A0A087XEL9_POEFO Loading...

Ig-like domain-containing protein

AlphaFold DB , UniProt , Accession A0A087XEL9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 349 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	Y	49.7	Very low	40.6	Very low	296 Å²	296	130.7 Å²	130.7	100%	1.161	75%	0.746	S	S	*	*				0	77.2	0	-105.7	-100.2	0	0	0	109.2
2	S	41.5	Very low	40.5	Very low	106 Å²	106	128.5 Å²	128.5	74%	0.741	74%	0.737	S	S	*	*			trans	-171.8	128.4	176.5	-176.3	0	0	0	0	109.3	A4	S2-A4 PolarHBondContact O-N 3.25Å; S2-A4 VanDerWaalsContact O-N 3.08Å
3	S	43.9	Very low	40.5	Very low	123 Å²	123	129.7 Å²	129.7	86%	0.86	74%	0.738	S	S	*	*	S	Bend	trans	57.1	26.3	143.1	-161.9	0	0	0	0	121.4
4	A	40.3	Very low	40.6	Very low	73 Å²	73	127.6 Å²	127.6	60%	0.603	74%	0.735	S	S	*	*	S	Bend	trans	-126.4	-0.1	174.1	0	0	0	0	0	115.9	S2	S2-A4 PolarHBondContact O-N 3.25Å; S2-A4 VanDerWaalsContact O-N 3.08Å
5	H	40.3	Very low	40.3	Very low	177 Å²	177	131.1 Å²	131.1	82%	0.819	74%	0.739	S	S	*	*	S	Bend	trans	-117.4	3.1	-174.1	-72.4	-12.8	0	0	0	115.6
6	K	40.2	Very low	40.3	Very low	196 Å²	196	136.1 Å²	136.1	85%	0.852	74%	0.744	S	S	*	*	S	Bend	trans	-104	-6.2	174.3	-71.1	-172.8	177.2	-177	0	114.6
7	A	40.1	Very low	40.5	Very low	85 Å²	85	139.3 Å²	139.3	70%	0.702	75%	0.749	S	S	*	*	S	Bend	trans	-90.4	-15.3	177.4	0	0	0	0	0	114
8	A	37.7	Very low	40.6	Very low	70 Å²	70	140.5 Å²	140.5	58%	0.579	76%	0.755	S	S	*	*	S	Bend	trans	-86.4	-14.7	-176.8	0	0	0	0	0	114.3
9	A	38.1	Very low	40.4	Very low	69 Å²	69	143.1 Å²	143.1	57%	0.57	76%	0.759	S	S	*	*	S	Bend	trans	-90.7	-14.9	-176.6	0	0	0	0	0	114.3
10	F	37.9	Very low	40.4	Very low	177 Å²	177	140.8 Å²	140.8	78%	0.776	75%	0.752	S	S	*	*	S	Bend	trans	-101.4	-11.7	179.7	-92.7	-85.8	0	0	0	114.4
11	A	36.5	Very low	40.5	Very low	66 Å²	66	139.7 Å²	139.7	55%	0.545	75%	0.751	S	S	.	*	S	Bend	trans	-87.9	-11.8	178	0	0	0	0	0	113.9
12	V	39.5	Very low	40.4	Very low	104 Å²	104	136 Å²	136	63%	0.63	74%	0.736	S	S	*	*	S	Bend	trans	-94.9	-12.7	-176.3	-175.4	0	0	0	0	112.9
13	L	41	Very low	40.8	Very low	144 Å²	144	137.6 Å²	137.6	75%	0.754	74%	0.736	S	S	*	*	S	Bend	trans	-98.2	4.5	-177.8	-77.7	167.6	0	0	0	115.4
14	S	41.1	Very low	41.3	Very low	100 Å²	100	142.9 Å²	142.9	70%	0.699	74%	0.737	S	S	*	*	S	Bend	trans	-115.3	5.3	-179.8	-72.2	0	0	0	0	115.7
15	F	37.2	Very low	42.8	Very low	180 Å²	180	142.6 Å²	142.6	79%	0.789	73%	0.728	S	S	*	*	S	Bend	trans	-97.6	3.8	176.3	-89.8	-82.3	0	0	0	115.1
16	Y	39.4	Very low	45	Very low	211 Å²	211	139.6 Å²	139.6	83%	0.827	71%	0.714	S	S	*	*	S	Bend	trans	-92.5	8.9	176.8	-83	-77.1	0	0	0	114.8
17	K	44.2	Very low	47.5	Very low	191 Å²	191	136.5 Å²	136.5	83%	0.83	70%	0.701	S	S	*	*	S	Bend	trans	-122.2	16.7	-173.5	-84.8	-160.1	177.6	-172.5	0	117.1
18	L	42.2	Very low	50.1	Low	161 Å²	161	132.7 Å²	132.7	84%	0.843	67%	0.668	S	S	*	*			trans	-146.9	55.3	173	-70.3	172.8	0	0	0	112
19	F	36.3	Very low	53	Low	189 Å²	189	130.2 Å²	130.2	83%	0.829	65%	0.647	S	S	*	*			trans	-93.9	112.1	139.9	-83	-84.9	0	0	0	104.9	T21	F19-T21 VanDerWaalsContact C-N 3.29Å; F19-T21 PolarHBondContact O-N 3.21Å
20	P	40	Very low	55.8	Low	97 Å²	97	127 Å²	127	63%	0.63	62%	0.62	S	S	*	*			trans	-58	110.4	160	18.7	-15.9	0	0	0	104.1	Y22	P20-Y22 PolarHBondContact O-N 2.96Å
21	T	44.5	Very low	58.7	Low	118 Å²	118	119.1 Å²	119.1	72%	0.724	59%	0.586	S	S	*	*			trans	-51.4	102.6	151.3	44.7	0	0	0	0	102.9	F19 L23	F19-T21 VanDerWaalsContact C-N 3.29Å; F19-T21 PolarHBondContact O-N 3.21Å; T21-L23 PolarHBondContact O-N 2.75Å
22	Y	46.3	Very low	61.7	Low	219 Å²	219	116.8 Å²	116.8	86%	0.859	56%	0.563	S	S	*	*			trans	-56.8	94.2	163.2	-101.8	-98.1	0	0	0	102.8	P20 R24	P20-Y22 PolarHBondContact O-N 2.96Å; Y22-R24 PolarHBondContact O-N 3.46Å
23	L	49.8	Very low	64.4	Low	139 Å²	139	113.2 Å²	113.2	73%	0.728	54%	0.541	S	S	*	.			trans	-58.9	97.2	160.8	-83.1	163.7	0	0	0	101.8	T21 T25	T21-L23 PolarHBondContact O-N 2.75Å; L23-T25 PolarHBondContact O-N 3.2Å
24	R	55.4	Low	67.2	Low	235 Å²	235	107 Å²	107	89%	0.887	51%	0.507	S	S	*	.			trans	-62.2	102.7	173.4	-178.1	178.6	-179.8	-174.1	-1.6	103.5	Y22 E26	Y22-R24 PolarHBondContact O-N 3.46Å; R24-E26 PolarHBondContact O-N 3.36Å; R24-E26 VanDerWaalsContact O-N 3.08Å
25	T	70.3	Confident	69.9	Low	67 Å²	67	102.9 Å²	102.9	41%	0.411	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-61.1	118.7	179	-15.5	0	0	0	0	107.1	L23 K27 E130 T131	L23-T25 PolarHBondContact O-N 3.2Å; T25-K27 PolarHBondContact O-N 2.75Å; T25-E130 WeakPolarHBondContact CB-OE1 3.46Å; T25-E130 VanDerWaalsContact CG2-CD 3.4Å; T25-E130 HydrophobicContact CG2-CG 3.19Å; T25-E130 WeakPolarHBondContact CG2-OE1 3.46Å; T25-E130 PolarHBondContact OG1-OE1 2.94Å; T25-T131 WeakPolarHBondContact CG2-O 3.18Å
26	E	87.3	Confident	72.7	Confident	113 Å²	113	94.6 Å²	94.6	53%	0.528	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-75.6	126.6	-178.2	-160	176	174.9	0	0	108.3	R24 H28 E130 T131	R24-E26 PolarHBondContact O-N 3.36Å; R24-E26 VanDerWaalsContact O-N 3.08Å; E26-H28 VanDerWaalsContact CD-NE2 3.34Å; E26-H28 WeakPolarHBondContact CG-NE2 3.35Å; E26-H28 IonicContact OE1-CE1 3.37Å; E26-H28 PolarHBondContact OE1-CE1 2.89Å; E26-H28 IonicContact OE1-NE2 3.31Å; E26-H28 IonicContact OE2-NE2 3.57Å; E26-E130 WeakPolarHBondContact O-CA 3.46Å; E26-T131 PolarHBondContact O-N 3.37Å; E26-T131 PolarHBondContact O-OG1 3.32Å
27	K	93.2	Very high	75.4	Confident	131 Å²	131	85.8 Å²	85.8	57%	0.57	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.6	135.6	176.7	-69.8	-170.2	176.9	-170.4	0	108.8	T25 G129	T25-K27 PolarHBondContact O-N 2.75Å; K27-G129 WeakPolarHBondContact CA-O 3.22Å
28	H	94.9	Very high	77.8	Confident	6 Å²	6	78 Å²	78	3%	0.028	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	152	179	-62.1	-75.8	0	0	0	110.6	E26 D56 E128 G129 T131 L137 M199 R203	E26-H28 VanDerWaalsContact CD-NE2 3.34Å; E26-H28 WeakPolarHBondContact CG-NE2 3.35Å; E26-H28 IonicContact OE1-CE1 3.37Å; E26-H28 PolarHBondContact OE1-CE1 2.89Å; E26-H28 IonicContact OE1-NE2 3.31Å; E26-H28 IonicContact OE2-NE2 3.57Å; H28-D56 WeakPolarHBondContact CA-OD1 3.23Å; H28-D56 WeakPolarHBondContact CB-OD1 3.42Å; H28-D56 IonicContact CE1-OD2 2.74Å; H28-D56 IonicContact CG-OD1 3.65Å; H28-D56 IonicContact CG-OD2 3.73Å; H28-D56 IonicContact ND1-OD1 3.29Å; H28-D56 PolarHBondContact ND1-OD1 3.47Å; H28-D56 IonicContact ND1-OD2 3.01Å; H28-D56 PolarHBondContact ND1-OD2 3.46Å; H28-E128 CarbonylContact O-C 3.5Å; H28-E128 VanDerWaalsContact O-CA 3.3Å; H28-E128 WeakPolarHBondContact O-CA 3.4Å; H28-G129 PolarHBondContact N-O 3.17Å; H28-G129 PolarHBondContact O-N 3.27Å; H28-T131 PolarHBondContact CD2-OG1 3.44Å; H28-T131 VanDerWaalsContact CD2-OG1 3.27Å; H28-T131 PolarHBondContact NE2-OG1 3.03Å; H28-L137 HydrophobicContact CB-CD2 4.47Å; H28-M199 HydrophobicContact CB-CE 4.45Å; H28-M199 HydrophobicContact CB-SD 3.88Å; H28-R203 PolarHBondContact CD2-NE 3.37Å; H28-R203 PolarHBondContact CE1-NE 2.93Å; H28-R203 PolarHBondContact ND1-NE 2.81Å; H28-R203 VanDerWaalsContact ND1-NE 3.16Å; H28-R203 PolarHBondContact NE2-NE 3.45Å; H28-R203 VanDerWaalsContact NE2-NE 3.19Å; H28-R203 PolarHBondContact NE2-NH2 3.08Å; H28-R203 VanDerWaalsContact NE2-NH2 3.17Å
29	S	97.3	Very high	80.2	Confident	18 Å²	18	73.4 Å²	73.4	13%	0.126	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	134.7	178.5	62.3	0	0	0	0	111.2	L55 D56 C127 M199	S29-L55 WeakPolarHBondContact O-CA 3.42Å; S29-D56 PolarHBondContact N-OD1 3.05Å; S29-D56 PolarHBondContact O-N 3.45Å; S29-C127 WeakPolarHBondContact CA-O 3.19Å; S29-M199 VanDerWaalsContact C-SD 3.53Å
30	L	98.4	Very high	82.6	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	116.7	165.2	176.5	62.5	0	0	0	108.1	Y32 L54 I60 G126 C127 W198 M199 F202	L30-Y32 HydrophobicContact CD1-CE2 4.26Å; L30-Y32 HydrophobicContact CD2-CE2 4.27Å; L30-Y32 HydrophobicContact CG-CE2 4.14Å; L30-L54 WeakPolarHBondContact CA-O 3.36Å; L30-I60 HydrophobicContact CD1-CD1 3.91Å; L30-G126 CarbonylContact O-C 3.5Å; L30-G126 WeakPolarHBondContact O-CA 3.35Å; L30-C127 PolarHBondContact N-O 3.18Å; L30-C127 PolarHBondContact O-N 3.35Å; L30-W198 HydrophobicContact CD2-CB 3.8Å; L30-M199 HydrophobicContact CB-CB 3.84Å; L30-M199 HydrophobicContact CB-CG 4.06Å; L30-M199 HydrophobicContact CB-SD 4.01Å; L30-M199 HydrophobicContact CD2-CB 4.16Å; L30-M199 PolarHBondContact N-SD 2.89Å; L30-M199 VanDerWaalsContact N-SD 3.4Å; L30-F202 HydrophobicContact CD1-CD2 4.11Å; L30-F202 HydrophobicContact CD1-CE2 4.28Å; L30-F202 HydrophobicContact CD2-CD2 4.1Å; L30-F202 HydrophobicContact CD2-CE2 4.11Å
31	T	98.3	Very high	84.7	Confident	12 Å²	12	65.2 Å²	65.2	7%	0.074	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	131.5	-174.6	-52.4	0	0	0	0	110.5	I33 G53 L54 M124 M143	T31-I33 HydrophobicContact CG2-CG1 4.14Å; T31-G53 CarbonylContact O-C 3.55Å; T31-L54 PolarHBondContact N-O 3.47Å; T31-L54 PolarHBondContact O-N 2.81Å; T31-M124 HydrophobicContact CG2-CG 3.47Å; T31-M124 VanDerWaalsContact CG2-CG 3.47Å; T31-M124 HydrophobicContact CG2-SD 4.1Å; T31-M143 HydrophobicContact CG2-SD 3.88Å
32	Y	98.3	Very high	86.5	Confident	17 Å²	17	67.1 Å²	67.1	7%	0.067	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	130.7	169	-66	-79.8	0	0	0	109.9	L30 M52 G53 D61 R93 M124 H125	L30-Y32 HydrophobicContact CD1-CE2 4.26Å; L30-Y32 HydrophobicContact CD2-CE2 4.27Å; L30-Y32 HydrophobicContact CG-CE2 4.14Å; Y32-M52 CarbonylContact C-O 3.49Å; Y32-M52 VanDerWaalsContact CA-O 3.3Å; Y32-M52 WeakPolarHBondContact CA-O 3.32Å; Y32-G53 VanDerWaalsContact CD1-CA 3.4Å; Y32-D61 WeakPolarHBondContact CE1-OD2 3.34Å; Y32-R93 VanDerWaalsContact CD1-NH2 3.29Å; Y32-M124 WeakPolarHBondContact O-CA 3.49Å; Y32-H125 PolarHBondContact N-O 3.2Å; Y32-H125 PolarHBondContact O-N 2.78Å
33	I	98.1	Very high	88.4	Confident	29 Å²	29	61.7 Å²	61.7	15%	0.149	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	125.9	179.1	-55.3	175.9	0	0	0	108.2	T31 A51 M52 L54 W123 M124	T31-I33 HydrophobicContact CG2-CG1 4.14Å; I33-A51 CarbonylContact O-C 3.55Å; I33-A51 VanDerWaalsContact O-CA 3.27Å; I33-A51 WeakPolarHBondContact O-CA 3.33Å; I33-M52 HydrophobicContact CB-CG 4.06Å; I33-M52 PolarHBondContact N-O 2.85Å; I33-M52 PolarHBondContact O-N 3.42Å; I33-L54 HydrophobicContact CD1-CD1 3.69Å; I33-W123 WeakPolarHBondContact CA-O 3.4Å; I33-M124 HydrophobicContact CD1-CE 3.93Å; I33-M124 HydrophobicContact CG1-CE 4.14Å; I33-M124 HydrophobicContact CG1-CG 4.29Å
34	Y	98.4	Very high	90.1	Very high	13 Å²	13	61.4 Å²	61.4	5%	0.051	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	135.1	173.2	-61.1	-103	0	0	0	108.1	F49 T50 A51 R93 K96 F100 Q122 W123 H125	Y34-F49 HydrophobicContact CD1-CE2 4.21Å; Y34-F49 AromaticContact CD1-CZ 3.73Å; Y34-F49 HydrophobicContact CD1-CZ 3.73Å; Y34-F49 HydrophobicContact CE1-CZ 4.44Å; Y34-T50 WeakPolarHBondContact CA-O 3.42Å; Y34-A51 HydrophobicContact CD1-CB 3.45Å; Y34-A51 VanDerWaalsContact CD1-CB 3.45Å; Y34-A51 HydrophobicContact CE1-CB 3.64Å; Y34-A51 HydrophobicContact CG-CB 4.16Å; Y34-R93 PolarHBondContact OH-NE 3.07Å; Y34-K96 HydrophobicContact CD1-CB 4.29Å; Y34-K96 HydrophobicContact CE1-CB 4.05Å; Y34-K96 HydrophobicContact CE1-CG 4.12Å; Y34-F100 VanDerWaalsContact CB-CZ 3.48Å; Y34-F100 HydrophobicContact CD1-CE2 4.35Å; Y34-F100 HydrophobicContact CG-CE2 4.18Å; Y34-F100 HydrophobicContact CG-CZ 4.43Å; Y34-Q122 CarbonylContact O-C 3.58Å; Y34-Q122 WeakPolarHBondContact O-CA 3.34Å; Y34-W123 HydrophobicContact CD2-CD2 4.2Å; Y34-W123 AromaticContact CD2-CE3 3.57Å; Y34-W123 HydrophobicContact CD2-CE3 3.57Å; Y34-W123 HydrophobicContact CD2-CZ3 4.09Å; Y34-W123 AromaticContact CE2-CE3 3.87Å; Y34-W123 HydrophobicContact CE2-CE3 3.87Å; Y34-W123 AromaticContact CE2-CZ3 3.9Å; Y34-W123 HydrophobicContact CE2-CZ3 3.9Å; Y34-W123 AromaticContact CG-CE3 3.98Å; Y34-W123 HydrophobicContact CG-CE3 3.98Å; Y34-W123 PolarHBondContact N-O 3.09Å; Y34-W123 PolarHBondContact O-N 2.74Å; Y34-H125 AromaticContact CE2-CD2 3.85Å; Y34-H125 AromaticContact CE2-NE2 3.63Å
35	T	97.8	Very high	91.3	Very high	15 Å²	15	53.3 Å²	53.3	9%	0.092	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	132	177.9	-63	0	0	0	0	109	F37 F49 T50 I120 Q122	T35-F37 HydrophobicContact CG2-CE2 4.24Å; T35-F49 CarbonylContact O-C 3.56Å; T35-F49 VanDerWaalsContact O-CA 3.3Å; T35-F49 WeakPolarHBondContact O-CA 3.29Å; T35-T50 PolarHBondContact N-O 3.13Å; T35-T50 PolarHBondContact O-N 3.14Å; T35-I120 HydrophobicContact CG2-CG2 3.86Å; T35-Q122 HydrophobicContact CG2-CG 4Å; T35-Q122 PolarHBondContact OG1-NE2 2.86Å
36	A	97.3	Very high	92.2	Very high	5 Å²	5	53.7 Å²	53.7	4%	0.041	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	139	174.4	0	0	0	0	0	111.2	E48 F49 F100 I120 L121	A36-E48 CarbonylContact C-O 3.46Å; A36-E48 VanDerWaalsContact CA-O 3.3Å; A36-E48 WeakPolarHBondContact CA-O 3.48Å; A36-F49 HydrophobicContact CB-CD2 4.02Å; A36-F100 HydrophobicContact CB-CB 3.68Å; A36-F100 HydrophobicContact CB-CD1 3.41Å; A36-F100 VanDerWaalsContact CB-CD1 3.41Å; A36-F100 HydrophobicContact CB-CE1 4.27Å; A36-F100 HydrophobicContact CB-CG 3.84Å; A36-I120 WeakPolarHBondContact O-CA 3.35Å; A36-L121 PolarHBondContact N-O 3.29Å; A36-L121 PolarHBondContact O-N 3.14Å
37	F	96.1	Very high	92.5	Very high	26 Å²	26	49.7 Å²	49.7	11%	0.114	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	147.4	171.1	-63.3	-90.5	0	0	0	110.3	T35 K39 V41 L46 H47 E48 T118 H119 I120	T35-F37 HydrophobicContact CG2-CE2 4.24Å; F37-K39 WeakPolarHBondContact CB-O 3.44Å; F37-K39 PolarHBondContact O-N 3.43Å; F37-V41 HydrophobicContact CB-CG2 4.1Å; F37-V41 HydrophobicContact CD1-CG2 3.48Å; F37-V41 VanDerWaalsContact CD1-CG2 3.48Å; F37-V41 HydrophobicContact CD2-CG2 4.33Å; F37-V41 HydrophobicContact CE1-CG2 3.92Å; F37-V41 HydrophobicContact CG-CG2 3.72Å; F37-L46 HydrophobicContact CZ-CD1 4.43Å; F37-H47 VanDerWaalsContact CD2-O 3.24Å; F37-H47 WeakPolarHBondContact CD2-O 3.22Å; F37-H47 WeakPolarHBondContact CE2-O 3.38Å; F37-E48 PolarHBondContact N-O 3.44Å; F37-T118 HydrophobicContact CB-CG2 4.15Å; F37-T118 HydrophobicContact CD1-CG2 3.84Å; F37-T118 HydrophobicContact CG-CG2 4.48Å; F37-H119 CarbonylContact C-O 3.55Å; F37-H119 WeakPolarHBondContact CA-O 2.87Å; F37-I120 HydrophobicContact CD1-CD1 3.99Å; F37-I120 HydrophobicContact CD1-CG1 3.67Å; F37-I120 HydrophobicContact CE1-CD1 3.49Å; F37-I120 VanDerWaalsContact CE1-CD1 3.49Å; F37-I120 HydrophobicContact CE1-CG1 3.72Å; F37-I120 HydrophobicContact CZ-CD1 4.39Å
38	S	94.5	Very high	92.6	Very high	29 Å²	29	46.6 Å²	46.6	20%	0.203	27%	0.272	C	S	.	.	S	Bend	trans	-70.3	-18.1	177.9	64.6	0	0	0	0	113.3	M108 H119	S38-M108 VanDerWaalsContact CB-SD 3.5Å; S38-H119 PolarHBondContact N-O 3.14Å; S38-H119 PolarHBondContact OG-N 2.79Å
39	K	90.9	Very high	92.7	Very high	64 Å²	64	46.4 Å²	46.4	28%	0.278	27%	0.271	S	S	.	.	S	Bend	trans	-152.5	159.1	175.9	59.9	-173.9	174.6	-167.1	0	110.5	F37 V41 N115 N116 D117 T118	F37-K39 WeakPolarHBondContact CB-O 3.44Å; F37-K39 PolarHBondContact O-N 3.43Å; K39-V41 PolarHBondContact O-N 3.4Å; K39-N115 PolarHBondContact NZ-O 2.84Å; K39-N116 PolarHBondContact NZ-O 2.84Å; K39-D117 VanDerWaalsContact CE-C 3.48Å; K39-D117 VanDerWaalsContact CE-O 3.28Å; K39-D117 WeakPolarHBondContact CE-O 3.34Å; K39-D117 PolarHBondContact NZ-O 2.68Å; K39-T118 WeakPolarHBondContact CE-OG1 3.26Å; K39-T118 HydrophobicContact CG-CG2 4.07Å
40	P	88.2	Confident	92.7	Very high	83 Å²	83	46.4 Å²	46.4	54%	0.539	27%	0.27	S	S	.	.			trans	-54.7	133.4	177.3	-27	35.4	0	0	0	112
41	V	84.3	Confident	92.7	Very high	31 Å²	31	46.4 Å²	46.4	19%	0.188	27%	0.27	C	S	.	.			trans	-104.1	111.8	174.9	-176.2	0	0	0	0	107.6	F37 K39 L43 L46 T118	F37-V41 HydrophobicContact CB-CG2 4.1Å; F37-V41 HydrophobicContact CD1-CG2 3.48Å; F37-V41 VanDerWaalsContact CD1-CG2 3.48Å; F37-V41 HydrophobicContact CD2-CG2 4.33Å; F37-V41 HydrophobicContact CE1-CG2 3.92Å; F37-V41 HydrophobicContact CG-CG2 3.72Å; K39-V41 PolarHBondContact O-N 3.4Å; V41-L43 HydrophobicContact CG1-CB 4.1Å; V41-L43 HydrophobicContact CG1-CD1 3.82Å; V41-L43 HydrophobicContact CG1-CG 3.87Å; V41-L43 PolarHBondContact O-N 2.84Å; V41-L46 HydrophobicContact CG1-CD1 3.9Å; V41-T118 HydrophobicContact CG2-CG2 3.92Å
42	N	81.9	Confident	92.7	Very high	157 Å²	157	47.7 Å²	47.7	84%	0.84	28%	0.276	S	S	*	.			trans	-79.7	53.4	-177.8	-64.8	-25.5	0	0	0	111.8
43	L	85.4	Confident	92.7	Very high	106 Å²	106	46.9 Å²	46.9	56%	0.555	27%	0.273	S	S	*	.	S	Bend	trans	-118.1	134.4	175.4	-68.3	175.5	0	0	0	109.4	V41 G45 L46	V41-L43 HydrophobicContact CG1-CB 4.1Å; V41-L43 HydrophobicContact CG1-CD1 3.82Å; V41-L43 HydrophobicContact CG1-CG 3.87Å; V41-L43 PolarHBondContact O-N 2.84Å; L43-G45 PolarHBondContact O-N 2.94Å; L43-L46 HydrophobicContact CB-CD1 4Å; L43-L46 HydrophobicContact CB-CG 4.32Å; L43-L46 HydrophobicContact CD1-CD1 3.99Å; L43-L46 PolarHBondContact O-N 2.51Å; L43-L46 VanDerWaalsContact O-N 3.14Å
44	P	85.1	Confident	92.6	Very high	133 Å²	133	46.8 Å²	46.8	86%	0.864	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	129	179.2	-25.7	34	0	0	0	112.2	L46	P44-L46 VanDerWaalsContact C-N 3.34Å
45	G	81.5	Confident	92.4	Very high	65 Å²	65	46.4 Å²	46.4	67%	0.67	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.5	2.5	178.1	0	0	0	0	0	115.5	L43	L43-G45 PolarHBondContact O-N 2.94Å
46	L	89.2	Confident	92.2	Very high	74 Å²	74	47.9 Å²	47.9	39%	0.387	28%	0.278	S	S	.	.			trans	-103.1	133.5	169.3	-63.8	-173.7	0	0	0	110.4	F37 V41 L43 P44	F37-L46 HydrophobicContact CZ-CD1 4.43Å; V41-L46 HydrophobicContact CG1-CD1 3.9Å; L43-L46 HydrophobicContact CB-CD1 4Å; L43-L46 HydrophobicContact CB-CG 4.32Å; L43-L46 HydrophobicContact CD1-CD1 3.99Å; L43-L46 PolarHBondContact O-N 2.51Å; L43-L46 VanDerWaalsContact O-N 3.14Å; P44-L46 VanDerWaalsContact C-N 3.34Å
47	H	93.4	Very high	91.7	Very high	29 Å²	29	53.8 Å²	53.8	13%	0.134	31%	0.309	C	S	.	.			trans	-115.9	153.7	176	-53.7	-76.8	0	0	0	110	F37 F49 T50 Y62 D64 E66	F37-H47 VanDerWaalsContact CD2-O 3.24Å; F37-H47 WeakPolarHBondContact CD2-O 3.22Å; F37-H47 WeakPolarHBondContact CE2-O 3.38Å; H47-F49 PolarHBondContact O-N 2.82Å; H47-T50 HydrophobicContact CB-CG2 3.91Å; H47-Y62 PolarHBondContact CD2-OH 2.87Å; H47-Y62 VanDerWaalsContact CD2-OH 3.22Å; H47-D64 HydrophobicContact CB-CB 4.09Å; H47-E66 IonicContact CE1-OE1 3.42Å; H47-E66 IonicContact CE1-OE2 2.82Å; H47-E66 IonicContact CG-OE1 3.56Å; H47-E66 IonicContact ND1-OE1 3.64Å; H47-E66 PolarHBondContact ND1-OE1 3.09Å; H47-E66 IonicContact ND1-OE2 3.63Å
48	E	94.8	Very high	91.3	Very high	66 Å²	66	55.2 Å²	55.2	31%	0.308	31%	0.314	S	S	.	.	S	Bend	trans	-56	-37.5	178.5	-174.9	-176.8	141.8	0	0	111.7	A36 F37 S65	A36-E48 CarbonylContact C-O 3.46Å; A36-E48 VanDerWaalsContact CA-O 3.3Å; A36-E48 WeakPolarHBondContact CA-O 3.48Å; F37-E48 PolarHBondContact N-O 3.44Å; E48-S65 PolarHBondContact N-OG 3.18Å
49	F	97.2	Very high	91.2	Very high	3 Å²	3	57 Å²	57	1%	0.013	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	138.4	172.5	173.7	-92	0	0	0	111	Y34 T35 A36 H47 A51 Y63 D64 S65 K96 Q97 F100	Y34-F49 HydrophobicContact CD1-CE2 4.21Å; Y34-F49 AromaticContact CD1-CZ 3.73Å; Y34-F49 HydrophobicContact CD1-CZ 3.73Å; Y34-F49 HydrophobicContact CE1-CZ 4.44Å; T35-F49 CarbonylContact O-C 3.56Å; T35-F49 VanDerWaalsContact O-CA 3.3Å; T35-F49 WeakPolarHBondContact O-CA 3.29Å; A36-F49 HydrophobicContact CB-CD2 4.02Å; H47-F49 PolarHBondContact O-N 2.82Å; F49-A51 HydrophobicContact CE1-CB 4.11Å; F49-A51 HydrophobicContact CZ-CB 4.22Å; F49-Y63 AromaticContact CD1-CD1 3.86Å; F49-Y63 HydrophobicContact CD1-CD1 3.86Å; F49-Y63 AromaticContact CD1-CE1 3.64Å; F49-Y63 HydrophobicContact CD1-CE1 3.64Å; F49-Y63 AromaticContact CE1-CD1 3.65Å; F49-Y63 HydrophobicContact CE1-CD1 3.65Å; F49-Y63 AromaticContact CE1-CE1 3.59Å; F49-Y63 HydrophobicContact CE1-CE1 3.59Å; F49-D64 CarbonylContact O-C 3.58Å; F49-D64 WeakPolarHBondContact O-CA 3.28Å; F49-S65 PolarHBondContact N-OG 2.86Å; F49-S65 PolarHBondContact O-N 3.44Å; F49-K96 HydrophobicContact CZ-CB 4.2Å; F49-Q97 HydrophobicContact CB-CG 3.85Å; F49-Q97 HydrophobicContact CD1-CB 3.66Å; F49-Q97 HydrophobicContact CD1-CG 3.81Å; F49-Q97 HydrophobicContact CD2-CB 4.31Å; F49-Q97 HydrophobicContact CD2-CG 4.39Å; F49-Q97 HydrophobicContact CE1-CB 3.7Å; F49-Q97 HydrophobicContact CE1-CG 4.37Å; F49-Q97 HydrophobicContact CE2-CB 4.37Å; F49-Q97 HydrophobicContact CG-CB 3.94Å; F49-Q97 HydrophobicContact CG-CG 3.78Å; F49-Q97 HydrophobicContact CZ-CB 4.03Å; F49-F100 HydrophobicContact CD2-CB 4.19Å; F49-F100 HydrophobicContact CD2-CD2 4.32Å; F49-F100 HydrophobicContact CD2-CG 4.23Å; F49-F100 HydrophobicContact CE2-CB 4.2Å; F49-F100 AromaticContact CE2-CD2 3.56Å; F49-F100 HydrophobicContact CE2-CD2 3.56Å; F49-F100 HydrophobicContact CE2-CE2 4.02Å; F49-F100 AromaticContact CE2-CG 3.91Å; F49-F100 HydrophobicContact CE2-CG 3.91Å; F49-F100 HydrophobicContact CZ-CD2 4.47Å
50	T	97.8	Very high	91.4	Very high	17 Å²	17	53.9 Å²	53.9	10%	0.104	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	151.6	172	58.1	0	0	0	0	110.4	Y34 T35 H47 Y62 Y63 D64	Y34-T50 WeakPolarHBondContact CA-O 3.42Å; T35-T50 PolarHBondContact N-O 3.13Å; T35-T50 PolarHBondContact O-N 3.14Å; H47-T50 HydrophobicContact CB-CG2 3.91Å; T50-Y62 HydrophobicContact CG2-CE2 4.45Å; T50-Y62 WeakPolarHBondContact CG2-OH 3.23Å; T50-Y63 CarbonylContact C-O 3.47Å; T50-Y63 VanDerWaalsContact CA-O 3.32Å; T50-Y63 WeakPolarHBondContact CA-O 3.45Å; T50-D64 HydrophobicContact CG2-CB 4.4Å
51	A	98.3	Very high	91.8	Very high	0 Å²	0	50 Å²	50	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	131.4	170.4	0	0	0	0	0	110.3	I33 Y34 F49 Y62 Y63 R93	I33-A51 CarbonylContact O-C 3.55Å; I33-A51 VanDerWaalsContact O-CA 3.27Å; I33-A51 WeakPolarHBondContact O-CA 3.33Å; Y34-A51 HydrophobicContact CD1-CB 3.45Å; Y34-A51 VanDerWaalsContact CD1-CB 3.45Å; Y34-A51 HydrophobicContact CE1-CB 3.64Å; Y34-A51 HydrophobicContact CG-CB 4.16Å; F49-A51 HydrophobicContact CE1-CB 4.11Å; F49-A51 HydrophobicContact CZ-CB 4.22Å; A51-Y62 CarbonylContact O-C 3.51Å; A51-Y63 PolarHBondContact N-O 2.92Å; A51-Y63 PolarHBondContact O-N 3.34Å; A51-R93 PolarHBondContact O-NH1 3.05Å; A51-R93 VanDerWaalsContact O-NH1 3.09Å
52	M	97.8	Very high	92.5	Very high	40 Å²	40	50.3 Å²	50.3	20%	0.197	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	144.8	-177	63.1	-172.1	72	0	0	111.4	Y32 I33 L54 M59 D61 Y62	Y32-M52 CarbonylContact C-O 3.49Å; Y32-M52 VanDerWaalsContact CA-O 3.3Å; Y32-M52 WeakPolarHBondContact CA-O 3.32Å; I33-M52 HydrophobicContact CB-CG 4.06Å; I33-M52 PolarHBondContact N-O 2.85Å; I33-M52 PolarHBondContact O-N 3.42Å; M52-L54 HydrophobicContact SD-CD2 4.48Å; M52-M59 HydrophobicContact CB-CE 4.22Å; M52-M59 HydrophobicContact CB-CG 4.36Å; M52-M59 HydrophobicContact CB-SD 4.44Å; M52-M59 HydrophobicContact CE-CE 4.18Å; M52-M59 HydrophobicContact SD-CE 3.72Å; M52-D61 WeakPolarHBondContact CA-O 3.4Å; M52-Y62 HydrophobicContact CB-CD2 4.24Å; M52-Y62 HydrophobicContact CE-CE2 4.32Å
53	G	97.9	Very high	93.3	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	135.9	168.6	0	0	0	0	0	110.5	T31 Y32 M59 I60 D61	T31-G53 CarbonylContact O-C 3.55Å; Y32-G53 VanDerWaalsContact CD1-CA 3.4Å; G53-M59 CarbonylContact O-C 3.5Å; G53-M59 WeakPolarHBondContact O-CA 3.33Å; G53-I60 WeakPolarHBondContact O-CG1 3.2Å; G53-I60 PolarHBondContact O-N 3.34Å; G53-D61 PolarHBondContact N-O 3.33Å; G53-D61 VanDerWaalsContact N-O 3.11Å; G53-D61 PolarHBondContact N-OD1 2.84Å
54	L	96.4	Very high	93.8	Very high	27 Å²	27	38.1 Å²	38.1	14%	0.141	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	123.9	177.7	-57.6	-178.9	0	0	0	109.8	L30 T31 I33 M52 R58 M59	L30-L54 WeakPolarHBondContact CA-O 3.36Å; T31-L54 PolarHBondContact N-O 3.47Å; T31-L54 PolarHBondContact O-N 2.81Å; I33-L54 HydrophobicContact CD1-CD1 3.69Å; M52-L54 HydrophobicContact SD-CD2 4.48Å; L54-R58 CarbonylContact C-O 3.58Å; L54-R58 WeakPolarHBondContact CA-O 3.33Å; L54-M59 HydrophobicContact CD2-CB 3.95Å; L54-M59 HydrophobicContact CD2-CG 4.4Å
55	L	95.4	Very high	94.3	Very high	4 Å²	4	32.6 Å²	32.6	2%	0.021	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	117.2	166.4	-178.3	69.7	0	0	0	108.1	S29 N57 R58 I60 W76 M199 F202 R203	S29-L55 WeakPolarHBondContact O-CA 3.42Å; L55-N57 PolarHBondContact O-N 3.44Å; L55-R58 PolarHBondContact N-O 3.05Å; L55-R58 WeakPolarHBondContact O-CB 3.32Å; L55-R58 PolarHBondContact O-N 3.07Å; L55-I60 HydrophobicContact CB-CD1 4.35Å; L55-I60 HydrophobicContact CB-CG2 3.59Å; L55-W76 HydrophobicContact CD2-CZ2 4.31Å; L55-M199 HydrophobicContact CD1-CG 3.94Å; L55-F202 HydrophobicContact CD2-CB 3.98Å; L55-R203 HydrophobicContact CD1-CG 4.12Å; L55-R203 HydrophobicContact CD2-CG 4.28Å
56	D	91.9	Very high	95	Very high	46 Å²	46	35.9 Å²	35.9	25%	0.246	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.3	44.6	-177.1	-57.8	-25.5	0	0	0	112.7	H28 S29 R58	H28-D56 WeakPolarHBondContact CA-OD1 3.23Å; H28-D56 WeakPolarHBondContact CB-OD1 3.42Å; H28-D56 IonicContact CE1-OD2 2.74Å; H28-D56 IonicContact CG-OD1 3.65Å; H28-D56 IonicContact CG-OD2 3.73Å; H28-D56 IonicContact ND1-OD1 3.29Å; H28-D56 PolarHBondContact ND1-OD1 3.47Å; H28-D56 IonicContact ND1-OD2 3.01Å; H28-D56 PolarHBondContact ND1-OD2 3.46Å; S29-D56 PolarHBondContact N-OD1 3.05Å; S29-D56 PolarHBondContact O-N 3.45Å; D56-R58 PolarHBondContact O-N 3.32Å
57	N	87.8	Confident	95.3	Very high	130 Å²	130	37.8 Å²	37.8	70%	0.695	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.5	12.5	-175	-54.6	-54.9	0	0	0	115.6	L55	L55-N57 PolarHBondContact O-N 3.44Å
58	R	88.1	Confident	95.5	Very high	55 Å²	55	40 Å²	40	21%	0.208	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	132.6	170.6	-49.7	-162.9	-42.6	-115	-2.7	110.3	L54 L55 D56 I60 E74	L54-R58 CarbonylContact C-O 3.58Å; L54-R58 WeakPolarHBondContact CA-O 3.33Å; L55-R58 PolarHBondContact N-O 3.05Å; L55-R58 WeakPolarHBondContact O-CB 3.32Å; L55-R58 PolarHBondContact O-N 3.07Å; D56-R58 PolarHBondContact O-N 3.32Å; R58-I60 PolarHBondContact O-N 3.33Å; R58-E74 IonicContact NE-OE1 2.88Å
59	M	92.3	Very high	95.6	Very high	66 Å²	66	40.3 Å²	40.3	33%	0.325	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	119.1	-179.9	-171.8	-176.6	-64.6	0	0	110.7	M52 G53 L54 D61 Y62 K73	M52-M59 HydrophobicContact CB-CE 4.22Å; M52-M59 HydrophobicContact CB-CG 4.36Å; M52-M59 HydrophobicContact CB-SD 4.44Å; M52-M59 HydrophobicContact CE-CE 4.18Å; M52-M59 HydrophobicContact SD-CE 3.72Å; G53-M59 CarbonylContact O-C 3.5Å; G53-M59 WeakPolarHBondContact O-CA 3.33Å; L54-M59 HydrophobicContact CD2-CB 3.95Å; L54-M59 HydrophobicContact CD2-CG 4.4Å; M59-D61 WeakPolarHBondContact CG-O 3.31Å; M59-Y62 HydrophobicContact CE-CD2 4.35Å; M59-Y62 HydrophobicContact SD-CD2 3.89Å; M59-Y62 HydrophobicContact SD-CG 4.3Å; M59-K73 HydrophobicContact CG-CB 4.27Å; M59-K73 HydrophobicContact CG-CG 4.01Å; M59-K73 VanDerWaalsContact O-CB 3.24Å; M59-K73 WeakPolarHBondContact O-CB 3.49Å; M59-K73 HydrophobicContact SD-CD 4.47Å; M59-K73 HydrophobicContact SD-CG 3.97Å
