBondContact O-CA 3.25Å; I285-L309 PolarHBondContact O-N 2.94Å
286	S	95.4	Very high	95.3	Very high	52 Å²	52	33 Å²	33	36%	0.364	19%	0.19	S	C	.	.			trans	-78	-31.6	-177.1	57.1	0	0	0	0	114.6	R310	S286-R310 PolarHBondContact O-N 2.83Å
287	T	95.4	Very high	95.1	Very high	48 Å²	48	35.7 Å²	35.7	29%	0.294	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	143.3	-171.3	56.1	0	0	0	0	111.4	T311	T287-T311 WeakPolarHBondContact CA-O 3.05Å; T287-T311 WeakPolarHBondContact CG2-OG1 3.31Å
288	I	96.3	Very high	95	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	121.6	167.5	-62.8	170.3	0	0	0	107.7	V264 M292 F293 I304 L309 T311 I312 E313 S316 F317	V264-I288 HydrophobicContact CG2-CG1 4.35Å; I288-M292 HydrophobicContact CG2-SD 4.45Å; I288-F293 HydrophobicContact CD1-CE2 4.5Å; I288-F293 HydrophobicContact CG2-CD2 4.28Å; I288-F293 HydrophobicContact CG2-CE2 3.62Å; I288-I304 HydrophobicContact CD1-CD1 3.46Å; I288-I304 VanDerWaalsContact CD1-CD1 3.46Å; I288-I304 HydrophobicContact CG1-CD1 4.48Å; I288-L309 HydrophobicContact CD1-CD1 4.1Å; I288-L309 HydrophobicContact CD1-CD2 3.84Å; I288-L309 HydrophobicContact CG1-CD1 3.76Å; I288-L309 HydrophobicContact CG1-CD2 4.42Å; I288-T311 PolarHBondContact N-O 3.32Å; I288-I312 HydrophobicContact CB-CG2 4.24Å; I288-I312 HydrophobicContact CD1-CD1 4.48Å; I288-I312 HydrophobicContact CD1-CG1 4.2Å; I288-I312 HydrophobicContact CG2-CG2 4.47Å; I288-E313 PolarHBondContact O-N 2.72Å; I288-S316 PolarHBondContact O-OG 3.04Å; I288-S316 VanDerWaalsContact O-OG 3.13Å; I288-F317 HydrophobicContact CD1-CE1 4.4Å; I288-F317 HydrophobicContact CD1-CZ 4.32Å; I288-F317 HydrophobicContact CG2-CE1 4.44Å
289	E	93.9	Very high	94.9	Very high	95 Å²	95	37.4 Å²	37.4	44%	0.444	21%	0.207	S	C	.	.			trans	-90.7	158.9	-178.9	-54.9	178.6	169.6	0	0	112.1	G291 M292 S316	E289-G291 PolarHBondContact O-N 3.19Å; E289-M292 HydrophobicContact CB-CE 3.57Å; E289-M292 HydrophobicContact CB-CG 4.12Å; E289-M292 HydrophobicContact CB-SD 3.86Å; E289-M292 HydrophobicContact CG-CE 3.49Å; E289-M292 VanDerWaalsContact CG-CE 3.49Å; E289-M292 HydrophobicContact CG-SD 4.27Å; E289-M292 PolarHBondContact N-SD 3.04Å; E289-M292 WeakPolarHBondContact O-CG 2.91Å; E289-M292 PolarHBondContact O-N 3.04Å; E289-M292 WeakPolarHBondContact OE2-CE 3.21Å; E289-S316 PolarHBondContact O-OG 2.94Å
290	A	92.1	Very high	94.9	Very high	55 Å²	55	38.4 Å²	38.4	46%	0.455	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	131.9	177.2	0	0	0	0	0	112.5	M292 E313	A290-M292 VanDerWaalsContact C-N 3.32Å; A290-M292 PolarHBondContact O-N 3.39Å; A290-E313 PolarHBondContact N-OE2 2.81Å
291	G	87.1	Confident	94.9	Very high	26 Å²	26	41.3 Å²	41.3	27%	0.268	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.2	2	173.3	0	0	0	0	0	116.4	E289 F293 S294	E289-G291 PolarHBondContact O-N 3.19Å; G291-F293 PolarHBondContact O-N 3.27Å; G291-F293 VanDerWaalsContact O-N 3.1Å; G291-S294 PolarHBondContact O-N 2.87Å; G291-S294 PolarHBondContact O-OG 3.24Å; G291-S294 VanDerWaalsContact O-OG 3.06Å
292	M	91.3	Very high	94.8	Very high	17 Å²	17	41 Å²	41	8%	0.084	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-24.4	177.7	-75.5	-179.1	161.8	0	0	113.9	V264 F266 I288 E289 A290	V264-M292 HydrophobicContact CB-SD 3.83Å; V264-M292 HydrophobicContact CG1-SD 4.43Å; V264-M292 HydrophobicContact CG2-SD 4.18Å; F266-M292 HydrophobicContact CB-CB 4.11Å; F266-M292 HydrophobicContact CB-CG 4.38Å; F266-M292 VanDerWaalsContact CB-O 3.24Å; F266-M292 WeakPolarHBondContact CB-O 3.1Å; F266-M292 HydrophobicContact CD1-CE 4.29Å; F266-M292 HydrophobicContact CD1-CG 4.14Å; F266-M292 HydrophobicContact CG-CG 4.33Å; I288-M292 HydrophobicContact CG2-SD 4.45Å; E289-M292 HydrophobicContact CB-CE 3.57Å; E289-M292 HydrophobicContact CB-CG 4.12Å; E289-M292 HydrophobicContact CB-SD 3.86Å; E289-M292 HydrophobicContact CG-CE 3.49Å; E289-M292 VanDerWaalsContact CG-CE 3.49Å; E289-M292 HydrophobicContact CG-SD 4.27Å; E289-M292 PolarHBondContact N-SD 3.04Å; E289-M292 WeakPolarHBondContact O-CG 2.91Å; E289-M292 PolarHBondContact O-N 3.04Å; E289-M292 WeakPolarHBondContact OE2-CE 3.21Å; A290-M292 VanDerWaalsContact C-N 3.32Å; A290-M292 PolarHBondContact O-N 3.39Å
293	F	94.4	Very high	94.9	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.9	10.2	-178.9	-56.2	-72	0	0	0	113.7	V264 F269 L278 L280 I288 G291 D295 L296 L302 I304 F317 L320	V264-F293 HydrophobicContact CG1-CE1 3.76Å; V264-F293 HydrophobicContact CG1-CZ 3.69Å; V264-F293 HydrophobicContact CG2-CZ 4.19Å; F269-F293 HydrophobicContact CE2-CD1 4.06Å; F269-F293 HydrophobicContact CE2-CE1 4.12Å; F269-F293 HydrophobicContact CZ-CD1 4.36Å; F269-F293 AromaticContact CZ-CE1 3.95Å; F269-F293 HydrophobicContact CZ-CE1 3.95Å; L278-F293 HydrophobicContact CD2-CD1 4.09Å; L278-F293 HydrophobicContact CD2-CE1 3.69Å; L280-F293 HydrophobicContact CD1-CE1 4.46Å; I288-F293 HydrophobicContact CD1-CE2 4.5Å; I288-F293 HydrophobicContact CG2-CD2 4.28Å; I288-F293 HydrophobicContact CG2-CE2 3.62Å; G291-F293 PolarHBondContact O-N 3.27Å; G291-F293 VanDerWaalsContact O-N 3.1Å; F293-D295 PolarHBondContact O-N 3.28Å; F293-D295 VanDerWaalsContact O-N 3.11Å; F293-L296 HydrophobicContact CD1-CD1 3.93Å; F293-L296 PolarHBondContact O-N 3.06Å; F293-L302 HydrophobicContact CE2-CD2 4.38Å; F293-L302 HydrophobicContact CZ-CD2 4.46Å; F293-I304 HydrophobicContact CZ-CD1 4.46Å; F293-F317 AromaticContact CD2-CD1 3.85Å; F293-F317 HydrophobicContact CD2-CD1 3.85Å; F293-F317 AromaticContact CD2-CE1 3.93Å; F293-F317 HydrophobicContact CD2-CE1 3.93Å; F293-F317 HydrophobicContact CE2-CD1 4.3Å; F293-F317 AromaticContact CE2-CE1 3.9Å; F293-F317 HydrophobicContact CE2-CE1 3.9Å; F293-L320 HydrophobicContact CB-CD1 3.89Å; F293-L320 HydrophobicContact CB-CD2 4.07Å; F293-L320 HydrophobicContact CB-CG 4.18Å; F293-L320 VanDerWaalsContact O-CD2 3.26Å; F293-L320 WeakPolarHBondContact O-CD2 3.24Å
294	S	92.3	Very high	94.9	Very high	47 Å²	47	38 Å²	38	33%	0.329	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-31.1	-167.4	55.8	0	0	0	0	115.1	G291 Q318	G291-S294 PolarHBondContact O-N 2.87Å; G291-S294 PolarHBondContact O-OG 3.24Å; G291-S294 VanDerWaalsContact O-OG 3.06Å; S294-Q318 WeakPolarHBondContact CA-O 3.23Å
295	D	92.7	Very high	94.9	Very high	62 Å²	62	36.9 Å²	36.9	33%	0.332	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-12.3	-177.2	-57.7	-87.9	0	0	0	113.2	K270 F293 I297	K270-D295 WeakPolarHBondContact CE-OD1 3.39Å; K270-D295 WeakPolarHBondContact CE-OD2 3.41Å; K270-D295 HydrophobicContact CG-CB 3.93Å; K270-D295 WeakPolarHBondContact CG-OD2 3.46Å; K270-D295 WeakPolarHBondContact O-CB 3.27Å; F293-D295 PolarHBondContact O-N 3.28Å; F293-D295 VanDerWaalsContact O-N 3.11Å; D295-I297 PolarHBondContact O-N 2.84Å
296	L	94.8	Very high	95	Very high	2 Å²	2	37.9 Å²	37.9	1%	0.01	21%	0.214	C	C	.	.			trans	-82.6	57.6	-178.8	-55.5	-176.5	0	0	0	111.4	F269 L272 L275 L278 F293 R298 L299 L320	F269-L296 HydrophobicContact CD2-CD1 3.98Å; F269-L296 HydrophobicContact CD2-CD2 4.35Å; F269-L296 HydrophobicContact CE2-CD1 3.99Å; L272-L296 HydrophobicContact CB-CD2 4.45Å; L275-L296 HydrophobicContact CB-CD2 4.5Å; L275-L296 HydrophobicContact CD2-CD1 4.27Å; L275-L296 HydrophobicContact CD2-CD2 4.5Å; L278-L296 HydrophobicContact CD2-CD1 4.07Å; F293-L296 HydrophobicContact CD1-CD1 3.93Å; F293-L296 PolarHBondContact O-N 3.06Å; L296-R298 PolarHBondContact O-N 2.84Å; L296-L299 HydrophobicContact CB-CB 4.16Å; L296-L299 HydrophobicContact CD1-CD2 4.3Å; L296-L299 WeakPolarHBondContact O-CB 3.05Å; L296-L299 PolarHBondContact O-N 3.14Å; L296-L320 HydrophobicContact CB-CD2 3.98Å; L296-L320 WeakPolarHBondContact O-CD2 3.46Å
297	I	93.3	Very high	94.9	Very high	87 Å²	87	35.4 Å²	35.4	45%	0.446	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-16.5	-169	60.1	168.3	0	0	0	115.1	D295 F322	D295-I297 PolarHBondContact O-N 2.84Å; I297-F322 VanDerWaalsContact O-CD2 3.29Å; I297-F322 WeakPolarHBondContact O-CD2 3.34Å
298	R	96	Very high	94.9	Very high	100 Å²	100	38.8 Å²	38.8	38%	0.377	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	3.8	179.4	-68.1	-162.7	179.4	101.1	-10.3	113.8	V273 L275 L296 Q300	V273-R298 PolarHBondContact O-NH1 3.02Å; L275-R298 CarbonylContact O-C 3.46Å; L296-R298 PolarHBondContact O-N 2.84Å; R298-Q300 WeakPolarHBondContact O-CG 3.42Å; R298-Q300 PolarHBondContact O-N 2.72Å
299	L	97	Very high	95	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.209	C	C	.	.			trans	-63.4	129.7	-176.8	-159.6	71.4	0	0	0	110.5	L275 L278 L296 L302 L320 F322 L323	L275-L299 HydrophobicContact CB-CD1 4.47Å; L275-L299 HydrophobicContact CD2-CD1 4.1Å; L275-L299 HydrophobicContact CG-CD1 4.19Å; L275-L299 WeakPolarHBondContact O-CA 3.14Å; L275-L299 PolarHBondContact O-N 3.36Å; L278-L299 HydrophobicContact CB-CD1 3.74Å; L278-L299 HydrophobicContact CB-CD2 4.36Å; L296-L299 HydrophobicContact CB-CB 4.16Å; L296-L299 HydrophobicContact CD1-CD2 4.3Å; L296-L299 WeakPolarHBondContact O-CB 3.05Å; L296-L299 PolarHBondContact O-N 3.14Å; L299-L302 HydrophobicContact CD2-CB 4.27Å; L299-L302 HydrophobicContact CD2-CD1 4.46Å; L299-L320 HydrophobicContact CB-CD2 3.96Å; L299-L320 HydrophobicContact CD2-CD1 4.02Å; L299-L320 HydrophobicContact CD2-CD2 4.27Å; L299-F322 CarbonylContact O-C 3.29Å; L299-F322 VanDerWaalsContact O-C 3.25Å; L299-L323 PolarHBondContact O-N 3.19Å
300	Q	97.1	Very high	95.1	Very high	67 Å²	67	41.7 Å²	41.7	31%	0.313	22%	0.216	S	C	.	.			trans	-114.2	-37.1	-179	-62.7	-177.9	10.2	0	0	111.6	T276 R298 F322 R324 V325	T276-Q300 PolarHBondContact O-N 3.19Å; R298-Q300 WeakPolarHBondContact O-CG 3.42Å; R298-Q300 PolarHBondContact O-N 2.72Å; Q300-F322 WeakPolarHBondContact CA-O 3.38Å; Q300-F322 HydrophobicContact CG-CB 4.43Å; Q300-R324 PolarHBondContact O-N 3.06Å; Q300-V325 PolarHBondContact O-N 3.32Å
301	E	98	Very high	95.2	Very high	61 Å²	61	42.6 Å²	42.6	29%	0.285	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	126.5	-176.7	-52.5	-164.7	172.7	0	0	110.7	T276 H277 L278 H303 V325	T276-E301 PolarHBondContact O-N 2.94Å; H277-E301 VanDerWaalsContact CD2-CD 3.42Å; H277-E301 IonicContact CD2-OE2 3.11Å; H277-E301 PolarHBondContact CD2-OE2 3.03Å; H277-E301 IonicContact NE2-OE1 2.64Å; H277-E301 IonicContact NE2-OE2 3.98Å; L278-E301 PolarHBondContact N-O 3.04Å; E301-H303 IonicContact OE2-NE2 3.08Å; E301-V325 WeakPolarHBondContact CA-O 3.33Å; E301-V325 HydrophobicContact CB-CB 4.18Å; E301-V325 HydrophobicContact CG-CB 3.94Å; E301-V325 HydrophobicContact CG-CG2 3.98Å
302	L	97.6	Very high	95.6	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	119.7	176.4	-179.5	59.1	0	0	0	110.3	L278 F293 L299 I304 F317 L323 V325 L326 N327	L278-L302 HydrophobicContact CB-CD1 3.99Å; L278-L302 HydrophobicContact CD2-CD1 3.89Å; L278-L302 HydrophobicContact CG-CD1 3.91Å; L278-L302 WeakPolarHBondContact O-CA 3.43Å; F293-L302 HydrophobicContact CE2-CD2 4.38Å; F293-L302 HydrophobicContact CZ-CD2 4.46Å; L299-L302 HydrophobicContact CD2-CB 4.27Å; L299-L302 HydrophobicContact CD2-CD1 4.46Å; L302-I304 HydrophobicContact CD1-CD1 4.09Å; L302-I304 HydrophobicContact CD1-CG1 4.06Å; L302-I304 HydrophobicContact CD2-CD1 4.17Å; L302-I304 HydrophobicContact CG-CD1 4.13Å; L302-I304 HydrophobicContact CG-CG1 4.18Å; L302-F317 HydrophobicContact CD2-CD1 4.15Å; L302-F317 HydrophobicContact CD2-CE1 3.56Å; L302-F317 HydrophobicContact CD2-CZ 4.07Å; L302-L323 HydrophobicContact CB-CD1 3.89Å; L302-V325 PolarHBondContact N-O 3Å; L302-L326 HydrophobicContact CB-CD1 4.12Å; L302-L326 HydrophobicContact CD2-CD1 4Å; L302-L326 HydrophobicContact CG-CD1 4.11Å; L302-N327 PolarHBondContact O-N 3.47Å
303	H	98.1	Very high	95.8	Very high	43 Å²	43	44 Å²	44	20%	0.199	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	121.7	179.4	-64.3	-103.4	0	0	0	110.3	L278 N279 L280 E301	L278-H303 PolarHBondContact O-N 3.43Å; N279-H303 CarbonylContact C-O 3.21Å; N279-H303 WeakPolarHBondContact CA-O 3.38Å; N279-H303 HydrophobicContact CB-CB 4.16Å; N279-H303 WeakPolarHBondContact OD1-CB 3.26Å; N279-H303 PolarHBondContact OD1-O 2.84Å; L280-H303 PolarHBondContact N-O 3.3Å; E301-H303 IonicContact OE2-NE2 3.08Å
304	I	97.2	Very high	95.6	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.233	C	C	.	.			trans	-139.1	62.7	176.8	-50.6	179	0	0	0	107	L280 I288 F293 L302 A307 N327 N331	L280-I304 HydrophobicContact CB-CG1 4.37Å; I288-I304 HydrophobicContact CD1-CD1 3.46Å; I288-I304 VanDerWaalsContact CD1-CD1 3.46Å; I288-I304 HydrophobicContact CG1-CD1 4.48Å; F293-I304 HydrophobicContact CZ-CD1 4.46Å; L302-I304 HydrophobicContact CD1-CD1 4.09Å; L302-I304 HydrophobicContact CD1-CG1 4.06Å; L302-I304 HydrophobicContact CD2-CD1 4.17Å; L302-I304 HydrophobicContact CG-CD1 4.13Å; L302-I304 HydrophobicContact CG-CG1 4.18Å; I304-A307 HydrophobicContact CG2-CB 3.49Å; I304-A307 VanDerWaalsContact CG2-CB 3.49Å; I304-N327 CarbonylContact C-O 3.3Å; I304-N327 PolarHBondContact N-O 3.4Å; I304-N331 PolarHBondContact O-ND2 3.46Å
305	V	97.6	Very high	95.7	Very high	12 Å²	12	49.1 Å²	49.1	7%	0.073	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	138.7	-178.3	-178.2	0	0	0	0	109.7	S281 Y282 A307 N327 S329 Q330	S281-V305 CarbonylContact C-O 3.11Å; S281-V305 VanDerWaalsContact CA-O 3.26Å; S281-V305 WeakPolarHBondContact CA-O 3.38Å; S281-V305 WeakPolarHBondContact CB-O 3.47Å; S281-V305 PolarHBondContact OG-N 2.87Å; Y282-V305 HydrophobicContact CE1-CG1 4.48Å; Y282-V305 PolarHBondContact N-O 3.21Å; V305-A307 VanDerWaalsContact C-N 3.27Å; V305-A307 PolarHBondContact O-N 2.95Å; V305-N327 HydrophobicContact CG2-CB 4.25Å; V305-N327 VanDerWaalsContact CG2-CG 3.43Å; V305-N327 VanDerWaalsContact CG2-OD1 3.3Å; V305-N327 WeakPolarHBondContact CG2-OD1 3.19Å; V305-S329 WeakPolarHBondContact CA-O 3.46Å; V305-S329 WeakPolarHBondContact CG1-O 3.16Å; V305-S329 WeakPolarHBondContact CG1-OG 3.08Å; V305-Q330 HydrophobicContact CG1-CB 4.23Å; V305-Q330 HydrophobicContact CG1-CG 4.3Å
306	G	96.6	Very high	95.8	Very high	21 Å²	21	46.2 Å²	46.2	22%	0.216	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.7	24.9	170.2	0	0	0	0	0	114.7	S329 Q330	G306-S329 PolarHBondContact N-O 2.79Å; G306-S329 VanDerWaalsContact N-O 3.09Å; G306-Q330 WeakPolarHBondContact CA-O 3.39Å; G306-Q330 PolarHBondContact N-O 2.71Å
307	A	94.4	Very high	95.8	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.223	C	C	.	.	S	Bend	trans	-95	0.9	-170.7	0	0	0	0	0	114.8	N283 P284 I285 I304 V305 L309 N331	N283-A307 CarbonylContact O-C 3.58Å; N283-A307 VanDerWaalsContact O-C 3.32Å; N283-A307 WeakPolarHBondContact O-CA 3.32Å; N283-A307 WeakPolarHBondContact O-CB 3.35Å; P284-A307 CarbonylContact C-O 3.46Å; I285-A307 CarbonylContact C-O 3.5Å; I285-A307 HydrophobicContact CB-CB 4.4Å; I285-A307 PolarHBondContact N-O 3.06Å; I304-A307 HydrophobicContact CG2-CB 3.49Å; I304-A307 VanDerWaalsContact CG2-CB 3.49Å; V305-A307 VanDerWaalsContact C-N 3.27Å; V305-A307 PolarHBondContact O-N 2.95Å; A307-L309 PolarHBondContact O-N 3.14Å; A307-N331 WeakPolarHBondContact CA-OD1 3.11Å; A307-N331 PolarHBondContact N-OD1 3.13Å
308	Q	95.9	Very high	95.6	Very high	119 Å²	119	47.1 Å²	47.1	56%	0.556	23%	0.226	S	C	*	.			trans	64.4	24.9	-173.1	-47.6	178.1	-8.2	0	0	114	R310 N331 L332	Q308-R310 PolarHBondContact O-N 2.95Å; Q308-N331 PolarHBondContact N-OD1 3.47Å; Q308-L332 HydrophobicContact CB-CD1 4.44Å
309	L	97.1	Very high	95.2	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.217	C	C	.	.			trans	-64.6	123.5	-177.5	-171.1	65.7	0	0	0	111.1	I285 I288 A307 I312 V328 N331 L332 L333	I285-L309 WeakPolarHBondContact O-CA 3.25Å; I285-L309 PolarHBondContact O-N 2.94Å; I288-L309 HydrophobicContact CD1-CD1 4.1Å; I288-L309 HydrophobicContact CD1-CD2 3.84Å; I288-L309 HydrophobicContact CG1-CD1 3.76Å; I288-L309 HydrophobicContact CG1-CD2 4.42Å; A307-L309 PolarHBondContact O-N 3.14Å; L309-I312 HydrophobicContact CD1-CG1 4.46Å; L309-I312 HydrophobicContact CD2-CD1 3.72Å; L309-I312 HydrophobicContact CD2-CG1 3.65Å; L309-I312 HydrophobicContact CG-CG1 4.19Å; L309-V328 HydrophobicContact CD2-CG1 4.39Å; L309-N331 HydrophobicContact CB-CB 3.94Å; L309-N331 WeakPolarHBondContact CB-OD1 3.47Å; L309-N331 PolarHBondContact N-OD1 3.05Å; L309-L332 CarbonylContact O-C 3.22Å; L309-L332 VanDerWaalsContact O-CA 3.3Å; L309-L332 WeakPolarHBondContact O-CA 3.43Å; L309-L332 PolarHBondContact O-N 3.11Å; L309-L333 HydrophobicContact CB-CD2 4.42Å; L309-L333 HydrophobicContact CD2-CD1 4.29Å; L309-L333 HydrophobicContact CD2-CD2 4.05Å; L309-L333 HydrophobicContact CD2-CG 4.43Å; L309-L333 HydrophobicContact CG-CD2 3.82Å; L309-L333 HydrophobicContact CG-CG 4.42Å; L309-L333 PolarHBondContact O-N 3.42Å; L309-L333 VanDerWaalsContact O-N 3.17Å
310	R	96	Very high	95	Very high	156 Å²	156	43.5 Å²	43.5	59%	0.589	22%	0.218	S	C	*	.			trans	-101.6	-41.5	-179.8	-66.7	179.3	-179.7	-92.2	-0.2	112.4	S286 Q308 L332	S286-R310 PolarHBondContact O-N 2.83Å; Q308-R310 PolarHBondContact O-N 2.95Å; R310-L332 HydrophobicContact CG-CB 4.13Å; R310-L332 HydrophobicContact CG-CD1 4.49Å
311	T	94.6	Very high	94.7	Very high	75 Å²	75	48.7 Å²	48.7	46%	0.46	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	144.9	-178.1	61.6	0	0	0	0	111.4	T287 I288	T287-T311 WeakPolarHBondContact CA-O 3.05Å; T287-T311 WeakPolarHBondContact CG2-OG1 3.31Å; I288-T311 PolarHBondContact N-O 3.32Å
312	I	96.6	Very high	94.5	Very high	20 Å²	20	51.7 Å²	51.7	10%	0.103	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	117	168.1	-58.8	171.8	0	0	0	105.7	I288 L309 F317 V328 L333 L336 V340	I288-I312 HydrophobicContact CB-CG2 4.24Å; I288-I312 HydrophobicContact CD1-CD1 4.48Å; I288-I312 HydrophobicContact CD1-CG1 4.2Å; I288-I312 HydrophobicContact CG2-CG2 4.47Å; L309-I312 HydrophobicContact CD1-CG1 4.46Å; L309-I312 HydrophobicContact CD2-CD1 3.72Å; L309-I312 HydrophobicContact CD2-CG1 3.65Å; L309-I312 HydrophobicContact CG-CG1 4.19Å; I312-F317 HydrophobicContact CD1-CZ 4.45Å; I312-F317 HydrophobicContact CG2-CE2 4.31Å; I312-F317 HydrophobicContact CG2-CZ 4.18Å; I312-V328 HydrophobicContact CD1-CG1 4.42Å; I312-L333 HydrophobicContact CD1-CD1 4.08Å; I312-L333 HydrophobicContact CD1-CD2 4.18Å; I312-L333 HydrophobicContact CG1-CD2 4.01Å; I312-L336 HydrophobicContact CD1-CD1 3.92Å; I312-V340 HydrophobicContact CG2-CB 4.48Å; I312-V340 HydrophobicContact CG2-CG1 3.4Å; I312-V340 HydrophobicContact CG2-CG2 4.2Å
313	E	93.9	Very high	94.4	Very high	53 Å²	53	52 Å²	52	25%	0.248	25%	0.248	C	C	.	.			trans	-68.2	150.5	-176.3	-66.7	-164.9	149.6	0	0	111.3	I288 A290 H315 S316 K455	I288-E313 PolarHBondContact O-N 2.72Å; A290-E313 PolarHBondContact N-OE2 2.81Å; E313-H315 PolarHBondContact O-N 2.91Å; E313-S316 PolarHBondContact N-OG 3.04Å; E313-S316 VanDerWaalsContact O-CB 3.27Å; E313-S316 WeakPolarHBondContact O-CB 3.12Å; E313-S316 PolarHBondContact O-N 3.13Å; E313-S316 VanDerWaalsContact O-N 3.14Å; E313-S316 PolarHBondContact O-OG 2.83Å; E313-K455 IonicContact OE1-NZ 2.72Å; E313-K455 PolarHBondContact OE1-NZ 2.8Å; E313-K455 IonicContact OE2-NZ 3.95Å
314	P	91.9	Very high	94.3	Very high	55 Å²	55	55 Å²	55	36%	0.357	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.1	142	170.1	-27.4	36.1	0	0	0	111.1	S316	P314-S316 PolarHBondContact O-N 3.4Å
315	H	93.6	Very high	94.3	Very high	99 Å²	99	56 Å²	56	46%	0.458	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.9	14.5	-178.3	-44.4	-47.1	0	0	0	115.9	E313 F317 Q318 N339	E313-H315 PolarHBondContact O-N 2.91Å; H315-F317 VanDerWaalsContact C-N 3.28Å; H315-F317 PolarHBondContact O-N 3.3Å; H315-Q318 HydrophobicContact CB-CB 4.19Å; H315-Q318 WeakPolarHBondContact O-CB 3.09Å; H315-Q318 PolarHBondContact O-N 3.48Å; H315-Q318 VanDerWaalsContact O-N 3.11Å; H315-N339 PolarHBondContact N-O 3.26Å; H315-N339 PolarHBondContact ND1-O 3.37Å
