A0A077Z3S7_TRITR Loading...

VEFS-Box domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z3S7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 140 aa.

						>A0A077Z3S7_TRITR|A0A077Z3S7
MDKENKKRKRTYYRMENGTMKSVEPAGVPAVFSGEKCGNMLEILVENAKIDNLCGCPLAAKTVMKLWNEYRRRWSILPTRLMYAACCEFLHCYQETIKSQDLQKAVAEMFAAWHDAEVLSHEDAQMLITRMYSLCGNPVI
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.2	Very low	50.7	Low	242 Å²	242	185.6 Å²	185.6	100%	1.192	85%	0.846	S	S	*	*				0	96.3	0	-81.1	-174.2	178.9	0	0	107.4	K3	M1-K3 PolarHBondContact O-N 2.97Å
2	D	41	Very low	51.7	Low	169 Å²	169	176.7 Å²	176.7	90%	0.904	80%	0.801	S	S	*	*			trans	-65.8	115.4	179.3	-80.9	-48.2	0	0	0	110.7	E4	D2-E4 PolarHBondContact O-N 2.89Å
3	K	45.7	Very low	53.3	Low	201 Å²	201	174.2 Å²	174.2	87%	0.874	78%	0.783	S	S	*	*			trans	-88.1	93.7	163.6	-76.9	-176.5	177.2	177.6	0	107.4	M1 N5	M1-K3 PolarHBondContact O-N 2.97Å; K3-N5 PolarHBondContact O-N 3.29Å
4	E	48.1	Very low	54.1	Low	179 Å²	179	172.3 Å²	172.3	84%	0.836	77%	0.767	S	S	*	*			trans	-53.6	107.4	164.2	-88.1	-172.6	143.8	0	0	109.4	D2 K6	D2-E4 PolarHBondContact O-N 2.89Å; E4-K6 VanDerWaalsContact C-N 3.34Å; E4-K6 PolarHBondContact O-N 2.76Å
5	N	49.1	Very low	55	Low	153 Å²	153	170.7 Å²	170.7	82%	0.818	76%	0.764	S	S	*	*			trans	-64.9	95	168.5	-109.2	-20	0	0	0	108.1	K3 K7	K3-N5 PolarHBondContact O-N 3.29Å; N5-K7 PolarHBondContact O-N 2.86Å
6	K	49.6	Very low	55.9	Low	193 Å²	193	164.1 Å²	164.1	84%	0.839	74%	0.736	S	S	*	*			trans	-59.9	82.5	165.7	-79.2	-179	176.9	175.8	0	109.4	E4 R8	E4-K6 VanDerWaalsContact C-N 3.34Å; E4-K6 PolarHBondContact O-N 2.76Å; K6-R8 VanDerWaalsContact C-N 3.32Å; K6-R8 PolarHBondContact O-N 3.19Å
7	K	52.2	Low	56.9	Low	195 Å²	195	163.9 Å²	163.9	85%	0.848	74%	0.743	S	S	*	*			trans	-61.1	98.2	163	-80.6	-176.3	176.9	178.1	0	106.9	N5 K9	N5-K7 PolarHBondContact O-N 2.86Å; K7-K9 PolarHBondContact O-N 2.83Å
8	R	55.3	Low	57.4	Low	237 Å²	237	158.8 Å²	158.8	89%	0.894	74%	0.743	S	S	*	*			trans	-51.3	113	169.3	-74.5	178.9	169.3	179.4	-3.9	107.7	K6 R10	K6-R8 VanDerWaalsContact C-N 3.32Å; K6-R8 PolarHBondContact O-N 3.19Å; R8-R10 PolarHBondContact O-N 3.46Å; R8-R10 VanDerWaalsContact O-N 3.08Å
9	K	58.4	Low	57.5	Low	195 Å²	195	154.9 Å²	154.9	85%	0.848	73%	0.731	S	S	*	*			trans	-57	113.4	168.5	-78.4	-172.1	176	-171.1	0	107.2	K7	K7-K9 PolarHBondContact O-N 2.83Å
