A0A087Y7S1_POEFO Loading...

Phospholipid scramblase

May mediate accelerated ATP-independent bidirectional transbilayer migration of phospholipids upon binding calcium ions that results in a loss of phospholipid asymmetry in the plasma membrane.

AlphaFold DB , UniProt , Accession A0A087Y7S1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 228 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.9	Very low	47.9	Very low	221 Å²	221	124.1 Å²	124.1	100%	1.089	71%	0.708	S	S	*	*				0	106.5	0	-78.8	114.2	173.1	0	0	108.9
2	N	32.9	Very low	50.2	Low	144 Å²	144	124.5 Å²	124.5	77%	0.77	72%	0.719	S	S	*	*			trans	-135.8	96.8	158.7	-90.4	-26	0	0	0	105.8	Y4	N2-Y4 HydrophobicContact CB-CD2 4.48Å; N2-Y4 HydrophobicContact CB-CE2 4.29Å; N2-Y4 PolarHBondContact O-N 3.42Å
3	M	40.7	Very low	52.6	Low	172 Å²	172	120 Å²	120	85%	0.847	72%	0.716	S	S	*	*			trans	-77.6	106.9	175.2	-65.1	179.1	-172.8	0	0	107.6
4	Y	45.3	Very low	55.1	Low	206 Å²	206	112.8 Å²	112.8	81%	0.808	67%	0.674	S	S	*	*			trans	-132.2	91.8	159.1	-62.8	-71.8	0	0	0	108.1	N2	N2-Y4 HydrophobicContact CB-CD2 4.48Å; N2-Y4 HydrophobicContact CB-CE2 4.29Å; N2-Y4 PolarHBondContact O-N 3.42Å
5	A	44.7	Very low	57.4	Low	74 Å²	74	105.7 Å²	105.7	61%	0.612	63%	0.632	S	S	*	*			trans	-133	100.6	151.1	0	0	0	0	0	106.3	F87	A5-F87 HydrophobicContact CB-CZ 4.29Å
6	V	40.3	Very low	59.4	Low	126 Å²	126	104.3 Å²	104.3	76%	0.764	63%	0.626	S	S	*	*			trans	-64.6	133.6	159.7	-177.5	0	0	0	0	105.6	S8	V6-S8 PolarHBondContact O-N 3.23Å
7	P	43.6	Very low	61.1	Low	119 Å²	119	99.4 Å²	99.4	77%	0.773	60%	0.602	S	S	*	*			trans	-61	105.2	168	-8.8	21.6	0	0	0	106.8
8	S	49.1	Very low	62.8	Low	76 Å²	76	93.8 Å²	93.8	53%	0.531	57%	0.568	S	S	.	*	P	Polyproline II helix	trans	-63.8	129.5	173	-178.5	0	0	0	0	107	V6 G10	V6-S8 PolarHBondContact O-N 3.23Å; S8-G10 PolarHBondContact O-N 3.15Å; S8-G10 VanDerWaalsContact O-N 3.15Å
9	P	53.9	Low	64.4	Low	111 Å²	111	91.8 Å²	91.8	72%	0.721	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-52.3	127	161.2	22.1	-28.9	0	0	0	106.9	I11	P9-I11 PolarHBondContact O-N 2.9Å
10	G	61.7	Low	65.8	Low	54 Å²	54	91.1 Å²	91.1	56%	0.557	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-50	129.2	-175.2	0	0	0	0	0	110	S8 P12	S8-G10 PolarHBondContact O-N 3.15Å; S8-G10 VanDerWaalsContact O-N 3.15Å; G10-P12 WeakPolarHBondContact O-CD 3.33Å
11	I	75	Confident	67.1	Low	62 Å²	62	86.8 Å²	86.8	32%	0.318	51%	0.514	S	S	.	.	P	Polyproline II helix	trans	-66.2	120.5	179.6	-61.2	172.1	0	0	0	106.9	P9 G13 C14 E19 T22	P9-I11 PolarHBondContact O-N 2.9Å; I11-G13 PolarHBondContact O-N 3.02Å; I11-G13 VanDerWaalsContact O-N 3.17Å; I11-C14 HydrophobicContact CB-CB 3.73Å; I11-C14 HydrophobicContact CG2-CB 4.04Å; I11-C14 WeakPolarHBondContact O-CB 3.37Å; I11-C14 PolarHBondContact O-N 2.97Å; I11-E19 HydrophobicContact CD1-CB 4.04Å; I11-E19 HydrophobicContact CD1-CG 4.09Å; I11-E19 HydrophobicContact CG1-CG 4.31Å; I11-T22 HydrophobicContact CD1-CG2 3.88Å
12	P	75.5	Confident	69.6	Low	129 Å²	129	78.5 Å²	78.5	84%	0.838	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	124.1	-178.1	-26.3	34.7	0	0	0	111.5	G10 C14	G10-P12 WeakPolarHBondContact O-CD 3.33Å; P12-C14 VanDerWaalsContact C-N 3.33Å; P12-C14 PolarHBondContact O-N 3.44Å
13	G	81.3	Confident	72.4	Confident	66 Å²	66	75.5 Å²	75.5	68%	0.68	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	87	-11.9	-179.2	0	0	0	0	0	115.7	I11 R207	I11-G13 PolarHBondContact O-N 3.02Å; I11-G13 VanDerWaalsContact O-N 3.17Å; G13-R207 PolarHBondContact O-NH2 2.89Å
14	C	87.4	Confident	74.8	Confident	19 Å²	19	67.9 Å²	67.9	13%	0.128	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-81.2	127.3	173.7	-173.2	0	0	0	0	110.2	I11 P12	I11-C14 HydrophobicContact CB-CB 3.73Å; I11-C14 HydrophobicContact CG2-CB 4.04Å; I11-C14 WeakPolarHBondContact O-CB 3.37Å; I11-C14 PolarHBondContact O-N 2.97Å; P12-C14 VanDerWaalsContact C-N 3.33Å; P12-C14 PolarHBondContact O-N 3.44Å
15	P	89.4	Confident	77.1	Confident	6 Å²	6	61.5 Å²	61.5	4%	0.039	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-58.1	139	168.2	-22.8	34.1	0	0	0	110.9	G17 L18 R207	P15-G17 PolarHBondContact O-N 2.98Å; P15-L18 HydrophobicContact CB-CD1 3.95Å; P15-L18 HydrophobicContact CB-CG 4.17Å; P15-L18 HydrophobicContact CG-CD1 3.94Å; P15-L18 PolarHBondContact O-N 3.46Å; P15-R207 HydrophobicContact CG-CG 4Å
16	P	89	Confident	79.4	Confident	84 Å²	84	59.1 Å²	59.1	55%	0.545	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	137.1	176.5	-25.7	33.5	0	0	0	112.2	L18 E19	P16-L18 VanDerWaalsContact C-N 3.31Å; P16-E19 WeakPolarHBondContact CA-OE1 3.18Å
17	G	88	Confident	81.9	Confident	20 Å²	20	53.1 Å²	53.1	21%	0.206	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.9	-14.9	-179.5	0	0	0	0	0	114.2	P15 E19	P15-G17 PolarHBondContact O-N 2.98Å; G17-E19 VanDerWaalsContact C-OE2 3.25Å; G17-E19 WeakPolarHBondContact CA-OE2 3.49Å; G17-E19 PolarHBondContact N-OE1 2.8Å; G17-E19 PolarHBondContact N-OE2 3.46Å
18	L	92.5	Very high	84.2	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	32%	0.315	C	S	.	.			trans	-93.1	1.1	177.4	-57.4	-167.6	0	0	0	113.6	P15 P16 Y20 L21 I92 A116 V206 A210	P15-L18 HydrophobicContact CB-CD1 3.95Å; P15-L18 HydrophobicContact CB-CG 4.17Å; P15-L18 HydrophobicContact CG-CD1 3.94Å; P15-L18 PolarHBondContact O-N 3.46Å; P16-L18 VanDerWaalsContact C-N 3.31Å; L18-Y20 PolarHBondContact O-N 2.99Å; L18-L21 HydrophobicContact CB-CD1 4.41Å; L18-L21 HydrophobicContact CD2-CD1 3.97Å; L18-L21 VanDerWaalsContact O-CB 3.28Å; L18-L21 WeakPolarHBondContact O-CB 3.39Å; L18-L21 PolarHBondContact O-N 2.81Å; L18-I92 HydrophobicContact CD2-CD1 3.73Å; L18-I92 HydrophobicContact CD2-CG1 3.67Å; L18-A116 HydrophobicContact CD1-CB 3.81Å; L18-A116 HydrophobicContact CD2-CB 4.02Å; L18-A116 HydrophobicContact CG-CB 4.09Å; L18-V206 HydrophobicContact CB-CB 4.34Å; L18-V206 HydrophobicContact CB-CG2 4.48Å; L18-V206 HydrophobicContact CD1-CG2 4.5Å; L18-A210 HydrophobicContact CD1-CB 4.04Å; L18-A210 HydrophobicContact CD2-CB 4.21Å
19	E	92.8	Very high	86.2	Confident	55 Å²	55	45.2 Å²	45.2	26%	0.257	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-58.4	-36.8	-173.6	-62.9	82.5	175.5	0	0	111.6	I11 P16 G17 L21 T22	I11-E19 HydrophobicContact CD1-CB 4.04Å; I11-E19 HydrophobicContact CD1-CG 4.09Å; I11-E19 HydrophobicContact CG1-CG 4.31Å; P16-E19 WeakPolarHBondContact CA-OE1 3.18Å; G17-E19 VanDerWaalsContact C-OE2 3.25Å; G17-E19 WeakPolarHBondContact CA-OE2 3.49Å; G17-E19 PolarHBondContact N-OE1 2.8Å; G17-E19 PolarHBondContact N-OE2 3.46Å; E19-L21 PolarHBondContact O-N 3.23Å; E19-T22 WeakPolarHBondContact O-CB 3.38Å; E19-T22 WeakPolarHBondContact O-CG2 3.43Å; E19-T22 PolarHBondContact O-N 3.44Å; E19-T22 PolarHBondContact O-OG1 3.28Å
20	Y	92.3	Very high	87.7	Confident	78 Å²	78	42.1 Å²	42.1	31%	0.306	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-60.3	-34.6	177.3	-167.5	-88.8	0	0	0	112.3	L18 T22 T23 V24 N52 V58 F59	L18-Y20 PolarHBondContact O-N 2.99Å; Y20-T22 PolarHBondContact O-N 3.36Å; Y20-T23 PolarHBondContact O-N 3.17Å; Y20-T23 PolarHBondContact O-OG1 2.61Å; Y20-V24 HydrophobicContact CD1-CG1 4.16Å; Y20-V24 HydrophobicContact CD1-CG2 4.43Å; Y20-V24 HydrophobicContact CE1-CG1 3.49Å; Y20-V24 VanDerWaalsContact CE1-CG1 3.49Å; Y20-V24 HydrophobicContact CE1-CG2 4.45Å; Y20-N52 PolarHBondContact OH-ND2 3.19Å; Y20-V58 HydrophobicContact CD1-CB 3.96Å; Y20-V58 HydrophobicContact CD1-CG1 4.05Å; Y20-V58 HydrophobicContact CD1-CG2 4.35Å; Y20-V58 HydrophobicContact CE1-CB 3.68Å; Y20-V58 HydrophobicContact CE1-CG1 3.26Å; Y20-V58 HydrophobicContact CE1-CG2 4.13Å; Y20-V58 HydrophobicContact CE2-CG1 4.1Å; Y20-V58 VanDerWaalsContact OH-CG1 3.31Å; Y20-V58 WeakPolarHBondContact OH-CG1 3.27Å; Y20-F59 HydrophobicContact CD1-CZ 4.49Å
21	L	93.3	Very high	88.6	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-65	-19	178.1	-60.5	-176.7	0	0	0	113	L18 E19 T23 V24 L27 F59 V206 K209 A210 I213	L18-L21 HydrophobicContact CB-CD1 4.41Å; L18-L21 HydrophobicContact CD2-CD1 3.97Å; L18-L21 VanDerWaalsContact O-CB 3.28Å; L18-L21 WeakPolarHBondContact O-CB 3.39Å; L18-L21 PolarHBondContact O-N 2.81Å; E19-L21 PolarHBondContact O-N 3.23Å; L21-T23 PolarHBondContact O-N 2.81Å; L21-V24 HydrophobicContact CD2-CG2 4.19Å; L21-L27 HydrophobicContact CD2-CD1 3.78Å; L21-F59 HydrophobicContact CD2-CE2 3.85Å; L21-F59 HydrophobicContact CD2-CZ 4.47Å; L21-F59 HydrophobicContact CG-CE2 4.33Å; L21-V206 HydrophobicContact CB-CB 4.44Å; L21-V206 HydrophobicContact CB-CG1 4.23Å; L21-K209 HydrophobicContact CB-CB 4.41Å; L21-K209 HydrophobicContact CB-CD 4.17Å; L21-K209 HydrophobicContact CD1-CB 4.08Å; L21-K209 VanDerWaalsContact O-CD 3.29Å; L21-K209 WeakPolarHBondContact O-CD 3.35Å; L21-K209 PolarHBondContact O-NZ 3.06Å; L21-A210 HydrophobicContact CD1-CB 4.29Å; L21-I213 HydrophobicContact CD1-CD1 4.3Å; L21-I213 HydrophobicContact CD2-CD1 4.25Å
22	T	92.6	Very high	88.6	Confident	47 Å²	47	42.1 Å²	42.1	29%	0.288	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-67.6	-22	172.5	67.8	0	0	0	0	112.6	I11 E19 Y20 M202 V206	I11-T22 HydrophobicContact CD1-CG2 3.88Å; E19-T22 WeakPolarHBondContact O-CB 3.38Å; E19-T22 WeakPolarHBondContact O-CG2 3.43Å; E19-T22 PolarHBondContact O-N 3.44Å; E19-T22 PolarHBondContact O-OG1 3.28Å; Y20-T22 PolarHBondContact O-N 3.36Å; T22-M202 WeakPolarHBondContact O-CE 3.28Å; T22-V206 HydrophobicContact CG2-CG1 3.47Å; T22-V206 VanDerWaalsContact CG2-CG1 3.47Å
23	T	91.6	Very high	87.8	Confident	81 Å²	81	41.8 Å²	41.8	50%	0.497	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-105.8	3.8	-171.2	68.3	0	0	0	0	114.1	Y20 L21 M202	Y20-T23 PolarHBondContact O-N 3.17Å; Y20-T23 PolarHBondContact O-OG1 2.61Å; L21-T23 PolarHBondContact O-N 2.81Å; T23-M202 VanDerWaalsContact CA-CE 3.48Å; T23-M202 WeakPolarHBondContact O-CE 3.39Å
24	V	92.3	Very high	86.6	Confident	12 Å²	12	46.2 Å²	46.2	7%	0.073	25%	0.248	C	C	.	.			trans	-130.3	149.1	-178.9	-63.6	0	0	0	0	111.6	Y20 L21 L27 F200 K209	Y20-V24 HydrophobicContact CD1-CG1 4.16Å; Y20-V24 HydrophobicContact CD1-CG2 4.43Å; Y20-V24 HydrophobicContact CE1-CG1 3.49Å; Y20-V24 VanDerWaalsContact CE1-CG1 3.49Å; Y20-V24 HydrophobicContact CE1-CG2 4.45Å; L21-V24 HydrophobicContact CD2-CG2 4.19Å; V24-L27 HydrophobicContact CG2-CD2 4.11Å; V24-L27 HydrophobicContact CG2-CG 4.43Å; V24-F200 WeakPolarHBondContact O-CE2 3Å; V24-K209 PolarHBondContact O-NZ 3.25Å
25	D	93.1	Very high	84.9	Confident	73 Å²	73	49.7 Å²	49.7	39%	0.39	27%	0.268	S	S	.	.	S	Bend	trans	-117	-7.4	173.2	61.5	-16.1	0	0	0	111.7	Q199 F200 M202	D25-Q199 WeakPolarHBondContact O-CA 3.28Å; D25-F200 CarbonylContact C-O 3.55Å; D25-F200 WeakPolarHBondContact CA-O 3.13Å; D25-F200 VanDerWaalsContact CB-O 3.31Å; D25-F200 WeakPolarHBondContact CB-O 3.15Å; D25-F200 PolarHBondContact O-N 3.19Å; D25-M202 HydrophobicContact CB-CB 4.29Å; D25-M202 HydrophobicContact CB-SD 4.34Å
26	Q	92.9	Very high	83.1	Confident	24 Å²	24	49.5 Å²	49.5	11%	0.112	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	137.7	179.3	-176.7	176.9	0.7	0	0	112.4	V53 W182 I198	Q26-V53 HydrophobicContact CB-CG1 3.62Å; Q26-V53 HydrophobicContact CG-CG1 3.74Å; Q26-W182 VanDerWaalsContact NE2-CZ2 3.32Å; Q26-I198 CarbonylContact C-O 3.59Å; Q26-I198 VanDerWaalsContact CA-O 3.22Å; Q26-I198 WeakPolarHBondContact CA-O 3.31Å; Q26-I198 WeakPolarHBondContact CG-O 3.19Å
27	L	92.9	Very high	81.4	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	150.9	173.8	-67.3	174.1	0	0	0	110.5	L21 V24 V50 R51 V58 G197 I198 F200 I213	L21-L27 HydrophobicContact CD2-CD1 3.78Å; V24-L27 HydrophobicContact CG2-CD2 4.11Å; V24-L27 HydrophobicContact CG2-CG 4.43Å; L27-V50 HydrophobicContact CB-CG1 4.32Å; L27-V50 HydrophobicContact CD1-CG1 4.21Å; L27-V50 HydrophobicContact CD2-CG1 4.13Å; L27-V50 HydrophobicContact CG-CG1 4.47Å; L27-R51 CarbonylContact C-O 3.59Å; L27-R51 WeakPolarHBondContact CA-O 3.26Å; L27-V58 HydrophobicContact CD2-CG2 4.02Å; L27-G197 WeakPolarHBondContact O-CA 3.46Å; L27-I198 PolarHBondContact N-O 2.86Å; L27-I198 PolarHBondContact O-N 2.99Å; L27-F200 HydrophobicContact CD1-CE1 4.46Å; L27-F200 HydrophobicContact CD1-CZ 4.14Å; L27-F200 HydrophobicContact CG-CZ 4.3Å; L27-I213 HydrophobicContact CD1-CD1 3.73Å; L27-I213 HydrophobicContact CD1-CG1 3.94Å
28	L	91	Very high	79.7	Confident	25 Å²	25	55.5 Å²	55.5	13%	0.131	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	124.1	174.3	-60	174.1	0	0	0	108.7	V50 R51 W182 F196	L28-V50 CarbonylContact O-C 3.52Å; L28-V50 WeakPolarHBondContact O-CA 3.25Å; L28-R51 HydrophobicContact CB-CB 4.27Å; L28-R51 PolarHBondContact N-O 2.98Å; L28-R51 PolarHBondContact O-N 3.49Å; L28-W182 HydrophobicContact CD2-CB 4.48Å; L28-W182 HydrophobicContact CD2-CG 4.49Å; L28-F196 CarbonylContact C-O 3.53Å; L28-F196 VanDerWaalsContact CA-O 3.3Å; L28-F196 WeakPolarHBondContact CA-O 3.38Å
29	I	90.9	Very high	77.8	Confident	3 Å²	3	61.4 Å²	61.4	2%	0.015	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	119.4	175.7	-57.2	-174.2	0	0	0	107.9	Y48 V50 N195 F196 I198 I213 C216 F217	I29-Y48 HydrophobicContact CG2-CD1 3.93Å; I29-Y48 HydrophobicContact CG2-CG 4.27Å; I29-V50 HydrophobicContact CG1-CG1 4.43Å; I29-V50 HydrophobicContact CG1-CG2 4.38Å; I29-N195 WeakPolarHBondContact O-CA 3.24Å; I29-F196 HydrophobicContact CB-CB 4.35Å; I29-F196 PolarHBondContact N-O 3.11Å; I29-F196 PolarHBondContact O-N 2.82Å; I29-I198 HydrophobicContact CD1-CD1 3.85Å; I29-I198 HydrophobicContact CG1-CD1 4.42Å; I29-I213 HydrophobicContact CD1-CG2 4.23Å; I29-C216 HydrophobicContact CD1-CB 4.02Å; I29-F217 HydrophobicContact CD1-CE1 4.34Å; I29-F217 HydrophobicContact CD1-CE2 4.43Å; I29-F217 HydrophobicContact CD1-CZ 4.09Å; I29-F217 HydrophobicContact CG2-CE1 3.86Å; I29-F217 HydrophobicContact CG2-CZ 4.22Å
30	K	85.9	Confident	75.9	Confident	47 Å²	47	59.2 Å²	59.2	20%	0.204	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	121.4	-178.2	174.9	167	-177.2	156	0	110.4	Y48 E49 A193 N195	K30-Y48 CarbonylContact O-C 3.51Å; K30-Y48 VanDerWaalsContact O-CA 3.26Å; K30-Y48 WeakPolarHBondContact O-CA 3.46Å; K30-E49 PolarHBondContact N-O 2.74Å; K30-E49 PolarHBondContact O-N 2.74Å; K30-A193 HydrophobicContact CD-CB 4.35Å; K30-A193 VanDerWaalsContact CE-CB 3.47Å; K30-A193 HydrophobicContact CG-CB 4.39Å; K30-N195 WeakPolarHBondContact CB-OD1 3.46Å; K30-N195 WeakPolarHBondContact CD-OD1 3.25Å; K30-N195 VanDerWaalsContact CG-OD1 3.25Å; K30-N195 WeakPolarHBondContact CG-OD1 3.16Å
31	Q	81.8	Confident	74.1	Confident	66 Å²	66	59.8 Å²	59.8	31%	0.308	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	140.1	173.1	-163.5	177.7	8.7	0	0	110.8	N46 K47 Y48	Q31-N46 PolarHBondContact NE2-OD1 2.89Å; Q31-K47 WeakPolarHBondContact CA-O 3.33Å; Q31-Y48 HydrophobicContact CB-CD1 3.82Å; Q31-Y48 HydrophobicContact CB-CE1 3.84Å; Q31-Y48 HydrophobicContact CG-CD1 4.02Å; Q31-Y48 HydrophobicContact CG-CE1 3.74Å
32	K	73.8	Confident	72.2	Confident	49 Å²	49	63.4 Å²	63.4	21%	0.213	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	136.5	179.9	-78.9	-123.5	174.9	149.2	0	110.3	V35 K47 E49	K32-V35 HydrophobicContact CD-CG2 4.47Å; K32-K47 PolarHBondContact N-O 3.22Å; K32-E49 HydrophobicContact CD-CG 4.34Å; K32-E49 WeakPolarHBondContact CE-OE1 3.29Å; K32-E49 WeakPolarHBondContact CE-OE2 3.28Å; K32-E49 HydrophobicContact CG-CG 4.13Å; K32-E49 IonicContact NZ-OE1 2.94Å; K32-E49 PolarHBondContact NZ-OE1 3.02Å; K32-E49 IonicContact NZ-OE2 3.63Å; K32-E49 PolarHBondContact NZ-OE2 3.26Å
33	V	59.3	Low	70.4	Confident	123 Å²	123	69.7 Å²	69.7	75%	0.745	39%	0.392	S	S	*	.	S	Bend	trans	-93	-30.4	-174.1	-174.6	0	0	0	0	113.1
34	E	56.3	Low	68.9	Low	159 Å²	159	66.6 Å²	66.6	74%	0.743	37%	0.373	S	S	*	.	S	Bend	trans	-131.1	-23.9	-164.4	-62.1	-177.8	170.4	0	0	116.9	V36	E34-V36 PolarHBondContact O-N 3.42Å
35	V	51.9	Low	67.7	Low	92 Å²	92	69.3 Å²	69.3	56%	0.558	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-15.8	-162.4	-174.3	0	0	0	0	114.7	K32	K32-V35 HydrophobicContact CD-CG2 4.47Å
36	V	50.8	Low	67.1	Low	2 Å²	2	66.6 Å²	66.6	1%	0.012	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-13.3	-169.6	174.4	0	0	0	0	113.1	E34 A38 L39 V40 K47 Y60 V62	E34-V36 PolarHBondContact O-N 3.42Å; V36-A38 VanDerWaalsContact C-N 3.27Å; V36-A38 PolarHBondContact O-N 3.16Å; V36-L39 PolarHBondContact O-N 3.16Å; V36-L39 VanDerWaalsContact O-N 3.16Å; V36-V40 HydrophobicContact CG1-CB 3.81Å; V36-V40 HydrophobicContact CG1-CG2 3.48Å; V36-V40 VanDerWaalsContact CG1-CG2 3.48Å; V36-V40 PolarHBondContact O-N 3.01Å; V36-V40 VanDerWaalsContact O-N 3.15Å; V36-K47 HydrophobicContact CB-CB 4.27Å; V36-K47 HydrophobicContact CB-CD 4Å; V36-K47 HydrophobicContact CB-CG 4.36Å; V36-K47 HydrophobicContact CG1-CD 4.33Å; V36-K47 HydrophobicContact CG1-CG 4.4Å; V36-K47 HydrophobicContact CG2-CB 4.48Å; V36-Y60 HydrophobicContact CG2-CD1 4.08Å; V36-Y60 HydrophobicContact CG2-CE1 4.4Å; V36-V62 HydrophobicContact CG1-CG1 3.99Å