316	S	94.5	Very high	94.3	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-36.5	173.9	-67.3	0	0	0	0	114.1	I288 E289 E313 P314	I288-S316 PolarHBondContact O-OG 3.04Å; I288-S316 VanDerWaalsContact O-OG 3.13Å; E289-S316 PolarHBondContact O-OG 2.94Å; E313-S316 PolarHBondContact N-OG 3.04Å; E313-S316 VanDerWaalsContact O-CB 3.27Å; E313-S316 WeakPolarHBondContact O-CB 3.12Å; E313-S316 PolarHBondContact O-N 3.13Å; E313-S316 VanDerWaalsContact O-N 3.14Å; E313-S316 PolarHBondContact O-OG 2.83Å; P314-S316 PolarHBondContact O-N 3.4Å
317	F	94.3	Very high	94.3	Very high	1 Å²	1	55.8 Å²	55.8	0%	0.004	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-101.5	23.7	178.1	-53.9	-38.5	0	0	0	112.2	I288 F293 L302 I312 H315 G319 L320 L323 L326 V340 F341	I288-F317 HydrophobicContact CD1-CE1 4.4Å; I288-F317 HydrophobicContact CD1-CZ 4.32Å; I288-F317 HydrophobicContact CG2-CE1 4.44Å; F293-F317 AromaticContact CD2-CD1 3.85Å; F293-F317 HydrophobicContact CD2-CD1 3.85Å; F293-F317 AromaticContact CD2-CE1 3.93Å; F293-F317 HydrophobicContact CD2-CE1 3.93Å; F293-F317 HydrophobicContact CE2-CD1 4.3Å; F293-F317 AromaticContact CE2-CE1 3.9Å; F293-F317 HydrophobicContact CE2-CE1 3.9Å; L302-F317 HydrophobicContact CD2-CD1 4.15Å; L302-F317 HydrophobicContact CD2-CE1 3.56Å; L302-F317 HydrophobicContact CD2-CZ 4.07Å; I312-F317 HydrophobicContact CD1-CZ 4.45Å; I312-F317 HydrophobicContact CG2-CE2 4.31Å; I312-F317 HydrophobicContact CG2-CZ 4.18Å; H315-F317 VanDerWaalsContact C-N 3.28Å; H315-F317 PolarHBondContact O-N 3.3Å; F317-G319 PolarHBondContact O-N 2.95Å; F317-L320 HydrophobicContact CB-CD1 3.92Å; F317-L320 HydrophobicContact CB-CG 4.37Å; F317-L320 HydrophobicContact CD1-CD1 3.97Å; F317-L320 HydrophobicContact CG-CD1 4.23Å; F317-L320 WeakPolarHBondContact O-CB 3.49Å; F317-L320 PolarHBondContact O-N 3.45Å; F317-L323 HydrophobicContact CD2-CD2 4.43Å; F317-L323 HydrophobicContact CG-CD2 4.45Å; F317-L326 HydrophobicContact CE2-CD1 4.19Å; F317-L326 HydrophobicContact CE2-CD2 3.77Å; F317-L326 HydrophobicContact CZ-CD1 4.09Å; F317-L326 HydrophobicContact CZ-CD2 4.41Å; F317-V340 WeakPolarHBondContact CA-O 3.21Å; F317-V340 WeakPolarHBondContact CB-O 3.31Å; F317-V340 HydrophobicContact CD2-CG1 3.4Å; F317-V340 VanDerWaalsContact CD2-CG1 3.4Å; F317-V340 HydrophobicContact CE2-CG1 3.61Å; F317-V340 HydrophobicContact CG-CG1 4.09Å; F317-V340 HydrophobicContact CZ-CG1 4.46Å; F317-V340 PolarHBondContact N-O 3.1Å; F317-F341 AromaticContact CD2-CD1 3.9Å; F317-F341 HydrophobicContact CD2-CD1 3.9Å; F317-F341 AromaticContact CD2-CE1 3.71Å; F317-F341 HydrophobicContact CD2-CE1 3.71Å; F317-F341 HydrophobicContact CD2-CZ 4.26Å; F317-F341 HydrophobicContact CE2-CE1 4.16Å; F317-F341 HydrophobicContact CE2-CZ 4.39Å
318	Q	90.6	Very high	94.5	Very high	108 Å²	108	55.8 Å²	55.8	51%	0.505	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	135.9	172.5	-173.9	174.2	3.5	0	0	109.9	S294 H315 L320	S294-Q318 WeakPolarHBondContact CA-O 3.23Å; H315-Q318 HydrophobicContact CB-CB 4.19Å; H315-Q318 WeakPolarHBondContact O-CB 3.09Å; H315-Q318 PolarHBondContact O-N 3.48Å; H315-Q318 VanDerWaalsContact O-N 3.11Å; Q318-L320 VanDerWaalsContact C-N 3.32Å; Q318-L320 PolarHBondContact O-N 3.06Å
319	G	87.3	Confident	94.5	Very high	18 Å²	18	50.5 Å²	50.5	19%	0.186	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.8	-20.9	-176.9	0	0	0	0	0	114.8	F317 R321	F317-G319 PolarHBondContact O-N 2.95Å; G319-R321 VanDerWaalsContact C-N 3.28Å; G319-R321 PolarHBondContact O-N 3.06Å
320	L	93.3	Very high	94.5	Very high	5 Å²	5	55.1 Å²	55.1	3%	0.026	26%	0.256	C	S	.	.			trans	-78.8	70.5	178	-56	-170.6	0	0	0	112	F293 L296 L299 F317 Q318 F322 L323	F293-L320 HydrophobicContact CB-CD1 3.89Å; F293-L320 HydrophobicContact CB-CD2 4.07Å; F293-L320 HydrophobicContact CB-CG 4.18Å; F293-L320 VanDerWaalsContact O-CD2 3.26Å; F293-L320 WeakPolarHBondContact O-CD2 3.24Å; L296-L320 HydrophobicContact CB-CD2 3.98Å; L296-L320 WeakPolarHBondContact O-CD2 3.46Å; L299-L320 HydrophobicContact CB-CD2 3.96Å; L299-L320 HydrophobicContact CD2-CD1 4.02Å; L299-L320 HydrophobicContact CD2-CD2 4.27Å; F317-L320 HydrophobicContact CB-CD1 3.92Å; F317-L320 HydrophobicContact CB-CG 4.37Å; F317-L320 HydrophobicContact CD1-CD1 3.97Å; F317-L320 HydrophobicContact CG-CD1 4.23Å; F317-L320 WeakPolarHBondContact O-CB 3.49Å; F317-L320 PolarHBondContact O-N 3.45Å; Q318-L320 VanDerWaalsContact C-N 3.32Å; Q318-L320 PolarHBondContact O-N 3.06Å; L320-F322 VanDerWaalsContact C-N 3.28Å; L320-F322 PolarHBondContact O-N 2.8Å; L320-L323 HydrophobicContact CB-CB 4.11Å; L320-L323 HydrophobicContact CD1-CD2 4.28Å
321	R	89.8	Confident	94.6	Very high	177 Å²	177	48 Å²	48	67%	0.668	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70	-22.7	-173	-63.9	-178.5	-175.5	-175	1.6	114.4	G319	G319-R321 VanDerWaalsContact C-N 3.28Å; G319-R321 PolarHBondContact O-N 3.06Å
322	F	93.6	Very high	94.7	Very high	124 Å²	124	47.9 Å²	47.9	54%	0.544	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.3	16.6	-176	-56	-75.2	0	0	0	112.8	I297 L299 Q300 L320 R324	I297-F322 VanDerWaalsContact O-CD2 3.29Å; I297-F322 WeakPolarHBondContact O-CD2 3.34Å; L299-F322 CarbonylContact O-C 3.29Å; L299-F322 VanDerWaalsContact O-C 3.25Å; Q300-F322 WeakPolarHBondContact CA-O 3.38Å; Q300-F322 HydrophobicContact CG-CB 4.43Å; L320-F322 VanDerWaalsContact C-N 3.28Å; L320-F322 PolarHBondContact O-N 2.8Å; F322-R324 WeakPolarHBondContact O-CG 3.4Å; F322-R324 PolarHBondContact O-N 3.35Å; F322-R324 VanDerWaalsContact O-N 3.11Å
323	L	95.9	Very high	94.8	Very high	5 Å²	5	47 Å²	47	3%	0.026	22%	0.221	C	C	.	.			trans	-67.3	110.6	178.1	-172.2	70.3	0	0	0	109.8	L299 L302 F317 L320 F341 A346 L347	L299-L323 PolarHBondContact O-N 3.19Å; L302-L323 HydrophobicContact CB-CD1 3.89Å; F317-L323 HydrophobicContact CD2-CD2 4.43Å; F317-L323 HydrophobicContact CG-CD2 4.45Å; L320-L323 HydrophobicContact CB-CB 4.11Å; L320-L323 HydrophobicContact CD1-CD2 4.28Å; L323-F341 HydrophobicContact CD2-CD1 4.37Å; L323-F341 HydrophobicContact CD2-CE1 4.22Å; L323-A346 CarbonylContact O-C 3.25Å; L323-L347 HydrophobicContact CG-CD1 4.42Å
324	R	95.8	Very high	94.8	Very high	106 Å²	106	50 Å²	50	40%	0.4	24%	0.235	S	C	.	.			trans	-102.1	-36.9	-178	-66.1	173.9	77.3	-158.9	-0.3	111.7	Q300 F322 L347 E348 V349	Q300-R324 PolarHBondContact O-N 3.06Å; F322-R324 WeakPolarHBondContact O-CG 3.4Å; F322-R324 PolarHBondContact O-N 3.35Å; F322-R324 VanDerWaalsContact O-N 3.11Å; R324-L347 WeakPolarHBondContact O-CD1 3.38Å; R324-E348 IonicContact CZ-OE1 3.42Å; R324-E348 IonicContact CZ-OE2 2.77Å; R324-E348 VanDerWaalsContact CZ-OE2 3.28Å; R324-E348 IonicContact NE-OE1 3.94Å; R324-E348 PolarHBondContact NE-OE1 3.25Å; R324-E348 IonicContact NE-OE2 4Å; R324-E348 PolarHBondContact NE-OE2 3Å; R324-E348 IonicContact NH2-OE1 3.28Å; R324-E348 PolarHBondContact NH2-OE1 2.82Å; R324-E348 IonicContact NH2-OE2 3.74Å; R324-E348 PolarHBondContact NH2-OE2 2.83Å; R324-E348 PolarHBondContact O-N 2.91Å; R324-V349 PolarHBondContact O-N 3.35Å
325	V	97.3	Very high	95	Very high	22 Å²	22	48.4 Å²	48.4	13%	0.133	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	121.2	-175.9	-175.9	0	0	0	0	109.5	Q300 E301 L302 V349	Q300-V325 PolarHBondContact O-N 3.32Å; E301-V325 WeakPolarHBondContact CA-O 3.33Å; E301-V325 HydrophobicContact CB-CB 4.18Å; E301-V325 HydrophobicContact CG-CB 3.94Å; E301-V325 HydrophobicContact CG-CG2 3.98Å; L302-V325 PolarHBondContact N-O 3Å; V325-V349 WeakPolarHBondContact CA-O 3.19Å; V325-V349 HydrophobicContact CB-CB 4.43Å; V325-V349 HydrophobicContact CG1-CB 4.15Å; V325-V349 HydrophobicContact CG1-CG1 4.3Å; V325-V349 HydrophobicContact CG2-CB 4.13Å; V325-V349 HydrophobicContact CG2-CG2 4.27Å
326	L	97.3	Very high	95.2	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	120.7	168.3	179.5	66	0	0	0	109.2	L302 F317 V328 L336 F341 L347 V349 L350 S351	L302-L326 HydrophobicContact CB-CD1 4.12Å; L302-L326 HydrophobicContact CD2-CD1 4Å; L302-L326 HydrophobicContact CG-CD1 4.11Å; F317-L326 HydrophobicContact CE2-CD1 4.19Å; F317-L326 HydrophobicContact CE2-CD2 3.77Å; F317-L326 HydrophobicContact CZ-CD1 4.09Å; F317-L326 HydrophobicContact CZ-CD2 4.41Å; L326-V328 HydrophobicContact CD1-CG1 3.87Å; L326-V328 HydrophobicContact CD2-CG1 4.4Å; L326-V328 HydrophobicContact CG-CG1 4.07Å; L326-L336 HydrophobicContact CD2-CD2 4.42Å; L326-F341 HydrophobicContact CD2-CE1 3.77Å; L326-F341 HydrophobicContact CD2-CZ 3.6Å; L326-L347 HydrophobicContact CB-CD1 3.9Å; L326-V349 PolarHBondContact N-O 2.99Å; L326-L350 HydrophobicContact CB-CD1 4.18Å; L326-L350 HydrophobicContact CD2-CD1 3.94Å; L326-L350 HydrophobicContact CG-CD1 4.23Å; L326-L350 WeakPolarHBondContact O-CA 3.26Å; L326-S351 PolarHBondContact O-N 3.34Å
327	N	97.6	Very high	95.2	Very high	29 Å²	29	46.9 Å²	46.9	16%	0.155	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	106.9	173.4	-169.2	-11.8	0	0	0	110.5	L302 I304 V305 S329 S351	L302-N327 PolarHBondContact O-N 3.47Å; I304-N327 CarbonylContact C-O 3.3Å; I304-N327 PolarHBondContact N-O 3.4Å; V305-N327 HydrophobicContact CG2-CB 4.25Å; V305-N327 VanDerWaalsContact CG2-CG 3.43Å; V305-N327 VanDerWaalsContact CG2-OD1 3.3Å; V305-N327 WeakPolarHBondContact CG2-OD1 3.19Å; N327-S329 WeakPolarHBondContact OD1-CB 3.45Å; N327-S329 PolarHBondContact OD1-N 3Å; N327-S329 VanDerWaalsContact OD1-N 3.15Å; N327-S329 PolarHBondContact OD1-OG 2.95Å; N327-S351 WeakPolarHBondContact OD1-CB 3.45Å
328	V	97.2	Very high	95.2	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	24%	0.239	C	C	.	.			trans	-121.6	29.6	176.5	-68.5	0	0	0	0	110.6	L309 I312 L326 N331 L333 S351 I352 N355	L309-V328 HydrophobicContact CD2-CG1 4.39Å; I312-V328 HydrophobicContact CD1-CG1 4.42Å; L326-V328 HydrophobicContact CD1-CG1 3.87Å; L326-V328 HydrophobicContact CD2-CG1 4.4Å; L326-V328 HydrophobicContact CG-CG1 4.07Å; V328-N331 VanDerWaalsContact C-ND2 3.3Å; V328-N331 PolarHBondContact O-ND2 3.01Å; V328-L333 HydrophobicContact CB-CD1 3.98Å; V328-L333 HydrophobicContact CG2-CD1 3.83Å; V328-S351 CarbonylContact C-O 3.57Å; V328-S351 PolarHBondContact N-O 2.89Å; V328-I352 HydrophobicContact CG2-CB 4.26Å; V328-I352 HydrophobicContact CG2-CG1 4.06Å; V328-N355 PolarHBondContact O-ND2 2.77Å
329	S	96.9	Very high	95.3	Very high	8 Å²	8	49.3 Å²	49.3	6%	0.056	23%	0.231	C	C	.	.			trans	-66.6	158.1	179.1	62.3	0	0	0	0	112.5	V305 G306 N327 N331 S351 N353	V305-S329 WeakPolarHBondContact CA-O 3.46Å; V305-S329 WeakPolarHBondContact CG1-O 3.16Å; V305-S329 WeakPolarHBondContact CG1-OG 3.08Å; G306-S329 PolarHBondContact N-O 2.79Å; G306-S329 VanDerWaalsContact N-O 3.09Å; N327-S329 WeakPolarHBondContact OD1-CB 3.45Å; N327-S329 PolarHBondContact OD1-N 3Å; N327-S329 VanDerWaalsContact OD1-N 3.15Å; N327-S329 PolarHBondContact OD1-OG 2.95Å; S329-N331 PolarHBondContact O-N 3.16Å; S329-N331 PolarHBondContact O-ND2 3.49Å; S329-S351 PolarHBondContact N-O 3.24Å; S329-N353 CarbonylContact C-O 3.36Å; S329-N353 VanDerWaalsContact CA-O 3.23Å; S329-N353 WeakPolarHBondContact CA-O 3.43Å; S329-N353 WeakPolarHBondContact CB-O 3.48Å; S329-N353 WeakPolarHBondContact CB-OD1 3.29Å
330	Q	96.3	Very high	95.6	Very high	96 Å²	96	48.5 Å²	48.5	45%	0.449	22%	0.222	S	C	.	.	S	Bend	trans	58.8	43.5	178	-52.1	-179.1	19.6	0	0	113.3	V305 G306 N353 N354	V305-Q330 HydrophobicContact CG1-CB 4.23Å; V305-Q330 HydrophobicContact CG1-CG 4.3Å; G306-Q330 WeakPolarHBondContact CA-O 3.39Å; G306-Q330 PolarHBondContact N-O 2.71Å; Q330-N353 PolarHBondContact N-O 2.6Å; Q330-N354 VanDerWaalsContact CA-O 3.27Å; Q330-N354 WeakPolarHBondContact CA-O 3.44Å; Q330-N354 HydrophobicContact CB-CB 4.49Å; Q330-N354 HydrophobicContact CG-CB 4.02Å; Q330-N354 PolarHBondContact N-O 2.91Å
331	N	97.8	Very high	95.7	Very high	7 Å²	7	49.2 Å²	49.2	4%	0.037	23%	0.225	C	C	.	.	S	Bend	trans	-118.5	-165.7	176.7	-77.9	-66.1	0	0	0	110.6	I304 A307 Q308 L309 V328 S329 L333 N354 N355	I304-N331 PolarHBondContact O-ND2 3.46Å; A307-N331 WeakPolarHBondContact CA-OD1 3.11Å; A307-N331 PolarHBondContact N-OD1 3.13Å; Q308-N331 PolarHBondContact N-OD1 3.47Å; L309-N331 HydrophobicContact CB-CB 3.94Å; L309-N331 WeakPolarHBondContact CB-OD1 3.47Å; L309-N331 PolarHBondContact N-OD1 3.05Å; V328-N331 VanDerWaalsContact C-ND2 3.3Å; V328-N331 PolarHBondContact O-ND2 3.01Å; S329-N331 PolarHBondContact O-N 3.16Å; S329-N331 PolarHBondContact O-ND2 3.49Å; N331-L333 HydrophobicContact CB-CG 4.32Å; N331-N354 PolarHBondContact N-O 2.82Å; N331-N355 WeakPolarHBondContact CA-OD1 3.37Å; N331-N355 WeakPolarHBondContact CB-OD1 3.46Å; N331-N355 PolarHBondContact N-OD1 2.92Å; N331-N355 PolarHBondContact O-OD1 2.92Å
332	L	97.6	Very high	95.6	Very high	73 Å²	73	43.6 Å²	43.6	38%	0.382	21%	0.213	S	C	.	.			trans	-115.7	29.4	180	-60.3	174.2	0	0	0	111	Q308 L309 R310 E334 N355	Q308-L332 HydrophobicContact CB-CD1 4.44Å; L309-L332 CarbonylContact O-C 3.22Å; L309-L332 VanDerWaalsContact O-CA 3.3Å; L309-L332 WeakPolarHBondContact O-CA 3.43Å; L309-L332 PolarHBondContact O-N 3.11Å; R310-L332 HydrophobicContact CG-CB 4.13Å; R310-L332 HydrophobicContact CG-CD1 4.49Å; L332-E334 PolarHBondContact O-N 2.82Å; L332-N355 PolarHBondContact N-OD1 2.95Å
333	L	97.3	Very high	95.4	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.204	C	C	.	.			trans	-71.5	127.4	-178.9	-66.3	173.5	0	0	0	110.7	L309 I312 V328 N331 N355 P356	L309-L333 HydrophobicContact CB-CD2 4.42Å; L309-L333 HydrophobicContact CD2-CD1 4.29Å; L309-L333 HydrophobicContact CD2-CD2 4.05Å; L309-L333 HydrophobicContact CD2-CG 4.43Å; L309-L333 HydrophobicContact CG-CD2 3.82Å; L309-L333 HydrophobicContact CG-CG 4.42Å; L309-L333 PolarHBondContact O-N 3.42Å; L309-L333 VanDerWaalsContact O-N 3.17Å; I312-L333 HydrophobicContact CD1-CD1 4.08Å; I312-L333 HydrophobicContact CD1-CD2 4.18Å; I312-L333 HydrophobicContact CG1-CD2 4.01Å; V328-L333 HydrophobicContact CB-CD1 3.98Å; V328-L333 HydrophobicContact CG2-CD1 3.83Å; N331-L333 HydrophobicContact CB-CG 4.32Å; L333-N355 HydrophobicContact CB-CB 4.25Å; L333-N355 WeakPolarHBondContact CB-OD1 3.36Å; L333-N355 PolarHBondContact N-OD1 2.96Å; L333-P356 CarbonylContact O-C 2.99Å; L333-P356 WeakPolarHBondContact O-CD 3.44Å
334	E	95.8	Very high	95	Very high	118 Å²	118	40.8 Å²	40.8	55%	0.551	21%	0.209	S	C	*	.	S	Bend	trans	-82.9	-31.1	168.8	-67.2	-179.8	-170.9	0	0	111.8	L332 L357 A358	L332-E334 PolarHBondContact O-N 2.82Å; E334-L357 CarbonylContact O-C 3.52Å; E334-L357 WeakPolarHBondContact O-CA 3.24Å; E334-A358 PolarHBondContact O-N 3.22Å
335	T	96.3	Very high	94.7	Very high	21 Å²	21	46.1 Å²	46.1	13%	0.129	23%	0.229	C	C	.	.			trans	-152.4	168.8	-178.6	-162.6	0	0	0	0	112	E337 R362 L363	T335-E337 HydrophobicContact CG2-CG 4.31Å; T335-R362 VanDerWaalsContact CG2-NH1 3.27Å; T335-R362 VanDerWaalsContact OG1-CB 3.28Å; T335-R362 WeakPolarHBondContact OG1-CB 3.33Å; T335-L363 WeakPolarHBondContact OG1-CD2 3.36Å
336	L	96.3	Very high	94.4	Very high	2 Å²	2	46.5 Å²	46.5	1%	0.01	23%	0.234	C	C	.	.			trans	-140.3	101.9	169.6	178.1	66.4	0	0	0	108.4	I312 L326 F341 L350 I352 L363 W365 I366	I312-L336 HydrophobicContact CD1-CD1 3.92Å; L326-L336 HydrophobicContact CD2-CD2 4.42Å; L336-F341 HydrophobicContact CD1-CE2 4.17Å; L336-F341 HydrophobicContact CD1-CZ 4.31Å; L336-F341 HydrophobicContact CD2-CE2 4.13Å; L336-F341 HydrophobicContact CD2-CZ 4.06Å; L336-F341 HydrophobicContact CG-CE2 4.12Å; L336-F341 HydrophobicContact CG-CZ 4.43Å; L336-L350 HydrophobicContact CD2-CD1 3.82Å; L336-L350 HydrophobicContact CD2-CD2 4.04Å; L336-I352 HydrophobicContact CB-CD1 3.68Å; L336-I352 HydrophobicContact CD2-CD1 3.94Å; L336-I352 HydrophobicContact CG-CD1 4.45Å; L336-L363 HydrophobicContact CB-CD2 4.41Å; L336-W365 HydrophobicContact CD2-CZ2 4.14Å; L336-W365 HydrophobicContact CG-CZ2 4.18Å; L336-W365 PolarHBondContact O-NE1 3.02Å; L336-I366 HydrophobicContact CB-CD1 4.42Å; L336-I366 HydrophobicContact CD2-CD1 4.39Å
337	E	94.2	Very high	94.3	Very high	64 Å²	64	46.6 Å²	46.6	30%	0.299	23%	0.234	S	C	.	.			trans	-75.9	149.8	-177.7	-64.8	-175.6	-154.7	0	0	112.2	T335 N339 V340 R362	T335-E337 HydrophobicContact CG2-CG 4.31Å; E337-N339 VanDerWaalsContact C-N 3.31Å; E337-N339 WeakPolarHBondContact CB-OD1 3.35Å; E337-N339 PolarHBondContact O-N 2.87Å; E337-N339 PolarHBondContact OE2-ND2 3.4Å; E337-N339 PolarHBondContact OE2-OD1 2.56Å; E337-V340 HydrophobicContact CB-CG2 4.22Å; E337-V340 WeakPolarHBondContact O-CB 3.29Å; E337-V340 VanDerWaalsContact O-CG2 3.26Å; E337-V340 WeakPolarHBondContact O-CG2 3.06Å; E337-V340 PolarHBondContact O-N 2.57Å; E337-R362 HydrophobicContact CG-CB 4.49Å
338	E	94.3	Very high	94.1	Very high	98 Å²	98	49.1 Å²	49.1	46%	0.458	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-66.4	-33.5	179.8	-170.7	176.2	-173.2	0	0	112.4	V340 F341 P344 W365	E338-V340 PolarHBondContact O-N 3.11Å; E338-V340 VanDerWaalsContact O-N 3.12Å; E338-F341 PolarHBondContact O-N 2.8Å; E338-F341 VanDerWaalsContact O-N 3.13Å; E338-P344 HydrophobicContact CG-CB 4.15Å; E338-P344 HydrophobicContact CG-CG 3.87Å; E338-W365 HydrophobicContact CB-CB 4.33Å; E338-W365 HydrophobicContact CB-CD2 4.09Å; E338-W365 HydrophobicContact CB-CG 3.81Å; E338-W365 HydrophobicContact CG-CB 4.46Å; E338-W365 HydrophobicContact CG-CD2 4.23Å; E338-W365 HydrophobicContact CG-CG 4.2Å
339	N	92.8	Very high	94.1	Very high	62 Å²	62	50.5 Å²	50.5	33%	0.332	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-66.1	-10.8	-178.8	62.8	11	0	0	0	114	H315 E337 F341	H315-N339 PolarHBondContact N-O 3.26Å; H315-N339 PolarHBondContact ND1-O 3.37Å; E337-N339 VanDerWaalsContact C-N 3.31Å; E337-N339 WeakPolarHBondContact CB-OD1 3.35Å; E337-N339 PolarHBondContact O-N 2.87Å; E337-N339 PolarHBondContact OE2-ND2 3.4Å; E337-N339 PolarHBondContact OE2-OD1 2.56Å; N339-F341 PolarHBondContact O-N 2.91Å
340	V	95.1	Very high	94	Very high	2 Å²	2	50.1 Å²	50.1	1%	0.012	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-64.7	-33.9	173	179.7	0	0	0	0	110.4	I312 F317 E337 E338	I312-V340 HydrophobicContact CG2-CB 4.48Å; I312-V340 HydrophobicContact CG2-CG1 3.4Å; I312-V340 HydrophobicContact CG2-CG2 4.2Å; F317-V340 WeakPolarHBondContact CA-O 3.21Å; F317-V340 WeakPolarHBondContact CB-O 3.31Å; F317-V340 HydrophobicContact CD2-CG1 3.4Å; F317-V340 VanDerWaalsContact CD2-CG1 3.4Å; F317-V340 HydrophobicContact CE2-CG1 3.61Å; F317-V340 HydrophobicContact CG-CG1 4.09Å; F317-V340 HydrophobicContact CZ-CG1 4.46Å; F317-V340 PolarHBondContact N-O 3.1Å; E337-V340 HydrophobicContact CB-CG2 4.22Å; E337-V340 WeakPolarHBondContact O-CB 3.29Å; E337-V340 VanDerWaalsContact O-CG2 3.26Å; E337-V340 WeakPolarHBondContact O-CG2 3.06Å; E337-V340 PolarHBondContact O-N 2.57Å; E338-V340 PolarHBondContact O-N 3.11Å; E338-V340 VanDerWaalsContact O-N 3.12Å
341	F	93.6	Very high	94.1	Very high	19 Å²	19	46.2 Å²	46.2	8%	0.083	23%	0.234	C	C	.	.	B	Isolated β-bridge	trans	-91.4	143.3	-174.1	-61	-84.9	0	0	0	112.6	F317 L323 L326 L336 E338 N339 P344 L347 W365	F317-F341 AromaticContact CD2-CD1 3.9Å; F317-F341 HydrophobicContact CD2-CD1 3.9Å; F317-F341 AromaticContact CD2-CE1 3.71Å; F317-F341 HydrophobicContact CD2-CE1 3.71Å; F317-F341 HydrophobicContact CD2-CZ 4.26Å; F317-F341 HydrophobicContact CE2-CE1 4.16Å; F317-F341 HydrophobicContact CE2-CZ 4.39Å; L323-F341 HydrophobicContact CD2-CD1 4.37Å; L323-F341 HydrophobicContact CD2-CE1 4.22Å; L326-F341 HydrophobicContact CD2-CE1 3.77Å; L326-F341 HydrophobicContact CD2-CZ 3.6Å; L336-F341 HydrophobicContact CD1-CE2 4.17Å; L336-F341 HydrophobicContact CD1-CZ 4.31Å; L336-F341 HydrophobicContact CD2-CE2 4.13Å; L336-F341 HydrophobicContact CD2-CZ 4.06Å; L336-F341 HydrophobicContact CG-CE2 4.12Å; L336-F341 HydrophobicContact CG-CZ 4.43Å; E338-F341 PolarHBondContact O-N 2.8Å; E338-F341 VanDerWaalsContact O-N 3.13Å; N339-F341 PolarHBondContact O-N 2.91Å; F341-P344 HydrophobicContact CB-CB 4.1Å; F341-P344 HydrophobicContact CG-CB 4.42Å; F341-L347 HydrophobicContact CE1-CD2 4.13Å; F341-L347 HydrophobicContact CZ-CD2 4.15Å; F341-W365 HydrophobicContact CD2-CH2 4.19Å; F341-W365 HydrophobicContact CD2-CZ2 4.29Å; F341-W365 AromaticContact CE2-CH2 3.65Å; F341-W365 HydrophobicContact CE2-CH2 3.65Å; F341-W365 AromaticContact CE2-CZ2 3.68Å; F341-W365 HydrophobicContact CE2-CZ2 3.68Å; F341-W365 HydrophobicContact CZ-CH2 4.28Å