60	I	95.3	Very high	95.6	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	-25.8	-178.7	63.2	169.1	0	0	0	112.9	L30 G53 L55 R58 K73 E74 W76 M77 F202	L30-I60 HydrophobicContact CD1-CD1 3.91Å; G53-I60 WeakPolarHBondContact O-CG1 3.2Å; G53-I60 PolarHBondContact O-N 3.34Å; L55-I60 HydrophobicContact CB-CD1 4.35Å; L55-I60 HydrophobicContact CB-CG2 3.59Å; R58-I60 PolarHBondContact O-N 3.33Å; I60-K73 PolarHBondContact O-N 2.82Å; I60-E74 HydrophobicContact CB-CG 4.42Å; I60-E74 HydrophobicContact CG2-CG 4.12Å; I60-W76 HydrophobicContact CB-CH2 4.46Å; I60-W76 HydrophobicContact CB-CZ2 4.25Å; I60-W76 HydrophobicContact CG2-CH2 4.3Å; I60-W76 HydrophobicContact CG2-CZ2 3.77Å; I60-M77 HydrophobicContact CB-CE 4.37Å; I60-M77 HydrophobicContact CB-CG 4.36Å; I60-M77 HydrophobicContact CB-SD 4.22Å; I60-M77 HydrophobicContact CD1-CE 4.31Å; I60-M77 HydrophobicContact CD1-SD 4.23Å; I60-M77 HydrophobicContact CG1-CE 4.35Å; I60-F202 HydrophobicContact CD1-CD2 3.68Å; I60-F202 HydrophobicContact CD1-CE2 3.76Å; I60-F202 HydrophobicContact CD1-CG 4.45Å
61	D	97.2	Very high	95.6	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	158.7	172.7	70.9	63.7	0	0	0	111.9	Y32 M52 G53 M59 K70 V71 M77 W86 R93	Y32-D61 WeakPolarHBondContact CE1-OD2 3.34Å; M52-D61 WeakPolarHBondContact CA-O 3.4Å; G53-D61 PolarHBondContact N-O 3.33Å; G53-D61 VanDerWaalsContact N-O 3.11Å; G53-D61 PolarHBondContact N-OD1 2.84Å; M59-D61 WeakPolarHBondContact CG-O 3.31Å; D61-K70 HydrophobicContact CB-CG 4.35Å; D61-K70 WeakPolarHBondContact OD2-CE 3.31Å; D61-K70 IonicContact OD2-NZ 3.51Å; D61-K70 PolarHBondContact OD2-NZ 3.03Å; D61-V71 VanDerWaalsContact CA-O 3.31Å; D61-V71 WeakPolarHBondContact CA-O 3.32Å; D61-M77 HydrophobicContact CB-CE 4.13Å; D61-W86 HydrophobicContact CB-CZ3 4.24Å; D61-R93 IonicContact OD1-CZ 3.83Å; D61-R93 IonicContact OD1-NH1 3.6Å; D61-R93 PolarHBondContact OD1-NH1 2.9Å; D61-R93 IonicContact OD1-NH2 3.8Å; D61-R93 PolarHBondContact OD1-NH2 3.3Å; D61-R93 IonicContact OD2-NH2 3.44Å
62	Y	97.8	Very high	95.4	Very high	39 Å²	39	44.3 Å²	44.3	15%	0.153	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	152.8	179.7	-174.6	-104.1	0	0	0	111.9	H47 T50 A51 M52 M59 D64 K70 V71	H47-Y62 PolarHBondContact CD2-OH 2.87Å; H47-Y62 VanDerWaalsContact CD2-OH 3.22Å; T50-Y62 HydrophobicContact CG2-CE2 4.45Å; T50-Y62 WeakPolarHBondContact CG2-OH 3.23Å; A51-Y62 CarbonylContact O-C 3.51Å; M52-Y62 HydrophobicContact CB-CD2 4.24Å; M52-Y62 HydrophobicContact CE-CE2 4.32Å; M59-Y62 HydrophobicContact CE-CD2 4.35Å; M59-Y62 HydrophobicContact SD-CD2 3.89Å; M59-Y62 HydrophobicContact SD-CG 4.3Å; Y62-D64 HydrophobicContact CE1-CB 3.81Å; Y62-D64 WeakPolarHBondContact CE1-OD2 3.49Å; Y62-K70 CarbonylContact O-C 3.57Å; Y62-K70 WeakPolarHBondContact O-CA 3.28Å; Y62-V71 PolarHBondContact N-O 2.82Å; Y62-V71 PolarHBondContact O-N 2.98Å
63	Y	98.3	Very high	95.1	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	140.9	174.2	175.5	-81	0	0	0	108.7	F49 T50 A51 Q68 R93 K94 Q97	F49-Y63 AromaticContact CD1-CD1 3.86Å; F49-Y63 HydrophobicContact CD1-CD1 3.86Å; F49-Y63 AromaticContact CD1-CE1 3.64Å; F49-Y63 HydrophobicContact CD1-CE1 3.64Å; F49-Y63 AromaticContact CE1-CD1 3.65Å; F49-Y63 HydrophobicContact CE1-CD1 3.65Å; F49-Y63 AromaticContact CE1-CE1 3.59Å; F49-Y63 HydrophobicContact CE1-CE1 3.59Å; T50-Y63 CarbonylContact C-O 3.47Å; T50-Y63 VanDerWaalsContact CA-O 3.32Å; T50-Y63 WeakPolarHBondContact CA-O 3.45Å; A51-Y63 PolarHBondContact N-O 2.92Å; A51-Y63 PolarHBondContact O-N 3.34Å; Y63-Q68 VanDerWaalsContact CE2-CA 3.49Å; Y63-Q68 HydrophobicContact CE2-CB 4.33Å; Y63-Q68 WeakPolarHBondContact CE2-O 3.38Å; Y63-R93 HydrophobicContact CD1-CB 3.95Å; Y63-R93 HydrophobicContact CD2-CB 3.5Å; Y63-R93 VanDerWaalsContact CD2-CB 3.5Å; Y63-R93 HydrophobicContact CD2-CG 4.06Å; Y63-R93 HydrophobicContact CE1-CB 4.15Å; Y63-R93 HydrophobicContact CE2-CB 3.7Å; Y63-R93 HydrophobicContact CG-CB 3.64Å; Y63-R93 HydrophobicContact CG-CG 4.02Å; Y63-K94 HydrophobicContact CE2-CG 4.26Å; Y63-K94 VanDerWaalsContact OH-CG 3.26Å; Y63-K94 WeakPolarHBondContact OH-CG 3.38Å; Y63-Q97 PolarHBondContact OH-OE1 2.78Å
64	D	97.1	Very high	94.6	Very high	7 Å²	7	48.7 Å²	48.7	4%	0.037	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	162.7	171.7	66	74.2	0	0	0	112.2	H47 F49 T50 Y62 E66 N67 Q68	H47-D64 HydrophobicContact CB-CB 4.09Å; F49-D64 CarbonylContact O-C 3.58Å; F49-D64 WeakPolarHBondContact O-CA 3.28Å; T50-D64 HydrophobicContact CG2-CB 4.4Å; Y62-D64 HydrophobicContact CE1-CB 3.81Å; Y62-D64 WeakPolarHBondContact CE1-OD2 3.49Å; D64-E66 VanDerWaalsContact C-N 3.26Å; D64-E66 PolarHBondContact O-N 2.88Å; D64-E66 WeakPolarHBondContact OD1-CA 3.38Å; D64-E66 WeakPolarHBondContact OD1-CB 3.49Å; D64-E66 PolarHBondContact OD1-N 3.35Å; D64-N67 VanDerWaalsContact CG-ND2 3.34Å; D64-N67 PolarHBondContact OD1-N 3.48Å; D64-N67 PolarHBondContact OD1-ND2 2.92Å; D64-N67 VanDerWaalsContact OD1-ND2 3.13Å; D64-N67 PolarHBondContact OD2-ND2 2.87Å; D64-Q68 VanDerWaalsContact O-CA 3.31Å; D64-Q68 WeakPolarHBondContact O-CA 3.25Å; D64-Q68 PolarHBondContact O-N 2.95Å
65	S	95.9	Very high	94	Very high	16 Å²	16	48.9 Å²	48.9	11%	0.112	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-15	-176.3	50.8	0	0	0	0	115.5	E48 F49 Q68	E48-S65 PolarHBondContact N-OG 3.18Å; F49-S65 PolarHBondContact N-OG 2.86Å; F49-S65 PolarHBondContact O-N 3.44Å; S65-Q68 WeakPolarHBondContact O-CG 3.42Å; S65-Q68 PolarHBondContact O-NE2 2.85Å
66	E	94.7	Very high	93.7	Very high	135 Å²	135	48.8 Å²	48.8	63%	0.631	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-52.2	-178.4	-70.4	168.6	-149.4	0	0	111.1	H47 D64	H47-E66 IonicContact CE1-OE1 3.42Å; H47-E66 IonicContact CE1-OE2 2.82Å; H47-E66 IonicContact CG-OE1 3.56Å; H47-E66 IonicContact ND1-OE1 3.64Å; H47-E66 PolarHBondContact ND1-OE1 3.09Å; H47-E66 IonicContact ND1-OE2 3.63Å; D64-E66 VanDerWaalsContact C-N 3.26Å; D64-E66 PolarHBondContact O-N 2.88Å; D64-E66 WeakPolarHBondContact OD1-CA 3.38Å; D64-E66 WeakPolarHBondContact OD1-CB 3.49Å; D64-E66 PolarHBondContact OD1-N 3.35Å
67	N	95.9	Very high	93.7	Very high	113 Å²	113	46.6 Å²	46.6	60%	0.604	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-34.1	179.2	-64.2	-64.5	0	0	0	111.7	D64 V69	D64-N67 VanDerWaalsContact CG-ND2 3.34Å; D64-N67 PolarHBondContact OD1-N 3.48Å; D64-N67 PolarHBondContact OD1-ND2 2.92Å; D64-N67 VanDerWaalsContact OD1-ND2 3.13Å; D64-N67 PolarHBondContact OD2-ND2 2.87Å; N67-V69 PolarHBondContact O-N 3.3Å; N67-V69 VanDerWaalsContact O-N 3.15Å
68	Q	96.9	Very high	93.7	Very high	75 Å²	75	47 Å²	47	35%	0.35	23%	0.233	S	C	.	.			trans	54.4	32.1	176.4	-54.7	-172.9	-8.9	0	0	115.1	Y63 D64 S65 T90 K94	Y63-Q68 VanDerWaalsContact CE2-CA 3.49Å; Y63-Q68 HydrophobicContact CE2-CB 4.33Å; Y63-Q68 WeakPolarHBondContact CE2-O 3.38Å; D64-Q68 VanDerWaalsContact O-CA 3.31Å; D64-Q68 WeakPolarHBondContact O-CA 3.25Å; D64-Q68 PolarHBondContact O-N 2.95Å; S65-Q68 WeakPolarHBondContact O-CG 3.42Å; S65-Q68 PolarHBondContact O-NE2 2.85Å; Q68-T90 WeakPolarHBondContact O-CG2 3.47Å; Q68-K94 WeakPolarHBondContact O-CE 3.22Å
69	V	97.9	Very high	93.8	Very high	74 Å²	74	51.5 Å²	51.5	45%	0.448	25%	0.254	S	S	.	.			trans	-128.6	134.9	175.9	177.3	0	0	0	0	108.6	N67 V71	N67-V69 PolarHBondContact O-N 3.3Å; N67-V69 VanDerWaalsContact O-N 3.15Å; V69-V71 HydrophobicContact CB-CG1 4.44Å; V69-V71 HydrophobicContact CG1-CG1 4.02Å; V69-V71 PolarHBondContact O-N 2.98Å
70	K	97.8	Very high	93.8	Very high	12 Å²	12	51.3 Å²	51.3	5%	0.052	25%	0.253	C	S	.	.			trans	-78.9	115.9	172	-177.5	-169	175	-173.5	0	107.7	D61 Y62 Y85 W86 T90	D61-K70 HydrophobicContact CB-CG 4.35Å; D61-K70 WeakPolarHBondContact OD2-CE 3.31Å; D61-K70 IonicContact OD2-NZ 3.51Å; D61-K70 PolarHBondContact OD2-NZ 3.03Å; Y62-K70 CarbonylContact O-C 3.57Å; Y62-K70 WeakPolarHBondContact O-CA 3.28Å; K70-Y85 PolarHBondContact NZ-OH 2.9Å; K70-W86 HydrophobicContact CD-CE3 4.13Å; K70-W86 HydrophobicContact CD-CZ3 4.27Å; K70-W86 HydrophobicContact CG-CE3 4.15Å; K70-W86 HydrophobicContact CG-CZ3 4.19Å; K70-T90 WeakPolarHBondContact CB-OG1 3.31Å; K70-T90 PolarHBondContact N-OG1 2.81Å
71	V	96.7	Very high	93.8	Very high	52 Å²	52	51.9 Å²	51.9	32%	0.315	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	145.4	-176.8	-62.1	0	0	0	0	111.5	D61 Y62 V69	D61-V71 VanDerWaalsContact CA-O 3.31Å; D61-V71 WeakPolarHBondContact CA-O 3.32Å; Y62-V71 PolarHBondContact N-O 2.82Å; Y62-V71 PolarHBondContact O-N 2.98Å; V69-V71 HydrophobicContact CB-CG1 4.44Å; V69-V71 HydrophobicContact CG1-CG1 4.02Å; V69-V71 PolarHBondContact O-N 2.98Å
72	P	95.1	Very high	93.7	Very high	40 Å²	40	58.7 Å²	58.7	26%	0.26	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	151.4	169.5	26.3	-32.5	0	0	0	110.9	M77 E78 W86	P72-M77 HydrophobicContact CB-CB 4.02Å; P72-E78 HydrophobicContact CB-CB 4.34Å; P72-E78 HydrophobicContact CG-CB 4.11Å; P72-W86 VanDerWaalsContact CA-CH2 3.49Å; P72-W86 HydrophobicContact CB-CH2 3.48Å; P72-W86 VanDerWaalsContact CB-CH2 3.48Å; P72-W86 HydrophobicContact CB-CZ2 3.79Å; P72-W86 HydrophobicContact CB-CZ3 4.22Å; P72-W86 HydrophobicContact CG-CH2 4.21Å; P72-W86 HydrophobicContact CG-CZ2 4.3Å
73	K	91.8	Very high	93.6	Very high	104 Å²	104	60.9 Å²	60.9	45%	0.452	31%	0.306	S	S	.	.	S	Bend	trans	-122.3	1.1	170.6	-67.1	-64.7	179.6	-172.4	0	113.6	M59 I60	M59-K73 HydrophobicContact CG-CB 4.27Å; M59-K73 HydrophobicContact CG-CG 4.01Å; M59-K73 VanDerWaalsContact O-CB 3.24Å; M59-K73 WeakPolarHBondContact O-CB 3.49Å; M59-K73 HydrophobicContact SD-CD 4.47Å; M59-K73 HydrophobicContact SD-CG 3.97Å; I60-K73 PolarHBondContact O-N 2.82Å
74	E	86.6	Confident	93.6	Very high	27 Å²	27	66.2 Å²	66.2	13%	0.126	33%	0.331	C	S	.	.	S	Bend	trans	-138.5	136.9	175.2	-57.3	-77.9	-168.7	0	0	108.6	R58 I60 W76 M77 Y241	R58-E74 IonicContact NE-OE1 2.88Å; I60-E74 HydrophobicContact CB-CG 4.42Å; I60-E74 HydrophobicContact CG2-CG 4.12Å; E74-W76 HydrophobicContact CB-CD2 4.5Å; E74-W76 HydrophobicContact CB-CG 4.38Å; E74-W76 HydrophobicContact CB-CZ2 4.38Å; E74-W76 HydrophobicContact CG-CZ2 4.46Å; E74-W76 PolarHBondContact O-N 3.24Å; E74-M77 HydrophobicContact CB-CG 4.31Å; E74-M77 VanDerWaalsContact O-CB 3.31Å; E74-M77 WeakPolarHBondContact O-CB 3.21Å; E74-M77 PolarHBondContact O-N 3Å; E74-Y241 WeakPolarHBondContact OE2-CE2 3.27Å; E74-Y241 PolarHBondContact OE2-OH 2.99Å
75	D	83.7	Confident	93.5	Very high	31 Å²	31	67.7 Å²	67.7	17%	0.166	34%	0.337	C	S	.	.	H	α-helix	trans	-57.6	-36.7	-174.1	-53	2	0	0	0	113.5	M77 E78 K79 D273	D75-M77 PolarHBondContact O-N 3.19Å; D75-E78 PolarHBondContact O-N 3.37Å; D75-E78 VanDerWaalsContact O-N 3.14Å; D75-K79 HydrophobicContact CB-CD 4.33Å; D75-K79 WeakPolarHBondContact O-CG 3.21Å; D75-K79 PolarHBondContact O-N 3.03Å; D75-K79 IonicContact OD2-NZ 3.94Å; D75-K79 PolarHBondContact OD2-NZ 2.69Å; D75-D273 WeakPolarHBondContact OD1-CB 3.07Å
76	W	88.8	Confident	93.6	Very high	2 Å²	2	68.5 Å²	68.5	1%	0.008	34%	0.337	C	S	.	.	H	α-helix	trans	-64.8	-26.9	-176.8	62.3	-92.4	0	0	0	111.4	L55 I60 E74 H80 F202 F205	L55-W76 HydrophobicContact CD2-CZ2 4.31Å; I60-W76 HydrophobicContact CB-CH2 4.46Å; I60-W76 HydrophobicContact CB-CZ2 4.25Å; I60-W76 HydrophobicContact CG2-CH2 4.3Å; I60-W76 HydrophobicContact CG2-CZ2 3.77Å; E74-W76 HydrophobicContact CB-CD2 4.5Å; E74-W76 HydrophobicContact CB-CG 4.38Å; E74-W76 HydrophobicContact CB-CZ2 4.38Å; E74-W76 HydrophobicContact CG-CZ2 4.46Å; E74-W76 PolarHBondContact O-N 3.24Å; W76-H80 WeakPolarHBondContact O-CB 3.41Å; W76-H80 PolarHBondContact O-N 2.83Å; W76-H80 PolarHBondContact O-ND1 3.35Å; W76-F202 HydrophobicContact CH2-CB 3.48Å; W76-F202 VanDerWaalsContact CH2-CB 3.48Å; W76-F202 AromaticContact CH2-CD1 3.76Å; W76-F202 HydrophobicContact CH2-CD1 3.76Å; W76-F202 HydrophobicContact CH2-CD2 4.43Å; W76-F202 AromaticContact CH2-CG 3.65Å; W76-F202 HydrophobicContact CH2-CG 3.65Å; W76-F202 HydrophobicContact CZ2-CB 4.42Å; W76-F202 HydrophobicContact CZ3-CB 3.87Å; W76-F202 AromaticContact CZ3-CD1 3.51Å; W76-F202 HydrophobicContact CZ3-CD1 3.51Å; W76-F202 HydrophobicContact CZ3-CE1 4.29Å; W76-F202 AromaticContact CZ3-CG 3.89Å; W76-F202 HydrophobicContact CZ3-CG 3.89Å; W76-F205 HydrophobicContact CB-CB 4.25Å; W76-F205 HydrophobicContact CD2-CB 3.87Å; W76-F205 HydrophobicContact CE3-CB 3.34Å; W76-F205 AromaticContact CE3-CD2 3.7Å; W76-F205 HydrophobicContact CE3-CD2 3.7Å; W76-F205 HydrophobicContact CE3-CG 4.01Å; W76-F205 HydrophobicContact CG-CB 4.28Å; W76-F205 HydrophobicContact CZ3-CB 4.03Å; W76-F205 AromaticContact CZ3-CD2 3.81Å; W76-F205 HydrophobicContact CZ3-CD2 3.81Å; W76-F205 HydrophobicContact CZ3-CG 4.45Å
77	M	91.7	Very high	93.7	Very high	0 Å²	0	68.5 Å²	68.5	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-65.7	-46.4	174.1	-69	-86.6	-71	0	0	110	I60 D61 P72 E74 D75 L81 Y85 W86 F202	I60-M77 HydrophobicContact CB-CE 4.37Å; I60-M77 HydrophobicContact CB-CG 4.36Å; I60-M77 HydrophobicContact CB-SD 4.22Å; I60-M77 HydrophobicContact CD1-CE 4.31Å; I60-M77 HydrophobicContact CD1-SD 4.23Å; I60-M77 HydrophobicContact CG1-CE 4.35Å; D61-M77 HydrophobicContact CB-CE 4.13Å; P72-M77 HydrophobicContact CB-CB 4.02Å; E74-M77 HydrophobicContact CB-CG 4.31Å; E74-M77 VanDerWaalsContact O-CB 3.31Å; E74-M77 WeakPolarHBondContact O-CB 3.21Å; E74-M77 PolarHBondContact O-N 3Å; D75-M77 PolarHBondContact O-N 3.19Å; M77-L81 HydrophobicContact CB-CD1 4.15Å; M77-L81 HydrophobicContact CE-CD1 3.76Å; M77-L81 HydrophobicContact CG-CD1 4.49Å; M77-L81 WeakPolarHBondContact O-CB 3.47Å; M77-L81 VanDerWaalsContact O-CG 3.3Å; M77-L81 WeakPolarHBondContact O-CG 3.37Å; M77-L81 PolarHBondContact O-N 2.81Å; M77-L81 VanDerWaalsContact O-N 3.1Å; M77-L81 HydrophobicContact SD-CD1 3.56Å; M77-L81 VanDerWaalsContact SD-CD1 3.56Å; M77-Y85 HydrophobicContact CE-CE1 4.17Å; M77-W86 HydrophobicContact CB-CH2 3.82Å; M77-W86 HydrophobicContact CB-CZ2 3.74Å; M77-W86 HydrophobicContact CE-CH2 3.45Å; M77-W86 VanDerWaalsContact CE-CH2 3.45Å; M77-W86 HydrophobicContact CE-CZ2 4.17Å; M77-W86 HydrophobicContact CE-CZ3 4.18Å; M77-F202 HydrophobicContact SD-CD1 4.18Å; M77-F202 HydrophobicContact SD-CE1 3.98Å; M77-F202 HydrophobicContact SD-CZ 4.32Å
78	E	88.4	Confident	93.8	Very high	140 Å²	140	69.1 Å²	69.1	65%	0.654	34%	0.335	S	S	*	.	H	α-helix	trans	-66.6	-40.1	178.9	-172	173.2	-164.2	0	0	111.6	P72 D75	P72-E78 HydrophobicContact CB-CB 4.34Å; P72-E78 HydrophobicContact CG-CB 4.11Å; D75-E78 PolarHBondContact O-N 3.37Å; D75-E78 VanDerWaalsContact O-N 3.14Å
79	K	89.7	Confident	93.8	Very high	149 Å²	149	66.2 Å²	66.2	65%	0.648	32%	0.324	S	S	*	.	H	α-helix	trans	-70.1	-35.1	-178.3	-70.2	166.9	-176.5	160.3	0	113.8	D75	D75-K79 HydrophobicContact CB-CD 4.33Å; D75-K79 WeakPolarHBondContact O-CG 3.21Å; D75-K79 PolarHBondContact O-N 3.03Å; D75-K79 IonicContact OD2-NZ 3.94Å; D75-K79 PolarHBondContact OD2-NZ 2.69Å
80	H	93.1	Very high	93.8	Very high	62 Å²	62	63.6 Å²	63.6	29%	0.287	31%	0.308	S	S	.	.	H	α-helix	trans	-105.8	-13.2	-171.6	-66.5	90.5	0	0	0	115.1	W76 F205 E208	W76-H80 WeakPolarHBondContact O-CB 3.41Å; W76-H80 PolarHBondContact O-N 2.83Å; W76-H80 PolarHBondContact O-ND1 3.35Å; H80-F205 HydrophobicContact CB-CD1 4.03Å; H80-F205 HydrophobicContact CB-CD2 3.75Å; H80-F205 HydrophobicContact CB-CE1 3.89Å; H80-F205 HydrophobicContact CB-CE2 3.57Å; H80-F205 HydrophobicContact CB-CG 3.96Å; H80-F205 HydrophobicContact CB-CZ 3.64Å; H80-F205 AromaticContact CD2-CD1 3.56Å; H80-F205 AromaticContact CD2-CE1 3.63Å; H80-F205 AromaticContact CG-CD1 3.68Å; H80-F205 AromaticContact CG-CE1 3.87Å; H80-F205 AromaticContact CG-CG 3.82Å; H80-E208 IonicContact NE2-OE2 2.61Å
81	L	95.1	Very high	93.8	Very high	12 Å²	12	69 Å²	69	6%	0.063	33%	0.334	C	S	.	.	S	Bend	trans	-107.2	122.6	-176.4	-57.3	172.1	0	0	0	110.6	M77 Y85 W86 W198 F202 F205	M77-L81 HydrophobicContact CB-CD1 4.15Å; M77-L81 HydrophobicContact CE-CD1 3.76Å; M77-L81 HydrophobicContact CG-CD1 4.49Å; M77-L81 WeakPolarHBondContact O-CB 3.47Å; M77-L81 VanDerWaalsContact O-CG 3.3Å; M77-L81 WeakPolarHBondContact O-CG 3.37Å; M77-L81 PolarHBondContact O-N 2.81Å; M77-L81 VanDerWaalsContact O-N 3.1Å; M77-L81 HydrophobicContact SD-CD1 3.56Å; M77-L81 VanDerWaalsContact SD-CD1 3.56Å; L81-Y85 HydrophobicContact CB-CD1 3.8Å; L81-Y85 HydrophobicContact CB-CE1 4.39Å; L81-Y85 HydrophobicContact CB-CG 4.18Å; L81-Y85 HydrophobicContact CD1-CD1 3.65Å; L81-Y85 HydrophobicContact CD1-CE1 3.35Å; L81-Y85 HydrophobicContact CD1-CE2 4.49Å; L81-Y85 HydrophobicContact CD1-CG 4.35Å; L81-Y85 HydrophobicContact CG-CD1 4.21Å; L81-Y85 HydrophobicContact CG-CE1 4.36Å; L81-W86 HydrophobicContact CB-CZ2 4.31Å; L81-W86 HydrophobicContact CD1-CZ2 3.99Å; L81-W86 PolarHBondContact O-NE1 2.95Å; L81-W198 HydrophobicContact CD2-CZ3 4.06Å; L81-F202 HydrophobicContact CD1-CE1 3.97Å; L81-F202 HydrophobicContact CD2-CE1 4.27Å; L81-F205 HydrophobicContact CD2-CE2 4.07Å
82	E	95.5	Very high	93.8	Very high	142 Å²	142	69.1 Å²	69.1	66%	0.664	34%	0.337	S	S	*	.			trans	-58	151.2	178.3	-63.6	-61.9	153.2	0	0	112.2	E84 Y85	E82-E84 PolarHBondContact O-N 3.07Å; E82-Y85 WeakPolarHBondContact O-CB 3.24Å; E82-Y85 PolarHBondContact O-N 3.31Å
83	P	95.7	Very high	94	Very high	85 Å²	85	67.5 Å²	67.5	55%	0.552	33%	0.326	S	S	*	.	H	α-helix	trans	-49.8	-37.1	177.2	-29.3	35.8	0	0	0	114	Y85 W86 E87	P83-Y85 VanDerWaalsContact C-N 3.27Å; P83-Y85 PolarHBondContact O-N 3.27Å; P83-W86 WeakPolarHBondContact O-CB 2.99Å; P83-W86 PolarHBondContact O-N 3.35Å; P83-E87 PolarHBondContact O-N 3.25Å
84	E	96.8	Very high	94.3	Very high	112 Å²	112	66.2 Å²	66.2	52%	0.523	32%	0.32	S	S	.	.	H	α-helix	trans	-60	-33.6	179.4	-169.6	-176.4	-169.5	0	0	113	E82 W86 K88	E82-E84 PolarHBondContact O-N 3.07Å; E84-W86 VanDerWaalsContact C-N 3.32Å; E84-W86 PolarHBondContact O-N 2.87Å; E84-K88 VanDerWaalsContact CD-NZ 3.28Å; E84-K88 HydrophobicContact CG-CD 4.06Å; E84-K88 HydrophobicContact CG-CG 4.33Å; E84-K88 WeakPolarHBondContact O-CB 3.42Å; E84-K88 WeakPolarHBondContact O-CG 3.27Å; E84-K88 PolarHBondContact O-N 2.83Å; E84-K88 WeakPolarHBondContact OE1-CE 3.48Å; E84-K88 IonicContact OE1-NZ 3.7Å; E84-K88 PolarHBondContact OE1-NZ 3.09Å; E84-K88 IonicContact OE2-NZ 3.29Å
85	Y	96.2	Very high	94.8	Very high	39 Å²	39	68.5 Å²	68.5	15%	0.153	34%	0.339	C	S	.	.	H	α-helix	trans	-62.4	-41.2	175.4	168.2	-93.7	0	0	0	111.3	K70 M77 L81 E82 P83 G89 W198 F202	K70-Y85 PolarHBondContact NZ-OH 2.9Å; M77-Y85 HydrophobicContact CE-CE1 4.17Å; L81-Y85 HydrophobicContact CB-CD1 3.8Å; L81-Y85 HydrophobicContact CB-CE1 4.39Å; L81-Y85 HydrophobicContact CB-CG 4.18Å; L81-Y85 HydrophobicContact CD1-CD1 3.65Å; L81-Y85 HydrophobicContact CD1-CE1 3.35Å; L81-Y85 HydrophobicContact CD1-CE2 4.49Å; L81-Y85 HydrophobicContact CD1-CG 4.35Å; L81-Y85 HydrophobicContact CG-CD1 4.21Å; L81-Y85 HydrophobicContact CG-CE1 4.36Å; E82-Y85 WeakPolarHBondContact O-CB 3.24Å; E82-Y85 PolarHBondContact O-N 3.31Å; P83-Y85 VanDerWaalsContact C-N 3.27Å; P83-Y85 PolarHBondContact O-N 3.27Å; Y85-G89 PolarHBondContact O-N 3.09Å; Y85-W198 AromaticContact CD2-CH2 3.57Å; Y85-W198 HydrophobicContact CD2-CH2 3.57Å; Y85-W198 HydrophobicContact CD2-CZ2 4.18Å; Y85-W198 HydrophobicContact CD2-CZ3 4.2Å; Y85-W198 AromaticContact CE2-CH2 3.54Å; Y85-W198 HydrophobicContact CE2-CH2 3.54Å; Y85-W198 HydrophobicContact CE2-CZ2 4.04Å; Y85-W198 AromaticContact CE2-CZ3 3.84Å; Y85-W198 HydrophobicContact CE2-CZ3 3.84Å; Y85-F202 WeakPolarHBondContact OH-CZ 3.37Å
86	W	97.4	Very high	95.5	Very high	33 Å²	33	69.8 Å²	69.8	13%	0.125	34%	0.344	C	S	.	.	H	α-helix	trans	-73.2	-39.6	-179.7	-61.6	107.8	0	0	0	112.4	D61 K70 P72 M77 L81 P83 E84 G89 T90	D61-W86 HydrophobicContact CB-CZ3 4.24Å; K70-W86 HydrophobicContact CD-CE3 4.13Å; K70-W86 HydrophobicContact CD-CZ3 4.27Å; K70-W86 HydrophobicContact CG-CE3 4.15Å; K70-W86 HydrophobicContact CG-CZ3 4.19Å; P72-W86 VanDerWaalsContact CA-CH2 3.49Å; P72-W86 HydrophobicContact CB-CH2 3.48Å; P72-W86 VanDerWaalsContact CB-CH2 3.48Å; P72-W86 HydrophobicContact CB-CZ2 3.79Å; P72-W86 HydrophobicContact CB-CZ3 4.22Å; P72-W86 HydrophobicContact CG-CH2 4.21Å; P72-W86 HydrophobicContact CG-CZ2 4.3Å; M77-W86 HydrophobicContact CB-CH2 3.82Å; M77-W86 HydrophobicContact CB-CZ2 3.74Å; M77-W86 HydrophobicContact CE-CH2 3.45Å; M77-W86 VanDerWaalsContact CE-CH2 3.45Å; M77-W86 HydrophobicContact CE-CZ2 4.17Å; M77-W86 HydrophobicContact CE-CZ3 4.18Å; L81-W86 HydrophobicContact CB-CZ2 4.31Å; L81-W86 HydrophobicContact CD1-CZ2 3.99Å; L81-W86 PolarHBondContact O-NE1 2.95Å; P83-W86 WeakPolarHBondContact O-CB 2.99Å; P83-W86 PolarHBondContact O-N 3.35Å; E84-W86 VanDerWaalsContact C-N 3.32Å; E84-W86 PolarHBondContact O-N 2.87Å; W86-G89 PolarHBondContact O-N 3.07Å; W86-T90 VanDerWaalsContact O-CB 3.3Å; W86-T90 WeakPolarHBondContact O-CB 3.27Å; W86-T90 PolarHBondContact O-N 3.19Å; W86-T90 PolarHBondContact O-OG1 3.05Å
87	E	97.4	Very high	95.9	Very high	134 Å²	134	70.7 Å²	70.7	63%	0.626	35%	0.348	S	S	*	.	H	α-helix	trans	-64.5	-51.6	176	-70.2	178.2	-178.4	0	0	111.6	P83 G89 T90 Q91	P83-E87 PolarHBondContact O-N 3.25Å; E87-G89 VanDerWaalsContact C-N 3.31Å; E87-G89 PolarHBondContact O-N 3.16Å; E87-T90 PolarHBondContact O-N 2.64Å; E87-Q91 PolarHBondContact O-N 2.87Å
88	K	97.2	Very high	96.1	Very high	127 Å²	127	75.9 Å²	75.9	55%	0.552	37%	0.372	S	S	*	.	H	α-helix	trans	-61	-42	175.8	-73	179.9	-179	168.6	0	111.4	E84 Q91 S92	E84-K88 VanDerWaalsContact CD-NZ 3.28Å; E84-K88 HydrophobicContact CG-CD 4.06Å; E84-K88 HydrophobicContact CG-CG 4.33Å; E84-K88 WeakPolarHBondContact O-CB 3.42Å; E84-K88 WeakPolarHBondContact O-CG 3.27Å; E84-K88 PolarHBondContact O-N 2.83Å; E84-K88 WeakPolarHBondContact OE1-CE 3.48Å; E84-K88 IonicContact OE1-NZ 3.7Å; E84-K88 PolarHBondContact OE1-NZ 3.09Å; E84-K88 IonicContact OE2-NZ 3.29Å; K88-Q91 PolarHBondContact O-N 2.93Å; K88-S92 WeakPolarHBondContact O-CB 3.5Å; K88-S92 PolarHBondContact O-N 2.87Å
89	G	97	Very high	96.5	Very high	13 Å²	13	72.9 Å²	72.9	13%	0.134	36%	0.355	C	S	.	.	H	α-helix	trans	-58.8	-47.7	174.9	0	0	0	0	0	112	Y85 W86 E87 Q91 S92 R93	Y85-G89 PolarHBondContact O-N 3.09Å; W86-G89 PolarHBondContact O-N 3.07Å; E87-G89 VanDerWaalsContact C-N 3.31Å; E87-G89 PolarHBondContact O-N 3.16Å; G89-Q91 PolarHBondContact O-N 2.7Å; G89-S92 WeakPolarHBondContact O-CB 3.16Å; G89-S92 PolarHBondContact O-N 3.17Å; G89-R93 WeakPolarHBondContact O-CG 3.46Å; G89-R93 PolarHBondContact O-N 3.09Å
90	T	98.3	Very high	96.9	Very high	19 Å²	19	65.8 Å²	65.8	12%	0.117	32%	0.324	C	S	.	.	H	α-helix	trans	-60.7	-46	178	-64.9	0	0	0	0	111.6	Q68 K70 W86 E87 S92 R93 K94	Q68-T90 WeakPolarHBondContact O-CG2 3.47Å; K70-T90 WeakPolarHBondContact CB-OG1 3.31Å; K70-T90 PolarHBondContact N-OG1 2.81Å; W86-T90 VanDerWaalsContact O-CB 3.3Å; W86-T90 WeakPolarHBondContact O-CB 3.27Å; W86-T90 PolarHBondContact O-N 3.19Å; W86-T90 PolarHBondContact O-OG1 3.05Å; E87-T90 PolarHBondContact O-N 2.64Å; T90-S92 VanDerWaalsContact C-N 3.33Å; T90-S92 PolarHBondContact O-N 2.65Å; T90-R93 PolarHBondContact O-N 3.23Å; T90-K94 HydrophobicContact CG2-CD 4.43Å; T90-K94 PolarHBondContact O-N 3Å
91	Q	98.1	Very high	97	Very high	125 Å²	125	68.2 Å²	68.2	58%	0.584	33%	0.334	S	S	*	.	H	α-helix	trans	-64.5	-39.1	178.4	-174.1	59.9	13.7	0	0	112	E87 K88 G89 K94 S95	E87-Q91 PolarHBondContact O-N 2.87Å; K88-Q91 PolarHBondContact O-N 2.93Å; G89-Q91 PolarHBondContact O-N 2.7Å; Q91-K94 PolarHBondContact O-N 2.95Å; Q91-S95 PolarHBondContact O-N 3.41Å
92	S	96.9	Very high	97	Very high	55 Å²	55	71.7 Å²	71.7	39%	0.385	36%	0.355	S	S	.	.	H	α-helix	trans	-60.5	-46.3	173.1	-179.8	0	0	0	0	111.6	K88 G89 T90 K94 S95 K96	K88-S92 WeakPolarHBondContact O-CB 3.5Å; K88-S92 PolarHBondContact O-N 2.87Å; G89-S92 WeakPolarHBondContact O-CB 3.16Å; G89-S92 PolarHBondContact O-N 3.17Å; T90-S92 VanDerWaalsContact C-N 3.33Å; T90-S92 PolarHBondContact O-N 2.65Å; S92-K94 PolarHBondContact O-N 3.1Å; S92-S95 WeakPolarHBondContact O-CB 3.28Å; S92-S95 PolarHBondContact O-N 3.48Å; S92-K96 WeakPolarHBondContact O-CG 3.5Å; S92-K96 PolarHBondContact O-N 3.47Å
93	R	97.9	Very high	96.9	Very high	7 Å²	7	66.9 Å²	66.9	3%	0.026	33%	0.334	C	S	.	.	H	α-helix	trans	-63.5	-40.5	177.6	-63.2	-56	176.3	72.2	2.3	112.4	Y32 Y34 A51 D61 Y63 G89 T90 S95 K96 Q97	Y32-R93 VanDerWaalsContact CD1-NH2 3.29Å; Y34-R93 PolarHBondContact OH-NE 3.07Å; A51-R93 PolarHBondContact O-NH1 3.05Å; A51-R93 VanDerWaalsContact O-NH1 3.09Å; D61-R93 IonicContact OD1-CZ 3.83Å; D61-R93 IonicContact OD1-NH1 3.6Å; D61-R93 PolarHBondContact OD1-NH1 2.9Å; D61-R93 IonicContact OD1-NH2 3.8Å; D61-R93 PolarHBondContact OD1-NH2 3.3Å; D61-R93 IonicContact OD2-NH2 3.44Å; Y63-R93 HydrophobicContact CD1-CB 3.95Å; Y63-R93 HydrophobicContact CD2-CB 3.5Å; Y63-R93 VanDerWaalsContact CD2-CB 3.5Å; Y63-R93 HydrophobicContact CD2-CG 4.06Å; Y63-R93 HydrophobicContact CE1-CB 4.15Å; Y63-R93 HydrophobicContact CE2-CB 3.7Å; Y63-R93 HydrophobicContact CG-CB 3.64Å; Y63-R93 HydrophobicContact CG-CG 4.02Å; G89-R93 WeakPolarHBondContact O-CG 3.46Å; G89-R93 PolarHBondContact O-N 3.09Å; T90-R93 PolarHBondContact O-N 3.23Å; R93-S95 PolarHBondContact O-N 2.98Å; R93-K96 PolarHBondContact O-N 3.4Å; R93-Q97 PolarHBondContact O-N 2.86Å
94	K	98.3	Very high	96.9	Very high	76 Å²	76	63 Å²	63	33%	0.33	31%	0.309	S	S	.	.	H	α-helix	trans	-60.2	-44.4	173.1	-75.9	179.1	177.1	-179.3	0	112.5	Y63 Q68 T90 Q91 S92 Q97 Q98	Y63-K94 HydrophobicContact CE2-CG 4.26Å; Y63-K94 VanDerWaalsContact OH-CG 3.26Å; Y63-K94 WeakPolarHBondContact OH-CG 3.38Å; Q68-K94 WeakPolarHBondContact O-CE 3.22Å; T90-K94 HydrophobicContact CG2-CD 4.43Å; T90-K94 PolarHBondContact O-N 3Å; Q91-K94 PolarHBondContact O-N 2.95Å; S92-K94 PolarHBondContact O-N 3.1Å; K94-Q97 PolarHBondContact O-N 3.36Å; K94-Q98 PolarHBondContact O-N 2.93Å
95	S	97.8	Very high	96.7	Very high	76 Å²	76	61.3 Å²	61.3	53%	0.531	30%	0.303	S	S	.	.	H	α-helix	trans	-61.5	-44.2	176.3	-178	0	0	0	0	111.4	Q91 S92 R93 Q98 W99	Q91-S95 PolarHBondContact O-N 3.41Å; S92-S95 WeakPolarHBondContact O-CB 3.28Å; S92-S95 PolarHBondContact O-N 3.48Å; R93-S95 PolarHBondContact O-N 2.98Å; S95-Q98 PolarHBondContact O-N 3Å; S95-W99 PolarHBondContact O-N 2.9Å
96	K	97.7	Very high	96.6	Very high	58 Å²	58	62.5 Å²	62.5	25%	0.252	31%	0.311	S	S	.	.	H	α-helix	trans	-64.6	-40.6	176	-68.4	-66.8	-178.7	171.6	0	112.4	Y34 F49 S92 R93 Q98 W99 F100 W123	Y34-K96 HydrophobicContact CD1-CB 4.29Å; Y34-K96 HydrophobicContact CE1-CB 4.05Å; Y34-K96 HydrophobicContact CE1-CG 4.12Å; F49-K96 HydrophobicContact CZ-CB 4.2Å; S92-K96 WeakPolarHBondContact O-CG 3.5Å; S92-K96 PolarHBondContact O-N 3.47Å; R93-K96 PolarHBondContact O-N 3.4Å; K96-Q98 VanDerWaalsContact C-N 3.3Å; K96-Q98 PolarHBondContact O-N 2.86Å; K96-W99 WeakPolarHBondContact O-CB 3.26Å; K96-W99 PolarHBondContact O-N 2.87Å; K96-W99 VanDerWaalsContact O-N 3.1Å; K96-F100 VanDerWaalsContact O-CD2 3.32Å; K96-F100 WeakPolarHBondContact O-CD2 3.43Å; K96-F100 PolarHBondContact O-N 3.49Å; K96-W123 HydrophobicContact CD-CZ3 3.74Å; K96-W123 HydrophobicContact CG-CZ3 4.45Å