37	E	52.7	Low	66.7	Low	130 Å²	130	65.8 Å²	65.8	61%	0.607	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-34.6	178.9	-75.3	-178	177.8	0	0	114.2	L39 K47	E37-L39 VanDerWaalsContact C-N 3.29Å; E37-L39 PolarHBondContact O-N 2.98Å; E37-K47 IonicContact OE1-NZ 3.01Å; E37-K47 PolarHBondContact OE1-NZ 3.01Å
38	A	52.8	Low	66.5	Low	100 Å²	100	66 Å²	66	83%	0.826	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-15.4	-177.1	0	0	0	0	0	113.7	V36	V36-A38 VanDerWaalsContact C-N 3.27Å; V36-A38 PolarHBondContact O-N 3.16Å
39	L	52.4	Low	66.4	Low	124 Å²	124	65.1 Å²	65.1	65%	0.649	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.2	-29.6	-173.6	-69.4	174.4	0	0	0	112.9	V36 E37	V36-L39 PolarHBondContact O-N 3.16Å; V36-L39 VanDerWaalsContact O-N 3.16Å; E37-L39 VanDerWaalsContact C-N 3.29Å; E37-L39 PolarHBondContact O-N 2.98Å
40	V	54	Low	66.5	Low	9 Å²	9	65 Å²	65	6%	0.055	37%	0.365	C	S	.	.	S	Bend	trans	-125.8	104.6	-165.9	-175.4	0	0	0	0	105.1	V36 F42 V62 L84	V36-V40 HydrophobicContact CG1-CB 3.81Å; V36-V40 HydrophobicContact CG1-CG2 3.48Å; V36-V40 VanDerWaalsContact CG1-CG2 3.48Å; V36-V40 PolarHBondContact O-N 3.01Å; V36-V40 VanDerWaalsContact O-N 3.15Å; V40-F42 HydrophobicContact CB-CD2 4.47Å; V40-F42 HydrophobicContact CG1-CB 4.27Å; V40-F42 HydrophobicContact CG1-CD2 3.29Å; V40-F42 HydrophobicContact CG1-CE2 3.92Å; V40-F42 HydrophobicContact CG1-CG 4.14Å; V40-F42 PolarHBondContact O-N 3.43Å; V40-V62 HydrophobicContact CG1-CB 4.5Å; V40-V62 HydrophobicContact CG1-CG1 3.79Å; V40-V62 HydrophobicContact CG1-CG2 4.05Å; V40-L84 HydrophobicContact CB-CD1 4.28Å; V40-L84 HydrophobicContact CG1-CD1 3.35Å; V40-L84 HydrophobicContact CG2-CD1 3.87Å
41	G	54.9	Low	66.7	Low	89 Å²	89	65 Å²	65	92%	0.918	36%	0.363	S	S	*	.			trans	-66.5	29.8	-173.3	0	0	0	0	0	115.6
42	F	51.6	Low	67	Low	76 Å²	76	62.1 Å²	62.1	33%	0.333	35%	0.35	S	S	.	.			trans	-104	122.3	-179.7	-67.3	-102	0	0	0	109.7	V40 S44 V62	V40-F42 HydrophobicContact CB-CD2 4.47Å; V40-F42 HydrophobicContact CG1-CB 4.27Å; V40-F42 HydrophobicContact CG1-CD2 3.29Å; V40-F42 HydrophobicContact CG1-CE2 3.92Å; V40-F42 HydrophobicContact CG1-CG 4.14Å; V40-F42 PolarHBondContact O-N 3.43Å; F42-S44 PolarHBondContact O-N 2.83Å; F42-V62 HydrophobicContact CD2-CG2 4.39Å; F42-V62 HydrophobicContact CG-CG2 4.28Å
43	E	55.7	Low	67.5	Low	179 Å²	179	62.6 Å²	62.6	84%	0.836	36%	0.357	S	S	*	.			trans	-71.8	113.1	158.7	-71.8	-178.4	174.7	0	0	107.1	N65	E43-N65 VanDerWaalsContact C-ND2 3.25Å; E43-N65 PolarHBondContact O-ND2 3.03Å
44	S	60.7	Low	68.6	Low	16 Å²	16	63.6 Å²	63.6	11%	0.112	36%	0.355	C	S	.	.			trans	-145.3	135.5	-163.4	152.4	0	0	0	0	110.6	F42 N46 E63 N65	F42-S44 PolarHBondContact O-N 2.83Å; S44-N46 PolarHBondContact OG-O 3.23Å; S44-N46 VanDerWaalsContact OG-O 3.11Å; S44-E63 WeakPolarHBondContact CA-O 3Å; S44-E63 WeakPolarHBondContact CB-O 3.32Å; S44-E63 PolarHBondContact OG-O 3.24Å; S44-N65 PolarHBondContact N-ND2 3.42Å
45	N	67.3	Low	69.8	Low	70 Å²	70	57 Å²	57	37%	0.374	33%	0.33	S	S	.	.	S	Bend	trans	-71.4	-40.6	-177.7	-75.9	-38	0	0	0	113.1	N65	N45-N65 WeakPolarHBondContact CB-OD1 3.3Å; N45-N65 PolarHBondContact N-OD1 2.88Å; N45-N65 PolarHBondContact ND2-OD1 2.82Å; N45-N65 PolarHBondContact OD1-OD1 3.47Å
46	N	79.8	Confident	71.3	Confident	15 Å²	15	57.6 Å²	57.6	8%	0.08	33%	0.327	C	S	.	.			trans	-131.7	130.2	-176	-71.2	-47.3	0	0	0	110.4	Q31 S44 Y48 E63 R77 E225	Q31-N46 PolarHBondContact NE2-OD1 2.89Å; S44-N46 PolarHBondContact OG-O 3.23Å; S44-N46 VanDerWaalsContact OG-O 3.11Å; N46-Y48 HydrophobicContact CB-CE2 3.63Å; N46-E63 HydrophobicContact CB-CB 4.03Å; N46-E63 WeakPolarHBondContact CB-OE2 3.47Å; N46-E63 PolarHBondContact ND2-OE2 2.87Å; N46-E63 WeakPolarHBondContact O-CB 3.49Å; N46-E63 PolarHBondContact O-N 3.18Å; N46-R77 PolarHBondContact ND2-NH2 3.47Å; N46-E225 PolarHBondContact ND2-OE1 2.64Å
47	K	84.8	Confident	73.1	Confident	8 Å²	8	59.4 Å²	59.4	4%	0.035	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	140.8	-178.7	-66.8	159.1	179.1	177	0	108.9	Q31 K32 V36 E37 A61 V62	Q31-K47 WeakPolarHBondContact CA-O 3.33Å; K32-K47 PolarHBondContact N-O 3.22Å; V36-K47 HydrophobicContact CB-CB 4.27Å; V36-K47 HydrophobicContact CB-CD 4Å; V36-K47 HydrophobicContact CB-CG 4.36Å; V36-K47 HydrophobicContact CG1-CD 4.33Å; V36-K47 HydrophobicContact CG1-CG 4.4Å; V36-K47 HydrophobicContact CG2-CB 4.48Å; E37-K47 IonicContact OE1-NZ 3.01Å; E37-K47 PolarHBondContact OE1-NZ 3.01Å; K47-A61 CarbonylContact C-O 3.52Å; K47-A61 WeakPolarHBondContact CA-O 3.22Å; K47-V62 HydrophobicContact CG-CG1 4.07Å
48	Y	87.9	Confident	74.9	Confident	4 Å²	4	53.6 Å²	53.6	2%	0.016	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	146.4	-175	-51.1	-98.9	0	0	0	110.8	I29 K30 Q31 N46 Y60 A61 F217 D220 F221	I29-Y48 HydrophobicContact CG2-CD1 3.93Å; I29-Y48 HydrophobicContact CG2-CG 4.27Å; K30-Y48 CarbonylContact O-C 3.51Å; K30-Y48 VanDerWaalsContact O-CA 3.26Å; K30-Y48 WeakPolarHBondContact O-CA 3.46Å; Q31-Y48 HydrophobicContact CB-CD1 3.82Å; Q31-Y48 HydrophobicContact CB-CE1 3.84Å; Q31-Y48 HydrophobicContact CG-CD1 4.02Å; Q31-Y48 HydrophobicContact CG-CE1 3.74Å; N46-Y48 HydrophobicContact CB-CE2 3.63Å; Y48-Y60 WeakPolarHBondContact O-CA 3.31Å; Y48-A61 HydrophobicContact CD2-CB 4.45Å; Y48-A61 PolarHBondContact N-O 2.83Å; Y48-A61 PolarHBondContact O-N 2.81Å; Y48-F217 HydrophobicContact CD1-CE1 4.13Å; Y48-F217 AromaticContact CD2-CE1 3.83Å; Y48-F217 HydrophobicContact CD2-CE1 3.83Å; Y48-F217 HydrophobicContact CE1-CE1 4.38Å; Y48-F217 HydrophobicContact CE2-CD1 4.47Å; Y48-F217 HydrophobicContact CE2-CE1 4.13Å; Y48-F217 AromaticContact CG-CE1 3.84Å; Y48-F217 HydrophobicContact CG-CE1 3.84Å; Y48-D220 PolarHBondContact OH-OD2 3.01Å; Y48-F221 WeakPolarHBondContact OH-CE2 3.42Å
49	E	90	Very high	76.8	Confident	7 Å²	7	49.2 Å²	49.2	3%	0.033	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	127.8	166.3	-69	176.7	163.9	0	0	108.5	K30 K32 R51 N57 Y60	K30-E49 PolarHBondContact N-O 2.74Å; K30-E49 PolarHBondContact O-N 2.74Å; K32-E49 HydrophobicContact CD-CG 4.34Å; K32-E49 WeakPolarHBondContact CE-OE1 3.29Å; K32-E49 WeakPolarHBondContact CE-OE2 3.28Å; K32-E49 HydrophobicContact CG-CG 4.13Å; K32-E49 IonicContact NZ-OE1 2.94Å; K32-E49 PolarHBondContact NZ-OE1 3.02Å; K32-E49 IonicContact NZ-OE2 3.63Å; K32-E49 PolarHBondContact NZ-OE2 3.26Å; E49-R51 HydrophobicContact CB-CG 4.4Å; E49-R51 IonicContact OE2-CZ 3.3Å; E49-R51 VanDerWaalsContact OE2-CZ 3.3Å; E49-R51 IonicContact OE2-NE 3.18Å; E49-R51 PolarHBondContact OE2-NE 3.17Å; E49-R51 IonicContact OE2-NH2 2.64Å; E49-R51 PolarHBondContact OE2-NH2 3.22Å; E49-N57 VanDerWaalsContact CD-ND2 3.31Å; E49-N57 PolarHBondContact OE1-ND2 2.85Å; E49-Y60 HydrophobicContact CG-CD1 4.2Å; E49-Y60 HydrophobicContact CG-CE1 4.1Å
50	V	91.6	Very high	78.7	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	122.1	170.2	-171.4	0	0	0	0	107.3	L27 L28 I29 V58 F59	L27-V50 HydrophobicContact CB-CG1 4.32Å; L27-V50 HydrophobicContact CD1-CG1 4.21Å; L27-V50 HydrophobicContact CD2-CG1 4.13Å; L27-V50 HydrophobicContact CG-CG1 4.47Å; L28-V50 CarbonylContact O-C 3.52Å; L28-V50 WeakPolarHBondContact O-CA 3.25Å; I29-V50 HydrophobicContact CG1-CG1 4.43Å; I29-V50 HydrophobicContact CG1-CG2 4.38Å; V50-V58 HydrophobicContact CB-CG2 4.35Å; V50-V58 HydrophobicContact CG1-CG2 4.05Å; V50-V58 VanDerWaalsContact O-CG2 3.28Å; V50-V58 WeakPolarHBondContact O-CG2 3.21Å; V50-V58 PolarHBondContact O-N 2.85Å; V50-F59 HydrophobicContact CB-CB 3.94Å; V50-F59 HydrophobicContact CB-CD2 4.35Å; V50-F59 HydrophobicContact CG1-CD2 4.19Å; V50-F59 HydrophobicContact CG2-CB 4.16Å; V50-F59 PolarHBondContact N-O 2.9Å; V50-F59 PolarHBondContact O-N 3.15Å
51	R	90.5	Very high	80.5	Confident	46 Å²	46	44.7 Å²	44.7	17%	0.174	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	152.4	-173.2	-59.9	-179.5	177.6	-159.9	-3.8	111.4	L27 L28 E49 Q56 N57	L27-R51 CarbonylContact C-O 3.59Å; L27-R51 WeakPolarHBondContact CA-O 3.26Å; L28-R51 HydrophobicContact CB-CB 4.27Å; L28-R51 PolarHBondContact N-O 2.98Å; L28-R51 PolarHBondContact O-N 3.49Å; E49-R51 HydrophobicContact CB-CG 4.4Å; E49-R51 IonicContact OE2-CZ 3.3Å; E49-R51 VanDerWaalsContact OE2-CZ 3.3Å; E49-R51 IonicContact OE2-NE 3.18Å; E49-R51 PolarHBondContact OE2-NE 3.17Å; E49-R51 IonicContact OE2-NH2 2.64Å; E49-R51 PolarHBondContact OE2-NH2 3.22Å; R51-Q56 CarbonylContact C-O 3.45Å; R51-Q56 WeakPolarHBondContact CA-O 3.29Å; R51-Q56 WeakPolarHBondContact CB-O 3.44Å; R51-N57 VanDerWaalsContact CG-OD1 3.24Å; R51-N57 WeakPolarHBondContact CG-OD1 3.35Å; R51-N57 PolarHBondContact NE-OD1 2.73Å
52	N	89.3	Confident	82.1	Confident	6 Å²	6	40.5 Å²	40.5	3%	0.032	20%	0.202	C	C	.	.			trans	-82.2	178.3	165.8	67.9	17	0	0	0	111.5	Y20 M54 G55 Q56 V58	Y20-N52 PolarHBondContact OH-ND2 3.19Å; N52-M54 PolarHBondContact O-N 2.78Å; N52-M54 WeakPolarHBondContact OD1-CA 3.17Å; N52-M54 WeakPolarHBondContact OD1-CB 3.28Å; N52-M54 PolarHBondContact OD1-N 3.3Å; N52-G55 PolarHBondContact O-N 2.92Å; N52-G55 PolarHBondContact OD1-N 2.8Å; N52-G55 VanDerWaalsContact OD1-N 3.16Å; N52-Q56 PolarHBondContact N-O 3.47Å; N52-Q56 PolarHBondContact ND2-OE1 2.77Å; N52-Q56 PolarHBondContact OD1-N 2.87Å; N52-V58 HydrophobicContact CB-CG1 3.99Å
53	V	82.4	Confident	83.8	Confident	60 Å²	60	36.9 Å²	36.9	36%	0.364	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-20.8	177.5	-61.4	0	0	0	0	114.3	Q26 G55	Q26-V53 HydrophobicContact CB-CG1 3.62Å; Q26-V53 HydrophobicContact CG-CG1 3.74Å; V53-G55 PolarHBondContact O-N 3.43Å
54	M	82.4	Confident	85.1	Confident	143 Å²	143	32.9 Å²	32.9	70%	0.704	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82	-0.4	174.2	-59.6	-179.8	65	0	0	112.4	N52 Q56	N52-M54 PolarHBondContact O-N 2.78Å; N52-M54 WeakPolarHBondContact OD1-CA 3.17Å; N52-M54 WeakPolarHBondContact OD1-CB 3.28Å; N52-M54 PolarHBondContact OD1-N 3.3Å; M54-Q56 VanDerWaalsContact C-N 3.27Å; M54-Q56 HydrophobicContact CB-CG 4.28Å; M54-Q56 PolarHBondContact O-N 2.87Å
55	G	81.5	Confident	85.2	Confident	21 Å²	21	35 Å²	35	22%	0.216	18%	0.178	C	C	.	.	S	Bend	trans	77	9.4	-178.2	0	0	0	0	0	114.3	N52 V53	N52-G55 PolarHBondContact O-N 2.92Å; N52-G55 PolarHBondContact OD1-N 2.8Å; N52-G55 VanDerWaalsContact OD1-N 3.16Å; V53-G55 PolarHBondContact O-N 3.43Å
56	Q	84.6	Confident	84.6	Confident	105 Å²	105	36.3 Å²	36.3	49%	0.491	19%	0.185	S	C	.	.			trans	-79.3	136.1	175.7	-59.5	172.5	-39.8	0	0	109.6	R51 N52 M54 V58	R51-Q56 CarbonylContact C-O 3.45Å; R51-Q56 WeakPolarHBondContact CA-O 3.29Å; R51-Q56 WeakPolarHBondContact CB-O 3.44Å; N52-Q56 PolarHBondContact N-O 3.47Å; N52-Q56 PolarHBondContact ND2-OE1 2.77Å; N52-Q56 PolarHBondContact OD1-N 2.87Å; M54-Q56 VanDerWaalsContact C-N 3.27Å; M54-Q56 HydrophobicContact CB-CG 4.28Å; M54-Q56 PolarHBondContact O-N 2.87Å; Q56-V58 PolarHBondContact O-N 2.72Å
57	N	87.2	Confident	83.1	Confident	39 Å²	39	41.8 Å²	41.8	21%	0.209	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	126	171.8	-68.4	-2.8	0	0	0	109.3	E49 R51 Y60	E49-N57 VanDerWaalsContact CD-ND2 3.31Å; E49-N57 PolarHBondContact OE1-ND2 2.85Å; R51-N57 VanDerWaalsContact CG-OD1 3.24Å; R51-N57 WeakPolarHBondContact CG-OD1 3.35Å; R51-N57 PolarHBondContact NE-OD1 2.73Å; N57-Y60 PolarHBondContact ND2-OH 2.91Å
58	V	91.3	Very high	81.4	Confident	8 Å²	8	48.5 Å²	48.5	5%	0.048	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	-36.3	179.8	-59.9	0	0	0	0	110.6	Y20 L27 V50 N52 Q56	Y20-V58 HydrophobicContact CD1-CB 3.96Å; Y20-V58 HydrophobicContact CD1-CG1 4.05Å; Y20-V58 HydrophobicContact CD1-CG2 4.35Å; Y20-V58 HydrophobicContact CE1-CB 3.68Å; Y20-V58 HydrophobicContact CE1-CG1 3.26Å; Y20-V58 HydrophobicContact CE1-CG2 4.13Å; Y20-V58 HydrophobicContact CE2-CG1 4.1Å; Y20-V58 VanDerWaalsContact OH-CG1 3.31Å; Y20-V58 WeakPolarHBondContact OH-CG1 3.27Å; L27-V58 HydrophobicContact CD2-CG2 4.02Å; V50-V58 HydrophobicContact CB-CG2 4.35Å; V50-V58 HydrophobicContact CG1-CG2 4.05Å; V50-V58 VanDerWaalsContact O-CG2 3.28Å; V50-V58 WeakPolarHBondContact O-CG2 3.21Å; V50-V58 PolarHBondContact O-N 2.85Å; N52-V58 HydrophobicContact CB-CG1 3.99Å; Q56-V58 PolarHBondContact O-N 2.72Å
59	F	93.2	Very high	79.6	Confident	8 Å²	8	49 Å²	49	4%	0.035	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	164.6	173.6	-48.6	-59.8	0	0	0	110.9	Y20 L21 V50 V83 L84 I91	Y20-F59 HydrophobicContact CD1-CZ 4.49Å; L21-F59 HydrophobicContact CD2-CE2 3.85Å; L21-F59 HydrophobicContact CD2-CZ 4.47Å; L21-F59 HydrophobicContact CG-CE2 4.33Å; V50-F59 HydrophobicContact CB-CB 3.94Å; V50-F59 HydrophobicContact CB-CD2 4.35Å; V50-F59 HydrophobicContact CG1-CD2 4.19Å; V50-F59 HydrophobicContact CG2-CB 4.16Å; V50-F59 PolarHBondContact N-O 2.9Å; V50-F59 PolarHBondContact O-N 3.15Å; F59-V83 HydrophobicContact CB-CG1 3.66Å; F59-V83 HydrophobicContact CG-CG1 4.13Å; F59-L84 CarbonylContact C-O 3.54Å; F59-L84 VanDerWaalsContact CA-O 3.27Å; F59-L84 WeakPolarHBondContact CA-O 3.44Å; F59-L84 WeakPolarHBondContact CB-O 3.5Å; F59-I91 HydrophobicContact CD1-CD1 3.25Å; F59-I91 HydrophobicContact CD1-CG1 4.47Å; F59-I91 HydrophobicContact CD2-CD1 4.45Å; F59-I91 HydrophobicContact CE1-CD1 3.15Å; F59-I91 HydrophobicContact CE2-CD1 4.36Å; F59-I91 HydrophobicContact CG-CD1 3.93Å; F59-I91 HydrophobicContact CZ-CD1 3.74Å
60	Y	92.1	Very high	77.7	Confident	39 Å²	39	53 Å²	53	15%	0.153	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	149.3	166.8	-64.1	-86	0	0	0	108.5	V36 Y48 E49 N57 V83 L84 N86	V36-Y60 HydrophobicContact CG2-CD1 4.08Å; V36-Y60 HydrophobicContact CG2-CE1 4.4Å; Y48-Y60 WeakPolarHBondContact O-CA 3.31Å; E49-Y60 HydrophobicContact CG-CD1 4.2Å; E49-Y60 HydrophobicContact CG-CE1 4.1Å; N57-Y60 PolarHBondContact ND2-OH 2.91Å; Y60-V83 CarbonylContact O-C 3.53Å; Y60-V83 WeakPolarHBondContact O-CA 3.42Å; Y60-V83 WeakPolarHBondContact O-CG1 3.44Å; Y60-L84 PolarHBondContact N-O 2.9Å; Y60-L84 PolarHBondContact O-N 3.36Å; Y60-N86 WeakPolarHBondContact CE2-OD1 3.47Å
61	A	91.9	Very high	75.6	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	136.1	169.7	0	0	0	0	0	110.3	K47 Y48 I81 H82 V83 F217	K47-A61 CarbonylContact C-O 3.52Å; K47-A61 WeakPolarHBondContact CA-O 3.22Å; Y48-A61 HydrophobicContact CD2-CB 4.45Å; Y48-A61 PolarHBondContact N-O 2.83Å; Y48-A61 PolarHBondContact O-N 2.81Å; A61-I81 HydrophobicContact CB-CG2 3.83Å; A61-H82 CarbonylContact C-O 3.57Å; A61-H82 VanDerWaalsContact CA-O 3.26Å; A61-H82 WeakPolarHBondContact CA-O 3.42Å; A61-V83 HydrophobicContact CB-CG2 4.12Å; A61-F217 HydrophobicContact CB-CE1 4.32Å; A61-F217 HydrophobicContact CB-CE2 4.16Å; A61-F217 HydrophobicContact CB-CZ 3.5Å
62	V	89.1	Confident	73.6	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	130.1	-178.4	-61.2	0	0	0	0	110	V36 V40 F42 K47 I81 H82 L84	V36-V62 HydrophobicContact CG1-CG1 3.99Å; V40-V62 HydrophobicContact CG1-CB 4.5Å; V40-V62 HydrophobicContact CG1-CG1 3.79Å; V40-V62 HydrophobicContact CG1-CG2 4.05Å; F42-V62 HydrophobicContact CD2-CG2 4.39Å; F42-V62 HydrophobicContact CG-CG2 4.28Å; K47-V62 HydrophobicContact CG-CG1 4.07Å; V62-I81 CarbonylContact O-C 3.57Å; V62-I81 WeakPolarHBondContact O-CA 3.42Å; V62-H82 HydrophobicContact CG2-CB 3.98Å; V62-H82 PolarHBondContact N-O 3.23Å; V62-H82 PolarHBondContact O-N 3.16Å; V62-L84 HydrophobicContact CG2-CD1 4.36Å
63	E	87.1	Confident	71.9	Confident	1 Å²	1	64.8 Å²	64.8	1%	0.005	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	126.5	172	-171.9	-161.2	136	0	0	109.9	S44 N46 R77 F79 N80 I81 F221	S44-E63 WeakPolarHBondContact CA-O 3Å; S44-E63 WeakPolarHBondContact CB-O 3.32Å; S44-E63 PolarHBondContact OG-O 3.24Å; N46-E63 HydrophobicContact CB-CB 4.03Å; N46-E63 WeakPolarHBondContact CB-OE2 3.47Å; N46-E63 PolarHBondContact ND2-OE2 2.87Å; N46-E63 WeakPolarHBondContact O-CB 3.49Å; N46-E63 PolarHBondContact O-N 3.18Å; E63-R77 IonicContact OE1-CZ 3.55Å; E63-R77 VanDerWaalsContact OE1-CZ 3.22Å; E63-R77 IonicContact OE1-NH1 3.96Å; E63-R77 PolarHBondContact OE1-NH1 2.95Å; E63-R77 IonicContact OE1-NH2 3.69Å; E63-R77 PolarHBondContact OE1-NH2 3.2Å; E63-R77 IonicContact OE2-CZ 2.8Å; E63-R77 IonicContact OE2-NH1 3.84Å; E63-R77 IonicContact OE2-NH2 2.69Å; E63-R77 PolarHBondContact OE2-NH2 2.75Å; E63-F79 HydrophobicContact CG-CB 4.33Å; E63-N80 CarbonylContact C-O 3.59Å; E63-N80 WeakPolarHBondContact CA-O 3.26Å; E63-I81 HydrophobicContact CB-CG1 4.28Å; E63-I81 HydrophobicContact CG-CG1 4.39Å; E63-F221 HydrophobicContact CG-CZ 4.35Å; E63-F221 WeakPolarHBondContact OE2-CE1 3.39Å; E63-F221 VanDerWaalsContact OE2-CZ 3.28Å; E63-F221 WeakPolarHBondContact OE2-CZ 2.89Å