342	S	89.3	Confident	94	Very high	59 Å²	59	45.9 Å²	45.9	41%	0.413	23%	0.233	S	C	.	.	S	Bend	trans	-72.5	-36.9	167.5	-170.5	0	0	0	0	112.7
343	S	88	Confident	93.8	Very high	50 Å²	50	43.1 Å²	43.1	35%	0.35	22%	0.218	S	C	.	.			trans	-146.6	82.9	-178.8	-175.3	0	0	0	0	108.7	R345 A346	S343-R345 PolarHBondContact O-N 3.18Å; S343-A346 PolarHBondContact O-N 3.01Å; S343-A346 VanDerWaalsContact O-N 3.11Å
344	P	88.9	Confident	93.8	Very high	20 Å²	20	46.5 Å²	46.5	13%	0.13	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-58.5	-33.6	-177.4	22.2	-32.4	0	0	0	111.1	E338 F341 A346 L347 W365 R369	E338-P344 HydrophobicContact CG-CB 4.15Å; E338-P344 HydrophobicContact CG-CG 3.87Å; F341-P344 HydrophobicContact CB-CB 4.1Å; F341-P344 HydrophobicContact CG-CB 4.42Å; P344-A346 PolarHBondContact O-N 3.36Å; P344-L347 WeakPolarHBondContact O-CB 3.48Å; P344-L347 PolarHBondContact O-N 2.82Å; P344-W365 HydrophobicContact CB-CZ3 4.36Å; P344-R369 VanDerWaalsContact C-NH1 3.33Å; P344-R369 PolarHBondContact O-NH1 2.93Å
345	R	88.9	Confident	93.8	Very high	219 Å²	219	41.6 Å²	41.6	83%	0.826	21%	0.214	S	C	*	.	G	3₁₀ helix	trans	-60.9	-23.8	179.3	-63.6	-176.3	-175.2	171.7	1.5	114.7	S343 L347 R369	S343-R345 PolarHBondContact O-N 3.18Å; R345-L347 VanDerWaalsContact C-N 3.26Å; R345-R369 PolarHBondContact O-NH2 3.36Å
346	A	91.2	Very high	93.8	Very high	29 Å²	29	43.2 Å²	43.2	24%	0.24	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-74.8	-17.9	176.4	0	0	0	0	0	112.8	L323 S343 P344 E348	L323-A346 CarbonylContact O-C 3.25Å; S343-A346 PolarHBondContact O-N 3.01Å; S343-A346 VanDerWaalsContact O-N 3.11Å; P344-A346 PolarHBondContact O-N 3.36Å; A346-E348 PolarHBondContact O-N 2.76Å
347	L	94.1	Very high	93.9	Very high	2 Å²	2	43.2 Å²	43.2	1%	0.01	23%	0.225	C	C	.	.			trans	-71.4	123.9	179.6	-163.5	72.1	0	0	0	110.3	L323 R324 L326 F341 P344 R345 L350 R369 L373	L323-L347 HydrophobicContact CG-CD1 4.42Å; R324-L347 WeakPolarHBondContact O-CD1 3.38Å; L326-L347 HydrophobicContact CB-CD1 3.9Å; F341-L347 HydrophobicContact CE1-CD2 4.13Å; F341-L347 HydrophobicContact CZ-CD2 4.15Å; P344-L347 WeakPolarHBondContact O-CB 3.48Å; P344-L347 PolarHBondContact O-N 2.82Å; R345-L347 VanDerWaalsContact C-N 3.26Å; L347-L350 HydrophobicContact CD2-CB 3.93Å; L347-L350 HydrophobicContact CD2-CD1 4.24Å; L347-L350 HydrophobicContact CD2-CD2 4.44Å; L347-L350 HydrophobicContact CD2-CG 4.42Å; L347-R369 PolarHBondContact O-NH2 2.97Å; L347-L373 HydrophobicContact CB-CD1 4.33Å; L347-L373 HydrophobicContact CD2-CD1 4.1Å; L347-L373 HydrophobicContact CG-CD1 4.05Å; L347-L373 WeakPolarHBondContact O-CD1 3.26Å
348	E	94.6	Very high	93.9	Very high	83 Å²	83	41.4 Å²	41.4	39%	0.388	22%	0.221	S	C	.	.			trans	-104.3	-40.2	179.9	-66.7	175.8	-166.6	0	0	111.3	R324 A346 Q374	R324-E348 IonicContact CZ-OE1 3.42Å; R324-E348 IonicContact CZ-OE2 2.77Å; R324-E348 VanDerWaalsContact CZ-OE2 3.28Å; R324-E348 IonicContact NE-OE1 3.94Å; R324-E348 PolarHBondContact NE-OE1 3.25Å; R324-E348 IonicContact NE-OE2 4Å; R324-E348 PolarHBondContact NE-OE2 3Å; R324-E348 IonicContact NH2-OE1 3.28Å; R324-E348 PolarHBondContact NH2-OE1 2.82Å; R324-E348 IonicContact NH2-OE2 3.74Å; R324-E348 PolarHBondContact NH2-OE2 2.83Å; R324-E348 PolarHBondContact O-N 2.91Å; A346-E348 PolarHBondContact O-N 2.76Å; E348-Q374 PolarHBondContact O-N 3.19Å
349	V	96.1	Very high	94	Very high	29 Å²	29	36.8 Å²	36.8	18%	0.176	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	122.7	-177.9	-175	0	0	0	0	109.9	R324 V325 L326 Q374	R324-V349 PolarHBondContact O-N 3.35Å; V325-V349 WeakPolarHBondContact CA-O 3.19Å; V325-V349 HydrophobicContact CB-CB 4.43Å; V325-V349 HydrophobicContact CG1-CB 4.15Å; V325-V349 HydrophobicContact CG1-CG1 4.3Å; V325-V349 HydrophobicContact CG2-CB 4.13Å; V325-V349 HydrophobicContact CG2-CG2 4.27Å; L326-V349 PolarHBondContact N-O 2.99Å; V349-Q374 CarbonylContact C-O 3.46Å; V349-Q374 WeakPolarHBondContact CA-O 3.45Å; V349-Q374 HydrophobicContact CG2-CB 4.3Å
350	L	96.5	Very high	94.1	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	108.8	174.6	176.6	60.5	0	0	0	110.1	L326 L336 L347 I352 W365 I366 L373 Q374 F375	L326-L350 HydrophobicContact CB-CD1 4.18Å; L326-L350 HydrophobicContact CD2-CD1 3.94Å; L326-L350 HydrophobicContact CG-CD1 4.23Å; L326-L350 WeakPolarHBondContact O-CA 3.26Å; L336-L350 HydrophobicContact CD2-CD1 3.82Å; L336-L350 HydrophobicContact CD2-CD2 4.04Å; L347-L350 HydrophobicContact CD2-CB 3.93Å; L347-L350 HydrophobicContact CD2-CD1 4.24Å; L347-L350 HydrophobicContact CD2-CD2 4.44Å; L347-L350 HydrophobicContact CD2-CG 4.42Å; L350-I352 HydrophobicContact CG-CG2 4.47Å; L350-W365 HydrophobicContact CD2-CH2 4.27Å; L350-I366 HydrophobicContact CD2-CD1 3.94Å; L350-I366 HydrophobicContact CD2-CG1 4.24Å; L350-I366 HydrophobicContact CD2-CG2 4.16Å; L350-L373 HydrophobicContact CB-CD1 4.03Å; L350-L373 HydrophobicContact CB-CD2 3.86Å; L350-L373 HydrophobicContact CB-CG 4.05Å; L350-L373 HydrophobicContact CD2-CD2 3.87Å; L350-Q374 PolarHBondContact N-O 2.93Å; L350-F375 WeakPolarHBondContact O-CA 3.38Å; L350-F375 WeakPolarHBondContact O-CD1 3.26Å
351	S	96.6	Very high	94	Very high	13 Å²	13	35.9 Å²	35.9	9%	0.091	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	105	172.5	-58.7	0	0	0	0	109.9	L326 N327 V328 S329	L326-S351 PolarHBondContact O-N 3.34Å; N327-S351 WeakPolarHBondContact OD1-CB 3.45Å; V328-S351 CarbonylContact C-O 3.57Å; V328-S351 PolarHBondContact N-O 2.89Å; S329-S351 PolarHBondContact N-O 3.24Å
352	I	96	Very high	94.1	Very high	1 Å²	1	37 Å²	37	1%	0.005	20%	0.2	C	C	.	.			trans	-124.2	12.9	178.5	-163.9	171.5	0	0	0	112	V328 L336 L350 N355 L357 P380	V328-I352 HydrophobicContact CG2-CB 4.26Å; V328-I352 HydrophobicContact CG2-CG1 4.06Å; L336-I352 HydrophobicContact CB-CD1 3.68Å; L336-I352 HydrophobicContact CD2-CD1 3.94Å; L336-I352 HydrophobicContact CG-CD1 4.45Å; L350-I352 HydrophobicContact CG-CG2 4.47Å; I352-N355 PolarHBondContact O-ND2 3.46Å; I352-L357 HydrophobicContact CD1-CD2 3.76Å; I352-L357 HydrophobicContact CG1-CD1 4.4Å; I352-L357 HydrophobicContact CG1-CD2 4.02Å; I352-L357 HydrophobicContact CG2-CD1 4.25Å; I352-P380 HydrophobicContact CG2-CB 3.88Å; I352-P380 HydrophobicContact CG2-CG 3.58Å
353	N	94.9	Very high	94.4	Very high	15 Å²	15	34.1 Å²	34.1	8%	0.08	18%	0.18	C	C	.	.			trans	-60.8	157.9	176.3	61.4	-62.5	0	0	0	112.1	S329 Q330 N355 Q378	S329-N353 CarbonylContact C-O 3.36Å; S329-N353 VanDerWaalsContact CA-O 3.23Å; S329-N353 WeakPolarHBondContact CA-O 3.43Å; S329-N353 WeakPolarHBondContact CB-O 3.48Å; S329-N353 WeakPolarHBondContact CB-OD1 3.29Å; Q330-N353 PolarHBondContact N-O 2.6Å; N353-N355 PolarHBondContact O-ND2 3.38Å; N353-Q378 HydrophobicContact CB-CB 4.2Å; N353-Q378 HydrophobicContact CB-CG 4.27Å; N353-Q378 PolarHBondContact ND2-OE1 2.87Å
354	N	95.5	Very high	94.6	Very high	71 Å²	71	33.7 Å²	33.7	38%	0.38	17%	0.174	S	C	.	.	S	Bend	trans	56.6	47.8	-177.6	-55.8	-13.8	0	0	0	112.4	Q330 N331 Q378	Q330-N354 VanDerWaalsContact CA-O 3.27Å; Q330-N354 WeakPolarHBondContact CA-O 3.44Å; Q330-N354 HydrophobicContact CB-CB 4.49Å; Q330-N354 HydrophobicContact CG-CB 4.02Å; Q330-N354 PolarHBondContact N-O 2.91Å; N331-N354 PolarHBondContact N-O 2.82Å; N354-Q378 PolarHBondContact OD1-NE2 3.41Å; N354-Q378 PolarHBondContact OD1-OE1 3.25Å
355	N	97	Very high	94.8	Very high	14 Å²	14	33.4 Å²	33.4	8%	0.075	17%	0.17	C	C	.	.	S	Bend	trans	-126.8	147.7	169.4	-80.5	-80.5	0	0	0	108.9	V328 N331 L332 L333 I352 N353 L357	V328-N355 PolarHBondContact O-ND2 2.77Å; N331-N355 WeakPolarHBondContact CA-OD1 3.37Å; N331-N355 WeakPolarHBondContact CB-OD1 3.46Å; N331-N355 PolarHBondContact N-OD1 2.92Å; N331-N355 PolarHBondContact O-OD1 2.92Å; L332-N355 PolarHBondContact N-OD1 2.95Å; L333-N355 HydrophobicContact CB-CB 4.25Å; L333-N355 WeakPolarHBondContact CB-OD1 3.36Å; L333-N355 PolarHBondContact N-OD1 2.96Å; I352-N355 PolarHBondContact O-ND2 3.46Å; N353-N355 PolarHBondContact O-ND2 3.38Å; N355-L357 HydrophobicContact CB-CD2 3.9Å; N355-L357 HydrophobicContact CB-CG 3.96Å; N355-L357 PolarHBondContact O-N 3.41Å
356	P	96.8	Very high	95	Very high	56 Å²	56	23 Å²	23	36%	0.364	13%	0.131	S	C	.	.			trans	-76	62.4	176.8	33.8	-36.8	0	0	0	111.8	L333 A358 A383	L333-P356 CarbonylContact O-C 2.99Å; L333-P356 WeakPolarHBondContact O-CD 3.44Å; P356-A358 PolarHBondContact O-N 3.45Å; P356-A383 VanDerWaalsContact C-CB 3.47Å; P356-A383 HydrophobicContact CB-CB 4.18Å
357	L	96.8	Very high	95	Very high	1 Å²	1	21.9 Å²	21.9	1%	0.005	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	124.1	-171.6	-62.2	174.5	0	0	0	112.6	E334 I352 N355 C359 L363 P380 A383 G384 F393	E334-L357 CarbonylContact O-C 3.52Å; E334-L357 WeakPolarHBondContact O-CA 3.24Å; I352-L357 HydrophobicContact CD1-CD2 3.76Å; I352-L357 HydrophobicContact CG1-CD1 4.4Å; I352-L357 HydrophobicContact CG1-CD2 4.02Å; I352-L357 HydrophobicContact CG2-CD1 4.25Å; N355-L357 HydrophobicContact CB-CD2 3.9Å; N355-L357 HydrophobicContact CB-CG 3.96Å; N355-L357 PolarHBondContact O-N 3.41Å; L357-C359 PolarHBondContact O-N 3.38Å; L357-L363 HydrophobicContact CB-CD1 4.02Å; L357-L363 HydrophobicContact CD2-CD1 4.37Å; L357-P380 HydrophobicContact CD1-CB 3.96Å; L357-A383 PolarHBondContact O-N 3.22Å; L357-G384 PolarHBondContact O-N 3.24Å; L357-F393 HydrophobicContact CD1-CE1 4.44Å; L357-F393 HydrophobicContact CD1-CZ 4.11Å
358	A	96.1	Very high	94.9	Very high	27 Å²	27	27.8 Å²	27.8	22%	0.223	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	104.3	166	0	0	0	0	0	109.1	E334 P356 D360 L363	E334-A358 PolarHBondContact O-N 3.22Å; P356-A358 PolarHBondContact O-N 3.45Å; A358-D360 PolarHBondContact O-N 2.98Å; A358-L363 WeakPolarHBondContact O-CD1 3.38Å
359	C	95.2	Very high	94.7	Very high	1 Å²	1	25.9 Å²	25.9	1%	0.007	14%	0.138	C	C	.	.			trans	-80.6	69.8	-176.9	-75.3	0	0	0	0	112.1	L357 C382 G384 I388 F405	L357-C359 PolarHBondContact O-N 3.38Å; C359-C382 HydrophobicContact CB-CB 3.75Å; C359-C382 WeakPolarHBondContact CB-SG 3.47Å; C359-C382 WeakPolarHBondContact SG-CA 3.48Å; C359-C382 WeakPolarHBondContact SG-CB 3.45Å; C359-C382 CovalentContact SG-SG 2.03Å; C359-C382 PolarHBondContact SG-SG 3.46Å; C359-G384 WeakPolarHBondContact CB-O 3.48Å; C359-G384 PolarHBondContact N-O 3.02Å; C359-I388 HydrophobicContact CB-CD1 3.52Å; C359-I388 HydrophobicContact CB-CG1 4.39Å; C359-F405 HydrophobicContact CB-CD1 4.13Å; C359-F405 HydrophobicContact CB-CE1 3.41Å; C359-F405 VanDerWaalsContact CB-CE1 3.41Å; C359-F405 HydrophobicContact CB-CZ 3.79Å
360	D	94.4	Very high	94.2	Very high	13 Å²	13	27 Å²	27	7%	0.07	14%	0.141	C	C	.	.	S	Bend	trans	-109.1	-172.6	174.6	65.1	42.2	0	0	0	111.5	A358 R362 L363 F405 T406 P438	A358-D360 PolarHBondContact O-N 2.98Å; D360-R362 PolarHBondContact O-N 3.15Å; D360-R362 WeakPolarHBondContact OD1-CB 3.31Å; D360-R362 VanDerWaalsContact OD1-CG 3.28Å; D360-R362 WeakPolarHBondContact OD1-CG 3.48Å; D360-R362 PolarHBondContact OD1-N 2.98Å; D360-R362 IonicContact OD1-NE 2.97Å; D360-R362 PolarHBondContact OD1-NE 3.25Å; D360-R362 VanDerWaalsContact OD1-NE 3.1Å; D360-R362 IonicContact OD2-CZ 3.23Å; D360-R362 VanDerWaalsContact OD2-CZ 3.29Å; D360-R362 IonicContact OD2-NE 3.92Å; D360-R362 PolarHBondContact OD2-NE 3.45Å; D360-R362 IonicContact OD2-NH2 2.69Å; D360-R362 PolarHBondContact OD2-NH2 3.49Å; D360-L363 PolarHBondContact O-N 2.92Å; D360-F405 WeakPolarHBondContact O-CD1 3.32Å; D360-T406 WeakPolarHBondContact CB-O 3.48Å; D360-P438 WeakPolarHBondContact OD2-CG 3.46Å
361	C	94.2	Very high	93.7	Very high	32 Å²	32	32.8 Å²	32.8	22%	0.216	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-56.8	-21.3	-178.9	73.5	0	0	0	0	114.9	L363 L364 T406 C407	C361-L363 VanDerWaalsContact C-N 3.27Å; C361-L363 PolarHBondContact O-N 3.3Å; C361-L364 WeakPolarHBondContact O-CB 3.35Å; C361-L364 PolarHBondContact O-N 3.42Å; C361-T406 PolarHBondContact N-O 3.03Å; C361-C407 VanDerWaalsContact CA-SG 3.59Å; C361-C407 HydrophobicContact CB-CB 3.76Å; C361-C407 WeakPolarHBondContact CB-SG 3.37Å; C361-C407 PolarHBondContact N-SG 3.24Å; C361-C407 WeakPolarHBondContact SG-CB 3.25Å; C361-C407 CovalentContact SG-SG 2.01Å; C361-C407 PolarHBondContact SG-SG 2.03Å
362	R	94.9	Very high	93.4	Very high	41 Å²	41	36.9 Å²	36.9	16%	0.155	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-66.1	-28.4	180	-65	177.2	-68.1	175.4	-0.9	112.8	T335 E337 D360 A488	T335-R362 VanDerWaalsContact CG2-NH1 3.27Å; T335-R362 VanDerWaalsContact OG1-CB 3.28Å; T335-R362 WeakPolarHBondContact OG1-CB 3.33Å; E337-R362 HydrophobicContact CG-CB 4.49Å; D360-R362 PolarHBondContact O-N 3.15Å; D360-R362 WeakPolarHBondContact OD1-CB 3.31Å; D360-R362 VanDerWaalsContact OD1-CG 3.28Å; D360-R362 WeakPolarHBondContact OD1-CG 3.48Å; D360-R362 PolarHBondContact OD1-N 2.98Å; D360-R362 IonicContact OD1-NE 2.97Å; D360-R362 PolarHBondContact OD1-NE 3.25Å; D360-R362 VanDerWaalsContact OD1-NE 3.1Å; D360-R362 IonicContact OD2-CZ 3.23Å; D360-R362 VanDerWaalsContact OD2-CZ 3.29Å; D360-R362 IonicContact OD2-NE 3.92Å; D360-R362 PolarHBondContact OD2-NE 3.45Å; D360-R362 IonicContact OD2-NH2 2.69Å; D360-R362 PolarHBondContact OD2-NH2 3.49Å; R362-A488 HydrophobicContact CG-CB 3.34Å
363	L	94.9	Very high	93.2	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-91.9	-0.6	178.7	-61.1	-177	0	0	0	113.1	T335 L336 L357 A358 D360 C361 W365 I366 L367 F393 F405	T335-L363 WeakPolarHBondContact OG1-CD2 3.36Å; L336-L363 HydrophobicContact CB-CD2 4.41Å; L357-L363 HydrophobicContact CB-CD1 4.02Å; L357-L363 HydrophobicContact CD2-CD1 4.37Å; A358-L363 WeakPolarHBondContact O-CD1 3.38Å; D360-L363 PolarHBondContact O-N 2.92Å; C361-L363 VanDerWaalsContact C-N 3.27Å; C361-L363 PolarHBondContact O-N 3.3Å; L363-W365 VanDerWaalsContact C-N 3.27Å; L363-W365 PolarHBondContact O-N 3.31Å; L363-I366 HydrophobicContact CD2-CD1 3.88Å; L363-I366 WeakPolarHBondContact O-CB 3.45Å; L363-I366 PolarHBondContact O-N 2.99Å; L363-L367 PolarHBondContact O-N 3.02Å; L363-F393 HydrophobicContact CD1-CZ 4.16Å; L363-F405 HydrophobicContact CB-CD1 4.44Å; L363-F405 HydrophobicContact CB-CE1 4.43Å
364	L	93.1	Very high	93.1	Very high	41 Å²	41	42.6 Å²	42.6	22%	0.215	23%	0.229	C	C	.	.	H	α-helix	trans	-59.7	-36.8	-174.8	-176	61.8	0	0	0	112.6	C361 I366 L367 Q368 L401 F405	C361-L364 WeakPolarHBondContact O-CB 3.35Å; C361-L364 PolarHBondContact O-N 3.42Å; L364-I366 PolarHBondContact O-N 3.47Å; L364-L367 PolarHBondContact O-N 3.16Å; L364-Q368 HydrophobicContact CD1-CG 4.42Å; L364-Q368 HydrophobicContact CG-CG 4.32Å; L364-Q368 VanDerWaalsContact O-CG 3.32Å; L364-Q368 WeakPolarHBondContact O-CG 3.44Å; L364-Q368 PolarHBondContact O-N 2.71Å; L364-L401 HydrophobicContact CD1-CB 3.85Å; L364-L401 HydrophobicContact CD1-CD1 4.33Å; L364-F405 HydrophobicContact CD1-CB 4.16Å
365	W	92.5	Very high	92.9	Very high	14 Å²	14	39.6 Å²	39.6	5%	0.053	21%	0.213	C	C	.	.	H	α-helix	trans	-61.1	-33	178.4	75.7	-90.7	0	0	0	112.6	L336 E338 F341 P344 L350 L363 R369	L336-W365 HydrophobicContact CD2-CZ2 4.14Å; L336-W365 HydrophobicContact CG-CZ2 4.18Å; L336-W365 PolarHBondContact O-NE1 3.02Å; E338-W365 HydrophobicContact CB-CB 4.33Å; E338-W365 HydrophobicContact CB-CD2 4.09Å; E338-W365 HydrophobicContact CB-CG 3.81Å; E338-W365 HydrophobicContact CG-CB 4.46Å; E338-W365 HydrophobicContact CG-CD2 4.23Å; E338-W365 HydrophobicContact CG-CG 4.2Å; F341-W365 HydrophobicContact CD2-CH2 4.19Å; F341-W365 HydrophobicContact CD2-CZ2 4.29Å; F341-W365 AromaticContact CE2-CH2 3.65Å; F341-W365 HydrophobicContact CE2-CH2 3.65Å; F341-W365 AromaticContact CE2-CZ2 3.68Å; F341-W365 HydrophobicContact CE2-CZ2 3.68Å; F341-W365 HydrophobicContact CZ-CH2 4.28Å; P344-W365 HydrophobicContact CB-CZ3 4.36Å; L350-W365 HydrophobicContact CD2-CH2 4.27Å; L363-W365 VanDerWaalsContact C-N 3.27Å; L363-W365 PolarHBondContact O-N 3.31Å; W365-R369 WeakPolarHBondContact O-CG 3.37Å; W365-R369 PolarHBondContact O-N 3.49Å
366	I	93.9	Very high	92.2	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.005	23%	0.233	C	C	.	.	H	α-helix	trans	-68.2	-46.7	178	-59.6	179.9	0	0	0	109.6	L336 L350 L363 L364 R369 Q370 L373 F375 F393	L336-I366 HydrophobicContact CB-CD1 4.42Å; L336-I366 HydrophobicContact CD2-CD1 4.39Å; L350-I366 HydrophobicContact CD2-CD1 3.94Å; L350-I366 HydrophobicContact CD2-CG1 4.24Å; L350-I366 HydrophobicContact CD2-CG2 4.16Å; L363-I366 HydrophobicContact CD2-CD1 3.88Å; L363-I366 WeakPolarHBondContact O-CB 3.45Å; L363-I366 PolarHBondContact O-N 2.99Å; L364-I366 PolarHBondContact O-N 3.47Å; I366-R369 CarbonylContact O-C 3.59Å; I366-R369 PolarHBondContact O-N 3.05Å; I366-R369 VanDerWaalsContact O-N 3.12Å; I366-Q370 PolarHBondContact O-N 3.01Å; I366-L373 HydrophobicContact CG2-CD2 4.16Å; I366-F375 HydrophobicContact CG2-CE1 3.48Å; I366-F375 VanDerWaalsContact CG2-CE1 3.48Å; I366-F375 HydrophobicContact CG2-CZ 3.57Å; I366-F393 HydrophobicContact CB-CE2 4.48Å; I366-F393 HydrophobicContact CG2-CD2 4.22Å; I366-F393 HydrophobicContact CG2-CE2 3.93Å
367	L	91.4	Very high	91.4	Very high	5 Å²	5	43 Å²	43	3%	0.026	26%	0.262	C	S	.	.	H	α-helix	trans	-68.6	-37.5	-179.7	-69.4	-161.5	0	0	0	113	L363 L364 R369 Q370 F393 F396 L401 F405	L363-L367 PolarHBondContact O-N 3.02Å; L364-L367 PolarHBondContact O-N 3.16Å; L367-R369 PolarHBondContact O-N 2.82Å; L367-Q370 WeakPolarHBondContact O-CB 3.31Å; L367-Q370 PolarHBondContact O-N 3.47Å; L367-F393 HydrophobicContact CD2-CB 3.69Å; L367-F393 HydrophobicContact CD2-CD1 4.21Å; L367-F393 HydrophobicContact CD2-CD2 3.21Å; L367-F393 HydrophobicContact CD2-CE2 3.76Å; L367-F393 HydrophobicContact CD2-CG 3.45Å; L367-F393 VanDerWaalsContact CD2-CG 3.45Å; L367-F393 HydrophobicContact CD2-CZ 4.45Å; L367-F393 HydrophobicContact CG-CD2 4.32Å; L367-F393 HydrophobicContact CG-CE2 4.44Å; L367-F396 HydrophobicContact CD1-CB 4.24Å; L367-F396 HydrophobicContact CD1-CD2 4.31Å; L367-F396 HydrophobicContact CD1-CG 4.4Å; L367-L401 HydrophobicContact CB-CD1 4.01Å; L367-L401 HydrophobicContact CB-CD2 4.04Å; L367-L401 HydrophobicContact CD1-CD2 3.51Å; L367-L401 HydrophobicContact CG-CD2 4.44Å; L367-F405 HydrophobicContact CD1-CD1 4.22Å; L367-F405 HydrophobicContact CD1-CD2 3.8Å; L367-F405 HydrophobicContact CD1-CE1 3.68Å; L367-F405 HydrophobicContact CD1-CE2 3.24Å; L367-F405 HydrophobicContact CD1-CG 4.3Å; L367-F405 HydrophobicContact CD1-CZ 3.2Å; L367-F405 HydrophobicContact CG-CE1 4.4Å; L367-F405 HydrophobicContact CG-CZ 4.29Å
368	Q	91.1	Very high	91	Very high	126 Å²	126	46.9 Å²	46.9	59%	0.589	28%	0.28	S	S	*	.	H	α-helix	trans	-60.4	-24.9	172.5	-72.8	175.3	-13.1	0	0	112.5	L364 L401	L364-Q368 HydrophobicContact CD1-CG 4.42Å; L364-Q368 HydrophobicContact CG-CG 4.32Å; L364-Q368 VanDerWaalsContact O-CG 3.32Å; L364-Q368 WeakPolarHBondContact O-CG 3.44Å; L364-Q368 PolarHBondContact O-N 2.71Å; Q368-L401 HydrophobicContact CG-CD1 4.48Å
369	R	91.3	Very high	90.8	Very high	42 Å²	42	48.7 Å²	48.7	16%	0.158	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	0.4	179.9	-71.2	-166.4	66.2	-146.5	-1.2	115.1	P344 R345 L347 W365 I366 L367 P371 T372 L373	P344-R369 VanDerWaalsContact C-NH1 3.33Å; P344-R369 PolarHBondContact O-NH1 2.93Å; R345-R369 PolarHBondContact O-NH2 3.36Å; L347-R369 PolarHBondContact O-NH2 2.97Å; W365-R369 WeakPolarHBondContact O-CG 3.37Å; W365-R369 PolarHBondContact O-N 3.49Å; I366-R369 CarbonylContact O-C 3.59Å; I366-R369 PolarHBondContact O-N 3.05Å; I366-R369 VanDerWaalsContact O-N 3.12Å; L367-R369 PolarHBondContact O-N 2.82Å; R369-P371 VanDerWaalsContact C-N 3.28Å; R369-P371 VanDerWaalsContact O-N 3.11Å; R369-T372 PolarHBondContact O-N 3.17Å; R369-T372 PolarHBondContact O-OG1 3.15Å; R369-L373 HydrophobicContact CB-CB 4.27Å; R369-L373 WeakPolarHBondContact O-CB 3.41Å; R369-L373 PolarHBondContact O-N 3.32Å