97	Q	97.5	Very high	96.4	Very high	20 Å²	20	61.3 Å²	61.3	9%	0.093	31%	0.308	C	S	.	.	H	α-helix	trans	-54.4	-46.4	174.3	-179.3	176.5	-27.4	0	0	111.8	F49 Y63 R93 K94 F100 K101	F49-Q97 HydrophobicContact CB-CG 3.85Å; F49-Q97 HydrophobicContact CD1-CB 3.66Å; F49-Q97 HydrophobicContact CD1-CG 3.81Å; F49-Q97 HydrophobicContact CD2-CB 4.31Å; F49-Q97 HydrophobicContact CD2-CG 4.39Å; F49-Q97 HydrophobicContact CE1-CB 3.7Å; F49-Q97 HydrophobicContact CE1-CG 4.37Å; F49-Q97 HydrophobicContact CE2-CB 4.37Å; F49-Q97 HydrophobicContact CG-CB 3.94Å; F49-Q97 HydrophobicContact CG-CG 3.78Å; F49-Q97 HydrophobicContact CZ-CB 4.03Å; Y63-Q97 PolarHBondContact OH-OE1 2.78Å; R93-Q97 PolarHBondContact O-N 2.86Å; K94-Q97 PolarHBondContact O-N 3.36Å; Q97-F100 PolarHBondContact O-N 3.36Å; Q97-K101 PolarHBondContact O-N 2.8Å; Q97-K101 VanDerWaalsContact O-N 3.08Å
98	Q	97.1	Very high	96.3	Very high	109 Å²	109	55.2 Å²	55.2	51%	0.509	28%	0.279	S	S	.	.	H	α-helix	trans	-65.9	-40.1	176.6	-63.8	-55.3	-42.9	0	0	112.3	K94 S95 K96 F100 K101 V102	K94-Q98 PolarHBondContact O-N 2.93Å; S95-Q98 PolarHBondContact O-N 3Å; K96-Q98 VanDerWaalsContact C-N 3.3Å; K96-Q98 PolarHBondContact O-N 2.86Å; Q98-F100 VanDerWaalsContact C-N 3.35Å; Q98-F100 PolarHBondContact O-N 3.06Å; Q98-K101 PolarHBondContact O-N 3.03Å; Q98-V102 PolarHBondContact O-N 2.97Å; Q98-V102 VanDerWaalsContact O-N 3.14Å
99	W	96.9	Very high	96.1	Very high	77 Å²	77	57 Å²	57	29%	0.292	29%	0.287	S	S	.	.	H	α-helix	trans	-59	-45.5	175.1	-178.1	93.4	0	0	0	111.7	S95 K96 V102 N103 L121 Y146 W177	S95-W99 PolarHBondContact O-N 2.9Å; K96-W99 WeakPolarHBondContact O-CB 3.26Å; K96-W99 PolarHBondContact O-N 2.87Å; K96-W99 VanDerWaalsContact O-N 3.1Å; W99-V102 PolarHBondContact O-N 3.42Å; W99-N103 VanDerWaalsContact CD2-ND2 3.3Å; W99-N103 HydrophobicContact CE3-CB 4.47Å; W99-N103 HydrophobicContact CH2-CB 4.27Å; W99-N103 HydrophobicContact CZ2-CB 4.4Å; W99-N103 HydrophobicContact CZ3-CB 4.31Å; W99-N103 PolarHBondContact NE1-ND2 2.85Å; W99-N103 WeakPolarHBondContact O-CB 3.34Å; W99-N103 PolarHBondContact O-N 2.88Å; W99-N103 PolarHBondContact O-ND2 2.82Å; W99-L121 HydrophobicContact CZ3-CD2 4.37Å; W99-Y146 HydrophobicContact CH2-CD1 4.47Å; W99-Y146 AromaticContact CH2-CE1 3.69Å; W99-Y146 HydrophobicContact CH2-CE1 3.69Å; W99-Y146 HydrophobicContact CZ3-CE1 4.1Å; W99-W177 HydrophobicContact CZ2-CH2 4.44Å; W99-W177 HydrophobicContact CZ2-CZ2 4.34Å
100	F	97.4	Very high	95.9	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-62.3	-44.5	177.9	-93.4	-93.5	0	0	0	112.1	Y34 A36 F49 K96 Q97 Q98 V102 N103 I104 L121 W123	Y34-F100 VanDerWaalsContact CB-CZ 3.48Å; Y34-F100 HydrophobicContact CD1-CE2 4.35Å; Y34-F100 HydrophobicContact CG-CE2 4.18Å; Y34-F100 HydrophobicContact CG-CZ 4.43Å; A36-F100 HydrophobicContact CB-CB 3.68Å; A36-F100 HydrophobicContact CB-CD1 3.41Å; A36-F100 VanDerWaalsContact CB-CD1 3.41Å; A36-F100 HydrophobicContact CB-CE1 4.27Å; A36-F100 HydrophobicContact CB-CG 3.84Å; F49-F100 HydrophobicContact CD2-CB 4.19Å; F49-F100 HydrophobicContact CD2-CD2 4.32Å; F49-F100 HydrophobicContact CD2-CG 4.23Å; F49-F100 HydrophobicContact CE2-CB 4.2Å; F49-F100 AromaticContact CE2-CD2 3.56Å; F49-F100 HydrophobicContact CE2-CD2 3.56Å; F49-F100 HydrophobicContact CE2-CE2 4.02Å; F49-F100 AromaticContact CE2-CG 3.91Å; F49-F100 HydrophobicContact CE2-CG 3.91Å; F49-F100 HydrophobicContact CZ-CD2 4.47Å; K96-F100 VanDerWaalsContact O-CD2 3.32Å; K96-F100 WeakPolarHBondContact O-CD2 3.43Å; K96-F100 PolarHBondContact O-N 3.49Å; Q97-F100 PolarHBondContact O-N 3.36Å; Q98-F100 VanDerWaalsContact C-N 3.35Å; Q98-F100 PolarHBondContact O-N 3.06Å; F100-V102 VanDerWaalsContact C-N 3.29Å; F100-V102 PolarHBondContact O-N 3.47Å; F100-N103 PolarHBondContact O-N 2.82Å; F100-I104 WeakPolarHBondContact O-CB 3.15Å; F100-I104 PolarHBondContact O-N 2.77Å; F100-L121 HydrophobicContact CD1-CB 4.15Å; F100-L121 HydrophobicContact CD1-CD2 3.7Å; F100-L121 HydrophobicContact CD1-CG 3.9Å; F100-L121 HydrophobicContact CE1-CB 4.19Å; F100-L121 HydrophobicContact CE1-CD2 3.88Å; F100-L121 HydrophobicContact CE1-CG 3.69Å; F100-L121 WeakPolarHBondContact CE1-O 3.32Å; F100-W123 HydrophobicContact CE1-CB 4.43Å; F100-W123 HydrophobicContact CE2-CB 4.34Å; F100-W123 HydrophobicContact CE2-CE3 4.22Å; F100-W123 HydrophobicContact CZ-CB 3.55Å
101	K	94.1	Very high	95.7	Very high	113 Å²	113	61.8 Å²	61.8	49%	0.491	30%	0.302	S	S	.	.	H	α-helix	trans	-56.1	-42.2	177.1	-177	172.4	-177.9	166.2	0	112.5	Q97 Q98 I104	Q97-K101 PolarHBondContact O-N 2.8Å; Q97-K101 VanDerWaalsContact O-N 3.08Å; Q98-K101 PolarHBondContact O-N 3.03Å; K101-I104 WeakPolarHBondContact O-CG2 3.45Å
102	V	95.1	Very high	95.5	Very high	86 Å²	86	67.2 Å²	67.2	52%	0.521	32%	0.317	S	S	.	.	H	α-helix	trans	-72.4	-41.9	177.1	175.2	0	0	0	0	111.8	Q98 W99 F100 I106	Q98-V102 PolarHBondContact O-N 2.97Å; Q98-V102 VanDerWaalsContact O-N 3.14Å; W99-V102 PolarHBondContact O-N 3.42Å; F100-V102 VanDerWaalsContact C-N 3.29Å; F100-V102 PolarHBondContact O-N 3.47Å; V102-I106 HydrophobicContact CG1-CD1 4.08Å; V102-I106 WeakPolarHBondContact O-CG1 3.47Å; V102-I106 PolarHBondContact O-N 2.61Å
103	N	94.8	Very high	95.3	Very high	40 Å²	40	67.3 Å²	67.3	21%	0.214	31%	0.312	C	S	.	.	H	α-helix	trans	-75.6	-30.7	-172.9	-79.1	-86.1	0	0	0	113.1	W99 F100 D105 I106 L107 L121	W99-N103 VanDerWaalsContact CD2-ND2 3.3Å; W99-N103 HydrophobicContact CE3-CB 4.47Å; W99-N103 HydrophobicContact CH2-CB 4.27Å; W99-N103 HydrophobicContact CZ2-CB 4.4Å; W99-N103 HydrophobicContact CZ3-CB 4.31Å; W99-N103 PolarHBondContact NE1-ND2 2.85Å; W99-N103 WeakPolarHBondContact O-CB 3.34Å; W99-N103 PolarHBondContact O-N 2.88Å; W99-N103 PolarHBondContact O-ND2 2.82Å; F100-N103 PolarHBondContact O-N 2.82Å; N103-D105 VanDerWaalsContact C-N 3.33Å; N103-D105 PolarHBondContact O-N 2.73Å; N103-I106 PolarHBondContact O-N 2.82Å; N103-L107 WeakPolarHBondContact O-CG 3.37Å; N103-L107 PolarHBondContact O-N 3.49Å; N103-L121 HydrophobicContact CB-CD2 4.43Å
104	I	94.9	Very high	94.9	Very high	4 Å²	4	71 Å²	71	2%	0.021	33%	0.332	C	S	.	.	H	α-helix	trans	-64.1	-39.8	176.9	-157.8	158.5	0	0	0	111.4	F100 K101 I106 L107 M108 L121 Y148	F100-I104 WeakPolarHBondContact O-CB 3.15Å; F100-I104 PolarHBondContact O-N 2.77Å; K101-I104 WeakPolarHBondContact O-CG2 3.45Å; I104-I106 VanDerWaalsContact C-N 3.33Å; I104-I106 PolarHBondContact O-N 3.13Å; I104-L107 PolarHBondContact O-N 2.75Å; I104-M108 WeakPolarHBondContact O-CG 3.42Å; I104-M108 PolarHBondContact O-N 3.45Å; I104-L121 HydrophobicContact CD1-CB 4.01Å; I104-L121 HydrophobicContact CG1-CB 4.34Å; I104-Y148 HydrophobicContact CG1-CE2 4.33Å
105	D	92.9	Very high	94.3	Very high	76 Å²	76	73.3 Å²	73.3	41%	0.406	35%	0.348	S	S	.	.	H	α-helix	trans	-63.4	-38	175.1	-74.9	-15.7	0	0	0	112.3	N103 K109	N103-D105 VanDerWaalsContact C-N 3.33Å; N103-D105 PolarHBondContact O-N 2.73Å; D105-K109 WeakPolarHBondContact O-CG 3.31Å; D105-K109 PolarHBondContact O-N 3.48Å
106	I	93.3	Very high	93.9	Very high	64 Å²	64	75.8 Å²	75.8	33%	0.328	36%	0.356	S	S	.	.	H	α-helix	trans	-67.4	-44.8	176	-66.2	169.6	0	0	0	110	V102 N103 I104 K109 R110	V102-I106 HydrophobicContact CG1-CD1 4.08Å; V102-I106 WeakPolarHBondContact O-CG1 3.47Å; V102-I106 PolarHBondContact O-N 2.61Å; N103-I106 PolarHBondContact O-N 2.82Å; I104-I106 VanDerWaalsContact C-N 3.33Å; I104-I106 PolarHBondContact O-N 3.13Å; I106-K109 PolarHBondContact O-N 2.88Å; I106-R110 PolarHBondContact O-N 2.83Å
107	L	94	Very high	93.6	Very high	9 Å²	9	78.1 Å²	78.1	5%	0.047	37%	0.371	C	S	.	.	H	α-helix	trans	-63.4	-46	179.4	-72.9	-179.2	0	0	0	111.8	N103 I104 K109 R110 M111 L121 Y148 F153	N103-L107 WeakPolarHBondContact O-CG 3.37Å; N103-L107 PolarHBondContact O-N 3.49Å; I104-L107 PolarHBondContact O-N 2.75Å; L107-K109 VanDerWaalsContact C-N 3.26Å; L107-K109 PolarHBondContact O-N 2Å; L107-R110 PolarHBondContact O-N 2.98Å; L107-M111 WeakPolarHBondContact O-CB 3.22Å; L107-M111 VanDerWaalsContact O-CG 3.26Å; L107-M111 WeakPolarHBondContact O-CG 3.01Å; L107-M111 PolarHBondContact O-N 2.94Å; L107-L121 HydrophobicContact CD1-CD1 3.6Å; L107-L121 HydrophobicContact CD1-CD2 3.86Å; L107-L121 HydrophobicContact CD1-CG 4.26Å; L107-Y148 HydrophobicContact CB-CD2 4.39Å; L107-Y148 HydrophobicContact CB-CE2 3.99Å; L107-Y148 HydrophobicContact CD1-CD2 3.91Å; L107-Y148 HydrophobicContact CD1-CE2 4.24Å; L107-F153 HydrophobicContact CD2-CE1 3.69Å; L107-F153 HydrophobicContact CD2-CE2 3.73Å; L107-F153 HydrophobicContact CD2-CZ 3.19Å
108	M	95.1	Very high	93.4	Very high	6 Å²	6	80 Å²	80	3%	0.03	38%	0.384	C	S	.	.	H	α-helix	trans	-54.4	-43.4	176.1	-74.1	175.1	61	0	0	111.7	S38 I104 M111 R112 Q113 N114 N115 H119 Y148	S38-M108 VanDerWaalsContact CB-SD 3.5Å; I104-M108 WeakPolarHBondContact O-CG 3.42Å; I104-M108 PolarHBondContact O-N 3.45Å; M108-M111 CarbonylContact O-C 3.54Å; M108-M111 PolarHBondContact O-N 2.94Å; M108-R112 PolarHBondContact O-N 2.85Å; M108-Q113 PolarHBondContact O-N 2.83Å; M108-N114 WeakPolarHBondContact CE-O 2.98Å; M108-N115 WeakPolarHBondContact CE-OD1 3.31Å; M108-H119 HydrophobicContact CG-CB 4.3Å; M108-H119 HydrophobicContact SD-CB 4.41Å; M108-Y148 WeakPolarHBondContact CG-OH 3.41Å
109	K	93.5	Very high	93.3	Very high	163 Å²	163	75.2 Å²	75.2	71%	0.709	36%	0.361	S	S	*	.	H	α-helix	trans	-63.9	-44.4	175.7	-70.3	171.9	-174.2	171.9	0	112.4	D105 I106 L107 M111 R112	D105-K109 WeakPolarHBondContact O-CG 3.31Å; D105-K109 PolarHBondContact O-N 3.48Å; I106-K109 PolarHBondContact O-N 2.88Å; L107-K109 VanDerWaalsContact C-N 3.26Å; L107-K109 PolarHBondContact O-N 2Å; K109-M111 VanDerWaalsContact C-N 3.29Å; K109-M111 PolarHBondContact O-N 2.85Å; K109-R112 PolarHBondContact O-N 3.49Å; K109-R112 VanDerWaalsContact O-N 3.09Å
110	R	92.8	Very high	93.2	Very high	68 Å²	68	74 Å²	74	26%	0.257	36%	0.36	S	S	.	.	H	α-helix	trans	-63.7	-36.2	177.3	-73.4	-175.8	-176.4	157.1	7	112.3	I106 L107 R112 E172 T173	I106-R110 PolarHBondContact O-N 2.83Å; L107-R110 PolarHBondContact O-N 2.98Å; R110-R112 PolarHBondContact O-N 2.83Å; R110-E172 IonicContact CZ-OE2 3.45Å; R110-E172 IonicContact NE-OE2 2.67Å; R110-E172 PolarHBondContact NE-OE2 3.08Å; R110-E172 IonicContact NH2-OE1 2.78Å; R110-E172 PolarHBondContact NH2-OE1 3.24Å; R110-E172 IonicContact NH2-OE2 2.89Å; R110-E172 PolarHBondContact NH2-OE2 3.35Å; R110-T173 PolarHBondContact NH1-OG1 2.78Å
111	M	93.8	Very high	93.2	Very high	66 Å²	66	74.1 Å²	74.1	33%	0.325	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-1.9	176.3	-63.2	-61.7	-76	0	0	112.9	L107 M108 K109 Q113 Y148 I167 A169	L107-M111 WeakPolarHBondContact O-CB 3.22Å; L107-M111 VanDerWaalsContact O-CG 3.26Å; L107-M111 WeakPolarHBondContact O-CG 3.01Å; L107-M111 PolarHBondContact O-N 2.94Å; M108-M111 CarbonylContact O-C 3.54Å; M108-M111 PolarHBondContact O-N 2.94Å; K109-M111 VanDerWaalsContact C-N 3.29Å; K109-M111 PolarHBondContact O-N 2.85Å; M111-Q113 HydrophobicContact CB-CG 4.01Å; M111-Q113 PolarHBondContact O-N 2.71Å; M111-Y148 HydrophobicContact CB-CE1 4.38Å; M111-Y148 HydrophobicContact CE-CD1 4.27Å; M111-Y148 HydrophobicContact CE-CE1 4.43Å; M111-Y148 HydrophobicContact CG-CD1 4.19Å; M111-Y148 HydrophobicContact CG-CE1 3.77Å; M111-I167 HydrophobicContact CE-CD1 4.1Å; M111-I167 HydrophobicContact SD-CD1 4.05Å; M111-A169 HydrophobicContact SD-CB 3.32Å; M111-A169 WeakPolarHBondContact SD-CB 3.38Å
112	R	93.6	Very high	93.4	Very high	238 Å²	238	72 Å²	72	90%	0.898	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.4	33.8	-178.1	-52.9	178.1	-179.4	176.8	-0.1	112.9	M108 K109 R110	M108-R112 PolarHBondContact O-N 2.85Å; K109-R112 PolarHBondContact O-N 3.49Å; K109-R112 VanDerWaalsContact O-N 3.09Å; R110-R112 PolarHBondContact O-N 2.83Å
113	Q	93.9	Very high	93.6	Very high	58 Å²	58	68.6 Å²	68.6	27%	0.271	33%	0.33	S	S	.	.			trans	-91.4	157.3	177.7	-69.9	162	-38.2	0	0	110.8	M108 M111 H119 Y148 D149	M108-Q113 PolarHBondContact O-N 2.83Å; M111-Q113 HydrophobicContact CB-CG 4.01Å; M111-Q113 PolarHBondContact O-N 2.71Å; Q113-H119 PolarHBondContact NE2-CE1 2.83Å; Q113-H119 PolarHBondContact NE2-ND1 2.79Å; Q113-Y148 VanDerWaalsContact OE1-CE1 3.27Å; Q113-Y148 PolarHBondContact OE1-OH 3.48Å; Q113-D149 PolarHBondContact NE2-OD2 3.02Å; Q113-D149 VanDerWaalsContact NE2-OD2 3.09Å
114	N	88.3	Confident	93.7	Very high	85 Å²	85	69.4 Å²	69.4	46%	0.455	33%	0.333	S	S	.	.			trans	-105.9	179.5	175.4	65.3	40.8	0	0	0	109.9	M108 N116	M108-N114 WeakPolarHBondContact CE-O 2.98Å; N114-N116 VanDerWaalsContact C-N 3.31Å; N114-N116 PolarHBondContact O-N 2.82Å; N114-N116 WeakPolarHBondContact OD1-CB 3.49Å; N114-N116 PolarHBondContact OD1-N 2.92Å
115	N	86.8	Confident	93.8	Very high	123 Å²	123	69.9 Å²	69.9	66%	0.658	34%	0.336	S	S	*	.	S	Bend	trans	-88.9	7	-177.5	-62.7	-4	0	0	0	113.7	K39 M108	K39-N115 PolarHBondContact NZ-O 2.84Å; M108-N115 WeakPolarHBondContact CE-OD1 3.31Å
116	N	88.6	Confident	94	Very high	129 Å²	129	66.3 Å²	66.3	69%	0.69	32%	0.316	S	S	*	.	S	Bend	trans	-73.1	-34.2	-177	-65.6	-8.3	0	0	0	111.6	K39 N114	K39-N116 PolarHBondContact NZ-O 2.84Å; N114-N116 VanDerWaalsContact C-N 3.31Å; N114-N116 PolarHBondContact O-N 2.82Å; N114-N116 WeakPolarHBondContact OD1-CB 3.49Å; N114-N116 PolarHBondContact OD1-N 2.92Å
117	D	90.8	Very high	94.3	Very high	107 Å²	107	63.2 Å²	63.2	57%	0.572	30%	0.301	S	S	*	.	S	Bend	trans	-96.3	159.6	176.7	-62	-40.8	0	0	0	111.3	K39	K39-D117 VanDerWaalsContact CE-C 3.48Å; K39-D117 VanDerWaalsContact CE-O 3.28Å; K39-D117 WeakPolarHBondContact CE-O 3.34Å; K39-D117 PolarHBondContact NZ-O 2.68Å
118	T	93	Very high	94.4	Very high	59 Å²	59	64.9 Å²	64.9	36%	0.362	31%	0.308	S	S	.	.			trans	-92.7	126.7	171	-56.9	0	0	0	0	107.9	F37 K39 V41	F37-T118 HydrophobicContact CB-CG2 4.15Å; F37-T118 HydrophobicContact CD1-CG2 3.84Å; F37-T118 HydrophobicContact CG-CG2 4.48Å; K39-T118 WeakPolarHBondContact CE-OG1 3.26Å; K39-T118 HydrophobicContact CG-CG2 4.07Å; V41-T118 HydrophobicContact CG2-CG2 3.92Å
119	H	95.2	Very high	94.5	Very high	9 Å²	9	64.6 Å²	64.6	4%	0.042	31%	0.307	C	S	.	.			trans	-107.6	154.8	176.7	-61.5	-72.4	0	0	0	110.4	F37 S38 M108 Q113 Y148 D149	F37-H119 CarbonylContact C-O 3.55Å; F37-H119 WeakPolarHBondContact CA-O 2.87Å; S38-H119 PolarHBondContact N-O 3.14Å; S38-H119 PolarHBondContact OG-N 2.79Å; M108-H119 HydrophobicContact CG-CB 4.3Å; M108-H119 HydrophobicContact SD-CB 4.41Å; Q113-H119 PolarHBondContact NE2-CE1 2.83Å; Q113-H119 PolarHBondContact NE2-ND1 2.79Å; H119-Y148 HydrophobicContact CB-CE2 4.19Å; H119-Y148 WeakPolarHBondContact CB-OH 3.44Å; H119-D149 WeakPolarHBondContact CA-OD1 3.37Å; H119-D149 WeakPolarHBondContact CB-OD1 3.35Å; H119-D149 IonicContact CE1-OD2 2.97Å; H119-D149 IonicContact CG-OD1 2.82Å; H119-D149 IonicContact CG-OD2 2.79Å; H119-D149 IonicContact ND1-OD1 3.6Å; H119-D149 PolarHBondContact ND1-OD1 2.87Å; H119-D149 IonicContact ND1-OD2 3.4Å; H119-D149 PolarHBondContact ND1-OD2 3.22Å
120	I	95.8	Very high	94.7	Very high	52 Å²	52	59.3 Å²	59.3	27%	0.267	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	127.2	-175.4	-48.6	178.6	0	0	0	109	T35 A36 F37 Q122 Y148 D149	T35-I120 HydrophobicContact CG2-CG2 3.86Å; A36-I120 WeakPolarHBondContact O-CA 3.35Å; F37-I120 HydrophobicContact CD1-CD1 3.99Å; F37-I120 HydrophobicContact CD1-CG1 3.67Å; F37-I120 HydrophobicContact CE1-CD1 3.49Å; F37-I120 VanDerWaalsContact CE1-CD1 3.49Å; F37-I120 HydrophobicContact CE1-CG1 3.72Å; F37-I120 HydrophobicContact CZ-CD1 4.39Å; I120-Q122 HydrophobicContact CG2-CG 3.92Å; I120-Y148 WeakPolarHBondContact O-CA 3.36Å; I120-Y148 WeakPolarHBondContact O-CD2 3.26Å; I120-D149 PolarHBondContact N-OD1 3.19Å; I120-D149 PolarHBondContact O-N 3.33Å
121	L	97.6	Very high	94.7	Very high	2 Å²	2	57.4 Å²	57.4	1%	0.01	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	128.1	168.1	-179.9	62.2	0	0	0	108.6	A36 W99 F100 N103 I104 L107 Y148	A36-L121 PolarHBondContact N-O 3.29Å; A36-L121 PolarHBondContact O-N 3.14Å; W99-L121 HydrophobicContact CZ3-CD2 4.37Å; F100-L121 HydrophobicContact CD1-CB 4.15Å; F100-L121 HydrophobicContact CD1-CD2 3.7Å; F100-L121 HydrophobicContact CD1-CG 3.9Å; F100-L121 HydrophobicContact CE1-CB 4.19Å; F100-L121 HydrophobicContact CE1-CD2 3.88Å; F100-L121 HydrophobicContact CE1-CG 3.69Å; F100-L121 WeakPolarHBondContact CE1-O 3.32Å; N103-L121 HydrophobicContact CB-CD2 4.43Å; I104-L121 HydrophobicContact CD1-CB 4.01Å; I104-L121 HydrophobicContact CG1-CB 4.34Å; L107-L121 HydrophobicContact CD1-CD1 3.6Å; L107-L121 HydrophobicContact CD1-CD2 3.86Å; L107-L121 HydrophobicContact CD1-CG 4.26Å; L121-Y148 HydrophobicContact CB-CD2 4.34Å; L121-Y148 HydrophobicContact CD1-CD2 4.25Å
122	Q	98.1	Very high	94.8	Very high	67 Å²	67	56.7 Å²	56.7	31%	0.313	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	144.9	175.3	-55.7	-174.8	-83.2	0	0	110.3	Y34 T35 I120 Y146 N147	Y34-Q122 CarbonylContact O-C 3.58Å; Y34-Q122 WeakPolarHBondContact O-CA 3.34Å; T35-Q122 HydrophobicContact CG2-CG 4Å; T35-Q122 PolarHBondContact OG1-NE2 2.86Å; I120-Q122 HydrophobicContact CG2-CG 3.92Å; Q122-Y146 CarbonylContact O-C 3.59Å; Q122-Y146 VanDerWaalsContact O-CA 3.27Å; Q122-Y146 WeakPolarHBondContact O-CA 3.2Å; Q122-N147 HydrophobicContact CB-CB 4.33Å; Q122-N147 PolarHBondContact N-O 3.47Å; Q122-N147 PolarHBondContact O-N 3.23Å
123	W	98.2	Very high	94.6	Very high	15 Å²	15	51.4 Å²	51.4	6%	0.057	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	120.1	171.7	178.7	34.4	0	0	0	108.5	I33 Y34 K96 F100 H125 D144 M145 Y146	I33-W123 WeakPolarHBondContact CA-O 3.4Å; Y34-W123 HydrophobicContact CD2-CD2 4.2Å; Y34-W123 AromaticContact CD2-CE3 3.57Å; Y34-W123 HydrophobicContact CD2-CE3 3.57Å; Y34-W123 HydrophobicContact CD2-CZ3 4.09Å; Y34-W123 AromaticContact CE2-CE3 3.87Å; Y34-W123 HydrophobicContact CE2-CE3 3.87Å; Y34-W123 AromaticContact CE2-CZ3 3.9Å; Y34-W123 HydrophobicContact CE2-CZ3 3.9Å; Y34-W123 AromaticContact CG-CE3 3.98Å; Y34-W123 HydrophobicContact CG-CE3 3.98Å; Y34-W123 PolarHBondContact N-O 3.09Å; Y34-W123 PolarHBondContact O-N 2.74Å; K96-W123 HydrophobicContact CD-CZ3 3.74Å; K96-W123 HydrophobicContact CG-CZ3 4.45Å; F100-W123 HydrophobicContact CE1-CB 4.43Å; F100-W123 HydrophobicContact CE2-CB 4.34Å; F100-W123 HydrophobicContact CE2-CE3 4.22Å; F100-W123 HydrophobicContact CZ-CB 3.55Å; W123-H125 AromaticContact CE2-CG 3.93Å; W123-H125 HydrophobicContact CZ2-CB 4.21Å; W123-H125 AromaticContact CZ2-CG 3.77Å; W123-H125 AromaticContact CZ2-ND1 3.83Å; W123-D144 PolarHBondContact NE1-OD1 2.87Å; W123-M145 CarbonylContact C-O 3.57Å; W123-M145 WeakPolarHBondContact CA-O 3.47Å; W123-Y146 HydrophobicContact CB-CD1 3.9Å; W123-Y146 HydrophobicContact CB-CE1 3.74Å; W123-Y146 AromaticContact CD1-CD1 3.93Å; W123-Y146 AromaticContact CD1-CE1 3.5Å; W123-Y146 AromaticContact CD1-CE2 3.71Å; W123-Y146 AromaticContact CD1-CZ 3.39Å; W123-Y146 HydrophobicContact CD2-CE1 4.04Å; W123-Y146 AromaticContact CE2-CZ 3.91Å; W123-Y146 HydrophobicContact CG-CD1 4.02Å; W123-Y146 AromaticContact CG-CE1 3.49Å; W123-Y146 HydrophobicContact CG-CE1 3.49Å; W123-Y146 VanDerWaalsContact CG-CE1 3.49Å; W123-Y146 HydrophobicContact CG-CE2 4.48Å; W123-Y146 AromaticContact CG-CZ 3.76Å; W123-Y146 AromaticContact NE1-CE2 3.76Å; W123-Y146 AromaticContact NE1-CZ 3.46Å; W123-Y146 PolarHBondContact NE1-OH 2.81Å
124	M	97.8	Very high	94.4	Very high	57 Å²	57	54.6 Å²	54.6	28%	0.281	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	119.8	175.1	-177.9	-180	-64.3	0	0	108	T31 Y32 I33 M143 D144 M145	T31-M124 HydrophobicContact CG2-CG 3.47Å; T31-M124 VanDerWaalsContact CG2-CG 3.47Å; T31-M124 HydrophobicContact CG2-SD 4.1Å; Y32-M124 WeakPolarHBondContact O-CA 3.49Å; I33-M124 HydrophobicContact CD1-CE 3.93Å; I33-M124 HydrophobicContact CG1-CE 4.14Å; I33-M124 HydrophobicContact CG1-CG 4.29Å; M124-M143 HydrophobicContact CG-SD 4.1Å; M124-M143 HydrophobicContact SD-SD 4.02Å; M124-D144 WeakPolarHBondContact O-CA 3.14Å; M124-M145 PolarHBondContact N-O 2.97Å; M124-M145 PolarHBondContact O-N 3.4Å; M124-M145 HydrophobicContact SD-CE 3.87Å
125	H	96.4	Very high	94.3	Very high	15 Å²	15	53 Å²	53	7%	0.069	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	147.7	174.4	81.5	128.1	0	0	0	112.6	Y32 Y34 W123 M143 D144 Y190	Y32-H125 PolarHBondContact N-O 3.2Å; Y32-H125 PolarHBondContact O-N 2.78Å; Y34-H125 AromaticContact CE2-CD2 3.85Å; Y34-H125 AromaticContact CE2-NE2 3.63Å; W123-H125 AromaticContact CE2-CG 3.93Å; W123-H125 HydrophobicContact CZ2-CB 4.21Å; W123-H125 AromaticContact CZ2-CG 3.77Å; W123-H125 AromaticContact CZ2-ND1 3.83Å; H125-M143 CarbonylContact C-O 3.58Å; H125-M143 WeakPolarHBondContact CA-O 3.4Å; H125-M143 WeakPolarHBondContact CB-O 3.48Å; H125-D144 HydrophobicContact CB-CB 4.23Å; H125-Y190 AromaticContact CE1-CE1 3.46Å; H125-Y190 VanDerWaalsContact CE1-CE1 3.46Å; H125-Y190 WeakPolarHBondContact CE1-CE1 3.45Å; H125-Y190 AromaticContact CE1-CZ 3.67Å; H125-Y190 AromaticContact ND1-CD1 3.93Å; H125-Y190 AromaticContact ND1-CE1 3.35Å; H125-Y190 VanDerWaalsContact ND1-CE1 3.35Å; H125-Y190 WeakPolarHBondContact ND1-CE1 3.21Å
126	G	97.9	Very high	94.6	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	162.6	-167.9	-172	0	0	0	0	0	113.8	L30 M143 L191	L30-G126 CarbonylContact O-C 3.5Å; L30-G126 WeakPolarHBondContact O-CA 3.35Å; G126-M143 PolarHBondContact N-O 3.4Å; G126-M143 PolarHBondContact O-N 3.3Å; G126-L191 WeakPolarHBondContact O-CD2 3.33Å
127	C	98.3	Very high	94.9	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	155.3	-175	58.6	0	0	0	0	111.2	S29 L30 F139 R141 L191 C195 M196	S29-C127 WeakPolarHBondContact CA-O 3.19Å; L30-C127 PolarHBondContact N-O 3.18Å; L30-C127 PolarHBondContact O-N 3.35Å; C127-F139 HydrophobicContact CB-CE2 4.33Å; C127-R141 WeakPolarHBondContact CA-O 3.28Å; C127-L191 VanDerWaalsContact CB-O 3.29Å; C127-L191 WeakPolarHBondContact CB-O 3.35Å; C127-C195 HydrophobicContact CB-CB 3.72Å; C127-C195 WeakPolarHBondContact CB-SG 3.46Å; C127-C195 PolarHBondContact N-SG 3.15Å; C127-C195 WeakPolarHBondContact SG-CB 3.39Å; C127-C195 CovalentContact SG-SG 2.04Å; C127-C195 PolarHBondContact SG-SG 2.89Å; C127-M196 HydrophobicContact CB-CG 4.42Å; C127-M196 HydrophobicContact CB-SD 4.1Å
128	E	98	Very high	95.1	Very high	43 Å²	43	45.7 Å²	45.7	20%	0.201	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	139.2	169.5	-66.3	-177.2	-179.3	0	0	110.2	H28 V140 R141 M143	H28-E128 CarbonylContact O-C 3.5Å; H28-E128 VanDerWaalsContact O-CA 3.3Å; H28-E128 WeakPolarHBondContact O-CA 3.4Å; E128-V140 HydrophobicContact CB-CB 4.35Å; E128-V140 WeakPolarHBondContact O-CB 3.22Å; E128-V140 PolarHBondContact O-N 2.9Å; E128-R141 HydrophobicContact CB-CG 3.99Å; E128-R141 HydrophobicContact CG-CG 4.19Å; E128-R141 PolarHBondContact N-O 2.81Å; E128-R141 PolarHBondContact O-N 2.59Å; E128-R141 IonicContact OE1-CZ 3.49Å; E128-R141 VanDerWaalsContact OE1-CZ 3.29Å; E128-R141 IonicContact OE1-NE 3.48Å; E128-R141 PolarHBondContact OE1-NE 3.38Å; E128-R141 IonicContact OE1-NH2 3.45Å; E128-R141 PolarHBondContact OE1-NH2 3.08Å; E128-R141 IonicContact OE2-CZ 2.73Å; E128-R141 IonicContact OE2-NE 3.63Å; E128-R141 PolarHBondContact OE2-NE 3.5Å; E128-R141 IonicContact OE2-NH2 2.75Å; E128-M143 HydrophobicContact CG-CE 3.88Å
129	G	96.9	Very high	95.3	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.01	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	154.7	179.1	0	0	0	0	0	111.8	K27 H28 K138	K27-G129 WeakPolarHBondContact CA-O 3.22Å; H28-G129 PolarHBondContact N-O 3.17Å; H28-G129 PolarHBondContact O-N 3.27Å; G129-K138 CarbonylContact C-O 3.5Å; G129-K138 WeakPolarHBondContact CA-O 3.36Å
130	E	96.5	Very high	95.4	Very high	51 Å²	51	47.9 Å²	47.9	24%	0.238	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	127.7	178	-179.5	173.9	-130.8	0	0	110	T25 E26 Q132 K138 V140	T25-E130 WeakPolarHBondContact CB-OE1 3.46Å; T25-E130 VanDerWaalsContact CG2-CD 3.4Å; T25-E130 HydrophobicContact CG2-CG 3.19Å; T25-E130 WeakPolarHBondContact CG2-OE1 3.46Å; T25-E130 PolarHBondContact OG1-OE1 2.94Å; E26-E130 WeakPolarHBondContact O-CA 3.46Å; E130-Q132 PolarHBondContact O-N 3.44Å; E130-Q132 PolarHBondContact O-NE2 3.27Å; E130-K138 PolarHBondContact N-O 2.99Å; E130-K138 PolarHBondContact O-N 2.9Å; E130-V140 HydrophobicContact CB-CG2 3.6Å
131	T	94.1	Very high	95.4	Very high	29 Å²	29	51 Å²	51	18%	0.178	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	121	-178.3	-58.1	0	0	0	0	110.6	T25 E26 H28	T25-T131 WeakPolarHBondContact CG2-O 3.18Å; E26-T131 PolarHBondContact O-N 3.37Å; E26-T131 PolarHBondContact O-OG1 3.32Å; H28-T131 PolarHBondContact CD2-OG1 3.44Å; H28-T131 VanDerWaalsContact CD2-OG1 3.27Å; H28-T131 PolarHBondContact NE2-OG1 3.03Å
132	Q	94.1	Very high	95.3	Very high	51 Å²	51	51.5 Å²	51.5	24%	0.238	28%	0.278	C	S	.	.			trans	-83.8	164.7	177.6	-59.2	-53.5	-71.4	0	0	111.1	E130 D134 G135 S136 K138	E130-Q132 PolarHBondContact O-N 3.44Å; E130-Q132 PolarHBondContact O-NE2 3.27Å; Q132-D134 WeakPolarHBondContact CB-OD1 3.39Å; Q132-D134 PolarHBondContact O-N 2.84Å; Q132-D134 VanDerWaalsContact O-N 3.09Å; Q132-G135 PolarHBondContact O-N 2.89Å; Q132-S136 WeakPolarHBondContact CB-O 3.23Å; Q132-S136 PolarHBondContact N-O 3.48Å; Q132-K138 HydrophobicContact CG-CB 3.74Å; Q132-K138 VanDerWaalsContact NE2-CB 3.32Å
133	P	90.8	Very high	95.2	Very high	126 Å²	126	48.9 Å²	48.9	82%	0.818	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-21.9	179.7	-27.1	36.2	0	0	0	115.4	G135	P133-G135 VanDerWaalsContact C-N 3.31Å
134	D	89.6	Confident	95.2	Very high	126 Å²	126	48.5 Å²	48.5	67%	0.674	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	1.3	175.6	65.9	-1.3	0	0	0	113.5	Q132 S136	Q132-D134 WeakPolarHBondContact CB-OD1 3.39Å; Q132-D134 PolarHBondContact O-N 2.84Å; Q132-D134 VanDerWaalsContact O-N 3.09Å; D134-S136 VanDerWaalsContact C-N 3.32Å; D134-S136 VanDerWaalsContact OD1-CB 3.28Å; D134-S136 WeakPolarHBondContact OD1-CB 3.25Å; D134-S136 PolarHBondContact OD1-N 2.91Å; D134-S136 PolarHBondContact OD1-OG 3.46Å; D134-S136 PolarHBondContact OD2-OG 3.18Å
135	G	86.9	Confident	95.2	Very high	50 Å²	50	48.6 Å²	48.6	52%	0.515	27%	0.265	S	S	.	.	S	Bend	trans	85.2	-5.2	-177.6	0	0	0	0	0	114.6	Q132 P133	Q132-G135 PolarHBondContact O-N 2.89Å; P133-G135 VanDerWaalsContact C-N 3.31Å
136	S	91.9	Very high	95.2	Very high	55 Å²	55	48.6 Å²	48.6	39%	0.385	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-73.7	153.7	176.7	70	0	0	0	0	111.9	Q132 D134	Q132-S136 WeakPolarHBondContact CB-O 3.23Å; Q132-S136 PolarHBondContact N-O 3.48Å; D134-S136 VanDerWaalsContact C-N 3.32Å; D134-S136 VanDerWaalsContact OD1-CB 3.28Å; D134-S136 WeakPolarHBondContact OD1-CB 3.25Å; D134-S136 PolarHBondContact OD1-N 2.91Å; D134-S136 PolarHBondContact OD1-OG 3.46Å; D134-S136 PolarHBondContact OD2-OG 3.18Å