64	E	81.7	Confident	71.1	Confident	94 Å²	94	62.9 Å²	62.9	44%	0.439	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	134.3	172.5	-170.4	-179.8	-160.2	0	0	111.1	N80 H82	E64-N80 HydrophobicContact CB-CB 4.23Å; E64-N80 PolarHBondContact N-O 3.29Å; E64-N80 PolarHBondContact OE2-ND2 2.78Å; E64-H82 IonicContact OE2-CE1 3.66Å; E64-H82 IonicContact OE2-NE2 2.76Å; E64-H82 PolarHBondContact OE2-NE2 2.86Å
65	N	63.9	Low	70.2	Confident	62 Å²	62	58.8 Å²	58.8	33%	0.332	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-75.3	131.4	-176.1	-75.5	-18.8	0	0	0	112.9	E43 S44 N45	E43-N65 VanDerWaalsContact C-ND2 3.25Å; E43-N65 PolarHBondContact O-ND2 3.03Å; S44-N65 PolarHBondContact N-ND2 3.42Å; N45-N65 WeakPolarHBondContact CB-OD1 3.3Å; N45-N65 PolarHBondContact N-OD1 2.88Å; N45-N65 PolarHBondContact ND2-OD1 2.82Å; N45-N65 PolarHBondContact OD1-OD1 3.47Å
66	D	54.4	Low	69.5	Low	96 Å²	96	60.9 Å²	60.9	51%	0.513	33%	0.327	S	S	.	.			trans	-119.8	104.1	153.4	-170.7	22	0	0	0	109.3	L68 S69	D66-L68 PolarHBondContact O-N 2.8Å; D66-S69 PolarHBondContact O-N 2.8Å; D66-S69 PolarHBondContact O-OG 3.48Å
67	C	47.8	Very low	69	Low	130 Å²	130	56.2 Å²	56.2	88%	0.878	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-10.4	-167.5	-165.8	0	0	0	0	114.2
68	L	48.6	Very low	68.8	Low	150 Å²	150	55.8 Å²	55.8	79%	0.785	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.6	-7.6	-170.3	-77.8	156.7	0	0	0	115.5	D66	D66-L68 PolarHBondContact O-N 2.8Å
69	S	50.7	Low	68.6	Low	13 Å²	13	55.9 Å²	55.9	9%	0.091	30%	0.304	C	S	.	.	S	Bend	trans	-96.8	-21.5	-169.4	64.8	0	0	0	0	115.7	D66 Q71 C72 C73	D66-S69 PolarHBondContact O-N 2.8Å; D66-S69 PolarHBondContact O-OG 3.48Å; S69-Q71 PolarHBondContact O-N 2.95Å; S69-C72 PolarHBondContact O-N 2.99Å; S69-C73 PolarHBondContact O-N 3.41Å
70	R	50.2	Low	68.5	Low	92 Å²	92	57.2 Å²	57.2	35%	0.347	31%	0.312	S	S	.	.	H	α-helix	trans	-66.7	-35.7	-178.2	-108	-176.1	175.9	166	-0.8	113.5	C72 E225	R70-C72 VanDerWaalsContact C-N 3.26Å; R70-C72 PolarHBondContact O-N 3.37Å; R70-E225 IonicContact CZ-OE1 2.85Å; R70-E225 IonicContact NE-OE1 2.7Å; R70-E225 IonicContact NH2-OE1 3.97Å; R70-E225 PolarHBondContact NH2-OE1 3.25Å
71	Q	47	Very low	68.5	Low	193 Å²	193	55.4 Å²	55.4	90%	0.902	30%	0.304	S	S	*	.	H	α-helix	trans	-73.8	-14.8	-175.6	-146	83.5	-25	0	0	113.6	S69	S69-Q71 PolarHBondContact O-N 2.95Å
72	C	48.6	Very low	68.6	Low	87 Å²	87	56 Å²	56	59%	0.588	31%	0.308	S	S	*	.	H	α-helix	trans	-113.2	-33.6	-172.9	-130.3	0	0	0	0	113.8	S69 R70 M101	S69-C72 PolarHBondContact O-N 2.99Å; R70-C72 VanDerWaalsContact C-N 3.26Å; R70-C72 PolarHBondContact O-N 3.37Å; C72-M101 HydrophobicContact CB-CE 4Å; C72-M101 HydrophobicContact CB-SD 4.1Å; C72-M101 WeakPolarHBondContact SG-CE 3.35Å
73	C	54.1	Low	68.8	Low	19 Å²	19	56 Å²	56	13%	0.128	31%	0.308	C	S	.	.	H	α-helix	trans	-117.9	-8.5	-164.4	-52.1	0	0	0	0	116.2	S69 L76 R77 M101	S69-C73 PolarHBondContact O-N 3.41Å; C73-L76 WeakPolarHBondContact O-CA 3.25Å; C73-L76 WeakPolarHBondContact O-CB 3.41Å; C73-L76 PolarHBondContact O-N 3.37Å; C73-R77 HydrophobicContact CB-CB 4.2Å; C73-M101 HydrophobicContact CB-SD 4.23Å; C73-M101 PolarHBondContact SG-SD 2.8Å
74	G	65.4	Low	69.1	Low	21 Å²	21	56.2 Å²	56.2	22%	0.216	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	46.6	-129	-176.8	0	0	0	0	0	113	L76 R77	G74-L76 PolarHBondContact O-N 3.26Å; G74-L76 VanDerWaalsContact O-N 3.12Å; G74-R77 WeakPolarHBondContact O-CB 3.35Å; G74-R77 WeakPolarHBondContact O-CG 3.42Å; G74-R77 PolarHBondContact O-N 3.15Å
75	P	63.1	Low	69.5	Low	57 Å²	57	53.1 Å²	53.1	37%	0.37	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-68.5	-6.9	-179.7	29.3	-35.5	0	0	0	114.2	R77 R96 F221	P75-R77 VanDerWaalsContact C-N 3.35Å; P75-R96 VanDerWaalsContact O-CZ 3.27Å; P75-R96 PolarHBondContact O-NH1 2.91Å; P75-R96 PolarHBondContact O-NH2 3.43Å; P75-F221 WeakPolarHBondContact CB-O 3.33Å
76	L	66.9	Low	70.5	Confident	64 Å²	64	54.5 Å²	54.5	34%	0.335	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-90.9	5.3	176.9	-60.5	174.9	0	0	0	113.6	C73 G74	C73-L76 WeakPolarHBondContact O-CA 3.25Å; C73-L76 WeakPolarHBondContact O-CB 3.41Å; C73-L76 PolarHBondContact O-N 3.37Å; G74-L76 PolarHBondContact O-N 3.26Å; G74-L76 VanDerWaalsContact O-N 3.12Å
77	R	75.4	Confident	72.1	Confident	7 Å²	7	58 Å²	58	3%	0.026	31%	0.313	C	S	.	.			trans	-64.6	148.2	-178.9	70.7	-169.7	-171.7	95.2	-16.2	112.7	N46 E63 C73 G74 P75 R96 E225	N46-R77 PolarHBondContact ND2-NH2 3.47Å; E63-R77 IonicContact OE1-CZ 3.55Å; E63-R77 VanDerWaalsContact OE1-CZ 3.22Å; E63-R77 IonicContact OE1-NH1 3.96Å; E63-R77 PolarHBondContact OE1-NH1 2.95Å; E63-R77 IonicContact OE1-NH2 3.69Å; E63-R77 PolarHBondContact OE1-NH2 3.2Å; E63-R77 IonicContact OE2-CZ 2.8Å; E63-R77 IonicContact OE2-NH1 3.84Å; E63-R77 IonicContact OE2-NH2 2.69Å; E63-R77 PolarHBondContact OE2-NH2 2.75Å; C73-R77 HydrophobicContact CB-CB 4.2Å; G74-R77 WeakPolarHBondContact O-CB 3.35Å; G74-R77 WeakPolarHBondContact O-CG 3.42Å; G74-R77 PolarHBondContact O-N 3.15Å; P75-R77 VanDerWaalsContact C-N 3.35Å; R77-R96 PolarHBondContact O-NH1 2.97Å; R77-E225 IonicContact CZ-OE1 3.42Å; R77-E225 IonicContact CZ-OE2 2.8Å; R77-E225 IonicContact NE-OE1 3.74Å; R77-E225 IonicContact NE-OE2 2.8Å; R77-E225 PolarHBondContact NE-OE2 3.35Å; R77-E225 VanDerWaalsContact NE-OE2 3.08Å; R77-E225 IonicContact NH2-OE1 3.98Å; R77-E225 PolarHBondContact NH2-OE1 2.96Å; R77-E225 IonicContact NH2-OE2 3.32Å; R77-E225 PolarHBondContact NH2-OE2 2.93Å
78	P	83.3	Confident	73.8	Confident	30 Å²	30	54 Å²	54	20%	0.195	29%	0.293	C	S	.	.			trans	-66.3	153	165.8	31.5	-33.8	0	0	0	109.2	R96 L98	P78-R96 VanDerWaalsContact CA-O 3.24Å; P78-R96 WeakPolarHBondContact CA-O 3.38Å; P78-R96 WeakPolarHBondContact CB-O 3.43Å; P78-L98 HydrophobicContact CB-CB 4.16Å; P78-L98 HydrophobicContact CG-CB 4.11Å; P78-L98 HydrophobicContact CG-CD1 4.27Å
79	F	86.1	Confident	75.7	Confident	10 Å²	10	53 Å²	53	4%	0.044	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	154.3	169.3	60.6	-108.1	0	0	0	110	E63 I81 V94 R96 L112 F221	E63-F79 HydrophobicContact CG-CB 4.33Å; F79-I81 HydrophobicContact CD2-CD1 3.82Å; F79-I81 HydrophobicContact CD2-CG1 3.86Å; F79-I81 HydrophobicContact CE2-CD1 3.78Å; F79-I81 HydrophobicContact CE2-CG1 4.25Å; F79-V94 HydrophobicContact CE2-CG1 4.26Å; F79-R96 HydrophobicContact CD1-CB 4.01Å; F79-R96 HydrophobicContact CD1-CG 4.44Å; F79-R96 HydrophobicContact CD2-CB 4.04Å; F79-R96 HydrophobicContact CE1-CB 3.87Å; F79-R96 HydrophobicContact CE1-CG 4.17Å; F79-R96 HydrophobicContact CE2-CB 3.88Å; F79-R96 HydrophobicContact CG-CB 4.1Å; F79-R96 HydrophobicContact CZ-CB 3.8Å; F79-R96 HydrophobicContact CZ-CG 4.43Å; F79-R96 PolarHBondContact N-O 3.16Å; F79-R96 PolarHBondContact O-N 3.23Å; F79-L112 HydrophobicContact CE2-CD1 3.68Å; F79-L112 HydrophobicContact CZ-CD1 3.63Å; F79-F221 HydrophobicContact CB-CE1 3.97Å; F79-F221 HydrophobicContact CD1-CB 4.38Å; F79-F221 AromaticContact CD1-CD1 3.33Å; F79-F221 HydrophobicContact CD1-CD1 3.33Å; F79-F221 AromaticContact CD1-CE1 3.51Å; F79-F221 HydrophobicContact CD1-CE1 3.51Å; F79-F221 AromaticContact CD1-CG 3.86Å; F79-F221 HydrophobicContact CD1-CG 3.86Å; F79-F221 HydrophobicContact CD1-CZ 4.23Å; F79-F221 HydrophobicContact CE1-CB 3.76Å; F79-F221 AromaticContact CE1-CD1 3.56Å; F79-F221 HydrophobicContact CE1-CD1 3.56Å; F79-F221 HydrophobicContact CE1-CD2 4.13Å; F79-F221 HydrophobicContact CE1-CE1 4.07Å; F79-F221 AromaticContact CE1-CG 3.56Å; F79-F221 HydrophobicContact CE1-CG 3.56Å; F79-F221 HydrophobicContact CG-CD1 4.11Å; F79-F221 AromaticContact CG-CE1 3.81Å; F79-F221 HydrophobicContact CG-CE1 3.81Å; F79-F221 HydrophobicContact CG-CZ 4.25Å; F79-F221 HydrophobicContact CZ-CD2 4.4Å; F79-F221 HydrophobicContact CZ-CG 4.25Å
80	N	90.3	Very high	77.7	Confident	37 Å²	37	55.1 Å²	55.1	20%	0.198	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	126.1	167.5	-168.1	-1	0	0	0	107.6	E63 E64 H82 S93 V94	E63-N80 CarbonylContact C-O 3.59Å; E63-N80 WeakPolarHBondContact CA-O 3.26Å; E64-N80 HydrophobicContact CB-CB 4.23Å; E64-N80 PolarHBondContact N-O 3.29Å; E64-N80 PolarHBondContact OE2-ND2 2.78Å; N80-H82 PolarHBondContact ND2-CE1 2.89Å; N80-S93 PolarHBondContact OD1-OG 2.53Å; N80-V94 CarbonylContact C-O 3.54Å; N80-V94 WeakPolarHBondContact CA-O 3.46Å; N80-V94 PolarHBondContact OD1-O 2.76Å
81	I	92.6	Very high	79.8	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	123.8	177.2	-65.3	169.9	0	0	0	108.3	A61 V62 E63 F79 V94 F217 F221	A61-I81 HydrophobicContact CB-CG2 3.83Å; V62-I81 CarbonylContact O-C 3.57Å; V62-I81 WeakPolarHBondContact O-CA 3.42Å; E63-I81 HydrophobicContact CB-CG1 4.28Å; E63-I81 HydrophobicContact CG-CG1 4.39Å; F79-I81 HydrophobicContact CD2-CD1 3.82Å; F79-I81 HydrophobicContact CD2-CG1 3.86Å; F79-I81 HydrophobicContact CE2-CD1 3.78Å; F79-I81 HydrophobicContact CE2-CG1 4.25Å; I81-V94 HydrophobicContact CB-CB 4.19Å; I81-V94 PolarHBondContact N-O 2.82Å; I81-V94 PolarHBondContact O-N 3.07Å; I81-F217 HydrophobicContact CD1-CB 3.69Å; I81-F217 HydrophobicContact CD1-CD1 3.76Å; I81-F217 HydrophobicContact CD1-CD2 4.02Å; I81-F217 HydrophobicContact CD1-CE1 4.4Å; I81-F217 HydrophobicContact CD1-CG 3.56Å; I81-F217 HydrophobicContact CG2-CD2 4.25Å; I81-F217 HydrophobicContact CG2-CE2 3.97Å; I81-F217 HydrophobicContact CG2-CZ 4.2Å; I81-F221 HydrophobicContact CD1-CE2 3.74Å; I81-F221 HydrophobicContact CD1-CZ 3.94Å
82	H	93.6	Very high	82.2	Confident	14 Å²	14	41.7 Å²	41.7	7%	0.065	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	118.2	175.4	-54	-78.4	0	0	0	109	A61 V62 E64 N80 L84 E90	A61-H82 CarbonylContact C-O 3.57Å; A61-H82 VanDerWaalsContact CA-O 3.26Å; A61-H82 WeakPolarHBondContact CA-O 3.42Å; V62-H82 HydrophobicContact CG2-CB 3.98Å; V62-H82 PolarHBondContact N-O 3.23Å; V62-H82 PolarHBondContact O-N 3.16Å; E64-H82 IonicContact OE2-CE1 3.66Å; E64-H82 IonicContact OE2-NE2 2.76Å; E64-H82 PolarHBondContact OE2-NE2 2.86Å; N80-H82 PolarHBondContact ND2-CE1 2.89Å; H82-L84 HydrophobicContact CB-CD2 4.25Å; H82-E90 HydrophobicContact CB-CG 4.22Å; H82-E90 IonicContact CE1-OE1 2.79Å; H82-E90 IonicContact CG-OE1 2.64Å; H82-E90 VanDerWaalsContact ND1-CD 3.29Å; H82-E90 IonicContact ND1-OE1 3.33Å; H82-E90 PolarHBondContact ND1-OE1 3.49Å; H82-E90 IonicContact ND1-OE2 3.61Å
83	V	94.4	Very high	84.5	Confident	0 Å²	0	38 Å²	38	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	121.7	171.7	-171.1	0	0	0	0	108.4	F59 Y60 A61 I91 I92 F217	F59-V83 HydrophobicContact CB-CG1 3.66Å; F59-V83 HydrophobicContact CG-CG1 4.13Å; Y60-V83 CarbonylContact O-C 3.53Å; Y60-V83 WeakPolarHBondContact O-CA 3.42Å; Y60-V83 WeakPolarHBondContact O-CG1 3.44Å; A61-V83 HydrophobicContact CB-CG2 4.12Å; V83-I91 HydrophobicContact CB-CG1 4.49Å; V83-I91 HydrophobicContact CG1-CD1 4.37Å; V83-I91 HydrophobicContact CG1-CG1 4.31Å; V83-I91 VanDerWaalsContact O-CG1 3.25Å; V83-I91 WeakPolarHBondContact O-CG1 3.38Å; V83-I91 PolarHBondContact O-N 2.83Å; V83-I92 HydrophobicContact CB-CB 3.83Å; V83-I92 HydrophobicContact CB-CG1 4.47Å; V83-I92 HydrophobicContact CG1-CD1 4.49Å; V83-I92 HydrophobicContact CG2-CB 3.94Å; V83-I92 HydrophobicContact CG2-CG2 4.41Å; V83-I92 PolarHBondContact N-O 2.8Å; V83-I92 PolarHBondContact O-N 2.87Å; V83-F217 HydrophobicContact CG2-CE2 4.39Å
84	L	92.8	Very high	86.5	Confident	5 Å²	5	37 Å²	37	3%	0.026	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	145.5	-175.6	-47.6	176.6	0	0	0	110.2	V40 F59 Y60 V62 H82 Q89 E90	V40-L84 HydrophobicContact CB-CD1 4.28Å; V40-L84 HydrophobicContact CG1-CD1 3.35Å; V40-L84 HydrophobicContact CG2-CD1 3.87Å; F59-L84 CarbonylContact C-O 3.54Å; F59-L84 VanDerWaalsContact CA-O 3.27Å; F59-L84 WeakPolarHBondContact CA-O 3.44Å; F59-L84 WeakPolarHBondContact CB-O 3.5Å; Y60-L84 PolarHBondContact N-O 2.9Å; Y60-L84 PolarHBondContact O-N 3.36Å; V62-L84 HydrophobicContact CG2-CD1 4.36Å; H82-L84 HydrophobicContact CB-CD2 4.25Å; L84-Q89 CarbonylContact C-O 3.58Å; L84-Q89 VanDerWaalsContact CA-O 3.26Å; L84-Q89 WeakPolarHBondContact CA-O 3.5Å; L84-E90 HydrophobicContact CD2-CB 3.74Å; L84-E90 HydrophobicContact CD2-CG 4.1Å
85	D	90.4	Very high	87.8	Confident	28 Å²	28	38.2 Å²	38.2	15%	0.15	21%	0.206	C	C	.	.			trans	-74.7	-179.1	166.6	75.7	5.1	0	0	0	112.3	F87 G88 Q89 I91	D85-F87 PolarHBondContact O-N 2.87Å; D85-F87 VanDerWaalsContact OD1-CA 3.28Å; D85-F87 WeakPolarHBondContact OD1-CA 3.48Å; D85-F87 WeakPolarHBondContact OD1-CB 3.23Å; D85-F87 PolarHBondContact OD1-N 2.72Å; D85-G88 PolarHBondContact O-N 2.82Å; D85-G88 VanDerWaalsContact O-N 3.11Å; D85-G88 PolarHBondContact OD1-N 2.78Å; D85-Q89 PolarHBondContact N-O 3.42Å; D85-Q89 PolarHBondContact OD1-N 3.11Å; D85-I91 HydrophobicContact CB-CG2 4.16Å
86	N	85.8	Confident	89.2	Confident	92 Å²	92	35.6 Å²	35.6	49%	0.492	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-7.6	178.6	-70.6	-44.9	0	0	0	114.1	Y60	Y60-N86 WeakPolarHBondContact CE2-OD1 3.47Å
87	F	86.2	Confident	90	Very high	170 Å²	170	35.4 Å²	35.4	75%	0.746	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.5	-0.4	174.4	-57.2	-75.7	0	0	0	112.3	A5 D85 Q89	A5-F87 HydrophobicContact CB-CZ 4.29Å; D85-F87 PolarHBondContact O-N 2.87Å; D85-F87 VanDerWaalsContact OD1-CA 3.28Å; D85-F87 WeakPolarHBondContact OD1-CA 3.48Å; D85-F87 WeakPolarHBondContact OD1-CB 3.23Å; D85-F87 PolarHBondContact OD1-N 2.72Å; F87-Q89 VanDerWaalsContact C-N 3.31Å
88	G	84.1	Confident	89.7	Confident	44 Å²	44	40.1 Å²	40.1	45%	0.454	22%	0.217	S	C	.	.	S	Bend	trans	79.9	11.6	-177	0	0	0	0	0	113.6	D85	D85-G88 PolarHBondContact O-N 2.82Å; D85-G88 VanDerWaalsContact O-N 3.11Å; D85-G88 PolarHBondContact OD1-N 2.78Å
89	Q	89.2	Confident	88.9	Confident	129 Å²	129	41.3 Å²	41.3	60%	0.603	22%	0.219	S	C	*	.			trans	-80.9	130.7	173.9	-179.5	172.9	-0.4	0	0	109.9	L84 D85 F87 I91	L84-Q89 CarbonylContact C-O 3.58Å; L84-Q89 VanDerWaalsContact CA-O 3.26Å; L84-Q89 WeakPolarHBondContact CA-O 3.5Å; D85-Q89 PolarHBondContact N-O 3.42Å; D85-Q89 PolarHBondContact OD1-N 3.11Å; F87-Q89 VanDerWaalsContact C-N 3.31Å; Q89-I91 PolarHBondContact O-N 2.91Å
90	E	91.7	Very high	87.3	Confident	58 Å²	58	45 Å²	45	27%	0.271	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	124.9	174.4	-168.1	-176.2	175	0	0	111.2	H82 L84 S93 P118	H82-E90 HydrophobicContact CB-CG 4.22Å; H82-E90 IonicContact CE1-OE1 2.79Å; H82-E90 IonicContact CG-OE1 2.64Å; H82-E90 VanDerWaalsContact ND1-CD 3.29Å; H82-E90 IonicContact ND1-OE1 3.33Å; H82-E90 PolarHBondContact ND1-OE1 3.49Å; H82-E90 IonicContact ND1-OE2 3.61Å; L84-E90 HydrophobicContact CD2-CB 3.74Å; L84-E90 HydrophobicContact CD2-CG 4.1Å; E90-S93 WeakPolarHBondContact OE1-CB 3.46Å; E90-P118 HydrophobicContact CB-CG 4.11Å; E90-P118 HydrophobicContact CG-CG 3.53Å; E90-P118 WeakPolarHBondContact OE1-CG 3.4Å
91	I	94.9	Very high	85.4	Confident	4 Å²	4	48.4 Å²	48.4	2%	0.021	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	-29.8	-176.9	56.4	160.7	0	0	0	112.9	F59 V83 D85 Q89 A116	F59-I91 HydrophobicContact CD1-CD1 3.25Å; F59-I91 HydrophobicContact CD1-CG1 4.47Å; F59-I91 HydrophobicContact CD2-CD1 4.45Å; F59-I91 HydrophobicContact CE1-CD1 3.15Å; F59-I91 HydrophobicContact CE2-CD1 4.36Å; F59-I91 HydrophobicContact CG-CD1 3.93Å; F59-I91 HydrophobicContact CZ-CD1 3.74Å; V83-I91 HydrophobicContact CB-CG1 4.49Å; V83-I91 HydrophobicContact CG1-CD1 4.37Å; V83-I91 HydrophobicContact CG1-CG1 4.31Å; V83-I91 VanDerWaalsContact O-CG1 3.25Å; V83-I91 WeakPolarHBondContact O-CG1 3.38Å; V83-I91 PolarHBondContact O-N 2.83Å; D85-I91 HydrophobicContact CB-CG2 4.16Å; Q89-I91 PolarHBondContact O-N 2.91Å; I91-A116 WeakPolarHBondContact O-CA 3.01Å
92	I	97.1	Very high	83.1	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	131.4	176.3	-52.1	166.8	0	0	0	108	L18 V83 V94 V114 Q115 A116 A210 I213	L18-I92 HydrophobicContact CD2-CD1 3.73Å; L18-I92 HydrophobicContact CD2-CG1 3.67Å; V83-I92 HydrophobicContact CB-CB 3.83Å; V83-I92 HydrophobicContact CB-CG1 4.47Å; V83-I92 HydrophobicContact CG1-CD1 4.49Å; V83-I92 HydrophobicContact CG2-CB 3.94Å; V83-I92 HydrophobicContact CG2-CG2 4.41Å; V83-I92 PolarHBondContact N-O 2.8Å; V83-I92 PolarHBondContact O-N 2.87Å; I92-V94 HydrophobicContact CG2-CG2 3.98Å; I92-V114 HydrophobicContact CG2-CG1 3.5Å; I92-V114 VanDerWaalsContact CG2-CG1 3.5Å; I92-Q115 CarbonylContact C-O 3.55Å; I92-Q115 VanDerWaalsContact CA-O 3.24Å; I92-Q115 WeakPolarHBondContact CA-O 3.43Å; I92-Q115 WeakPolarHBondContact CG2-O 3.24Å; I92-A116 HydrophobicContact CG1-CB 4.16Å; I92-A210 HydrophobicContact CD1-CB 3.87Å; I92-A210 HydrophobicContact CG1-CB 4.44Å; I92-I213 HydrophobicContact CD1-CD1 4.16Å