370	Q	86.1	Confident	90.7	Very high	53 Å²	53	48.7 Å²	48.7	25%	0.248	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.7	-36.1	180	174.8	174.8	61.3	0	0	115.3	I366 L367 T372 F375 F393 K394	I366-Q370 PolarHBondContact O-N 3.01Å; L367-Q370 WeakPolarHBondContact O-CB 3.31Å; L367-Q370 PolarHBondContact O-N 3.47Å; Q370-T372 PolarHBondContact O-N 3.46Å; Q370-F375 HydrophobicContact CB-CE2 4.19Å; Q370-F375 HydrophobicContact CG-CE2 4.04Å; Q370-F393 PolarHBondContact NE2-O 2.82Å; Q370-K394 VanDerWaalsContact NE2-CA 3.33Å
371	P	84.6	Confident	90.7	Very high	122 Å²	122	51.9 Å²	51.9	79%	0.792	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-23.8	176.3	-22.5	34.3	0	0	0	114.3	R369	R369-P371 VanDerWaalsContact C-N 3.28Å; R369-P371 VanDerWaalsContact O-N 3.11Å
372	T	90.1	Very high	90.8	Very high	98 Å²	98	50.5 Å²	50.5	60%	0.601	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.6	-21.7	-175.4	59.6	0	0	0	0	113.5	R369 Q370	R369-T372 PolarHBondContact O-N 3.17Å; R369-T372 PolarHBondContact O-OG1 3.15Å; Q370-T372 PolarHBondContact O-N 3.46Å
373	L	91.4	Very high	90.9	Very high	5 Å²	5	50.5 Å²	50.5	3%	0.026	30%	0.299	C	S	.	.			trans	-102.9	123	-173	-171.4	69.1	0	0	0	110	L347 L350 I366 R369 F375	L347-L373 HydrophobicContact CB-CD1 4.33Å; L347-L373 HydrophobicContact CD2-CD1 4.1Å; L347-L373 HydrophobicContact CG-CD1 4.05Å; L347-L373 WeakPolarHBondContact O-CD1 3.26Å; L350-L373 HydrophobicContact CB-CD1 4.03Å; L350-L373 HydrophobicContact CB-CD2 3.86Å; L350-L373 HydrophobicContact CB-CG 4.05Å; L350-L373 HydrophobicContact CD2-CD2 3.87Å; I366-L373 HydrophobicContact CG2-CD2 4.16Å; R369-L373 HydrophobicContact CB-CB 4.27Å; R369-L373 WeakPolarHBondContact O-CB 3.41Å; R369-L373 PolarHBondContact O-N 3.32Å; L373-F375 HydrophobicContact CD2-CE1 4.04Å; L373-F375 HydrophobicContact CD2-CZ 4.16Å
374	Q	93.4	Very high	90.8	Very high	131 Å²	131	51.3 Å²	51.3	61%	0.612	31%	0.307	S	S	*	.	B	Isolated β-bridge	trans	-87.7	131.3	179.1	-60.3	-178.7	7.2	0	0	110.5	E348 V349 L350 G376	E348-Q374 PolarHBondContact O-N 3.19Å; V349-Q374 CarbonylContact C-O 3.46Å; V349-Q374 WeakPolarHBondContact CA-O 3.45Å; V349-Q374 HydrophobicContact CG2-CB 4.3Å; L350-Q374 PolarHBondContact N-O 2.93Å; Q374-G376 VanDerWaalsContact C-N 3.33Å; Q374-G376 PolarHBondContact O-N 3.41Å
375	F	90.8	Very high	90.8	Very high	8 Å²	8	52.4 Å²	52.4	4%	0.035	32%	0.317	C	S	.	.			trans	-93.4	20.8	180	-65	-70.1	0	0	0	114.2	L350 I366 Q370 L373 Q378 P380 F393	L350-F375 WeakPolarHBondContact O-CA 3.38Å; L350-F375 WeakPolarHBondContact O-CD1 3.26Å; I366-F375 HydrophobicContact CG2-CE1 3.48Å; I366-F375 VanDerWaalsContact CG2-CE1 3.48Å; I366-F375 HydrophobicContact CG2-CZ 3.57Å; Q370-F375 HydrophobicContact CB-CE2 4.19Å; Q370-F375 HydrophobicContact CG-CE2 4.04Å; L373-F375 HydrophobicContact CD2-CE1 4.04Å; L373-F375 HydrophobicContact CD2-CZ 4.16Å; F375-Q378 VanDerWaalsContact O-O 3.09Å; F375-P380 HydrophobicContact CD1-CG 3.63Å; F375-P380 HydrophobicContact CE1-CG 4.09Å; F375-P380 HydrophobicContact CG-CG 4.16Å; F375-F393 HydrophobicContact CE1-CD2 4.4Å; F375-F393 HydrophobicContact CZ-CD2 4.3Å
376	G	83.4	Confident	90.8	Very high	48 Å²	48	58.1 Å²	58.1	50%	0.495	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.7	-142.5	-176.8	0	0	0	0	0	112.7	Q374	Q374-G376 VanDerWaalsContact C-N 3.33Å; Q374-G376 PolarHBondContact O-N 3.41Å
377	G	80.4	Confident	90.6	Very high	94 Å²	94	63.4 Å²	63.4	97%	0.969	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-16.7	-175.2	0	0	0	0	0	115.8
378	Q	88.1	Confident	90.7	Very high	83 Å²	83	63.1 Å²	63.1	39%	0.388	38%	0.379	S	S	.	.	S	Bend	trans	-140.1	133.6	-175.7	-170.8	-174	-0.1	0	0	111	N353 N354 F375	N353-Q378 HydrophobicContact CB-CB 4.2Å; N353-Q378 HydrophobicContact CB-CG 4.27Å; N353-Q378 PolarHBondContact ND2-OE1 2.87Å; N354-Q378 PolarHBondContact OD1-NE2 3.41Å; N354-Q378 PolarHBondContact OD1-OE1 3.25Å; F375-Q378 VanDerWaalsContact O-O 3.09Å
379	Q	91.1	Very high	90.8	Very high	65 Å²	65	63.9 Å²	63.9	30%	0.304	38%	0.377	S	S	.	.			trans	-72.4	142.5	-179.5	-70.7	-73.8	-29.2	0	0	112.2	S392 K394	Q379-S392 VanDerWaalsContact CB-OG 3.3Å; Q379-S392 WeakPolarHBondContact CB-OG 2.99Å; Q379-K394 HydrophobicContact CG-CB 4.42Å; Q379-K394 HydrophobicContact CG-CD 4.29Å
380	P	94.1	Very high	90.9	Very high	0 Å²	0	68.8 Å²	68.8	0%	0	40%	0.401	C	S	.	.			trans	-64.3	145.7	170	-18.1	31.7	0	0	0	111.3	I352 L357 F375 S392 F393	I352-P380 HydrophobicContact CG2-CB 3.88Å; I352-P380 HydrophobicContact CG2-CG 3.58Å; L357-P380 HydrophobicContact CD1-CB 3.96Å; F375-P380 HydrophobicContact CD1-CG 3.63Å; F375-P380 HydrophobicContact CE1-CG 4.09Å; F375-P380 HydrophobicContact CG-CG 4.16Å; P380-S392 WeakPolarHBondContact O-CA 3.37Å; P380-F393 HydrophobicContact CB-CD1 4.01Å; P380-F393 HydrophobicContact CB-CD2 3.83Å; P380-F393 HydrophobicContact CB-CE1 4.12Å; P380-F393 HydrophobicContact CB-CE2 3.98Å; P380-F393 HydrophobicContact CB-CG 3.87Å; P380-F393 HydrophobicContact CB-CZ 4.12Å; P380-F393 HydrophobicContact CG-CD2 3.92Å; P380-F393 HydrophobicContact CG-CE2 4.3Å; P380-F393 HydrophobicContact CG-CG 4.24Å; P380-F393 WeakPolarHBondContact O-CD1 3.43Å; P380-F393 PolarHBondContact O-N 3.19Å
381	M	94.8	Very high	91.2	Very high	80 Å²	80	71.7 Å²	71.7	39%	0.394	41%	0.41	S	S	.	.	B	Isolated β-bridge	trans	-125.2	145.9	179.3	-62.2	-176.1	-65.2	0	0	110.1	R391	M381-R391 WeakPolarHBondContact CA-O 3.22Å
382	C	96.2	Very high	91.6	Very high	4 Å²	4	66.5 Å²	66.5	3%	0.027	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	133.4	176.8	-63.9	0	0	0	0	111.1	C359 I388 E390 R391	C359-C382 HydrophobicContact CB-CB 3.75Å; C359-C382 WeakPolarHBondContact CB-SG 3.47Å; C359-C382 WeakPolarHBondContact SG-CA 3.48Å; C359-C382 WeakPolarHBondContact SG-CB 3.45Å; C359-C382 CovalentContact SG-SG 2.03Å; C359-C382 PolarHBondContact SG-SG 3.46Å; C382-I388 HydrophobicContact CB-CG1 4.36Å; C382-I388 WeakPolarHBondContact CB-O 3.39Å; C382-E390 WeakPolarHBondContact O-CA 3.46Å; C382-E390 PolarHBondContact O-N 3.08Å; C382-R391 PolarHBondContact N-O 3.05Å
383	A	96.4	Very high	91.7	Very high	41 Å²	41	61.9 Å²	61.9	34%	0.339	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	-30.2	168.8	0	0	0	0	0	112.1	P356 L357 R389	P356-A383 VanDerWaalsContact C-CB 3.47Å; P356-A383 HydrophobicContact CB-CB 4.18Å; L357-A383 PolarHBondContact O-N 3.22Å; A383-R389 WeakPolarHBondContact O-CG 3.48Å
384	G	93.1	Very high	91.6	Very high	16 Å²	16	67.9 Å²	67.9	17%	0.165	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	170.7	173.1	0	0	0	0	0	111.4	L357 C359	L357-G384 PolarHBondContact O-N 3.24Å; C359-G384 WeakPolarHBondContact CB-O 3.48Å; C359-G384 PolarHBondContact N-O 3.02Å
385	P	92.8	Very high	91.4	Very high	65 Å²	65	65.4 Å²	65.4	42%	0.422	37%	0.365	S	S	.	.	S	Bend	cis	-69.3	165.9	-1.9	28.7	-35.6	0	0	0	113.3	T387 I388 R389	P385-T387 PolarHBondContact O-N 2.95Å; P385-I388 HydrophobicContact CG-CD1 4.39Å; P385-I388 HydrophobicContact CG-CG1 4.08Å; P385-I388 PolarHBondContact O-N 3.46Å; P385-R389 PolarHBondContact O-N 2.8Å; P385-R389 VanDerWaalsContact O-N 3.16Å
386	D	91.4	Very high	91.4	Very high	134 Å²	134	65.5 Å²	65.5	72%	0.717	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-27.7	-172.9	-69.5	-43.2	0	0	0	114.4	I388	D386-I388 VanDerWaalsContact C-N 3.28Å; D386-I388 PolarHBondContact O-N 2.92Å
387	T	90.9	Very high	91.3	Very high	111 Å²	111	69.7 Å²	69.7	68%	0.681	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-27.4	178.7	53.9	0	0	0	0	113.9	P385	P385-T387 PolarHBondContact O-N 2.95Å
388	I	93.1	Very high	91	Very high	0 Å²	0	70.2 Å²	70.2	0%	0	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.6	14	-176.9	62.1	173.5	0	0	0	113	C359 C382 P385 D386 R391 F396 Y404 F405	C359-I388 HydrophobicContact CB-CD1 3.52Å; C359-I388 HydrophobicContact CB-CG1 4.39Å; C382-I388 HydrophobicContact CB-CG1 4.36Å; C382-I388 WeakPolarHBondContact CB-O 3.39Å; P385-I388 HydrophobicContact CG-CD1 4.39Å; P385-I388 HydrophobicContact CG-CG1 4.08Å; P385-I388 PolarHBondContact O-N 3.46Å; D386-I388 VanDerWaalsContact C-N 3.28Å; D386-I388 PolarHBondContact O-N 2.92Å; I388-R391 WeakPolarHBondContact O-CB 3.46Å; I388-R391 PolarHBondContact O-N 3Å; I388-F396 HydrophobicContact CB-CE1 4.37Å; I388-F396 HydrophobicContact CB-CZ 4.08Å; I388-F396 HydrophobicContact CD1-CE1 4.5Å; I388-F396 HydrophobicContact CD1-CZ 4.23Å; I388-F396 HydrophobicContact CG2-CE1 4.07Å; I388-F396 HydrophobicContact CG2-CZ 4.29Å; I388-Y404 HydrophobicContact CG2-CD1 3.5Å; I388-Y404 VanDerWaalsContact CG2-CD1 3.5Å; I388-Y404 HydrophobicContact CG2-CE1 3.99Å; I388-Y404 HydrophobicContact CG2-CG 4.3Å; I388-F405 HydrophobicContact CD1-CE2 4.49Å; I388-F405 HydrophobicContact CD1-CZ 4.41Å
389	R	93.8	Very high	90.6	Very high	142 Å²	142	72 Å²	72	54%	0.536	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	139.4	175.7	179.6	168.7	176.7	170.2	3.2	111.1	A383 P385 R391	A383-R389 WeakPolarHBondContact O-CG 3.48Å; P385-R389 PolarHBondContact O-N 2.8Å; P385-R389 VanDerWaalsContact O-N 3.16Å; R389-R391 PolarHBondContact O-N 2.86Å; R389-R391 VanDerWaalsContact O-N 3.08Å
390	E	92.4	Very high	90.2	Very high	145 Å²	145	70.3 Å²	70.3	68%	0.678	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.1	7.3	-177.8	-66.8	169.4	-161.6	0	0	115.5	C382	C382-E390 WeakPolarHBondContact O-CA 3.46Å; C382-E390 PolarHBondContact O-N 3.08Å
391	R	93.2	Very high	89.8	Confident	114 Å²	114	70.9 Å²	70.9	43%	0.43	38%	0.377	S	S	.	.			trans	-77.5	141.2	171.4	-66.2	-167.1	176.8	-167.9	0.5	111.4	M381 C382 I388 R389 F396	M381-R391 WeakPolarHBondContact CA-O 3.22Å; C382-R391 PolarHBondContact N-O 3.05Å; I388-R391 WeakPolarHBondContact O-CB 3.46Å; I388-R391 PolarHBondContact O-N 3Å; R389-R391 PolarHBondContact O-N 2.86Å; R389-R391 VanDerWaalsContact O-N 3.08Å; R391-F396 HydrophobicContact CB-CE2 4.1Å; R391-F396 HydrophobicContact CB-CZ 3.81Å
392	S	93.3	Very high	89.2	Confident	12 Å²	12	71 Å²	71	8%	0.084	39%	0.386	C	S	.	.	B	Isolated β-bridge	trans	-86.9	149.1	-179.9	157.1	0	0	0	0	110.8	Q379 P380 K394 D395 F396	Q379-S392 VanDerWaalsContact CB-OG 3.3Å; Q379-S392 WeakPolarHBondContact CB-OG 2.99Å; P380-S392 WeakPolarHBondContact O-CA 3.37Å; S392-K394 PolarHBondContact O-N 2.96Å; S392-K394 VanDerWaalsContact O-N 3.12Å; S392-K394 VanDerWaalsContact OG-CG 3.31Å; S392-K394 WeakPolarHBondContact OG-CG 2.98Å; S392-K394 PolarHBondContact OG-N 3Å; S392-D395 WeakPolarHBondContact CB-OD2 3.4Å; S392-D395 PolarHBondContact N-OD2 3.26Å; S392-D395 WeakPolarHBondContact O-CB 3.03Å; S392-D395 PolarHBondContact O-N 3.06Å; S392-F396 WeakPolarHBondContact O-CD2 3.46Å; S392-F396 WeakPolarHBondContact O-CE2 3.43Å
393	F	92	Very high	88.7	Confident	1 Å²	1	78.5 Å²	78.5	0%	0.004	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	-56.6	-32.5	179.7	-81.8	22.8	0	0	0	112.8	L357 L363 I366 L367 Q370 F375 P380 D395 F396	L357-F393 HydrophobicContact CD1-CE1 4.44Å; L357-F393 HydrophobicContact CD1-CZ 4.11Å; L363-F393 HydrophobicContact CD1-CZ 4.16Å; I366-F393 HydrophobicContact CB-CE2 4.48Å; I366-F393 HydrophobicContact CG2-CD2 4.22Å; I366-F393 HydrophobicContact CG2-CE2 3.93Å; L367-F393 HydrophobicContact CD2-CB 3.69Å; L367-F393 HydrophobicContact CD2-CD1 4.21Å; L367-F393 HydrophobicContact CD2-CD2 3.21Å; L367-F393 HydrophobicContact CD2-CE2 3.76Å; L367-F393 HydrophobicContact CD2-CG 3.45Å; L367-F393 VanDerWaalsContact CD2-CG 3.45Å; L367-F393 HydrophobicContact CD2-CZ 4.45Å; L367-F393 HydrophobicContact CG-CD2 4.32Å; L367-F393 HydrophobicContact CG-CE2 4.44Å; Q370-F393 PolarHBondContact NE2-O 2.82Å; F375-F393 HydrophobicContact CE1-CD2 4.4Å; F375-F393 HydrophobicContact CZ-CD2 4.3Å; P380-F393 HydrophobicContact CB-CD1 4.01Å; P380-F393 HydrophobicContact CB-CD2 3.83Å; P380-F393 HydrophobicContact CB-CE1 4.12Å; P380-F393 HydrophobicContact CB-CE2 3.98Å; P380-F393 HydrophobicContact CB-CG 3.87Å; P380-F393 HydrophobicContact CB-CZ 4.12Å; P380-F393 HydrophobicContact CG-CD2 3.92Å; P380-F393 HydrophobicContact CG-CE2 4.3Å; P380-F393 HydrophobicContact CG-CG 4.24Å; P380-F393 WeakPolarHBondContact O-CD1 3.43Å; P380-F393 PolarHBondContact O-N 3.19Å; F393-D395 PolarHBondContact O-N 3.18Å; F393-F396 PolarHBondContact O-N 2.91Å
394	K	89.5	Confident	88.3	Confident	132 Å²	132	81.1 Å²	81.1	57%	0.574	42%	0.42	S	S	*	.	G	3₁₀ helix	trans	-61.1	-21.9	175.5	83.2	-168.9	173.8	173.1	0	114.8	Q370 Q379 S392 F396	Q370-K394 VanDerWaalsContact NE2-CA 3.33Å; Q379-K394 HydrophobicContact CG-CB 4.42Å; Q379-K394 HydrophobicContact CG-CD 4.29Å; S392-K394 PolarHBondContact O-N 2.96Å; S392-K394 VanDerWaalsContact O-N 3.12Å; S392-K394 VanDerWaalsContact OG-CG 3.31Å; S392-K394 WeakPolarHBondContact OG-CG 2.98Å; S392-K394 PolarHBondContact OG-N 3Å; K394-F396 VanDerWaalsContact C-N 3.3Å
395	D	89.9	Confident	88.3	Confident	79 Å²	79	80.5 Å²	80.5	42%	0.422	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	-83.7	-14.1	-172.8	-53.6	-33.7	0	0	0	111.4	S392 F393 H397	S392-D395 WeakPolarHBondContact CB-OD2 3.4Å; S392-D395 PolarHBondContact N-OD2 3.26Å; S392-D395 WeakPolarHBondContact O-CB 3.03Å; S392-D395 PolarHBondContact O-N 3.06Å; F393-D395 PolarHBondContact O-N 3.18Å; D395-H397 PolarHBondContact O-ND1 3.04Å
396	F	89.1	Confident	88.3	Confident	10 Å²	10	81.2 Å²	81.2	4%	0.044	42%	0.416	C	S	.	.			trans	-91.3	125	-179.1	-59	-78.8	0	0	0	111.3	L367 I388 R391 S392 F393 K394 L401 Y404 F405	L367-F396 HydrophobicContact CD1-CB 4.24Å; L367-F396 HydrophobicContact CD1-CD2 4.31Å; L367-F396 HydrophobicContact CD1-CG 4.4Å; I388-F396 HydrophobicContact CB-CE1 4.37Å; I388-F396 HydrophobicContact CB-CZ 4.08Å; I388-F396 HydrophobicContact CD1-CE1 4.5Å; I388-F396 HydrophobicContact CD1-CZ 4.23Å; I388-F396 HydrophobicContact CG2-CE1 4.07Å; I388-F396 HydrophobicContact CG2-CZ 4.29Å; R391-F396 HydrophobicContact CB-CE2 4.1Å; R391-F396 HydrophobicContact CB-CZ 3.81Å; S392-F396 WeakPolarHBondContact O-CD2 3.46Å; S392-F396 WeakPolarHBondContact O-CE2 3.43Å; F393-F396 PolarHBondContact O-N 2.91Å; K394-F396 VanDerWaalsContact C-N 3.3Å; F396-L401 HydrophobicContact CB-CD2 3.75Å; F396-Y404 AromaticContact CD1-CD2 3.93Å; F396-Y404 HydrophobicContact CD1-CD2 3.93Å; F396-Y404 HydrophobicContact CD1-CE2 4.42Å; F396-Y404 HydrophobicContact CD1-CG 4.23Å; F396-Y404 HydrophobicContact CE1-CD1 4.46Å; F396-Y404 HydrophobicContact CE1-CD2 4.19Å; F396-Y404 HydrophobicContact CE1-CG 4.07Å; F396-F405 AromaticContact CD1-CE2 3.97Å; F396-F405 HydrophobicContact CD1-CE2 3.97Å; F396-F405 HydrophobicContact CD2-CE2 4.19Å; F396-F405 HydrophobicContact CD2-CZ 4.29Å; F396-F405 HydrophobicContact CE1-CE2 4.05Å; F396-F405 HydrophobicContact CE2-CE2 4.27Å; F396-F405 HydrophobicContact CE2-CZ 4.14Å; F396-F405 HydrophobicContact CG-CE2 4.04Å; F396-F405 HydrophobicContact CZ-CE2 4.19Å; F396-F405 HydrophobicContact CZ-CZ 4.31Å
397	H	82.2	Confident	88.5	Confident	136 Å²	136	76.3 Å²	76.3	63%	0.63	39%	0.392	S	S	*	.			trans	-93.9	147.5	176.6	-63.8	71.9	0	0	0	110.5	D395 T399 A400	D395-H397 PolarHBondContact O-ND1 3.04Å; H397-T399 PolarHBondContact O-N 2.88Å; H397-T399 VanDerWaalsContact O-N 3.11Å; H397-A400 PolarHBondContact O-N 3.4Å; H397-A400 VanDerWaalsContact O-N 3.09Å
398	S	74.9	Confident	88.6	Confident	104 Å²	104	77 Å²	77	73%	0.727	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-56.1	-31.9	-173	56.8	0	0	0	0	114.6	A400	S398-A400 VanDerWaalsContact C-N 3.32Å; S398-A400 PolarHBondContact O-N 3.06Å
399	T	78.8	Confident	88.7	Confident	122 Å²	122	82.6 Å²	82.6	75%	0.748	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-71.5	-21.2	-178.9	40.3	0	0	0	0	114.4	H397	H397-T399 PolarHBondContact O-N 2.88Å; H397-T399 VanDerWaalsContact O-N 3.11Å
400	A	82	Confident	88.8	Confident	29 Å²	29	76.1 Å²	76.1	24%	0.24	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-110.6	0.7	-175.7	0	0	0	0	0	113.9	H397 S398 S402 F403 Y404	H397-A400 PolarHBondContact O-N 3.4Å; H397-A400 VanDerWaalsContact O-N 3.09Å; S398-A400 VanDerWaalsContact C-N 3.32Å; S398-A400 PolarHBondContact O-N 3.06Å; A400-S402 VanDerWaalsContact C-N 3.29Å; A400-S402 PolarHBondContact O-N 2.9Å; A400-F403 PolarHBondContact O-N 2.81Å; A400-F403 VanDerWaalsContact O-N 3.09Å; A400-Y404 HydrophobicContact CB-CD2 4.29Å; A400-Y404 HydrophobicContact CB-CE2 3.95Å; A400-Y404 VanDerWaalsContact O-CD2 3.32Å; A400-Y404 WeakPolarHBondContact O-CD2 3.39Å
401	L	86.3	Confident	88.9	Confident	12 Å²	12	76.1 Å²	76.1	6%	0.063	38%	0.384	C	S	.	.	H	α-helix	trans	-58.6	-38.9	-174.8	-67	179.8	0	0	0	113.1	L364 L367 Q368 F396 F403 Y404 F405	L364-L401 HydrophobicContact CD1-CB 3.85Å; L364-L401 HydrophobicContact CD1-CD1 4.33Å; L367-L401 HydrophobicContact CB-CD1 4.01Å; L367-L401 HydrophobicContact CB-CD2 4.04Å; L367-L401 HydrophobicContact CD1-CD2 3.51Å; L367-L401 HydrophobicContact CG-CD2 4.44Å; Q368-L401 HydrophobicContact CG-CD1 4.48Å; F396-L401 HydrophobicContact CB-CD2 3.75Å; L401-F403 PolarHBondContact O-N 3.01Å; L401-Y404 PolarHBondContact O-N 2.99Å; L401-F405 HydrophobicContact CD2-CD2 4.36Å; L401-F405 HydrophobicContact CD2-CE2 4.48Å; L401-F405 PolarHBondContact O-N 2.81Å
402	S	82.3	Confident	88.9	Confident	81 Å²	81	70.9 Å²	70.9	57%	0.566	36%	0.364	S	S	*	.	H	α-helix	trans	-66	-16.3	179.8	52.1	0	0	0	0	114.3	A400 T406	A400-S402 VanDerWaalsContact C-N 3.29Å; A400-S402 PolarHBondContact O-N 2.9Å; S402-T406 WeakPolarHBondContact O-CG2 3.3Å
403	F	85.2	Confident	88.5	Confident	163 Å²	163	78 Å²	78	72%	0.715	39%	0.39	S	S	*	.	H	α-helix	trans	-88	-33.9	175.8	-66	-79.3	0	0	0	112.5	A400 L401	A400-F403 PolarHBondContact O-N 2.81Å; A400-F403 VanDerWaalsContact O-N 3.09Å; L401-F403 PolarHBondContact O-N 3.01Å
404	Y	88.3	Confident	87.7	Confident	95 Å²	95	83.7 Å²	83.7	37%	0.373	42%	0.416	S	S	.	.	H	α-helix	trans	-90.2	-43.1	-177.1	-65.1	-68.2	0	0	0	112.4	I388 F396 A400 L401 T406	I388-Y404 HydrophobicContact CG2-CD1 3.5Å; I388-Y404 VanDerWaalsContact CG2-CD1 3.5Å; I388-Y404 HydrophobicContact CG2-CE1 3.99Å; I388-Y404 HydrophobicContact CG2-CG 4.3Å; F396-Y404 AromaticContact CD1-CD2 3.93Å; F396-Y404 HydrophobicContact CD1-CD2 3.93Å; F396-Y404 HydrophobicContact CD1-CE2 4.42Å; F396-Y404 HydrophobicContact CD1-CG 4.23Å; F396-Y404 HydrophobicContact CE1-CD1 4.46Å; F396-Y404 HydrophobicContact CE1-CD2 4.19Å; F396-Y404 HydrophobicContact CE1-CG 4.07Å; A400-Y404 HydrophobicContact CB-CD2 4.29Å; A400-Y404 HydrophobicContact CB-CE2 3.95Å; A400-Y404 VanDerWaalsContact O-CD2 3.32Å; A400-Y404 WeakPolarHBondContact O-CD2 3.39Å; L401-Y404 PolarHBondContact O-N 2.99Å; Y404-T406 PolarHBondContact O-N 2.9Å
405	F	92.7	Very high	86.7	Confident	4 Å²	4	82.7 Å²	82.7	2%	0.018	41%	0.412	C	S	.	.	S	Bend	trans	-98.6	73.8	-173.9	-68.8	-101.3	0	0	0	109.9	C359 D360 L363 L364 L367 I388 F396 L401	C359-F405 HydrophobicContact CB-CD1 4.13Å; C359-F405 HydrophobicContact CB-CE1 3.41Å; C359-F405 VanDerWaalsContact CB-CE1 3.41Å; C359-F405 HydrophobicContact CB-CZ 3.79Å; D360-F405 WeakPolarHBondContact O-CD1 3.32Å; L363-F405 HydrophobicContact CB-CD1 4.44Å; L363-F405 HydrophobicContact CB-CE1 4.43Å; L364-F405 HydrophobicContact CD1-CB 4.16Å; L367-F405 HydrophobicContact CD1-CD1 4.22Å; L367-F405 HydrophobicContact CD1-CD2 3.8Å; L367-F405 HydrophobicContact CD1-CE1 3.68Å; L367-F405 HydrophobicContact CD1-CE2 3.24Å; L367-F405 HydrophobicContact CD1-CG 4.3Å; L367-F405 HydrophobicContact CD1-CZ 3.2Å; L367-F405 HydrophobicContact CG-CE1 4.4Å; L367-F405 HydrophobicContact CG-CZ 4.29Å; I388-F405 HydrophobicContact CD1-CE2 4.49Å; I388-F405 HydrophobicContact CD1-CZ 4.41Å; F396-F405 AromaticContact CD1-CE2 3.97Å; F396-F405 HydrophobicContact CD1-CE2 3.97Å; F396-F405 HydrophobicContact CD2-CE2 4.19Å; F396-F405 HydrophobicContact CD2-CZ 4.29Å; F396-F405 HydrophobicContact CE1-CE2 4.05Å; F396-F405 HydrophobicContact CE2-CE2 4.27Å; F396-F405 HydrophobicContact CE2-CZ 4.14Å; F396-F405 HydrophobicContact CG-CE2 4.04Å; F396-F405 HydrophobicContact CZ-CE2 4.19Å; F396-F405 HydrophobicContact CZ-CZ 4.31Å; L401-F405 HydrophobicContact CD2-CD2 4.36Å; L401-F405 HydrophobicContact CD2-CE2 4.48Å; L401-F405 PolarHBondContact O-N 2.81Å