10	R	58.8	Low	57.8	Low	191 Å²	191	153.9 Å²	153.9	72%	0.721	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-83.9	126.3	174.6	-115.3	176.1	179.7	169.5	-1.8	108	R8 Y12	R8-R10 PolarHBondContact O-N 3.46Å; R8-R10 VanDerWaalsContact O-N 3.08Å; R10-Y12 HydrophobicContact CB-CE2 4.32Å; R10-Y12 WeakPolarHBondContact O-CD2 3.49Å; R10-Y12 WeakPolarHBondContact O-CE2 3.27Å
11	T	63.8	Low	58.5	Low	87 Å²	87	151.1 Å²	151.1	53%	0.534	71%	0.713	S	S	.	*	P	Polyproline II helix	trans	-81.8	125.8	172.5	-50	0	0	0	0	109	Y13	T11-Y13 HydrophobicContact CG2-CE1 4.27Å; T11-Y13 HydrophobicContact CG2-CE2 4.33Å
12	Y	61.7	Low	60.4	Low	78 Å²	78	143.6 Å²	143.6	31%	0.306	68%	0.684	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.4	147.9	173.6	-64.2	-98.3	0	0	0	109	R10 S22 V23 P25	R10-Y12 HydrophobicContact CB-CE2 4.32Å; R10-Y12 WeakPolarHBondContact O-CD2 3.49Å; R10-Y12 WeakPolarHBondContact O-CE2 3.27Å; Y12-S22 CarbonylContact O-C 3.59Å; Y12-S22 VanDerWaalsContact O-CA 3.27Å; Y12-S22 WeakPolarHBondContact O-CA 3.47Å; Y12-V23 PolarHBondContact O-N 3.46Å; Y12-P25 HydrophobicContact CD2-CB 4.32Å; Y12-P25 HydrophobicContact CD2-CG 3.83Å; Y12-P25 HydrophobicContact CE2-CB 4.33Å; Y12-P25 HydrophobicContact CE2-CG 3.69Å
13	Y	73.2	Confident	61.8	Low	144 Å²	144	137.9 Å²	137.9	57%	0.565	66%	0.655	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-117.8	142.7	177	-61.5	-84.7	0	0	0	110.5	T11 M20 K21	T11-Y13 HydrophobicContact CG2-CE1 4.27Å; T11-Y13 HydrophobicContact CG2-CE2 4.33Å; Y13-M20 HydrophobicContact CD1-CE 4.4Å; Y13-M20 HydrophobicContact CD1-CG 4.02Å; Y13-M20 HydrophobicContact CD1-SD 4.37Å; Y13-M20 HydrophobicContact CG-CG 4.23Å; Y13-M20 HydrophobicContact CG-SD 4.25Å; Y13-K21 CarbonylContact C-O 3.55Å; Y13-K21 VanDerWaalsContact CA-O 3.26Å; Y13-K21 WeakPolarHBondContact CA-O 3.36Å
14	R	65	Low	62.7	Low	148 Å²	148	136.4 Å²	136.4	56%	0.558	65%	0.652	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-131.5	139.8	174.4	-168.2	-176	-153.4	-175.7	6.8	108.6	E16 K21 V23	R14-E16 HydrophobicContact CG-CG 4.49Å; R14-E16 IonicContact NH1-OE1 3.77Å; R14-K21 PolarHBondContact N-O 3.02Å; R14-K21 PolarHBondContact O-N 3.12Å; R14-V23 HydrophobicContact CB-CG1 3.75Å; R14-V23 HydrophobicContact CB-CG2 3.95Å
15	M	67	Low	63.2	Low	148 Å²	148	130.8 Å²	130.8	73%	0.729	63%	0.631	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-85.2	124.4	171.6	-156.3	-177.9	-80.4	0	0	108.9