93	S	96.3	Very high	80.9	Confident	8 Å²	8	55.7 Å²	55.7	6%	0.056	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	131.5	167.8	-177.4	0	0	0	0	109.1	N80 E90 V114 Q115	N80-S93 PolarHBondContact OD1-OG 2.53Å; E90-S93 WeakPolarHBondContact OE1-CB 3.46Å; S93-V114 WeakPolarHBondContact O-CA 3.47Å; S93-Q115 PolarHBondContact N-O 2.84Å; S93-Q115 PolarHBondContact O-N 3.18Å
94	V	96.5	Very high	78.5	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	111.7	180	179.3	0	0	0	0	108.6	F79 N80 I81 I92 L112 E113 V114	F79-V94 HydrophobicContact CE2-CG1 4.26Å; N80-V94 CarbonylContact C-O 3.54Å; N80-V94 WeakPolarHBondContact CA-O 3.46Å; N80-V94 PolarHBondContact OD1-O 2.76Å; I81-V94 HydrophobicContact CB-CB 4.19Å; I81-V94 PolarHBondContact N-O 2.82Å; I81-V94 PolarHBondContact O-N 3.07Å; I92-V94 HydrophobicContact CG2-CG2 3.98Å; V94-L112 HydrophobicContact CG1-CD1 3.31Å; V94-L112 HydrophobicContact CG1-CD2 3.73Å; V94-L112 HydrophobicContact CG1-CG 3.62Å; V94-E113 WeakPolarHBondContact CA-O 3.36Å; V94-V114 HydrophobicContact CG2-CG1 4.4Å; V94-V114 HydrophobicContact CG2-CG2 4.33Å
95	T	94.1	Very high	76.2	Confident	45 Å²	45	73.6 Å²	73.6	28%	0.276	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	123.8	-175.7	-64.1	0	0	0	0	110.8	L112 E113	T95-L112 WeakPolarHBondContact O-CA 3.25Å; T95-E113 PolarHBondContact N-O 3.32Å; T95-E113 PolarHBondContact O-N 3.37Å
96	R	91	Very high	74.3	Confident	2 Å²	2	76 Å²	76	1%	0.008	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	111.9	168.9	-179.5	-174	174.7	-163.5	7.2	109.5	P75 R77 P78 F79 L112	P75-R96 VanDerWaalsContact O-CZ 3.27Å; P75-R96 PolarHBondContact O-NH1 2.91Å; P75-R96 PolarHBondContact O-NH2 3.43Å; R77-R96 PolarHBondContact O-NH1 2.97Å; P78-R96 VanDerWaalsContact CA-O 3.24Å; P78-R96 WeakPolarHBondContact CA-O 3.38Å; P78-R96 WeakPolarHBondContact CB-O 3.43Å; F79-R96 HydrophobicContact CD1-CB 4.01Å; F79-R96 HydrophobicContact CD1-CG 4.44Å; F79-R96 HydrophobicContact CD2-CB 4.04Å; F79-R96 HydrophobicContact CE1-CB 3.87Å; F79-R96 HydrophobicContact CE1-CG 4.17Å; F79-R96 HydrophobicContact CE2-CB 3.88Å; F79-R96 HydrophobicContact CG-CB 4.1Å; F79-R96 HydrophobicContact CZ-CB 3.8Å; F79-R96 HydrophobicContact CZ-CG 4.43Å; F79-R96 PolarHBondContact N-O 3.16Å; F79-R96 PolarHBondContact O-N 3.23Å; R96-L112 HydrophobicContact CB-CD1 4.39Å
97	P	84.1	Confident	72.8	Confident	61 Å²	61	75 Å²	75	40%	0.396	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-70.3	156.1	177.6	29.6	-35.4	0	0	0	112.2	K99 E111	P97-K99 PolarHBondContact O-N 2.88Å; P97-E111 WeakPolarHBondContact CD-O 3.26Å
98	L	69.8	Low	71.9	Confident	106 Å²	106	68.5 Å²	68.5	56%	0.555	38%	0.383	S	S	*	.	P	Polyproline II helix	trans	-67.7	116.6	172	179.5	73.8	0	0	0	109	P78	P78-L98 HydrophobicContact CB-CB 4.16Å; P78-L98 HydrophobicContact CG-CB 4.11Å; P78-L98 HydrophobicContact CG-CD1 4.27Å
99	K	65	Low	71.8	Confident	55 Å²	55	69.1 Å²	69.1	24%	0.239	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-102.9	137.3	168.4	-70.6	-170.5	176	-173.2	0	110	P97 L109 E111	P97-K99 PolarHBondContact O-N 2.88Å; K99-L109 WeakPolarHBondContact CD-O 3.47Å; K99-L109 PolarHBondContact NZ-O 3.22Å; K99-L109 VanDerWaalsContact NZ-O 3.08Å; K99-E111 IonicContact NZ-OE2 2.81Å; K99-E111 PolarHBondContact NZ-OE2 2.85Å
100	C	53.6	Low	71.6	Confident	88 Å²	88	63 Å²	63	60%	0.595	35%	0.347	S	S	*	.	P	Polyproline II helix	trans	-46.4	139.6	-163.8	-165.8	0	0	0	0	115.6	C108	C100-C108 PolarHBondContact O-SG 2.92Å
101	M	49.4	Very low	71.6	Confident	108 Å²	108	63 Å²	63	53%	0.532	35%	0.347	S	S	.	.	S	Bend	trans	-81.6	-12.7	177.5	-66.3	-153	-70.4	0	0	115	C72 C73	C72-M101 HydrophobicContact CB-CE 4Å; C72-M101 HydrophobicContact CB-SD 4.1Å; C72-M101 WeakPolarHBondContact SG-CE 3.35Å; C73-M101 HydrophobicContact CB-SD 4.23Å; C73-M101 PolarHBondContact SG-SD 2.8Å
102	S	45.1	Very low	71.5	Confident	100 Å²	100	62.9 Å²	62.9	70%	0.699	35%	0.346	S	S	*	.			trans	-102.8	94.9	-177.6	-177.5	0	0	0	0	109.1
103	C	47.1	Very low	71.5	Confident	66 Å²	66	65.2 Å²	65.2	45%	0.446	36%	0.357	S	S	.	.			trans	-162.4	119.8	160.1	-120.8	0	0	0	0	115.5	F105 C107	C103-F105 PolarHBondContact O-N 3.38Å; C103-C107 HydrophobicContact CB-CB 3.4Å; C103-C107 WeakPolarHBondContact CB-SG 3.41Å; C103-C107 WeakPolarHBondContact SG-CB 3.08Å; C103-C107 CovalentContact SG-SG 2.02Å; C103-C107 PolarHBondContact SG-SG 2.83Å
104	F	44.3	Very low	71.6	Confident	213 Å²	213	64.8 Å²	64.8	93%	0.934	35%	0.354	S	S	*	.	S	Bend	trans	-64.6	101.9	150.3	-90.4	-108.1	0	0	0	108
105	F	44.6	Very low	71.7	Confident	168 Å²	168	66.6 Å²	66.6	74%	0.737	36%	0.363	S	S	*	.	S	Bend	trans	45.2	127.6	156.5	-129.5	-90.3	0	0	0	119.5	C103 W129	C103-F105 PolarHBondContact O-N 3.38Å; F105-W129 HydrophobicContact CE1-CZ2 4.04Å
106	P	51.2	Low	71.7	Confident	80 Å²	80	64.4 Å²	64.4	52%	0.519	35%	0.349	S	S	.	.	S	Bend	cis	-108.2	91.5	-27.8	34.3	-16.2	0	0	0	110.2	W129	P106-W129 HydrophobicContact CB-CG 4.31Å
107	C	53.2	Low	71.9	Confident	69 Å²	69	66.5 Å²	66.5	47%	0.466	36%	0.363	S	S	.	.			trans	-116.5	-1.8	-169.4	-24.5	0	0	0	0	115.3	C103	C103-C107 HydrophobicContact CB-CB 3.4Å; C103-C107 WeakPolarHBondContact CB-SG 3.41Å; C103-C107 WeakPolarHBondContact SG-CB 3.08Å; C103-C107 CovalentContact SG-SG 2.02Å; C103-C107 PolarHBondContact SG-SG 2.83Å
108	C	67.1	Low	72.3	Confident	35 Å²	35	66.1 Å²	66.1	24%	0.236	36%	0.361	C	S	.	.			trans	-114.4	37.2	-167.9	-53.3	0	0	0	0	112.3	C100 Q110	C100-C108 PolarHBondContact O-SG 2.92Å; C108-Q110 PolarHBondContact O-N 2.91Å; C108-Q110 PolarHBondContact O-NE2 2.86Å
109	L	82.1	Confident	73.3	Confident	56 Å²	56	64.3 Å²	64.3	29%	0.293	37%	0.368	S	S	.	.			trans	-64.6	123.5	176.7	-69.8	177.4	0	0	0	110.5	K99 Q127 W129	K99-L109 WeakPolarHBondContact CD-O 3.47Å; K99-L109 PolarHBondContact NZ-O 3.22Å; K99-L109 VanDerWaalsContact NZ-O 3.08Å; L109-Q127 HydrophobicContact CB-CB 4.48Å; L109-Q127 HydrophobicContact CD2-CB 4.32Å; L109-Q127 HydrophobicContact CD2-CG 3.99Å; L109-W129 HydrophobicContact CD1-CB 4.24Å; L109-W129 HydrophobicContact CD2-CB 3.98Å
110	Q	85.8	Confident	74.8	Confident	1 Å²	1	65 Å²	65	1%	0.005	37%	0.374	C	S	.	.			trans	-73.4	149.8	-176.6	-59.4	-54.6	-56	0	0	112	C108 Q127 L218 M222	C108-Q110 PolarHBondContact O-N 2.91Å; C108-Q110 PolarHBondContact O-NE2 2.86Å; Q110-Q127 HydrophobicContact CB-CB 4.22Å; Q110-Q127 VanDerWaalsContact O-CB 3.31Å; Q110-Q127 WeakPolarHBondContact O-CB 3.26Å; Q110-Q127 PolarHBondContact O-N 2.85Å; Q110-L218 HydrophobicContact CB-CD1 4.24Å; Q110-M222 HydrophobicContact CB-CE 4.45Å; Q110-M222 HydrophobicContact CB-SD 3.96Å; Q110-M222 HydrophobicContact CG-CE 3.93Å; Q110-M222 HydrophobicContact CG-SD 3.82Å
111	E	91.1	Very high	76.8	Confident	59 Å²	59	62.4 Å²	62.4	28%	0.276	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	146.6	175.8	179.5	176.6	174.8	0	0	108.1	P97 K99 V125 I126	P97-E111 WeakPolarHBondContact CD-O 3.26Å; K99-E111 IonicContact NZ-OE2 2.81Å; K99-E111 PolarHBondContact NZ-OE2 2.85Å; E111-V125 CarbonylContact C-O 3.6Å; E111-V125 VanDerWaalsContact CA-O 3.26Å; E111-V125 WeakPolarHBondContact CA-O 3.35Å; E111-I126 HydrophobicContact CG-CG1 4.21Å
112	L	94.1	Very high	79.1	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	133	-177.7	169.3	143	0	0	0	108.5	F79 V94 T95 R96 V114 Y124 V125 L218	F79-L112 HydrophobicContact CE2-CD1 3.68Å; F79-L112 HydrophobicContact CZ-CD1 3.63Å; V94-L112 HydrophobicContact CG1-CD1 3.31Å; V94-L112 HydrophobicContact CG1-CD2 3.73Å; V94-L112 HydrophobicContact CG1-CG 3.62Å; T95-L112 WeakPolarHBondContact O-CA 3.25Å; R96-L112 HydrophobicContact CB-CD1 4.39Å; L112-V114 HydrophobicContact CD2-CG2 3.55Å; L112-Y124 CarbonylContact O-C 3.58Å; L112-Y124 VanDerWaalsContact O-CA 3.28Å; L112-Y124 WeakPolarHBondContact O-CA 3.46Å; L112-V125 HydrophobicContact CB-CB 4.4Å; L112-V125 HydrophobicContact CD2-CB 4.1Å; L112-V125 HydrophobicContact CD2-CG2 3.84Å; L112-V125 PolarHBondContact N-O 3.41Å; L112-V125 PolarHBondContact O-N 3.4Å; L112-L218 HydrophobicContact CB-CD2 4.23Å; L112-L218 HydrophobicContact CD1-CB 4.06Å; L112-L218 HydrophobicContact CD1-CD1 4.42Å
113	E	97.2	Very high	81.6	Confident	49 Å²	49	52.5 Å²	52.5	23%	0.229	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	139.4	176.3	-178.3	-179	175.8	0	0	109.6	V94 T95 Q115 T121 Y124	V94-E113 WeakPolarHBondContact CA-O 3.36Å; T95-E113 PolarHBondContact N-O 3.32Å; T95-E113 PolarHBondContact O-N 3.37Å; E113-Q115 HydrophobicContact CG-CG 4.21Å; E113-Q115 PolarHBondContact OE1-NE2 3.42Å; E113-T121 HydrophobicContact CG-CG2 3.76Å; E113-T121 WeakPolarHBondContact OE1-CG2 3.49Å; E113-T121 PolarHBondContact OE1-OG1 3.17Å; E113-Y124 HydrophobicContact CB-CD1 3.93Å; E113-Y124 HydrophobicContact CB-CE1 3.88Å; E113-Y124 HydrophobicContact CG-CD1 4.04Å; E113-Y124 HydrophobicContact CG-CE1 3.62Å
114	V	98	Very high	84	Confident	0 Å²	0	51 Å²	51	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	127.5	173.3	-174.9	0	0	0	0	109.4	I92 S93 V94 L112 V122 G123 A210 V211	I92-V114 HydrophobicContact CG2-CG1 3.5Å; I92-V114 VanDerWaalsContact CG2-CG1 3.5Å; S93-V114 WeakPolarHBondContact O-CA 3.47Å; V94-V114 HydrophobicContact CG2-CG1 4.4Å; V94-V114 HydrophobicContact CG2-CG2 4.33Å; L112-V114 HydrophobicContact CD2-CG2 3.55Å; V114-V122 HydrophobicContact CB-CG2 4.18Å; V114-V122 HydrophobicContact CG1-CG2 3.86Å; V114-V122 VanDerWaalsContact O-CG2 3.27Å; V114-V122 WeakPolarHBondContact O-CG2 3.17Å; V114-V122 PolarHBondContact O-N 3.47Å; V114-G123 PolarHBondContact N-O 3.25Å; V114-G123 PolarHBondContact O-N 2.97Å; V114-A210 HydrophobicContact CG1-CB 4.38Å; V114-V211 HydrophobicContact CB-CG2 4.21Å; V114-V211 HydrophobicContact CG2-CG1 4.49Å
115	Q	97.6	Very high	86.6	Confident	37 Å²	37	41 Å²	41	17%	0.173	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	137.5	177.9	-57.3	-178.3	-8.1	0	0	110.1	I92 S93 E113 N120	I92-Q115 CarbonylContact C-O 3.55Å; I92-Q115 VanDerWaalsContact CA-O 3.24Å; I92-Q115 WeakPolarHBondContact CA-O 3.43Å; I92-Q115 WeakPolarHBondContact CG2-O 3.24Å; S93-Q115 PolarHBondContact N-O 2.84Å; S93-Q115 PolarHBondContact O-N 3.18Å; E113-Q115 HydrophobicContact CG-CG 4.21Å; E113-Q115 PolarHBondContact OE1-NE2 3.42Å; Q115-N120 CarbonylContact C-O 3.55Å; Q115-N120 VanDerWaalsContact CA-O 3.22Å; Q115-N120 WeakPolarHBondContact CA-O 3.34Å
116	A	95.3	Very high	89	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	21%	0.212	C	C	.	.	S	Bend	trans	-153.8	119.6	175.4	0	0	0	0	0	111.2	L18 I91 I92 N120 V122	L18-A116 HydrophobicContact CD1-CB 3.81Å; L18-A116 HydrophobicContact CD2-CB 4.02Å; L18-A116 HydrophobicContact CG-CB 4.09Å; I91-A116 WeakPolarHBondContact O-CA 3.01Å; I92-A116 HydrophobicContact CG1-CB 4.16Å; A116-N120 PolarHBondContact N-O 3.32Å; A116-N120 PolarHBondContact O-ND2 3.19Å; A116-V122 HydrophobicContact CB-CG1 3.95Å; A116-V122 HydrophobicContact CB-CG2 4.14Å; A116-V122 WeakPolarHBondContact O-CG1 3.42Å
117	P	93.8	Very high	90.9	Very high	46 Å²	46	32.7 Å²	32.7	30%	0.299	20%	0.196	S	C	.	.	S	Bend	cis	-58.4	170.8	-18.7	29.6	-36.4	0	0	0	111.4	G119 N120	P117-G119 PolarHBondContact O-N 2.84Å; P117-N120 WeakPolarHBondContact O-CB 3.29Å; P117-N120 PolarHBondContact O-N 3.46Å
118	P	92.7	Very high	92.7	Very high	53 Å²	53	33.1 Å²	33.1	34%	0.344	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50	134.8	176.3	-27.4	34.9	0	0	0	112.6	E90	E90-P118 HydrophobicContact CB-CG 4.11Å; E90-P118 HydrophobicContact CG-CG 3.53Å; E90-P118 WeakPolarHBondContact OE1-CG 3.4Å
119	G	92.4	Very high	93.6	Very high	68 Å²	68	37.8 Å²	37.8	70%	0.701	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	89	-7.6	-172	0	0	0	0	0	115.3	P117	P117-G119 PolarHBondContact O-N 2.84Å
120	N	94.9	Very high	93.7	Very high	70 Å²	70	38.3 Å²	38.3	37%	0.374	20%	0.204	S	C	.	.	S	Bend	trans	-117.7	99.7	174.3	178.5	58.4	0	0	0	110.9	Q115 A116 P117 V122	Q115-N120 CarbonylContact C-O 3.55Å; Q115-N120 VanDerWaalsContact CA-O 3.22Å; Q115-N120 WeakPolarHBondContact CA-O 3.34Å; A116-N120 PolarHBondContact N-O 3.32Å; A116-N120 PolarHBondContact O-ND2 3.19Å; P117-N120 WeakPolarHBondContact O-CB 3.29Å; P117-N120 PolarHBondContact O-N 3.46Å; N120-V122 PolarHBondContact O-N 3.16Å
121	T	97.1	Very high	93.3	Very high	32 Å²	32	42.1 Å²	42.1	20%	0.196	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	128.4	179.2	-45.9	0	0	0	0	111.5	E113 Y124 E141	E113-T121 HydrophobicContact CG-CG2 3.76Å; E113-T121 WeakPolarHBondContact OE1-CG2 3.49Å; E113-T121 PolarHBondContact OE1-OG1 3.17Å; T121-Y124 HydrophobicContact CG2-CE1 4.15Å; T121-Y124 HydrophobicContact CG2-CE2 3.81Å; T121-E141 WeakPolarHBondContact O-CB 3.44Å
122	V	96.9	Very high	92.8	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	-16.9	178.2	-67.1	0	0	0	0	113	V114 A116 N120 E141 R207 M208 V211	V114-V122 HydrophobicContact CB-CG2 4.18Å; V114-V122 HydrophobicContact CG1-CG2 3.86Å; V114-V122 VanDerWaalsContact O-CG2 3.27Å; V114-V122 WeakPolarHBondContact O-CG2 3.17Å; V114-V122 PolarHBondContact O-N 3.47Å; A116-V122 HydrophobicContact CB-CG1 3.95Å; A116-V122 HydrophobicContact CB-CG2 4.14Å; A116-V122 WeakPolarHBondContact O-CG1 3.42Å; N120-V122 PolarHBondContact O-N 3.16Å; V122-E141 PolarHBondContact O-N 3.4Å; V122-R207 HydrophobicContact CB-CB 4.05Å; V122-R207 HydrophobicContact CB-CG 4.18Å; V122-R207 HydrophobicContact CG1-CB 4.5Å; V122-R207 HydrophobicContact CG1-CG 4.1Å; V122-M208 WeakPolarHBondContact O-CE 3.18Å; V122-V211 HydrophobicContact CG2-CG2 4.31Å
123	G	97.6	Very high	92.4	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	165.7	-175.1	172.7	0	0	0	0	0	114	V114 A139	V114-G123 PolarHBondContact N-O 3.25Å; V114-G123 PolarHBondContact O-N 2.97Å; G123-A139 CarbonylContact C-O 3.51Å; G123-A139 WeakPolarHBondContact CA-O 3.36Å
124	Y	98.1	Very high	92	Very high	36 Å²	36	42.7 Å²	42.7	14%	0.141	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	152.3	-171.8	-57.3	-90.9	0	0	0	111.5	L112 E113 T121 V138 A139 N140 N143	L112-Y124 CarbonylContact O-C 3.58Å; L112-Y124 VanDerWaalsContact O-CA 3.28Å; L112-Y124 WeakPolarHBondContact O-CA 3.46Å; E113-Y124 HydrophobicContact CB-CD1 3.93Å; E113-Y124 HydrophobicContact CB-CE1 3.88Å; E113-Y124 HydrophobicContact CG-CD1 4.04Å; E113-Y124 HydrophobicContact CG-CE1 3.62Å; T121-Y124 HydrophobicContact CG2-CE1 4.15Å; T121-Y124 HydrophobicContact CG2-CE2 3.81Å; Y124-V138 WeakPolarHBondContact O-CA 3.27Å; Y124-A139 PolarHBondContact N-O 2.71Å; Y124-A139 PolarHBondContact O-N 2.8Å; Y124-N140 WeakPolarHBondContact CD2-O 3.32Å; Y124-N143 WeakPolarHBondContact CD2-OD1 3.49Å; Y124-N143 VanDerWaalsContact CE2-ND2 3.32Å; Y124-N143 WeakPolarHBondContact CE2-ND2 3.29Å; Y124-N143 WeakPolarHBondContact CE2-OD1 3.28Å
125	V	97.6	Very high	91.8	Very high	1 Å²	1	45 Å²	45	1%	0.006	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	118.1	169.3	-174	0	0	0	0	108	E111 L112 F136 I137 V211 A215 L218	E111-V125 CarbonylContact C-O 3.6Å; E111-V125 VanDerWaalsContact CA-O 3.26Å; E111-V125 WeakPolarHBondContact CA-O 3.35Å; L112-V125 HydrophobicContact CB-CB 4.4Å; L112-V125 HydrophobicContact CD2-CB 4.1Å; L112-V125 HydrophobicContact CD2-CG2 3.84Å; L112-V125 PolarHBondContact N-O 3.41Å; L112-V125 PolarHBondContact O-N 3.4Å; V125-F136 HydrophobicContact CG1-CB 4.14Å; V125-F136 HydrophobicContact CG1-CD1 4.22Å; V125-F136 HydrophobicContact CG1-CG 4.45Å; V125-I137 CarbonylContact C-O 3.59Å; V125-I137 WeakPolarHBondContact CA-O 3.39Å; V125-V211 HydrophobicContact CG2-CG1 3.56Å; V125-A215 HydrophobicContact CG1-CB 4.04Å; V125-A215 HydrophobicContact CG2-CB 3.78Å; V125-L218 HydrophobicContact CB-CD2 4.25Å; V125-L218 HydrophobicContact CG1-CD2 3.78Å
126	I	95	Very high	91.7	Very high	39 Å²	39	43.3 Å²	43.3	20%	0.2	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	118.7	-171.7	-55.7	166.2	0	0	0	109.1	E111 F136 I137 A139	E111-I126 HydrophobicContact CG-CG1 4.21Å; I126-F136 CarbonylContact O-C 3.57Å; I126-F136 VanDerWaalsContact O-CA 3.28Å; I126-F136 WeakPolarHBondContact O-CA 3.22Å; I126-I137 HydrophobicContact CB-CB 4.49Å; I126-I137 PolarHBondContact N-O 3.36Å; I126-I137 PolarHBondContact O-N 3.21Å; I126-A139 HydrophobicContact CD1-CB 4.42Å