406	T	92.8	Very high	86	Confident	80 Å²	80	87.2 Å²	87.2	49%	0.491	43%	0.427	S	S	.	.			trans	-110.3	157.9	-177.3	60.3	0	0	0	0	111.6	D360 C361 S402 Y404	D360-T406 WeakPolarHBondContact CB-O 3.48Å; C361-T406 PolarHBondContact N-O 3.03Å; S402-T406 WeakPolarHBondContact O-CG2 3.3Å; Y404-T406 PolarHBondContact O-N 2.9Å
407	C	95.1	Very high	85	Confident	30 Å²	30	92.2 Å²	92.2	20%	0.203	45%	0.454	C	S	.	.			trans	-135.2	149.8	171.2	-71.8	0	0	0	0	108.6	C361 D437 P438 A489	C361-C407 VanDerWaalsContact CA-SG 3.59Å; C361-C407 HydrophobicContact CB-CB 3.76Å; C361-C407 WeakPolarHBondContact CB-SG 3.37Å; C361-C407 PolarHBondContact N-SG 3.24Å; C361-C407 WeakPolarHBondContact SG-CB 3.25Å; C361-C407 CovalentContact SG-SG 2.01Å; C361-C407 PolarHBondContact SG-SG 2.03Å; C407-D437 CarbonylContact C-O 3.59Å; C407-D437 WeakPolarHBondContact CA-O 3.39Å; C407-D437 VanDerWaalsContact CB-O 3.3Å; C407-D437 WeakPolarHBondContact CB-O 3.22Å; C407-P438 VanDerWaalsContact SG-CD 3.58Å; C407-A489 HydrophobicContact CB-CB 3.65Å
408	K	95	Very high	84.9	Confident	127 Å²	127	87.7 Å²	87.7	55%	0.552	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.8	116.5	174.3	-176.9	-176.1	176.4	-173.8	0	109.6	D437 N487	K408-D437 HydrophobicContact CB-CB 3.84Å; K408-D437 PolarHBondContact N-O 3.05Å; K408-D437 PolarHBondContact O-N 2.89Å; K408-N487 PolarHBondContact O-ND2 2.9Å
409	K	94.4	Very high	85.4	Confident	117 Å²	117	88.7 Å²	88.7	51%	0.509	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.5	140.7	175.7	-167.5	177.7	179.7	179.1	0	110.9	A489 N491	K409-A489 HydrophobicContact CB-CB 4.09Å; K409-N491 WeakPolarHBondContact CE-O 3.48Å; K409-N491 PolarHBondContact NZ-O 3.04Å
410	P	95.9	Very high	85.9	Confident	6 Å²	6	86 Å²	86	4%	0.039	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.4	143.6	177.2	23.9	-36.7	0	0	0	111.1	D435 P440 A485 N487 G490 D492	P410-D435 CarbonylContact C-O 3.27Å; P410-D435 VanDerWaalsContact CA-O 3.29Å; P410-D435 WeakPolarHBondContact CA-O 3.32Å; P410-P440 HydrophobicContact CB-CB 3.96Å; P410-P440 HydrophobicContact CB-CG 3.7Å; P410-A485 HydrophobicContact CB-CB 4.07Å; P410-A485 WeakPolarHBondContact CG-O 3.36Å; P410-N487 WeakPolarHBondContact CD-OD1 3.35Å; P410-G490 VanDerWaalsContact CD-O 3.29Å; P410-G490 WeakPolarHBondContact CD-O 3.45Å; P410-G490 WeakPolarHBondContact CG-O 3.34Å; P410-D492 HydrophobicContact CB-CB 4.48Å; P410-D492 HydrophobicContact CG-CB 4.42Å; P410-D492 WeakPolarHBondContact O-CB 3.08Å
411	K	94.7	Very high	86.2	Confident	145 Å²	145	89.4 Å²	89.4	63%	0.63	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.7	116	171.4	-174.1	178	-179.8	-177.7	0	108.5	R413 A434 D435	K411-R413 PolarHBondContact O-N 3.45Å; K411-A434 WeakPolarHBondContact O-CA 3.31Å; K411-D435 PolarHBondContact N-O 3.35Å; K411-D435 PolarHBondContact O-N 2.86Å
412	I	92.4	Very high	86.5	Confident	4 Å²	4	89.3 Å²	89.3	2%	0.021	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	124.9	176.3	-63.5	172.1	0	0	0	108.1	S433 A434 A485 D492 F494	I412-S433 WeakPolarHBondContact CA-O 3.44Å; I412-A434 HydrophobicContact CG1-CB 4.09Å; I412-A485 HydrophobicContact CD1-CB 4.29Å; I412-A485 HydrophobicContact CG1-CB 3.95Å; I412-D492 HydrophobicContact CD1-CB 4.43Å; I412-D492 HydrophobicContact CG1-CB 4.29Å; I412-D492 PolarHBondContact N-OD2 2.87Å; I412-F494 HydrophobicContact CD1-CB 3.62Å; I412-F494 HydrophobicContact CG2-CB 4.21Å
413	R	86.3	Confident	86.9	Confident	162 Å²	162	89 Å²	89	61%	0.611	41%	0.412	S	S	*	.	S	Bend	trans	-64	-47.1	-170.8	-72.6	-174.7	174.1	179.6	5.9	112	K411 S433 D435	K411-R413 PolarHBondContact O-N 3.45Å; R413-S433 PolarHBondContact N-O 3.45Å; R413-D435 IonicContact CZ-OD1 3.59Å; R413-D435 VanDerWaalsContact CZ-OD1 3.23Å; R413-D435 IonicContact CZ-OD2 4Å; R413-D435 IonicContact NE-OD1 2.84Å; R413-D435 PolarHBondContact NE-OD1 2.03Å; R413-D435 IonicContact NE-OD2 2.69Å; R413-D435 PolarHBondContact NE-OD2 3.42Å; R413-D435 IonicContact NH2-OD1 3.53Å; R413-D435 PolarHBondContact NH2-OD1 3.37Å; R413-D435 IonicContact NH2-OD2 2.76Å
414	E	73.9	Confident	87.2	Confident	120 Å²	120	85 Å²	85	56%	0.561	40%	0.396	S	S	*	.			trans	-114.1	107.4	-177.1	-65.5	-166.3	-168.4	0	0	111	K416	E414-K416 VanDerWaalsContact C-N 3.34Å
415	K	69.8	Low	87.2	Confident	111 Å²	111	82.3 Å²	82.3	48%	0.483	40%	0.397	S	S	.	.			trans	-96.8	17.5	171.8	-60.4	-165.5	178.7	-159.2	0	112.6	L417 D492 F494	K415-L417 PolarHBondContact O-N 2.83Å; K415-D492 VanDerWaalsContact CE-OD2 3.3Å; K415-D492 WeakPolarHBondContact CE-OD2 3.35Å; K415-D492 VanDerWaalsContact NZ-CG 3.33Å; K415-D492 IonicContact NZ-OD1 3.53Å; K415-D492 PolarHBondContact NZ-OD1 2.65Å; K415-D492 IonicContact NZ-OD2 3.79Å; K415-D492 PolarHBondContact NZ-OD2 3.29Å; K415-F494 HydrophobicContact CB-CD2 4.19Å; K415-F494 HydrophobicContact CB-CE2 4.43Å; K415-F494 HydrophobicContact CG-CD2 4.41Å
416	K	73.4	Confident	87.2	Confident	173 Å²	173	86.8 Å²	86.8	75%	0.752	42%	0.418	S	S	*	.	S	Bend	trans	-65.7	125.4	177.3	-171.5	178.1	-180	-175.9	0	107.8	E414 Q418 F494	E414-K416 VanDerWaalsContact C-N 3.34Å; K416-Q418 PolarHBondContact O-N 2.84Å; K416-F494 WeakPolarHBondContact O-CZ 3.45Å
417	L	68.6	Low	87.2	Confident	115 Å²	115	86.6 Å²	86.6	60%	0.602	42%	0.417	S	S	*	.			trans	-50.9	109	-178.6	-146.3	76.5	0	0	0	109.7	K415 H419	K415-L417 PolarHBondContact O-N 2.83Å; L417-H419 WeakPolarHBondContact CD2-NE2 3.48Å; L417-H419 VanDerWaalsContact CG-NE2 3.32Å; L417-H419 WeakPolarHBondContact CG-NE2 3.4Å; L417-H419 PolarHBondContact O-N 3.43Å
418	Q	79.8	Confident	87	Confident	42 Å²	42	85.3 Å²	85.3	20%	0.196	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	107.6	178.4	-74.6	-179.1	22.5	0	0	107.9	K416 E431 F494 A496 S497	K416-Q418 PolarHBondContact O-N 2.84Å; Q418-E431 PolarHBondContact NE2-O 3.47Å; Q418-F494 HydrophobicContact CB-CE1 4.28Å; Q418-F494 HydrophobicContact CB-CZ 4.18Å; Q418-F494 HydrophobicContact CG-CE1 4.04Å; Q418-F494 HydrophobicContact CG-CZ 4Å; Q418-A496 HydrophobicContact CB-CB 3.92Å; Q418-S497 PolarHBondContact O-N 2.98Å
419	H	86.4	Confident	86.9	Confident	124 Å²	124	84 Å²	84	57%	0.574	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.3	108.8	168.9	-73.7	-81.9	0	0	0	108.2	L417 S497	L417-H419 WeakPolarHBondContact CD2-NE2 3.48Å; L417-H419 VanDerWaalsContact CG-NE2 3.32Å; L417-H419 WeakPolarHBondContact CG-NE2 3.4Å; L417-H419 PolarHBondContact O-N 3.43Å; H419-S497 WeakPolarHBondContact CA-O 3.4Å; H419-S497 VanDerWaalsContact ND1-CB 3.27Å; H419-S497 WeakPolarHBondContact ND1-CB 3.31Å; H419-S497 PolarHBondContact ND1-OG 3.46Å
420	L	88.5	Confident	86.8	Confident	65 Å²	65	78.5 Å²	78.5	34%	0.34	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	129.6	179.7	-156.7	78.4	0	0	0	110	V422 V428 L430 S497 L498 T499	L420-V422 HydrophobicContact CB-CG2 4.44Å; L420-V422 HydrophobicContact CD2-CG2 3.44Å; L420-V422 VanDerWaalsContact CD2-CG2 3.44Å; L420-V422 HydrophobicContact CG-CG2 3.61Å; L420-V428 HydrophobicContact CD2-CB 4.47Å; L420-V428 HydrophobicContact CD2-CG1 3.6Å; L420-L430 HydrophobicContact CB-CD2 4.32Å; L420-L430 HydrophobicContact CD2-CD2 4.46Å; L420-S497 PolarHBondContact N-O 3.04Å; L420-L498 HydrophobicContact CB-CD1 4.2Å; L420-L498 HydrophobicContact CD2-CD1 4.34Å; L420-T499 PolarHBondContact O-N 3.13Å
421	L	89.7	Confident	86.6	Confident	101 Å²	101	83.8 Å²	83.8	53%	0.529	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	118.5	177.3	-173.4	68.5	0	0	0	107.9	T499 K501	L421-T499 WeakPolarHBondContact CA-O 3.39Å; L421-T499 HydrophobicContact CD1-CG2 3.72Å; L421-K501 HydrophobicContact CD1-CD 4.32Å; L421-K501 HydrophobicContact CD1-CG 3.97Å; L421-K501 HydrophobicContact CD2-CD 4.45Å; L421-K501 HydrophobicContact CG-CD 4.25Å; L421-K501 HydrophobicContact CG-CG 4.37Å
422	V	91.1	Very high	86.5	Confident	10 Å²	10	77.1 Å²	77.1	6%	0.061	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	142.3	-167.9	-177.5	0	0	0	0	110.2	L420 Q426 V428 A473 L498 T499 V500 K501	L420-V422 HydrophobicContact CB-CG2 4.44Å; L420-V422 HydrophobicContact CD2-CG2 3.44Å; L420-V422 VanDerWaalsContact CD2-CG2 3.44Å; L420-V422 HydrophobicContact CG-CG2 3.61Å; V422-Q426 HydrophobicContact CG1-CB 3.55Å; V422-Q426 HydrophobicContact CG1-CG 4.45Å; V422-V428 HydrophobicContact CB-CG2 4.08Å; V422-V428 HydrophobicContact CG1-CG2 3.8Å; V422-V428 HydrophobicContact CG2-CG2 3.94Å; V422-A473 HydrophobicContact CG1-CB 4.45Å; V422-L498 HydrophobicContact CB-CD1 4.38Å; V422-L498 HydrophobicContact CG2-CD1 4.01Å; V422-T499 PolarHBondContact N-O 3.05Å; V422-V500 CarbonylContact O-C 3.46Å; V422-V500 VanDerWaalsContact O-CA 3.25Å; V422-V500 WeakPolarHBondContact O-CA 3.2Å; V422-K501 PolarHBondContact O-N 2.92Å
423	D	91.1	Very high	86.4	Confident	75 Å²	75	79.2 Å²	79.2	40%	0.401	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	146.9	176.7	-60.2	-44.8	0	0	0	111.1	G425 Q426	D423-G425 PolarHBondContact O-N 3.25Å; D423-Q426 HydrophobicContact CB-CG 4.46Å; D423-Q426 WeakPolarHBondContact O-CB 3.4Å; D423-Q426 PolarHBondContact O-N 3.26Å; D423-Q426 VanDerWaalsContact O-N 3.15Å
424	E	91.8	Very high	86.8	Confident	79 Å²	79	72.1 Å²	72.1	37%	0.369	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	132.1	177.7	-169.9	171.3	-158.6	0	0	111.6	A473 V500 K501 F503	E424-A473 WeakPolarHBondContact CG-O 3.39Å; E424-V500 HydrophobicContact CB-CG1 4.16Å; E424-K501 PolarHBondContact N-O 3.44Å; E424-F503 HydrophobicContact CB-CD2 4.42Å
425	G	88.1	Confident	87.7	Confident	38 Å²	38	69 Å²	69	39%	0.392	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.5	-13	-178	0	0	0	0	0	115.7	D423 A473	D423-G425 PolarHBondContact O-N 3.25Å; G425-A473 PolarHBondContact N-O 3.3Å
426	Q	92	Very high	88.9	Confident	99 Å²	99	64.1 Å²	64.1	46%	0.463	34%	0.335	S	S	.	.			trans	-76.2	163.1	176.1	-68.2	-172.9	-18.2	0	0	112.8	V422 D423 A473	V422-Q426 HydrophobicContact CG1-CB 3.55Å; V422-Q426 HydrophobicContact CG1-CG 4.45Å; D423-Q426 HydrophobicContact CB-CG 4.46Å; D423-Q426 WeakPolarHBondContact O-CB 3.4Å; D423-Q426 PolarHBondContact O-N 3.26Å; D423-Q426 VanDerWaalsContact O-N 3.15Å; Q426-A473 WeakPolarHBondContact O-CB 3.39Å; Q426-A473 PolarHBondContact O-N 3.07Å
427	T	92.8	Very high	89.8	Confident	76 Å²	76	60.2 Å²	60.2	47%	0.466	32%	0.322	S	S	.	.			trans	-92.3	132.6	174.2	-59.6	0	0	0	0	109.9	E469 I470 R471	T427-E469 HydrophobicContact CG2-CG 3.77Å; T427-I470 WeakPolarHBondContact CA-O 3.31Å; T427-R471 HydrophobicContact CG2-CG 4.17Å
428	V	92.3	Very high	91.1	Very high	2 Å²	2	55.5 Å²	55.5	1%	0.012	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	137.2	-177.6	174.4	0	0	0	0	109.6	L420 V422 L430 E469 I470 A473 L498	L420-V428 HydrophobicContact CD2-CB 4.47Å; L420-V428 HydrophobicContact CD2-CG1 3.6Å; V422-V428 HydrophobicContact CB-CG2 4.08Å; V422-V428 HydrophobicContact CG1-CG2 3.8Å; V422-V428 HydrophobicContact CG2-CG2 3.94Å; V428-L430 HydrophobicContact CG1-CD2 4.34Å; V428-L430 HydrophobicContact CG1-CG 4.1Å; V428-E469 CarbonylContact O-C 3.59Å; V428-E469 VanDerWaalsContact O-CA 3.29Å; V428-E469 WeakPolarHBondContact O-CA 3.33Å; V428-I470 HydrophobicContact CB-CB 4.18Å; V428-I470 PolarHBondContact N-O 3.3Å; V428-I470 PolarHBondContact O-N 2.97Å; V428-A473 HydrophobicContact CG2-CB 3.94Å; V428-L498 HydrophobicContact CG1-CD1 3.89Å; V428-L498 HydrophobicContact CG1-CD2 4.12Å; V428-L498 HydrophobicContact CG2-CD1 3.99Å; V428-L498 HydrophobicContact CG2-CD2 4.24Å
429	Q	92.9	Very high	91.7	Very high	100 Å²	100	60.5 Å²	60.5	47%	0.467	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	123.2	170.4	-69.3	-179.2	-8.9	0	0	109.3	T467 L468 E469	Q429-T467 HydrophobicContact CB-CG2 3.94Å; Q429-T467 HydrophobicContact CG-CG2 4.44Å; Q429-L468 CarbonylContact C-O 3.48Å; Q429-L468 WeakPolarHBondContact CA-O 3.49Å; Q429-E469 HydrophobicContact CG-CB 4.41Å; Q429-E469 HydrophobicContact CG-CG 4.25Å; Q429-E469 PolarHBondContact NE2-OE1 3.29Å; Q429-E469 VanDerWaalsContact NE2-OE1 3.13Å
430	L	91.7	Very high	92	Very high	1 Å²	1	55.5 Å²	55.5	1%	0.005	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	110	174.4	-61.9	174.9	0	0	0	108.1	L420 V428 W444 T467 L468 Y481 A496	L420-L430 HydrophobicContact CB-CD2 4.32Å; L420-L430 HydrophobicContact CD2-CD2 4.46Å; V428-L430 HydrophobicContact CG1-CD2 4.34Å; V428-L430 HydrophobicContact CG1-CG 4.1Å; L430-W444 HydrophobicContact CB-CH2 3.64Å; L430-W444 HydrophobicContact CB-CZ2 4.02Å; L430-W444 HydrophobicContact CB-CZ3 4.23Å; L430-W444 HydrophobicContact CD1-CZ3 4.32Å; L430-W444 WeakPolarHBondContact O-CZ2 3.44Å; L430-T467 CarbonylContact O-C 3.43Å; L430-T467 WeakPolarHBondContact O-CA 3.06Å; L430-T467 WeakPolarHBondContact O-CG2 3.28Å; L430-L468 HydrophobicContact CB-CB 4.36Å; L430-L468 HydrophobicContact CD1-CD2 4.37Å; L430-L468 PolarHBondContact N-O 3.26Å; L430-L468 PolarHBondContact O-N 3.08Å; L430-Y481 HydrophobicContact CD1-CD1 4.4Å; L430-Y481 HydrophobicContact CD1-CD2 4.1Å; L430-Y481 HydrophobicContact CD1-CG 3.92Å; L430-A496 HydrophobicContact CD1-CB 4.16Å; L430-A496 HydrophobicContact CD2-CB 4.19Å
431	E	91.6	Very high	92.2	Very high	117 Å²	117	57.2 Å²	57.2	55%	0.547	31%	0.313	S	S	.	.			trans	-76.3	136.6	-174.1	-66.2	179.7	-171.4	0	0	111	Q418 T467	Q418-E431 PolarHBondContact NE2-O 3.47Å; E431-T467 HydrophobicContact CG-CG2 4.31Å
432	C	91.4	Very high	92.4	Very high	5 Å²	5	53.4 Å²	53.4	3%	0.034	29%	0.293	C	S	.	.			trans	-148.6	113.5	168.8	-173.7	0	0	0	0	109.3	I442 W444 D465 G466 C483	C432-I442 HydrophobicContact CB-CG2 4.38Å; C432-I442 WeakPolarHBondContact O-CD1 3.42Å; C432-W444 HydrophobicContact CB-CH2 4.2Å; C432-W444 HydrophobicContact CB-CZ2 3.4Å; C432-D465 VanDerWaalsContact O-O 3.12Å; C432-G466 CarbonylContact O-C 3.56Å; C432-G466 WeakPolarHBondContact O-CA 3.26Å; C432-C483 HydrophobicContact CB-CB 3.75Å; C432-C483 WeakPolarHBondContact CB-SG 3.21Å; C432-C483 WeakPolarHBondContact SG-CB 3.42Å; C432-C483 CovalentContact SG-SG 2.02Å; C432-C483 PolarHBondContact SG-SG 2.85Å
433	S	92.3	Very high	92.6	Very high	49 Å²	49	53.9 Å²	53.9	34%	0.343	30%	0.297	S	S	.	.			trans	-122.1	139.5	174.7	62.8	0	0	0	0	110.2	I412 R413	I412-S433 WeakPolarHBondContact CA-O 3.44Å; R413-S433 PolarHBondContact N-O 3.45Å
434	A	93.1	Very high	92.8	Very high	13 Å²	13	50.3 Å²	50.3	11%	0.107	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	140.5	-176.2	0	0	0	0	0	111.7	K411 I412 P440 I442 A485	K411-A434 WeakPolarHBondContact O-CA 3.31Å; I412-A434 HydrophobicContact CG1-CB 4.09Å; A434-P440 HydrophobicContact CB-CB 4.4Å; A434-P440 HydrophobicContact CB-CG 4.32Å; A434-I442 HydrophobicContact CB-CD1 4.25Å; A434-A485 HydrophobicContact CB-CB 3.44Å; A434-A485 VanDerWaalsContact CB-CB 3.44Å
435	D	94.1	Very high	93	Very high	54 Å²	54	47.7 Å²	47.7	29%	0.289	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	136	171.7	-69.3	-37.6	0	0	0	110.3	P410 K411 R413	P410-D435 CarbonylContact C-O 3.27Å; P410-D435 VanDerWaalsContact CA-O 3.29Å; P410-D435 WeakPolarHBondContact CA-O 3.32Å; K411-D435 PolarHBondContact N-O 3.35Å; K411-D435 PolarHBondContact O-N 2.86Å; R413-D435 IonicContact CZ-OD1 3.59Å; R413-D435 VanDerWaalsContact CZ-OD1 3.23Å; R413-D435 IonicContact CZ-OD2 4Å; R413-D435 IonicContact NE-OD1 2.84Å; R413-D435 PolarHBondContact NE-OD1 2.03Å; R413-D435 IonicContact NE-OD2 2.69Å; R413-D435 PolarHBondContact NE-OD2 3.42Å; R413-D435 IonicContact NH2-OD1 3.53Å; R413-D435 PolarHBondContact NH2-OD1 3.37Å; R413-D435 IonicContact NH2-OD2 2.76Å
436	G	94.1	Very high	93.2	Very high	8 Å²	8	46.7 Å²	46.7	8%	0.082	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.3	169.6	174.8	0	0	0	0	0	110.1	P438	G436-P438 CarbonylContact C-O 3.49Å; G436-P438 VanDerWaalsContact C-O 3.27Å
437	D	93.1	Very high	93.1	Very high	91 Å²	91	44.3 Å²	44.3	49%	0.487	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	115.2	175.3	-173.1	39.9	0	0	0	109	C407 K408	C407-D437 CarbonylContact C-O 3.59Å; C407-D437 WeakPolarHBondContact CA-O 3.39Å; C407-D437 VanDerWaalsContact CB-O 3.3Å; C407-D437 WeakPolarHBondContact CB-O 3.22Å; K408-D437 HydrophobicContact CB-CB 3.84Å; K408-D437 PolarHBondContact N-O 3.05Å; K408-D437 PolarHBondContact O-N 2.89Å
438	P	94.4	Very high	92.9	Very high	17 Å²	17	47.2 Å²	47.2	11%	0.11	25%	0.249	C	C	.	.	S	Bend	cis	-58.6	162.8	-3	-23.1	32.5	0	0	0	113.9	D360 C407 G436 N487	D360-P438 WeakPolarHBondContact OD2-CG 3.46Å; C407-P438 VanDerWaalsContact SG-CD 3.58Å; G436-P438 CarbonylContact C-O 3.49Å; G436-P438 VanDerWaalsContact C-O 3.27Å; P438-N487 PolarHBondContact O-ND2 3.43Å
439	Q	92.9	Very high	92.8	Very high	147 Å²	147	57.5 Å²	57.5	69%	0.687	29%	0.288	S	S	*	.	P	Polyproline II helix	trans	-52.9	123.6	178.8	-72.4	-62.9	-20.1	0	0	111.3
440	P	93.8	Very high	92.7	Very high	18 Å²	18	60.5 Å²	60.5	12%	0.117	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-68.4	141.1	-175.9	-20.6	33.1	0	0	0	113.4	P410 A434 A485 S486	P410-P440 HydrophobicContact CB-CB 3.96Å; P410-P440 HydrophobicContact CB-CG 3.7Å; A434-P440 HydrophobicContact CB-CB 4.4Å; A434-P440 HydrophobicContact CB-CG 4.32Å; P440-A485 HydrophobicContact CB-CB 4.3Å; P440-S486 CarbonylContact C-O 3.54Å; P440-S486 WeakPolarHBondContact CA-O 3.43Å
441	V	92.8	Very high	92.7	Very high	101 Å²	101	67.1 Å²	67.1	61%	0.612	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.4	129.5	168.4	-177.9	0	0	0	0	108.8	S486	V441-S486 PolarHBondContact N-O 3.06Å; V441-S486 PolarHBondContact O-N 3.26Å
442	I	94	Very high	92.8	Very high	21 Å²	21	62.5 Å²	62.5	11%	0.108	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	133.2	-178.5	-60.7	-174.4	0	0	0	110.3	C432 A434 G466 A485	C432-I442 HydrophobicContact CB-CG2 4.38Å; C432-I442 WeakPolarHBondContact O-CD1 3.42Å; A434-I442 HydrophobicContact CB-CD1 4.25Å; I442-G466 WeakPolarHBondContact CG2-O 3.01Å; I442-A485 HydrophobicContact CG1-CB 4.38Å
443	S	94.9	Very high	92.7	Very high	21 Å²	21	64.7 Å²	64.7	15%	0.147	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	155.7	177	61.3	0	0	0	0	110.6	I452 I484	S443-I452 WeakPolarHBondContact CA-O 3.47Å; S443-I484 PolarHBondContact N-O 2.88Å; S443-I484 PolarHBondContact O-N 3.46Å; S443-I484 PolarHBondContact OG-O 3.34Å
444	W	95	Very high	92.4	Very high	0 Å²	0	66.8 Å²	66.8	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	137.8	-176.9	-75.9	85.4	0	0	0	112.1	L430 C432 F451 I452 V462 G466 L468 V482 C483 A496	L430-W444 HydrophobicContact CB-CH2 3.64Å; L430-W444 HydrophobicContact CB-CZ2 4.02Å; L430-W444 HydrophobicContact CB-CZ3 4.23Å; L430-W444 HydrophobicContact CD1-CZ3 4.32Å; L430-W444 WeakPolarHBondContact O-CZ2 3.44Å; C432-W444 HydrophobicContact CB-CH2 4.2Å; C432-W444 HydrophobicContact CB-CZ2 3.4Å; W444-F451 CarbonylContact O-C 3.03Å; W444-F451 WeakPolarHBondContact O-CA 3.42Å; W444-I452 HydrophobicContact CB-CB 4.47Å; W444-I452 PolarHBondContact N-O 2.98Å; W444-I452 PolarHBondContact O-N 3.13Å; W444-V462 HydrophobicContact CG-CG2 4.49Å; W444-G466 PolarHBondContact NE1-O 2.97Å; W444-L468 HydrophobicContact CB-CD1 4.3Å; W444-L468 HydrophobicContact CB-CD2 4.03Å; W444-L468 HydrophobicContact CD2-CB 3.73Å; W444-L468 HydrophobicContact CD2-CD2 3.96Å; W444-L468 HydrophobicContact CD2-CG 4.42Å; W444-L468 HydrophobicContact CE3-CB 4.44Å; W444-L468 HydrophobicContact CE3-CD2 4.07Å; W444-L468 HydrophobicContact CG-CB 3.79Å; W444-L468 HydrophobicContact CG-CD1 4.36Å; W444-L468 HydrophobicContact CG-CD2 3.99Å; W444-L468 HydrophobicContact CG-CG 4.27Å; W444-L468 HydrophobicContact CZ2-CB 4.11Å; W444-V482 CarbonylContact C-O 3.57Å; W444-V482 WeakPolarHBondContact CA-O 3.41Å; W444-C483 HydrophobicContact CD2-CB 3.97Å; W444-C483 HydrophobicContact CE3-CB 3.93Å; W444-C483 HydrophobicContact CH2-CB 3.76Å; W444-C483 HydrophobicContact CZ2-CB 3.78Å; W444-C483 HydrophobicContact CZ3-CB 3.82Å; W444-A496 HydrophobicContact CH2-CB 4.3Å; W444-A496 HydrophobicContact CZ3-CB 4.14Å