137	L	94.6	Very high	95.2	Very high	27 Å²	27	49.8 Å²	49.8	14%	0.141	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	122.5	173.3	-73	175	0	0	0	110.5	H28 M196 M199	H28-L137 HydrophobicContact CB-CD2 4.47Å; L137-M196 HydrophobicContact CB-CE 3.67Å; L137-M199 HydrophobicContact CD1-CE 3.89Å; L137-M199 HydrophobicContact CD1-CG 4.15Å
138	K	96.1	Very high	95.2	Very high	125 Å²	125	50.1 Å²	50.1	54%	0.543	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	129.9	169.4	-175.1	-178.8	176.4	-175.8	0	109.6	G129 E130 Q132 V140	G129-K138 CarbonylContact C-O 3.5Å; G129-K138 WeakPolarHBondContact CA-O 3.36Å; E130-K138 PolarHBondContact N-O 2.99Å; E130-K138 PolarHBondContact O-N 2.9Å; Q132-K138 HydrophobicContact CG-CB 3.74Å; Q132-K138 VanDerWaalsContact NE2-CB 3.32Å; K138-V140 PolarHBondContact O-N 2.86Å
139	F	96.9	Very high	95.1	Very high	53 Å²	53	51 Å²	51	23%	0.232	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	134.5	173.4	177.2	-101.7	0	0	0	111.4	C127 R141 D158 L191 E192 M196	C127-F139 HydrophobicContact CB-CE2 4.33Å; F139-R141 WeakPolarHBondContact CE2-O 2.88Å; F139-D158 WeakPolarHBondContact CZ-OD2 3.39Å; F139-L191 WeakPolarHBondContact CE2-O 3.42Å; F139-E192 HydrophobicContact CD1-CG 4.28Å; F139-E192 HydrophobicContact CE1-CG 3.77Å; F139-E192 HydrophobicContact CE2-CB 4.38Å; F139-E192 HydrophobicContact CE2-CG 4.03Å; F139-E192 HydrophobicContact CZ-CB 4.42Å; F139-E192 HydrophobicContact CZ-CG 3.6Å; F139-M196 HydrophobicContact CB-CE 4.32Å; F139-M196 HydrophobicContact CB-CG 4.34Å; F139-M196 HydrophobicContact CB-SD 4.33Å; F139-M196 HydrophobicContact CD2-CG 3.87Å; F139-M196 HydrophobicContact CD2-SD 3.94Å
140	V	96.4	Very high	95	Very high	61 Å²	61	54.1 Å²	54.1	37%	0.37	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	-52.1	178.2	176.1	0	0	0	0	110.7	E128 E130 K138	E128-V140 HydrophobicContact CB-CB 4.35Å; E128-V140 WeakPolarHBondContact O-CB 3.22Å; E128-V140 PolarHBondContact O-N 2.9Å; E130-V140 HydrophobicContact CB-CG2 3.6Å; K138-V140 PolarHBondContact O-N 2.86Å
141	R	95.8	Very high	95	Very high	116 Å²	116	55.4 Å²	55.4	44%	0.438	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.1	151.9	177.8	65.8	178.4	-170.2	118.8	1.4	112.1	C127 E128 F139	C127-R141 WeakPolarHBondContact CA-O 3.28Å; E128-R141 HydrophobicContact CB-CG 3.99Å; E128-R141 HydrophobicContact CG-CG 4.19Å; E128-R141 PolarHBondContact N-O 2.81Å; E128-R141 PolarHBondContact O-N 2.59Å; E128-R141 IonicContact OE1-CZ 3.49Å; E128-R141 VanDerWaalsContact OE1-CZ 3.29Å; E128-R141 IonicContact OE1-NE 3.48Å; E128-R141 PolarHBondContact OE1-NE 3.38Å; E128-R141 IonicContact OE1-NH2 3.45Å; E128-R141 PolarHBondContact OE1-NH2 3.08Å; E128-R141 IonicContact OE2-CZ 2.73Å; E128-R141 IonicContact OE2-NE 3.63Å; E128-R141 PolarHBondContact OE2-NE 3.5Å; E128-R141 IonicContact OE2-NH2 2.75Å; F139-R141 WeakPolarHBondContact CE2-O 2.88Å
142	G	96.1	Very high	95.1	Very high	13 Å²	13	59.2 Å²	59.2	13%	0.134	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	154.9	165.8	0	0	0	0	0	110.7
143	M	95.8	Very high	95.3	Very high	12 Å²	12	57.1 Å²	57.1	6%	0.059	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	132.9	167.5	62.6	-170.1	76.5	0	0	109	T31 M124 H125 G126 E128 L191	T31-M143 HydrophobicContact CG2-SD 3.88Å; M124-M143 HydrophobicContact CG-SD 4.1Å; M124-M143 HydrophobicContact SD-SD 4.02Å; H125-M143 CarbonylContact C-O 3.58Å; H125-M143 WeakPolarHBondContact CA-O 3.4Å; H125-M143 WeakPolarHBondContact CB-O 3.48Å; G126-M143 PolarHBondContact N-O 3.4Å; G126-M143 PolarHBondContact O-N 3.3Å; E128-M143 HydrophobicContact CG-CE 3.88Å; M143-L191 WeakPolarHBondContact O-CD2 3.38Å
144	D	97.8	Very high	95.6	Very high	8 Å²	8	51.3 Å²	51.3	4%	0.043	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	99.7	167.5	-169.3	-29.4	0	0	0	106.3	W123 M124 H125 S155 F156 T187 L191	W123-D144 PolarHBondContact NE1-OD1 2.87Å; M124-D144 WeakPolarHBondContact O-CA 3.14Å; H125-D144 HydrophobicContact CB-CB 4.23Å; D144-S155 CarbonylContact O-C 3.43Å; D144-S155 VanDerWaalsContact O-CA 3.26Å; D144-S155 WeakPolarHBondContact O-CA 3.13Å; D144-F156 HydrophobicContact CB-CB 3.96Å; D144-F156 PolarHBondContact O-N 3.06Å; D144-T187 HydrophobicContact CB-CG2 4.24Å; D144-T187 WeakPolarHBondContact OD2-CG2 3.21Å; D144-L191 HydrophobicContact CB-CD1 4.22Å
145	M	97.8	Very high	96	Very high	58 Å²	58	47.1 Å²	47.1	29%	0.286	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	134.8	-166.5	-53.6	-173.5	-48.4	0	0	110.5	W123 M124	W123-M145 CarbonylContact C-O 3.57Å; W123-M145 WeakPolarHBondContact CA-O 3.47Å; M124-M145 PolarHBondContact N-O 2.97Å; M124-M145 PolarHBondContact O-N 3.4Å; M124-M145 HydrophobicContact SD-CE 3.87Å
146	Y	98.1	Very high	96.6	Very high	15 Å²	15	45.4 Å²	45.4	6%	0.059	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	130	172.9	-65	-92.2	0	0	0	109.2	W99 Q122 W123 F153 L154 W163 W177	W99-Y146 HydrophobicContact CH2-CD1 4.47Å; W99-Y146 AromaticContact CH2-CE1 3.69Å; W99-Y146 HydrophobicContact CH2-CE1 3.69Å; W99-Y146 HydrophobicContact CZ3-CE1 4.1Å; Q122-Y146 CarbonylContact O-C 3.59Å; Q122-Y146 VanDerWaalsContact O-CA 3.27Å; Q122-Y146 WeakPolarHBondContact O-CA 3.2Å; W123-Y146 HydrophobicContact CB-CD1 3.9Å; W123-Y146 HydrophobicContact CB-CE1 3.74Å; W123-Y146 AromaticContact CD1-CD1 3.93Å; W123-Y146 AromaticContact CD1-CE1 3.5Å; W123-Y146 AromaticContact CD1-CE2 3.71Å; W123-Y146 AromaticContact CD1-CZ 3.39Å; W123-Y146 HydrophobicContact CD2-CE1 4.04Å; W123-Y146 AromaticContact CE2-CZ 3.91Å; W123-Y146 HydrophobicContact CG-CD1 4.02Å; W123-Y146 AromaticContact CG-CE1 3.49Å; W123-Y146 HydrophobicContact CG-CE1 3.49Å; W123-Y146 VanDerWaalsContact CG-CE1 3.49Å; W123-Y146 HydrophobicContact CG-CE2 4.48Å; W123-Y146 AromaticContact CG-CZ 3.76Å; W123-Y146 AromaticContact NE1-CE2 3.76Å; W123-Y146 AromaticContact NE1-CZ 3.46Å; W123-Y146 PolarHBondContact NE1-OH 2.81Å; Y146-F153 WeakPolarHBondContact O-CA 3.16Å; Y146-F153 WeakPolarHBondContact O-CB 3.38Å; Y146-F153 PolarHBondContact O-N 2.84Å; Y146-L154 HydrophobicContact CD2-CB 4.36Å; Y146-L154 HydrophobicContact CD2-CD2 4.47Å; Y146-L154 PolarHBondContact N-O 3.38Å; Y146-L154 PolarHBondContact O-N 2.86Å; Y146-W163 HydrophobicContact CD2-CZ3 4.46Å; Y146-W163 HydrophobicContact CE2-CH2 4.34Å; Y146-W163 HydrophobicContact CE2-CZ3 4.08Å; Y146-W177 AromaticContact CE2-CH2 3.95Å; Y146-W177 HydrophobicContact CE2-CH2 3.95Å; Y146-W177 AromaticContact CE2-CZ3 3.72Å; Y146-W177 HydrophobicContact CE2-CZ3 3.72Å; Y146-W177 AromaticContact CZ-CH2 3.84Å
147	N	97.8	Very high	96.8	Very high	25 Å²	25	45 Å²	45	13%	0.134	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	138.8	174.6	-65.4	94.1	0	0	0	109.6	Q122 S151 D152	Q122-N147 HydrophobicContact CB-CB 4.33Å; Q122-N147 PolarHBondContact N-O 3.47Å; Q122-N147 PolarHBondContact O-N 3.23Å; N147-S151 CarbonylContact C-O 3.6Å; N147-S151 WeakPolarHBondContact CA-O 3.46Å; N147-S151 PolarHBondContact ND2-O 3.06Å; N147-D152 WeakPolarHBondContact ND2-CA 3.43Å; N147-D152 PolarHBondContact ND2-OD1 2.91Å
148	Y	97.1	Very high	96.7	Very high	7 Å²	7	44.2 Å²	44.2	3%	0.027	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	125.6	178.9	-171.3	-105	0	0	0	109.8	I104 L107 M108 M111 Q113 H119 I120 L121 G150 S151	I104-Y148 HydrophobicContact CG1-CE2 4.33Å; L107-Y148 HydrophobicContact CB-CD2 4.39Å; L107-Y148 HydrophobicContact CB-CE2 3.99Å; L107-Y148 HydrophobicContact CD1-CD2 3.91Å; L107-Y148 HydrophobicContact CD1-CE2 4.24Å; M108-Y148 WeakPolarHBondContact CG-OH 3.41Å; M111-Y148 HydrophobicContact CB-CE1 4.38Å; M111-Y148 HydrophobicContact CE-CD1 4.27Å; M111-Y148 HydrophobicContact CE-CE1 4.43Å; M111-Y148 HydrophobicContact CG-CD1 4.19Å; M111-Y148 HydrophobicContact CG-CE1 3.77Å; Q113-Y148 VanDerWaalsContact OE1-CE1 3.27Å; Q113-Y148 PolarHBondContact OE1-OH 3.48Å; H119-Y148 HydrophobicContact CB-CE2 4.19Å; H119-Y148 WeakPolarHBondContact CB-OH 3.44Å; I120-Y148 WeakPolarHBondContact O-CA 3.36Å; I120-Y148 WeakPolarHBondContact O-CD2 3.26Å; L121-Y148 HydrophobicContact CB-CD2 4.34Å; L121-Y148 HydrophobicContact CD1-CD2 4.25Å; Y148-G150 PolarHBondContact O-N 3.15Å; Y148-G150 VanDerWaalsContact O-N 3.15Å; Y148-S151 PolarHBondContact N-O 3.09Å; Y148-S151 PolarHBondContact O-N 3.44Å
149	D	95.7	Very high	96.5	Very high	63 Å²	63	44.7 Å²	44.7	34%	0.337	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.1	38.5	-174.7	-64.4	-18.6	0	0	0	113.1	Q113 H119 I120 S151	Q113-D149 PolarHBondContact NE2-OD2 3.02Å; Q113-D149 VanDerWaalsContact NE2-OD2 3.09Å; H119-D149 WeakPolarHBondContact CA-OD1 3.37Å; H119-D149 WeakPolarHBondContact CB-OD1 3.35Å; H119-D149 IonicContact CE1-OD2 2.97Å; H119-D149 IonicContact CG-OD1 2.82Å; H119-D149 IonicContact CG-OD2 2.79Å; H119-D149 IonicContact ND1-OD1 3.6Å; H119-D149 PolarHBondContact ND1-OD1 2.87Å; H119-D149 IonicContact ND1-OD2 3.4Å; H119-D149 PolarHBondContact ND1-OD2 3.22Å; I120-D149 PolarHBondContact N-OD1 3.19Å; I120-D149 PolarHBondContact O-N 3.33Å; D149-S151 VanDerWaalsContact C-N 3.29Å; D149-S151 PolarHBondContact O-N 3.42Å
150	G	94.8	Very high	96.4	Very high	65 Å²	65	48.7 Å²	48.7	67%	0.67	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.7	1.3	179.5	0	0	0	0	0	115.6	Y148	Y148-G150 PolarHBondContact O-N 3.15Å; Y148-G150 VanDerWaalsContact O-N 3.15Å
151	S	96.6	Very high	96.3	Very high	79 Å²	79	49 Å²	49	55%	0.552	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.7	152.9	177.4	-59.7	0	0	0	0	111.8	N147 Y148 D149 F153	N147-S151 CarbonylContact C-O 3.6Å; N147-S151 WeakPolarHBondContact CA-O 3.46Å; N147-S151 PolarHBondContact ND2-O 3.06Å; Y148-S151 PolarHBondContact N-O 3.09Å; Y148-S151 PolarHBondContact O-N 3.44Å; D149-S151 VanDerWaalsContact C-N 3.29Å; D149-S151 PolarHBondContact O-N 3.42Å; S151-F153 PolarHBondContact O-N 3.33Å
152	D	97.3	Very high	96.3	Very high	108 Å²	108	46 Å²	46	58%	0.578	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62	128.7	174.2	-66.6	-18.6	0	0	0	110.7	N147 P166	N147-D152 WeakPolarHBondContact ND2-CA 3.43Å; N147-D152 PolarHBondContact ND2-OD1 2.91Å; D152-P166 HydrophobicContact CB-CG 4.04Å; D152-P166 WeakPolarHBondContact O-CG 3.36Å
153	F	97.1	Very high	96.4	Very high	8 Å²	8	45.4 Å²	45.4	4%	0.035	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	-52.9	-178.4	179.3	-97.8	0	0	0	112.5	L107 Y146 S151 P166 I167 A169 A170	L107-F153 HydrophobicContact CD2-CE1 3.69Å; L107-F153 HydrophobicContact CD2-CE2 3.73Å; L107-F153 HydrophobicContact CD2-CZ 3.19Å; Y146-F153 WeakPolarHBondContact O-CA 3.16Å; Y146-F153 WeakPolarHBondContact O-CB 3.38Å; Y146-F153 PolarHBondContact O-N 2.84Å; S151-F153 PolarHBondContact O-N 3.33Å; F153-P166 VanDerWaalsContact O-CD 3.28Å; F153-P166 WeakPolarHBondContact O-CD 3.49Å; F153-I167 HydrophobicContact CD2-CD1 3.72Å; F153-I167 HydrophobicContact CD2-CG1 4.23Å; F153-I167 HydrophobicContact CE2-CD1 4.04Å; F153-I167 HydrophobicContact CE2-CG1 4.45Å; F153-A169 HydrophobicContact CE2-CB 4.31Å; F153-A170 HydrophobicContact CD1-CB 4.24Å; F153-A170 HydrophobicContact CD2-CB 4.16Å; F153-A170 HydrophobicContact CE1-CB 3.89Å; F153-A170 HydrophobicContact CE2-CB 3.8Å; F153-A170 HydrophobicContact CG-CB 4.35Å; F153-A170 HydrophobicContact CZ-CB 3.64Å; F153-A170 WeakPolarHBondContact O-CB 3.46Å
154	L	98	Very high	96.5	Very high	4 Å²	4	47.8 Å²	47.8	2%	0.021	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	140.6	-178.8	-169.7	79.9	0	0	0	109.2	Y146 W163 V164 A165 A170 T173 K174 W177	Y146-L154 HydrophobicContact CD2-CB 4.36Å; Y146-L154 HydrophobicContact CD2-CD2 4.47Å; Y146-L154 PolarHBondContact N-O 3.38Å; Y146-L154 PolarHBondContact O-N 2.86Å; L154-W163 HydrophobicContact CD1-CB 4.4Å; L154-W163 HydrophobicContact CD2-CD2 4.34Å; L154-W163 HydrophobicContact CD2-CE3 3.73Å; L154-W163 HydrophobicContact CD2-CZ3 4.2Å; L154-W163 HydrophobicContact CG-CE3 3.9Å; L154-V164 WeakPolarHBondContact CA-O 3.3Å; L154-V164 WeakPolarHBondContact CD1-O 3.24Å; L154-A165 HydrophobicContact CD1-CB 4.19Å; L154-A170 HydrophobicContact CD1-CB 4.15Å; L154-T173 HydrophobicContact CD2-CG2 3.67Å; L154-K174 HydrophobicContact CD1-CB 3.99Å; L154-W177 HydrophobicContact CD2-CE3 3.83Å; L154-W177 HydrophobicContact CD2-CZ3 3.9Å
155	S	98.1	Very high	96.5	Very high	38 Å²	38	48.6 Å²	48.6	27%	0.266	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	158.4	175.2	56.3	0	0	0	0	112.4	D144 W163 V164	D144-S155 CarbonylContact O-C 3.43Å; D144-S155 VanDerWaalsContact O-CA 3.26Å; D144-S155 WeakPolarHBondContact O-CA 3.13Å; S155-W163 CarbonylContact O-C 3.55Å; S155-W163 WeakPolarHBondContact O-CA 3.32Å; S155-V164 PolarHBondContact N-O 3.34Å; S155-V164 PolarHBondContact O-N 3.28Å
156	F	98.3	Very high	96.5	Very high	14 Å²	14	49.3 Å²	49.3	6%	0.061	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	120.7	174	-169.7	-114	0	0	0	110.5	D144 D158 Q161 W163 K184 T187 K188 L191	D144-F156 HydrophobicContact CB-CB 3.96Å; D144-F156 PolarHBondContact O-N 3.06Å; F156-D158 HydrophobicContact CD1-CB 4.27Å; F156-D158 HydrophobicContact CE1-CB 4.4Å; F156-D158 PolarHBondContact O-N 3.44Å; F156-Q161 HydrophobicContact CZ-CB 4.32Å; F156-W163 HydrophobicContact CB-CD2 4.39Å; F156-W163 HydrophobicContact CB-CE3 3.98Å; F156-W163 HydrophobicContact CB-CH2 3.99Å; F156-W163 HydrophobicContact CB-CZ2 4.38Å; F156-W163 HydrophobicContact CB-CZ3 3.78Å; F156-W163 AromaticContact CD2-CD2 3.85Å; F156-W163 HydrophobicContact CD2-CD2 3.85Å; F156-W163 AromaticContact CD2-CE2 3.62Å; F156-W163 HydrophobicContact CD2-CE3 4.31Å; F156-W163 HydrophobicContact CD2-CG 4.24Å; F156-W163 HydrophobicContact CD2-CH2 4.38Å; F156-W163 AromaticContact CD2-CZ2 3.92Å; F156-W163 HydrophobicContact CD2-CZ2 3.92Å; F156-W163 AromaticContact CD2-NE1 3.87Å; F156-W163 HydrophobicContact CG-CH2 4.48Å; F156-W163 HydrophobicContact CG-CZ2 4.41Å; F156-K184 HydrophobicContact CE2-CB 4.13Å; F156-K184 HydrophobicContact CE2-CG 4.13Å; F156-K184 HydrophobicContact CZ-CB 4.24Å; F156-T187 HydrophobicContact CB-CG2 4.33Å; F156-T187 HydrophobicContact CD1-CG2 3.58Å; F156-T187 HydrophobicContact CD2-CG2 4.37Å; F156-T187 HydrophobicContact CE1-CG2 3.85Å; F156-T187 HydrophobicContact CG-CG2 3.85Å; F156-T187 HydrophobicContact CZ-CG2 4.36Å; F156-K188 HydrophobicContact CE1-CB 4.24Å; F156-L191 HydrophobicContact CD1-CD1 4.03Å
157	D	96.8	Very high	96.4	Very high	47 Å²	47	51.5 Å²	51.5	25%	0.251	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	96.7	166.9	-175	-22	0	0	0	108.5	N159 H160 Q161 V162 V164	D157-N159 VanDerWaalsContact C-N 3.28Å; D157-N159 PolarHBondContact O-N 2.78Å; D157-N159 PolarHBondContact OD1-N 2.96Å; D157-N159 VanDerWaalsContact OD1-N 3.11Å; D157-H160 VanDerWaalsContact CG-ND1 3.3Å; D157-H160 PolarHBondContact O-N 2.95Å; D157-H160 IonicContact OD1-CG 3.99Å; D157-H160 PolarHBondContact OD1-N 3.06Å; D157-H160 IonicContact OD1-ND1 3.63Å; D157-H160 PolarHBondContact OD1-ND1 3.32Å; D157-H160 IonicContact OD2-CE1 2.85Å; D157-H160 IonicContact OD2-CG 3.6Å; D157-H160 IonicContact OD2-ND1 3.98Å; D157-H160 PolarHBondContact OD2-ND1 2.88Å; D157-Q161 WeakPolarHBondContact O-CA 3.45Å; D157-Q161 PolarHBondContact O-N 3.23Å; D157-V162 HydrophobicContact CB-CG2 4.05Å; D157-V162 WeakPolarHBondContact CB-O 3.41Å; D157-V162 PolarHBondContact N-O 2.98Å; D157-V162 PolarHBondContact O-N 3.22Å; D157-V164 HydrophobicContact CB-CG2 3.9Å
158	D	92.3	Very high	96.3	Very high	9 Å²	9	57.4 Å²	57.4	5%	0.048	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-34.9	-177.7	178.8	52.9	0	0	0	113	F139 F156 K188	F139-D158 WeakPolarHBondContact CZ-OD2 3.39Å; F156-D158 HydrophobicContact CD1-CB 4.27Å; F156-D158 HydrophobicContact CE1-CB 4.4Å; F156-D158 PolarHBondContact O-N 3.44Å; D158-K188 VanDerWaalsContact CG-NZ 3.34Å; D158-K188 PolarHBondContact O-NZ 2.79Å; D158-K188 WeakPolarHBondContact OD1-CG 3.11Å; D158-K188 IonicContact OD1-NZ 3.92Å; D158-K188 PolarHBondContact OD1-NZ 3.28Å; D158-K188 IonicContact OD2-NZ 2.63Å; D158-K188 PolarHBondContact OD2-NZ 2.9Å
159	N	92.7	Very high	96.2	Very high	136 Å²	136	58 Å²	58	73%	0.727	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-41.2	-178.9	-69.9	-40.7	0	0	0	111.9	D157	D157-N159 VanDerWaalsContact C-N 3.28Å; D157-N159 PolarHBondContact O-N 2.78Å; D157-N159 PolarHBondContact OD1-N 2.96Å; D157-N159 VanDerWaalsContact OD1-N 3.11Å
160	H	94.5	Very high	96.3	Very high	136 Å²	136	55 Å²	55	63%	0.63	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	-3.8	-177.2	-58.5	107.4	0	0	0	113.2	D157 V162	D157-H160 VanDerWaalsContact CG-ND1 3.3Å; D157-H160 PolarHBondContact O-N 2.95Å; D157-H160 IonicContact OD1-CG 3.99Å; D157-H160 PolarHBondContact OD1-N 3.06Å; D157-H160 IonicContact OD1-ND1 3.63Å; D157-H160 PolarHBondContact OD1-ND1 3.32Å; D157-H160 IonicContact OD2-CE1 2.85Å; D157-H160 IonicContact OD2-CG 3.6Å; D157-H160 IonicContact OD2-ND1 3.98Å; D157-H160 PolarHBondContact OD2-ND1 2.88Å; H160-V162 HydrophobicContact CB-CG2 3.91Å; H160-V162 PolarHBondContact O-N 2.84Å
161	Q	94.4	Very high	96.3	Very high	68 Å²	68	55.3 Å²	55.3	32%	0.318	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.1	51.1	-175.5	-61.6	-175.1	-56.8	0	0	112.5	F156 D157 K184 K188	F156-Q161 HydrophobicContact CZ-CB 4.32Å; D157-Q161 WeakPolarHBondContact O-CA 3.45Å; D157-Q161 PolarHBondContact O-N 3.23Å; Q161-K184 VanDerWaalsContact O-CD 3.31Å; Q161-K184 WeakPolarHBondContact O-CD 3.41Å; Q161-K188 HydrophobicContact CG-CD 3.77Å
162	V	96.3	Very high	96.3	Very high	52 Å²	52	54.9 Å²	54.9	32%	0.315	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	149.3	178.3	-67	0	0	0	0	110.7	D157 H160	D157-V162 HydrophobicContact CB-CG2 4.05Å; D157-V162 WeakPolarHBondContact CB-O 3.41Å; D157-V162 PolarHBondContact N-O 2.98Å; D157-V162 PolarHBondContact O-N 3.22Å; H160-V162 HydrophobicContact CB-CG2 3.91Å; H160-V162 PolarHBondContact O-N 2.84Å
163	W	98	Very high	96.2	Very high	2 Å²	2	50.5 Å²	50.5	1%	0.008	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	144.7	170.3	-67.7	93.6	0	0	0	110.5	Y146 L154 S155 F156 K174 W177 D178	Y146-W163 HydrophobicContact CD2-CZ3 4.46Å; Y146-W163 HydrophobicContact CE2-CH2 4.34Å; Y146-W163 HydrophobicContact CE2-CZ3 4.08Å; L154-W163 HydrophobicContact CD1-CB 4.4Å; L154-W163 HydrophobicContact CD2-CD2 4.34Å; L154-W163 HydrophobicContact CD2-CE3 3.73Å; L154-W163 HydrophobicContact CD2-CZ3 4.2Å; L154-W163 HydrophobicContact CG-CE3 3.9Å; S155-W163 CarbonylContact O-C 3.55Å; S155-W163 WeakPolarHBondContact O-CA 3.32Å; F156-W163 HydrophobicContact CB-CD2 4.39Å; F156-W163 HydrophobicContact CB-CE3 3.98Å; F156-W163 HydrophobicContact CB-CH2 3.99Å; F156-W163 HydrophobicContact CB-CZ2 4.38Å; F156-W163 HydrophobicContact CB-CZ3 3.78Å; F156-W163 AromaticContact CD2-CD2 3.85Å; F156-W163 HydrophobicContact CD2-CD2 3.85Å; F156-W163 AromaticContact CD2-CE2 3.62Å; F156-W163 HydrophobicContact CD2-CE3 4.31Å; F156-W163 HydrophobicContact CD2-CG 4.24Å; F156-W163 HydrophobicContact CD2-CH2 4.38Å; F156-W163 AromaticContact CD2-CZ2 3.92Å; F156-W163 HydrophobicContact CD2-CZ2 3.92Å; F156-W163 AromaticContact CD2-NE1 3.87Å; F156-W163 HydrophobicContact CG-CH2 4.48Å; F156-W163 HydrophobicContact CG-CZ2 4.41Å; W163-K174 HydrophobicContact CB-CB 4.34Å; W163-K174 HydrophobicContact CB-CG 4.1Å; W163-K174 VanDerWaalsContact O-CD 3.26Å; W163-K174 WeakPolarHBondContact O-CD 3.43Å; W163-K174 VanDerWaalsContact O-CE 3.31Å; W163-K174 WeakPolarHBondContact O-CE 3.38Å; W163-K174 PolarHBondContact O-NZ 3.16Å; W163-W177 HydrophobicContact CD2-CB 4.48Å; W163-W177 AromaticContact CD2-CE3 3.72Å; W163-W177 HydrophobicContact CD2-CE3 3.72Å; W163-W177 HydrophobicContact CD2-CZ3 4.44Å; W163-W177 AromaticContact CE2-CE3 3.46Å; W163-W177 VanDerWaalsContact CE2-CE3 3.46Å; W163-W177 AromaticContact CE3-CE3 3.92Å; W163-W177 HydrophobicContact CE3-CE3 3.92Å; W163-W177 HydrophobicContact CE3-CZ3 4.22Å; W163-W177 HydrophobicContact CG-CB 4.13Å; W163-W177 HydrophobicContact CG-CE3 4.46Å; W163-W177 AromaticContact CH2-CE3 3.65Å; W163-W177 HydrophobicContact CH2-CE3 3.65Å; W163-W177 AromaticContact CH2-CZ3 3.51Å; W163-W177 HydrophobicContact CH2-CZ3 3.51Å; W163-W177 AromaticContact CZ2-CE3 3.43Å; W163-W177 HydrophobicContact CZ2-CE3 3.43Å; W163-W177 VanDerWaalsContact CZ2-CE3 3.43Å; W163-W177 AromaticContact CZ2-CZ3 3.76Å; W163-W177 HydrophobicContact CZ2-CZ3 3.76Å; W163-W177 AromaticContact CZ3-CE3 3.89Å; W163-W177 HydrophobicContact CZ3-CE3 3.89Å; W163-W177 AromaticContact CZ3-CZ3 3.76Å; W163-W177 HydrophobicContact CZ3-CZ3 3.76Å; W163-D178 VanDerWaalsContact CD1-OD1 3.3Å; W163-D178 PolarHBondContact N-OD1 2.85Å
164	V	98.1	Very high	96.2	Very high	61 Å²	61	53 Å²	53	37%	0.37	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	124.9	179.7	-179	0	0	0	0	108.1	L154 S155 D157 P166	L154-V164 WeakPolarHBondContact CA-O 3.3Å; L154-V164 WeakPolarHBondContact CD1-O 3.24Å; S155-V164 PolarHBondContact N-O 3.34Å; S155-V164 PolarHBondContact O-N 3.28Å; D157-V164 HydrophobicContact CB-CG2 3.9Å; V164-P166 WeakPolarHBondContact O-CD 3.44Å
165	A	97.9	Very high	96.2	Very high	25 Å²	25	59 Å²	59	21%	0.207	30%	0.303	C	S	.	.			trans	-111.3	97.9	-179.9	0	0	0	0	0	109.3	L154 I167 A170 E171 K174	L154-A165 HydrophobicContact CD1-CB 4.19Å; A165-I167 PolarHBondContact O-N 2.85Å; A165-A170 HydrophobicContact CB-CB 3.85Å; A165-E171 HydrophobicContact CB-CG 4.33Å; A165-K174 HydrophobicContact CB-CB 3.97Å; A165-K174 HydrophobicContact CB-CD 3.79Å
166	P	97	Very high	96.1	Very high	74 Å²	74	62.2 Å²	62.2	48%	0.481	31%	0.312	S	S	.	.	S	Bend	trans	-66.9	-20.2	177.2	25.5	-36.7	0	0	0	113.8	D152 F153 V164	D152-P166 HydrophobicContact CB-CG 4.04Å; D152-P166 WeakPolarHBondContact O-CG 3.36Å; F153-P166 VanDerWaalsContact O-CD 3.28Å; F153-P166 WeakPolarHBondContact O-CD 3.49Å; V164-P166 WeakPolarHBondContact O-CD 3.44Å
167	I	95.9	Very high	96	Very high	60 Å²	60	64.2 Å²	64.2	31%	0.308	32%	0.319	S	S	.	.	S	Bend	trans	-129.1	152.4	-179.4	68.8	170.5	0	0	0	112	M111 F153 A165 A169 A170	M111-I167 HydrophobicContact CE-CD1 4.1Å; M111-I167 HydrophobicContact SD-CD1 4.05Å; F153-I167 HydrophobicContact CD2-CD1 3.72Å; F153-I167 HydrophobicContact CD2-CG1 4.23Å; F153-I167 HydrophobicContact CE2-CD1 4.04Å; F153-I167 HydrophobicContact CE2-CG1 4.45Å; A165-I167 PolarHBondContact O-N 2.85Å; I167-A169 HydrophobicContact CD1-CB 4.03Å; I167-A169 HydrophobicContact CG1-CB 4.33Å; I167-A169 PolarHBondContact O-N 3.13Å; I167-A170 HydrophobicContact CG1-CB 4.08Å; I167-A170 WeakPolarHBondContact O-CB 3.44Å; I167-A170 PolarHBondContact O-N 2.94Å
168	H	95.6	Very high	96	Very high	150 Å²	150	63.6 Å²	63.6	69%	0.694	32%	0.315	S	S	*	.	H	α-helix	trans	-57	-35.4	-179.2	-178.5	-89.8	0	0	0	113.2	A170 E171	H168-A170 PolarHBondContact O-N 2.82Å; H168-E171 IonicContact CD2-OE1 2.88Å; H168-E171 IonicContact CD2-OE2 3.24Å; H168-E171 IonicContact NE2-OE2 2.69Å; H168-E171 WeakPolarHBondContact O-CB 3.4Å; H168-E171 PolarHBondContact O-N 2.79Å
169	A	95.4	Very high	96.2	Very high	19 Å²	19	70.6 Å²	70.6	16%	0.157	35%	0.348	C	S	.	.	H	α-helix	trans	-64.9	-19.7	179.4	0	0	0	0	0	114	M111 F153 I167	M111-A169 HydrophobicContact SD-CB 3.32Å; M111-A169 WeakPolarHBondContact SD-CB 3.38Å; F153-A169 HydrophobicContact CE2-CB 4.31Å; I167-A169 HydrophobicContact CD1-CB 4.03Å; I167-A169 HydrophobicContact CG1-CB 4.33Å; I167-A169 PolarHBondContact O-N 3.13Å
170	A	96.6	Very high	96.4	Very high	0 Å²	0	67.6 Å²	67.6	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-92.1	-14.8	178.2	0	0	0	0	0	113.5	F153 L154 A165 I167 H168 E172 T173 K174	F153-A170 HydrophobicContact CD1-CB 4.24Å; F153-A170 HydrophobicContact CD2-CB 4.16Å; F153-A170 HydrophobicContact CE1-CB 3.89Å; F153-A170 HydrophobicContact CE2-CB 3.8Å; F153-A170 HydrophobicContact CG-CB 4.35Å; F153-A170 HydrophobicContact CZ-CB 3.64Å; F153-A170 WeakPolarHBondContact O-CB 3.46Å; L154-A170 HydrophobicContact CD1-CB 4.15Å; A165-A170 HydrophobicContact CB-CB 3.85Å; I167-A170 HydrophobicContact CG1-CB 4.08Å; I167-A170 WeakPolarHBondContact O-CB 3.44Å; I167-A170 PolarHBondContact O-N 2.94Å; H168-A170 PolarHBondContact O-N 2.82Å; A170-E172 VanDerWaalsContact C-N 3.29Å; A170-E172 PolarHBondContact O-N 2.85Å; A170-T173 PolarHBondContact O-N 2.65Å; A170-T173 VanDerWaalsContact O-N 3.09Å; A170-K174 PolarHBondContact O-N 2.8Å
171	E	96.4	Very high	96.4	Very high	71 Å²	71	65.3 Å²	65.3	33%	0.332	32%	0.324	S	S	.	.	H	α-helix	trans	-60.6	-36	-176.3	-69.2	179.3	-168.9	0	0	113.3	A165 H168 T173 K174 R175	A165-E171 HydrophobicContact CB-CG 4.33Å; H168-E171 IonicContact CD2-OE1 2.88Å; H168-E171 IonicContact CD2-OE2 3.24Å; H168-E171 IonicContact NE2-OE2 2.69Å; H168-E171 WeakPolarHBondContact O-CB 3.4Å; H168-E171 PolarHBondContact O-N 2.79Å; E171-T173 VanDerWaalsContact C-N 3.34Å; E171-K174 PolarHBondContact O-N 2.7Å; E171-R175 WeakPolarHBondContact O-CG 3.32Å; E171-R175 PolarHBondContact O-N 2.88Å; E171-R175 IonicContact OE2-NH1 2.64Å; E171-R175 PolarHBondContact OE2-NH1 2.8Å
172	E	94.9	Very high	96.5	Very high	70 Å²	70	67.2 Å²	67.2	33%	0.327	34%	0.34	S	S	.	.	H	α-helix	trans	-62.5	-43.3	176.5	-166.8	-160.6	152.1	0	0	111.1	R110 A170 K176	R110-E172 IonicContact CZ-OE2 3.45Å; R110-E172 IonicContact NE-OE2 2.67Å; R110-E172 PolarHBondContact NE-OE2 3.08Å; R110-E172 IonicContact NH2-OE1 2.78Å; R110-E172 PolarHBondContact NH2-OE1 3.24Å; R110-E172 IonicContact NH2-OE2 2.89Å; R110-E172 PolarHBondContact NH2-OE2 3.35Å; A170-E172 VanDerWaalsContact C-N 3.29Å; A170-E172 PolarHBondContact O-N 2.85Å; E172-K176 WeakPolarHBondContact O-CG 3.28Å; E172-K176 PolarHBondContact O-N 3.48Å; E172-K176 VanDerWaalsContact OE1-CE 3.3Å; E172-K176 WeakPolarHBondContact OE1-CE 2.95Å; E172-K176 IonicContact OE1-NZ 3.63Å; E172-K176 PolarHBondContact OE1-NZ 3.01Å
173	T	95.7	Very high	96.5	Very high	16 Å²	16	67.2 Å²	67.2	10%	0.098	34%	0.338	C	S	.	.	H	α-helix	trans	-66.2	-46	176.1	-56.2	0	0	0	0	110.6	R110 L154 A170 E171 R175 K176 W177	R110-T173 PolarHBondContact NH1-OG1 2.78Å; L154-T173 HydrophobicContact CD2-CG2 3.67Å; A170-T173 PolarHBondContact O-N 2.65Å; A170-T173 VanDerWaalsContact O-N 3.09Å; E171-T173 VanDerWaalsContact C-N 3.34Å; T173-R175 PolarHBondContact O-N 3.18Å; T173-K176 PolarHBondContact O-N 3.19Å; T173-W177 HydrophobicContact CG2-CD2 3.77Å; T173-W177 HydrophobicContact CG2-CE3 4.25Å; T173-W177 HydrophobicContact CG2-CG 4.1Å; T173-W177 HydrophobicContact CG2-CZ2 4.05Å; T173-W177 WeakPolarHBondContact O-CB 3.41Å; T173-W177 PolarHBondContact O-N 3.23Å