127	Q	92.1	Very high	91.8	Very high	36 Å²	36	44.9 Å²	44.9	17%	0.168	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	134.3	174.5	-169.9	-173.5	11.7	0	0	110.8	L109 Q110 F136	L109-Q127 HydrophobicContact CB-CB 4.48Å; L109-Q127 HydrophobicContact CD2-CB 4.32Å; L109-Q127 HydrophobicContact CD2-CG 3.99Å; Q110-Q127 HydrophobicContact CB-CB 4.22Å; Q110-Q127 VanDerWaalsContact O-CB 3.31Å; Q110-Q127 WeakPolarHBondContact O-CB 3.26Å; Q110-Q127 PolarHBondContact O-N 2.85Å; Q127-F136 HydrophobicContact CB-CD1 3.92Å; Q127-F136 HydrophobicContact CB-CE1 3.91Å; Q127-F136 HydrophobicContact CG-CD1 4.18Å; Q127-F136 HydrophobicContact CG-CE1 3.87Å
128	Q	90.6	Very high	92	Very high	77 Å²	77	42.7 Å²	42.7	36%	0.36	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	137.2	171.8	-64	-62.5	-55.3	0	0	110	H130 K135 I137	Q128-H130 PolarHBondContact O-N 2.86Å; Q128-K135 HydrophobicContact CB-CB 3.98Å; Q128-K135 PolarHBondContact N-O 2.94Å; Q128-I137 VanDerWaalsContact CD-CD1 3.47Å; Q128-I137 HydrophobicContact CG-CD1 3.76Å; Q128-I137 HydrophobicContact CG-CG1 3.66Å
129	W	86.3	Confident	92.3	Very high	134 Å²	134	40.2 Å²	40.2	51%	0.508	22%	0.217	S	C	.	.	P	Polyproline II helix	trans	-68.7	129.9	174.6	-174.5	86.3	0	0	0	110.1	F105 P106 L109 P131	F105-W129 HydrophobicContact CE1-CZ2 4.04Å; P106-W129 HydrophobicContact CB-CG 4.31Å; L109-W129 HydrophobicContact CD1-CB 4.24Å; L109-W129 HydrophobicContact CD2-CB 3.98Å; W129-P131 HydrophobicContact CH2-CB 4.13Å; W129-P131 HydrophobicContact CH2-CG 4.44Å; W129-P131 HydrophobicContact CZ2-CB 4.47Å
130	H	84	Confident	92.5	Very high	67 Å²	67	38 Å²	38	31%	0.31	19%	0.189	S	C	.	.			trans	-152.9	139	174.1	-173	-95.7	0	0	0	109.3	Q128 L132 S133 K135	Q128-H130 PolarHBondContact O-N 2.86Å; H130-L132 VanDerWaalsContact C-N 3.31Å; H130-L132 PolarHBondContact O-N 2.9Å; H130-S133 WeakPolarHBondContact CB-O 3.44Å; H130-S133 PolarHBondContact CE1-OG 3.22Å; H130-S133 VanDerWaalsContact CE1-OG 3.29Å; H130-S133 PolarHBondContact ND1-N 2.87Å; H130-S133 PolarHBondContact ND1-O 2.86Å; H130-S133 PolarHBondContact ND1-OG 3.46Å; H130-K135 HydrophobicContact CB-CD 4.08Å; H130-K135 HydrophobicContact CB-CG 4.15Å; H130-K135 VanDerWaalsContact CD2-CE 3.49Å; H130-K135 WeakPolarHBondContact CD2-CE 3.4Å
131	P	77.8	Confident	92.5	Very high	80 Å²	80	37.9 Å²	37.9	52%	0.519	19%	0.187	S	C	.	.	S	Bend	trans	-72.3	-20.6	-167.9	25.8	-35.1	0	0	0	114.6	W129	W129-P131 HydrophobicContact CH2-CB 4.13Å; W129-P131 HydrophobicContact CH2-CG 4.44Å; W129-P131 HydrophobicContact CZ2-CB 4.47Å
132	L	80.3	Confident	92.4	Very high	88 Å²	88	42.7 Å²	42.7	46%	0.461	21%	0.207	S	C	.	.	S	Bend	trans	-132.1	-12.1	-162.7	-67.6	173.5	0	0	0	114.8	H130 F153 C154	H130-L132 VanDerWaalsContact C-N 3.31Å; H130-L132 PolarHBondContact O-N 2.9Å; L132-F153 HydrophobicContact CB-CD2 3.87Å; L132-F153 HydrophobicContact CB-CE2 3.55Å; L132-F153 HydrophobicContact CB-CZ 4.44Å; L132-F153 HydrophobicContact CD1-CE2 3.91Å; L132-F153 HydrophobicContact CD2-CE2 3.68Å; L132-F153 HydrophobicContact CD2-CZ 3.81Å; L132-F153 HydrophobicContact CG-CE2 3.87Å; L132-F153 HydrophobicContact CG-CZ 4.5Å; L132-F153 CarbonylContact O-C 3.53Å; L132-F153 WeakPolarHBondContact O-CA 3.12Å; L132-F153 WeakPolarHBondContact O-CD2 3.32Å; L132-C154 PolarHBondContact O-N 3.48Å; L132-C154 PolarHBondContact O-SG 3.35Å
133	S	86.1	Confident	92.3	Very high	20 Å²	20	46.4 Å²	46.4	14%	0.14	23%	0.226	C	C	.	.	S	Bend	trans	-155.6	147.9	-178.1	57.8	0	0	0	0	109.3	H130 P152	H130-S133 WeakPolarHBondContact CB-O 3.44Å; H130-S133 PolarHBondContact CE1-OG 3.22Å; H130-S133 VanDerWaalsContact CE1-OG 3.29Å; H130-S133 PolarHBondContact ND1-N 2.87Å; H130-S133 PolarHBondContact ND1-O 2.86Å; H130-S133 PolarHBondContact ND1-OG 3.46Å; S133-P152 WeakPolarHBondContact CB-O 3.5Å
134	P	89.1	Confident	92.3	Very high	13 Å²	13	51.7 Å²	51.7	8%	0.084	25%	0.251	C	S	.	.			trans	-75.4	133.6	175.7	32.2	-31.5	0	0	0	109.9	F136 G151 P152 F164 F223	P134-F136 HydrophobicContact CB-CE2 4.02Å; P134-F136 HydrophobicContact CB-CZ 4.37Å; P134-G151 PolarHBondContact O-N 3.35Å; P134-P152 WeakPolarHBondContact CD-O 3.36Å; P134-F164 HydrophobicContact CB-CE1 4.45Å; P134-F164 HydrophobicContact CG-CE1 3.73Å; P134-F164 HydrophobicContact CG-CZ 4.41Å; P134-F223 HydrophobicContact CB-CE1 4.26Å; P134-F223 HydrophobicContact CB-CE2 4.07Å; P134-F223 HydrophobicContact CB-CZ 3.46Å; P134-F223 VanDerWaalsContact CB-CZ 3.46Å; P134-F223 HydrophobicContact CG-CE1 4.34Å; P134-F223 HydrophobicContact CG-CE2 4.32Å; P134-F223 HydrophobicContact CG-CZ 3.83Å
135	K	92.8	Very high	92.2	Very high	47 Å²	47	53.2 Å²	53.2	20%	0.204	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	141.7	177.7	-67.2	-168.9	176.1	-169.4	0	109.6	Q128 H130 I149	Q128-K135 HydrophobicContact CB-CB 3.98Å; Q128-K135 PolarHBondContact N-O 2.94Å; H130-K135 HydrophobicContact CB-CD 4.08Å; H130-K135 HydrophobicContact CB-CG 4.15Å; H130-K135 VanDerWaalsContact CD2-CE 3.49Å; H130-K135 WeakPolarHBondContact CD2-CE 3.4Å; K135-I149 CarbonylContact C-O 3.51Å; K135-I149 WeakPolarHBondContact CA-O 3.16Å
136	F	95.8	Very high	92.2	Very high	2 Å²	2	55.7 Å²	55.7	1%	0.009	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	149	175.6	-50.7	-94.7	0	0	0	110.5	V125 I126 Q127 P134 K148 I149 F164 L218 I219 M222 F223	V125-F136 HydrophobicContact CG1-CB 4.14Å; V125-F136 HydrophobicContact CG1-CD1 4.22Å; V125-F136 HydrophobicContact CG1-CG 4.45Å; I126-F136 CarbonylContact O-C 3.57Å; I126-F136 VanDerWaalsContact O-CA 3.28Å; I126-F136 WeakPolarHBondContact O-CA 3.22Å; Q127-F136 HydrophobicContact CB-CD1 3.92Å; Q127-F136 HydrophobicContact CB-CE1 3.91Å; Q127-F136 HydrophobicContact CG-CD1 4.18Å; Q127-F136 HydrophobicContact CG-CE1 3.87Å; P134-F136 HydrophobicContact CB-CE2 4.02Å; P134-F136 HydrophobicContact CB-CZ 4.37Å; F136-K148 WeakPolarHBondContact O-CA 3.45Å; F136-I149 HydrophobicContact CB-CB 4.16Å; F136-I149 HydrophobicContact CD2-CB 4.35Å; F136-I149 HydrophobicContact CD2-CG2 4.38Å; F136-I149 PolarHBondContact N-O 2.88Å; F136-I149 PolarHBondContact O-N 3.08Å; F136-F164 HydrophobicContact CE2-CD1 4.46Å; F136-F164 HydrophobicContact CE2-CE1 4.23Å; F136-L218 HydrophobicContact CD1-CD2 4.13Å; F136-L218 HydrophobicContact CE1-CD2 3.98Å; F136-L218 HydrophobicContact CE1-CG 4.49Å; F136-I219 HydrophobicContact CE2-CG1 4.21Å; F136-I219 HydrophobicContact CZ-CG1 4.43Å; F136-M222 HydrophobicContact CE1-CE 4.39Å; F136-M222 HydrophobicContact CE1-SD 3.89Å; F136-M222 HydrophobicContact CZ-CE 4.38Å; F136-M222 HydrophobicContact CZ-SD 4.09Å; F136-F223 HydrophobicContact CE2-CE2 4.45Å; F136-F223 HydrophobicContact CZ-CE2 4.04Å
137	I	97.6	Very high	92.3	Very high	33 Å²	33	54.3 Å²	54.3	17%	0.169	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	136.7	167.6	-69.4	178.4	0	0	0	107.6	V125 I126 Q128 P145	V125-I137 CarbonylContact C-O 3.59Å; V125-I137 WeakPolarHBondContact CA-O 3.39Å; I126-I137 HydrophobicContact CB-CB 4.49Å; I126-I137 PolarHBondContact N-O 3.36Å; I126-I137 PolarHBondContact O-N 3.21Å; Q128-I137 VanDerWaalsContact CD-CD1 3.47Å; Q128-I137 HydrophobicContact CG-CD1 3.76Å; Q128-I137 HydrophobicContact CG-CG1 3.66Å; I137-P145 HydrophobicContact CG2-CB 3.58Å
138	V	98	Very high	92.5	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	118.8	170.9	174.7	0	0	0	0	106.1	Y124 V146 L147 I149 M208 V211 M212	Y124-V138 WeakPolarHBondContact O-CA 3.27Å; V138-V146 PolarHBondContact O-N 3.45Å; V138-L147 HydrophobicContact CB-CB 3.94Å; V138-L147 HydrophobicContact CG1-CB 4.45Å; V138-L147 HydrophobicContact CG2-CB 4.29Å; V138-L147 PolarHBondContact N-O 2.87Å; V138-L147 PolarHBondContact O-N 2.95Å; V138-I149 HydrophobicContact CG2-CD1 3.67Å; V138-I149 HydrophobicContact CG2-CG1 3.88Å; V138-M208 HydrophobicContact CG1-SD 4.31Å; V138-V211 HydrophobicContact CG1-CB 4.27Å; V138-V211 HydrophobicContact CG1-CG1 3.68Å; V138-M212 HydrophobicContact CB-CE 3.86Å; V138-M212 HydrophobicContact CG1-CE 3.31Å; V138-M212 HydrophobicContact CG2-CE 3.28Å; V138-M212 HydrophobicContact CG2-SD 4.41Å
139	A	97.9	Very high	92.8	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.008	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	153.4	-178.5	0	0	0	0	0	111.4	G123 Y124 I126 E144	G123-A139 CarbonylContact C-O 3.51Å; G123-A139 WeakPolarHBondContact CA-O 3.36Å; Y124-A139 PolarHBondContact N-O 2.71Å; Y124-A139 PolarHBondContact O-N 2.8Å; I126-A139 HydrophobicContact CD1-CB 4.42Å; A139-E144 CarbonylContact C-O 3.57Å; A139-E144 WeakPolarHBondContact CA-O 3.42Å; A139-E144 WeakPolarHBondContact CB-O 3.4Å
140	N	96.8	Very high	93.2	Very high	22 Å²	22	45.9 Å²	45.9	12%	0.118	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	-175.8	174.9	70.7	6.4	0	0	0	112.1	Y124 H142 N143 E144 V146 M208	Y124-N140 WeakPolarHBondContact CD2-O 3.32Å; N140-H142 PolarHBondContact O-N 2.8Å; N140-H142 VanDerWaalsContact O-N 3.08Å; N140-H142 WeakPolarHBondContact OD1-CA 3.47Å; N140-H142 WeakPolarHBondContact OD1-CB 3.37Å; N140-H142 PolarHBondContact OD1-N 3.38Å; N140-N143 PolarHBondContact O-N 2.84Å; N140-N143 PolarHBondContact OD1-N 2.94Å; N140-E144 PolarHBondContact N-O 3.2Å; N140-E144 PolarHBondContact ND2-OE2 2.91Å; N140-E144 WeakPolarHBondContact OD1-CB 3.47Å; N140-E144 PolarHBondContact OD1-N 3.29Å; N140-E144 PolarHBondContact OD1-O 2.76Å; N140-V146 HydrophobicContact CB-CG2 3.86Å; N140-M208 HydrophobicContact CB-CE 4.27Å
141	E	95.8	Very high	93.5	Very high	68 Å²	68	43.2 Å²	43.2	32%	0.318	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-20.9	177.8	62.7	-95	-137.1	0	0	114.4	T121 V122	T121-E141 WeakPolarHBondContact O-CB 3.44Å; V122-E141 PolarHBondContact O-N 3.4Å
142	H	95.4	Very high	93.9	Very high	133 Å²	133	40.5 Å²	40.5	62%	0.616	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.9	9.7	179.1	-60.7	-47.5	0	0	0	113.1	N140 E144	N140-H142 PolarHBondContact O-N 2.8Å; N140-H142 VanDerWaalsContact O-N 3.08Å; N140-H142 WeakPolarHBondContact OD1-CA 3.47Å; N140-H142 WeakPolarHBondContact OD1-CB 3.37Å; N140-H142 PolarHBondContact OD1-N 3.38Å; H142-E144 HydrophobicContact CB-CG 4.01Å; H142-E144 PolarHBondContact O-N 2.96Å
143	N	93.8	Very high	93.7	Very high	77 Å²	77	41.2 Å²	41.2	41%	0.412	21%	0.211	S	C	.	.	S	Bend	trans	60.7	23.5	-171.2	-79.6	-70.1	0	0	0	114	Y124 N140	Y124-N143 WeakPolarHBondContact CD2-OD1 3.49Å; Y124-N143 VanDerWaalsContact CE2-ND2 3.32Å; Y124-N143 WeakPolarHBondContact CE2-ND2 3.29Å; Y124-N143 WeakPolarHBondContact CE2-OD1 3.28Å; N140-N143 PolarHBondContact O-N 2.84Å; N140-N143 PolarHBondContact OD1-N 2.94Å
144	E	96.8	Very high	92.6	Very high	111 Å²	111	43.5 Å²	43.5	52%	0.519	23%	0.227	S	C	.	.			trans	-86.3	130.8	174.1	-55.3	173.8	139.7	0	0	109.7	A139 N140 H142 V146	A139-E144 CarbonylContact C-O 3.57Å; A139-E144 WeakPolarHBondContact CA-O 3.42Å; A139-E144 WeakPolarHBondContact CB-O 3.4Å; N140-E144 PolarHBondContact N-O 3.2Å; N140-E144 PolarHBondContact ND2-OE2 2.91Å; N140-E144 WeakPolarHBondContact OD1-CB 3.47Å; N140-E144 PolarHBondContact OD1-N 3.29Å; N140-E144 PolarHBondContact OD1-O 2.76Å; H142-E144 HydrophobicContact CB-CG 4.01Å; H142-E144 PolarHBondContact O-N 2.96Å; E144-V146 WeakPolarHBondContact O-CG2 3.44Å; E144-V146 PolarHBondContact O-N 3.48Å
145	P	97.2	Very high	91	Very high	68 Å²	68	45.5 Å²	45.5	44%	0.442	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	126	-175.9	31.5	-36.5	0	0	0	111.4	I137 M169	I137-P145 HydrophobicContact CG2-CB 3.58Å; P145-M169 HydrophobicContact CB-CE 3.57Å; P145-M169 HydrophobicContact CB-SD 3.92Å; P145-M169 HydrophobicContact CG-CE 3.85Å
146	V	96.8	Very high	89.1	Confident	54 Å²	54	50.7 Å²	50.7	33%	0.327	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	-40.6	-176.4	-172.4	0	0	0	0	111.9	V138 N140 E144 M169 M208	V138-V146 PolarHBondContact O-N 3.45Å; N140-V146 HydrophobicContact CB-CG2 3.86Å; E144-V146 WeakPolarHBondContact O-CG2 3.44Å; E144-V146 PolarHBondContact O-N 3.48Å; V146-M169 WeakPolarHBondContact O-CG 3.46Å; V146-M208 HydrophobicContact CB-SD 4.4Å; V146-M208 HydrophobicContact CG1-CG 4.43Å; V146-M208 HydrophobicContact CG2-SD 4.28Å
147	L	97.4	Very high	86.9	Confident	9 Å²	9	53.9 Å²	53.9	5%	0.047	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	163.7	-178.6	-58.4	168.5	0	0	0	111.1	V138 I166 I175 L204 M212	V138-L147 HydrophobicContact CB-CB 3.94Å; V138-L147 HydrophobicContact CG1-CB 4.45Å; V138-L147 HydrophobicContact CG2-CB 4.29Å; V138-L147 PolarHBondContact N-O 2.87Å; V138-L147 PolarHBondContact O-N 2.95Å; L147-I166 HydrophobicContact CB-CG2 4.43Å; L147-I166 HydrophobicContact CD1-CG2 4.06Å; L147-I175 HydrophobicContact CD1-CD1 4.09Å; L147-I175 HydrophobicContact CD2-CD1 3.46Å; L147-I175 VanDerWaalsContact CD2-CD1 3.46Å; L147-I175 HydrophobicContact CG-CD1 4.43Å; L147-L204 HydrophobicContact CD1-CD1 4.25Å; L147-L204 HydrophobicContact CD1-CD2 4.44Å; L147-M212 HydrophobicContact CD1-CE 4.36Å
148	K	97.4	Very high	84.6	Confident	39 Å²	39	58.4 Å²	58.4	17%	0.17	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	146.6	171.7	-71.1	173.3	176.5	169.6	0	110.1	F136 I166 L167 M169 E171	F136-K148 WeakPolarHBondContact O-CA 3.45Å; K148-I166 CarbonylContact O-C 3.59Å; K148-I166 WeakPolarHBondContact O-CA 3.43Å; K148-L167 HydrophobicContact CB-CB 4.48Å; K148-L167 PolarHBondContact N-O 3.07Å; K148-L167 PolarHBondContact O-N 2.87Å; K148-M169 HydrophobicContact CG-SD 4.04Å; K148-M169 PolarHBondContact NZ-O 3.04Å; K148-E171 HydrophobicContact CD-CG 3.64Å; K148-E171 WeakPolarHBondContact CD-OE1 3.41Å; K148-E171 IonicContact NZ-OE1 3.63Å; K148-E171 PolarHBondContact NZ-OE1 2.95Å
149	I	97.1	Very high	82.6	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	121.9	171.3	-54.9	173.1	0	0	0	108.2	K135 F136 V138 F164 E165 I166 I178 M212 A215 I219	K135-I149 CarbonylContact C-O 3.51Å; K135-I149 WeakPolarHBondContact CA-O 3.16Å; F136-I149 HydrophobicContact CB-CB 4.16Å; F136-I149 HydrophobicContact CD2-CB 4.35Å; F136-I149 HydrophobicContact CD2-CG2 4.38Å; F136-I149 PolarHBondContact N-O 2.88Å; F136-I149 PolarHBondContact O-N 3.08Å; V138-I149 HydrophobicContact CG2-CD1 3.67Å; V138-I149 HydrophobicContact CG2-CG1 3.88Å; I149-F164 HydrophobicContact CG2-CB 3.82Å; I149-F164 HydrophobicContact CG2-CD1 4.33Å; I149-E165 CarbonylContact C-O 3.47Å; I149-E165 VanDerWaalsContact CA-O 3.25Å; I149-E165 WeakPolarHBondContact CA-O 3.36Å; I149-I166 HydrophobicContact CG1-CG1 4.44Å; I149-I178 HydrophobicContact CD1-CD1 4.29Å; I149-M212 HydrophobicContact CD1-CE 4.44Å; I149-M212 HydrophobicContact CD1-SD 4.14Å; I149-A215 HydrophobicContact CD1-CB 3.68Å; I149-I219 HydrophobicContact CG2-CD1 4.44Å
150	H	94.6	Very high	80.5	Confident	31 Å²	31	66.4 Å²	66.4	14%	0.144	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	117.4	177.2	-71.2	-179.6	0	0	0	109.9	F164 E165 L167 E171	H150-F164 CarbonylContact O-C 3.51Å; H150-F164 WeakPolarHBondContact O-CA 3.48Å; H150-E165 PolarHBondContact N-O 2.92Å; H150-E165 PolarHBondContact O-N 2.84Å; H150-L167 HydrophobicContact CB-CD1 3.8Å; H150-E171 IonicContact CE1-OE1 3.97Å; H150-E171 IonicContact CE1-OE2 3.43Å; H150-E171 PolarHBondContact CE1-OE2 3.26Å
151	G	89.5	Confident	79	Confident	11 Å²	11	69.1 Å²	69.1	11%	0.113	39%	0.385	C	S	.	.			trans	-86.2	175.5	171.6	0	0	0	0	0	113.1	P134	P134-G151 PolarHBondContact O-N 3.35Å
152	P	85.6	Confident	78.2	Confident	23 Å²	23	66.3 Å²	66.3	15%	0.149	37%	0.372	C	S	.	.			trans	-68.9	168.3	-176.9	35.8	-42.4	0	0	0	111.6	S133 P134 C154 W156 V162 D163	S133-P152 WeakPolarHBondContact CB-O 3.5Å; P134-P152 WeakPolarHBondContact CD-O 3.36Å; P152-C154 PolarHBondContact O-N 3Å; P152-W156 HydrophobicContact CB-CB 4.45Å; P152-W156 HydrophobicContact CB-CE3 4.15Å; P152-V162 HydrophobicContact CG-CG1 3.62Å; P152-D163 WeakPolarHBondContact CD-O 3.42Å
153	F	77.6	Confident	77.9	Confident	103 Å²	103	63.2 Å²	63.2	45%	0.452	36%	0.36	S	S	.	.			trans	-60.6	136.3	171.5	-173	-96.9	0	0	0	111.1	L132 G155 W156	L132-F153 HydrophobicContact CB-CD2 3.87Å; L132-F153 HydrophobicContact CB-CE2 3.55Å; L132-F153 HydrophobicContact CB-CZ 4.44Å; L132-F153 HydrophobicContact CD1-CE2 3.91Å; L132-F153 HydrophobicContact CD2-CE2 3.68Å; L132-F153 HydrophobicContact CD2-CZ 3.81Å; L132-F153 HydrophobicContact CG-CE2 3.87Å; L132-F153 HydrophobicContact CG-CZ 4.5Å; L132-F153 CarbonylContact O-C 3.53Å; L132-F153 WeakPolarHBondContact O-CA 3.12Å; L132-F153 WeakPolarHBondContact O-CD2 3.32Å; F153-G155 VanDerWaalsContact CD1-N 3.26Å; F153-G155 PolarHBondContact O-N 2.63Å; F153-W156 WeakPolarHBondContact O-CB 3.09Å; F153-W156 PolarHBondContact O-N 2.84Å
154	C	61.3	Low	77.8	Confident	69 Å²	69	59.7 Å²	59.7	47%	0.466	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-55.9	-20.8	-175.6	-71.5	0	0	0	0	114.4	L132 P152 W156 S157	L132-C154 PolarHBondContact O-N 3.48Å; L132-C154 PolarHBondContact O-SG 3.35Å; P152-C154 PolarHBondContact O-N 3Å; C154-W156 PolarHBondContact O-N 3.42Å; C154-S157 PolarHBondContact O-OG 2.9Å