445	V	95	Very high	91.9	Very high	23 Å²	23	73.2 Å²	73.2	14%	0.139	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	121.3	171.3	-174.7	0	0	0	0	108.9	R450 F451 Y481 V482 I484	V445-R450 WeakPolarHBondContact CA-O 3.5Å; V445-F451 HydrophobicContact CG2-CD1 3.8Å; V445-F451 HydrophobicContact CG2-CE1 3.56Å; V445-F451 HydrophobicContact CG2-CG 4.44Å; V445-F451 HydrophobicContact CG2-CZ 4.01Å; V445-Y481 WeakPolarHBondContact O-CA 3.34Å; V445-V482 HydrophobicContact CB-CB 4.24Å; V445-V482 PolarHBondContact N-O 3.29Å; V445-V482 PolarHBondContact O-N 3.21Å; V445-I484 HydrophobicContact CG2-CD1 3.62Å; V445-I484 HydrophobicContact CG2-CG1 4.44Å
446	T	92.4	Very high	91.6	Very high	17 Å²	17	72.1 Å²	72.1	10%	0.104	35%	0.349	C	S	.	.			trans	-74.8	164	177.5	62.1	0	0	0	0	111.9	R448 R449 R450 I452 Y481	T446-R448 PolarHBondContact O-N 3.28Å; T446-R449 WeakPolarHBondContact O-CA 3.29Å; T446-R449 PolarHBondContact O-N 2.97Å; T446-R450 HydrophobicContact CG2-CB 4.37Å; T446-R450 PolarHBondContact N-O 2.96Å; T446-R450 WeakPolarHBondContact OG1-CA 3.45Å; T446-R450 VanDerWaalsContact OG1-CB 3.3Å; T446-R450 WeakPolarHBondContact OG1-CB 3.23Å; T446-R450 PolarHBondContact OG1-N 3.4Å; T446-R450 PolarHBondContact OG1-O 2.75Å; T446-I452 HydrophobicContact CG2-CD1 4.2Å; T446-I452 HydrophobicContact CG2-CG1 3.82Å; T446-Y481 HydrophobicContact CG2-CD1 4.41Å; T446-Y481 HydrophobicContact CG2-CE1 3.91Å
447	P	90.3	Very high	91	Very high	50 Å²	50	79.5 Å²	79.5	33%	0.325	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-27.1	174.8	-24.4	31.6	0	0	0	113.2	R449 M480 Y481	P447-R449 VanDerWaalsContact C-N 3.28Å; P447-R449 PolarHBondContact O-N 3.31Å; P447-M480 WeakPolarHBondContact CA-O 3.48Å; P447-M480 WeakPolarHBondContact CG-O 3.07Å; P447-Y481 VanDerWaalsContact CD-CZ 3.42Å; P447-Y481 HydrophobicContact CG-CD2 3.98Å; P447-Y481 HydrophobicContact CG-CE2 3.61Å
448	R	89.6	Confident	90.7	Very high	136 Å²	136	77.3 Å²	77.3	51%	0.513	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	16.5	176.7	-64.4	-178.8	170.4	-177.5	-7.6	113.7	T446 R450 Q476	T446-R448 PolarHBondContact O-N 3.28Å; R448-R450 PolarHBondContact O-N 2.93Å; R448-Q476 VanDerWaalsContact CZ-OE1 3.27Å
449	R	89.9	Confident	90.5	Very high	218 Å²	218	80.3 Å²	80.3	82%	0.823	40%	0.395	S	S	*	.			trans	59.3	23.4	179.5	-56.5	-175.2	176.1	-171.6	-1.2	115.2	T446 P447	T446-R449 WeakPolarHBondContact O-CA 3.29Å; T446-R449 PolarHBondContact O-N 2.97Å; P447-R449 VanDerWaalsContact C-N 3.28Å; P447-R449 PolarHBondContact O-N 3.31Å
450	R	90.5	Very high	90.3	Very high	164 Å²	164	74.4 Å²	74.4	62%	0.619	37%	0.371	S	S	*	.			trans	-84	135.7	171.1	-56.1	-178.7	176.4	-178.4	-2.5	110.3	V445 T446 R448	V445-R450 WeakPolarHBondContact CA-O 3.5Å; T446-R450 HydrophobicContact CG2-CB 4.37Å; T446-R450 PolarHBondContact N-O 2.96Å; T446-R450 WeakPolarHBondContact OG1-CA 3.45Å; T446-R450 VanDerWaalsContact OG1-CB 3.3Å; T446-R450 WeakPolarHBondContact OG1-CB 3.23Å; T446-R450 PolarHBondContact OG1-N 3.4Å; T446-R450 PolarHBondContact OG1-O 2.75Å; R448-R450 PolarHBondContact O-N 2.93Å
451	F	91.8	Very high	90.3	Very high	139 Å²	139	74.7 Å²	74.7	61%	0.61	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.1	127.2	173.1	-75	-93.7	0	0	0	110.6	W444 V445 I484	W444-F451 CarbonylContact O-C 3.03Å; W444-F451 WeakPolarHBondContact O-CA 3.42Å; V445-F451 HydrophobicContact CG2-CD1 3.8Å; V445-F451 HydrophobicContact CG2-CE1 3.56Å; V445-F451 HydrophobicContact CG2-CG 4.44Å; V445-F451 HydrophobicContact CG2-CZ 4.01Å; F451-I484 HydrophobicContact CE1-CD1 4.26Å
452	I	92.6	Very high	90.2	Very high	20 Å²	20	70.5 Å²	70.5	10%	0.103	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	130.4	175	-45.4	-62.2	0	0	0	108	S443 W444 T446 V462 L468	S443-I452 WeakPolarHBondContact CA-O 3.47Å; W444-I452 HydrophobicContact CB-CB 4.47Å; W444-I452 PolarHBondContact N-O 2.98Å; W444-I452 PolarHBondContact O-N 3.13Å; T446-I452 HydrophobicContact CG2-CD1 4.2Å; T446-I452 HydrophobicContact CG2-CG1 3.82Å; I452-V462 HydrophobicContact CB-CG2 4.3Å; I452-V462 HydrophobicContact CG2-CG2 3.9Å; I452-L468 HydrophobicContact CB-CD1 4.39Å; I452-L468 HydrophobicContact CG2-CD1 4.13Å
453	T	90.3	Very high	90	Very high	52 Å²	52	72.4 Å²	72.4	32%	0.319	36%	0.357	S	S	.	.			trans	-128.6	176.9	179.7	65.4	0	0	0	0	109.4	K455 S456	T453-K455 PolarHBondContact O-N 3.43Å; T453-K455 PolarHBondContact OG1-N 3.46Å; T453-S456 PolarHBondContact N-OG 3.05Å; T453-S456 WeakPolarHBondContact O-CB 3.44Å; T453-S456 PolarHBondContact O-N 3.34Å; T453-S456 VanDerWaalsContact O-N 3.09Å; T453-S456 PolarHBondContact O-OG 2.55Å; T453-S456 PolarHBondContact OG1-OG 2.98Å
454	T	85.3	Confident	89.5	Confident	93 Å²	93	75.7 Å²	75.7	57%	0.571	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-21	172.9	52.4	0	0	0	0	113.5	V462	T454-V462 HydrophobicContact CG2-CB 4.42Å; T454-V462 HydrophobicContact CG2-CG1 4.26Å
455	K	84.1	Confident	89	Confident	147 Å²	147	80.3 Å²	80.3	64%	0.639	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-6	175.7	-62.2	-174.4	179.6	-175.2	0	113.4	E313 T453	E313-K455 IonicContact OE1-NZ 2.72Å; E313-K455 PolarHBondContact OE1-NZ 2.8Å; E313-K455 IonicContact OE2-NZ 3.95Å; T453-K455 PolarHBondContact O-N 3.43Å; T453-K455 PolarHBondContact OG1-N 3.46Å
456	S	85.8	Confident	88.7	Confident	31 Å²	31	79.4 Å²	79.4	22%	0.217	41%	0.414	C	S	.	.			trans	-78.4	133.2	-176.2	-62.3	0	0	0	0	111.3	T453	T453-S456 PolarHBondContact N-OG 3.05Å; T453-S456 WeakPolarHBondContact O-CB 3.44Å; T453-S456 PolarHBondContact O-N 3.34Å; T453-S456 VanDerWaalsContact O-N 3.09Å; T453-S456 PolarHBondContact O-OG 2.55Å; T453-S456 PolarHBondContact OG1-OG 2.98Å
457	N	82.2	Confident	88.7	Confident	163 Å²	163	78.9 Å²	78.9	87%	0.872	41%	0.411	S	S	*	.			trans	-104.8	135.3	177.1	-67.6	-16	0	0	0	110.7
458	G	86.4	Confident	88.8	Confident	45 Å²	45	76.5 Å²	76.5	46%	0.464	40%	0.395	S	S	.	.	S	Bend	trans	154.4	-160.9	175.2	0	0	0	0	0	113.9	A460 R471	G458-A460 VanDerWaalsContact C-N 3.33Å; G458-R471 PolarHBondContact O-NH2 2.83Å
459	R	90.1	Very high	89	Confident	81 Å²	81	71.8 Å²	71.8	31%	0.306	38%	0.38	S	S	.	.	S	Bend	trans	-66.3	-34.6	173.2	-69.2	-164.9	-58	101.4	-2.3	112.5	I470 R471 F472 D477	R459-I470 WeakPolarHBondContact O-CA 3.45Å; R459-R471 WeakPolarHBondContact CD-O 3.33Å; R459-R471 PolarHBondContact NH1-O 3.11Å; R459-R471 VanDerWaalsContact NH1-O 3.15Å; R459-R471 PolarHBondContact O-N 3.15Å; R459-F472 PolarHBondContact NH1-O 3.09Å; R459-F472 VanDerWaalsContact NH1-O 3.08Å; R459-D477 IonicContact CZ-OD1 3.03Å; R459-D477 IonicContact CZ-OD2 2.8Å; R459-D477 IonicContact NH1-OD1 3.29Å; R459-D477 IonicContact NH1-OD2 2.74Å; R459-D477 PolarHBondContact NH1-OD2 3.17Å; R459-D477 IonicContact NH2-OD1 3.1Å; R459-D477 PolarHBondContact NH2-OD1 3.2Å; R459-D477 IonicContact NH2-OD2 3.13Å; R459-D477 PolarHBondContact NH2-OD2 2.8Å; R459-D477 VanDerWaalsContact NH2-OD2 3.08Å
460	A	90.3	Very high	89.2	Confident	22 Å²	22	61.5 Å²	61.5	18%	0.182	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	121.8	178.5	0	0	0	0	0	110.2	G458 L468 E469 I470	G458-A460 VanDerWaalsContact C-N 3.33Å; A460-L468 HydrophobicContact CB-CD1 4.36Å; A460-E469 CarbonylContact C-O 3.49Å; A460-E469 VanDerWaalsContact CA-O 3.22Å; A460-E469 WeakPolarHBondContact CA-O 3.45Å; A460-I470 HydrophobicContact CB-CG1 4.12Å
461	T	92.1	Very high	89.3	Confident	25 Å²	25	58.9 Å²	58.9	15%	0.153	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	146.6	-176.3	45.6	0	0	0	0	111	E469	T461-E469 PolarHBondContact N-O 3.01Å; T461-E469 PolarHBondContact O-N 2.97Å
462	V	92.4	Very high	89.3	Confident	13 Å²	13	58.8 Å²	58.8	8%	0.079	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	125.1	175.4	-179.7	0	0	0	0	109.4	W444 I452 T454 T467 L468	W444-V462 HydrophobicContact CG-CG2 4.49Å; I452-V462 HydrophobicContact CB-CG2 4.3Å; I452-V462 HydrophobicContact CG2-CG2 3.9Å; T454-V462 HydrophobicContact CG2-CB 4.42Å; T454-V462 HydrophobicContact CG2-CG1 4.26Å; V462-T467 WeakPolarHBondContact CA-O 3.36Å; V462-L468 HydrophobicContact CG2-CD1 4.22Å
463	L	89.3	Confident	89.2	Confident	61 Å²	61	57.9 Å²	57.9	32%	0.319	33%	0.326	S	S	.	.			trans	-78.1	168	177.7	-59.6	-179.6	0	0	0	111.3	D465 G466 T467 E469	L463-D465 VanDerWaalsContact CB-OD1 3.24Å; L463-D465 WeakPolarHBondContact CB-OD1 3.48Å; L463-D465 PolarHBondContact O-N 2.92Å; L463-G466 PolarHBondContact O-N 3.29Å; L463-T467 HydrophobicContact CD1-CG2 4.27Å; L463-T467 PolarHBondContact N-O 3.39Å; L463-E469 HydrophobicContact CD1-CB 4.48Å; L463-E469 HydrophobicContact CG-CB 4.4Å
464	G	83.8	Confident	89.3	Confident	90 Å²	90	58.6 Å²	58.6	93%	0.928	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-21	-175.1	0	0	0	0	0	115.1	G466	G464-G466 VanDerWaalsContact C-N 3.35Å
465	D	85.8	Confident	89.4	Confident	97 Å²	97	59 Å²	59	52%	0.519	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-6.5	173.7	65.5	-18.1	0	0	0	113.3	C432 L463 T467	C432-D465 VanDerWaalsContact O-O 3.12Å; L463-D465 VanDerWaalsContact CB-OD1 3.24Å; L463-D465 WeakPolarHBondContact CB-OD1 3.48Å; L463-D465 PolarHBondContact O-N 2.92Å; D465-T467 VanDerWaalsContact CG-OG1 3.25Å; D465-T467 VanDerWaalsContact OD1-CB 3.28Å; D465-T467 WeakPolarHBondContact OD1-CB 3.36Å; D465-T467 PolarHBondContact OD1-N 3.3Å; D465-T467 PolarHBondContact OD1-OG1 3.06Å; D465-T467 PolarHBondContact OD2-OG1 2.69Å
466	G	88.1	Confident	89.7	Confident	4 Å²	4	56 Å²	56	4%	0.041	31%	0.313	C	S	.	.	S	Bend	trans	96.6	-2.1	-176.4	0	0	0	0	0	115.2	C432 I442 W444 L463 G464	C432-G466 CarbonylContact O-C 3.56Å; C432-G466 WeakPolarHBondContact O-CA 3.26Å; I442-G466 WeakPolarHBondContact CG2-O 3.01Å; W444-G466 PolarHBondContact NE1-O 2.97Å; L463-G466 PolarHBondContact O-N 3.29Å; G464-G466 VanDerWaalsContact C-N 3.35Å
467	T	91.6	Very high	89.9	Confident	5 Å²	5	55.5 Å²	55.5	3%	0.031	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-69.5	131.3	-179.2	-62.9	0	0	0	0	111.2	Q429 L430 E431 V462 L463 D465	Q429-T467 HydrophobicContact CB-CG2 3.94Å; Q429-T467 HydrophobicContact CG-CG2 4.44Å; L430-T467 CarbonylContact O-C 3.43Å; L430-T467 WeakPolarHBondContact O-CA 3.06Å; L430-T467 WeakPolarHBondContact O-CG2 3.28Å; E431-T467 HydrophobicContact CG-CG2 4.31Å; V462-T467 WeakPolarHBondContact CA-O 3.36Å; L463-T467 HydrophobicContact CD1-CG2 4.27Å; L463-T467 PolarHBondContact N-O 3.39Å; D465-T467 VanDerWaalsContact CG-OG1 3.25Å; D465-T467 VanDerWaalsContact OD1-CB 3.28Å; D465-T467 WeakPolarHBondContact OD1-CB 3.36Å; D465-T467 PolarHBondContact OD1-N 3.3Å; D465-T467 PolarHBondContact OD1-OG1 3.06Å; D465-T467 PolarHBondContact OD2-OG1 2.69Å
468	L	93.3	Very high	90.5	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	116.5	173.6	177.1	66.7	0	0	0	109.8	Q429 L430 W444 I452 A460 V462 I470 Y481	Q429-L468 CarbonylContact C-O 3.48Å; Q429-L468 WeakPolarHBondContact CA-O 3.49Å; L430-L468 HydrophobicContact CB-CB 4.36Å; L430-L468 HydrophobicContact CD1-CD2 4.37Å; L430-L468 PolarHBondContact N-O 3.26Å; L430-L468 PolarHBondContact O-N 3.08Å; W444-L468 HydrophobicContact CB-CD1 4.3Å; W444-L468 HydrophobicContact CB-CD2 4.03Å; W444-L468 HydrophobicContact CD2-CB 3.73Å; W444-L468 HydrophobicContact CD2-CD2 3.96Å; W444-L468 HydrophobicContact CD2-CG 4.42Å; W444-L468 HydrophobicContact CE3-CB 4.44Å; W444-L468 HydrophobicContact CE3-CD2 4.07Å; W444-L468 HydrophobicContact CG-CB 3.79Å; W444-L468 HydrophobicContact CG-CD1 4.36Å; W444-L468 HydrophobicContact CG-CD2 3.99Å; W444-L468 HydrophobicContact CG-CG 4.27Å; W444-L468 HydrophobicContact CZ2-CB 4.11Å; I452-L468 HydrophobicContact CB-CD1 4.39Å; I452-L468 HydrophobicContact CG2-CD1 4.13Å; A460-L468 HydrophobicContact CB-CD1 4.36Å; V462-L468 HydrophobicContact CG2-CD1 4.22Å; L468-I470 HydrophobicContact CD2-CD1 4.24Å; L468-I470 HydrophobicContact CD2-CG1 4.35Å; L468-I470 HydrophobicContact CG-CG1 4.18Å; L468-Y481 HydrophobicContact CD2-CD1 3.47Å; L468-Y481 VanDerWaalsContact CD2-CD1 3.47Å; L468-Y481 HydrophobicContact CD2-CE1 3.75Å; L468-Y481 HydrophobicContact CD2-CG 4.42Å
469	E	93.4	Very high	90.8	Very high	38 Å²	38	48.7 Å²	48.7	18%	0.178	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	127.1	172.9	-175.5	178.9	-103.6	0	0	110.4	T427 V428 Q429 A460 T461 L463 R471	T427-E469 HydrophobicContact CG2-CG 3.77Å; V428-E469 CarbonylContact O-C 3.59Å; V428-E469 VanDerWaalsContact O-CA 3.29Å; V428-E469 WeakPolarHBondContact O-CA 3.33Å; Q429-E469 HydrophobicContact CG-CB 4.41Å; Q429-E469 HydrophobicContact CG-CG 4.25Å; Q429-E469 PolarHBondContact NE2-OE1 3.29Å; Q429-E469 VanDerWaalsContact NE2-OE1 3.13Å; A460-E469 CarbonylContact C-O 3.49Å; A460-E469 VanDerWaalsContact CA-O 3.22Å; A460-E469 WeakPolarHBondContact CA-O 3.45Å; T461-E469 PolarHBondContact N-O 3.01Å; T461-E469 PolarHBondContact O-N 2.97Å; L463-E469 HydrophobicContact CD1-CB 4.48Å; L463-E469 HydrophobicContact CG-CB 4.4Å; E469-R471 HydrophobicContact CG-CG 4.4Å; E469-R471 IonicContact OE2-NE 2.94Å
470	I	93.6	Very high	90.9	Very high	2 Å²	2	50.5 Å²	50.5	1%	0.01	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	110.4	172.8	-51.5	168	0	0	0	108.4	T427 V428 R459 A460 L468 Y481 L498	T427-I470 WeakPolarHBondContact CA-O 3.31Å; V428-I470 HydrophobicContact CB-CB 4.18Å; V428-I470 PolarHBondContact N-O 3.3Å; V428-I470 PolarHBondContact O-N 2.97Å; R459-I470 WeakPolarHBondContact O-CA 3.45Å; A460-I470 HydrophobicContact CB-CG1 4.12Å; L468-I470 HydrophobicContact CD2-CD1 4.24Å; L468-I470 HydrophobicContact CD2-CG1 4.35Å; L468-I470 HydrophobicContact CG-CG1 4.18Å; I470-Y481 HydrophobicContact CD1-CE1 3.74Å; I470-Y481 HydrophobicContact CD1-CE2 4.44Å; I470-Y481 WeakPolarHBondContact CD1-OH 3.32Å; I470-L498 HydrophobicContact CD1-CD2 3.99Å
471	R	92.6	Very high	91.1	Very high	109 Å²	109	49.8 Å²	49.8	41%	0.411	28%	0.276	S	S	.	.	S	Bend	trans	-81.6	139.1	176.2	-68.9	179.6	-85.3	177.8	-7.9	110.8	T427 G458 R459 E469	T427-R471 HydrophobicContact CG2-CG 4.17Å; G458-R471 PolarHBondContact O-NH2 2.83Å; R459-R471 WeakPolarHBondContact CD-O 3.33Å; R459-R471 PolarHBondContact NH1-O 3.11Å; R459-R471 VanDerWaalsContact NH1-O 3.15Å; R459-R471 PolarHBondContact O-N 3.15Å; E469-R471 HydrophobicContact CG-CG 4.4Å; E469-R471 IonicContact OE2-NE 2.94Å
472	F	91.4	Very high	91.2	Very high	137 Å²	137	50.6 Å²	50.6	60%	0.601	28%	0.28	S	S	*	.	S	Bend	trans	51.6	72.6	-179.1	-53.1	-76.6	0	0	0	112.1	R459 Q474	R459-F472 PolarHBondContact NH1-O 3.09Å; R459-F472 VanDerWaalsContact NH1-O 3.08Å; F472-Q474 PolarHBondContact O-N 3.29Å
473	A	91.9	Very high	91.3	Very high	1 Å²	1	50 Å²	50	1%	0.008	28%	0.277	C	S	.	.			trans	-55.5	133.8	179.8	0	0	0	0	0	111.4	V422 E424 G425 Q426 V428 V500	V422-A473 HydrophobicContact CG1-CB 4.45Å; E424-A473 WeakPolarHBondContact CG-O 3.39Å; G425-A473 PolarHBondContact N-O 3.3Å; Q426-A473 WeakPolarHBondContact O-CB 3.39Å; Q426-A473 PolarHBondContact O-N 3.07Å; V428-A473 HydrophobicContact CG2-CB 3.94Å; A473-V500 HydrophobicContact CB-CG1 4.3Å; A473-V500 HydrophobicContact CB-CG2 4.09Å
474	Q	91.7	Very high	91.5	Very high	67 Å²	67	48.6 Å²	48.6	31%	0.313	27%	0.269	S	S	.	.			trans	-118.4	155.8	178.2	-65.2	174.9	-29.6	0	0	109.7	F472 Q476 D477 V500	F472-Q474 PolarHBondContact O-N 3.29Å; Q474-Q476 HydrophobicContact CB-CG 3.75Å; Q474-Q476 PolarHBondContact O-N 3.05Å; Q474-D477 PolarHBondContact N-OD2 3.04Å; Q474-D477 WeakPolarHBondContact O-CB 3.32Å; Q474-D477 PolarHBondContact O-N 2.93Å; Q474-V500 WeakPolarHBondContact O-CG2 3.15Å
475	D	88.6	Confident	92.1	Very high	100 Å²	100	44.3 Å²	44.3	54%	0.535	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-51.2	-36.3	177.2	-175.9	57.6	0	0	0	112.5	D477 S478	D475-D477 PolarHBondContact O-N 2.87Å; D475-S478 VanDerWaalsContact O-CB 3.23Å; D475-S478 WeakPolarHBondContact O-CB 3.49Å; D475-S478 PolarHBondContact O-N 2.86Å; D475-S478 VanDerWaalsContact O-N 3.1Å; D475-S478 PolarHBondContact O-OG 2.9Å; D475-S478 VanDerWaalsContact O-OG 3.05Å
476	Q	89.3	Confident	92.5	Very high	86 Å²	86	42.2 Å²	42.2	40%	0.402	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-67.5	-14.1	176.5	62.9	168.8	-4.2	0	0	116.5	R448 Q474 S478	R448-Q476 VanDerWaalsContact CZ-OE1 3.27Å; Q474-Q476 HydrophobicContact CB-CG 3.75Å; Q474-Q476 PolarHBondContact O-N 3.05Å; Q476-S478 VanDerWaalsContact C-N 3.28Å
477	D	91.1	Very high	92.8	Very high	19 Å²	19	43.1 Å²	43.1	10%	0.102	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-83.5	-9.3	175.4	-59.9	-32.7	0	0	0	110.8	R459 Q474 D475 Y481 L498	R459-D477 IonicContact CZ-OD1 3.03Å; R459-D477 IonicContact CZ-OD2 2.8Å; R459-D477 IonicContact NH1-OD1 3.29Å; R459-D477 IonicContact NH1-OD2 2.74Å; R459-D477 PolarHBondContact NH1-OD2 3.17Å; R459-D477 IonicContact NH2-OD1 3.1Å; R459-D477 PolarHBondContact NH2-OD1 3.2Å; R459-D477 IonicContact NH2-OD2 3.13Å; R459-D477 PolarHBondContact NH2-OD2 2.8Å; R459-D477 VanDerWaalsContact NH2-OD2 3.08Å; Q474-D477 PolarHBondContact N-OD2 3.04Å; Q474-D477 WeakPolarHBondContact O-CB 3.32Å; Q474-D477 PolarHBondContact O-N 2.93Å; D475-D477 PolarHBondContact O-N 2.87Å; D477-Y481 VanDerWaalsContact O-CE2 3.28Å; D477-Y481 WeakPolarHBondContact O-CE2 3.23Å; D477-Y481 PolarHBondContact O-OH 3.39Å; D477-L498 HydrophobicContact CB-CD2 4.47Å
478	S	93	Very high	92.9	Very high	40 Å²	40	45.3 Å²	45.3	28%	0.28	24%	0.241	S	C	.	.			trans	-61.4	135.9	174.7	-62.9	0	0	0	0	112.1	D475 Q476 L498 V500	D475-S478 VanDerWaalsContact O-CB 3.23Å; D475-S478 WeakPolarHBondContact O-CB 3.49Å; D475-S478 PolarHBondContact O-N 2.86Å; D475-S478 VanDerWaalsContact O-N 3.1Å; D475-S478 PolarHBondContact O-OG 2.9Å; D475-S478 VanDerWaalsContact O-OG 3.05Å; Q476-S478 VanDerWaalsContact C-N 3.28Å; S478-L498 WeakPolarHBondContact CA-O 3.28Å; S478-V500 WeakPolarHBondContact OG-CB 3.24Å; S478-V500 PolarHBondContact OG-N 3.45Å
479	G	92.9	Very high	92.9	Very high	26 Å²	26	47.1 Å²	47.1	27%	0.268	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	147.8	-162.5	174.6	0	0	0	0	0	113.9	L498	G479-L498 PolarHBondContact N-O 3.45Å; G479-L498 PolarHBondContact O-N 3.23Å
480	M	93.4	Very high	92.9	Very high	119 Å²	119	46.4 Å²	46.4	59%	0.586	26%	0.259	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.1	125.5	179	-64.2	-126.9	-60.4	0	0	111.7	P447	P447-M480 WeakPolarHBondContact CA-O 3.48Å; P447-M480 WeakPolarHBondContact CG-O 3.07Å
481	Y	93.9	Very high	93	Very high	6 Å²	6	50.6 Å²	50.6	2%	0.024	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	140.8	173	-72.4	-101.6	0	0	0	109.4	L430 V445 T446 P447 L468 I470 D477 T495 A496 L498	L430-Y481 HydrophobicContact CD1-CD1 4.4Å; L430-Y481 HydrophobicContact CD1-CD2 4.1Å; L430-Y481 HydrophobicContact CD1-CG 3.92Å; V445-Y481 WeakPolarHBondContact O-CA 3.34Å; T446-Y481 HydrophobicContact CG2-CD1 4.41Å; T446-Y481 HydrophobicContact CG2-CE1 3.91Å; P447-Y481 VanDerWaalsContact CD-CZ 3.42Å; P447-Y481 HydrophobicContact CG-CD2 3.98Å; P447-Y481 HydrophobicContact CG-CE2 3.61Å; L468-Y481 HydrophobicContact CD2-CD1 3.47Å; L468-Y481 VanDerWaalsContact CD2-CD1 3.47Å; L468-Y481 HydrophobicContact CD2-CE1 3.75Å; L468-Y481 HydrophobicContact CD2-CG 4.42Å; I470-Y481 HydrophobicContact CD1-CE1 3.74Å; I470-Y481 HydrophobicContact CD1-CE2 4.44Å; I470-Y481 WeakPolarHBondContact CD1-OH 3.32Å; D477-Y481 VanDerWaalsContact O-CE2 3.28Å; D477-Y481 WeakPolarHBondContact O-CE2 3.23Å; D477-Y481 PolarHBondContact O-OH 3.39Å; Y481-T495 CarbonylContact O-C 3.6Å; Y481-T495 WeakPolarHBondContact O-CA 3.37Å; Y481-A496 PolarHBondContact N-O 3.45Å; Y481-A496 PolarHBondContact O-N 2.79Å; Y481-L498 HydrophobicContact CD2-CB 4.14Å; Y481-L498 HydrophobicContact CE2-CB 3.91Å; Y481-L498 HydrophobicContact CE2-CD2 3.98Å