16	E	69.4	Low	63.3	Low	66 Å²	66	128.9 Å²	128.9	31%	0.308	64%	0.636	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-133.5	125.5	174	-73.4	-175.7	172.7	0	0	108.5	R14 G18 T19 K21	R14-E16 HydrophobicContact CG-CG 4.49Å; R14-E16 IonicContact NH1-OE1 3.77Å; E16-G18 VanDerWaalsContact C-N 3.3Å; E16-G18 PolarHBondContact O-N 3.45Å; E16-T19 PolarHBondContact N-O 3.43Å; E16-T19 PolarHBondContact O-N 3.46Å; E16-T19 VanDerWaalsContact O-O 3.11Å; E16-K21 HydrophobicContact CB-CD 4.4Å; E16-K21 WeakPolarHBondContact OE2-CD 3.19Å; E16-K21 IonicContact OE2-NZ 2.87Å; E16-K21 PolarHBondContact OE2-NZ 2.99Å
17	N	73.3	Confident	63.3	Low	161 Å²	161	122.4 Å²	122.4	86%	0.861	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	51.3	45.4	-179.5	-58.1	-16.7	0	0	0	113.1	T19	N17-T19 PolarHBondContact O-N 3.38Å; N17-T19 VanDerWaalsContact O-N 3.12Å; N17-T19 PolarHBondContact O-OG1 3.22Å
18	G	65.6	Low	62.8	Low	72 Å²	72	119.5 Å²	119.5	74%	0.742	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	69.7	4.5	-178.5	0	0	0	0	0	115	E16	E16-G18 VanDerWaalsContact C-N 3.3Å; E16-G18 PolarHBondContact O-N 3.45Å
19	T	60.2	Low	62.2	Low	84 Å²	84	110.7 Å²	110.7	52%	0.515	60%	0.596	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-114.5	134.4	-179.2	-29.7	0	0	0	0	110.1	E16 N17	E16-T19 PolarHBondContact N-O 3.43Å; E16-T19 PolarHBondContact O-N 3.46Å; E16-T19 VanDerWaalsContact O-O 3.11Å; N17-T19 PolarHBondContact O-N 3.38Å; N17-T19 VanDerWaalsContact O-N 3.12Å; N17-T19 PolarHBondContact O-OG1 3.22Å
20	M	63.2	Low	61.2	Low	134 Å²	134	105 Å²	105	66%	0.66	59%	0.586	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-80.1	122	175.2	-169.3	167.3	68.1	0	0	109.9	Y13	Y13-M20 HydrophobicContact CD1-CE 4.4Å; Y13-M20 HydrophobicContact CD1-CG 4.02Å; Y13-M20 HydrophobicContact CD1-SD 4.37Å; Y13-M20 HydrophobicContact CG-CG 4.23Å; Y13-M20 HydrophobicContact CG-SD 4.25Å
21	K	71.5	Confident	60.1	Low	96 Å²	96	100.4 Å²	100.4	42%	0.417	58%	0.578	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-118.4	142.9	177.8	-67.1	-174.8	-171.3	166.2	0	111.2	Y13 R14 E16	Y13-K21 CarbonylContact C-O 3.55Å; Y13-K21 VanDerWaalsContact CA-O 3.26Å; Y13-K21 WeakPolarHBondContact CA-O 3.36Å; R14-K21 PolarHBondContact N-O 3.02Å; R14-K21 PolarHBondContact O-N 3.12Å; E16-K21 HydrophobicContact CB-CD 4.4Å; E16-K21 WeakPolarHBondContact OE2-CD 3.19Å; E16-K21 IonicContact OE2-NZ 2.87Å; E16-K21 PolarHBondContact OE2-NZ 2.99Å
22	S	76.6	Confident	58.6	Low	85 Å²	85	102.1 Å²	102.1	59%	0.594	58%	0.579	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-71.8	130.4	167	57.3	0	0	0	0	109.9	Y12	Y12-S22 CarbonylContact O-C 3.59Å; Y12-S22 VanDerWaalsContact O-CA 3.27Å; Y12-S22 WeakPolarHBondContact O-CA 3.47Å