155	G	55.5	Low	77.8	Confident	55 Å²	55	57.6 Å²	57.6	57%	0.567	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-70.1	-8.3	172.3	0	0	0	0	0	114.8	F153	F153-G155 VanDerWaalsContact CD1-N 3.26Å; F153-G155 PolarHBondContact O-N 2.63Å
156	W	53.1	Low	77.7	Confident	156 Å²	156	54.4 Å²	54.4	59%	0.591	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-107.4	4.5	-179	-69.2	-6.1	0	0	0	114	P152 F153 C154 C158 L159	P152-W156 HydrophobicContact CB-CB 4.45Å; P152-W156 HydrophobicContact CB-CE3 4.15Å; F153-W156 WeakPolarHBondContact O-CB 3.09Å; F153-W156 PolarHBondContact O-N 2.84Å; C154-W156 PolarHBondContact O-N 3.42Å; W156-C158 PolarHBondContact O-N 2.81Å; W156-L159 HydrophobicContact CB-CD1 3.92Å; W156-L159 HydrophobicContact CB-CG 4.44Å; W156-L159 HydrophobicContact CD2-CD1 4.21Å; W156-L159 HydrophobicContact CG-CD1 3.8Å; W156-L159 WeakPolarHBondContact O-CB 3.32Å; W156-L159 PolarHBondContact O-N 2.92Å
157	S	50.3	Low	77.7	Confident	68 Å²	68	52.2 Å²	52.2	48%	0.476	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-8.4	177.2	-53.3	0	0	0	0	114.4	C154	C154-S157 PolarHBondContact O-OG 2.9Å
158	C	49.3	Very low	77.6	Confident	128 Å²	128	53.5 Å²	53.5	87%	0.865	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.7	4.5	175.9	-52.9	0	0	0	0	113.8	W156	W156-C158 PolarHBondContact O-N 2.81Å
159	L	56.3	Low	77.5	Confident	91 Å²	91	54.8 Å²	54.8	48%	0.476	31%	0.313	S	S	.	.	S	Bend	trans	-89.5	144.3	177.2	-67	177.1	0	0	0	111.1	W156 D161	W156-L159 HydrophobicContact CB-CD1 3.92Å; W156-L159 HydrophobicContact CB-CG 4.44Å; W156-L159 HydrophobicContact CD2-CD1 4.21Å; W156-L159 HydrophobicContact CG-CD1 3.8Å; W156-L159 WeakPolarHBondContact O-CB 3.32Å; W156-L159 PolarHBondContact O-N 2.92Å; L159-D161 PolarHBondContact O-N 2.86Å
160	P	54.2	Low	77.2	Confident	79 Å²	79	59.8 Å²	59.8	51%	0.513	34%	0.339	S	S	.	.	S	Bend	trans	-68.5	-31.1	-176.2	24.3	-32.1	0	0	0	113.7
161	D	65.3	Low	77	Confident	79 Å²	79	62.5 Å²	62.5	42%	0.422	35%	0.352	S	S	.	.			trans	-104.2	115.6	177.4	-62.4	-60.6	0	0	0	109.7	L159 T183	L159-D161 PolarHBondContact O-N 2.86Å; D161-T183 WeakPolarHBondContact OD1-CG2 3.43Å; D161-T183 PolarHBondContact OD1-OG1 2.79Å
162	V	78.6	Confident	77	Confident	8 Å²	8	67.3 Å²	67.3	5%	0.048	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	115.8	179.8	171.7	0	0	0	0	110.4	P152 F164 S179 K180 F224	P152-V162 HydrophobicContact CG-CG1 3.62Å; V162-F164 HydrophobicContact CG1-CD2 3.99Å; V162-F164 HydrophobicContact CG1-CE2 3.49Å; V162-F164 VanDerWaalsContact CG1-CE2 3.49Å; V162-F164 HydrophobicContact CG1-CZ 4.26Å; V162-S179 CarbonylContact O-C 3.45Å; V162-S179 VanDerWaalsContact O-CA 3.32Å; V162-S179 WeakPolarHBondContact O-CA 3.47Å; V162-K180 HydrophobicContact CB-CB 4.39Å; V162-K180 PolarHBondContact N-O 3.19Å; V162-K180 PolarHBondContact O-N 2.91Å; V162-F224 HydrophobicContact CB-CZ 4.08Å; V162-F224 HydrophobicContact CG1-CZ 4.09Å; V162-F224 HydrophobicContact CG2-CZ 4.29Å
163	D	88	Confident	77.3	Confident	68 Å²	68	69 Å²	69	36%	0.364	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	129.2	177.5	-79.8	0.6	0	0	0	111.3	P152 K177 S179	P152-D163 WeakPolarHBondContact CD-O 3.42Å; D163-K177 IonicContact OD1-NZ 3.78Å; D163-K177 IonicContact OD2-NZ 2.74Å; D163-K177 PolarHBondContact OD2-NZ 3.35Å; D163-S179 WeakPolarHBondContact OD1-CB 3.43Å; D163-S179 PolarHBondContact OD1-OG 3.27Å
164	F	92.7	Very high	78.1	Confident	4 Å²	4	70.5 Å²	70.5	2%	0.018	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	112.7	166.9	-68.4	-103.7	0	0	0	108.5	P134 F136 I149 H150 V162 K177 I178 I219 F223 F224	P134-F164 HydrophobicContact CB-CE1 4.45Å; P134-F164 HydrophobicContact CG-CE1 3.73Å; P134-F164 HydrophobicContact CG-CZ 4.41Å; F136-F164 HydrophobicContact CE2-CD1 4.46Å; F136-F164 HydrophobicContact CE2-CE1 4.23Å; I149-F164 HydrophobicContact CG2-CB 3.82Å; I149-F164 HydrophobicContact CG2-CD1 4.33Å; H150-F164 CarbonylContact O-C 3.51Å; H150-F164 WeakPolarHBondContact O-CA 3.48Å; V162-F164 HydrophobicContact CG1-CD2 3.99Å; V162-F164 HydrophobicContact CG1-CE2 3.49Å; V162-F164 VanDerWaalsContact CG1-CE2 3.49Å; V162-F164 HydrophobicContact CG1-CZ 4.26Å; F164-K177 CarbonylContact O-C 3.54Å; F164-K177 WeakPolarHBondContact O-CA 3.28Å; F164-K177 WeakPolarHBondContact O-CB 3.47Å; F164-I178 HydrophobicContact CB-CB 4.23Å; F164-I178 WeakPolarHBondContact CB-O 3.48Å; F164-I178 PolarHBondContact N-O 2.98Å; F164-I178 PolarHBondContact O-N 2.97Å; F164-I219 HydrophobicContact CB-CD1 4.22Å; F164-I219 HydrophobicContact CD1-CD1 3.82Å; F164-I219 HydrophobicContact CD1-CG1 4.25Å; F164-I219 HydrophobicContact CD2-CD1 4.28Å; F164-I219 HydrophobicContact CD2-CG2 3.9Å; F164-I219 HydrophobicContact CE1-CD1 4.23Å; F164-I219 HydrophobicContact CE1-CG1 4.15Å; F164-I219 HydrophobicContact CE1-CG2 4.1Å; F164-I219 HydrophobicContact CE2-CG2 3.37Å; F164-I219 HydrophobicContact CG-CD1 3.87Å; F164-I219 HydrophobicContact CG-CG2 4.46Å; F164-I219 HydrophobicContact CZ-CG1 4.41Å; F164-I219 HydrophobicContact CZ-CG2 3.5Å; F164-F223 HydrophobicContact CE1-CD2 4.38Å; F164-F223 HydrophobicContact CE1-CE2 4.14Å; F164-F223 AromaticContact CZ-CD2 3.88Å; F164-F223 HydrophobicContact CZ-CD2 3.88Å; F164-F223 HydrophobicContact CZ-CE2 4.09Å; F164-F224 HydrophobicContact CE2-CE2 4.24Å
165	E	95.3	Very high	79.7	Confident	67 Å²	67	69.4 Å²	69.4	31%	0.313	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	136.1	-176	-58.4	-174.6	151.9	0	0	111	I149 H150 L167 K174	I149-E165 CarbonylContact C-O 3.47Å; I149-E165 VanDerWaalsContact CA-O 3.25Å; I149-E165 WeakPolarHBondContact CA-O 3.36Å; H150-E165 PolarHBondContact N-O 2.92Å; H150-E165 PolarHBondContact O-N 2.84Å; E165-L167 HydrophobicContact CB-CD1 4.12Å; E165-L167 VanDerWaalsContact O-CD1 3.29Å; E165-L167 WeakPolarHBondContact O-CD1 3.36Å; E165-K174 IonicContact OE1-NZ 3.22Å; E165-K174 PolarHBondContact OE1-NZ 2.8Å; E165-K174 WeakPolarHBondContact OE2-CD 3.1Å; E165-K174 WeakPolarHBondContact OE2-CE 3.43Å; E165-K174 IonicContact OE2-NZ 3.86Å; E165-K174 PolarHBondContact OE2-NZ 2.9Å
166	I	96.6	Very high	81.5	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	121.8	173	-54.4	168.1	0	0	0	107.9	L147 K148 I149 I175 G176 I178 M212	L147-I166 HydrophobicContact CB-CG2 4.43Å; L147-I166 HydrophobicContact CD1-CG2 4.06Å; K148-I166 CarbonylContact O-C 3.59Å; K148-I166 WeakPolarHBondContact O-CA 3.43Å; I149-I166 HydrophobicContact CG1-CG1 4.44Å; I166-I175 HydrophobicContact CB-CG1 4.24Å; I166-I175 HydrophobicContact CG2-CD1 4.01Å; I166-I175 HydrophobicContact CG2-CG1 3.76Å; I166-I175 PolarHBondContact O-N 2.84Å; I166-G176 PolarHBondContact N-O 3.29Å; I166-G176 PolarHBondContact O-N 2.95Å; I166-I178 HydrophobicContact CD1-CG1 4.4Å; I166-M212 HydrophobicContact CD1-CG 4.27Å; I166-M212 HydrophobicContact CD1-SD 3.73Å; I166-M212 HydrophobicContact CG1-SD 4.23Å; I166-M212 HydrophobicContact CG2-SD 4.34Å
167	L	96.6	Very high	83.5	Confident	8 Å²	8	62.8 Å²	62.8	4%	0.042	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	153.7	-174.7	-50.1	99.7	0	0	0	111.9	K148 H150 E165 S173 K174	K148-L167 HydrophobicContact CB-CB 4.48Å; K148-L167 PolarHBondContact N-O 3.07Å; K148-L167 PolarHBondContact O-N 2.87Å; H150-L167 HydrophobicContact CB-CD1 3.8Å; E165-L167 HydrophobicContact CB-CD1 4.12Å; E165-L167 VanDerWaalsContact O-CD1 3.29Å; E165-L167 WeakPolarHBondContact O-CD1 3.36Å; L167-S173 WeakPolarHBondContact CA-O 3.14Å; L167-K174 HydrophobicContact CD2-CG 4.1Å; L167-K174 HydrophobicContact CG-CG 4.45Å
168	T	95.1	Very high	85.6	Confident	36 Å²	36	59.6 Å²	59.6	22%	0.221	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	160.5	163.6	47.3	0	0	0	0	111.3	D170 E171 S173 I175	T168-D170 VanDerWaalsContact CB-OD1 3.26Å; T168-D170 WeakPolarHBondContact CB-OD1 3.41Å; T168-D170 PolarHBondContact O-N 3.27Å; T168-D170 PolarHBondContact OG1-OD1 2.87Å; T168-E171 WeakPolarHBondContact O-CA 3.48Å; T168-E171 PolarHBondContact O-N 3.18Å; T168-S173 PolarHBondContact N-O 2.51Å; T168-S173 WeakPolarHBondContact OG1-CB 3.35Å; T168-S173 PolarHBondContact OG1-N 3.2Å; T168-S173 PolarHBondContact OG1-O 2.9Å; T168-I175 HydrophobicContact CG2-CG2 3.96Å
169	M	94.6	Very high	87.4	Confident	67 Å²	67	53.6 Å²	53.6	33%	0.33	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-29.7	-176.8	-74.7	-55.7	-62.5	0	0	114.5	P145 V146 K148 E171	P145-M169 HydrophobicContact CB-CE 3.57Å; P145-M169 HydrophobicContact CB-SD 3.92Å; P145-M169 HydrophobicContact CG-CE 3.85Å; V146-M169 WeakPolarHBondContact O-CG 3.46Å; K148-M169 HydrophobicContact CG-SD 4.04Å; K148-M169 PolarHBondContact NZ-O 3.04Å; M169-E171 PolarHBondContact O-N 2.92Å
170	D	92.4	Very high	88.5	Confident	104 Å²	104	50.9 Å²	50.9	56%	0.556	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-5.6	174.8	66	-3.6	0	0	0	113.6	T168 V172	T168-D170 VanDerWaalsContact CB-OD1 3.26Å; T168-D170 WeakPolarHBondContact CB-OD1 3.41Å; T168-D170 PolarHBondContact O-N 3.27Å; T168-D170 PolarHBondContact OG1-OD1 2.87Å; D170-V172 HydrophobicContact CB-CG2 4.09Å; D170-V172 PolarHBondContact O-N 3.16Å; D170-V172 VanDerWaalsContact O-N 3.16Å; D170-V172 PolarHBondContact OD1-N 2.9Å
171	E	90.3	Very high	89.1	Confident	88 Å²	88	51.1 Å²	51.1	41%	0.411	27%	0.266	S	S	.	.	S	Bend	trans	60	15	-176.7	-58.2	177.8	-158.1	0	0	114.3	K148 H150 T168 M169	K148-E171 HydrophobicContact CD-CG 3.64Å; K148-E171 WeakPolarHBondContact CD-OE1 3.41Å; K148-E171 IonicContact NZ-OE1 3.63Å; K148-E171 PolarHBondContact NZ-OE1 2.95Å; H150-E171 IonicContact CE1-OE1 3.97Å; H150-E171 IonicContact CE1-OE2 3.43Å; H150-E171 PolarHBondContact CE1-OE2 3.26Å; T168-E171 WeakPolarHBondContact O-CA 3.48Å; T168-E171 PolarHBondContact O-N 3.18Å; M169-E171 PolarHBondContact O-N 2.92Å
172	V	89	Confident	88.8	Confident	112 Å²	112	50.4 Å²	50.4	68%	0.679	26%	0.257	S	S	*	.			trans	-86.7	-43.1	-178.3	180	0	0	0	0	111.3	D170	D170-V172 HydrophobicContact CB-CG2 4.09Å; D170-V172 PolarHBondContact O-N 3.16Å; D170-V172 VanDerWaalsContact O-N 3.16Å; D170-V172 PolarHBondContact OD1-N 2.9Å
173	S	90.9	Very high	87.4	Confident	59 Å²	59	53.8 Å²	53.8	41%	0.413	28%	0.279	S	S	.	.			trans	-105.5	123.3	-173.6	-58.7	0	0	0	0	111.2	L167 T168	L167-S173 WeakPolarHBondContact CA-O 3.14Å; T168-S173 PolarHBondContact N-O 2.51Å; T168-S173 WeakPolarHBondContact OG1-CB 3.35Å; T168-S173 PolarHBondContact OG1-N 3.2Å; T168-S173 PolarHBondContact OG1-O 2.9Å
174	K	94.6	Very high	85.7	Confident	134 Å²	134	52.1 Å²	52.1	58%	0.583	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.9	115.4	168	-58.8	-177.6	-173.8	-168	0	108.1	E165 L167	E165-K174 IonicContact OE1-NZ 3.22Å; E165-K174 PolarHBondContact OE1-NZ 2.8Å; E165-K174 WeakPolarHBondContact OE2-CD 3.1Å; E165-K174 WeakPolarHBondContact OE2-CE 3.43Å; E165-K174 IonicContact OE2-NZ 3.86Å; E165-K174 PolarHBondContact OE2-NZ 2.9Å; L167-K174 HydrophobicContact CD2-CG 4.1Å; L167-K174 HydrophobicContact CG-CG 4.45Å
175	I	94.8	Very high	83.3	Confident	47 Å²	47	61 Å²	61	24%	0.241	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	-13.1	-173.3	65.2	164.6	0	0	0	112.9	L147 I166 T168 P201	L147-I175 HydrophobicContact CD1-CD1 4.09Å; L147-I175 HydrophobicContact CD2-CD1 3.46Å; L147-I175 VanDerWaalsContact CD2-CD1 3.46Å; L147-I175 HydrophobicContact CG-CD1 4.43Å; I166-I175 HydrophobicContact CB-CG1 4.24Å; I166-I175 HydrophobicContact CG2-CD1 4.01Å; I166-I175 HydrophobicContact CG2-CG1 3.76Å; I166-I175 PolarHBondContact O-N 2.84Å; T168-I175 HydrophobicContact CG2-CG2 3.96Å; I175-P201 HydrophobicContact CB-CG 3.84Å; I175-P201 HydrophobicContact CD1-CG 4.3Å; I175-P201 HydrophobicContact CG1-CG 4.45Å; I175-P201 VanDerWaalsContact O-CD 3.25Å; I175-P201 WeakPolarHBondContact O-CD 3.44Å; I175-P201 WeakPolarHBondContact O-CG 3.41Å
176	G	94.6	Very high	81.1	Confident	13 Å²	13	61.7 Å²	61.7	13%	0.134	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177	-173.2	-175.3	0	0	0	0	0	112.3	I166 Q199	I166-G176 PolarHBondContact N-O 3.29Å; I166-G176 PolarHBondContact O-N 2.95Å; G176-Q199 CarbonylContact C-O 3.53Å; G176-Q199 WeakPolarHBondContact CA-O 3.29Å
177	K	94.4	Very high	78.7	Confident	58 Å²	58	71.6 Å²	71.6	25%	0.252	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	157.5	176.3	64.9	-177.9	-164.9	165.1	0	113.2	D163 F164 S179 W182 Q199	D163-K177 IonicContact OD1-NZ 3.78Å; D163-K177 IonicContact OD2-NZ 2.74Å; D163-K177 PolarHBondContact OD2-NZ 3.35Å; F164-K177 CarbonylContact O-C 3.54Å; F164-K177 WeakPolarHBondContact O-CA 3.28Å; F164-K177 WeakPolarHBondContact O-CB 3.47Å; K177-S179 WeakPolarHBondContact CE-OG 3.26Å; K177-W182 HydrophobicContact CD-CZ3 4.39Å; K177-W182 HydrophobicContact CG-CZ3 4.18Å; K177-Q199 HydrophobicContact CG-CB 4.4Å; K177-Q199 PolarHBondContact N-O 3.33Å; K177-Q199 PolarHBondContact O-N 3.06Å
178	I	93.4	Very high	76.3	Confident	1 Å²	1	80.9 Å²	80.9	1%	0.005	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	122.7	166.2	-59.1	170.5	0	0	0	107	I149 F164 I166 G197 I198 A215 C216 I219	I149-I178 HydrophobicContact CD1-CD1 4.29Å; F164-I178 HydrophobicContact CB-CB 4.23Å; F164-I178 WeakPolarHBondContact CB-O 3.48Å; F164-I178 PolarHBondContact N-O 2.98Å; F164-I178 PolarHBondContact O-N 2.97Å; I166-I178 HydrophobicContact CD1-CG1 4.4Å; I178-G197 CarbonylContact C-O 3.49Å; I178-G197 VanDerWaalsContact CA-O 3.29Å; I178-G197 WeakPolarHBondContact CA-O 3.49Å; I178-I198 HydrophobicContact CG1-CG1 4.38Å; I178-I198 HydrophobicContact CG1-CG2 4.17Å; I178-A215 HydrophobicContact CD1-CB 4.1Å; I178-C216 HydrophobicContact CD1-CB 4.41Å; I178-C216 HydrophobicContact CG2-CB 4.24Å; I178-I219 HydrophobicContact CB-CD1 4.48Å; I178-I219 HydrophobicContact CD1-CD1 3.9Å; I178-I219 HydrophobicContact CG2-CD1 4.36Å
179	S	88.6	Confident	73.8	Confident	2 Å²	2	82.7 Å²	82.7	1%	0.014	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	132.7	-175.7	-58.8	0	0	0	0	111.4	V162 D163 K177 F196 G197	V162-S179 CarbonylContact O-C 3.45Å; V162-S179 VanDerWaalsContact O-CA 3.32Å; V162-S179 WeakPolarHBondContact O-CA 3.47Å; D163-S179 WeakPolarHBondContact OD1-CB 3.43Å; D163-S179 PolarHBondContact OD1-OG 3.27Å; K177-S179 WeakPolarHBondContact CE-OG 3.26Å; S179-F196 WeakPolarHBondContact O-CA 3.29Å; S179-G197 PolarHBondContact N-O 3.5Å; S179-G197 PolarHBondContact O-N 2.88Å
180	K	77.9	Confident	71.5	Confident	34 Å²	34	83.8 Å²	83.8	15%	0.148	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	128	163.2	-173.7	175.8	-177.1	178.5	0	108.7	V162 D194 F196 F224	V162-K180 HydrophobicContact CB-CB 4.39Å; V162-K180 PolarHBondContact N-O 3.19Å; V162-K180 PolarHBondContact O-N 2.91Å; K180-D194 IonicContact NZ-OD1 3.08Å; K180-F196 HydrophobicContact CB-CD1 4.21Å; K180-F196 HydrophobicContact CB-CE1 3.83Å; K180-F196 HydrophobicContact CB-CZ 4.44Å; K180-F196 HydrophobicContact CD-CE1 4.34Å; K180-F196 HydrophobicContact CD-CZ 4.18Å; K180-F196 HydrophobicContact CG-CE1 4.02Å; K180-F196 HydrophobicContact CG-CZ 4.14Å; K180-F224 HydrophobicContact CB-CE2 4.03Å; K180-F224 HydrophobicContact CB-CZ 3.96Å; K180-F224 HydrophobicContact CD-CB 4.3Å; K180-F224 HydrophobicContact CD-CD1 3.26Å; K180-F224 HydrophobicContact CD-CD2 3.68Å; K180-F224 HydrophobicContact CD-CE1 3.21Å; K180-F224 HydrophobicContact CD-CE2 3.65Å; K180-F224 HydrophobicContact CD-CG 3.47Å; K180-F224 VanDerWaalsContact CD-CG 3.47Å; K180-F224 HydrophobicContact CD-CZ 3.4Å; K180-F224 HydrophobicContact CG-CE1 4.46Å; K180-F224 HydrophobicContact CG-CE2 4.37Å; K180-F224 HydrophobicContact CG-CZ 4.28Å; K180-F224 VanDerWaalsContact NZ-CG 3.31Å
181	Q	67.4	Low	69.1	Low	85 Å²	85	84.8 Å²	84.8	40%	0.397	44%	0.441	S	S	.	.	S	Bend	trans	61.7	83.3	-170.2	-55.8	-161.3	-5.5	0	0	112.6	T183 N195	Q181-T183 PolarHBondContact O-N 2.94Å; Q181-N195 PolarHBondContact N-O 2.8Å; Q181-N195 VanDerWaalsContact N-O 3.07Å
182	W	59	Low	66.6	Low	63 Å²	63	89 Å²	89	24%	0.239	47%	0.467	C	S	.	.			trans	-69.9	94.8	175.2	-172	-89.2	0	0	0	111.4	Q26 L28 K177 G184 Q199	Q26-W182 VanDerWaalsContact NE2-CZ2 3.32Å; L28-W182 HydrophobicContact CD2-CB 4.48Å; L28-W182 HydrophobicContact CD2-CG 4.49Å; K177-W182 HydrophobicContact CD-CZ3 4.39Å; K177-W182 HydrophobicContact CG-CZ3 4.18Å; W182-G184 PolarHBondContact O-N 3.44Å; W182-Q199 HydrophobicContact CH2-CB 4.03Å; W182-Q199 HydrophobicContact CZ3-CB 4.3Å
183	T	49.7	Very low	64.6	Low	80 Å²	80	85.2 Å²	85.2	49%	0.491	45%	0.447	S	S	.	.			trans	-90.1	16.5	-176.5	47.2	0	0	0	0	115.2	D161 Q181	D161-T183 WeakPolarHBondContact OD1-CG2 3.43Å; D161-T183 PolarHBondContact OD1-OG1 2.79Å; Q181-T183 PolarHBondContact O-N 2.94Å