482	V	94.1	Very high	93.1	Very high	42 Å²	42	46.8 Å²	46.8	26%	0.255	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	115.1	177.9	-170.8	0	0	0	0	108.9	W444 V445 I484 F494 T495	W444-V482 CarbonylContact C-O 3.57Å; W444-V482 WeakPolarHBondContact CA-O 3.41Å; V445-V482 HydrophobicContact CB-CB 4.24Å; V445-V482 PolarHBondContact N-O 3.29Å; V445-V482 PolarHBondContact O-N 3.21Å; V482-I484 HydrophobicContact CG1-CG1 4.22Å; V482-F494 CarbonylContact C-O 3.51Å; V482-F494 WeakPolarHBondContact CA-O 3.28Å; V482-T495 HydrophobicContact CG2-CG2 4.25Å
483	C	93.9	Very high	93.2	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	134.7	166	-178.2	0	0	0	0	109.4	C432 W444 T493 F494	C432-C483 HydrophobicContact CB-CB 3.75Å; C432-C483 WeakPolarHBondContact CB-SG 3.21Å; C432-C483 WeakPolarHBondContact SG-CB 3.42Å; C432-C483 CovalentContact SG-SG 2.02Å; C432-C483 PolarHBondContact SG-SG 2.85Å; W444-C483 HydrophobicContact CD2-CB 3.97Å; W444-C483 HydrophobicContact CE3-CB 3.93Å; W444-C483 HydrophobicContact CH2-CB 3.76Å; W444-C483 HydrophobicContact CZ2-CB 3.78Å; W444-C483 HydrophobicContact CZ3-CB 3.82Å; C483-T493 VanDerWaalsContact O-CA 3.26Å; C483-T493 WeakPolarHBondContact O-CA 3.13Å; C483-F494 HydrophobicContact CB-CB 4.45Å; C483-F494 PolarHBondContact N-O 3.25Å; C483-F494 PolarHBondContact O-N 3.04Å
484	I	94.9	Very high	93.2	Very high	33 Å²	33	44.3 Å²	44.3	17%	0.169	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	112.3	176	-53.1	178	0	0	0	107.5	S443 V445 F451 V482 T493	S443-I484 PolarHBondContact N-O 2.88Å; S443-I484 PolarHBondContact O-N 3.46Å; S443-I484 PolarHBondContact OG-O 3.34Å; V445-I484 HydrophobicContact CG2-CD1 3.62Å; V445-I484 HydrophobicContact CG2-CG1 4.44Å; F451-I484 HydrophobicContact CE1-CD1 4.26Å; V482-I484 HydrophobicContact CG1-CG1 4.22Å; I484-T493 HydrophobicContact CB-CG2 4.42Å; I484-T493 HydrophobicContact CG1-CG2 4.02Å; I484-T493 HydrophobicContact CG2-CG2 4.25Å
485	A	95.1	Very high	93.2	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	126.2	169	0	0	0	0	0	109	P410 I412 A434 P440 I442 N491 D492	P410-A485 HydrophobicContact CB-CB 4.07Å; P410-A485 WeakPolarHBondContact CG-O 3.36Å; I412-A485 HydrophobicContact CD1-CB 4.29Å; I412-A485 HydrophobicContact CG1-CB 3.95Å; A434-A485 HydrophobicContact CB-CB 3.44Å; A434-A485 VanDerWaalsContact CB-CB 3.44Å; P440-A485 HydrophobicContact CB-CB 4.3Å; I442-A485 HydrophobicContact CG1-CB 4.38Å; A485-N491 CarbonylContact O-C 3.29Å; A485-N491 VanDerWaalsContact O-CA 3.23Å; A485-N491 WeakPolarHBondContact O-CA 3.24Å; A485-D492 PolarHBondContact N-O 3.08Å; A485-D492 PolarHBondContact O-N 2.78Å
486	S	94.7	Very high	93.4	Very high	53 Å²	53	39.2 Å²	39.2	37%	0.371	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	135.3	-173.1	-168.6	0	0	0	0	112.2	P440 V441	P440-S486 CarbonylContact C-O 3.54Å; P440-S486 WeakPolarHBondContact CA-O 3.43Å; V441-S486 PolarHBondContact N-O 3.06Å; V441-S486 PolarHBondContact O-N 3.26Å
487	N	94.8	Very high	93.5	Very high	22 Å²	22	36.2 Å²	36.2	12%	0.118	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	-173.3	165.7	77.1	4.1	0	0	0	110.6	K408 P410 P438 A489 G490	K408-N487 PolarHBondContact O-ND2 2.9Å; P410-N487 WeakPolarHBondContact CD-OD1 3.35Å; P438-N487 PolarHBondContact O-ND2 3.43Å; N487-A489 PolarHBondContact O-N 2.97Å; N487-A489 WeakPolarHBondContact OD1-CA 3.28Å; N487-A489 WeakPolarHBondContact OD1-CB 3.45Å; N487-A489 PolarHBondContact OD1-N 2.91Å; N487-G490 PolarHBondContact N-O 2.95Å; N487-G490 PolarHBondContact O-N 3.1Å; N487-G490 VanDerWaalsContact O-O 3.11Å; N487-G490 PolarHBondContact OD1-N 2.85Å
488	A	92.8	Very high	93.6	Very high	51 Å²	51	35.3 Å²	35.3	42%	0.421	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-22.4	-179	0	0	0	0	0	115	R362	R362-A488 HydrophobicContact CG-CB 3.34Å
489	A	93.2	Very high	93.6	Very high	39 Å²	39	36.7 Å²	36.7	32%	0.322	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-9	174.8	0	0	0	0	0	113.7	C407 K409 N487	C407-A489 HydrophobicContact CB-CB 3.65Å; K409-A489 HydrophobicContact CB-CB 4.09Å; N487-A489 PolarHBondContact O-N 2.97Å; N487-A489 WeakPolarHBondContact OD1-CA 3.28Å; N487-A489 WeakPolarHBondContact OD1-CB 3.45Å; N487-A489 PolarHBondContact OD1-N 2.91Å
490	G	93.6	Very high	93.6	Very high	23 Å²	23	35.8 Å²	35.8	24%	0.237	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	132.5	-155	175.3	0	0	0	0	0	112.8	P410 N487	P410-G490 VanDerWaalsContact CD-O 3.29Å; P410-G490 WeakPolarHBondContact CD-O 3.45Å; P410-G490 WeakPolarHBondContact CG-O 3.34Å; N487-G490 PolarHBondContact N-O 2.95Å; N487-G490 PolarHBondContact O-N 3.1Å; N487-G490 VanDerWaalsContact O-O 3.11Å; N487-G490 PolarHBondContact OD1-N 2.85Å
491	N	95.3	Very high	93.4	Very high	90 Å²	90	35.2 Å²	35.2	48%	0.481	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	152.6	-171.6	52.1	1	0	0	0	112.9	K409 A485	K409-N491 WeakPolarHBondContact CE-O 3.48Å; K409-N491 PolarHBondContact NZ-O 3.04Å; A485-N491 CarbonylContact O-C 3.29Å; A485-N491 VanDerWaalsContact O-CA 3.23Å; A485-N491 WeakPolarHBondContact O-CA 3.24Å
492	D	95.1	Very high	92.6	Very high	29 Å²	29	36.7 Å²	36.7	16%	0.155	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	145.9	167	-169.3	23.7	0	0	0	108.3	P410 I412 K415 A485	P410-D492 HydrophobicContact CB-CB 4.48Å; P410-D492 HydrophobicContact CG-CB 4.42Å; P410-D492 WeakPolarHBondContact O-CB 3.08Å; I412-D492 HydrophobicContact CD1-CB 4.43Å; I412-D492 HydrophobicContact CG1-CB 4.29Å; I412-D492 PolarHBondContact N-OD2 2.87Å; K415-D492 VanDerWaalsContact CE-OD2 3.3Å; K415-D492 WeakPolarHBondContact CE-OD2 3.35Å; K415-D492 VanDerWaalsContact NZ-CG 3.33Å; K415-D492 IonicContact NZ-OD1 3.53Å; K415-D492 PolarHBondContact NZ-OD1 2.65Å; K415-D492 IonicContact NZ-OD2 3.79Å; K415-D492 PolarHBondContact NZ-OD2 3.29Å; A485-D492 PolarHBondContact N-O 3.08Å; A485-D492 PolarHBondContact O-N 2.78Å
493	T	93.9	Very high	91.1	Very high	72 Å²	72	42.8 Å²	42.8	44%	0.442	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	149.7	-174.8	60.9	0	0	0	0	111.7	C483 I484	C483-T493 VanDerWaalsContact O-CA 3.26Å; C483-T493 WeakPolarHBondContact O-CA 3.13Å; I484-T493 HydrophobicContact CB-CG2 4.42Å; I484-T493 HydrophobicContact CG1-CG2 4.02Å; I484-T493 HydrophobicContact CG2-CG2 4.25Å
494	F	91.6	Very high	89.3	Confident	13 Å²	13	47 Å²	47	6%	0.057	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	143.7	178.4	171.6	-107.1	0	0	0	109.8	I412 K415 K416 Q418 V482 C483 A496	I412-F494 HydrophobicContact CD1-CB 3.62Å; I412-F494 HydrophobicContact CG2-CB 4.21Å; K415-F494 HydrophobicContact CB-CD2 4.19Å; K415-F494 HydrophobicContact CB-CE2 4.43Å; K415-F494 HydrophobicContact CG-CD2 4.41Å; K416-F494 WeakPolarHBondContact O-CZ 3.45Å; Q418-F494 HydrophobicContact CB-CE1 4.28Å; Q418-F494 HydrophobicContact CB-CZ 4.18Å; Q418-F494 HydrophobicContact CG-CE1 4.04Å; Q418-F494 HydrophobicContact CG-CZ 4Å; V482-F494 CarbonylContact C-O 3.51Å; V482-F494 WeakPolarHBondContact CA-O 3.28Å; C483-F494 HydrophobicContact CB-CB 4.45Å; C483-F494 PolarHBondContact N-O 3.25Å; C483-F494 PolarHBondContact O-N 3.04Å; F494-A496 HydrophobicContact CE1-CB 4.25Å
495	T	92.2	Very high	87.1	Confident	59 Å²	59	49.4 Å²	49.4	36%	0.362	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	130.4	-177.7	54.5	0	0	0	0	111.2	Y481 V482	Y481-T495 CarbonylContact O-C 3.6Å; Y481-T495 WeakPolarHBondContact O-CA 3.37Å; V482-T495 HydrophobicContact CG2-CG2 4.25Å
496	A	92.2	Very high	84.6	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.008	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	143.6	173.6	0	0	0	0	0	110.1	Q418 L430 W444 Y481 F494	Q418-A496 HydrophobicContact CB-CB 3.92Å; L430-A496 HydrophobicContact CD1-CB 4.16Å; L430-A496 HydrophobicContact CD2-CB 4.19Å; W444-A496 HydrophobicContact CH2-CB 4.3Å; W444-A496 HydrophobicContact CZ3-CB 4.14Å; Y481-A496 PolarHBondContact N-O 3.45Å; Y481-A496 PolarHBondContact O-N 2.79Å; F494-A496 HydrophobicContact CE1-CB 4.25Å
497	S	92.6	Very high	82.2	Confident	23 Å²	23	63.3 Å²	63.3	16%	0.161	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	124.8	-179.9	173.7	0	0	0	0	109.8	Q418 H419 L420	Q418-S497 PolarHBondContact O-N 2.98Å; H419-S497 WeakPolarHBondContact CA-O 3.4Å; H419-S497 VanDerWaalsContact ND1-CB 3.27Å; H419-S497 WeakPolarHBondContact ND1-CB 3.31Å; H419-S497 PolarHBondContact ND1-OG 3.46Å; L420-S497 PolarHBondContact N-O 3.04Å
498	L	93.4	Very high	79.9	Confident	1 Å²	1	71.4 Å²	71.4	1%	0.005	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	128.8	175.5	177.9	61.4	0	0	0	109.2	L420 V422 V428 I470 D477 S478 G479 Y481 V500	L420-L498 HydrophobicContact CB-CD1 4.2Å; L420-L498 HydrophobicContact CD2-CD1 4.34Å; V422-L498 HydrophobicContact CB-CD1 4.38Å; V422-L498 HydrophobicContact CG2-CD1 4.01Å; V428-L498 HydrophobicContact CG1-CD1 3.89Å; V428-L498 HydrophobicContact CG1-CD2 4.12Å; V428-L498 HydrophobicContact CG2-CD1 3.99Å; V428-L498 HydrophobicContact CG2-CD2 4.24Å; I470-L498 HydrophobicContact CD1-CD2 3.99Å; D477-L498 HydrophobicContact CB-CD2 4.47Å; S478-L498 WeakPolarHBondContact CA-O 3.28Å; G479-L498 PolarHBondContact N-O 3.45Å; G479-L498 PolarHBondContact O-N 3.23Å; Y481-L498 HydrophobicContact CD2-CB 4.14Å; Y481-L498 HydrophobicContact CE2-CB 3.91Å; Y481-L498 HydrophobicContact CE2-CD2 3.98Å; L498-V500 HydrophobicContact CD2-CG2 4.31Å; L498-V500 HydrophobicContact CG-CG2 4.19Å
499	T	92.8	Very high	77.7	Confident	69 Å²	69	75.1 Å²	75.1	42%	0.423	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	117.5	171	-54	0	0	0	0	108.8	L420 L421 V422	L420-T499 PolarHBondContact O-N 3.13Å; L421-T499 WeakPolarHBondContact CA-O 3.39Å; L421-T499 HydrophobicContact CD1-CG2 3.72Å; V422-T499 PolarHBondContact N-O 3.05Å
500	V	92.6	Very high	75.2	Confident	6 Å²	6	84 Å²	84	4%	0.036	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	124.2	175.8	-175.5	0	0	0	0	108.8	V422 E424 A473 Q474 S478 L498 G502	V422-V500 CarbonylContact O-C 3.46Å; V422-V500 VanDerWaalsContact O-CA 3.25Å; V422-V500 WeakPolarHBondContact O-CA 3.2Å; E424-V500 HydrophobicContact CB-CG1 4.16Å; A473-V500 HydrophobicContact CB-CG1 4.3Å; A473-V500 HydrophobicContact CB-CG2 4.09Å; Q474-V500 WeakPolarHBondContact O-CG2 3.15Å; S478-V500 WeakPolarHBondContact OG-CB 3.24Å; S478-V500 PolarHBondContact OG-N 3.45Å; L498-V500 HydrophobicContact CD2-CG2 4.31Å; L498-V500 HydrophobicContact CG-CG2 4.19Å; V500-G502 PolarHBondContact O-N 2.96Å
501	K	88.2	Confident	72.6	Confident	107 Å²	107	86.9 Å²	86.9	47%	0.465	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	110	170.5	-72.9	179.5	176	168.8	0	108.5	L421 V422 E424	L421-K501 HydrophobicContact CD1-CD 4.32Å; L421-K501 HydrophobicContact CD1-CG 3.97Å; L421-K501 HydrophobicContact CD2-CD 4.45Å; L421-K501 HydrophobicContact CG-CD 4.25Å; L421-K501 HydrophobicContact CG-CG 4.37Å; V422-K501 PolarHBondContact O-N 2.92Å; E424-K501 PolarHBondContact N-O 3.44Å
502	G	77.3	Confident	69.8	Low	37 Å²	37	90.1 Å²	90.1	38%	0.381	48%	0.477	S	S	.	.			trans	-62.6	149	164.9	0	0	0	0	0	110.3	V500 A504	V500-G502 PolarHBondContact O-N 2.96Å; G502-A504 PolarHBondContact O-N 3.22Å
503	F	64.1	Low	66.9	Low	170 Å²	170	100.8 Å²	100.8	75%	0.746	52%	0.515	S	S	*	.			trans	-60.9	102.8	166.5	-83.8	-89.7	0	0	0	108.2	E424 S505	E424-F503 HydrophobicContact CB-CD2 4.42Å; F503-S505 VanDerWaalsContact C-N 3.32Å; F503-S505 PolarHBondContact O-N 3.42Å
504	A	55	Low	64.1	Low	89 Å²	89	103.7 Å²	103.7	74%	0.736	53%	0.533	S	S	*	.			trans	-56.9	106.5	160	0	0	0	0	0	105.7	G502 D506	G502-A504 PolarHBondContact O-N 3.22Å; A504-D506 PolarHBondContact O-N 3.03Å
505	S	48.7	Very low	62.3	Low	83 Å²	83	108.5 Å²	108.5	58%	0.58	57%	0.565	S	S	*	*			trans	-59.6	113.9	166.7	-56.4	0	0	0	0	105.5	F503 R507	F503-S505 VanDerWaalsContact C-N 3.32Å; F503-S505 PolarHBondContact O-N 3.42Å; S505-R507 PolarHBondContact O-N 2.83Å
506	D	42.4	Very low	59.2	Low	132 Å²	132	113.9 Å²	113.9	71%	0.706	59%	0.588	S	S	*	*			trans	-63.2	55.2	163.1	-95.5	-26.6	0	0	0	110.2	A504 F508	A504-D506 PolarHBondContact O-N 3.03Å; D506-F508 VanDerWaalsContact C-N 3.34Å
507	R	44.4	Very low	56.1	Low	213 Å²	213	122.6 Å²	122.6	80%	0.804	62%	0.622	S	S	*	*			trans	-91.3	4	172.4	-87.6	-170.5	-178.7	-156.5	1.7	112.4	S505	S505-R507 PolarHBondContact O-N 2.83Å
508	F	47.4	Very low	53	Low	193 Å²	193	129 Å²	129	85%	0.846	65%	0.651	S	S	*	*	S	Bend	trans	-109	5.2	179.5	-66.8	-70.3	0	0	0	114.9	D506	D506-F508 VanDerWaalsContact C-N 3.34Å
509	L	46.4	Very low	49.9	Very low	129 Å²	129	134.8 Å²	134.8	68%	0.675	69%	0.687	S	S	*	*	S	Bend	trans	-104	7.3	177.4	-75.7	171.5	0	0	0	115.6
510	Y	39.4	Very low	46.8	Very low	225 Å²	225	138.5 Å²	138.5	88%	0.882	70%	0.704	S	S	*	*	S	Bend	trans	-134.2	31.7	175.6	-72.8	-77.1	0	0	0	114.7
511	A	40.6	Very low	43.8	Very low	84 Å²	84	144.1 Å²	144.1	69%	0.694	74%	0.744	S	S	*	*			trans	-106.6	60.5	170.5	0	0	0	0	0	111
512	N	35.4	Very low	41	Very low	158 Å²	158	146 Å²	146	85%	0.845	76%	0.759	S	S	*	*			trans	-143.6	77.6	166.4	-95.8	-20.4	0	0	0	110.1
513	R	35.3	Very low	38.7	Very low	253 Å²	253	151.7 Å²	151.7	96%	0.955	78%	0.78	S	S	*	*			trans	-151.5	111.3	150.2	-100.9	-175.6	-177.8	-179	0.3	108.5
514	T	33.3	Very low	37.2	Very low	133 Å²	133	148.9 Å²	148.9	82%	0.816	78%	0.777	S	S	*	*			trans	-91.4	-175.5	170.5	50.7	0	0	0	0	109.6
515	P	54.2	Low	36.3	Very low	113 Å²	113	152.4 Å²	152.4	73%	0.734	78%	0.782	S	S	*	*				-132.6	157.3	-62	36.7	-21.8	0	0	0	111.6
516	M	27.5	Very low	35.4	Very low	172 Å²	172	153.9 Å²	153.9	85%	0.847	79%	0.793	S	S	*	*			trans	-161.7	114.4	158.5	-131.4	166.6	-176.1	0	0	115.9
517	Y	27.9	Very low	35	Very low	185 Å²	185	155.8 Å²	155.8	73%	0.725	80%	0.803	S	S	*	*			trans	74.6	124.6	138.3	-87.5	-111.1	0	0	0	123.9
518	M	27.1	Very low	34.4	Very low	157 Å²	157	148.7 Å²	148.7	77%	0.773	80%	0.796	S	S	*	*			trans	71.4	135	143.7	-78	178.9	163.8	0	0	118
519	T	28.8	Very low	33.6	Very low	123 Å²	123	146.4 Å²	146.4	76%	0.755	80%	0.798	S	S	*	*			cis	-165.3	160.6	11.8	13.8	0	0	0	0	108.9
520	D	27.9	Very low	33.3	Very low	147 Å²	147	148.7 Å²	148.7	79%	0.786	81%	0.811	S	S	*	*			trans	-41.8	154.6	177.1	-65.7	-51.4	0	0	0	118.5
521	S	28.6	Very low	33.1	Very low	124 Å²	124	142 Å²	142	87%	0.867	80%	0.802	S	S	*	*				-168.8	131.3	116.3	-72.5	0	0	0	0	112.2
522	N	29.8	Very low	33.3	Very low	146 Å²	146	145.9 Å²	145.9	78%	0.781	81%	0.811	S	S	*	*			trans	-56.9	146.9	172	-74.4	-32.9	0	0	0	113.4
523	D	28.7	Very low	33.1	Very low	156 Å²	156	144.7 Å²	144.7	83%	0.834	81%	0.81	S	S	*	*				-173.1	157.8	103.6	-99.9	-22.4	0	0	0	114.9
524	T	31.9	Very low	33.5	Very low	111 Å²	111	141.8 Å²	141.8	68%	0.681	80%	0.804	S	S	*	*			trans	-56.5	140.9	-164.6	48	0	0	0	0	120.7
525	I	36.4	Very low	33.7	Very low	163 Å²	163	141.4 Å²	141.4	84%	0.836	81%	0.807	S	S	*	*				40.8	112.1	127.1	-50.2	169.1	0	0	0	118.9
526	S	30.8	Very low	33.5	Very low	115 Å²	115	142.4 Å²	142.4	80%	0.804	81%	0.806	S	S	*	*			trans	-165	130.1	130.7	64.2	0	0	0	0	112.9
527	N	33.1	Very low	34.8	Very low	172 Å²	172	138.6 Å²	138.6	92%	0.92	79%	0.788	S	S	*	*			trans	-57.1	144	170.2	-77.7	-32.9	0	0	0	113.1
528	G	31.4	Very low	36.3	Very low	64 Å²	64	135.8 Å²	135.8	66%	0.66	79%	0.785	S	S	*	*			trans	159.2	98.9	158.8	0	0	0	0	0	116.9
529	T	32.2	Very low	37.7	Very low	145 Å²	145	136.1 Å²	136.1	89%	0.89	78%	0.783	S	S	*	*			trans	58.3	115.5	149.1	53.3	0	0	0	0	120.5	A531	T529-A531 PolarHBondContact O-N 3.45Å
530	N	39.8	Very low	39	Very low	177 Å²	177	134.5 Å²	134.5	95%	0.947	77%	0.773	S	S	*	*			trans	-53.4	120.5	168.9	-68.8	-31.6	0	0	0	113.1
531	A	33.7	Very low	40.6	Very low	83 Å²	83	131 Å²	131	69%	0.686	75%	0.753	S	S	*	*			trans	-131.2	122.9	160.7	0	0	0	0	0	109.3	T529 T533	T529-A531 PolarHBondContact O-N 3.45Å; A531-T533 PolarHBondContact O-N 3.39Å
532	N	44.9	Very low	42.2	Very low	166 Å²	166	130.4 Å²	130.4	89%	0.888	74%	0.74	S	S	*	*			trans	-54.4	119.9	173.3	-75.4	-17.3	0	0	0	110.5
533	T	32	Very low	43.9	Very low	133 Å²	133	127.8 Å²	127.8	82%	0.816	73%	0.728	S	S	*	*			trans	-117.6	110.3	170.4	38.7	0	0	0	0	109.3	A531 S535	A531-T533 PolarHBondContact O-N 3.39Å; T533-S535 PolarHBondContact O-N 3.04Å
534	F	42.7	Very low	45.2	Very low	193 Å²	193	123.7 Å²	123.7	85%	0.846	71%	0.712	S	S	*	*			trans	-64.9	119.5	161.3	-83.4	-92.1	0	0	0	108	L536	F534-L536 PolarHBondContact O-N 2.94Å; F534-L536 VanDerWaalsContact O-N 3.14Å
535	S	38	Very low	47	Very low	124 Å²	124	122.6 Å²	122.6	87%	0.867	71%	0.705	S	S	*	*			trans	-77.9	92.6	169.3	47.9	0	0	0	0	109.5	T533	T533-S535 PolarHBondContact O-N 3.04Å
536	L	49.7	Very low	48.4	Very low	135 Å²	135	117 Å²	117	71%	0.707	68%	0.684	S	S	*	*			trans	-82.7	119.5	164.1	-75.2	165.8	0	0	0	108.8	F534 L538 I541	F534-L536 PolarHBondContact O-N 2.94Å; F534-L536 VanDerWaalsContact O-N 3.14Å; L536-L538 PolarHBondContact O-N 3.06Å; L536-I541 HydrophobicContact CB-CD1 3.91Å
537	D	55.5	Low	50	Low	91 Å²	91	117.8 Å²	117.8	49%	0.487	68%	0.676	S	S	.	*			trans	-62.1	118.3	177.3	172.2	34.8	0	0	0	111.1	K539 T540 I541	D537-K539 PolarHBondContact O-N 3.3Å; D537-K539 VanDerWaalsContact O-N 3.16Å; D537-K539 PolarHBondContact OD1-N 3.14Å; D537-T540 WeakPolarHBondContact O-CB 3.47Å; D537-T540 PolarHBondContact O-N 3.13Å; D537-T540 PolarHBondContact OD2-OG1 3.39Å; D537-I541 PolarHBondContact O-N 3.38Å
538	L	58.8	Low	51.7	Low	126 Å²	126	111.3 Å²	111.3	66%	0.66	65%	0.65	S	S	*	*	H	α-helix	trans	-58.9	-28.3	-176.4	-169.1	70.7	0	0	0	112.1	L536 L542	L536-L538 PolarHBondContact O-N 3.06Å; L538-L542 HydrophobicContact CG-CD1 4.37Å; L538-L542 WeakPolarHBondContact O-CB 3.23Å; L538-L542 PolarHBondContact O-N 3.12Å; L538-L542 VanDerWaalsContact O-N 3.16Å
539	K	56.8	Low	53.3	Low	165 Å²	165	111.8 Å²	111.8	72%	0.717	64%	0.642	S	S	*	*	H	α-helix	trans	-67	-38.9	173.5	-84.6	-177.7	175.6	178	0	112.2	D537 L542 V543	D537-K539 PolarHBondContact O-N 3.3Å; D537-K539 VanDerWaalsContact O-N 3.16Å; D537-K539 PolarHBondContact OD1-N 3.14Å; K539-L542 PolarHBondContact O-N 3.41Å; K539-V543 WeakPolarHBondContact O-CB 3.29Å; K539-V543 VanDerWaalsContact O-CG2 3.23Å; K539-V543 WeakPolarHBondContact O-CG2 3.4Å; K539-V543 PolarHBondContact O-N 3.21Å
540	T	57.3	Low	55.1	Low	89 Å²	89	112.3 Å²	112.3	55%	0.546	63%	0.632	S	S	.	*	H	α-helix	trans	-71.2	-37.1	-178.9	-54.7	0	0	0	0	111.2	D537 S544	D537-T540 WeakPolarHBondContact O-CB 3.47Å; D537-T540 PolarHBondContact O-N 3.13Å; D537-T540 PolarHBondContact OD2-OG1 3.39Å; T540-S544 WeakPolarHBondContact O-CB 3.35Å; T540-S544 PolarHBondContact O-N 3Å
541	I	61	Low	56.8	Low	74 Å²	74	108.1 Å²	108.1	38%	0.379	61%	0.614	S	S	.	*	H	α-helix	trans	-65.5	-46.2	174.7	-65.2	174	0	0	0	111	L536 D537 V543 S544 T545	L536-I541 HydrophobicContact CB-CD1 3.91Å; D537-I541 PolarHBondContact O-N 3.38Å; I541-V543 PolarHBondContact O-N 3.21Å; I541-S544 PolarHBondContact O-N 3.08Å; I541-S544 PolarHBondContact O-OG 3.49Å; I541-T545 PolarHBondContact O-N 3.34Å; I541-T545 PolarHBondContact O-OG1 3.02Å
542	L	61.2	Low	58.8	Low	111 Å²	111	111.1 Å²	111.1	58%	0.581	61%	0.611	S	S	*	*	H	α-helix	trans	-63.3	-38.8	178.7	-108.5	139.4	0	0	0	112.7	L538 K539 T545 A546	L538-L542 HydrophobicContact CG-CD1 4.37Å; L538-L542 WeakPolarHBondContact O-CB 3.23Å; L538-L542 PolarHBondContact O-N 3.12Å; L538-L542 VanDerWaalsContact O-N 3.16Å; K539-L542 PolarHBondContact O-N 3.41Å; L542-T545 PolarHBondContact O-OG1 3.43Å; L542-A546 VanDerWaalsContact O-CB 3.27Å; L542-A546 WeakPolarHBondContact O-CB 3.26Å; L542-A546 PolarHBondContact O-N 3.09Å
543	V	65.7	Low	60.4	Low	90 Å²	90	107.8 Å²	107.8	55%	0.545	59%	0.593	S	S	.	*	H	α-helix	trans	-70.1	-38.9	176.2	172.9	0	0	0	0	111.2	K539 I541 A546 M547	K539-V543 WeakPolarHBondContact O-CB 3.29Å; K539-V543 VanDerWaalsContact O-CG2 3.23Å; K539-V543 WeakPolarHBondContact O-CG2 3.4Å; K539-V543 PolarHBondContact O-N 3.21Å; I541-V543 PolarHBondContact O-N 3.21Å; V543-A546 PolarHBondContact O-N 3.02Å; V543-M547 WeakPolarHBondContact O-CB 3.5Å; V543-M547 PolarHBondContact O-N 3.24Å