23	V	71.3	Confident	57.3	Low	48 Å²	48	103 Å²	103	29%	0.291	60%	0.596	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-121.8	138.9	177.5	-66.4	0	0	0	0	110.1	Y12 R14	Y12-V23 PolarHBondContact O-N 3.46Å; R14-V23 HydrophobicContact CB-CG1 3.75Å; R14-V23 HydrophobicContact CB-CG2 3.95Å
24	E	62.7	Low	55.5	Low	171 Å²	171	97.4 Å²	97.4	80%	0.799	58%	0.582	S	S	*	*			trans	-76.3	130.8	162.1	-70.2	-158.5	150.7	0	0	108.3	A26	E24-A26 PolarHBondContact O-N 2.84Å; E24-A26 VanDerWaalsContact O-N 3.15Å
25	P	59.8	Low	54.2	Low	61 Å²	61	99 Å²	99	40%	0.396	60%	0.596	S	S	.	*			trans	-65.1	117.9	178.2	26.7	-32.5	0	0	0	109.4	Y12 G27	Y12-P25 HydrophobicContact CD2-CB 4.32Å; Y12-P25 HydrophobicContact CD2-CG 3.83Å; Y12-P25 HydrophobicContact CE2-CB 4.33Å; Y12-P25 HydrophobicContact CE2-CG 3.69Å; P25-G27 PolarHBondContact O-N 3.26Å
26	A	51	Low	53.2	Low	112 Å²	112	99 Å²	99	93%	0.926	59%	0.592	S	S	*	*	S	Bend	trans	-73.3	110.7	169.6	0	0	0	0	0	109	E24	E24-A26 PolarHBondContact O-N 2.84Å; E24-A26 VanDerWaalsContact O-N 3.15Å
27	G	49	Very low	51.9	Low	58 Å²	58	100.9 Å²	100.9	60%	0.598	61%	0.611	S	S	*	*	S	Bend	trans	99.9	171.6	-177.6	0	0	0	0	0	113.4	P25 P29	P25-G27 PolarHBondContact O-N 3.26Å; G27-P29 WeakPolarHBondContact O-CD 3.37Å; G27-P29 VanDerWaalsContact O-N 3.08Å
28	V	42.7	Very low	51	Low	133 Å²	133	94 Å²	94	81%	0.806	58%	0.577	S	S	*	*			trans	-60.1	113.6	170.8	-176.6	0	0	0	0	106.4	A30	V28-A30 PolarHBondContact O-N 2.89Å; V28-A30 VanDerWaalsContact O-N 3.08Å
29	P	42.9	Very low	50.9	Low	53 Å²	53	94.9 Å²	94.9	34%	0.344	57%	0.566	S	S	.	*			trans	-55.7	126.2	171.6	22.8	-30.3	0	0	0	105.8	G27 V31	G27-P29 WeakPolarHBondContact O-CD 3.37Å; G27-P29 VanDerWaalsContact O-N 3.08Å; P29-V31 PolarHBondContact O-N 3.18Å
30	A	37.7	Very low	51.5	Low	76 Å²	76	97.9 Å²	97.9	63%	0.628	58%	0.575	S	S	*	*			trans	-45.9	114.6	171.3	0	0	0	0	0	106	V28 F32	V28-A30 PolarHBondContact O-N 2.89Å; V28-A30 VanDerWaalsContact O-N 3.08Å; A30-F32 VanDerWaalsContact O-CD2 3.29Å; A30-F32 WeakPolarHBondContact O-CD2 3.4Å; A30-F32 PolarHBondContact O-N 3.29Å
31	V	34.1	Very low	51.8	Low	93 Å²	93	97 Å²	97	56%	0.564	57%	0.572	S	S	*	*			trans	-53.5	105.3	-165.6	172.5	0	0	0	0	107.9	P29 S33	P29-V31 PolarHBondContact O-N 3.18Å; V31-S33 WeakPolarHBondContact CG1-OG 3.38Å; V31-S33 PolarHBondContact O-N 2.94Å