184	G	52.2	Low	63	Low	33 Å²	33	86 Å²	86	34%	0.34	45%	0.446	S	S	.	.	S	Bend	trans	-61.6	-173.2	-179.9	0	0	0	0	0	115.5	W182 L186 R187	W182-G184 PolarHBondContact O-N 3.44Å; G184-L186 PolarHBondContact O-N 3.33Å; G184-R187 PolarHBondContact O-N 2.64Å
185	L	43	Very low	62.2	Low	190 Å²	190	81.1 Å²	81.1	100%	0.995	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	-4.6	-175.2	-80.4	161.4	0	0	0	117	R187	L185-R187 VanDerWaalsContact C-N 3.34Å
186	L	47.3	Very low	61.8	Low	82 Å²	82	79.1 Å²	79.1	43%	0.429	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	22.7	178.5	-66.5	171	0	0	0	113.1	G184 E188 A189 F190	G184-L186 PolarHBondContact O-N 3.33Å; L186-E188 PolarHBondContact O-N 3.08Å; L186-A189 PolarHBondContact O-N 3.41Å; L186-F190 HydrophobicContact CB-CD2 4.24Å; L186-F190 HydrophobicContact CB-CE2 4.16Å; L186-F190 WeakPolarHBondContact O-CD2 3.29Å
187	R	47.2	Very low	61.6	Low	208 Å²	208	78.5 Å²	78.5	79%	0.785	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-17.1	-174.4	-154	175.2	-178.1	-175.9	2.6	114.8	G184 L185	G184-R187 PolarHBondContact O-N 2.64Å; L185-R187 VanDerWaalsContact C-N 3.34Å
188	E	45.1	Very low	61.6	Low	203 Å²	203	75.8 Å²	75.8	95%	0.949	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-13	-173.3	-68.5	-175.3	172.5	0	0	115.2	L186	L186-E188 PolarHBondContact O-N 3.08Å
189	A	44.4	Very low	61.7	Low	73 Å²	73	79.3 Å²	79.3	60%	0.603	42%	0.415	S	S	*	.	S	Bend	trans	-112.9	-8	-172.6	0	0	0	0	0	115.7	L186	L186-A189 PolarHBondContact O-N 3.41Å
190	F	46.2	Very low	62	Low	91 Å²	91	79.4 Å²	79.4	40%	0.399	42%	0.415	S	S	.	.			trans	-137.8	92.3	-164	-53.5	-69	0	0	0	112.2	L186	L186-F190 HydrophobicContact CB-CD2 4.24Å; L186-F190 HydrophobicContact CB-CE2 4.16Å; L186-F190 WeakPolarHBondContact O-CD2 3.29Å
191	T	41.1	Very low	62.8	Low	124 Å²	124	79.4 Å²	79.4	76%	0.761	42%	0.419	S	S	*	.			trans	-95.2	142.8	177.1	49.6	0	0	0	0	112.9	A193	T191-A193 PolarHBondContact O-N 3.47Å
192	D	38.9	Very low	64	Low	178 Å²	178	79.9 Å²	79.9	95%	0.952	42%	0.422	S	S	*	.	S	Bend	trans	64.8	29.7	143.8	-110.6	14.5	0	0	0	121.1
193	A	46.7	Very low	65.7	Low	32 Å²	32	83.9 Å²	83.9	26%	0.264	45%	0.448	S	S	.	.	S	Bend	trans	-126.8	147.7	164.4	0	0	0	0	0	110.3	K30 T191 N195	K30-A193 HydrophobicContact CD-CB 4.35Å; K30-A193 VanDerWaalsContact CE-CB 3.47Å; K30-A193 HydrophobicContact CG-CB 4.39Å; T191-A193 PolarHBondContact O-N 3.47Å; A193-N195 VanDerWaalsContact C-N 3.33Å; A193-N195 PolarHBondContact O-N 2.95Å; A193-N195 PolarHBondContact O-ND2 2.69Å
194	D	57.6	Low	67.8	Low	74 Å²	74	81.5 Å²	81.5	40%	0.396	43%	0.432	S	S	.	.			trans	-56.8	96.7	169.9	-70.9	-60.6	0	0	0	109.2	K180	K180-D194 IonicContact NZ-OD1 3.08Å
195	N	76.7	Confident	69.8	Low	33 Å²	33	83.9 Å²	83.9	18%	0.176	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	123.3	-179.2	-59	-49.4	0	0	0	108	I29 K30 Q181 A193	I29-N195 WeakPolarHBondContact O-CA 3.24Å; K30-N195 WeakPolarHBondContact CB-OD1 3.46Å; K30-N195 WeakPolarHBondContact CD-OD1 3.25Å; K30-N195 VanDerWaalsContact CG-OD1 3.25Å; K30-N195 WeakPolarHBondContact CG-OD1 3.16Å; Q181-N195 PolarHBondContact N-O 2.8Å; Q181-N195 VanDerWaalsContact N-O 3.07Å; A193-N195 VanDerWaalsContact C-N 3.33Å; A193-N195 PolarHBondContact O-N 2.95Å; A193-N195 PolarHBondContact O-ND2 2.69Å
196	F	86.9	Confident	72.3	Confident	5 Å²	5	75.7 Å²	75.7	2%	0.022	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	138.2	167.2	-69.4	-93.9	0	0	0	109.7	L28 I29 S179 K180 C216 D220 F224	L28-F196 CarbonylContact C-O 3.53Å; L28-F196 VanDerWaalsContact CA-O 3.3Å; L28-F196 WeakPolarHBondContact CA-O 3.38Å; I29-F196 HydrophobicContact CB-CB 4.35Å; I29-F196 PolarHBondContact N-O 3.11Å; I29-F196 PolarHBondContact O-N 2.82Å; S179-F196 WeakPolarHBondContact O-CA 3.29Å; K180-F196 HydrophobicContact CB-CD1 4.21Å; K180-F196 HydrophobicContact CB-CE1 3.83Å; K180-F196 HydrophobicContact CB-CZ 4.44Å; K180-F196 HydrophobicContact CD-CE1 4.34Å; K180-F196 HydrophobicContact CD-CZ 4.18Å; K180-F196 HydrophobicContact CG-CE1 4.02Å; K180-F196 HydrophobicContact CG-CZ 4.14Å; F196-C216 WeakPolarHBondContact CB-SG 3.14Å; F196-D220 HydrophobicContact CE1-CB 4.33Å; F196-D220 HydrophobicContact CE2-CB 3.79Å; F196-D220 WeakPolarHBondContact CE2-OD1 3.49Å; F196-D220 HydrophobicContact CZ-CB 3.68Å; F196-D220 WeakPolarHBondContact CZ-OD1 3.49Å; F196-F224 AromaticContact CE1-CD2 3.66Å; F196-F224 HydrophobicContact CE1-CD2 3.66Å; F196-F224 AromaticContact CE1-CE2 3.86Å; F196-F224 HydrophobicContact CE1-CE2 3.86Å; F196-F224 HydrophobicContact CZ-CB 4.23Å; F196-F224 AromaticContact CZ-CD2 3.55Å; F196-F224 HydrophobicContact CZ-CD2 3.55Å; F196-F224 HydrophobicContact CZ-CE2 4.21Å; F196-F224 HydrophobicContact CZ-CG 4.16Å
197	G	90.8	Very high	74.7	Confident	0 Å²	0	74.3 Å²	74.3	0%	0	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	133.8	170.3	0	0	0	0	0	110.3	L27 I178 S179	L27-G197 WeakPolarHBondContact O-CA 3.46Å; I178-G197 CarbonylContact C-O 3.49Å; I178-G197 VanDerWaalsContact CA-O 3.29Å; I178-G197 WeakPolarHBondContact CA-O 3.49Å; S179-G197 PolarHBondContact N-O 3.5Å; S179-G197 PolarHBondContact O-N 2.88Å
198	I	94.4	Very high	77	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	126.9	171.7	-50.2	174.1	0	0	0	107.1	Q26 L27 I29 I178 F200 M212 I213 C216	Q26-I198 CarbonylContact C-O 3.59Å; Q26-I198 VanDerWaalsContact CA-O 3.22Å; Q26-I198 WeakPolarHBondContact CA-O 3.31Å; Q26-I198 WeakPolarHBondContact CG-O 3.19Å; L27-I198 PolarHBondContact N-O 2.86Å; L27-I198 PolarHBondContact O-N 2.99Å; I29-I198 HydrophobicContact CD1-CD1 3.85Å; I29-I198 HydrophobicContact CG1-CD1 4.42Å; I178-I198 HydrophobicContact CG1-CG1 4.38Å; I178-I198 HydrophobicContact CG1-CG2 4.17Å; I198-F200 HydrophobicContact CB-CE1 4.37Å; I198-F200 HydrophobicContact CG2-CD1 3.5Å; I198-F200 VanDerWaalsContact CG2-CD1 3.5Å; I198-F200 HydrophobicContact CG2-CE1 3.58Å; I198-M212 HydrophobicContact CG2-CB 4.09Å; I198-I213 HydrophobicContact CD1-CG1 4.21Å; I198-C216 HydrophobicContact CD1-CB 3.57Å; I198-C216 HydrophobicContact CG1-CB 4.01Å
199	Q	94.8	Very high	79.5	Confident	75 Å²	75	55.1 Å²	55.1	35%	0.35	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	131.2	172.9	-174	-179.6	23.2	0	0	109.3	D25 G176 K177 W182	D25-Q199 WeakPolarHBondContact O-CA 3.28Å; G176-Q199 CarbonylContact C-O 3.53Å; G176-Q199 WeakPolarHBondContact CA-O 3.29Å; K177-Q199 HydrophobicContact CG-CB 4.4Å; K177-Q199 PolarHBondContact N-O 3.33Å; K177-Q199 PolarHBondContact O-N 3.06Å; W182-Q199 HydrophobicContact CH2-CB 4.03Å; W182-Q199 HydrophobicContact CZ3-CB 4.3Å
200	F	95.1	Very high	82	Confident	5 Å²	5	51.6 Å²	51.6	2%	0.022	27%	0.274	C	S	.	.			trans	-148.3	165.2	177.3	42.1	-115.4	0	0	0	110.4	V24 D25 L27 I198 L204 K209 M212	V24-F200 WeakPolarHBondContact O-CE2 3Å; D25-F200 CarbonylContact C-O 3.55Å; D25-F200 WeakPolarHBondContact CA-O 3.13Å; D25-F200 VanDerWaalsContact CB-O 3.31Å; D25-F200 WeakPolarHBondContact CB-O 3.15Å; D25-F200 PolarHBondContact O-N 3.19Å; L27-F200 HydrophobicContact CD1-CE1 4.46Å; L27-F200 HydrophobicContact CD1-CZ 4.14Å; L27-F200 HydrophobicContact CG-CZ 4.3Å; I198-F200 HydrophobicContact CB-CE1 4.37Å; I198-F200 HydrophobicContact CG2-CD1 3.5Å; I198-F200 VanDerWaalsContact CG2-CD1 3.5Å; I198-F200 HydrophobicContact CG2-CE1 3.58Å; F200-L204 HydrophobicContact CB-CD2 3.81Å; F200-L204 HydrophobicContact CG-CD2 4.3Å; F200-K209 HydrophobicContact CD1-CG 4.37Å; F200-K209 HydrophobicContact CD2-CD 3.79Å; F200-K209 HydrophobicContact CD2-CG 3.76Å; F200-K209 HydrophobicContact CE1-CB 4.22Å; F200-K209 HydrophobicContact CE1-CG 4.24Å; F200-K209 HydrophobicContact CE2-CB 4.26Å; F200-K209 HydrophobicContact CE2-CD 3.35Å; F200-K209 HydrophobicContact CE2-CG 3.61Å; F200-K209 HydrophobicContact CG-CG 4.16Å; F200-K209 HydrophobicContact CZ-CB 4Å; F200-K209 HydrophobicContact CZ-CD 3.91Å; F200-K209 HydrophobicContact CZ-CG 3.87Å; F200-M212 HydrophobicContact CD1-CB 4.24Å; F200-M212 HydrophobicContact CD1-CG 4.19Å; F200-M212 HydrophobicContact CE1-CB 4.49Å
201	P	94.8	Very high	84.5	Confident	34 Å²	34	47.3 Å²	47.3	22%	0.221	26%	0.255	C	S	.	.			trans	-61.9	144.3	177.8	-22	34.7	0	0	0	112.3	I175 D203 L204 K209	I175-P201 HydrophobicContact CB-CG 3.84Å; I175-P201 HydrophobicContact CD1-CG 4.3Å; I175-P201 HydrophobicContact CG1-CG 4.45Å; I175-P201 VanDerWaalsContact O-CD 3.25Å; I175-P201 WeakPolarHBondContact O-CD 3.44Å; I175-P201 WeakPolarHBondContact O-CG 3.41Å; P201-D203 WeakPolarHBondContact CB-OD1 3.47Å; P201-D203 PolarHBondContact O-N 2.88Å; P201-L204 HydrophobicContact CB-CB 4.33Å; P201-L204 VanDerWaalsContact O-CB 3.29Å; P201-L204 WeakPolarHBondContact O-CB 3.38Å; P201-L204 PolarHBondContact O-N 2.95Å; P201-L204 VanDerWaalsContact O-N 3.15Å; P201-K209 VanDerWaalsContact O-CE 3.28Å; P201-K209 WeakPolarHBondContact O-CE 3.45Å
202	M	93.1	Very high	87.2	Confident	95 Å²	95	41.4 Å²	41.4	47%	0.468	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-36.7	177.7	-174.4	68.7	170	0	0	112.1	T22 T23 D25 K209	T22-M202 WeakPolarHBondContact O-CE 3.28Å; T23-M202 VanDerWaalsContact CA-CE 3.48Å; T23-M202 WeakPolarHBondContact O-CE 3.39Å; D25-M202 HydrophobicContact CB-CB 4.29Å; D25-M202 HydrophobicContact CB-SD 4.34Å; M202-K209 PolarHBondContact O-NZ 3.35Å
203	D	93.4	Very high	90	Very high	147 Å²	147	32.9 Å²	32.9	79%	0.786	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88	2.7	-178.9	62.9	-30.8	0	0	0	114.2	P201	P201-D203 WeakPolarHBondContact CB-OD1 3.47Å; P201-D203 PolarHBondContact O-N 2.88Å
204	L	94.7	Very high	92.3	Very high	29 Å²	29	31.4 Å²	31.4	15%	0.152	16%	0.161	C	C	.	.	S	Bend	trans	-61.9	141	173.5	-175.6	65.6	0	0	0	110.4	L147 F200 P201 V206 M208 K209	L147-L204 HydrophobicContact CD1-CD1 4.25Å; L147-L204 HydrophobicContact CD1-CD2 4.44Å; F200-L204 HydrophobicContact CB-CD2 3.81Å; F200-L204 HydrophobicContact CG-CD2 4.3Å; P201-L204 HydrophobicContact CB-CB 4.33Å; P201-L204 VanDerWaalsContact O-CB 3.29Å; P201-L204 WeakPolarHBondContact O-CB 3.38Å; P201-L204 PolarHBondContact O-N 2.95Å; P201-L204 VanDerWaalsContact O-N 3.15Å; L204-V206 PolarHBondContact O-N 2.85Å; L204-M208 HydrophobicContact CD1-CB 4.27Å; L204-M208 HydrophobicContact CD2-CB 4.25Å; L204-M208 HydrophobicContact CG-CB 4.16Å; L204-K209 HydrophobicContact CB-CG 4.28Å; L204-K209 HydrophobicContact CD2-CG 4.08Å; L204-K209 HydrophobicContact CG-CG 4.28Å; L204-K209 VanDerWaalsContact O-CE 3.23Å; L204-K209 WeakPolarHBondContact O-CE 3.49Å
205	D	94.8	Very high	94.2	Very high	84 Å²	84	27.9 Å²	27.9	45%	0.449	14%	0.143	S	C	.	.			trans	-51.4	128.6	175.4	-169.2	-42.5	0	0	0	110.6	R207 M208 K209	D205-R207 PolarHBondContact O-N 2.92Å; D205-R207 VanDerWaalsContact OD1-CB 3.26Å; D205-R207 WeakPolarHBondContact OD1-CB 3.49Å; D205-R207 WeakPolarHBondContact OD1-CG 3.32Å; D205-R207 PolarHBondContact OD1-N 2.89Å; D205-M208 HydrophobicContact CB-CB 4.45Å; D205-M208 HydrophobicContact CB-CG 4.13Å; D205-M208 WeakPolarHBondContact O-CA 3.49Å; D205-M208 WeakPolarHBondContact O-CB 3.48Å; D205-M208 PolarHBondContact O-N 3.03Å; D205-K209 PolarHBondContact O-N 2.7Å
206	V	95.3	Very high	95	Very high	17 Å²	17	26.4 Å²	26.4	10%	0.103	14%	0.135	C	C	.	.	H	α-helix	trans	-57.5	-30.9	179.9	-67.9	0	0	0	0	113.1	L18 L21 T22 L204 K209 A210	L18-V206 HydrophobicContact CB-CB 4.34Å; L18-V206 HydrophobicContact CB-CG2 4.48Å; L18-V206 HydrophobicContact CD1-CG2 4.5Å; L21-V206 HydrophobicContact CB-CB 4.44Å; L21-V206 HydrophobicContact CB-CG1 4.23Å; T22-V206 HydrophobicContact CG2-CG1 3.47Å; T22-V206 VanDerWaalsContact CG2-CG1 3.47Å; L204-V206 PolarHBondContact O-N 2.85Å; V206-K209 PolarHBondContact O-N 2.83Å; V206-A210 PolarHBondContact O-N 2.95Å
207	R	96.4	Very high	95.3	Very high	54 Å²	54	26.2 Å²	26.2	20%	0.204	13%	0.134	C	C	.	.	H	α-helix	trans	-62	-46.5	172.7	-64.9	171.9	-166.4	-104.7	-6	109.8	G13 P15 V122 D205 K209 A210 V211	G13-R207 PolarHBondContact O-NH2 2.89Å; P15-R207 HydrophobicContact CG-CG 4Å; V122-R207 HydrophobicContact CB-CB 4.05Å; V122-R207 HydrophobicContact CB-CG 4.18Å; V122-R207 HydrophobicContact CG1-CB 4.5Å; V122-R207 HydrophobicContact CG1-CG 4.1Å; D205-R207 PolarHBondContact O-N 2.92Å; D205-R207 VanDerWaalsContact OD1-CB 3.26Å; D205-R207 WeakPolarHBondContact OD1-CB 3.49Å; D205-R207 WeakPolarHBondContact OD1-CG 3.32Å; D205-R207 PolarHBondContact OD1-N 2.89Å; R207-K209 VanDerWaalsContact C-N 3.34Å; R207-K209 PolarHBondContact O-N 2.79Å; R207-A210 WeakPolarHBondContact O-CB 3.28Å; R207-A210 PolarHBondContact O-N 3.43Å; R207-A210 VanDerWaalsContact O-N 3.16Å; R207-V211 WeakPolarHBondContact O-CG2 3.14Å; R207-V211 PolarHBondContact O-N 3.35Å
208	M	97	Very high	95.3	Very high	7 Å²	7	26.3 Å²	26.3	3%	0.034	13%	0.134	C	C	.	.	H	α-helix	trans	-69.8	-32.5	178.9	-59.4	-49.8	104.8	0	0	111.7	V122 V138 N140 V146 L204 D205 A210 V211 M212	V122-M208 WeakPolarHBondContact O-CE 3.18Å; V138-M208 HydrophobicContact CG1-SD 4.31Å; N140-M208 HydrophobicContact CB-CE 4.27Å; V146-M208 HydrophobicContact CB-SD 4.4Å; V146-M208 HydrophobicContact CG1-CG 4.43Å; V146-M208 HydrophobicContact CG2-SD 4.28Å; L204-M208 HydrophobicContact CD1-CB 4.27Å; L204-M208 HydrophobicContact CD2-CB 4.25Å; L204-M208 HydrophobicContact CG-CB 4.16Å; D205-M208 HydrophobicContact CB-CB 4.45Å; D205-M208 HydrophobicContact CB-CG 4.13Å; D205-M208 WeakPolarHBondContact O-CA 3.49Å; D205-M208 WeakPolarHBondContact O-CB 3.48Å; D205-M208 PolarHBondContact O-N 3.03Å; M208-A210 VanDerWaalsContact C-N 3.34Å; M208-V211 HydrophobicContact CE-CG2 4.45Å; M208-V211 CarbonylContact O-C 3.44Å; M208-V211 PolarHBondContact O-N 2.86Å; M208-M212 WeakPolarHBondContact O-CG 3.26Å; M208-M212 PolarHBondContact O-N 3.41Å
209	K	97.1	Very high	95.1	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-61	-42.2	169.5	-65	-178.9	178.8	-175.1	0	111.6	L21 V24 F200 P201 M202 L204 D205 V206 R207 M212 I213	L21-K209 HydrophobicContact CB-CB 4.41Å; L21-K209 HydrophobicContact CB-CD 4.17Å; L21-K209 HydrophobicContact CD1-CB 4.08Å; L21-K209 VanDerWaalsContact O-CD 3.29Å; L21-K209 WeakPolarHBondContact O-CD 3.35Å; L21-K209 PolarHBondContact O-NZ 3.06Å; V24-K209 PolarHBondContact O-NZ 3.25Å; F200-K209 HydrophobicContact CD1-CG 4.37Å; F200-K209 HydrophobicContact CD2-CD 3.79Å; F200-K209 HydrophobicContact CD2-CG 3.76Å; F200-K209 HydrophobicContact CE1-CB 4.22Å; F200-K209 HydrophobicContact CE1-CG 4.24Å; F200-K209 HydrophobicContact CE2-CB 4.26Å; F200-K209 HydrophobicContact CE2-CD 3.35Å; F200-K209 HydrophobicContact CE2-CG 3.61Å; F200-K209 HydrophobicContact CG-CG 4.16Å; F200-K209 HydrophobicContact CZ-CB 4Å; F200-K209 HydrophobicContact CZ-CD 3.91Å; F200-K209 HydrophobicContact CZ-CG 3.87Å; P201-K209 VanDerWaalsContact O-CE 3.28Å; P201-K209 WeakPolarHBondContact O-CE 3.45Å; M202-K209 PolarHBondContact O-NZ 3.35Å; L204-K209 HydrophobicContact CB-CG 4.28Å; L204-K209 HydrophobicContact CD2-CG 4.08Å; L204-K209 HydrophobicContact CG-CG 4.28Å; L204-K209 VanDerWaalsContact O-CE 3.23Å; L204-K209 WeakPolarHBondContact O-CE 3.49Å; D205-K209 PolarHBondContact O-N 2.7Å; V206-K209 PolarHBondContact O-N 2.83Å; R207-K209 VanDerWaalsContact C-N 3.34Å; R207-K209 PolarHBondContact O-N 2.79Å; K209-M212 WeakPolarHBondContact O-CB 3.45Å; K209-M212 PolarHBondContact O-N 2.83Å; K209-I213 PolarHBondContact O-N 2.92Å; K209-I213 VanDerWaalsContact O-N 3.16Å
210	A	97.4	Very high	94.6	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-62.9	-41.4	172.9	0	0	0	0	0	111.8	L18 L21 I92 V114 V206 R207 M208 M212 I213 G214	L18-A210 HydrophobicContact CD1-CB 4.04Å; L18-A210 HydrophobicContact CD2-CB 4.21Å; L21-A210 HydrophobicContact CD1-CB 4.29Å; I92-A210 HydrophobicContact CD1-CB 3.87Å; I92-A210 HydrophobicContact CG1-CB 4.44Å; V114-A210 HydrophobicContact CG1-CB 4.38Å; V206-A210 PolarHBondContact O-N 2.95Å; R207-A210 WeakPolarHBondContact O-CB 3.28Å; R207-A210 PolarHBondContact O-N 3.43Å; R207-A210 VanDerWaalsContact O-N 3.16Å; M208-A210 VanDerWaalsContact C-N 3.34Å; A210-M212 VanDerWaalsContact C-N 3.3Å; A210-M212 PolarHBondContact O-N 2.8Å; A210-I213 WeakPolarHBondContact O-CB 3.31Å; A210-I213 PolarHBondContact O-N 2.78Å; A210-I213 VanDerWaalsContact O-N 3.16Å; A210-G214 PolarHBondContact O-N 3.26Å
211	V	98	Very high	94	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-63.2	-35.1	174.4	-176.5	0	0	0	0	111.7	V114 V122 V125 V138 R207 M208 I213 G214 A215	V114-V211 HydrophobicContact CB-CG2 4.21Å; V114-V211 HydrophobicContact CG2-CG1 4.49Å; V122-V211 HydrophobicContact CG2-CG2 4.31Å; V125-V211 HydrophobicContact CG2-CG1 3.56Å; V138-V211 HydrophobicContact CG1-CB 4.27Å; V138-V211 HydrophobicContact CG1-CG1 3.68Å; R207-V211 WeakPolarHBondContact O-CG2 3.14Å; R207-V211 PolarHBondContact O-N 3.35Å; M208-V211 HydrophobicContact CE-CG2 4.45Å; M208-V211 CarbonylContact O-C 3.44Å; M208-V211 PolarHBondContact O-N 2.86Å; V211-I213 VanDerWaalsContact C-N 3.33Å; V211-I213 PolarHBondContact O-N 3.05Å; V211-G214 PolarHBondContact O-N 3.48Å; V211-A215 PolarHBondContact O-N 3.12Å