174	K	97.1	Very high	96.4	Very high	61 Å²	61	68.4 Å²	68.4	27%	0.265	34%	0.343	S	S	.	.	H	α-helix	trans	-52	-53.8	176.1	168.6	174.9	165.4	51.4	0	111.6	L154 W163 A165 A170 E171 K176 W177 D178	L154-K174 HydrophobicContact CD1-CB 3.99Å; W163-K174 HydrophobicContact CB-CB 4.34Å; W163-K174 HydrophobicContact CB-CG 4.1Å; W163-K174 VanDerWaalsContact O-CD 3.26Å; W163-K174 WeakPolarHBondContact O-CD 3.43Å; W163-K174 VanDerWaalsContact O-CE 3.31Å; W163-K174 WeakPolarHBondContact O-CE 3.38Å; W163-K174 PolarHBondContact O-NZ 3.16Å; A165-K174 HydrophobicContact CB-CB 3.97Å; A165-K174 HydrophobicContact CB-CD 3.79Å; A170-K174 PolarHBondContact O-N 2.8Å; E171-K174 PolarHBondContact O-N 2.7Å; K174-K176 PolarHBondContact O-N 3.19Å; K174-W177 PolarHBondContact O-N 2.89Å; K174-D178 VanDerWaalsContact CG-OD2 3.29Å; K174-D178 WeakPolarHBondContact CG-OD2 3.43Å; K174-D178 IonicContact NZ-OD2 3.69Å; K174-D178 PolarHBondContact NZ-OD2 2.84Å; K174-D178 WeakPolarHBondContact O-CB 3.34Å; K174-D178 PolarHBondContact O-N 3.21Å
175	R	97.4	Very high	96.3	Very high	130 Å²	130	70.1 Å²	70.1	49%	0.491	35%	0.347	S	S	.	.	H	α-helix	trans	-56.8	-49.8	-179.9	-72.9	-172.6	-64.6	-95.5	0.7	111.6	E171 T173 W177 D178 E179	E171-R175 WeakPolarHBondContact O-CG 3.32Å; E171-R175 PolarHBondContact O-N 2.88Å; E171-R175 IonicContact OE2-NH1 2.64Å; E171-R175 PolarHBondContact OE2-NH1 2.8Å; T173-R175 PolarHBondContact O-N 3.18Å; R175-W177 VanDerWaalsContact C-N 3.32Å; R175-W177 PolarHBondContact O-N 2.75Å; R175-D178 PolarHBondContact O-N 2.89Å; R175-E179 VanDerWaalsContact O-CG 3.26Å; R175-E179 WeakPolarHBondContact O-CG 3.4Å; R175-E179 PolarHBondContact O-N 3.37Å
176	K	96	Very high	96.2	Very high	106 Å²	106	75.8 Å²	75.8	46%	0.461	36%	0.364	S	S	.	.	H	α-helix	trans	-59.5	-41.3	179.4	-73.3	-180	-175.1	176.4	0	112.6	E172 T173 K174 V180	E172-K176 WeakPolarHBondContact O-CG 3.28Å; E172-K176 PolarHBondContact O-N 3.48Å; E172-K176 VanDerWaalsContact OE1-CE 3.3Å; E172-K176 WeakPolarHBondContact OE1-CE 2.95Å; E172-K176 IonicContact OE1-NZ 3.63Å; E172-K176 PolarHBondContact OE1-NZ 3.01Å; T173-K176 PolarHBondContact O-N 3.19Å; K174-K176 PolarHBondContact O-N 3.19Å; K176-V180 WeakPolarHBondContact O-CG2 3.49Å
177	W	96.9	Very high	96.1	Very high	56 Å²	56	72.7 Å²	72.7	21%	0.212	34%	0.344	C	S	.	.	H	α-helix	trans	-80.9	-32.7	-175.6	-71.1	12.8	0	0	0	112.3	W99 Y146 L154 W163 T173 K174 R175 E179 V180 L183	W99-W177 HydrophobicContact CZ2-CH2 4.44Å; W99-W177 HydrophobicContact CZ2-CZ2 4.34Å; Y146-W177 AromaticContact CE2-CH2 3.95Å; Y146-W177 HydrophobicContact CE2-CH2 3.95Å; Y146-W177 AromaticContact CE2-CZ3 3.72Å; Y146-W177 HydrophobicContact CE2-CZ3 3.72Å; Y146-W177 AromaticContact CZ-CH2 3.84Å; L154-W177 HydrophobicContact CD2-CE3 3.83Å; L154-W177 HydrophobicContact CD2-CZ3 3.9Å; W163-W177 HydrophobicContact CD2-CB 4.48Å; W163-W177 AromaticContact CD2-CE3 3.72Å; W163-W177 HydrophobicContact CD2-CE3 3.72Å; W163-W177 HydrophobicContact CD2-CZ3 4.44Å; W163-W177 AromaticContact CE2-CE3 3.46Å; W163-W177 VanDerWaalsContact CE2-CE3 3.46Å; W163-W177 AromaticContact CE3-CE3 3.92Å; W163-W177 HydrophobicContact CE3-CE3 3.92Å; W163-W177 HydrophobicContact CE3-CZ3 4.22Å; W163-W177 HydrophobicContact CG-CB 4.13Å; W163-W177 HydrophobicContact CG-CE3 4.46Å; W163-W177 AromaticContact CH2-CE3 3.65Å; W163-W177 HydrophobicContact CH2-CE3 3.65Å; W163-W177 AromaticContact CH2-CZ3 3.51Å; W163-W177 HydrophobicContact CH2-CZ3 3.51Å; W163-W177 AromaticContact CZ2-CE3 3.43Å; W163-W177 HydrophobicContact CZ2-CE3 3.43Å; W163-W177 VanDerWaalsContact CZ2-CE3 3.43Å; W163-W177 AromaticContact CZ2-CZ3 3.76Å; W163-W177 HydrophobicContact CZ2-CZ3 3.76Å; W163-W177 AromaticContact CZ3-CE3 3.89Å; W163-W177 HydrophobicContact CZ3-CE3 3.89Å; W163-W177 AromaticContact CZ3-CZ3 3.76Å; W163-W177 HydrophobicContact CZ3-CZ3 3.76Å; T173-W177 HydrophobicContact CG2-CD2 3.77Å; T173-W177 HydrophobicContact CG2-CE3 4.25Å; T173-W177 HydrophobicContact CG2-CG 4.1Å; T173-W177 HydrophobicContact CG2-CZ2 4.05Å; T173-W177 WeakPolarHBondContact O-CB 3.41Å; T173-W177 PolarHBondContact O-N 3.23Å; K174-W177 PolarHBondContact O-N 2.89Å; R175-W177 VanDerWaalsContact C-N 3.32Å; R175-W177 PolarHBondContact O-N 2.75Å; W177-E179 VanDerWaalsContact C-N 3.3Å; W177-E179 PolarHBondContact O-N 3.45Å; W177-V180 PolarHBondContact O-N 2.84Å; W177-L183 HydrophobicContact CB-CD2 3.77Å; W177-L183 HydrophobicContact CD2-CD2 3.9Å; W177-L183 HydrophobicContact CE3-CD2 4.31Å; W177-L183 HydrophobicContact CG-CD2 3.68Å
178	D	96.3	Very high	96.2	Very high	33 Å²	33	71.5 Å²	71.5	18%	0.176	34%	0.336	C	S	.	.	H	α-helix	trans	-67	-31	174.6	-79.6	-24.5	0	0	0	113.2	W163 K174 R175 V180 K184	W163-D178 VanDerWaalsContact CD1-OD1 3.3Å; W163-D178 PolarHBondContact N-OD1 2.85Å; K174-D178 VanDerWaalsContact CG-OD2 3.29Å; K174-D178 WeakPolarHBondContact CG-OD2 3.43Å; K174-D178 IonicContact NZ-OD2 3.69Å; K174-D178 PolarHBondContact NZ-OD2 2.84Å; K174-D178 WeakPolarHBondContact O-CB 3.34Å; K174-D178 PolarHBondContact O-N 3.21Å; R175-D178 PolarHBondContact O-N 2.89Å; D178-V180 VanDerWaalsContact C-N 3.26Å; D178-V180 PolarHBondContact O-N 2.79Å; D178-K184 VanDerWaalsContact O-CE 3.27Å; D178-K184 WeakPolarHBondContact O-CE 3.47Å; D178-K184 PolarHBondContact O-NZ 3.46Å
179	E	96.8	Very high	96.3	Very high	157 Å²	157	65.9 Å²	65.9	73%	0.734	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-17.9	175.6	-74.2	170.3	-166.1	0	0	112.9	R175 W177 Q181	R175-E179 VanDerWaalsContact O-CG 3.26Å; R175-E179 WeakPolarHBondContact O-CG 3.4Å; R175-E179 PolarHBondContact O-N 3.37Å; W177-E179 VanDerWaalsContact C-N 3.3Å; W177-E179 PolarHBondContact O-N 3.45Å; E179-Q181 PolarHBondContact O-N 2.92Å
180	V	97.1	Very high	96.4	Very high	72 Å²	72	66.5 Å²	66.5	44%	0.436	32%	0.318	S	S	.	.			trans	-97.4	91.2	-179.8	-175.8	0	0	0	0	109.7	K176 W177 D178 V182 L183 K184	K176-V180 WeakPolarHBondContact O-CG2 3.49Å; W177-V180 PolarHBondContact O-N 2.84Å; D178-V180 VanDerWaalsContact C-N 3.26Å; D178-V180 PolarHBondContact O-N 2.79Å; V180-V182 VanDerWaalsContact C-N 3.33Å; V180-V182 PolarHBondContact O-N 2.89Å; V180-L183 HydrophobicContact CB-CB 4Å; V180-L183 HydrophobicContact CG1-CB 3.71Å; V180-L183 WeakPolarHBondContact O-CB 3.43Å; V180-L183 PolarHBondContact O-N 2.83Å; V180-L183 VanDerWaalsContact O-N 3.08Å; V180-K184 PolarHBondContact O-N 2.74Å
181	Q	95.3	Very high	96.4	Very high	88 Å²	88	66.6 Å²	66.6	41%	0.411	32%	0.318	S	S	.	.	H	α-helix	trans	-55.6	-44.8	-177.1	-175.1	60.4	21.6	0	0	113.3	E179 L183 K184 E185	E179-Q181 PolarHBondContact O-N 2.92Å; Q181-L183 PolarHBondContact O-N 3.24Å; Q181-K184 PolarHBondContact O-N 3.34Å; Q181-K184 VanDerWaalsContact O-N 3.15Å; Q181-E185 VanDerWaalsContact CG-OE1 3.29Å; Q181-E185 WeakPolarHBondContact CG-OE1 3.27Å; Q181-E185 PolarHBondContact NE2-OE1 3.42Å; Q181-E185 PolarHBondContact O-N 3.42Å
182	V	96.8	Very high	96.5	Very high	108 Å²	108	66.8 Å²	66.8	66%	0.655	32%	0.319	S	S	*	.	H	α-helix	trans	-59.6	-33.8	179.4	177.8	0	0	0	0	112.1	V180 Y186	V180-V182 VanDerWaalsContact C-N 3.33Å; V180-V182 PolarHBondContact O-N 2.89Å; V182-Y186 WeakPolarHBondContact O-CB 3.37Å; V182-Y186 PolarHBondContact O-N 2.88Å
183	L	95.6	Very high	96.6	Very high	52 Å²	52	69.5 Å²	69.5	27%	0.272	33%	0.33	S	S	.	.	H	α-helix	trans	-66.2	-45.8	178.4	176	62.6	0	0	0	110.6	W177 V180 Q181 Y186 T187	W177-L183 HydrophobicContact CB-CD2 3.77Å; W177-L183 HydrophobicContact CD2-CD2 3.9Å; W177-L183 HydrophobicContact CE3-CD2 4.31Å; W177-L183 HydrophobicContact CG-CD2 3.68Å; V180-L183 HydrophobicContact CB-CB 4Å; V180-L183 HydrophobicContact CG1-CB 3.71Å; V180-L183 WeakPolarHBondContact O-CB 3.43Å; V180-L183 PolarHBondContact O-N 2.83Å; V180-L183 VanDerWaalsContact O-N 3.08Å; Q181-L183 PolarHBondContact O-N 3.24Å; L183-Y186 PolarHBondContact O-N 2.83Å; L183-T187 WeakPolarHBondContact O-CB 3.39Å; L183-T187 PolarHBondContact O-N 2.9Å; L183-T187 PolarHBondContact O-OG1 3.43Å; L183-T187 VanDerWaalsContact O-OG1 3.1Å
184	K	96.2	Very high	96.6	Very high	27 Å²	27	72.6 Å²	72.6	12%	0.117	34%	0.343	C	S	.	.	H	α-helix	trans	-65.4	-41.6	179.8	-61.3	-178.1	-69.7	179.1	0	112.1	F156 Q161 D178 V180 Q181 T187 K188	F156-K184 HydrophobicContact CE2-CB 4.13Å; F156-K184 HydrophobicContact CE2-CG 4.13Å; F156-K184 HydrophobicContact CZ-CB 4.24Å; Q161-K184 VanDerWaalsContact O-CD 3.31Å; Q161-K184 WeakPolarHBondContact O-CD 3.41Å; D178-K184 VanDerWaalsContact O-CE 3.27Å; D178-K184 WeakPolarHBondContact O-CE 3.47Å; D178-K184 PolarHBondContact O-NZ 3.46Å; V180-K184 PolarHBondContact O-N 2.74Å; Q181-K184 PolarHBondContact O-N 3.34Å; Q181-K184 VanDerWaalsContact O-N 3.15Å; K184-T187 PolarHBondContact O-N 3.21Å; K184-K188 WeakPolarHBondContact O-CB 3.5Å; K184-K188 PolarHBondContact O-N 2.99Å
185	E	95.7	Very high	96.7	Very high	98 Å²	98	69.7 Å²	69.7	46%	0.458	33%	0.33	S	S	.	.	H	α-helix	trans	-64.5	-43	176.3	-72	170.9	-177.3	0	0	111.5	Q181 G189	Q181-E185 VanDerWaalsContact CG-OE1 3.29Å; Q181-E185 WeakPolarHBondContact CG-OE1 3.27Å; Q181-E185 PolarHBondContact NE2-OE1 3.42Å; Q181-E185 PolarHBondContact O-N 3.42Å; E185-G189 PolarHBondContact O-N 3.04Å
186	Y	95.1	Very high	96.7	Very high	143 Å²	143	64.1 Å²	64.1	56%	0.561	31%	0.31	S	S	*	.	H	α-helix	trans	-62.5	-48.2	175.1	177.4	-97	0	0	0	111.9	V182 L183 G189 Y190	V182-Y186 WeakPolarHBondContact O-CB 3.37Å; V182-Y186 PolarHBondContact O-N 2.88Å; L183-Y186 PolarHBondContact O-N 2.83Å; Y186-G189 PolarHBondContact O-N 3.25Å; Y186-Y190 WeakPolarHBondContact O-CB 3.46Å; Y186-Y190 PolarHBondContact O-N 3.33Å
187	T	96.4	Very high	96.8	Very high	9 Å²	9	64.2 Å²	64.2	6%	0.055	31%	0.312	C	S	.	.	H	α-helix	trans	-58.6	-51.3	177.8	-64.4	0	0	0	0	110.7	D144 F156 L183 K184 G189 Y190 L191	D144-T187 HydrophobicContact CB-CG2 4.24Å; D144-T187 WeakPolarHBondContact OD2-CG2 3.21Å; F156-T187 HydrophobicContact CB-CG2 4.33Å; F156-T187 HydrophobicContact CD1-CG2 3.58Å; F156-T187 HydrophobicContact CD2-CG2 4.37Å; F156-T187 HydrophobicContact CE1-CG2 3.85Å; F156-T187 HydrophobicContact CG-CG2 3.85Å; F156-T187 HydrophobicContact CZ-CG2 4.36Å; L183-T187 WeakPolarHBondContact O-CB 3.39Å; L183-T187 PolarHBondContact O-N 2.9Å; L183-T187 PolarHBondContact O-OG1 3.43Å; L183-T187 VanDerWaalsContact O-OG1 3.1Å; K184-T187 PolarHBondContact O-N 3.21Å; T187-G189 PolarHBondContact O-N 3.34Å; T187-Y190 PolarHBondContact O-N 2.9Å; T187-L191 HydrophobicContact CG2-CD1 3.85Å; T187-L191 HydrophobicContact CG2-CG 4.41Å; T187-L191 VanDerWaalsContact O-CG 3.23Å; T187-L191 WeakPolarHBondContact O-CG 3.22Å; T187-L191 PolarHBondContact O-N 2.9Å
188	K	96.9	Very high	96.8	Very high	35 Å²	35	65.2 Å²	65.2	15%	0.152	32%	0.316	C	S	.	.	H	α-helix	trans	-59.2	-47.5	177	179.8	167.7	-160.7	68.3	0	112.3	F156 D158 Q161 K184 Y190 L191 E192	F156-K188 HydrophobicContact CE1-CB 4.24Å; D158-K188 VanDerWaalsContact CG-NZ 3.34Å; D158-K188 PolarHBondContact O-NZ 2.79Å; D158-K188 WeakPolarHBondContact OD1-CG 3.11Å; D158-K188 IonicContact OD1-NZ 3.92Å; D158-K188 PolarHBondContact OD1-NZ 3.28Å; D158-K188 IonicContact OD2-NZ 2.63Å; D158-K188 PolarHBondContact OD2-NZ 2.9Å; Q161-K188 HydrophobicContact CG-CD 3.77Å; K184-K188 WeakPolarHBondContact O-CB 3.5Å; K184-K188 PolarHBondContact O-N 2.99Å; K188-Y190 VanDerWaalsContact C-N 3.29Å; K188-Y190 PolarHBondContact O-N 3.25Å; K188-L191 PolarHBondContact O-N 3.42Å; K188-L191 VanDerWaalsContact O-N 3.16Å; K188-E192 WeakPolarHBondContact CE-OE1 3.36Å; K188-E192 VanDerWaalsContact CE-OE2 3.27Å; K188-E192 WeakPolarHBondContact CE-OE2 3.24Å; K188-E192 HydrophobicContact CG-CG 4.12Å; K188-E192 VanDerWaalsContact NZ-CD 3.26Å; K188-E192 IonicContact NZ-OE1 3.66Å; K188-E192 PolarHBondContact NZ-OE1 3.04Å; K188-E192 IonicContact NZ-OE2 3.53Å; K188-E192 PolarHBondContact O-N 3.15Å
189	G	97.3	Very high	96.9	Very high	32 Å²	32	63.7 Å²	63.7	33%	0.33	31%	0.308	S	S	.	.	H	α-helix	trans	-59.1	-40	179.9	0	0	0	0	0	112.5	E185 Y186 T187 K193 E194	E185-G189 PolarHBondContact O-N 3.04Å; Y186-G189 PolarHBondContact O-N 3.25Å; T187-G189 PolarHBondContact O-N 3.34Å; G189-K193 VanDerWaalsContact O-CB 3.27Å; G189-K193 WeakPolarHBondContact O-CB 3.47Å; G189-K193 PolarHBondContact O-N 3.24Å; G189-K193 VanDerWaalsContact O-N 3.12Å; G189-E194 PolarHBondContact O-N 3.46Å
190	Y	97.1	Very high	96.8	Very high	33 Å²	33	59.6 Å²	59.6	13%	0.129	29%	0.293	C	S	.	.	I	π-helix	trans	-63.6	-49.6	173.5	177	-94.7	0	0	0	111.9	H125 Y186 T187 K188 E194 C195	H125-Y190 AromaticContact CE1-CE1 3.46Å; H125-Y190 VanDerWaalsContact CE1-CE1 3.46Å; H125-Y190 WeakPolarHBondContact CE1-CE1 3.45Å; H125-Y190 AromaticContact CE1-CZ 3.67Å; H125-Y190 AromaticContact ND1-CD1 3.93Å; H125-Y190 AromaticContact ND1-CE1 3.35Å; H125-Y190 VanDerWaalsContact ND1-CE1 3.35Å; H125-Y190 WeakPolarHBondContact ND1-CE1 3.21Å; Y186-Y190 WeakPolarHBondContact O-CB 3.46Å; Y186-Y190 PolarHBondContact O-N 3.33Å; T187-Y190 PolarHBondContact O-N 2.9Å; K188-Y190 VanDerWaalsContact C-N 3.29Å; K188-Y190 PolarHBondContact O-N 3.25Å; Y190-E194 HydrophobicContact CD2-CB 3.9Å; Y190-E194 HydrophobicContact CE2-CB 4.38Å; Y190-E194 PolarHBondContact O-N 2.88Å; Y190-C195 HydrophobicContact CE1-CB 4.25Å; Y190-C195 VanDerWaalsContact O-CB 3.28Å; Y190-C195 WeakPolarHBondContact O-CB 3.27Å; Y190-C195 PolarHBondContact O-N 2.92Å
191	L	97.6	Very high	96.7	Very high	1 Å²	1	60.7 Å²	60.7	1%	0.005	29%	0.292	C	S	.	.	I	π-helix	trans	-66.4	-45.9	-174.4	-63.2	173	0	0	0	112.7	G126 C127 F139 M143 D144 F156 T187 K188	G126-L191 WeakPolarHBondContact O-CD2 3.33Å; C127-L191 VanDerWaalsContact CB-O 3.29Å; C127-L191 WeakPolarHBondContact CB-O 3.35Å; F139-L191 WeakPolarHBondContact CE2-O 3.42Å; M143-L191 WeakPolarHBondContact O-CD2 3.38Å; D144-L191 HydrophobicContact CB-CD1 4.22Å; F156-L191 HydrophobicContact CD1-CD1 4.03Å; T187-L191 HydrophobicContact CG2-CD1 3.85Å; T187-L191 HydrophobicContact CG2-CG 4.41Å; T187-L191 VanDerWaalsContact O-CG 3.23Å; T187-L191 WeakPolarHBondContact O-CG 3.22Å; T187-L191 PolarHBondContact O-N 2.9Å; K188-L191 PolarHBondContact O-N 3.42Å; K188-L191 VanDerWaalsContact O-N 3.16Å
192	E	97.5	Very high	96.7	Very high	75 Å²	75	56.5 Å²	56.5	35%	0.35	27%	0.273	S	S	.	.	I	π-helix	trans	-81.3	-30.6	-175.7	-66.2	-167.8	155.1	0	0	113.4	F139 K188 M196	F139-E192 HydrophobicContact CD1-CG 4.28Å; F139-E192 HydrophobicContact CE1-CG 3.77Å; F139-E192 HydrophobicContact CE2-CB 4.38Å; F139-E192 HydrophobicContact CE2-CG 4.03Å; F139-E192 HydrophobicContact CZ-CB 4.42Å; F139-E192 HydrophobicContact CZ-CG 3.6Å; K188-E192 WeakPolarHBondContact CE-OE1 3.36Å; K188-E192 VanDerWaalsContact CE-OE2 3.27Å; K188-E192 WeakPolarHBondContact CE-OE2 3.24Å; K188-E192 HydrophobicContact CG-CG 4.12Å; K188-E192 VanDerWaalsContact NZ-CD 3.26Å; K188-E192 IonicContact NZ-OE1 3.66Å; K188-E192 PolarHBondContact NZ-OE1 3.04Å; K188-E192 IonicContact NZ-OE2 3.53Å; K188-E192 PolarHBondContact O-N 3.15Å; E192-M196 VanDerWaalsContact O-CG 3.26Å; E192-M196 WeakPolarHBondContact O-CG 3.36Å
193	K	97	Very high	96.5	Very high	128 Å²	128	52.5 Å²	52.5	56%	0.557	25%	0.246	S	C	*	.	I	π-helix	trans	-114.6	-70.2	-172.3	-173.5	-175.3	174.1	-173.9	0	112.6	G189 C195 M196 E197	G189-K193 VanDerWaalsContact O-CB 3.27Å; G189-K193 WeakPolarHBondContact O-CB 3.47Å; G189-K193 PolarHBondContact O-N 3.24Å; G189-K193 VanDerWaalsContact O-N 3.12Å; K193-C195 VanDerWaalsContact C-N 3.31Å; K193-C195 PolarHBondContact O-N 2.9Å; K193-M196 PolarHBondContact O-N 2.85Å; K193-M196 VanDerWaalsContact O-N 3.09Å; K193-E197 WeakPolarHBondContact CE-OE1 3.49Å; K193-E197 HydrophobicContact CG-CG 4.48Å; K193-E197 WeakPolarHBondContact CG-OE1 3.37Å; K193-E197 WeakPolarHBondContact O-CG 3.24Å; K193-E197 PolarHBondContact O-N 3Å
194	E	97.3	Very high	96.4	Very high	80 Å²	80	51.7 Å²	51.7	37%	0.374	25%	0.25	S	C	.	.	I	π-helix	trans	-60.4	-42.4	-170.5	-63.4	-174.8	-162.8	0	0	111.9	G189 Y190 M196 E197 W198	G189-E194 PolarHBondContact O-N 3.46Å; Y190-E194 HydrophobicContact CD2-CB 3.9Å; Y190-E194 HydrophobicContact CE2-CB 4.38Å; Y190-E194 PolarHBondContact O-N 2.88Å; E194-M196 PolarHBondContact O-N 2.97Å; E194-E197 PolarHBondContact O-N 3.35Å; E194-W198 PolarHBondContact O-N 3.41Å
195	C	98.1	Very high	96.1	Very high	0 Å²	0	52 Å²	52	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-62.3	-43.3	177	179.3	0	0	0	0	111.8	C127 Y190 K193 W198 M199	C127-C195 HydrophobicContact CB-CB 3.72Å; C127-C195 WeakPolarHBondContact CB-SG 3.46Å; C127-C195 PolarHBondContact N-SG 3.15Å; C127-C195 WeakPolarHBondContact SG-CB 3.39Å; C127-C195 CovalentContact SG-SG 2.04Å; C127-C195 PolarHBondContact SG-SG 2.89Å; Y190-C195 HydrophobicContact CE1-CB 4.25Å; Y190-C195 VanDerWaalsContact O-CB 3.28Å; Y190-C195 WeakPolarHBondContact O-CB 3.27Å; Y190-C195 PolarHBondContact O-N 2.92Å; K193-C195 VanDerWaalsContact C-N 3.31Å; K193-C195 PolarHBondContact O-N 2.9Å; C195-W198 PolarHBondContact O-N 3.19Å; C195-M199 VanDerWaalsContact O-CB 3.29Å; C195-M199 WeakPolarHBondContact O-CB 3.35Å; C195-M199 PolarHBondContact O-N 3.11Å
196	M	98.1	Very high	95.6	Very high	13 Å²	13	47.7 Å²	47.7	6%	0.064	23%	0.234	C	C	.	.	H	α-helix	trans	-66.2	-38.9	177.9	-68.5	-65.8	-60	0	0	112.1	C127 L137 F139 E192 K193 E194 M199 T200	C127-M196 HydrophobicContact CB-CG 4.42Å; C127-M196 HydrophobicContact CB-SD 4.1Å; L137-M196 HydrophobicContact CB-CE 3.67Å; F139-M196 HydrophobicContact CB-CE 4.32Å; F139-M196 HydrophobicContact CB-CG 4.34Å; F139-M196 HydrophobicContact CB-SD 4.33Å; F139-M196 HydrophobicContact CD2-CG 3.87Å; F139-M196 HydrophobicContact CD2-SD 3.94Å; E192-M196 VanDerWaalsContact O-CG 3.26Å; E192-M196 WeakPolarHBondContact O-CG 3.36Å; K193-M196 PolarHBondContact O-N 2.85Å; K193-M196 VanDerWaalsContact O-N 3.09Å; E194-M196 PolarHBondContact O-N 2.97Å; M196-M199 HydrophobicContact CE-CE 3.78Å; M196-M199 PolarHBondContact O-N 2.8Å; M196-M199 HydrophobicContact SD-CE 3.38Å; M196-M199 WeakPolarHBondContact SD-CE 3.47Å; M196-T200 WeakPolarHBondContact O-CB 3.48Å; M196-T200 PolarHBondContact O-N 3.33Å; M196-T200 PolarHBondContact O-OG1 2.9Å
197	E	97.7	Very high	95.1	Very high	108 Å²	108	45.3 Å²	45.3	51%	0.505	23%	0.228	S	C	.	.	H	α-helix	trans	-62.3	-47.5	174.5	-72.6	174.6	176.9	0	0	111	K193 E194 T200 K201	K193-E197 WeakPolarHBondContact CE-OE1 3.49Å; K193-E197 HydrophobicContact CG-CG 4.48Å; K193-E197 WeakPolarHBondContact CG-OE1 3.37Å; K193-E197 WeakPolarHBondContact O-CG 3.24Å; K193-E197 PolarHBondContact O-N 3Å; E194-E197 PolarHBondContact O-N 3.35Å; E197-T200 PolarHBondContact O-N 3.18Å; E197-K201 WeakPolarHBondContact O-CB 3.3Å; E197-K201 PolarHBondContact O-N 2.85Å
198	W	97.5	Very high	94.4	Very high	78 Å²	78	49.6 Å²	49.6	30%	0.295	25%	0.247	S	C	.	.	H	α-helix	trans	-64	-43.8	175.7	-82.1	112.5	0	0	0	112.5	L30 L81 Y85 E194 C195 T200 K201 F202	L30-W198 HydrophobicContact CD2-CB 3.8Å; L81-W198 HydrophobicContact CD2-CZ3 4.06Å; Y85-W198 AromaticContact CD2-CH2 3.57Å; Y85-W198 HydrophobicContact CD2-CH2 3.57Å; Y85-W198 HydrophobicContact CD2-CZ2 4.18Å; Y85-W198 HydrophobicContact CD2-CZ3 4.2Å; Y85-W198 AromaticContact CE2-CH2 3.54Å; Y85-W198 HydrophobicContact CE2-CH2 3.54Å; Y85-W198 HydrophobicContact CE2-CZ2 4.04Å; Y85-W198 AromaticContact CE2-CZ3 3.84Å; Y85-W198 HydrophobicContact CE2-CZ3 3.84Å; E194-W198 PolarHBondContact O-N 3.41Å; C195-W198 PolarHBondContact O-N 3.19Å; W198-T200 VanDerWaalsContact C-N 3.32Å; W198-T200 PolarHBondContact O-N 2.91Å; W198-K201 HydrophobicContact CE3-CD 4.21Å; W198-K201 HydrophobicContact CZ3-CD 4.05Å; W198-K201 PolarHBondContact O-N 3.09Å; W198-F202 HydrophobicContact CB-CD2 4.49Å; W198-F202 HydrophobicContact CB-CE2 4.12Å; W198-F202 HydrophobicContact CB-CZ 4.48Å; W198-F202 HydrophobicContact CD2-CE1 4.49Å; W198-F202 HydrophobicContact CD2-CZ 4.05Å; W198-F202 HydrophobicContact CE3-CD1 4.17Å; W198-F202 AromaticContact CE3-CE1 3.35Å; W198-F202 HydrophobicContact CE3-CE1 3.35Å; W198-F202 HydrophobicContact CE3-CE2 4.06Å; W198-F202 AromaticContact CE3-CZ 3.27Å; W198-F202 HydrophobicContact CE3-CZ 3.27Å; W198-F202 AromaticContact CZ3-CE1 3.6Å; W198-F202 HydrophobicContact CZ3-CE1 3.6Å; W198-F202 AromaticContact CZ3-CZ 3.78Å; W198-F202 HydrophobicContact CZ3-CZ 3.78Å; W198-F202 WeakPolarHBondContact O-CB 3.37Å; W198-F202 WeakPolarHBondContact O-CD2 3.36Å; W198-F202 WeakPolarHBondContact O-CG 3.31Å; W198-F202 PolarHBondContact O-N 2.86Å
199	M	97.2	Very high	93.6	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-60	-44	176.9	-177	165.5	65.5	0	0	111.2	H28 S29 L30 L55 L137 C195 M196 K201 F202 R203	H28-M199 HydrophobicContact CB-CE 4.45Å; H28-M199 HydrophobicContact CB-SD 3.88Å; S29-M199 VanDerWaalsContact C-SD 3.53Å; L30-M199 HydrophobicContact CB-CB 3.84Å; L30-M199 HydrophobicContact CB-CG 4.06Å; L30-M199 HydrophobicContact CB-SD 4.01Å; L30-M199 HydrophobicContact CD2-CB 4.16Å; L30-M199 PolarHBondContact N-SD 2.89Å; L30-M199 VanDerWaalsContact N-SD 3.4Å; L55-M199 HydrophobicContact CD1-CG 3.94Å; L137-M199 HydrophobicContact CD1-CE 3.89Å; L137-M199 HydrophobicContact CD1-CG 4.15Å; C195-M199 VanDerWaalsContact O-CB 3.29Å; C195-M199 WeakPolarHBondContact O-CB 3.35Å; C195-M199 PolarHBondContact O-N 3.11Å; M196-M199 HydrophobicContact CE-CE 3.78Å; M196-M199 PolarHBondContact O-N 2.8Å; M196-M199 HydrophobicContact SD-CE 3.38Å; M196-M199 WeakPolarHBondContact SD-CE 3.47Å; M199-K201 PolarHBondContact O-N 3.02Å; M199-F202 PolarHBondContact O-N 2.92Å; M199-R203 WeakPolarHBondContact O-CB 3.15Å; M199-R203 VanDerWaalsContact O-CG 3.27Å; M199-R203 WeakPolarHBondContact O-CG 3.04Å; M199-R203 PolarHBondContact O-N 3.01Å
200	T	95.9	Very high	92.8	Very high	71 Å²	71	49.9 Å²	49.9	44%	0.436	24%	0.241	S	C	.	.	H	α-helix	trans	-59.6	-47.3	175.8	-56.9	0	0	0	0	111.1	M196 E197 W198 G204	M196-T200 WeakPolarHBondContact O-CB 3.48Å; M196-T200 PolarHBondContact O-N 3.33Å; M196-T200 PolarHBondContact O-OG1 2.9Å; E197-T200 PolarHBondContact O-N 3.18Å; W198-T200 VanDerWaalsContact C-N 3.32Å; W198-T200 PolarHBondContact O-N 2.91Å; T200-G204 PolarHBondContact O-N 3.15Å; T200-G204 VanDerWaalsContact O-N 3.08Å
201	K	95.4	Very high	92	Very high	95 Å²	95	55.5 Å²	55.5	41%	0.413	27%	0.273	S	S	.	.	H	α-helix	trans	-62.6	-48.3	179.4	-175.5	175.8	179.9	-179.6	0	112.3	E197 W198 M199 G204 F205	E197-K201 WeakPolarHBondContact O-CB 3.3Å; E197-K201 PolarHBondContact O-N 2.85Å; W198-K201 HydrophobicContact CE3-CD 4.21Å; W198-K201 HydrophobicContact CZ3-CD 4.05Å; W198-K201 PolarHBondContact O-N 3.09Å; M199-K201 PolarHBondContact O-N 3.02Å; K201-G204 PolarHBondContact O-N 3.26Å; K201-F205 HydrophobicContact CD-CE2 4.05Å; K201-F205 HydrophobicContact CD-CZ 4.03Å; K201-F205 VanDerWaalsContact CE-CE2 3.49Å; K201-F205 HydrophobicContact CG-CD2 4.25Å; K201-F205 HydrophobicContact CG-CE1 4.27Å; K201-F205 HydrophobicContact CG-CE2 3.54Å; K201-F205 HydrophobicContact CG-CZ 3.56Å; K201-F205 WeakPolarHBondContact O-CD2 3.31Å; K201-F205 WeakPolarHBondContact O-CG 3.32Å; K201-F205 PolarHBondContact O-N 2.92Å; K201-F205 VanDerWaalsContact O-N 3.12Å
202	F	95.4	Very high	91.1	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-64.8	-39.5	-179.9	-67.8	-20.7	0	0	0	112.9	L30 L55 I60 W76 M77 L81 Y85 W198 M199 F205 G206	L30-F202 HydrophobicContact CD1-CD2 4.11Å; L30-F202 HydrophobicContact CD1-CE2 4.28Å; L30-F202 HydrophobicContact CD2-CD2 4.1Å; L30-F202 HydrophobicContact CD2-CE2 4.11Å; L55-F202 HydrophobicContact CD2-CB 3.98Å; I60-F202 HydrophobicContact CD1-CD2 3.68Å; I60-F202 HydrophobicContact CD1-CE2 3.76Å; I60-F202 HydrophobicContact CD1-CG 4.45Å; W76-F202 HydrophobicContact CH2-CB 3.48Å; W76-F202 VanDerWaalsContact CH2-CB 3.48Å; W76-F202 AromaticContact CH2-CD1 3.76Å; W76-F202 HydrophobicContact CH2-CD1 3.76Å; W76-F202 HydrophobicContact CH2-CD2 4.43Å; W76-F202 AromaticContact CH2-CG 3.65Å; W76-F202 HydrophobicContact CH2-CG 3.65Å; W76-F202 HydrophobicContact CZ2-CB 4.42Å; W76-F202 HydrophobicContact CZ3-CB 3.87Å; W76-F202 AromaticContact CZ3-CD1 3.51Å; W76-F202 HydrophobicContact CZ3-CD1 3.51Å; W76-F202 HydrophobicContact CZ3-CE1 4.29Å; W76-F202 AromaticContact CZ3-CG 3.89Å; W76-F202 HydrophobicContact CZ3-CG 3.89Å; M77-F202 HydrophobicContact SD-CD1 4.18Å; M77-F202 HydrophobicContact SD-CE1 3.98Å; M77-F202 HydrophobicContact SD-CZ 4.32Å; L81-F202 HydrophobicContact CD1-CE1 3.97Å; L81-F202 HydrophobicContact CD2-CE1 4.27Å; Y85-F202 WeakPolarHBondContact OH-CZ 3.37Å; W198-F202 HydrophobicContact CB-CD2 4.49Å; W198-F202 HydrophobicContact CB-CE2 4.12Å; W198-F202 HydrophobicContact CB-CZ 4.48Å; W198-F202 HydrophobicContact CD2-CE1 4.49Å; W198-F202 HydrophobicContact CD2-CZ 4.05Å; W198-F202 HydrophobicContact CE3-CD1 4.17Å; W198-F202 AromaticContact CE3-CE1 3.35Å; W198-F202 HydrophobicContact CE3-CE1 3.35Å; W198-F202 HydrophobicContact CE3-CE2 4.06Å; W198-F202 AromaticContact CE3-CZ 3.27Å; W198-F202 HydrophobicContact CE3-CZ 3.27Å; W198-F202 AromaticContact CZ3-CE1 3.6Å; W198-F202 HydrophobicContact CZ3-CE1 3.6Å; W198-F202 AromaticContact CZ3-CZ 3.78Å; W198-F202 HydrophobicContact CZ3-CZ 3.78Å; W198-F202 WeakPolarHBondContact O-CB 3.37Å; W198-F202 WeakPolarHBondContact O-CD2 3.36Å; W198-F202 WeakPolarHBondContact O-CG 3.31Å; W198-F202 PolarHBondContact O-N 2.86Å; M199-F202 PolarHBondContact O-N 2.92Å; F202-F205 HydrophobicContact CD1-CD2 4.35Å; F202-F205 PolarHBondContact O-N 3.5Å; F202-G206 PolarHBondContact O-N 3.45Å
203	R	92.6	Very high	90.2	Very high	25 Å²	25	59 Å²	59	9%	0.094	30%	0.298	C	S	.	.	H	α-helix	trans	-60.7	-45.4	172.6	-74.7	177.1	71.8	-90.4	-15.1	111.4	H28 L55 M199 F205 G206 E207	H28-R203 PolarHBondContact CD2-NE 3.37Å; H28-R203 PolarHBondContact CE1-NE 2.93Å; H28-R203 PolarHBondContact ND1-NE 2.81Å; H28-R203 VanDerWaalsContact ND1-NE 3.16Å; H28-R203 PolarHBondContact NE2-NE 3.45Å; H28-R203 VanDerWaalsContact NE2-NE 3.19Å; H28-R203 PolarHBondContact NE2-NH2 3.08Å; H28-R203 VanDerWaalsContact NE2-NH2 3.17Å; L55-R203 HydrophobicContact CD1-CG 4.12Å; L55-R203 HydrophobicContact CD2-CG 4.28Å; M199-R203 WeakPolarHBondContact O-CB 3.15Å; M199-R203 VanDerWaalsContact O-CG 3.27Å; M199-R203 WeakPolarHBondContact O-CG 3.04Å; M199-R203 PolarHBondContact O-N 3.01Å; R203-F205 VanDerWaalsContact C-N 3.32Å; R203-F205 PolarHBondContact O-N 2.94Å; R203-G206 PolarHBondContact O-N 3.03Å; R203-G206 VanDerWaalsContact O-N 3.15Å; R203-E207 IonicContact CZ-OE1 2.71Å; R203-E207 IonicContact NH1-OE1 3.66Å; R203-E207 IonicContact NH2-OE1 3.85Å; R203-E207 PolarHBondContact NH2-OE1 2.96Å; R203-E207 WeakPolarHBondContact O-CB 3.47Å; R203-E207 WeakPolarHBondContact O-CG 3.49Å; R203-E207 PolarHBondContact O-N 3.31Å
204	G	91.7	Very high	89.5	Confident	34 Å²	34	61.3 Å²	61.3	35%	0.351	31%	0.308	S	S	.	.	H	α-helix	trans	-56.6	-44.3	177	0	0	0	0	0	112.8	T200 K201 E207 E208	T200-G204 PolarHBondContact O-N 3.15Å; T200-G204 VanDerWaalsContact O-N 3.08Å; K201-G204 PolarHBondContact O-N 3.26Å; G204-E207 PolarHBondContact O-N 3.26Å; G204-E208 PolarHBondContact O-N 2.84Å