544	S	57.4	Low	62.7	Low	71 Å²	71	103.3 Å²	103.3	50%	0.497	57%	0.573	S	S	.	*	H	α-helix	trans	-69.4	-37.9	178	83.1	0	0	0	0	112.8	T540 I541 G548	T540-S544 WeakPolarHBondContact O-CB 3.35Å; T540-S544 PolarHBondContact O-N 3Å; I541-S544 PolarHBondContact O-N 3.08Å; I541-S544 PolarHBondContact O-OG 3.49Å; S544-G548 PolarHBondContact O-N 3.47Å
545	T	69	Low	64.6	Low	87 Å²	87	98.5 Å²	98.5	53%	0.534	56%	0.56	S	S	.	*	H	α-helix	trans	-72.5	-36.1	176.5	32.1	0	0	0	0	111.5	I541 L542 C549	I541-T545 PolarHBondContact O-N 3.34Å; I541-T545 PolarHBondContact O-OG1 3.02Å; L542-T545 PolarHBondContact O-OG1 3.43Å; T545-C549 WeakPolarHBondContact O-CB 3.48Å; T545-C549 PolarHBondContact O-N 3.35Å
546	A	66.6	Low	66.6	Low	46 Å²	46	95.2 Å²	95.2	38%	0.38	53%	0.534	S	S	.	.	H	α-helix	trans	-65	-48.2	172.5	0	0	0	0	0	112.1	L542 V543 G548 C549 F550	L542-A546 VanDerWaalsContact O-CB 3.27Å; L542-A546 WeakPolarHBondContact O-CB 3.26Å; L542-A546 PolarHBondContact O-N 3.09Å; V543-A546 PolarHBondContact O-N 3.02Å; A546-G548 VanDerWaalsContact C-N 3.35Å; A546-G548 PolarHBondContact O-N 2.97Å; A546-C549 PolarHBondContact O-N 2.92Å; A546-F550 WeakPolarHBondContact O-CD2 3.48Å; A546-F550 PolarHBondContact O-N 3.16Å; A546-F550 VanDerWaalsContact O-N 3.15Å
547	M	63.8	Low	68.1	Low	132 Å²	132	94.1 Å²	94.1	65%	0.65	53%	0.528	S	S	*	.	H	α-helix	trans	-63.7	-37.2	176.1	-88.1	-175.6	78.2	0	0	112.7	V543 C549 T551	V543-M547 WeakPolarHBondContact O-CB 3.5Å; V543-M547 PolarHBondContact O-N 3.24Å; M547-C549 VanDerWaalsContact C-N 3.35Å; M547-T551 WeakPolarHBondContact O-CG2 3.41Å; M547-T551 PolarHBondContact O-N 3.37Å; M547-T551 VanDerWaalsContact O-N 3.15Å; M547-T551 PolarHBondContact O-OG1 3.18Å; M547-T551 VanDerWaalsContact O-OG1 3.1Å
548	G	67.6	Low	69.3	Low	35 Å²	35	96 Å²	96	36%	0.361	53%	0.532	S	S	.	.	H	α-helix	trans	-65.6	-36.2	175	0	0	0	0	0	113	S544 A546 T551 F552	S544-G548 PolarHBondContact O-N 3.47Å; A546-G548 VanDerWaalsContact C-N 3.35Å; A546-G548 PolarHBondContact O-N 2.97Å; G548-T551 PolarHBondContact O-OG1 3.27Å; G548-F552 WeakPolarHBondContact O-CB 3.4Å; G548-F552 PolarHBondContact O-N 3.39Å
549	C	65	Low	70.1	Confident	74 Å²	74	93.1 Å²	93.1	50%	0.5	52%	0.522	S	S	.	.	H	α-helix	trans	-71.5	-39.4	179.5	-153.3	0	0	0	0	111.9	T545 A546 M547 F552 L553	T545-C549 WeakPolarHBondContact O-CB 3.48Å; T545-C549 PolarHBondContact O-N 3.35Å; A546-C549 PolarHBondContact O-N 2.92Å; M547-C549 VanDerWaalsContact C-N 3.35Å; C549-F552 PolarHBondContact O-N 3.19Å; C549-L553 WeakPolarHBondContact O-CB 3.44Å; C549-L553 PolarHBondContact O-N 3.22Å
550	F	70.3	Confident	71.3	Confident	156 Å²	156	91.7 Å²	91.7	68%	0.684	52%	0.516	S	S	*	.	H	α-helix	trans	-68.2	-37	175.9	-73.1	-62.9	0	0	0	113.1	A546 G554	A546-F550 WeakPolarHBondContact O-CD2 3.48Å; A546-F550 PolarHBondContact O-N 3.16Å; A546-F550 VanDerWaalsContact O-N 3.15Å; F550-G554 PolarHBondContact O-N 3.3Å
551	T	76.5	Confident	72.4	Confident	90 Å²	90	92.4 Å²	92.4	55%	0.552	52%	0.516	S	S	*	.	H	α-helix	trans	-70.3	-38.6	176.1	53.2	0	0	0	0	111.7	M547 G548 G554 V555	M547-T551 WeakPolarHBondContact O-CG2 3.41Å; M547-T551 PolarHBondContact O-N 3.37Å; M547-T551 VanDerWaalsContact O-N 3.15Å; M547-T551 PolarHBondContact O-OG1 3.18Å; M547-T551 VanDerWaalsContact O-OG1 3.1Å; G548-T551 PolarHBondContact O-OG1 3.27Å; T551-G554 PolarHBondContact O-N 2.82Å; T551-V555 WeakPolarHBondContact O-CG2 3.25Å; T551-V555 PolarHBondContact O-N 3.44Å
552	F	75.2	Confident	73.1	Confident	145 Å²	145	93.4 Å²	93.4	64%	0.636	52%	0.521	S	S	*	.	H	α-helix	trans	-63.8	-47.5	174.6	-175.2	-100.2	0	0	0	112.3	G548 C549 G554 V555 V556	G548-F552 WeakPolarHBondContact O-CB 3.4Å; G548-F552 PolarHBondContact O-N 3.39Å; C549-F552 PolarHBondContact O-N 3.19Å; F552-G554 VanDerWaalsContact C-N 3.31Å; F552-G554 PolarHBondContact O-N 3.24Å; F552-V555 PolarHBondContact O-N 3.11Å; F552-V556 HydrophobicContact CD1-CG2 4.3Å; F552-V556 HydrophobicContact CE1-CG2 3.98Å; F552-V556 HydrophobicContact CZ-CG2 4.1Å; F552-V556 VanDerWaalsContact O-CG2 3.31Å; F552-V556 WeakPolarHBondContact O-CG2 3.35Å; F552-V556 PolarHBondContact O-N 3.16Å
553	L	79.3	Confident	73.8	Confident	97 Å²	97	93 Å²	93	51%	0.508	52%	0.519	S	S	.	.	H	α-helix	trans	-60.8	-39.5	175.3	-88.1	153.4	0	0	0	112.1	C549 V556 L557	C549-L553 WeakPolarHBondContact O-CB 3.44Å; C549-L553 PolarHBondContact O-N 3.22Å; L553-V556 PolarHBondContact O-N 3.29Å; L553-L557 WeakPolarHBondContact O-CB 3.45Å; L553-L557 PolarHBondContact O-N 3.1Å
554	G	80.6	Confident	74.4	Confident	39 Å²	39	94.3 Å²	94.3	40%	0.402	52%	0.518	S	S	.	.	H	α-helix	trans	-62.6	-43.7	176.1	0	0	0	0	0	113.3	F550 T551 F552 L557 F558	F550-G554 PolarHBondContact O-N 3.3Å; T551-G554 PolarHBondContact O-N 2.82Å; F552-G554 VanDerWaalsContact C-N 3.31Å; F552-G554 PolarHBondContact O-N 3.24Å; G554-L557 PolarHBondContact O-N 3.02Å; G554-F558 WeakPolarHBondContact O-CB 3.12Å; G554-F558 PolarHBondContact O-N 3.15Å
555	V	81	Confident	75.2	Confident	92 Å²	92	95.7 Å²	95.7	56%	0.558	52%	0.523	S	S	*	.	H	α-helix	trans	-66.9	-39.6	177.4	173.5	0	0	0	0	111.3	T551 F552 F558 C559	T551-V555 WeakPolarHBondContact O-CG2 3.25Å; T551-V555 PolarHBondContact O-N 3.44Å; F552-V555 PolarHBondContact O-N 3.11Å; V555-F558 PolarHBondContact O-N 3.36Å; V555-C559 WeakPolarHBondContact O-CB 3.16Å; V555-C559 PolarHBondContact O-N 3.32Å
556	V	81.6	Confident	74.8	Confident	54 Å²	54	99.4 Å²	99.4	33%	0.327	53%	0.528	S	S	.	.	H	α-helix	trans	-64.4	-45.3	176.8	172.9	0	0	0	0	111	F552 L553 F558 C559 F560	F552-V556 HydrophobicContact CD1-CG2 4.3Å; F552-V556 HydrophobicContact CE1-CG2 3.98Å; F552-V556 HydrophobicContact CZ-CG2 4.1Å; F552-V556 VanDerWaalsContact O-CG2 3.31Å; F552-V556 WeakPolarHBondContact O-CG2 3.35Å; F552-V556 PolarHBondContact O-N 3.16Å; L553-V556 PolarHBondContact O-N 3.29Å; V556-F558 VanDerWaalsContact C-N 3.34Å; V556-F558 PolarHBondContact O-N 3.06Å; V556-C559 PolarHBondContact O-N 2.74Å; V556-F560 HydrophobicContact CG1-CD2 3.85Å; V556-F560 HydrophobicContact CG1-CE2 3.88Å; V556-F560 WeakPolarHBondContact O-CD2 3.36Å; V556-F560 PolarHBondContact O-N 2.79Å
557	L	80.8	Confident	74.8	Confident	112 Å²	112	101.3 Å²	101.3	59%	0.586	54%	0.538	S	S	*	.	H	α-helix	trans	-61.4	-41.5	175.8	-115.6	155.6	0	0	0	112.1	L553 G554 F560 L561	L553-L557 WeakPolarHBondContact O-CB 3.45Å; L553-L557 PolarHBondContact O-N 3.1Å; G554-L557 PolarHBondContact O-N 3.02Å; L557-F560 PolarHBondContact O-N 3.2Å; L557-L561 WeakPolarHBondContact O-CG 3.46Å; L557-L561 PolarHBondContact O-N 3.24Å
558	F	79.9	Confident	74.7	Confident	130 Å²	130	104 Å²	104	57%	0.57	54%	0.541	S	S	*	.	H	α-helix	trans	-64	-42.8	176.2	-174.9	-104	0	0	0	112.2	G554 V555 V556 F560 L561 L562	G554-F558 WeakPolarHBondContact O-CB 3.12Å; G554-F558 PolarHBondContact O-N 3.15Å; V555-F558 PolarHBondContact O-N 3.36Å; V556-F558 VanDerWaalsContact C-N 3.34Å; V556-F558 PolarHBondContact O-N 3.06Å; F558-F560 PolarHBondContact O-N 2.8Å; F558-L561 PolarHBondContact O-N 3.09Å; F558-L562 HydrophobicContact CD1-CD1 3.94Å; F558-L562 HydrophobicContact CD1-CG 4.48Å; F558-L562 HydrophobicContact CE1-CD1 3.52Å; F558-L562 HydrophobicContact CE1-CG 4.19Å; F558-L562 HydrophobicContact CZ-CD1 4.1Å; F558-L562 HydrophobicContact CZ-CG 4.39Å; F558-L562 WeakPolarHBondContact O-CG 3.46Å; F558-L562 PolarHBondContact O-N 3.34Å
559	C	75.1	Confident	74.1	Confident	66 Å²	66	105 Å²	105	45%	0.446	55%	0.551	S	S	.	*	H	α-helix	trans	-61.7	-41	173.1	-92.7	0	0	0	0	112.4	V555 V556 L562 L563	V555-C559 WeakPolarHBondContact O-CB 3.16Å; V555-C559 PolarHBondContact O-N 3.32Å; V556-C559 PolarHBondContact O-N 2.74Å; C559-L562 PolarHBondContact O-N 3.3Å; C559-L563 WeakPolarHBondContact O-CG 3.26Å; C559-L563 PolarHBondContact O-N 3.17Å
560	F	81.8	Confident	73.5	Confident	136 Å²	136	109 Å²	109	60%	0.596	56%	0.56	S	S	*	*	H	α-helix	trans	-64.8	-38.6	175.4	-91.5	-72.5	0	0	0	112.5	V556 L557 F558 L563 F564	V556-F560 HydrophobicContact CG1-CD2 3.85Å; V556-F560 HydrophobicContact CG1-CE2 3.88Å; V556-F560 WeakPolarHBondContact O-CD2 3.36Å; V556-F560 PolarHBondContact O-N 2.79Å; L557-F560 PolarHBondContact O-N 3.2Å; F558-F560 PolarHBondContact O-N 2.8Å; F560-L563 PolarHBondContact O-N 3.43Å; F560-F564 VanDerWaalsContact O-CB 3.3Å; F560-F564 WeakPolarHBondContact O-CB 3.22Å; F560-F564 PolarHBondContact O-N 3.45Å
561	L	80.6	Confident	72.6	Confident	104 Å²	104	104.5 Å²	104.5	55%	0.545	56%	0.558	S	S	.	*	H	α-helix	trans	-64.3	-42.1	174.1	-74.2	171.7	0	0	0	111.8	L557 F558 F564 V565	L557-L561 WeakPolarHBondContact O-CG 3.46Å; L557-L561 PolarHBondContact O-N 3.24Å; F558-L561 PolarHBondContact O-N 3.09Å; L561-F564 PolarHBondContact O-N 2.72Å; L561-V565 VanDerWaalsContact O-CG2 3.29Å; L561-V565 WeakPolarHBondContact O-CG2 3.3Å; L561-V565 PolarHBondContact O-N 3.04Å
562	L	77.2	Confident	71.3	Confident	94 Å²	94	109.2 Å²	109.2	49%	0.492	57%	0.571	S	S	.	*	H	α-helix	trans	-63.2	-42.8	174.9	-72.9	177.3	0	0	0	112.1	F558 C559 F564 V565 W566	F558-L562 HydrophobicContact CD1-CD1 3.94Å; F558-L562 HydrophobicContact CD1-CG 4.48Å; F558-L562 HydrophobicContact CE1-CD1 3.52Å; F558-L562 HydrophobicContact CE1-CG 4.19Å; F558-L562 HydrophobicContact CZ-CD1 4.1Å; F558-L562 HydrophobicContact CZ-CG 4.39Å; F558-L562 WeakPolarHBondContact O-CG 3.46Å; F558-L562 PolarHBondContact O-N 3.34Å; C559-L562 PolarHBondContact O-N 3.3Å; L562-F564 VanDerWaalsContact C-N 3.32Å; L562-F564 PolarHBondContact O-N 2.78Å; L562-V565 PolarHBondContact O-N 3.24Å; L562-W566 VanDerWaalsContact O-CB 3.25Å; L562-W566 WeakPolarHBondContact O-CB 3.34Å; L562-W566 PolarHBondContact O-N 3.06Å
563	L	76.2	Confident	69.9	Low	102 Å²	102	110.7 Å²	110.7	53%	0.534	58%	0.579	S	S	.	*	H	α-helix	trans	-65	-35.5	175.1	-72.6	173.1	0	0	0	112.1	C559 F560 W566 S567	C559-L563 WeakPolarHBondContact O-CG 3.26Å; C559-L563 PolarHBondContact O-N 3.17Å; F560-L563 PolarHBondContact O-N 3.43Å; L563-W566 PolarHBondContact O-N 3.06Å; L563-S567 VanDerWaalsContact O-CB 3.23Å; L563-S567 WeakPolarHBondContact O-CB 3.14Å; L563-S567 PolarHBondContact O-N 3.37Å
564	F	76.6	Confident	68.2	Low	118 Å²	118	115.7 Å²	115.7	52%	0.518	60%	0.597	S	S	.	*	H	α-helix	trans	-70.8	-40.3	177.1	-166.6	-102.3	0	0	0	112.3	F560 L561 L562 S567 R568	F560-F564 VanDerWaalsContact O-CB 3.3Å; F560-F564 WeakPolarHBondContact O-CB 3.22Å; F560-F564 PolarHBondContact O-N 3.45Å; L561-F564 PolarHBondContact O-N 2.72Å; L562-F564 VanDerWaalsContact C-N 3.32Å; L562-F564 PolarHBondContact O-N 2.78Å; F564-S567 PolarHBondContact O-N 3.42Å; F564-R568 VanDerWaalsContact CZ-NH1 3.26Å; F564-R568 PolarHBondContact O-N 3.41Å
565	V	74.6	Confident	66.5	Low	101 Å²	101	119.5 Å²	119.5	61%	0.612	61%	0.608	S	S	*	*	H	α-helix	trans	-64.4	-41.4	172	171.9	0	0	0	0	110.6	L561 L562 R568 G569	L561-V565 VanDerWaalsContact O-CG2 3.29Å; L561-V565 WeakPolarHBondContact O-CG2 3.3Å; L561-V565 PolarHBondContact O-N 3.04Å; L562-V565 PolarHBondContact O-N 3.24Å; V565-R568 PolarHBondContact O-N 2.77Å; V565-G569 PolarHBondContact O-N 3.14Å
566	W	61.5	Low	64.5	Low	164 Å²	164	117.9 Å²	117.9	62%	0.621	60%	0.601	S	S	*	*	H	α-helix	trans	-68	-36.4	177.4	-164.7	63.9	0	0	0	112.8	L562 L563 G569	L562-W566 VanDerWaalsContact O-CB 3.25Å; L562-W566 WeakPolarHBondContact O-CB 3.34Å; L562-W566 PolarHBondContact O-N 3.06Å; L563-W566 PolarHBondContact O-N 3.06Å; W566-G569 PolarHBondContact O-N 3.47Å
567	S	65.6	Low	63	Low	87 Å²	87	121 Å²	121	61%	0.608	61%	0.614	S	S	*	*	H	α-helix	trans	-63.9	-41.4	173.5	176	0	0	0	0	111.9	L563 F564	L563-S567 VanDerWaalsContact O-CB 3.23Å; L563-S567 WeakPolarHBondContact O-CB 3.14Å; L563-S567 PolarHBondContact O-N 3.37Å; F564-S567 PolarHBondContact O-N 3.42Å
568	R	62.6	Low	61.1	Low	189 Å²	189	120.3 Å²	120.3	71%	0.713	61%	0.611	S	S	*	*	H	α-helix	trans	-73	-25.3	174.6	-84.7	-165.6	153.4	123.1	-2.2	114	F564 V565 K570	F564-R568 VanDerWaalsContact CZ-NH1 3.26Å; F564-R568 PolarHBondContact O-N 3.41Å; V565-R568 PolarHBondContact O-N 2.77Å; R568-K570 VanDerWaalsContact C-N 3.34Å; R568-K570 PolarHBondContact O-N 2.92Å
569	G	53.8	Low	59.7	Low	55 Å²	55	120.6 Å²	120.6	57%	0.567	62%	0.618	S	S	*	*	H	α-helix	trans	-73.2	-16.9	178.7	0	0	0	0	0	115.5	V565 W566	V565-G569 PolarHBondContact O-N 3.14Å; W566-G569 PolarHBondContact O-N 3.47Å
570	K	52.7	Low	58	Low	157 Å²	157	123.5 Å²	123.5	68%	0.683	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	5.7	-178.4	-97.5	-178.2	174	171.4	0	115.4	R568	R568-K570 VanDerWaalsContact C-N 3.34Å; R568-K570 PolarHBondContact O-N 2.92Å
571	G	51.8	Low	56.5	Low	62 Å²	62	125 Å²	125	64%	0.639	63%	0.628	S	S	*	*	S	Bend	trans	-99.8	-8.8	-170.7	0	0	0	0	0	118.2
572	K	49.8	Very low	54.9	Low	189 Å²	189	125.6 Å²	125.6	82%	0.822	64%	0.636	S	S	*	*			trans	-154.4	72.8	-177.5	-70.9	-170.7	-179.9	176.3	0	113.9
573	H	45.9	Very low	53.3	Low	176 Å²	176	125.3 Å²	125.3	82%	0.815	64%	0.64	S	S	*	*			trans	-129.9	87.1	149.5	-84.5	-70.8	0	0	0	108.4	N575	H573-N575 PolarHBondContact O-N 3.22Å
574	K	42.3	Very low	51.7	Low	202 Å²	202	132.2 Å²	132.2	88%	0.878	66%	0.658	S	S	*	*			trans	-75	110.3	156.6	-83.8	-178.3	174.5	-179.9	0	105.9	S576	K574-S576 PolarHBondContact O-N 3Å
575	N	46.3	Very low	50.1	Low	120 Å²	120	136.1 Å²	136.1	64%	0.642	68%	0.675	S	S	*	*			trans	-70.7	94.8	170.4	-68.7	-10.9	0	0	0	108.5	H573	H573-N575 PolarHBondContact O-N 3.22Å
576	S	38.4	Very low	48.4	Very low	58 Å²	58	138.9 Å²	138.9	41%	0.406	69%	0.686	S	S	.	*			trans	-138.1	102.2	168	167.5	0	0	0	0	105.6	K574 N602	K574-S576 PolarHBondContact O-N 3Å; S576-N602 PolarHBondContact OG-ND2 2.76Å
577	I	49.9	Very low	47.5	Very low	119 Å²	119	138.9 Å²	138.9	61%	0.61	70%	0.699	S	S	*	*			trans	-93.9	113.2	171.9	-60.6	173.3	0	0	0	105.9	L579	I577-L579 HydrophobicContact CG2-CD1 4.23Å; I577-L579 HydrophobicContact CG2-CG 4.01Å
578	D	41.6	Very low	46.2	Very low	97 Å²	97	138 Å²	138	52%	0.519	70%	0.704	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-85.2	112.4	167.1	-74.4	-31.7	0	0	0	107.7	N602	D578-N602 PolarHBondContact OD1-ND2 3.17Å; D578-N602 VanDerWaalsContact OD1-ND2 3.07Å
579	L	50.2	Low	44.9	Very low	137 Å²	137	134.3 Å²	134.3	72%	0.717	71%	0.713	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-98.7	121.7	173	-85.8	153.3	0	0	0	109	I577	I577-L579 HydrophobicContact CG2-CD1 4.23Å; I577-L579 HydrophobicContact CG2-CG 4.01Å
580	E	39.9	Very low	44.3	Very low	126 Å²	126	136.3 Å²	136.3	59%	0.589	73%	0.725	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-94.6	112.1	174.9	-160.1	165.5	-140.4	0	0	108.9	P598	E580-P598 HydrophobicContact CG-CB 3.91Å
581	Y	48.4	Very low	43.6	Very low	168 Å²	168	135.8 Å²	135.8	66%	0.659	73%	0.734	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-100.6	121.8	179.8	-179	-98	0	0	0	110.4	P583	Y581-P583 HydrophobicContact CD1-CG 4.13Å; Y581-P583 HydrophobicContact CE1-CB 3.84Å; Y581-P583 HydrophobicContact CE1-CG 3.8Å
582	V	47.6	Very low	43.1	Very low	117 Å²	117	142.1 Å²	142.1	71%	0.709	75%	0.747	S	S	*	*			trans	-106.7	115	169.2	-178.2	0	0	0	0	108	R584	V582-R584 PolarHBondContact O-N 2.73Å
583	P	43.9	Very low	42.5	Very low	88 Å²	88	136.5 Å²	136.5	57%	0.571	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-67	131.5	-179.9	-10.1	22.2	0	0	0	110.7	Y581	Y581-P583 HydrophobicContact CD1-CG 4.13Å; Y581-P583 HydrophobicContact CE1-CB 3.84Å; Y581-P583 HydrophobicContact CE1-CG 3.8Å
584	R	42.7	Very low	42.1	Very low	246 Å²	246	137.4 Å²	137.4	93%	0.928	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-72.6	127.1	167.1	-92.4	-176.7	174.1	170.8	-1.5	109.7	V582 N586	V582-R584 PolarHBondContact O-N 2.73Å; R584-N586 PolarHBondContact O-N 2.79Å
585	K	43.3	Very low	42.1	Very low	200 Å²	200	135 Å²	135	87%	0.87	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-68	119.1	175.4	-154.5	176.4	-172.8	179.8	0	109.5
586	N	38.7	Very low	42.1	Very low	159 Å²	159	132.8 Å²	132.8	85%	0.85	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-89	132	171.4	-144.7	23.1	0	0	0	108.5	R584 G588	R584-N586 PolarHBondContact O-N 2.79Å; N586-G588 PolarHBondContact O-N 3.21Å
587	N	42.4	Very low	42.8	Very low	164 Å²	164	132.3 Å²	132.3	88%	0.877	75%	0.752	S	S	*	*			trans	-71.2	111.8	179.3	-82.1	-15.6	0	0	0	110.3
588	G	37.1	Very low	42.6	Very low	69 Å²	69	130.6 Å²	130.6	71%	0.711	75%	0.749	S	S	*	*			trans	170.1	105.5	169.8	0	0	0	0	0	113.3	N586	N586-G588 PolarHBondContact O-N 3.21Å
589	A	35.8	Very low	43.2	Very low	111 Å²	111	134.4 Å²	134.4	92%	0.917	76%	0.756	S	S	*	*			trans	66.3	127.6	164.7	0	0	0	0	0	118.9
590	A	41	Very low	43	Very low	98 Å²	98	136.8 Å²	136.8	81%	0.81	76%	0.756	S	S	*	*			trans	-77.9	132.2	-176.2	0	0	0	0	0	112.9
591	V	38	Very low	43.5	Very low	145 Å²	145	137.8 Å²	137.8	88%	0.879	76%	0.758	S	S	*	*			trans	-147.3	130.5	147.3	-178	0	0	0	0	107.5
592	E	42	Very low	43	Very low	196 Å²	196	134.9 Å²	134.9	92%	0.916	75%	0.754	S	S	*	*			trans	-70.2	135.6	178.6	-68.6	173.8	144.1	0	0	111.8
593	G	37.6	Very low	42.7	Very low	71 Å²	71	136.8 Å²	136.8	73%	0.732	76%	0.757	S	S	*	*			trans	155.9	109	169.6	0	0	0	0	0	114.2
594	E	36.6	Very low	42.3	Very low	195 Å²	195	141.4 Å²	141.4	91%	0.911	77%	0.768	S	S	*	*			trans	61	107.8	163.7	-67.1	-174.4	155.3	0	0	119.6	A596	E594-A596 PolarHBondContact O-N 2.7Å
595	V	42.3	Very low	42	Very low	150 Å²	150	136.9 Å²	136.9	91%	0.909	76%	0.759	S	S	*	*			trans	-67.7	98.4	163.9	178.8	0	0	0	0	108.9	G597	V595-G597 PolarHBondContact O-N 3.23Å
596	A	46.5	Very low	41.9	Very low	75 Å²	75	138.4 Å²	138.4	62%	0.62	78%	0.775	S	S	*	*			trans	-71	110.6	170.9	0	0	0	0	0	110.1	E594	E594-A596 PolarHBondContact O-N 2.7Å
597	G	54.2	Low	42	Very low	48 Å²	48	137.4 Å²	137.4	50%	0.495	77%	0.771	S	S	.	*	P	Polyproline II helix	trans	-64.7	167.7	169.5	0	0	0	0	0	113	V595 R599	V595-G597 PolarHBondContact O-N 3.23Å; G597-R599 PolarHBondContact O-N 3.18Å
598	P	44.2	Very low	42	Very low	83 Å²	83	136 Å²	136	54%	0.539	77%	0.765	S	S	.	*	P	Polyproline II helix	trans	-57.5	124.9	-175.4	22.4	-31.8	0	0	0	111.3	E580	E580-P598 HydrophobicContact CG-CB 3.91Å
599	R	54.3	Low	42.3	Very low	176 Å²	176	139.7 Å²	139.7	66%	0.664	77%	0.768	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-92.8	123.1	176.7	-70.3	-175.3	176.4	174.7	-0.4	109.7	G597 F601	G597-R599 PolarHBondContact O-N 3.18Å; R599-F601 HydrophobicContact CB-CD2 4.47Å; R599-F601 HydrophobicContact CB-CE2 3.91Å
600	R	45.8	Very low	42.7	Very low	188 Å²	188	141.4 Å²	141.4	71%	0.709	76%	0.76	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-89.2	127.4	174.6	-68.6	-177.6	176.9	178.2	-2.1	109.9
601	F	51.6	Low	42.8	Very low	146 Å²	146	144.1 Å²	144.1	64%	0.64	76%	0.756	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-118.4	128.6	170.6	-72.8	-85.9	0	0	0	109.5	R599	R599-F601 HydrophobicContact CB-CD2 4.47Å; R599-F601 HydrophobicContact CB-CE2 3.91Å
602	N	37.5	Very low	43.1	Very low	108 Å²	108	144.1 Å²	144.1	58%	0.578	75%	0.748	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-99.9	106	177.4	-155.1	-86.5	0	0	0	108.1	S576 D578	S576-N602 PolarHBondContact OG-ND2 2.76Å; D578-N602 PolarHBondContact OD1-ND2 3.17Å; D578-N602 VanDerWaalsContact OD1-ND2 3.07Å
603	M	41.4	Very low	43.1	Very low	157 Å²	157	140.4 Å²	140.4	77%	0.773	74%	0.736	S	S	*	*			trans	-97.8	120.4	174.8	-83.7	179	73.2	0	0	110.1
604	K	34.9	Very low	43.6	Very low	185 Å²	185	145.7 Å²	145.7	80%	0.804	74%	0.737	S	S	*	*			trans	-92.2	109.7	174.3	-157.6	177.3	-174.5	-177.4	0	107.9	I606	K604-I606 PolarHBondContact O-N 3.07Å
605	M	35.7	Very low	44.1	Very low	150 Å²	150	141.6 Å²	141.6	74%	0.739	72%	0.722	S	S	*	*			trans	-70.1	121.8	169.9	-74.5	-157.3	-74.1	0	0	108.6
606	I	41.4	Very low	44.3	Very low	233 Å²	233	140.8 Å²	140.8	100%	1.195	71%	0.705	S	S	*	*			trans	-83.7	0	168.8	-63	176.2	0	0	0	108.4	K604	K604-I606 PolarHBondContact O-N 3.07Å

Retrieved 606 of 606 residues in 136.5 ms (Link to these results)

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