212	M	97.4	Very high	93.3	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-64	-36.1	173.8	-68.9	-49.5	95.6	0	0	112.6	V138 L147 I149 I166 I198 F200 M208 K209 A210 G214 A215 C216	V138-M212 HydrophobicContact CB-CE 3.86Å; V138-M212 HydrophobicContact CG1-CE 3.31Å; V138-M212 HydrophobicContact CG2-CE 3.28Å; V138-M212 HydrophobicContact CG2-SD 4.41Å; L147-M212 HydrophobicContact CD1-CE 4.36Å; I149-M212 HydrophobicContact CD1-CE 4.44Å; I149-M212 HydrophobicContact CD1-SD 4.14Å; I166-M212 HydrophobicContact CD1-CG 4.27Å; I166-M212 HydrophobicContact CD1-SD 3.73Å; I166-M212 HydrophobicContact CG1-SD 4.23Å; I166-M212 HydrophobicContact CG2-SD 4.34Å; I198-M212 HydrophobicContact CG2-CB 4.09Å; F200-M212 HydrophobicContact CD1-CB 4.24Å; F200-M212 HydrophobicContact CD1-CG 4.19Å; F200-M212 HydrophobicContact CE1-CB 4.49Å; M208-M212 WeakPolarHBondContact O-CG 3.26Å; M208-M212 PolarHBondContact O-N 3.41Å; K209-M212 WeakPolarHBondContact O-CB 3.45Å; K209-M212 PolarHBondContact O-N 2.83Å; A210-M212 VanDerWaalsContact C-N 3.3Å; A210-M212 PolarHBondContact O-N 2.8Å; M212-G214 VanDerWaalsContact C-N 3.34Å; M212-A215 PolarHBondContact O-N 3.3Å; M212-C216 PolarHBondContact O-N 3.32Å
213	I	96.8	Very high	92.5	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-61.1	-46.6	172.7	-65	168.7	0	0	0	109.5	L21 L27 I29 I92 I198 K209 A210 V211 A215 C216 F217	L21-I213 HydrophobicContact CD1-CD1 4.3Å; L21-I213 HydrophobicContact CD2-CD1 4.25Å; L27-I213 HydrophobicContact CD1-CD1 3.73Å; L27-I213 HydrophobicContact CD1-CG1 3.94Å; I29-I213 HydrophobicContact CD1-CG2 4.23Å; I92-I213 HydrophobicContact CD1-CD1 4.16Å; I198-I213 HydrophobicContact CD1-CG1 4.21Å; K209-I213 PolarHBondContact O-N 2.92Å; K209-I213 VanDerWaalsContact O-N 3.16Å; A210-I213 WeakPolarHBondContact O-CB 3.31Å; A210-I213 PolarHBondContact O-N 2.78Å; A210-I213 VanDerWaalsContact O-N 3.16Å; V211-I213 VanDerWaalsContact C-N 3.33Å; V211-I213 PolarHBondContact O-N 3.05Å; I213-A215 PolarHBondContact O-N 3.49Å; I213-C216 WeakPolarHBondContact O-CB 3.43Å; I213-C216 PolarHBondContact O-N 2.95Å; I213-F217 HydrophobicContact CG2-CD2 4.15Å; I213-F217 HydrophobicContact CG2-CE2 3.6Å; I213-F217 HydrophobicContact CG2-CZ 4.45Å; I213-F217 VanDerWaalsContact O-CD2 3.29Å; I213-F217 WeakPolarHBondContact O-CD2 3.34Å; I213-F217 PolarHBondContact O-N 2.84Å
214	G	96.3	Very high	91.6	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-60.1	-41.9	174.1	0	0	0	0	0	113.4	A210 V211 M212 C216 F217 L218	A210-G214 PolarHBondContact O-N 3.26Å; V211-G214 PolarHBondContact O-N 3.48Å; M212-G214 VanDerWaalsContact C-N 3.34Å; G214-C216 VanDerWaalsContact C-N 3.3Å; G214-C216 PolarHBondContact O-N 3.47Å; G214-F217 PolarHBondContact O-N 3.33Å; G214-L218 PolarHBondContact O-N 2.94Å
215	A	96.4	Very high	90.3	Very high	1 Å²	1	17.2 Å²	17.2	1%	0.008	8%	0.082	C	C	.	.	H	α-helix	trans	-61.4	-38.8	175.9	0	0	0	0	0	112.1	V125 I149 I178 V211 M212 I213 L218 I219	V125-A215 HydrophobicContact CG1-CB 4.04Å; V125-A215 HydrophobicContact CG2-CB 3.78Å; I149-A215 HydrophobicContact CD1-CB 3.68Å; I178-A215 HydrophobicContact CD1-CB 4.1Å; V211-A215 PolarHBondContact O-N 3.12Å; M212-A215 PolarHBondContact O-N 3.3Å; I213-A215 PolarHBondContact O-N 3.49Å; A215-L218 PolarHBondContact O-N 2.8Å; A215-I219 WeakPolarHBondContact O-CB 3.24Å; A215-I219 VanDerWaalsContact O-CG1 3.29Å; A215-I219 WeakPolarHBondContact O-CG1 3.41Å; A215-I219 PolarHBondContact O-N 2.85Å
216	C	94.6	Very high	88.3	Confident	1 Å²	1	18.5 Å²	18.5	1%	0.007	9%	0.093	C	C	.	.	H	α-helix	trans	-61.5	-45	176	-170.9	0	0	0	0	111.6	I29 I178 F196 I198 M212 I213 G214 I219 D220	I29-C216 HydrophobicContact CD1-CB 4.02Å; I178-C216 HydrophobicContact CD1-CB 4.41Å; I178-C216 HydrophobicContact CG2-CB 4.24Å; F196-C216 WeakPolarHBondContact CB-SG 3.14Å; I198-C216 HydrophobicContact CD1-CB 3.57Å; I198-C216 HydrophobicContact CG1-CB 4.01Å; M212-C216 PolarHBondContact O-N 3.32Å; I213-C216 WeakPolarHBondContact O-CB 3.43Å; I213-C216 PolarHBondContact O-N 2.95Å; G214-C216 VanDerWaalsContact C-N 3.3Å; G214-C216 PolarHBondContact O-N 3.47Å; C216-I219 PolarHBondContact O-N 3.2Å; C216-D220 WeakPolarHBondContact O-CB 3.45Å; C216-D220 PolarHBondContact O-N 2.81Å
217	F	92.6	Very high	85.7	Confident	2 Å²	2	22.8 Å²	22.8	1%	0.009	12%	0.119	C	C	.	.	H	α-helix	trans	-63.5	-42.3	174.3	-68.4	-57.4	0	0	0	111.9	I29 Y48 A61 I81 V83 I213 G214 I219 D220 F221	I29-F217 HydrophobicContact CD1-CE1 4.34Å; I29-F217 HydrophobicContact CD1-CE2 4.43Å; I29-F217 HydrophobicContact CD1-CZ 4.09Å; I29-F217 HydrophobicContact CG2-CE1 3.86Å; I29-F217 HydrophobicContact CG2-CZ 4.22Å; Y48-F217 HydrophobicContact CD1-CE1 4.13Å; Y48-F217 AromaticContact CD2-CE1 3.83Å; Y48-F217 HydrophobicContact CD2-CE1 3.83Å; Y48-F217 HydrophobicContact CE1-CE1 4.38Å; Y48-F217 HydrophobicContact CE2-CD1 4.47Å; Y48-F217 HydrophobicContact CE2-CE1 4.13Å; Y48-F217 AromaticContact CG-CE1 3.84Å; Y48-F217 HydrophobicContact CG-CE1 3.84Å; A61-F217 HydrophobicContact CB-CE1 4.32Å; A61-F217 HydrophobicContact CB-CE2 4.16Å; A61-F217 HydrophobicContact CB-CZ 3.5Å; I81-F217 HydrophobicContact CD1-CB 3.69Å; I81-F217 HydrophobicContact CD1-CD1 3.76Å; I81-F217 HydrophobicContact CD1-CD2 4.02Å; I81-F217 HydrophobicContact CD1-CE1 4.4Å; I81-F217 HydrophobicContact CD1-CG 3.56Å; I81-F217 HydrophobicContact CG2-CD2 4.25Å; I81-F217 HydrophobicContact CG2-CE2 3.97Å; I81-F217 HydrophobicContact CG2-CZ 4.2Å; V83-F217 HydrophobicContact CG2-CE2 4.39Å; I213-F217 HydrophobicContact CG2-CD2 4.15Å; I213-F217 HydrophobicContact CG2-CE2 3.6Å; I213-F217 HydrophobicContact CG2-CZ 4.45Å; I213-F217 VanDerWaalsContact O-CD2 3.29Å; I213-F217 WeakPolarHBondContact O-CD2 3.34Å; I213-F217 PolarHBondContact O-N 2.84Å; G214-F217 PolarHBondContact O-N 3.33Å; F217-I219 VanDerWaalsContact C-N 3.3Å; F217-I219 PolarHBondContact O-N 3.31Å; F217-D220 PolarHBondContact O-N 3.08Å; F217-F221 WeakPolarHBondContact O-CD2 3.4Å; F217-F221 PolarHBondContact O-N 3.41Å
218	L	90.9	Very high	82.6	Confident	1 Å²	1	30.7 Å²	30.7	1%	0.005	17%	0.165	C	C	.	.	H	α-helix	trans	-57.6	-45.2	176.2	-172.3	58.2	0	0	0	111.9	Q110 L112 V125 F136 G214 A215 M222	Q110-L218 HydrophobicContact CB-CD1 4.24Å; L112-L218 HydrophobicContact CB-CD2 4.23Å; L112-L218 HydrophobicContact CD1-CB 4.06Å; L112-L218 HydrophobicContact CD1-CD1 4.42Å; V125-L218 HydrophobicContact CB-CD2 4.25Å; V125-L218 HydrophobicContact CG1-CD2 3.78Å; F136-L218 HydrophobicContact CD1-CD2 4.13Å; F136-L218 HydrophobicContact CE1-CD2 3.98Å; F136-L218 HydrophobicContact CE1-CG 4.49Å; G214-L218 PolarHBondContact O-N 2.94Å; A215-L218 PolarHBondContact O-N 2.8Å; L218-M222 HydrophobicContact CD1-CG 4.13Å; L218-M222 HydrophobicContact CD1-SD 3.84Å; L218-M222 HydrophobicContact CD2-SD 4.36Å; L218-M222 HydrophobicContact CG-CG 4.39Å; L218-M222 HydrophobicContact CG-SD 3.78Å; L218-M222 VanDerWaalsContact O-CB 3.29Å; L218-M222 WeakPolarHBondContact O-CB 3.36Å; L218-M222 WeakPolarHBondContact O-CG 3.4Å; L218-M222 PolarHBondContact O-N 2.83Å
219	I	89.3	Confident	81.9	Confident	1 Å²	1	31.9 Å²	31.9	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-63.5	-45.5	178.7	-72.5	164.3	0	0	0	110.9	F136 I149 F164 I178 A215 C216 F217 M222 F223 F224	F136-I219 HydrophobicContact CE2-CG1 4.21Å; F136-I219 HydrophobicContact CZ-CG1 4.43Å; I149-I219 HydrophobicContact CG2-CD1 4.44Å; F164-I219 HydrophobicContact CB-CD1 4.22Å; F164-I219 HydrophobicContact CD1-CD1 3.82Å; F164-I219 HydrophobicContact CD1-CG1 4.25Å; F164-I219 HydrophobicContact CD2-CD1 4.28Å; F164-I219 HydrophobicContact CD2-CG2 3.9Å; F164-I219 HydrophobicContact CE1-CD1 4.23Å; F164-I219 HydrophobicContact CE1-CG1 4.15Å; F164-I219 HydrophobicContact CE1-CG2 4.1Å; F164-I219 HydrophobicContact CE2-CG2 3.37Å; F164-I219 HydrophobicContact CG-CD1 3.87Å; F164-I219 HydrophobicContact CG-CG2 4.46Å; F164-I219 HydrophobicContact CZ-CG1 4.41Å; F164-I219 HydrophobicContact CZ-CG2 3.5Å; I178-I219 HydrophobicContact CB-CD1 4.48Å; I178-I219 HydrophobicContact CD1-CD1 3.9Å; I178-I219 HydrophobicContact CG2-CD1 4.36Å; A215-I219 WeakPolarHBondContact O-CB 3.24Å; A215-I219 VanDerWaalsContact O-CG1 3.29Å; A215-I219 WeakPolarHBondContact O-CG1 3.41Å; A215-I219 PolarHBondContact O-N 2.85Å; C216-I219 PolarHBondContact O-N 3.2Å; F217-I219 VanDerWaalsContact C-N 3.3Å; F217-I219 PolarHBondContact O-N 3.31Å; I219-M222 PolarHBondContact O-N 3.29Å; I219-F223 HydrophobicContact CG2-CD2 4.22Å; I219-F223 WeakPolarHBondContact O-CD2 2.94Å; I219-F223 PolarHBondContact O-N 3.31Å; I219-F224 HydrophobicContact CG2-CD2 4.44Å; I219-F224 HydrophobicContact CG2-CE2 4.05Å
220	D	85.4	Confident	81.1	Confident	11 Å²	11	33.5 Å²	33.5	6%	0.059	18%	0.181	C	C	.	.	H	α-helix	trans	-55.7	-53.6	176.5	-175	32.6	0	0	0	111.3	Y48 F196 C216 F217 M222 F223 F224 E225	Y48-D220 PolarHBondContact OH-OD2 3.01Å; F196-D220 HydrophobicContact CE1-CB 4.33Å; F196-D220 HydrophobicContact CE2-CB 3.79Å; F196-D220 WeakPolarHBondContact CE2-OD1 3.49Å; F196-D220 HydrophobicContact CZ-CB 3.68Å; F196-D220 WeakPolarHBondContact CZ-OD1 3.49Å; C216-D220 WeakPolarHBondContact O-CB 3.45Å; C216-D220 PolarHBondContact O-N 2.81Å; F217-D220 PolarHBondContact O-N 3.08Å; D220-M222 VanDerWaalsContact C-N 3.33Å; D220-M222 PolarHBondContact O-N 3.33Å; D220-F223 PolarHBondContact O-N 3.42Å; D220-F224 CarbonylContact O-C 3.59Å; D220-F224 WeakPolarHBondContact O-CA 2.96Å; D220-F224 WeakPolarHBondContact O-CB 3.39Å; D220-F224 PolarHBondContact O-N 3.29Å; D220-E225 PolarHBondContact O-N 3.29Å
221	F	81.6	Confident	80.2	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-65.4	-33	-179	-81.1	-114.3	0	0	0	113.4	Y48 E63 P75 F79 I81 F217 E225	Y48-F221 WeakPolarHBondContact OH-CE2 3.42Å; E63-F221 HydrophobicContact CG-CZ 4.35Å; E63-F221 WeakPolarHBondContact OE2-CE1 3.39Å; E63-F221 VanDerWaalsContact OE2-CZ 3.28Å; E63-F221 WeakPolarHBondContact OE2-CZ 2.89Å; P75-F221 WeakPolarHBondContact CB-O 3.33Å; F79-F221 HydrophobicContact CB-CE1 3.97Å; F79-F221 HydrophobicContact CD1-CB 4.38Å; F79-F221 AromaticContact CD1-CD1 3.33Å; F79-F221 HydrophobicContact CD1-CD1 3.33Å; F79-F221 AromaticContact CD1-CE1 3.51Å; F79-F221 HydrophobicContact CD1-CE1 3.51Å; F79-F221 AromaticContact CD1-CG 3.86Å; F79-F221 HydrophobicContact CD1-CG 3.86Å; F79-F221 HydrophobicContact CD1-CZ 4.23Å; F79-F221 HydrophobicContact CE1-CB 3.76Å; F79-F221 AromaticContact CE1-CD1 3.56Å; F79-F221 HydrophobicContact CE1-CD1 3.56Å; F79-F221 HydrophobicContact CE1-CD2 4.13Å; F79-F221 HydrophobicContact CE1-CE1 4.07Å; F79-F221 AromaticContact CE1-CG 3.56Å; F79-F221 HydrophobicContact CE1-CG 3.56Å; F79-F221 HydrophobicContact CG-CD1 4.11Å; F79-F221 AromaticContact CG-CE1 3.81Å; F79-F221 HydrophobicContact CG-CE1 3.81Å; F79-F221 HydrophobicContact CG-CZ 4.25Å; F79-F221 HydrophobicContact CZ-CD2 4.4Å; F79-F221 HydrophobicContact CZ-CG 4.25Å; I81-F221 HydrophobicContact CD1-CE2 3.74Å; I81-F221 HydrophobicContact CD1-CZ 3.94Å; F217-F221 WeakPolarHBondContact O-CD2 3.4Å; F217-F221 PolarHBondContact O-N 3.41Å; F221-E225 WeakPolarHBondContact CD1-OE2 3.43Å
222	M	79.9	Confident	79.1	Confident	34 Å²	34	37.5 Å²	37.5	17%	0.167	20%	0.202	C	C	.	.	H	α-helix	trans	-79	-34.5	-177.9	-76.5	-176.7	66.9	0	0	113.9	Q110 F136 L218 I219 D220	Q110-M222 HydrophobicContact CB-CE 4.45Å; Q110-M222 HydrophobicContact CB-SD 3.96Å; Q110-M222 HydrophobicContact CG-CE 3.93Å; Q110-M222 HydrophobicContact CG-SD 3.82Å; F136-M222 HydrophobicContact CE1-CE 4.39Å; F136-M222 HydrophobicContact CE1-SD 3.89Å; F136-M222 HydrophobicContact CZ-CE 4.38Å; F136-M222 HydrophobicContact CZ-SD 4.09Å; L218-M222 HydrophobicContact CD1-CG 4.13Å; L218-M222 HydrophobicContact CD1-SD 3.84Å; L218-M222 HydrophobicContact CD2-SD 4.36Å; L218-M222 HydrophobicContact CG-CG 4.39Å; L218-M222 HydrophobicContact CG-SD 3.78Å; L218-M222 VanDerWaalsContact O-CB 3.29Å; L218-M222 WeakPolarHBondContact O-CB 3.36Å; L218-M222 WeakPolarHBondContact O-CG 3.4Å; L218-M222 PolarHBondContact O-N 2.83Å; I219-M222 PolarHBondContact O-N 3.29Å; D220-M222 VanDerWaalsContact C-N 3.33Å; D220-M222 PolarHBondContact O-N 3.33Å
223	F	77	Confident	78	Confident	75 Å²	75	39.8 Å²	39.8	33%	0.329	22%	0.215	S	C	.	.	H	α-helix	trans	-117.8	-18.3	-169.4	-63.2	-73.1	0	0	0	114.4	P134 F136 F164 I219 D220	P134-F223 HydrophobicContact CB-CE1 4.26Å; P134-F223 HydrophobicContact CB-CE2 4.07Å; P134-F223 HydrophobicContact CB-CZ 3.46Å; P134-F223 VanDerWaalsContact CB-CZ 3.46Å; P134-F223 HydrophobicContact CG-CE1 4.34Å; P134-F223 HydrophobicContact CG-CE2 4.32Å; P134-F223 HydrophobicContact CG-CZ 3.83Å; F136-F223 HydrophobicContact CE2-CE2 4.45Å; F136-F223 HydrophobicContact CZ-CE2 4.04Å; F164-F223 HydrophobicContact CE1-CD2 4.38Å; F164-F223 HydrophobicContact CE1-CE2 4.14Å; F164-F223 AromaticContact CZ-CD2 3.88Å; F164-F223 HydrophobicContact CZ-CD2 3.88Å; F164-F223 HydrophobicContact CZ-CE2 4.09Å; I219-F223 HydrophobicContact CG2-CD2 4.22Å; I219-F223 WeakPolarHBondContact O-CD2 2.94Å; I219-F223 PolarHBondContact O-N 3.31Å; D220-F223 PolarHBondContact O-N 3.42Å
224	F	74.1	Confident	76.7	Confident	32 Å²	32	42.5 Å²	42.5	14%	0.14	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-132.7	-21.9	-164.4	-58.3	-56.9	0	0	0	114.6	V162 F164 K180 F196 I219 D220 T226	V162-F224 HydrophobicContact CB-CZ 4.08Å; V162-F224 HydrophobicContact CG1-CZ 4.09Å; V162-F224 HydrophobicContact CG2-CZ 4.29Å; F164-F224 HydrophobicContact CE2-CE2 4.24Å; K180-F224 HydrophobicContact CB-CE2 4.03Å; K180-F224 HydrophobicContact CB-CZ 3.96Å; K180-F224 HydrophobicContact CD-CB 4.3Å; K180-F224 HydrophobicContact CD-CD1 3.26Å; K180-F224 HydrophobicContact CD-CD2 3.68Å; K180-F224 HydrophobicContact CD-CE1 3.21Å; K180-F224 HydrophobicContact CD-CE2 3.65Å; K180-F224 HydrophobicContact CD-CG 3.47Å; K180-F224 VanDerWaalsContact CD-CG 3.47Å; K180-F224 HydrophobicContact CD-CZ 3.4Å; K180-F224 HydrophobicContact CG-CE1 4.46Å; K180-F224 HydrophobicContact CG-CE2 4.37Å; K180-F224 HydrophobicContact CG-CZ 4.28Å; K180-F224 VanDerWaalsContact NZ-CG 3.31Å; F196-F224 AromaticContact CE1-CD2 3.66Å; F196-F224 HydrophobicContact CE1-CD2 3.66Å; F196-F224 AromaticContact CE1-CE2 3.86Å; F196-F224 HydrophobicContact CE1-CE2 3.86Å; F196-F224 HydrophobicContact CZ-CB 4.23Å; F196-F224 AromaticContact CZ-CD2 3.55Å; F196-F224 HydrophobicContact CZ-CD2 3.55Å; F196-F224 HydrophobicContact CZ-CE2 4.21Å; F196-F224 HydrophobicContact CZ-CG 4.16Å; I219-F224 HydrophobicContact CG2-CD2 4.44Å; I219-F224 HydrophobicContact CG2-CE2 4.05Å; D220-F224 CarbonylContact O-C 3.59Å; D220-F224 WeakPolarHBondContact O-CA 2.96Å; D220-F224 WeakPolarHBondContact O-CB 3.39Å; D220-F224 PolarHBondContact O-N 3.29Å; F224-T226 PolarHBondContact O-N 2.02Å
225	E	68.3	Low	75.4	Confident	41 Å²	41	45.5 Å²	45.5	19%	0.192	25%	0.245	C	C	.	.			trans	-63.7	107.8	167.7	-168	178.3	-159.2	0	0	109.2	N46 R70 R77 D220 F221	N46-E225 PolarHBondContact ND2-OE1 2.64Å; R70-E225 IonicContact CZ-OE1 2.85Å; R70-E225 IonicContact NE-OE1 2.7Å; R70-E225 IonicContact NH2-OE1 3.97Å; R70-E225 PolarHBondContact NH2-OE1 3.25Å; R77-E225 IonicContact CZ-OE1 3.42Å; R77-E225 IonicContact CZ-OE2 2.8Å; R77-E225 IonicContact NE-OE1 3.74Å; R77-E225 IonicContact NE-OE2 2.8Å; R77-E225 PolarHBondContact NE-OE2 3.35Å; R77-E225 VanDerWaalsContact NE-OE2 3.08Å; R77-E225 IonicContact NH2-OE1 3.98Å; R77-E225 PolarHBondContact NH2-OE1 2.96Å; R77-E225 IonicContact NH2-OE2 3.32Å; R77-E225 PolarHBondContact NH2-OE2 2.93Å; D220-E225 PolarHBondContact O-N 3.29Å; F221-E225 WeakPolarHBondContact CD1-OE2 3.43Å
226	T	52	Low	73.7	Confident	112 Å²	112	48.9 Å²	48.9	69%	0.687	26%	0.264	S	S	*	.			trans	-84.5	130.2	174.4	-43.9	0	0	0	0	107.9	F224 N228	F224-T226 PolarHBondContact O-N 2.02Å; T226-N228 PolarHBondContact O-N 3.21Å
227	T	41.4	Very low	72	Confident	107 Å²	107	52.9 Å²	52.9	66%	0.656	29%	0.285	S	S	*	.			trans	-57.1	102.3	169.4	-14.8	0	0	0	0	108.2
228	N	31.2	Very low	70.1	Confident	219 Å²	219	57.5 Å²	57.5	100%	1.171	31%	0.31	S	S	*	.			trans	-68.6	0	167.4	-79.9	-35.5	0	0	0	110	T226	T226-N228 PolarHBondContact O-N 3.21Å

Retrieved 228 of 228 residues in 1784.8 ms (Link to these results)

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