205	F	90.6	Very high	89	Confident	33 Å²	33	64.1 Å²	64.1	15%	0.145	32%	0.315	C	S	.	.	H	α-helix	trans	-65	-40.8	176	-60.3	-27.1	0	0	0	113.1	W76 H80 L81 K201 F202 R203 E208 Q209	W76-F205 HydrophobicContact CB-CB 4.25Å; W76-F205 HydrophobicContact CD2-CB 3.87Å; W76-F205 HydrophobicContact CE3-CB 3.34Å; W76-F205 AromaticContact CE3-CD2 3.7Å; W76-F205 HydrophobicContact CE3-CD2 3.7Å; W76-F205 HydrophobicContact CE3-CG 4.01Å; W76-F205 HydrophobicContact CG-CB 4.28Å; W76-F205 HydrophobicContact CZ3-CB 4.03Å; W76-F205 AromaticContact CZ3-CD2 3.81Å; W76-F205 HydrophobicContact CZ3-CD2 3.81Å; W76-F205 HydrophobicContact CZ3-CG 4.45Å; H80-F205 HydrophobicContact CB-CD1 4.03Å; H80-F205 HydrophobicContact CB-CD2 3.75Å; H80-F205 HydrophobicContact CB-CE1 3.89Å; H80-F205 HydrophobicContact CB-CE2 3.57Å; H80-F205 HydrophobicContact CB-CG 3.96Å; H80-F205 HydrophobicContact CB-CZ 3.64Å; H80-F205 AromaticContact CD2-CD1 3.56Å; H80-F205 AromaticContact CD2-CE1 3.63Å; H80-F205 AromaticContact CG-CD1 3.68Å; H80-F205 AromaticContact CG-CE1 3.87Å; H80-F205 AromaticContact CG-CG 3.82Å; L81-F205 HydrophobicContact CD2-CE2 4.07Å; K201-F205 HydrophobicContact CD-CE2 4.05Å; K201-F205 HydrophobicContact CD-CZ 4.03Å; K201-F205 VanDerWaalsContact CE-CE2 3.49Å; K201-F205 HydrophobicContact CG-CD2 4.25Å; K201-F205 HydrophobicContact CG-CE1 4.27Å; K201-F205 HydrophobicContact CG-CE2 3.54Å; K201-F205 HydrophobicContact CG-CZ 3.56Å; K201-F205 WeakPolarHBondContact O-CD2 3.31Å; K201-F205 WeakPolarHBondContact O-CG 3.32Å; K201-F205 PolarHBondContact O-N 2.92Å; K201-F205 VanDerWaalsContact O-N 3.12Å; F202-F205 HydrophobicContact CD1-CD2 4.35Å; F202-F205 PolarHBondContact O-N 3.5Å; R203-F205 VanDerWaalsContact C-N 3.32Å; R203-F205 PolarHBondContact O-N 2.94Å; F205-E208 PolarHBondContact O-N 3.43Å; F205-Q209 PolarHBondContact O-N 2.88Å
206	G	85.1	Confident	88.7	Confident	9 Å²	9	64.4 Å²	64.4	9%	0.093	32%	0.317	C	S	.	.	H	α-helix	trans	-67.6	-38.6	176.9	0	0	0	0	0	113.1	F202 R203 Q209 L210	F202-G206 PolarHBondContact O-N 3.45Å; R203-G206 PolarHBondContact O-N 3.03Å; R203-G206 VanDerWaalsContact O-N 3.15Å; G206-Q209 PolarHBondContact O-N 2.72Å; G206-L210 WeakPolarHBondContact O-CB 3.12Å; G206-L210 PolarHBondContact O-N 3.23Å
207	E	84.4	Confident	88.6	Confident	93 Å²	93	69.5 Å²	69.5	44%	0.435	34%	0.34	S	S	.	.	H	α-helix	trans	-63.2	-42.5	174.7	-75.8	174.5	-169.7	0	0	111.1	R203 G204 Q209 L210 L211	R203-E207 IonicContact CZ-OE1 2.71Å; R203-E207 IonicContact NH1-OE1 3.66Å; R203-E207 IonicContact NH2-OE1 3.85Å; R203-E207 PolarHBondContact NH2-OE1 2.96Å; R203-E207 WeakPolarHBondContact O-CB 3.47Å; R203-E207 WeakPolarHBondContact O-CG 3.49Å; R203-E207 PolarHBondContact O-N 3.31Å; G204-E207 PolarHBondContact O-N 3.26Å; E207-Q209 PolarHBondContact O-N 2.88Å; E207-L210 WeakPolarHBondContact O-CB 3.45Å; E207-L210 PolarHBondContact O-N 3.27Å; E207-L211 WeakPolarHBondContact O-CG 3.35Å; E207-L211 PolarHBondContact O-N 3.19Å
208	E	82.1	Confident	88.5	Confident	99 Å²	99	64.8 Å²	64.8	46%	0.463	32%	0.319	S	S	.	.	H	α-helix	trans	-60.3	-45.2	175.1	-176.6	178.9	169.1	0	0	112.1	H80 G204 F205 L210 L211 N212	H80-E208 IonicContact NE2-OE2 2.61Å; G204-E208 PolarHBondContact O-N 2.84Å; F205-E208 PolarHBondContact O-N 3.43Å; E208-L210 VanDerWaalsContact C-N 3.29Å; E208-L210 PolarHBondContact O-N 3.48Å; E208-L211 PolarHBondContact O-N 3.27Å; E208-N212 PolarHBondContact O-N 3.09Å; E208-N212 VanDerWaalsContact O-N 3.16Å; E208-N212 PolarHBondContact O-ND2 2.94Å
209	Q	80.2	Confident	88.5	Confident	36 Å²	36	64.9 Å²	64.9	17%	0.168	32%	0.322	C	S	.	.	H	α-helix	trans	-62.1	-39.9	176.1	-170.1	-169.4	15.6	0	0	111.4	F205 G206 E207 N212 A213 Y241	F205-Q209 PolarHBondContact O-N 2.88Å; G206-Q209 PolarHBondContact O-N 2.72Å; E207-Q209 PolarHBondContact O-N 2.88Å; Q209-N212 CarbonylContact O-C 3.56Å; Q209-N212 PolarHBondContact O-N 2.83Å; Q209-A213 PolarHBondContact O-N 2.83Å; Q209-Y241 VanDerWaalsContact CD-CE1 3.49Å; Q209-Y241 HydrophobicContact CG-CE1 4.13Å; Q209-Y241 PolarHBondContact OE1-OH 3.37Å
210	L	81.3	Confident	88.4	Confident	37 Å²	37	65.8 Å²	65.8	19%	0.194	33%	0.327	C	S	.	.	H	α-helix	trans	-68	-39.9	179.9	-176.3	63.1	0	0	0	112.6	G206 E207 E208 N212 A213 Y241 A299	G206-L210 WeakPolarHBondContact O-CB 3.12Å; G206-L210 PolarHBondContact O-N 3.23Å; E207-L210 WeakPolarHBondContact O-CB 3.45Å; E207-L210 PolarHBondContact O-N 3.27Å; E208-L210 VanDerWaalsContact C-N 3.29Å; E208-L210 PolarHBondContact O-N 3.48Å; L210-N212 PolarHBondContact O-N 3.28Å; L210-A213 VanDerWaalsContact O-CB 3.24Å; L210-A213 WeakPolarHBondContact O-CB 3.26Å; L210-A213 PolarHBondContact O-N 3.17Å; L210-A213 VanDerWaalsContact O-N 3.15Å; L210-Y241 WeakPolarHBondContact CD1-O 3.36Å; L210-A299 HydrophobicContact CD1-CB 3.94Å; L210-A299 HydrophobicContact CD2-CB 3.97Å; L210-A299 WeakPolarHBondContact CD2-O 3.44Å
211	L	79.9	Confident	88.4	Confident	150 Å²	150	64.3 Å²	64.3	79%	0.785	32%	0.315	S	S	*	.	H	α-helix	trans	-63.8	-33.7	175.1	-73.7	171.1	0	0	0	112	E207 E208 A213	E207-L211 WeakPolarHBondContact O-CG 3.35Å; E207-L211 PolarHBondContact O-N 3.19Å; E208-L211 PolarHBondContact O-N 3.27Å; L211-A213 VanDerWaalsContact C-N 3.34Å
212	N	78.6	Confident	88.3	Confident	121 Å²	121	60.1 Å²	60.1	65%	0.647	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-4.5	176.7	-67.7	-44.5	0	0	0	113.3	E208 Q209 L210	E208-N212 PolarHBondContact O-N 3.09Å; E208-N212 VanDerWaalsContact O-N 3.16Å; E208-N212 PolarHBondContact O-ND2 2.94Å; Q209-N212 CarbonylContact O-C 3.56Å; Q209-N212 PolarHBondContact O-N 2.83Å; L210-N212 PolarHBondContact O-N 3.28Å
213	A	78.4	Confident	88.1	Confident	28 Å²	28	67.1 Å²	67.1	23%	0.231	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-66.1	138.1	-178.8	0	0	0	0	0	110.8	Q209 L210 L211	Q209-A213 PolarHBondContact O-N 2.83Å; L210-A213 VanDerWaalsContact O-CB 3.24Å; L210-A213 WeakPolarHBondContact O-CB 3.26Å; L210-A213 PolarHBondContact O-N 3.17Å; L210-A213 VanDerWaalsContact O-N 3.15Å; L211-A213 VanDerWaalsContact C-N 3.34Å
214	K	81.9	Confident	88	Confident	177 Å²	177	73.9 Å²	73.9	77%	0.77	35%	0.354	S	S	*	.	P	Polyproline II helix	trans	-68.9	153	177.3	-67.4	178.9	-175	171	0	110.3
215	R	87.5	Confident	88.1	Confident	140 Å²	140	73 Å²	73	53%	0.528	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-63	133.7	171.5	-170.3	174	-178	118.2	0.3	109.5	E217 M302 K303 V304	R215-E217 PolarHBondContact O-N 2.72Å; R215-M302 VanDerWaalsContact CA-CE 3.45Å; R215-M302 HydrophobicContact CB-CE 3.38Å; R215-M302 HydrophobicContact CB-SD 4.08Å; R215-M302 HydrophobicContact CG-CE 3.6Å; R215-M302 HydrophobicContact CG-SD 4.03Å; R215-K303 PolarHBondContact NH2-O 2.92Å; R215-V304 HydrophobicContact CG-CG2 3.99Å
216	P	92.3	Very high	88.1	Confident	5 Å²	5	81.8 Å²	81.8	3%	0.032	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-54.1	131.2	174.2	7.9	-17.9	0	0	0	110.8	T238 F240 V295 V304	P216-T238 WeakPolarHBondContact CA-O 3.09Å; P216-F240 HydrophobicContact CB-CB 4.05Å; P216-F240 HydrophobicContact CB-CD1 4.5Å; P216-F240 HydrophobicContact CG-CB 4.39Å; P216-V295 HydrophobicContact CG-CG1 4.46Å; P216-V304 HydrophobicContact CG-CG2 4.11Å
217	E	94.8	Very high	88.5	Confident	121 Å²	121	83.2 Å²	83.2	57%	0.565	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.8	126.6	168.5	-65.4	-173.5	179.9	0	0	108.3	R215 H219 A237 T238	R215-E217 PolarHBondContact O-N 2.72Å; E217-H219 IonicContact OE2-NE2 2.94Å; E217-A237 CarbonylContact O-C 3.56Å; E217-A237 WeakPolarHBondContact O-CA 3.09Å; E217-T238 HydrophobicContact CB-CG2 3.99Å; E217-T238 PolarHBondContact N-O 2.97Å; E217-T238 PolarHBondContact O-N 3.37Å
218	V	96.4	Very high	88.7	Confident	8 Å²	8	85.6 Å²	85.6	5%	0.048	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	125.3	-178.9	-175.4	0	0	0	0	108.8	L236 V295 V304 K306	V218-L236 CarbonylContact C-O 3.53Å; V218-L236 WeakPolarHBondContact CA-O 3.5Å; V218-V295 HydrophobicContact CB-CG2 4.43Å; V218-V295 HydrophobicContact CG1-CG2 3.88Å; V218-V295 HydrophobicContact CG2-CB 3.88Å; V218-V295 HydrophobicContact CG2-CG1 4.34Å; V218-V295 HydrophobicContact CG2-CG2 3.6Å; V218-V304 HydrophobicContact CB-CG1 4.07Å; V218-V304 HydrophobicContact CG2-CB 3.79Å; V218-V304 HydrophobicContact CG2-CG1 3.7Å; V218-V304 HydrophobicContact CG2-CG2 4.39Å; V218-K306 HydrophobicContact CB-CG 3.9Å; V218-K306 HydrophobicContact CG1-CB 4.16Å; V218-K306 HydrophobicContact CG1-CG 3.82Å; V218-K306 WeakPolarHBondContact O-CE 3.17Å; V218-K306 WeakPolarHBondContact O-CG 3.3Å
219	H	95.9	Very high	89.2	Confident	80 Å²	80	85.3 Å²	85.3	37%	0.37	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	136.2	177.2	-52.7	-90	0	0	0	109.1	E217 F221 C235 L236	E217-H219 IonicContact OE2-NE2 2.94Å; H219-F221 HydrophobicContact CB-CD1 3.94Å; H219-F221 HydrophobicContact CB-CE1 4.15Å; H219-C235 CarbonylContact O-C 3.59Å; H219-C235 WeakPolarHBondContact O-CA 3.43Å; H219-L236 HydrophobicContact CB-CB 4.35Å; H219-L236 PolarHBondContact N-O 2.82Å; H219-L236 PolarHBondContact O-N 3.4Å
220	L	96.3	Very high	89.9	Confident	20 Å²	20	85.1 Å²	85.1	11%	0.105	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	111.4	174.9	-177	57.5	0	0	0	107.5	L233 T234 C235 C293 K306 W308	L220-L233 HydrophobicContact CD1-CD1 3.69Å; L220-L233 HydrophobicContact CD1-CD2 4.16Å; L220-L233 HydrophobicContact CD1-CG 3.8Å; L220-L233 HydrophobicContact CG-CD1 4.09Å; L220-T234 WeakPolarHBondContact CA-O 3.26Å; L220-C235 HydrophobicContact CD1-CB 4.03Å; L220-C293 HydrophobicContact CD1-CB 4.15Å; L220-C293 HydrophobicContact CD2-CB 4.05Å; L220-C293 HydrophobicContact CG-CB 4.5Å; L220-K306 HydrophobicContact CB-CB 4.24Å; L220-K306 WeakPolarHBondContact CD2-O 3.46Å; L220-W308 HydrophobicContact CD2-CB 3.73Å; L220-W308 HydrophobicContact CG-CB 4.05Å
221	F	94.8	Very high	90.6	Very high	39 Å²	39	83.6 Å²	83.6	17%	0.171	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	167.8	-172.3	59.6	-93.5	0	0	0	110.5	H219 R223 T234 L236	H219-F221 HydrophobicContact CB-CD1 3.94Å; H219-F221 HydrophobicContact CB-CE1 4.15Å; F221-R223 HydrophobicContact CD2-CG 4.29Å; F221-R223 HydrophobicContact CE2-CG 4.15Å; F221-T234 HydrophobicContact CE1-CG2 4.32Å; F221-T234 HydrophobicContact CE2-CG2 3.95Å; F221-T234 HydrophobicContact CZ-CG2 3.65Å; F221-T234 PolarHBondContact N-O 2.97Å; F221-T234 PolarHBondContact O-N 3.32Å; F221-L236 HydrophobicContact CE1-CB 4.07Å
222	T	94.2	Very high	91.3	Very high	8 Å²	8	78.6 Å²	78.6	5%	0.049	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	154.2	178.2	55.7	0	0	0	0	112.9	T231 I232 L233 W308	T222-T231 WeakPolarHBondContact CB-OG1 3.3Å; T222-T231 HydrophobicContact CG2-CG2 4.01Å; T222-I232 CarbonylContact C-O 3.52Å; T222-I232 VanDerWaalsContact CA-O 3.24Å; T222-I232 WeakPolarHBondContact CA-O 3.09Å; T222-L233 HydrophobicContact CG2-CB 4.5Å; T222-L233 HydrophobicContact CG2-CD1 3.8Å; T222-W308 HydrophobicContact CG2-CH2 4.28Å; T222-W308 HydrophobicContact CG2-CZ2 3.41Å; T222-W308 VanDerWaalsContact CG2-CZ2 3.41Å
223	R	91.3	Very high	92.2	Very high	147 Å²	147	72.8 Å²	72.8	56%	0.555	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.8	159.2	169.2	-63.8	-178	178.8	178.3	1.5	110.5	F221 A225 T231 I232	F221-R223 HydrophobicContact CD2-CG 4.29Å; F221-R223 HydrophobicContact CE2-CG 4.15Å; R223-A225 PolarHBondContact O-N 2.86Å; R223-T231 PolarHBondContact O-OG1 3.16Å; R223-T231 VanDerWaalsContact O-OG1 3.09Å; R223-I232 PolarHBondContact N-O 3.19Å; R223-I232 PolarHBondContact O-N 2.87Å
224	K	91.4	Very high	93.1	Very high	166 Å²	166	71.9 Å²	71.9	72%	0.722	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.8	128.7	177.1	-70.5	-176.3	179	177	0	110.9
225	A	92.7	Very high	93.9	Very high	16 Å²	16	63.5 Å²	63.5	13%	0.132	30%	0.303	C	S	.	.			trans	-82.8	173.8	167.8	0	0	0	0	0	110.4	R223 A227 N230 I232 E282	R223-A225 PolarHBondContact O-N 2.86Å; A225-A227 VanDerWaalsContact C-N 3.34Å; A225-N230 HydrophobicContact CB-CB 3.71Å; A225-N230 WeakPolarHBondContact CB-O 3.42Å; A225-I232 HydrophobicContact CB-CG1 3.99Å; A225-E282 HydrophobicContact CB-CG 4.2Å
226	K	91.1	Very high	94.4	Very high	217 Å²	217	58 Å²	58	94%	0.943	28%	0.284	S	S	*	.	S	Bend	trans	-68.3	-35.1	173.8	-68.1	-174.9	177.7	177.7	0	112.3
227	A	92.3	Very high	94.6	Very high	39 Å²	39	57.8 Å²	57.8	32%	0.322	28%	0.283	S	S	.	.	S	Bend	trans	-92.1	132.9	176	0	0	0	0	0	110.3	A225 T229 N230	A225-A227 VanDerWaalsContact C-N 3.34Å; A227-T229 PolarHBondContact O-N 2.85Å; A227-N230 HydrophobicContact CB-CB 4.23Å; A227-N230 PolarHBondContact O-N 2.95Å
228	D	90.1	Very high	94.6	Very high	143 Å²	143	53.3 Å²	53.3	77%	0.765	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-23.3	-177.2	-73	-35.8	0	0	0	113.9	N230 K285	D228-N230 PolarHBondContact O-N 3.4Å; D228-K285 WeakPolarHBondContact O-CD 3.36Å; D228-K285 VanDerWaalsContact O-CE 3.23Å; D228-K285 WeakPolarHBondContact O-CE 3.46Å; D228-K285 PolarHBondContact O-NZ 3.16Å
229	T	92.6	Very high	94.4	Very high	94 Å²	94	53.8 Å²	53.8	58%	0.577	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-13.1	174.6	53.4	0	0	0	0	113.1	A227 K285	A227-T229 PolarHBondContact O-N 2.85Å; T229-K285 PolarHBondContact O-N 3.22Å
230	N	94.5	Very high	94.2	Very high	32 Å²	32	50 Å²	50	17%	0.171	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	159.7	-169.4	-63	17.7	0	0	0	111.3	A225 A227 D228 E282 I283 L284 K285	A225-N230 HydrophobicContact CB-CB 3.71Å; A225-N230 WeakPolarHBondContact CB-O 3.42Å; A227-N230 HydrophobicContact CB-CB 4.23Å; A227-N230 PolarHBondContact O-N 2.95Å; D228-N230 PolarHBondContact O-N 3.4Å; N230-E282 HydrophobicContact CB-CG 3.88Å; N230-E282 WeakPolarHBondContact CB-OE1 3.46Å; N230-E282 PolarHBondContact ND2-OE1 3.03Å; N230-I283 CarbonylContact C-O 3.54Å; N230-I283 VanDerWaalsContact CA-O 3.29Å; N230-I283 WeakPolarHBondContact CA-O 3.44Å; N230-L284 WeakPolarHBondContact OD1-CD2 3.44Å; N230-K285 VanDerWaalsContact O-CE 3.23Å; N230-K285 WeakPolarHBondContact O-CE 3.23Å
231	T	94.8	Very high	93.7	Very high	4 Å²	4	49.9 Å²	49.9	3%	0.025	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	150.3	173.6	-164.9	0	0	0	0	109.4	T222 R223 E282 I283 K285	T222-T231 WeakPolarHBondContact CB-OG1 3.3Å; T222-T231 HydrophobicContact CG2-CG2 4.01Å; R223-T231 PolarHBondContact O-OG1 3.16Å; R223-T231 VanDerWaalsContact O-OG1 3.09Å; T231-E282 WeakPolarHBondContact O-CA 3.4Å; T231-I283 HydrophobicContact CG2-CD1 4.17Å; T231-I283 HydrophobicContact CG2-CG1 3.64Å; T231-I283 PolarHBondContact N-O 3.45Å; T231-I283 PolarHBondContact O-N 3.28Å; T231-K285 HydrophobicContact CG2-CG 4.27Å
232	I	96.4	Very high	93.3	Very high	45 Å²	45	48.4 Å²	48.4	23%	0.231	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	106.1	178.5	-58.8	175.3	0	0	0	107.7	T222 R223 A225 H280	T222-I232 CarbonylContact C-O 3.52Å; T222-I232 VanDerWaalsContact CA-O 3.24Å; T222-I232 WeakPolarHBondContact CA-O 3.09Å; R223-I232 PolarHBondContact N-O 3.19Å; R223-I232 PolarHBondContact O-N 2.87Å; A225-I232 HydrophobicContact CB-CG1 3.99Å; I232-H280 HydrophobicContact CG2-CB 3.85Å
233	L	97.1	Very high	92.9	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	121.2	172.2	-175.6	70.9	0	0	0	108.8	L220 T222 I249 H280 V281 I283 Y291 W308	L220-L233 HydrophobicContact CD1-CD1 3.69Å; L220-L233 HydrophobicContact CD1-CD2 4.16Å; L220-L233 HydrophobicContact CD1-CG 3.8Å; L220-L233 HydrophobicContact CG-CD1 4.09Å; T222-L233 HydrophobicContact CG2-CB 4.5Å; T222-L233 HydrophobicContact CG2-CD1 3.8Å; L233-I249 HydrophobicContact CD2-CG2 4.15Å; L233-H280 CarbonylContact O-C 3.56Å; L233-H280 WeakPolarHBondContact O-CA 3.48Å; L233-H280 WeakPolarHBondContact O-CB 3.38Å; L233-V281 HydrophobicContact CB-CG1 4.27Å; L233-V281 PolarHBondContact N-O 2.82Å; L233-V281 PolarHBondContact O-N 2.83Å; L233-I283 HydrophobicContact CB-CD1 3.99Å; L233-I283 HydrophobicContact CB-CG1 4.35Å; L233-I283 HydrophobicContact CD2-CD1 4.34Å; L233-Y291 HydrophobicContact CD2-CD1 3.5Å; L233-Y291 HydrophobicContact CD2-CD2 4.49Å; L233-Y291 HydrophobicContact CD2-CE1 4.25Å; L233-Y291 HydrophobicContact CD2-CG 3.63Å; L233-W308 HydrophobicContact CD1-CB 4.36Å; L233-W308 HydrophobicContact CD1-CD2 3.88Å; L233-W308 HydrophobicContact CD1-CE3 4.41Å; L233-W308 HydrophobicContact CD1-CG 3.84Å
234	T	97.4	Very high	92.8	Very high	9 Å²	9	50.4 Å²	50.4	6%	0.055	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	127.1	-178.2	-55.3	0	0	0	0	109.7	L220 F221 H280	L220-T234 WeakPolarHBondContact CA-O 3.26Å; F221-T234 HydrophobicContact CE1-CG2 4.32Å; F221-T234 HydrophobicContact CE2-CG2 3.95Å; F221-T234 HydrophobicContact CZ-CG2 3.65Å; F221-T234 PolarHBondContact N-O 2.97Å; F221-T234 PolarHBondContact O-N 3.32Å; T234-H280 HydrophobicContact CG2-CB 4.32Å
235	C	97.8	Very high	92.9	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	125.3	163.8	-176.3	0	0	0	0	110.4	H219 L220 L247 I249 K278 D279 C293	H219-C235 CarbonylContact O-C 3.59Å; H219-C235 WeakPolarHBondContact O-CA 3.43Å; L220-C235 HydrophobicContact CD1-CB 4.03Å; C235-L247 HydrophobicContact CB-CD2 4Å; C235-I249 HydrophobicContact CB-CD1 4.06Å; C235-I249 HydrophobicContact CB-CG1 3.98Å; C235-K278 VanDerWaalsContact O-CA 3.31Å; C235-K278 WeakPolarHBondContact O-CA 3.44Å; C235-D279 PolarHBondContact N-O 2.94Å; C235-D279 PolarHBondContact O-N 2.97Å; C235-C293 HydrophobicContact CB-CB 3.6Å; C235-C293 WeakPolarHBondContact CB-SG 3.38Å; C235-C293 WeakPolarHBondContact SG-CB 3.17Å; C235-C293 CovalentContact SG-SG 2Å; C235-C293 PolarHBondContact SG-SG 3.49Å
236	L	97.5	Very high	93	Very high	25 Å²	25	45.9 Å²	45.9	13%	0.131	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	123.6	173	166.1	59.8	0	0	0	108.9	V218 H219 F221 Q276 R277 K278	V218-L236 CarbonylContact C-O 3.53Å; V218-L236 WeakPolarHBondContact CA-O 3.5Å; H219-L236 HydrophobicContact CB-CB 4.35Å; H219-L236 PolarHBondContact N-O 2.82Å; H219-L236 PolarHBondContact O-N 3.4Å; F221-L236 HydrophobicContact CE1-CB 4.07Å; L236-Q276 HydrophobicContact CD1-CB 4.25Å; L236-R277 WeakPolarHBondContact CA-O 3.32Å; L236-K278 HydrophobicContact CB-CG 4.14Å; L236-K278 HydrophobicContact CD1-CD 4.26Å; L236-K278 HydrophobicContact CD1-CG 3.61Å; L236-K278 HydrophobicContact CG-CG 4.41Å
237	A	97.3	Very high	93.3	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	133	160.8	0	0	0	0	0	108.7	E217 F240 I245 L247 Q276 R277 V295	E217-A237 CarbonylContact O-C 3.56Å; E217-A237 WeakPolarHBondContact O-CA 3.09Å; A237-F240 HydrophobicContact CB-CD1 4.3Å; A237-F240 HydrophobicContact CB-CE1 4.03Å; A237-I245 HydrophobicContact CB-CD1 4.17Å; A237-L247 HydrophobicContact CB-CD1 4.06Å; A237-Q276 CarbonylContact O-C 3.48Å; A237-Q276 WeakPolarHBondContact O-CA 3.29Å; A237-R277 PolarHBondContact N-O 3.47Å; A237-R277 PolarHBondContact O-N 2.74Å; A237-V295 HydrophobicContact CB-CG1 4.16Å; A237-V295 HydrophobicContact CB-CG2 3.97Å
238	T	95.9	Very high	93.6	Very high	27 Å²	27	36.4 Å²	36.4	17%	0.166	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	162.2	177.5	-168.5	0	0	0	0	111.5	P216 E217 N270 F275	P216-T238 WeakPolarHBondContact CA-O 3.09Å; E217-T238 HydrophobicContact CB-CG2 3.99Å; E217-T238 PolarHBondContact N-O 2.97Å; E217-T238 PolarHBondContact O-N 3.37Å; T238-N270 PolarHBondContact OG1-ND2 2.8Å; T238-N270 VanDerWaalsContact OG1-ND2 3.14Å; T238-F275 CarbonylContact C-O 3.59Å; T238-F275 WeakPolarHBondContact CA-O 3.18Å
239	G	92.1	Very high	93.9	Very high	18 Å²	18	29.7 Å²	29.7	19%	0.186	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	77.1	20.2	176	0	0	0	0	0	113.9	T274 F275	G239-T274 WeakPolarHBondContact CA-OG1 3.21Å; G239-F275 PolarHBondContact N-O 3.29Å
240	F	91.1	Very high	94.2	Very high	1 Å²	1	26.6 Å²	26.6	0%	0.004	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	149.4	177.4	58.5	-88.9	0	0	0	112.1	P216 A237 P242 I245 V267 F275 R277	P216-F240 HydrophobicContact CB-CB 4.05Å; P216-F240 HydrophobicContact CB-CD1 4.5Å; P216-F240 HydrophobicContact CG-CB 4.39Å; A237-F240 HydrophobicContact CB-CD1 4.3Å; A237-F240 HydrophobicContact CB-CE1 4.03Å; F240-P242 WeakPolarHBondContact CD2-O 3.4Å; F240-I245 HydrophobicContact CB-CD1 4.2Å; F240-I245 HydrophobicContact CD1-CD1 3.46Å; F240-I245 VanDerWaalsContact CD1-CD1 3.46Å; F240-I245 HydrophobicContact CD2-CB 4.09Å; F240-I245 HydrophobicContact CD2-CD1 3.67Å; F240-I245 HydrophobicContact CD2-CG1 4.45Å; F240-I245 HydrophobicContact CD2-CG2 4.41Å; F240-I245 HydrophobicContact CE1-CD1 3.59Å; F240-I245 HydrophobicContact CE1-CG2 4.4Å; F240-I245 HydrophobicContact CE2-CB 3.74Å; F240-I245 HydrophobicContact CE2-CD1 3.79Å; F240-I245 HydrophobicContact CE2-CG1 4.41Å; F240-I245 HydrophobicContact CE2-CG2 3.58Å; F240-I245 HydrophobicContact CG-CD1 3.51Å; F240-I245 HydrophobicContact CZ-CB 4.16Å; F240-I245 HydrophobicContact CZ-CD1 3.77Å; F240-I245 HydrophobicContact CZ-CG2 3.6Å; F240-V267 HydrophobicContact CE2-CG1 4.19Å; F240-V267 HydrophobicContact CZ-CG1 4.18Å; F240-F275 VanDerWaalsContact CD1-O 3.25Å; F240-F275 WeakPolarHBondContact CD1-O 3.48Å; F240-F275 HydrophobicContact CD2-CB 3.92Å; F240-F275 HydrophobicContact CE1-CB 4.36Å; F240-F275 VanDerWaalsContact CE1-O 3.23Å; F240-F275 WeakPolarHBondContact CE1-O 3.45Å; F240-F275 HydrophobicContact CE2-CB 3.46Å; F240-F275 VanDerWaalsContact CE2-CB 3.46Å; F240-F275 HydrophobicContact CE2-CG 4.44Å; F240-F275 HydrophobicContact CZ-CB 3.7Å; F240-F275 PolarHBondContact N-O 3.2Å; F240-F275 PolarHBondContact O-N 3.15Å; F240-R277 HydrophobicContact CZ-CB 4.22Å
241	Y	85.8	Confident	94.3	Very high	17 Å²	17	29.7 Å²	29.7	7%	0.067	15%	0.147	C	C	.	.	S	Bend	trans	-150.2	137.5	174.1	169.1	-87.6	0	0	0	108.7	E74 Q209 L210 F275 H297	E74-Y241 WeakPolarHBondContact OE2-CE2 3.27Å; E74-Y241 PolarHBondContact OE2-OH 2.99Å; Q209-Y241 VanDerWaalsContact CD-CE1 3.49Å; Q209-Y241 HydrophobicContact CG-CE1 4.13Å; Q209-Y241 PolarHBondContact OE1-OH 3.37Å; L210-Y241 WeakPolarHBondContact CD1-O 3.36Å; Y241-F275 HydrophobicContact CD2-CE2 4.09Å; Y241-H297 VanDerWaalsContact C-CE1 3.42Å; Y241-H297 PolarHBondContact O-CE1 2.91Å; Y241-H297 PolarHBondContact O-NE2 3.41Å
242	P	85.8	Confident	94.3	Very high	8 Å²	8	35 Å²	35	5%	0.052	18%	0.175	C	C	.	.	S	Bend	cis	-72.3	-176.8	-2	30.9	-39.6	0	0	0	114.3	F240 D244 H297 A299	F240-P242 WeakPolarHBondContact CD2-O 3.4Å; P242-D244 PolarHBondContact O-N 2.95Å; P242-H297 PolarHBondContact O-NE2 3.44Å; P242-A299 HydrophobicContact CG-CB 3.67Å
243	K	86.4	Confident	94.2	Very high	101 Å²	101	35.6 Å²	35.6	44%	0.439	19%	0.192	S	C	.	.	S	Bend	trans	-61	-22.9	-175.2	72.3	-177.3	-178.8	-176	0	115.6	I245 V267 F275	K243-I245 PolarHBondContact O-N 2.82Å; K243-V267 HydrophobicContact CB-CG1 4.13Å; K243-F275 HydrophobicContact CB-CD1 3.99Å; K243-F275 HydrophobicContact CB-CD2 3.9Å; K243-F275 HydrophobicContact CB-CE1 3.89Å; K243-F275 HydrophobicContact CB-CE2 3.81Å; K243-F275 HydrophobicContact CB-CG 4Å; K243-F275 HydrophobicContact CB-CZ 3.81Å
244	D	88.2	Confident	94.2	Very high	97 Å²	97	41.4 Å²	41.4	52%	0.519	21%	0.214	S	C	.	.			trans	-77.4	111.7	-170.9	-68.9	-25.7	0	0	0	110.9	P242 H297 P298	P242-D244 PolarHBondContact O-N 2.95Å; D244-H297 PolarHBondContact O-CD2 2.82Å; D244-P298 WeakPolarHBondContact O-CD 3.49Å
245	I	93.6	Very high	94.2	Very high	15 Å²	15	44.5 Å²	44.5	8%	0.077	23%	0.23	C	C	.	.			trans	-142.8	148.3	-175.6	-161.7	163.6	0	0	0	111.9	A237 F240 K243 V267 R277 V295 H297	A237-I245 HydrophobicContact CB-CD1 4.17Å; F240-I245 HydrophobicContact CB-CD1 4.2Å; F240-I245 HydrophobicContact CD1-CD1 3.46Å; F240-I245 VanDerWaalsContact CD1-CD1 3.46Å; F240-I245 HydrophobicContact CD2-CB 4.09Å; F240-I245 HydrophobicContact CD2-CD1 3.67Å; F240-I245 HydrophobicContact CD2-CG1 4.45Å; F240-I245 HydrophobicContact CD2-CG2 4.41Å; F240-I245 HydrophobicContact CE1-CD1 3.59Å; F240-I245 HydrophobicContact CE1-CG2 4.4Å; F240-I245 HydrophobicContact CE2-CB 3.74Å; F240-I245 HydrophobicContact CE2-CD1 3.79Å; F240-I245 HydrophobicContact CE2-CG1 4.41Å; F240-I245 HydrophobicContact CE2-CG2 3.58Å; F240-I245 HydrophobicContact CG-CD1 3.51Å; F240-I245 HydrophobicContact CZ-CB 4.16Å; F240-I245 HydrophobicContact CZ-CD1 3.77Å; F240-I245 HydrophobicContact CZ-CG2 3.6Å; K243-I245 PolarHBondContact O-N 2.82Å; I245-V267 HydrophobicContact CG2-CG2 4.17Å; I245-R277 PolarHBondContact O-NH1 3.37Å; I245-V295 HydrophobicContact CD1-CG1 3.47Å; I245-V295 VanDerWaalsContact CD1-CG1 3.47Å; I245-V295 HydrophobicContact CG1-CG1 3.86Å; I245-H297 HydrophobicContact CG1-CB 4.47Å
246	I	95.9	Very high	94.2	Very high	72 Å²	72	45.2 Å²	45.2	37%	0.369	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	120.3	171.9	-57.8	169.2	0	0	0	107.6	Q248 V295 I296 P298	I246-Q248 HydrophobicContact CG2-CG 3.99Å; I246-V295 CarbonylContact O-C 3.58Å; I246-V295 WeakPolarHBondContact O-CA 3.2Å; I246-I296 HydrophobicContact CB-CB 4.17Å; I246-I296 PolarHBondContact N-O 3.07Å; I246-I296 PolarHBondContact O-N 3.29Å; I246-P298 HydrophobicContact CD1-CG 4.32Å
247	L	97.4	Very high	94.2	Very high	9 Å²	9	46.8 Å²	46.8	5%	0.047	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	127	175.6	-169.5	168.2	0	0	0	108.2	C235 A237 I249 R277 D279 V295	C235-L247 HydrophobicContact CB-CD2 4Å; A237-L247 HydrophobicContact CB-CD1 4.06Å; L247-I249 HydrophobicContact CD2-CG1 4.35Å; L247-R277 HydrophobicContact CD1-CB 4.45Å; L247-R277 HydrophobicContact CD1-CG 4.11Å; L247-D279 HydrophobicContact CD2-CB 3.68Å; L247-V295 HydrophobicContact CG-CG2 4.12Å
248	Q	97.6	Very high	94.1	Very high	48 Å²	48	54.9 Å²	54.9	22%	0.224	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	121.7	-176.6	-64.7	178	-0.3	0	0	110.8	I246 I255 C293 E294	I246-Q248 HydrophobicContact CG2-CG 3.99Å; Q248-I255 HydrophobicContact CB-CG2 4.34Å; Q248-I255 HydrophobicContact CG-CG2 4.33Å; Q248-I255 VanDerWaalsContact OE1-CD1 3.24Å; Q248-C293 CarbonylContact O-C 3.54Å; Q248-C293 WeakPolarHBondContact O-CA 3.36Å; Q248-E294 PolarHBondContact N-O 3.47Å; Q248-E294 PolarHBondContact O-N 3.48Å; Q248-E294 PolarHBondContact OE1-OE1 3.45Å
249	I	98	Very high	94	Very high	2 Å²	2	61.6 Å²	61.6	1%	0.01	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	130.7	167.1	-59.3	175.5	0	0	0	107.9	L233 C235 L247 L256 I262 D279 V281 Y291 T292	L233-I249 HydrophobicContact CD2-CG2 4.15Å; C235-I249 HydrophobicContact CB-CD1 4.06Å; C235-I249 HydrophobicContact CB-CG1 3.98Å; L247-I249 HydrophobicContact CD2-CG1 4.35Å; I249-L256 HydrophobicContact CB-CD1 4.44Å; I249-L256 HydrophobicContact CG2-CD1 3.87Å; I249-L256 WeakPolarHBondContact O-CB 3.45Å; I249-L256 PolarHBondContact O-N 3.34Å; I249-I262 HydrophobicContact CB-CD1 4.08Å; I249-I262 HydrophobicContact CD1-CD1 3.94Å; I249-I262 HydrophobicContact CG1-CD1 4.39Å; I249-D279 HydrophobicContact CD1-CB 4.35Å; I249-D279 WeakPolarHBondContact CD1-O 3.39Å; I249-V281 HydrophobicContact CD1-CG1 4.42Å; I249-V281 HydrophobicContact CG2-CG1 4.44Å; I249-Y291 HydrophobicContact CG2-CD1 4.33Å; I249-T292 CarbonylContact C-O 3.55Å; I249-T292 WeakPolarHBondContact CA-O 3.3Å
250	K	98	Very high	94.2	Very high	28 Å²	28	63.2 Å²	63.2	12%	0.122	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	140.5	179.1	-56.5	179.5	-176.2	176.3	0	110.5	R254 I255 Y291 T292 E294	K250-R254 CarbonylContact C-O 3.49Å; K250-R254 WeakPolarHBondContact CA-O 3.47Å; K250-I255 HydrophobicContact CD-CG1 4.3Å; K250-I255 HydrophobicContact CG-CG1 4.01Å; K250-Y291 CarbonylContact O-C 3.54Å; K250-Y291 VanDerWaalsContact O-CA 3.28Å; K250-Y291 WeakPolarHBondContact O-CA 3.29Å; K250-T292 PolarHBondContact N-O 3.4Å; K250-T292 PolarHBondContact O-N 3.16Å; K250-E294 WeakPolarHBondContact CE-OE1 3.44Å; K250-E294 IonicContact NZ-OE1 2.84Å; K250-E294 PolarHBondContact NZ-OE1 3.25Å; K250-E294 IonicContact NZ-OE2 2.98Å; K250-E294 PolarHBondContact NZ-OE2 2.78Å
251	R	97.1	Very high	94.5	Very high	98 Å²	98	65 Å²	65	37%	0.37	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	115	171.5	-175	-176.7	-176.7	-166.9	-4.2	108.7	G253 R254 L256 D287 A289 Y291	R251-G253 PolarHBondContact O-N 3.27Å; R251-R254 PolarHBondContact N-O 2.97Å; R251-R254 WeakPolarHBondContact O-CB 3.32Å; R251-R254 PolarHBondContact O-N 2.79Å; R251-L256 HydrophobicContact CB-CD2 3.9Å; R251-L256 HydrophobicContact CB-CG 4.38Å; R251-D287 IonicContact CZ-OD1 3.65Å; R251-D287 IonicContact CZ-OD2 2.65Å; R251-D287 IonicContact NE-OD1 2.79Å; R251-D287 IonicContact NE-OD2 3.78Å; R251-D287 PolarHBondContact NE-OD2 3.36Å; R251-D287 IonicContact NH1-OD2 3.21Å; R251-D287 IonicContact NH2-OD1 3.16Å; R251-D287 PolarHBondContact NH2-OD1 3.24Å; R251-D287 IonicContact NH2-OD2 2.78Å; R251-D287 PolarHBondContact NH2-OD2 3.42Å; R251-A289 HydrophobicContact CG-CB 3.48Å; R251-A289 VanDerWaalsContact CG-CB 3.48Å; R251-Y291 HydrophobicContact CB-CD1 4.1Å; R251-Y291 HydrophobicContact CB-CE1 3.71Å; R251-Y291 WeakPolarHBondContact CD-OH 3.38Å; R251-Y291 HydrophobicContact CG-CD1 4.34Å; R251-Y291 HydrophobicContact CG-CE1 3.72Å; R251-Y291 HydrophobicContact CG-CE2 4.23Å; R251-Y291 PolarHBondContact NE-OH 3.31Å
252	N	95.1	Very high	95	Very high	115 Å²	115	65.5 Å²	65.5	62%	0.615	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.5	38.4	-172.2	-66.8	-25.3	0	0	0	112.9	R254 A290	N252-R254 VanDerWaalsContact C-N 3.29Å; N252-R254 PolarHBondContact O-N 3.16Å; N252-A290 PolarHBondContact N-O 3.19Å; N252-A290 PolarHBondContact OD1-N 2.95Å
253	G	93.8	Very high	95.5	Very high	57 Å²	57	71 Å²	71	59%	0.588	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.5	-13.6	-178.5	0	0	0	0	0	115.7	R251	R251-G253 PolarHBondContact O-N 3.27Å
254	R	97.1	Very high	96	Very high	122 Å²	122	69.5 Å²	69.5	46%	0.46	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	126.1	173	-173.5	-174.6	70.5	90.4	-13.1	110.4	K250 R251 N252 L256 D260	K250-R254 CarbonylContact C-O 3.49Å; K250-R254 WeakPolarHBondContact CA-O 3.47Å; R251-R254 PolarHBondContact N-O 2.97Å; R251-R254 WeakPolarHBondContact O-CB 3.32Å; R251-R254 PolarHBondContact O-N 2.79Å; N252-R254 VanDerWaalsContact C-N 3.29Å; N252-R254 PolarHBondContact O-N 3.16Å; R254-L256 PolarHBondContact O-N 3.14Å; R254-D260 IonicContact CZ-OD1 3.83Å; R254-D260 IonicContact CZ-OD2 3.83Å; R254-D260 IonicContact NH1-OD1 3.5Å; R254-D260 PolarHBondContact NH1-OD1 3.35Å; R254-D260 IonicContact NH1-OD2 3.46Å; R254-D260 PolarHBondContact NH1-OD2 3.34Å; R254-D260 IonicContact NH2-OD1 3.59Å; R254-D260 PolarHBondContact NH2-OD1 2.87Å; R254-D260 IonicContact NH2-OD2 3.67Å
255	I	97.7	Very high	96.3	Very high	74 Å²	74	67.3 Å²	67.3	38%	0.379	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	130.1	174.2	-61.8	163.8	0	0	0	109.5	Q248 K250	Q248-I255 HydrophobicContact CB-CG2 4.34Å; Q248-I255 HydrophobicContact CG-CG2 4.33Å; Q248-I255 VanDerWaalsContact OE1-CD1 3.24Å; K250-I255 HydrophobicContact CD-CG1 4.3Å; K250-I255 HydrophobicContact CG-CG1 4.01Å
256	L	97.3	Very high	96.3	Very high	16 Å²	16	68 Å²	68	8%	0.084	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-82.7	145.5	172.8	-58.9	-175.8	0	0	0	110.6	I249 R251 R254 D260 I262 V281 Y291	I249-L256 HydrophobicContact CB-CD1 4.44Å; I249-L256 HydrophobicContact CG2-CD1 3.87Å; I249-L256 WeakPolarHBondContact O-CB 3.45Å; I249-L256 PolarHBondContact O-N 3.34Å; R251-L256 HydrophobicContact CB-CD2 3.9Å; R251-L256 HydrophobicContact CB-CG 4.38Å; R254-L256 PolarHBondContact O-N 3.14Å; L256-D260 WeakPolarHBondContact CA-OD2 3.31Å; L256-D260 HydrophobicContact CB-CB 4.12Å; L256-D260 HydrophobicContact CD2-CB 4.09Å; L256-I262 HydrophobicContact CB-CD1 3.83Å; L256-I262 HydrophobicContact CB-CG1 3.66Å; L256-I262 HydrophobicContact CD1-CD1 4.28Å; L256-V281 HydrophobicContact CD1-CG1 3.97Å; L256-V281 HydrophobicContact CD1-CG2 4.44Å; L256-Y291 HydrophobicContact CD1-CE1 4.15Å
257	T	96.4	Very high	96.2	Very high	57 Å²	57	67.2 Å²	67.2	35%	0.35	36%	0.362	S	S	.	.			trans	-123.6	-179.7	-172.9	58.4	0	0	0	0	111	E259 D260 I262	T257-E259 VanDerWaalsContact CB-OE2 3.25Å; T257-E259 WeakPolarHBondContact CB-OE2 3.03Å; T257-E259 PolarHBondContact O-N 3.38Å; T257-E259 PolarHBondContact OG1-OE2 3.01Å; T257-D260 PolarHBondContact N-OD2 3.28Å; T257-D260 WeakPolarHBondContact O-CB 3.41Å; T257-D260 PolarHBondContact O-N 3.1Å; T257-D260 VanDerWaalsContact O-N 3.07Å; T257-D260 PolarHBondContact OG1-OD2 3.5Å; T257-I262 WeakPolarHBondContact O-CB 3.32Å; T257-I262 VanDerWaalsContact O-CG1 3.31Å; T257-I262 WeakPolarHBondContact O-CG1 3.49Å; T257-I262 PolarHBondContact O-N 3.35Å
258	K	95.1	Very high	96	Very high	171 Å²	171	70.7 Å²	70.7	74%	0.743	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-62.6	-32.9	175.5	-72.5	-173.9	179	-178.8	0	111.6	D260 G261	K258-D260 PolarHBondContact O-N 3.08Å; K258-G261 PolarHBondContact O-N 3.47Å
259	E	95.5	Very high	95.7	Very high	167 Å²	167	72.9 Å²	72.9	78%	0.78	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-64.5	-27	174.8	-63.6	81.8	-174.1	0	0	112.4	T257 G261	T257-E259 VanDerWaalsContact CB-OE2 3.25Å; T257-E259 WeakPolarHBondContact CB-OE2 3.03Å; T257-E259 PolarHBondContact O-N 3.38Å; T257-E259 PolarHBondContact OG1-OE2 3.01Å; E259-G261 PolarHBondContact O-N 2.86Å
260	D	95.6	Very high	95.2	Very high	53 Å²	53	74.4 Å²	74.4	28%	0.283	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-81	2.2	174.3	-60.3	-68.2	0	0	0	113.1	R254 L256 T257 K258 V281	R254-D260 IonicContact CZ-OD1 3.83Å; R254-D260 IonicContact CZ-OD2 3.83Å; R254-D260 IonicContact NH1-OD1 3.5Å; R254-D260 PolarHBondContact NH1-OD1 3.35Å; R254-D260 IonicContact NH1-OD2 3.46Å; R254-D260 PolarHBondContact NH1-OD2 3.34Å; R254-D260 IonicContact NH2-OD1 3.59Å; R254-D260 PolarHBondContact NH2-OD1 2.87Å; R254-D260 IonicContact NH2-OD2 3.67Å; L256-D260 WeakPolarHBondContact CA-OD2 3.31Å; L256-D260 HydrophobicContact CB-CB 4.12Å; L256-D260 HydrophobicContact CD2-CB 4.09Å; T257-D260 PolarHBondContact N-OD2 3.28Å; T257-D260 WeakPolarHBondContact O-CB 3.41Å; T257-D260 PolarHBondContact O-N 3.1Å; T257-D260 VanDerWaalsContact O-N 3.07Å; T257-D260 PolarHBondContact OG1-OD2 3.5Å; K258-D260 PolarHBondContact O-N 3.08Å; D260-V281 WeakPolarHBondContact O-CG2 3.34Å
261	G	96.1	Very high	94.6	Very high	39 Å²	39	83 Å²	83	40%	0.402	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	87	16	-179.5	0	0	0	0	0	114.8	K258 E259 Q263	K258-G261 PolarHBondContact O-N 3.47Å; E259-G261 PolarHBondContact O-N 2.86Å; G261-Q263 PolarHBondContact O-N 3.01Å
262	I	97.6	Very high	93.8	Very high	27 Å²	27	83.2 Å²	83.2	14%	0.138	46%	0.455	C	S	.	.			trans	-63.7	127.2	174	-68.2	-79.3	0	0	0	110.3	I249 L256 T257 H280 V281	I249-I262 HydrophobicContact CB-CD1 4.08Å; I249-I262 HydrophobicContact CD1-CD1 3.94Å; I249-I262 HydrophobicContact CG1-CD1 4.39Å; L256-I262 HydrophobicContact CB-CD1 3.83Å; L256-I262 HydrophobicContact CB-CG1 3.66Å; L256-I262 HydrophobicContact CD1-CD1 4.28Å; T257-I262 WeakPolarHBondContact O-CB 3.32Å; T257-I262 VanDerWaalsContact O-CG1 3.31Å; T257-I262 WeakPolarHBondContact O-CG1 3.49Å; T257-I262 PolarHBondContact O-N 3.35Å; I262-H280 WeakPolarHBondContact CA-O 3.26Å; I262-V281 HydrophobicContact CD1-CB 3.78Å; I262-V281 HydrophobicContact CD1-CG1 4.1Å; I262-V281 HydrophobicContact CG1-CB 4.5Å
263	Q	96.8	Very high	93	Very high	122 Å²	122	82.2 Å²	82.2	57%	0.57	45%	0.45	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.2	144.7	170.2	-65.1	-178.2	1.4	0	0	109.2	G261 D279 H280	G261-Q263 PolarHBondContact O-N 3.01Å; Q263-D279 CarbonylContact O-C 3.58Å; Q263-D279 VanDerWaalsContact O-CA 3.26Å; Q263-D279 WeakPolarHBondContact O-CA 3.4Å; Q263-H280 WeakPolarHBondContact CB-NE2 3.32Å; Q263-H280 PolarHBondContact N-O 2.65Å; Q263-H280 PolarHBondContact O-N 2.64Å; Q263-H280 PolarHBondContact OE1-NE2 2.96Å
264	T	96.7	Very high	92.7	Very high	70 Å²	70	80.6 Å²	80.6	43%	0.429	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	141.8	-179	-175.8	0	0	0	0	110.4	G266 R277 K278 D279	T264-G266 PolarHBondContact O-N 3.14Å; T264-G266 PolarHBondContact OG1-N 3.27Å; T264-G266 VanDerWaalsContact OG1-N 3.13Å; T264-R277 PolarHBondContact OG1-NE 3.04Å; T264-K278 CarbonylContact C-O 3.58Å; T264-K278 WeakPolarHBondContact CA-O 3.36Å; T264-D279 WeakPolarHBondContact CB-OD1 3.26Å; T264-D279 PolarHBondContact OG1-OD1 3.04Å
265	S	93.9	Very high	92.5	Very high	51 Å²	51	77 Å²	77	36%	0.357	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	-13	168.6	64	0	0	0	0	112.9	K278	S265-K278 PolarHBondContact N-O 3.18Å; S265-K278 PolarHBondContact OG-N 2.85Å; S265-K278 PolarHBondContact OG-O 2.85Å
266	G	94	Very high	92.4	Very high	29 Å²	29	75.7 Å²	75.7	30%	0.299	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	68	-177	-157.6	0	0	0	0	0	111.5	T264	T264-G266 PolarHBondContact O-N 3.14Å; T264-G266 PolarHBondContact OG1-N 3.27Å; T264-G266 VanDerWaalsContact OG1-N 3.13Å
267	V	93.3	Very high	92.4	Very high	57 Å²	57	77.2 Å²	77.2	35%	0.345	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	129.8	175.8	-177.9	0	0	0	0	108.9	F240 K243 I245 F275 Q276 R277	F240-V267 HydrophobicContact CE2-CG1 4.19Å; F240-V267 HydrophobicContact CZ-CG1 4.18Å; K243-V267 HydrophobicContact CB-CG1 4.13Å; I245-V267 HydrophobicContact CG2-CG2 4.17Å; V267-F275 HydrophobicContact CG1-CB 3.66Å; V267-F275 HydrophobicContact CG1-CD1 3.7Å; V267-F275 HydrophobicContact CG1-CG 3.91Å; V267-Q276 WeakPolarHBondContact CA-O 3.45Å; V267-R277 HydrophobicContact CG2-CB 4.46Å
268	L	93.4	Very high	92.4	Very high	82 Å²	82	77.8 Å²	77.8	43%	0.429	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	144.7	179.7	-61.2	173.6	0	0	0	109.4	F275 Q276	L268-F275 CarbonylContact O-C 3.56Å; L268-F275 WeakPolarHBondContact O-CA 3.35Å; L268-Q276 HydrophobicContact CB-CG 4.09Å; L268-Q276 PolarHBondContact N-O 3.22Å; L268-Q276 PolarHBondContact O-N 3.11Å
269	P	90.7	Very high	92.6	Very high	94 Å²	94	69.9 Å²	69.9	61%	0.61	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.1	152.4	174.9	31.3	-34.6	0	0	0	111.8	F275	P269-F275 HydrophobicContact CB-CD1 4.48Å; P269-F275 HydrophobicContact CB-CE1 4.42Å
270	N	88.6	Confident	92.7	Very high	34 Å²	34	64.4 Å²	64.4	18%	0.182	35%	0.352	C	S	.	.			trans	-99.4	175.8	164.9	-67.3	-32.8	0	0	0	110.3	T238 D272 T274 F275 Q276	T238-N270 PolarHBondContact OG1-ND2 2.8Å; T238-N270 VanDerWaalsContact OG1-ND2 3.14Å; N270-D272 VanDerWaalsContact C-N 3.26Å; N270-D272 WeakPolarHBondContact CB-OD1 3.42Å; N270-D272 PolarHBondContact O-N 3.42Å; N270-T274 WeakPolarHBondContact CB-O 3.47Å; N270-T274 PolarHBondContact N-O 2.99Å; N270-T274 PolarHBondContact ND2-OG1 3.45Å; N270-F275 PolarHBondContact ND2-O 3.39Å; N270-Q276 VanDerWaalsContact OD1-CD 3.31Å; N270-Q276 WeakPolarHBondContact OD1-CG 3.31Å; N270-Q276 PolarHBondContact OD1-NE2 3.37Å
271	E	85.3	Confident	92.8	Very high	208 Å²	208	62.1 Å²	62.1	97%	0.972	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-9.4	175.8	-65.5	-176.3	177.1	0	0	113.5
272	D	80.6	Confident	92.8	Very high	102 Å²	102	65 Å²	65	55%	0.545	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.9	30.7	-174.7	68.9	-17.1	0	0	0	113.2	N270 T274	N270-D272 VanDerWaalsContact C-N 3.26Å; N270-D272 WeakPolarHBondContact CB-OD1 3.42Å; N270-D272 PolarHBondContact O-N 3.42Å; D272-T274 PolarHBondContact O-N 2.95Å; D272-T274 PolarHBondContact OD1-OG1 2.74Å
273	D	76.6	Confident	92.7	Very high	94 Å²	94	64.2 Å²	64.2	50%	0.503	34%	0.338	S	S	.	.	S	Bend	trans	58.8	12.5	179.9	-58	-53.3	0	0	0	115.1	D75	D75-D273 WeakPolarHBondContact OD1-CB 3.07Å
274	T	88.3	Confident	92.6	Very high	23 Å²	23	62.8 Å²	62.8	14%	0.141	33%	0.334	C	S	.	.			trans	-98.3	174.6	169.9	72.7	0	0	0	0	111.1	G239 N270 D272	G239-T274 WeakPolarHBondContact CA-OG1 3.21Å; N270-T274 WeakPolarHBondContact CB-O 3.47Å; N270-T274 PolarHBondContact N-O 2.99Å; N270-T274 PolarHBondContact ND2-OG1 3.45Å; D272-T274 PolarHBondContact O-N 2.95Å; D272-T274 PolarHBondContact OD1-OG1 2.74Å
275	F	92.5	Very high	92.3	Very high	48 Å²	48	64.5 Å²	64.5	21%	0.211	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	159.2	179.5	-62.1	-85.4	0	0	0	112	T238 G239 F240 Y241 K243 V267 L268 P269 N270	T238-F275 CarbonylContact C-O 3.59Å; T238-F275 WeakPolarHBondContact CA-O 3.18Å; G239-F275 PolarHBondContact N-O 3.29Å; F240-F275 VanDerWaalsContact CD1-O 3.25Å; F240-F275 WeakPolarHBondContact CD1-O 3.48Å; F240-F275 HydrophobicContact CD2-CB 3.92Å; F240-F275 HydrophobicContact CE1-CB 4.36Å; F240-F275 VanDerWaalsContact CE1-O 3.23Å; F240-F275 WeakPolarHBondContact CE1-O 3.45Å; F240-F275 HydrophobicContact CE2-CB 3.46Å; F240-F275 VanDerWaalsContact CE2-CB 3.46Å; F240-F275 HydrophobicContact CE2-CG 4.44Å; F240-F275 HydrophobicContact CZ-CB 3.7Å; F240-F275 PolarHBondContact N-O 3.2Å; F240-F275 PolarHBondContact O-N 3.15Å; Y241-F275 HydrophobicContact CD2-CE2 4.09Å; K243-F275 HydrophobicContact CB-CD1 3.99Å; K243-F275 HydrophobicContact CB-CD2 3.9Å; K243-F275 HydrophobicContact CB-CE1 3.89Å; K243-F275 HydrophobicContact CB-CE2 3.81Å; K243-F275 HydrophobicContact CB-CG 4Å; K243-F275 HydrophobicContact CB-CZ 3.81Å; V267-F275 HydrophobicContact CG1-CB 3.66Å; V267-F275 HydrophobicContact CG1-CD1 3.7Å; V267-F275 HydrophobicContact CG1-CG 3.91Å; L268-F275 CarbonylContact O-C 3.56Å; L268-F275 WeakPolarHBondContact O-CA 3.35Å; P269-F275 HydrophobicContact CB-CD1 4.48Å; P269-F275 HydrophobicContact CB-CE1 4.42Å; N270-F275 PolarHBondContact ND2-O 3.39Å
276	Q	96.3	Very high	92.1	Very high	45 Å²	45	67 Å²	67	21%	0.21	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	153.5	170.3	67.8	178	-62.4	0	0	111.5	L236 A237 V267 L268 N270	L236-Q276 HydrophobicContact CD1-CB 4.25Å; A237-Q276 CarbonylContact O-C 3.48Å; A237-Q276 WeakPolarHBondContact O-CA 3.29Å; V267-Q276 WeakPolarHBondContact CA-O 3.45Å; L268-Q276 HydrophobicContact CB-CG 4.09Å; L268-Q276 PolarHBondContact N-O 3.22Å; L268-Q276 PolarHBondContact O-N 3.11Å; N270-Q276 VanDerWaalsContact OD1-CD 3.31Å; N270-Q276 WeakPolarHBondContact OD1-CG 3.31Å; N270-Q276 PolarHBondContact OD1-NE2 3.37Å
277	R	97.3	Very high	91.9	Very high	48 Å²	48	66.7 Å²	66.7	18%	0.181	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	138	173.3	175.4	176	168	176.5	-4	110	L236 A237 F240 I245 L247 T264 V267 D279	L236-R277 WeakPolarHBondContact CA-O 3.32Å; A237-R277 PolarHBondContact N-O 3.47Å; A237-R277 PolarHBondContact O-N 2.74Å; F240-R277 HydrophobicContact CZ-CB 4.22Å; I245-R277 PolarHBondContact O-NH1 3.37Å; L247-R277 HydrophobicContact CD1-CB 4.45Å; L247-R277 HydrophobicContact CD1-CG 4.11Å; T264-R277 PolarHBondContact OG1-NE 3.04Å; V267-R277 HydrophobicContact CG2-CB 4.46Å; R277-D279 IonicContact CZ-OD1 3.63Å; R277-D279 IonicContact CZ-OD2 3.45Å; R277-D279 IonicContact NE-OD1 3.32Å; R277-D279 PolarHBondContact NE-OD1 3.34Å; R277-D279 IonicContact NE-OD2 2.87Å; R277-D279 PolarHBondContact NE-OD2 3.09Å; R277-D279 IonicContact NH2-OD1 3.33Å; R277-D279 PolarHBondContact NH2-OD1 2.9Å; R277-D279 IonicContact NH2-OD2 3.47Å; R277-D279 PolarHBondContact NH2-OD2 2.8Å
278	K	97.2	Very high	91.8	Very high	69 Å²	69	68.4 Å²	68.4	30%	0.3	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	126	175	-66.5	172.3	-172.4	161	0	109.7	C235 L236 T264 S265	C235-K278 VanDerWaalsContact O-CA 3.31Å; C235-K278 WeakPolarHBondContact O-CA 3.44Å; L236-K278 HydrophobicContact CB-CG 4.14Å; L236-K278 HydrophobicContact CD1-CD 4.26Å; L236-K278 HydrophobicContact CD1-CG 3.61Å; L236-K278 HydrophobicContact CG-CG 4.41Å; T264-K278 CarbonylContact C-O 3.58Å; T264-K278 WeakPolarHBondContact CA-O 3.36Å; S265-K278 PolarHBondContact N-O 3.18Å; S265-K278 PolarHBondContact OG-N 2.85Å; S265-K278 PolarHBondContact OG-O 2.85Å
279	D	98	Very high	91.8	Very high	6 Å²	6	64.7 Å²	64.7	3%	0.032	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	140.7	166.5	-65.8	9.8	0	0	0	108.3	C235 L247 I249 Q263 T264 R277	C235-D279 PolarHBondContact N-O 2.94Å; C235-D279 PolarHBondContact O-N 2.97Å; L247-D279 HydrophobicContact CD2-CB 3.68Å; I249-D279 HydrophobicContact CD1-CB 4.35Å; I249-D279 WeakPolarHBondContact CD1-O 3.39Å; Q263-D279 CarbonylContact O-C 3.58Å; Q263-D279 VanDerWaalsContact O-CA 3.26Å; Q263-D279 WeakPolarHBondContact O-CA 3.4Å; T264-D279 WeakPolarHBondContact CB-OD1 3.26Å; T264-D279 PolarHBondContact OG1-OD1 3.04Å; R277-D279 IonicContact CZ-OD1 3.63Å; R277-D279 IonicContact CZ-OD2 3.45Å; R277-D279 IonicContact NE-OD1 3.32Å; R277-D279 PolarHBondContact NE-OD1 3.34Å; R277-D279 IonicContact NE-OD2 2.87Å; R277-D279 PolarHBondContact NE-OD2 3.09Å; R277-D279 IonicContact NH2-OD1 3.33Å; R277-D279 PolarHBondContact NH2-OD1 2.9Å; R277-D279 IonicContact NH2-OD2 3.47Å; R277-D279 PolarHBondContact NH2-OD2 2.8Å
280	H	97.6	Very high	92	Very high	52 Å²	52	62.8 Å²	62.8	24%	0.241	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	156.1	-178.2	63.5	-92.1	0	0	0	112.9	I232 L233 T234 I262 Q263	I232-H280 HydrophobicContact CG2-CB 3.85Å; L233-H280 CarbonylContact O-C 3.56Å; L233-H280 WeakPolarHBondContact O-CA 3.48Å; L233-H280 WeakPolarHBondContact O-CB 3.38Å; T234-H280 HydrophobicContact CG2-CB 4.32Å; I262-H280 WeakPolarHBondContact CA-O 3.26Å; Q263-H280 WeakPolarHBondContact CB-NE2 3.32Å; Q263-H280 PolarHBondContact N-O 2.65Å; Q263-H280 PolarHBondContact O-N 2.64Å; Q263-H280 PolarHBondContact OE1-NE2 2.96Å
281	V	97.5	Very high	92.3	Very high	5 Å²	5	61.4 Å²	61.4	3%	0.03	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	140.7	178.1	58.6	0	0	0	0	109.7	L233 I249 L256 D260 I262 I283	L233-V281 HydrophobicContact CB-CG1 4.27Å; L233-V281 PolarHBondContact N-O 2.82Å; L233-V281 PolarHBondContact O-N 2.83Å; I249-V281 HydrophobicContact CD1-CG1 4.42Å; I249-V281 HydrophobicContact CG2-CG1 4.44Å; L256-V281 HydrophobicContact CD1-CG1 3.97Å; L256-V281 HydrophobicContact CD1-CG2 4.44Å; D260-V281 WeakPolarHBondContact O-CG2 3.34Å; I262-V281 HydrophobicContact CD1-CB 3.78Å; I262-V281 HydrophobicContact CD1-CG1 4.1Å; I262-V281 HydrophobicContact CG1-CB 4.5Å; V281-I283 HydrophobicContact CG1-CG2 3.98Å; V281-I283 HydrophobicContact CG2-CG2 4.28Å
282	E	96.8	Very high	92.9	Very high	99 Å²	99	52.3 Å²	52.3	46%	0.463	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	125.5	173.4	-171	172.8	164.7	0	0	109.8	A225 N230 T231	A225-E282 HydrophobicContact CB-CG 4.2Å; N230-E282 HydrophobicContact CB-CG 3.88Å; N230-E282 WeakPolarHBondContact CB-OE1 3.46Å; N230-E282 PolarHBondContact ND2-OE1 3.03Å; T231-E282 WeakPolarHBondContact O-CA 3.4Å
283	I	95.3	Very high	93.7	Very high	11 Å²	11	47.4 Å²	47.4	6%	0.056	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	158.4	-177.3	65.7	172.2	0	0	0	110.5	N230 T231 L233 V281 Y291 W308	N230-I283 CarbonylContact C-O 3.54Å; N230-I283 VanDerWaalsContact CA-O 3.29Å; N230-I283 WeakPolarHBondContact CA-O 3.44Å; T231-I283 HydrophobicContact CG2-CD1 4.17Å; T231-I283 HydrophobicContact CG2-CG1 3.64Å; T231-I283 PolarHBondContact N-O 3.45Å; T231-I283 PolarHBondContact O-N 3.28Å; L233-I283 HydrophobicContact CB-CD1 3.99Å; L233-I283 HydrophobicContact CB-CG1 4.35Å; L233-I283 HydrophobicContact CD2-CD1 4.34Å; V281-I283 HydrophobicContact CG1-CG2 3.98Å; V281-I283 HydrophobicContact CG2-CG2 4.28Å; I283-Y291 HydrophobicContact CD1-CD2 4.14Å; I283-Y291 HydrophobicContact CD1-CE1 4.49Å; I283-Y291 HydrophobicContact CD1-CE2 3.76Å; I283-Y291 HydrophobicContact CG2-CE1 4Å; I283-Y291 WeakPolarHBondContact CG2-OH 3.3Å; I283-W308 HydrophobicContact CD1-CH2 4.21Å; I283-W308 HydrophobicContact CD1-CZ3 3.9Å
284	L	93.9	Very high	94.8	Very high	92 Å²	92	43.5 Å²	43.5	48%	0.482	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	136.6	172.3	-65.3	174	0	0	0	109.8	N230 S286 D287	N230-L284 WeakPolarHBondContact OD1-CD2 3.44Å; L284-S286 PolarHBondContact O-N 2.95Å; L284-D287 HydrophobicContact CB-CB 4.33Å; L284-D287 WeakPolarHBondContact O-CB 3.02Å; L284-D287 PolarHBondContact O-N 2.89Å
285	K	90.8	Very high	95.2	Very high	106 Å²	106	42.5 Å²	42.5	46%	0.461	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-26.7	173	-70.1	178.9	-179.9	170	0	112.7	D228 T229 N230 T231 D287	D228-K285 WeakPolarHBondContact O-CD 3.36Å; D228-K285 VanDerWaalsContact O-CE 3.23Å; D228-K285 WeakPolarHBondContact O-CE 3.46Å; D228-K285 PolarHBondContact O-NZ 3.16Å; T229-K285 PolarHBondContact O-N 3.22Å; N230-K285 VanDerWaalsContact O-CE 3.23Å; N230-K285 WeakPolarHBondContact O-CE 3.23Å; T231-K285 HydrophobicContact CG2-CG 4.27Å; K285-D287 VanDerWaalsContact C-N 3.29Å
286	S	89.7	Confident	95.3	Very high	103 Å²	103	42.5 Å²	42.5	72%	0.72	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-0.8	178	62.7	0	0	0	0	113.8	L284 A288	L284-S286 PolarHBondContact O-N 2.95Å; S286-A288 PolarHBondContact O-N 3.39Å
287	D	90.9	Very high	95.1	Very high	22 Å²	22	40.5 Å²	40.5	12%	0.118	23%	0.227	C	C	.	.			trans	-70.9	115.3	-179.7	-170.3	3.3	0	0	0	110.7	R251 L284 K285 A289 Y291	R251-D287 IonicContact CZ-OD1 3.65Å; R251-D287 IonicContact CZ-OD2 2.65Å; R251-D287 IonicContact NE-OD1 2.79Å; R251-D287 IonicContact NE-OD2 3.78Å; R251-D287 PolarHBondContact NE-OD2 3.36Å; R251-D287 IonicContact NH1-OD2 3.21Å; R251-D287 IonicContact NH2-OD1 3.16Å; R251-D287 PolarHBondContact NH2-OD1 3.24Å; R251-D287 IonicContact NH2-OD2 2.78Å; R251-D287 PolarHBondContact NH2-OD2 3.42Å; L284-D287 HydrophobicContact CB-CB 4.33Å; L284-D287 WeakPolarHBondContact O-CB 3.02Å; L284-D287 PolarHBondContact O-N 2.89Å; K285-D287 VanDerWaalsContact C-N 3.29Å; D287-A289 VanDerWaalsContact C-N 3.26Å; D287-A289 PolarHBondContact O-N 3.42Å; D287-A289 VanDerWaalsContact OD1-CB 3.26Å; D287-A289 WeakPolarHBondContact OD1-CB 3.28Å; D287-A289 PolarHBondContact OD1-N 2.92Å; D287-A289 VanDerWaalsContact OD1-N 3.09Å; D287-Y291 HydrophobicContact CB-CE2 4.49Å; D287-Y291 WeakPolarHBondContact OD2-CE2 3.02Å; D287-Y291 PolarHBondContact OD2-OH 3.27Å
288	A	89.9	Confident	94.6	Very high	93 Å²	93	41.1 Å²	41.1	77%	0.769	24%	0.238	S	C	*	.			trans	-85.1	4.6	-179.9	0	0	0	0	0	113.4	S286	S286-A288 PolarHBondContact O-N 3.39Å
289	A	93.8	Very high	93.8	Very high	4 Å²	4	39.6 Å²	39.6	3%	0.033	24%	0.238	C	C	.	.			trans	-66.9	143.8	179.9	0	0	0	0	0	112.1	R251 D287 Y291	R251-A289 HydrophobicContact CG-CB 3.48Å; R251-A289 VanDerWaalsContact CG-CB 3.48Å; D287-A289 VanDerWaalsContact C-N 3.26Å; D287-A289 PolarHBondContact O-N 3.42Å; D287-A289 VanDerWaalsContact OD1-CB 3.26Å; D287-A289 WeakPolarHBondContact OD1-CB 3.28Å; D287-A289 PolarHBondContact OD1-N 2.92Å; D287-A289 VanDerWaalsContact OD1-N 3.09Å; A289-Y291 HydrophobicContact CB-CD2 4.48Å; A289-Y291 HydrophobicContact CB-CE2 3.99Å; A289-Y291 WeakPolarHBondContact O-CD2 3.29Å; A289-Y291 PolarHBondContact O-N 2.85Å
290	A	94.4	Very high	93.1	Very high	54 Å²	54	40.8 Å²	40.8	45%	0.446	25%	0.247	S	C	.	.			trans	-75.8	112.5	172.6	0	0	0	0	0	110	N252	N252-A290 PolarHBondContact N-O 3.19Å; N252-A290 PolarHBondContact OD1-N 2.95Å
291	Y	96.7	Very high	92.5	Very high	6 Å²	6	46.5 Å²	46.5	2%	0.024	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	134.4	174.8	-73	-90	0	0	0	111.9	L233 I249 K250 R251 L256 I283 D287 A289 W308	L233-Y291 HydrophobicContact CD2-CD1 3.5Å; L233-Y291 HydrophobicContact CD2-CD2 4.49Å; L233-Y291 HydrophobicContact CD2-CE1 4.25Å; L233-Y291 HydrophobicContact CD2-CG 3.63Å; I249-Y291 HydrophobicContact CG2-CD1 4.33Å; K250-Y291 CarbonylContact O-C 3.54Å; K250-Y291 VanDerWaalsContact O-CA 3.28Å; K250-Y291 WeakPolarHBondContact O-CA 3.29Å; R251-Y291 HydrophobicContact CB-CD1 4.1Å; R251-Y291 HydrophobicContact CB-CE1 3.71Å; R251-Y291 WeakPolarHBondContact CD-OH 3.38Å; R251-Y291 HydrophobicContact CG-CD1 4.34Å; R251-Y291 HydrophobicContact CG-CE1 3.72Å; R251-Y291 HydrophobicContact CG-CE2 4.23Å; R251-Y291 PolarHBondContact NE-OH 3.31Å; L256-Y291 HydrophobicContact CD1-CE1 4.15Å; I283-Y291 HydrophobicContact CD1-CD2 4.14Å; I283-Y291 HydrophobicContact CD1-CE1 4.49Å; I283-Y291 HydrophobicContact CD1-CE2 3.76Å; I283-Y291 HydrophobicContact CG2-CE1 4Å; I283-Y291 WeakPolarHBondContact CG2-OH 3.3Å; D287-Y291 HydrophobicContact CB-CE2 4.49Å; D287-Y291 WeakPolarHBondContact OD2-CE2 3.02Å; D287-Y291 PolarHBondContact OD2-OH 3.27Å; A289-Y291 HydrophobicContact CB-CD2 4.48Å; A289-Y291 HydrophobicContact CB-CE2 3.99Å; A289-Y291 WeakPolarHBondContact O-CD2 3.29Å; A289-Y291 PolarHBondContact O-N 2.85Å; Y291-W308 AromaticContact CD2-CE3 3.96Å; Y291-W308 HydrophobicContact CD2-CE3 3.96Å; Y291-W308 HydrophobicContact CD2-CZ3 4.21Å; Y291-W308 HydrophobicContact CG-CE3 4.45Å; Y291-W308 PolarHBondContact O-N 2.04Å
292	T	97.5	Very high	92.1	Very high	16 Å²	16	48.3 Å²	48.3	10%	0.098	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	152.4	172.6	70.8	0	0	0	0	110.8	I249 K250 K306 K307	I249-T292 CarbonylContact C-O 3.55Å; I249-T292 WeakPolarHBondContact CA-O 3.3Å; K250-T292 PolarHBondContact N-O 3.4Å; K250-T292 PolarHBondContact O-N 3.16Å; T292-K306 CarbonylContact C-O 3.54Å; T292-K306 VanDerWaalsContact CA-O 3.22Å; T292-K306 WeakPolarHBondContact CA-O 3.46Å; T292-K307 HydrophobicContact CG2-CB 4.27Å; T292-K307 HydrophobicContact CG2-CD 4.29Å; T292-K307 HydrophobicContact CG2-CG 3.74Å
293	C	97.8	Very high	92	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	121.5	167.1	-176.3	0	0	0	0	109	L220 C235 Q248 E305 K306	L220-C293 HydrophobicContact CD1-CB 4.15Å; L220-C293 HydrophobicContact CD2-CB 4.05Å; L220-C293 HydrophobicContact CG-CB 4.5Å; C235-C293 HydrophobicContact CB-CB 3.6Å; C235-C293 WeakPolarHBondContact CB-SG 3.38Å; C235-C293 WeakPolarHBondContact SG-CB 3.17Å; C235-C293 CovalentContact SG-SG 2Å; C235-C293 PolarHBondContact SG-SG 3.49Å; Q248-C293 CarbonylContact O-C 3.54Å; Q248-C293 WeakPolarHBondContact O-CA 3.36Å; C293-E305 CarbonylContact O-C 3.59Å; C293-E305 VanDerWaalsContact O-CA 3.31Å; C293-E305 WeakPolarHBondContact O-CA 3.35Å; C293-K306 PolarHBondContact N-O 3.04Å; C293-K306 PolarHBondContact O-N 3.09Å
294	E	97.8	Very high	92	Very high	12 Å²	12	49.2 Å²	49.2	6%	0.056	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	129.4	175.3	-175.2	178.2	76.3	0	0	109.4	Q248 K250 I296 K303	Q248-E294 PolarHBondContact N-O 3.47Å; Q248-E294 PolarHBondContact O-N 3.48Å; Q248-E294 PolarHBondContact OE1-OE1 3.45Å; K250-E294 WeakPolarHBondContact CE-OE1 3.44Å; K250-E294 IonicContact NZ-OE1 2.84Å; K250-E294 PolarHBondContact NZ-OE1 3.25Å; K250-E294 IonicContact NZ-OE2 2.98Å; K250-E294 PolarHBondContact NZ-OE2 2.78Å; E294-I296 HydrophobicContact CG-CG1 4.28Å; E294-K303 WeakPolarHBondContact OE2-CE 3.36Å; E294-K303 IonicContact OE2-NZ 3.88Å; E294-K303 PolarHBondContact OE2-NZ 2.93Å
295	V	97.3	Very high	92.1	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.006	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	123.4	177.9	176.9	0	0	0	0	108.2	P216 V218 A237 I245 I246 L247 K303 V304	P216-V295 HydrophobicContact CG-CG1 4.46Å; V218-V295 HydrophobicContact CB-CG2 4.43Å; V218-V295 HydrophobicContact CG1-CG2 3.88Å; V218-V295 HydrophobicContact CG2-CB 3.88Å; V218-V295 HydrophobicContact CG2-CG1 4.34Å; V218-V295 HydrophobicContact CG2-CG2 3.6Å; A237-V295 HydrophobicContact CB-CG1 4.16Å; A237-V295 HydrophobicContact CB-CG2 3.97Å; I245-V295 HydrophobicContact CD1-CG1 3.47Å; I245-V295 VanDerWaalsContact CD1-CG1 3.47Å; I245-V295 HydrophobicContact CG1-CG1 3.86Å; I246-V295 CarbonylContact O-C 3.58Å; I246-V295 WeakPolarHBondContact O-CA 3.2Å; L247-V295 HydrophobicContact CG-CG2 4.12Å; V295-K303 CarbonylContact O-C 3.55Å; V295-K303 WeakPolarHBondContact O-CA 3.48Å; V295-V304 HydrophobicContact CB-CB 4.48Å; V295-V304 PolarHBondContact N-O 3.4Å; V295-V304 PolarHBondContact O-N 2.83Å
296	I	95.5	Very high	92.3	Very high	49 Å²	49	48.9 Å²	48.9	25%	0.251	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	122.5	175.8	-56.5	163.2	0	0	0	106.9	I246 E294 P298 M302 K303	I246-I296 HydrophobicContact CB-CB 4.17Å; I246-I296 PolarHBondContact N-O 3.07Å; I246-I296 PolarHBondContact O-N 3.29Å; E294-I296 HydrophobicContact CG-CG1 4.28Å; I296-P298 WeakPolarHBondContact O-CD 3.36Å; I296-M302 WeakPolarHBondContact CA-O 3.45Å; I296-K303 HydrophobicContact CG1-CD 4.45Å; I296-K303 HydrophobicContact CG1-CG 4.16Å
297	H	91.3	Very high	92.6	Very high	2 Å²	2	51.4 Å²	51.4	1%	0.009	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	99	176.6	-176.9	-111	0	0	0	108.2	Y241 P242 D244 I245 A299 S300 H301 M302	Y241-H297 VanDerWaalsContact C-CE1 3.42Å; Y241-H297 PolarHBondContact O-CE1 2.91Å; Y241-H297 PolarHBondContact O-NE2 3.41Å; P242-H297 PolarHBondContact O-NE2 3.44Å; D244-H297 PolarHBondContact O-CD2 2.82Å; I245-H297 HydrophobicContact CG1-CB 4.47Å; H297-A299 VanDerWaalsContact C-N 3.34Å; H297-A299 PolarHBondContact O-N 2.67Å; H297-S300 PolarHBondContact ND1-N 3.48Å; H297-S300 PolarHBondContact ND1-OG 2.75Å; H297-S300 PolarHBondContact O-N 2.95Å; H297-H301 PolarHBondContact O-N 3.49Å; H297-H301 VanDerWaalsContact O-N 3.15Å; H297-M302 HydrophobicContact CB-CB 4.43Å; H297-M302 PolarHBondContact N-O 3.08Å; H297-M302 PolarHBondContact O-N 3.12Å
298	P	86.6	Confident	92.7	Very high	62 Å²	62	51.1 Å²	51.1	40%	0.403	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-41.1	-168.1	-27.1	36.2	0	0	0	113.8	D244 I246 I296 H301	D244-P298 WeakPolarHBondContact O-CD 3.49Å; I246-P298 HydrophobicContact CD1-CG 4.32Å; I296-P298 WeakPolarHBondContact O-CD 3.36Å; P298-H301 PolarHBondContact O-N 3.47Å; P298-H301 PolarHBondContact O-ND1 3.02Å
299	A	81.6	Confident	92.4	Very high	37 Å²	37	51.5 Å²	51.5	31%	0.306	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-48.1	-175.7	0	0	0	0	0	112	L210 P242 H297 H301	L210-A299 HydrophobicContact CD1-CB 3.94Å; L210-A299 HydrophobicContact CD2-CB 3.97Å; L210-A299 WeakPolarHBondContact CD2-O 3.44Å; P242-A299 HydrophobicContact CG-CB 3.67Å; H297-A299 VanDerWaalsContact C-N 3.34Å; H297-A299 PolarHBondContact O-N 2.67Å; A299-H301 VanDerWaalsContact C-N 3.28Å; A299-H301 PolarHBondContact O-N 3.23Å
300	S	83.1	Confident	91.6	Very high	30 Å²	30	55.5 Å²	55.5	21%	0.21	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	5.3	178.1	70.3	0	0	0	0	113.7	H297 M302	H297-S300 PolarHBondContact ND1-N 3.48Å; H297-S300 PolarHBondContact ND1-OG 2.75Å; H297-S300 PolarHBondContact O-N 2.95Å; S300-M302 PolarHBondContact O-N 3.25Å; S300-M302 WeakPolarHBondContact OG-CB 3.44Å; S300-M302 WeakPolarHBondContact OG-CG 3.49Å; S300-M302 PolarHBondContact OG-SD 2.86Å
301	H	84.5	Confident	90.3	Very high	172 Å²	172	57.6 Å²	57.6	80%	0.796	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	24.1	-172.1	-56.7	-62.9	0	0	0	114.4	H297 P298 A299	H297-H301 PolarHBondContact O-N 3.49Å; H297-H301 VanDerWaalsContact O-N 3.15Å; P298-H301 PolarHBondContact O-N 3.47Å; P298-H301 PolarHBondContact O-ND1 3.02Å; A299-H301 VanDerWaalsContact C-N 3.28Å; A299-H301 PolarHBondContact O-N 3.23Å
302	M	89.3	Confident	88.4	Confident	44 Å²	44	60.3 Å²	60.3	22%	0.217	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	137.6	-177.3	-75	178	136.3	0	0	111.6	R215 I296 H297 S300	R215-M302 VanDerWaalsContact CA-CE 3.45Å; R215-M302 HydrophobicContact CB-CE 3.38Å; R215-M302 HydrophobicContact CB-SD 4.08Å; R215-M302 HydrophobicContact CG-CE 3.6Å; R215-M302 HydrophobicContact CG-SD 4.03Å; I296-M302 WeakPolarHBondContact CA-O 3.45Å; H297-M302 HydrophobicContact CB-CB 4.43Å; H297-M302 PolarHBondContact N-O 3.08Å; H297-M302 PolarHBondContact O-N 3.12Å; S300-M302 PolarHBondContact O-N 3.25Å; S300-M302 WeakPolarHBondContact OG-CB 3.44Å; S300-M302 WeakPolarHBondContact OG-CG 3.49Å; S300-M302 PolarHBondContact OG-SD 2.86Å
303	K	94.4	Very high	86.1	Confident	116 Å²	116	64.9 Å²	64.9	50%	0.504	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	122.9	173	-177.5	175.3	179.8	173	0	110.3	R215 E294 V295 I296	R215-K303 PolarHBondContact NH2-O 2.92Å; E294-K303 WeakPolarHBondContact OE2-CE 3.36Å; E294-K303 IonicContact OE2-NZ 3.88Å; E294-K303 PolarHBondContact OE2-NZ 2.93Å; V295-K303 CarbonylContact O-C 3.55Å; V295-K303 WeakPolarHBondContact O-CA 3.48Å; I296-K303 HydrophobicContact CG1-CD 4.45Å; I296-K303 HydrophobicContact CG1-CG 4.16Å
304	V	95.3	Very high	83.6	Confident	13 Å²	13	72.9 Å²	72.9	8%	0.079	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	130.7	179.5	-166.9	0	0	0	0	109.1	R215 P216 V218 V295	R215-V304 HydrophobicContact CG-CG2 3.99Å; P216-V304 HydrophobicContact CG-CG2 4.11Å; V218-V304 HydrophobicContact CB-CG1 4.07Å; V218-V304 HydrophobicContact CG2-CB 3.79Å; V218-V304 HydrophobicContact CG2-CG1 3.7Å; V218-V304 HydrophobicContact CG2-CG2 4.39Å; V295-V304 HydrophobicContact CB-CB 4.48Å; V295-V304 PolarHBondContact N-O 3.4Å; V295-V304 PolarHBondContact O-N 2.83Å
305	E	95.8	Very high	81.1	Confident	89 Å²	89	78 Å²	78	42%	0.416	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	134.5	173.3	-172.3	179.4	105.6	0	0	109.7	C293	C293-E305 CarbonylContact O-C 3.59Å; C293-E305 VanDerWaalsContact O-CA 3.31Å; C293-E305 WeakPolarHBondContact O-CA 3.35Å
306	K	96.2	Very high	78.4	Confident	101 Å²	101	86.8 Å²	86.8	44%	0.439	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	133.4	171.8	-75	-68.8	-172.1	174.4	0	109.9	V218 L220 T292 C293	V218-K306 HydrophobicContact CB-CG 3.9Å; V218-K306 HydrophobicContact CG1-CB 4.16Å; V218-K306 HydrophobicContact CG1-CG 3.82Å; V218-K306 WeakPolarHBondContact O-CE 3.17Å; V218-K306 WeakPolarHBondContact O-CG 3.3Å; L220-K306 HydrophobicContact CB-CB 4.24Å; L220-K306 WeakPolarHBondContact CD2-O 3.46Å; T292-K306 CarbonylContact C-O 3.54Å; T292-K306 VanDerWaalsContact CA-O 3.22Å; T292-K306 WeakPolarHBondContact CA-O 3.46Å; C293-K306 PolarHBondContact N-O 3.04Å; C293-K306 PolarHBondContact O-N 3.09Å
307	K	95.4	Very high	75.8	Confident	156 Å²	156	92.1 Å²	92.1	68%	0.678	46%	0.46	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.9	141.7	174.7	-54.8	-165.3	174.4	176.5	0	109	T292 D309	T292-K307 HydrophobicContact CG2-CB 4.27Å; T292-K307 HydrophobicContact CG2-CD 4.29Å; T292-K307 HydrophobicContact CG2-CG 3.74Å; K307-D309 PolarHBondContact O-N 3.31Å
308	W	92.8	Very high	73.4	Confident	16 Å²	16	102.6 Å²	102.6	6%	0.061	50%	0.499	C	S	.	.			trans	-76.4	125.1	175.2	-176.8	40	0	0	0	109.1	L220 T222 L233 I283 Y291 H310	L220-W308 HydrophobicContact CD2-CB 3.73Å; L220-W308 HydrophobicContact CG-CB 4.05Å; T222-W308 HydrophobicContact CG2-CH2 4.28Å; T222-W308 HydrophobicContact CG2-CZ2 3.41Å; T222-W308 VanDerWaalsContact CG2-CZ2 3.41Å; L233-W308 HydrophobicContact CD1-CB 4.36Å; L233-W308 HydrophobicContact CD1-CD2 3.88Å; L233-W308 HydrophobicContact CD1-CE3 4.41Å; L233-W308 HydrophobicContact CD1-CG 3.84Å; I283-W308 HydrophobicContact CD1-CH2 4.21Å; I283-W308 HydrophobicContact CD1-CZ3 3.9Å; Y291-W308 AromaticContact CD2-CE3 3.96Å; Y291-W308 HydrophobicContact CD2-CE3 3.96Å; Y291-W308 HydrophobicContact CD2-CZ3 4.21Å; Y291-W308 HydrophobicContact CG-CE3 4.45Å; Y291-W308 PolarHBondContact O-N 2.04Å; W308-H310 AromaticContact CE3-CE1 3.99Å; W308-H310 AromaticContact CZ3-CD2 3.86Å; W308-H310 PolarHBondContact O-N 2.96Å; W308-H310 PolarHBondContact O-ND1 2.93Å
309	D	83.4	Confident	71.2	Confident	101 Å²	101	104.3 Å²	104.3	54%	0.54	51%	0.51	S	S	.	.			trans	-82.3	4.6	-176.6	64.7	-12.7	0	0	0	113.3	K307 N311	K307-D309 PolarHBondContact O-N 3.31Å; D309-N311 PolarHBondContact O-N 3.24Å; D309-N311 PolarHBondContact OD1-N 3.48Å; D309-N311 VanDerWaalsContact OD1-N 3.16Å; D309-N311 PolarHBondContact OD2-ND2 3.49Å
310	H	77	Confident	69.7	Low	89 Å²	89	107.7 Å²	107.7	41%	0.412	52%	0.524	S	S	.	.			trans	59.7	9.5	-175.6	-64.6	60.8	0	0	0	114.1	W308 C312	W308-H310 AromaticContact CE3-CE1 3.99Å; W308-H310 AromaticContact CZ3-CD2 3.86Å; W308-H310 PolarHBondContact O-N 2.96Å; W308-H310 PolarHBondContact O-ND1 2.93Å; H310-C312 PolarHBondContact O-N 3.28Å; H310-C312 VanDerWaalsContact O-N 3.09Å
311	N	66.3	Low	68.4	Low	97 Å²	97	112.3 Å²	112.3	52%	0.519	55%	0.545	S	S	.	.			trans	-73.2	108	167.1	-76.7	-34.6	0	0	0	107.5	D309 N313	D309-N311 PolarHBondContact O-N 3.24Å; D309-N311 PolarHBondContact OD1-N 3.48Å; D309-N311 VanDerWaalsContact OD1-N 3.16Å; D309-N311 PolarHBondContact OD2-ND2 3.49Å; N311-N313 VanDerWaalsContact C-N 3.32Å; N311-N313 PolarHBondContact O-N 3.26Å; N311-N313 VanDerWaalsContact O-N 3.07Å
312	C	56.8	Low	67.1	Low	63 Å²	63	111 Å²	111	43%	0.426	54%	0.542	S	S	.	.			trans	-67.5	102.9	156.6	-64.5	0	0	0	0	104.9	H310 E314	H310-C312 PolarHBondContact O-N 3.28Å; H310-C312 VanDerWaalsContact O-N 3.09Å; C312-E314 PolarHBondContact O-N 3.48Å
313	N	50.4	Low	65.7	Low	113 Å²	113	113.4 Å²	113.4	60%	0.604	55%	0.554	S	S	*	*			trans	-61.9	85.5	161.9	-74.4	-14.1	0	0	0	106.1	N311 D315	N311-N313 VanDerWaalsContact C-N 3.32Å; N311-N313 PolarHBondContact O-N 3.26Å; N311-N313 VanDerWaalsContact O-N 3.07Å; N313-D315 PolarHBondContact O-N 3.42Å
314	E	46	Very low	64.4	Low	168 Å²	168	115.6 Å²	115.6	79%	0.785	56%	0.564	S	S	*	*			trans	-54	116.6	148.9	-67.3	-171.2	159.3	0	0	103.7	C312 E316	C312-E314 PolarHBondContact O-N 3.48Å; E314-E316 PolarHBondContact O-N 3.41Å
315	D	43.3	Very low	63.3	Low	118 Å²	118	119 Å²	119	63%	0.631	59%	0.585	S	S	*	*			trans	-35.3	131.1	170.1	-73.2	-53.9	0	0	0	108.3	N313 Q317	N313-D315 PolarHBondContact O-N 3.42Å; D315-Q317 HydrophobicContact CB-CG 4.32Å; D315-Q317 PolarHBondContact O-N 2.93Å
316	E	41.8	Very low	62.4	Low	187 Å²	187	117.4 Å²	117.4	87%	0.874	59%	0.587	S	S	*	*			trans	-62	61	163.2	-77.2	-172	130.8	0	0	109.3	E314 R318	E314-E316 PolarHBondContact O-N 3.41Å; E316-R318 PolarHBondContact O-N 2.93Å
317	Q	40	Very low	61.6	Low	160 Å²	160	116.4 Å²	116.4	75%	0.748	59%	0.589	S	S	*	*			trans	-74.4	78.8	150.9	-76.3	179.2	-8.1	0	0	105.4	D315 P319	D315-Q317 HydrophobicContact CB-CG 4.32Å; D315-Q317 PolarHBondContact O-N 2.93Å; Q317-P319 VanDerWaalsContact C-CD 3.43Å; Q317-P319 WeakPolarHBondContact O-CD 3.38Å
318	R	40.8	Very low	60.8	Low	222 Å²	222	111.2 Å²	111.2	84%	0.838	57%	0.573	S	S	*	*			trans	-77.3	97.6	142.5	-75.1	-171.7	-175.9	-169.2	3	105.4	E316 N320	E316-R318 PolarHBondContact O-N 2.93Å; R318-N320 VanDerWaalsContact C-N 3.33Å; R318-N320 PolarHBondContact O-N 3Å
319	P	42.1	Very low	60.4	Low	98 Å²	98	116.6 Å²	116.6	64%	0.636	60%	0.6	S	S	*	*			trans	-67.9	98.6	172.1	29.1	-33.3	0	0	0	107.2	Q317 I321	Q317-P319 VanDerWaalsContact C-CD 3.43Å; Q317-P319 WeakPolarHBondContact O-CD 3.38Å; P319-I321 WeakPolarHBondContact O-CG1 3.49Å; P319-I321 PolarHBondContact O-N 3.1Å
320	N	48.7	Very low	60.5	Low	109 Å²	109	117.7 Å²	117.7	58%	0.583	61%	0.605	S	S	*	*			trans	30.5	42.2	147.5	-72.4	-24.8	0	0	0	118.1	R318 I322 I323 F324	R318-N320 VanDerWaalsContact C-N 3.33Å; R318-N320 PolarHBondContact O-N 3Å; N320-I322 PolarHBondContact O-N 3.45Å; N320-I323 HydrophobicContact CB-CB 4.11Å; N320-I323 HydrophobicContact CB-CD1 4.02Å; N320-I323 HydrophobicContact CB-CG1 4.06Å; N320-I323 PolarHBondContact O-N 2.82Å; N320-I323 VanDerWaalsContact O-N 3.1Å; N320-F324 PolarHBondContact O-N 2.96Å; N320-F324 VanDerWaalsContact O-N 3.09Å
321	I	55.7	Low	60.9	Low	127 Å²	127	119.1 Å²	119.1	65%	0.651	62%	0.615	S	S	*	*	H	α-helix	trans	-60.4	-34.7	176.2	-63.4	179.3	0	0	0	108.7	P319 I323 F324 V325	P319-I321 WeakPolarHBondContact O-CG1 3.49Å; P319-I321 PolarHBondContact O-N 3.1Å; I321-I323 PolarHBondContact O-N 3.02Å; I321-F324 PolarHBondContact O-N 2.83Å; I321-V325 HydrophobicContact CG2-CG2 4.17Å; I321-V325 WeakPolarHBondContact O-CB 3.3Å; I321-V325 WeakPolarHBondContact O-CG2 3.27Å; I321-V325 PolarHBondContact O-N 3.23Å
322	I	56.7	Low	61.8	Low	145 Å²	145	122.5 Å²	122.5	74%	0.744	63%	0.626	S	S	*	*	H	α-helix	trans	-64.4	-40.2	178.2	-57.4	176.9	0	0	0	111.6	N320 A326	N320-I322 PolarHBondContact O-N 3.45Å; I322-A326 VanDerWaalsContact O-CB 3.27Å; I322-A326 WeakPolarHBondContact O-CB 3.14Å; I322-A326 PolarHBondContact O-N 2.64Å
323	I	61.5	Low	63.1	Low	93 Å²	93	123.7 Å²	123.7	48%	0.477	63%	0.631	S	S	.	*	H	α-helix	trans	-71.8	-41.3	179	-54.1	-176	0	0	0	110.2	N320 I321 V325 A326 V327	N320-I323 HydrophobicContact CB-CB 4.11Å; N320-I323 HydrophobicContact CB-CD1 4.02Å; N320-I323 HydrophobicContact CB-CG1 4.06Å; N320-I323 PolarHBondContact O-N 2.82Å; N320-I323 VanDerWaalsContact O-N 3.1Å; I321-I323 PolarHBondContact O-N 3.02Å; I323-V325 PolarHBondContact O-N 2.83Å; I323-A326 PolarHBondContact O-N 3.47Å; I323-V327 HydrophobicContact CG2-CG2 4.16Å; I323-V327 WeakPolarHBondContact O-CB 3.28Å; I323-V327 VanDerWaalsContact O-CG2 3.27Å; I323-V327 WeakPolarHBondContact O-CG2 3.27Å; I323-V327 PolarHBondContact O-N 3.05Å
324	F	66.5	Low	64.7	Low	162 Å²	162	122 Å²	122	71%	0.711	62%	0.624	S	S	*	*	H	α-helix	trans	-66.3	-38.4	-179.7	-145.4	-85.9	0	0	0	112.3	N320 I321 S328	N320-F324 PolarHBondContact O-N 2.96Å; N320-F324 VanDerWaalsContact O-N 3.09Å; I321-F324 PolarHBondContact O-N 2.83Å; F324-S328 WeakPolarHBondContact O-CB 3.32Å; F324-S328 PolarHBondContact O-N 3.37Å; F324-S328 PolarHBondContact O-OG 3.17Å
325	V	72.8	Confident	66.4	Low	85 Å²	85	115.6 Å²	115.6	52%	0.515	60%	0.603	S	S	.	*	H	α-helix	trans	-67.7	-43.2	173.9	173.9	0	0	0	0	111.1	I321 I323 S328 M329	I321-V325 HydrophobicContact CG2-CG2 4.17Å; I321-V325 WeakPolarHBondContact O-CB 3.3Å; I321-V325 WeakPolarHBondContact O-CG2 3.27Å; I321-V325 PolarHBondContact O-N 3.23Å; I323-V325 PolarHBondContact O-N 2.83Å; V325-S328 PolarHBondContact O-N 3.45Å; V325-M329 WeakPolarHBondContact O-CB 3.31Å; V325-M329 PolarHBondContact O-N 3.39Å
326	A	75.5	Confident	68.2	Low	55 Å²	55	112 Å²	112	46%	0.455	59%	0.594	S	S	.	*	H	α-helix	trans	-63.8	-43.7	178.3	0	0	0	0	0	112.5	I322 I323 M329 L330	I322-A326 VanDerWaalsContact O-CB 3.27Å; I322-A326 WeakPolarHBondContact O-CB 3.14Å; I322-A326 PolarHBondContact O-N 2.64Å; I323-A326 PolarHBondContact O-N 3.47Å; A326-M329 PolarHBondContact O-N 3.47Å; A326-L330 WeakPolarHBondContact O-CB 3.44Å; A326-L330 PolarHBondContact O-N 3.44Å
327	V	80.6	Confident	70.1	Confident	80 Å²	80	106.8 Å²	106.8	49%	0.485	58%	0.575	S	S	.	*	H	α-helix	trans	-66.6	-40.5	177.9	174.2	0	0	0	0	111	I323 L330 L331	I323-V327 HydrophobicContact CG2-CG2 4.16Å; I323-V327 WeakPolarHBondContact O-CB 3.28Å; I323-V327 VanDerWaalsContact O-CG2 3.27Å; I323-V327 WeakPolarHBondContact O-CG2 3.27Å; I323-V327 PolarHBondContact O-N 3.05Å; V327-L330 PolarHBondContact O-N 2.92Å; V327-L331 HydrophobicContact CG1-CD1 4.16Å; V327-L331 WeakPolarHBondContact O-CG 3.26Å; V327-L331 PolarHBondContact O-N 3.47Å
328	S	78.9	Confident	72	Confident	48 Å²	48	103.4 Å²	103.4	34%	0.336	56%	0.561	S	S	.	*	H	α-helix	trans	-63.6	-45.5	176.5	-63	0	0	0	0	111.8	F324 V325 L330 L331 F332	F324-S328 WeakPolarHBondContact O-CB 3.32Å; F324-S328 PolarHBondContact O-N 3.37Å; F324-S328 PolarHBondContact O-OG 3.17Å; V325-S328 PolarHBondContact O-N 3.45Å; S328-L330 VanDerWaalsContact C-N 3.34Å; S328-L330 PolarHBondContact O-N 3.05Å; S328-L331 PolarHBondContact O-N 2.63Å; S328-F332 VanDerWaalsContact O-CD2 3.32Å; S328-F332 WeakPolarHBondContact O-CD2 3.48Å; S328-F332 PolarHBondContact O-N 3.24Å
329	M	84.3	Confident	73.8	Confident	128 Å²	128	98 Å²	98	63%	0.631	55%	0.553	S	S	*	*	H	α-helix	trans	-59.7	-42.8	174.9	-91.2	-83.1	-83.7	0	0	112.1	V325 A326 L331 F332 V333	V325-M329 WeakPolarHBondContact O-CB 3.31Å; V325-M329 PolarHBondContact O-N 3.39Å; A326-M329 PolarHBondContact O-N 3.47Å; M329-L331 PolarHBondContact O-N 3.44Å; M329-F332 PolarHBondContact O-N 3.3Å; M329-V333 WeakPolarHBondContact O-CG2 3.39Å; M329-V333 PolarHBondContact O-N 3.08Å
330	L	85.1	Confident	75.4	Confident	125 Å²	125	99.7 Å²	99.7	65%	0.654	55%	0.551	S	S	*	*	H	α-helix	trans	-62.9	-42.8	179	-143.6	88	0	0	0	111.7	A326 V327 S328 V333 V334	A326-L330 WeakPolarHBondContact O-CB 3.44Å; A326-L330 PolarHBondContact O-N 3.44Å; V327-L330 PolarHBondContact O-N 2.92Å; S328-L330 VanDerWaalsContact C-N 3.34Å; S328-L330 PolarHBondContact O-N 3.05Å; L330-V333 PolarHBondContact O-N 3.1Å; L330-V334 VanDerWaalsContact O-CG2 3.32Å; L330-V334 WeakPolarHBondContact O-CG2 3.39Å; L330-V334 PolarHBondContact O-N 3.15Å
331	L	84.8	Confident	76.5	Confident	119 Å²	119	99.2 Å²	99.2	62%	0.623	55%	0.548	S	S	*	.	H	α-helix	trans	-63.9	-39.7	177.4	-75.4	169.8	0	0	0	112.3	V327 S328 M329 G335	V327-L331 HydrophobicContact CG1-CD1 4.16Å; V327-L331 WeakPolarHBondContact O-CG 3.26Å; V327-L331 PolarHBondContact O-N 3.47Å; S328-L331 PolarHBondContact O-N 2.63Å; M329-L331 PolarHBondContact O-N 3.44Å; L331-G335 PolarHBondContact O-N 2.96Å
332	F	84.9	Confident	77.1	Confident	168 Å²	168	100.3 Å²	100.3	74%	0.737	55%	0.548	S	S	*	.	H	α-helix	trans	-64.8	-41.4	175.4	-91.3	-74.1	0	0	0	112.5	S328 M329 G336	S328-F332 VanDerWaalsContact O-CD2 3.32Å; S328-F332 WeakPolarHBondContact O-CD2 3.48Å; S328-F332 PolarHBondContact O-N 3.24Å; M329-F332 PolarHBondContact O-N 3.3Å; F332-G336 PolarHBondContact O-N 3.49Å
333	V	84.9	Confident	77.5	Confident	88 Å²	88	95 Å²	95	53%	0.533	53%	0.529	S	S	.	.	H	α-helix	trans	-65.5	-46.7	177.5	173.8	0	0	0	0	110.7	M329 L330 G336 V337	M329-V333 WeakPolarHBondContact O-CG2 3.39Å; M329-V333 PolarHBondContact O-N 3.08Å; L330-V333 PolarHBondContact O-N 3.1Å; V333-G336 PolarHBondContact O-N 3.45Å; V333-V337 HydrophobicContact CG1-CG2 4.5Å; V333-V337 VanDerWaalsContact O-CG2 3.31Å; V333-V337 WeakPolarHBondContact O-CG2 3.47Å; V333-V337 PolarHBondContact O-N 2.92Å
334	V	83.3	Confident	77.3	Confident	77 Å²	77	97.2 Å²	97.2	47%	0.467	53%	0.532	S	S	.	.	H	α-helix	trans	-64.3	-43.5	178.8	175	0	0	0	0	111.1	L330 G336 V337 L338	L330-V334 VanDerWaalsContact O-CG2 3.32Å; L330-V334 WeakPolarHBondContact O-CG2 3.39Å; L330-V334 PolarHBondContact O-N 3.15Å; V334-G336 PolarHBondContact O-N 3.37Å; V334-V337 PolarHBondContact O-N 2.88Å; V334-L338 HydrophobicContact CG1-CD1 4.01Å; V334-L338 HydrophobicContact CG1-CG 4.47Å; V334-L338 WeakPolarHBondContact O-CB 3.27Å; V334-L338 WeakPolarHBondContact O-CG 3.41Å; V334-L338 PolarHBondContact O-N 3.35Å
335	G	81.9	Confident	76.7	Confident	33 Å²	33	97.5 Å²	97.5	34%	0.34	53%	0.533	S	S	.	.	H	α-helix	trans	-59.8	-44.5	174.6	0	0	0	0	0	112.4	L331 L338 V339	L331-G335 PolarHBondContact O-N 2.96Å; G335-L338 PolarHBondContact O-N 3.31Å; G335-V339 WeakPolarHBondContact O-CG2 2.94Å; G335-V339 PolarHBondContact O-N 2.91Å
336	G	82.1	Confident	75.8	Confident	43 Å²	43	102.4 Å²	102.4	44%	0.443	55%	0.548	S	S	.	.	H	α-helix	trans	-61.9	-43.8	176.2	0	0	0	0	0	112.9	F332 V333 V334 V339 F340	F332-G336 PolarHBondContact O-N 3.49Å; V333-G336 PolarHBondContact O-N 3.45Å; V334-G336 PolarHBondContact O-N 3.37Å; G336-V339 PolarHBondContact O-N 3.34Å; G336-F340 VanDerWaalsContact O-CB 3.31Å; G336-F340 WeakPolarHBondContact O-CB 3.35Å; G336-F340 PolarHBondContact O-N 2.86Å
337	V	81.6	Confident	74.8	Confident	78 Å²	78	107.8 Å²	107.8	47%	0.473	57%	0.566	S	S	.	*	H	α-helix	trans	-65	-41.1	177	171.8	0	0	0	0	111.3	V333 V334 F340 L341	V333-V337 HydrophobicContact CG1-CG2 4.5Å; V333-V337 VanDerWaalsContact O-CG2 3.31Å; V333-V337 WeakPolarHBondContact O-CG2 3.47Å; V333-V337 PolarHBondContact O-N 2.92Å; V334-V337 PolarHBondContact O-N 2.88Å; V337-F340 PolarHBondContact O-N 3.37Å; V337-L341 HydrophobicContact CG1-CD1 3.78Å; V337-L341 HydrophobicContact CG1-CG 4.29Å; V337-L341 WeakPolarHBondContact O-CB 3.35Å; V337-L341 VanDerWaalsContact O-CG 3.28Å; V337-L341 WeakPolarHBondContact O-CG 2.97Å; V337-L341 PolarHBondContact O-N 2.97Å
338	L	78.9	Confident	73.4	Confident	88 Å²	88	113.9 Å²	113.9	46%	0.461	58%	0.58	S	S	.	*	H	α-helix	trans	-65.4	-45.4	176.9	-72.5	171.5	0	0	0	111.6	V334 G335 F340 L341 F342	V334-L338 HydrophobicContact CG1-CD1 4.01Å; V334-L338 HydrophobicContact CG1-CG 4.47Å; V334-L338 WeakPolarHBondContact O-CB 3.27Å; V334-L338 WeakPolarHBondContact O-CG 3.41Å; V334-L338 PolarHBondContact O-N 3.35Å; G335-L338 PolarHBondContact O-N 3.31Å; L338-F340 VanDerWaalsContact C-N 3.31Å; L338-F340 PolarHBondContact O-N 3.26Å; L338-L341 PolarHBondContact O-N 3.33Å; L338-F342 HydrophobicContact CD2-CE2 4.42Å; L338-F342 WeakPolarHBondContact O-CB 3.36Å; L338-F342 WeakPolarHBondContact O-CD2 3.29Å; L338-F342 PolarHBondContact O-N 3.12Å
339	V	78.9	Confident	71.7	Confident	110 Å²	110	120.8 Å²	120.8	67%	0.667	63%	0.626	S	S	*	*	H	α-helix	trans	-61.4	-41.6	175	170.7	0	0	0	0	111	G335 G336 G343	G335-V339 WeakPolarHBondContact O-CG2 2.94Å; G335-V339 PolarHBondContact O-N 2.91Å; G336-V339 PolarHBondContact O-N 3.34Å; V339-G343 WeakPolarHBondContact O-CA 3.21Å; V339-G343 PolarHBondContact O-N 2.89Å
340	F	75.3	Confident	71.1	Confident	132 Å²	132	120.5 Å²	120.5	58%	0.579	63%	0.626	S	S	*	*	H	α-helix	trans	-62.3	-49.2	175.8	-170.9	-97	0	0	0	111.2	G336 V337 L338 G343 Y344	G336-F340 VanDerWaalsContact O-CB 3.31Å; G336-F340 WeakPolarHBondContact O-CB 3.35Å; G336-F340 PolarHBondContact O-N 2.86Å; V337-F340 PolarHBondContact O-N 3.37Å; L338-F340 VanDerWaalsContact C-N 3.31Å; L338-F340 PolarHBondContact O-N 3.26Å; F340-G343 PolarHBondContact O-N 2.95Å; F340-Y344 HydrophobicContact CD1-CD2 4.4Å; F340-Y344 AromaticContact CE1-CD2 3.79Å; F340-Y344 HydrophobicContact CE1-CD2 3.79Å; F340-Y344 HydrophobicContact CE1-CE2 4.08Å; F340-Y344 HydrophobicContact CE1-CG 4.5Å; F340-Y344 HydrophobicContact CE2-CD2 4Å; F340-Y344 HydrophobicContact CE2-CE2 4.07Å; F340-Y344 AromaticContact CZ-CD2 3.56Å; F340-Y344 HydrophobicContact CZ-CD2 3.56Å; F340-Y344 AromaticContact CZ-CE2 3.51Å; F340-Y344 HydrophobicContact CZ-CE2 3.51Å; F340-Y344 VanDerWaalsContact O-CB 3.28Å; F340-Y344 WeakPolarHBondContact O-CB 3.39Å; F340-Y344 PolarHBondContact O-N 3.45Å
341	L	72.6	Confident	70.3	Confident	100 Å²	100	120.2 Å²	120.2	52%	0.524	63%	0.625	S	S	.	*	H	α-helix	trans	-64.3	-42.4	-179.8	-74	170.6	0	0	0	113.2	V337 L338 K345	V337-L341 HydrophobicContact CG1-CD1 3.78Å; V337-L341 HydrophobicContact CG1-CG 4.29Å; V337-L341 WeakPolarHBondContact O-CB 3.35Å; V337-L341 VanDerWaalsContact O-CG 3.28Å; V337-L341 WeakPolarHBondContact O-CG 2.97Å; V337-L341 PolarHBondContact O-N 2.97Å; L338-L341 PolarHBondContact O-N 3.33Å; L341-K345 PolarHBondContact O-N 2.93Å; L341-K345 VanDerWaalsContact O-N 3.08Å
342	F	68.9	Low	69.5	Low	149 Å²	149	120.3 Å²	120.3	65%	0.654	63%	0.625	S	S	*	*	H	α-helix	trans	-73.9	-35.7	177.4	-84.4	-83.5	0	0	0	112.3	L338 K345 K346	L338-F342 HydrophobicContact CD2-CE2 4.42Å; L338-F342 WeakPolarHBondContact O-CB 3.36Å; L338-F342 WeakPolarHBondContact O-CD2 3.29Å; L338-F342 PolarHBondContact O-N 3.12Å; F342-K345 PolarHBondContact O-N 3.07Å; F342-K346 PolarHBondContact O-N 3.26Å
343	G	63.2	Low	68.6	Low	34 Å²	34	117.5 Å²	117.5	35%	0.351	62%	0.618	S	S	.	*	H	α-helix	trans	-65.6	-43	172.7	0	0	0	0	0	112.5	V339 F340 K345 K346 M347	V339-G343 WeakPolarHBondContact O-CA 3.21Å; V339-G343 PolarHBondContact O-N 2.89Å; F340-G343 PolarHBondContact O-N 2.95Å; G343-K345 VanDerWaalsContact C-N 3.33Å; G343-K345 PolarHBondContact O-N 3.24Å; G343-K346 PolarHBondContact O-N 3.06Å; G343-K346 VanDerWaalsContact O-N 3.14Å; G343-M347 PolarHBondContact O-N 2.83Å; G343-M347 VanDerWaalsContact O-N 3.13Å
344	Y	58	Low	67.6	Low	139 Å²	139	119.3 Å²	119.3	55%	0.545	62%	0.623	S	S	.	*	H	α-helix	trans	-65.6	-34.7	175.8	-126.5	-93.7	0	0	0	112.4	F340	F340-Y344 HydrophobicContact CD1-CD2 4.4Å; F340-Y344 AromaticContact CE1-CD2 3.79Å; F340-Y344 HydrophobicContact CE1-CD2 3.79Å; F340-Y344 HydrophobicContact CE1-CE2 4.08Å; F340-Y344 HydrophobicContact CE1-CG 4.5Å; F340-Y344 HydrophobicContact CE2-CD2 4Å; F340-Y344 HydrophobicContact CE2-CE2 4.07Å; F340-Y344 AromaticContact CZ-CD2 3.56Å; F340-Y344 HydrophobicContact CZ-CD2 3.56Å; F340-Y344 AromaticContact CZ-CE2 3.51Å; F340-Y344 HydrophobicContact CZ-CE2 3.51Å; F340-Y344 VanDerWaalsContact O-CB 3.28Å; F340-Y344 WeakPolarHBondContact O-CB 3.39Å; F340-Y344 PolarHBondContact O-N 3.45Å
345	K	54.2	Low	66.6	Low	168 Å²	168	122.1 Å²	122.1	73%	0.73	63%	0.634	S	S	*	*	H	α-helix	trans	-67.8	-34	172.1	-102.1	-175.4	173.7	-179.4	0	112.5	L341 F342 G343 R348	L341-K345 PolarHBondContact O-N 2.93Å; L341-K345 VanDerWaalsContact O-N 3.08Å; F342-K345 PolarHBondContact O-N 3.07Å; G343-K345 VanDerWaalsContact C-N 3.33Å; G343-K345 PolarHBondContact O-N 3.24Å; K345-R348 PolarHBondContact O-N 2.61Å
346	K	54.3	Low	65.5	Low	188 Å²	188	128.5 Å²	128.5	82%	0.817	66%	0.655	S	S	*	*	H	α-helix	trans	-77.1	-22.1	-179.4	-155.9	173.5	-175.4	178.7	0	113.6	F342 G343 R348	F342-K346 PolarHBondContact O-N 3.26Å; G343-K346 PolarHBondContact O-N 3.06Å; G343-K346 VanDerWaalsContact O-N 3.14Å; K346-R348 VanDerWaalsContact C-N 3.34Å
347	M	53.7	Low	64.2	Low	168 Å²	168	135.1 Å²	135.1	83%	0.828	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	-0.5	173	-80.5	177.9	56.2	0	0	114.2	G343	G343-M347 PolarHBondContact O-N 2.83Å; G343-M347 VanDerWaalsContact O-N 3.13Å
348	R	52.4	Low	62.7	Low	208 Å²	208	139.8 Å²	139.8	79%	0.785	69%	0.688	S	S	*	*			trans	-121.2	57	-178.4	-135.9	178.4	-167.6	170.3	3.2	110.7	K345 K346	K345-R348 PolarHBondContact O-N 2.61Å; K346-R348 VanDerWaalsContact C-N 3.34Å
349	C	42.7	Very low	61.3	Low	194 Å²	194	144.5 Å²	144.5	100%	1.311	71%	0.708	S	S	*	*			trans	-139.6	0	157.7	-84.9	0	0	0	0	108.4

Retrieved 349 of 349 residues in 152.2 ms (Link to these results)

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