32	F	33.8	Very low	51.9	Low	124 Å²	124	97.9 Å²	97.9	54%	0.544	58%	0.578	S	S	.	*	S	Bend	trans	-73.8	66.7	165.2	-84.7	-95.3	0	0	0	107.7	A30 W74 L81	A30-F32 VanDerWaalsContact O-CD2 3.29Å; A30-F32 WeakPolarHBondContact O-CD2 3.4Å; A30-F32 PolarHBondContact O-N 3.29Å; F32-W74 HydrophobicContact CD1-CZ3 4.33Å; F32-W74 AromaticContact CE1-CE3 3.95Å; F32-W74 HydrophobicContact CE1-CE3 3.95Å; F32-W74 AromaticContact CE1-CH2 3.64Å; F32-W74 HydrophobicContact CE1-CH2 3.64Å; F32-W74 AromaticContact CE1-CZ3 3.2Å; F32-W74 HydrophobicContact CE1-CZ3 3.2Å; F32-W74 HydrophobicContact CZ-CE3 4.39Å; F32-W74 HydrophobicContact CZ-CH2 4.25Å; F32-W74 AromaticContact CZ-CZ3 3.57Å; F32-W74 HydrophobicContact CZ-CZ3 3.57Å; F32-L81 HydrophobicContact CZ-CD1 4.43Å
33	S	33.7	Very low	51.9	Low	97 Å²	97	96.3 Å²	96.3	68%	0.678	56%	0.563	S	S	*	*			trans	-156.1	54.7	162.5	77.2	0	0	0	0	107.7	V31	V31-S33 WeakPolarHBondContact CG1-OG 3.38Å; V31-S33 PolarHBondContact O-N 2.94Å
34	G	34.4	Very low	51.9	Low	25 Å²	25	99 Å²	99	26%	0.258	58%	0.575	S	S	.	*			trans	-100.1	72.2	170.8	0	0	0	0	0	108.5	K36	G34-K36 PolarHBondContact O-N 3.25Å
35	E	37.9	Very low	52.4	Low	182 Å²	182	94.6 Å²	94.6	85%	0.85	56%	0.56	S	S	*	*			trans	-68.7	71.1	155.2	-151.1	177.9	-167.2	0	0	106.5	C37	E35-C37 PolarHBondContact O-N 2.84Å
36	K	45.9	Very low	53.3	Low	148 Å²	148	95.4 Å²	95.4	64%	0.643	56%	0.558	S	S	*	*			trans	-78.8	90.2	157.6	-80.1	-165.9	175.1	-172.2	0	104.3	G34 G38	G34-K36 PolarHBondContact O-N 3.25Å; K36-G38 PolarHBondContact O-N 3.01Å
37	C	43.1	Very low	54.8	Low	106 Å²	106	91.8 Å²	91.8	72%	0.716	52%	0.523	S	S	*	.			trans	-57.1	99	147.6	-71.1	0	0	0	0	105.2	E35 N39	E35-C37 PolarHBondContact O-N 2.84Å; C37-N39 PolarHBondContact O-N 3.48Å
38	G	53	Low	56.1	Low	15 Å²	15	91.2 Å²	91.2	16%	0.155	51%	0.513	C	S	.	.			trans	-48.3	134.7	166.3	0	0	0	0	0	106.9	K36 M40	K36-G38 PolarHBondContact O-N 3.01Å; G38-M40 PolarHBondContact O-N 3.33Å
39	N	64.5	Low	58.2	Low	92 Å²	92	91.6 Å²	91.6	49%	0.492	50%	0.503	S	S	.	.			trans	-52.2	135.8	-179.9	-176.7	-18	0	0	0	107	C37 L41 E42 I43	C37-N39 PolarHBondContact O-N 3.48Å; N39-L41 CarbonylContact O-C 3.38Å; N39-L41 PolarHBondContact O-N 3.14Å; N39-L41 PolarHBondContact OD1-N 3.14Å; N39-E42 HydrophobicContact CB-CG 4.16Å; N39-E42 PolarHBondContact N-OE2 3.08Å; N39-E42 WeakPolarHBondContact O-CA 2.82Å; N39-E42 WeakPolarHBondContact O-CB 2.81Å; N39-E42 PolarHBondContact O-N 2.95Å; N39-I43 PolarHBondContact O-N 3.1Å
40	M	72.1	Confident	60.1	Low	146 Å²	146	89.5 Å²	89.5	72%	0.719	49%	0.489	S	S	*	.	H	α-helix	trans	-49.2	-32.3	-179.1	-167.8	178.8	-161.2	0	0	111.4	G38 I43 L44	G38-M40 PolarHBondContact O-N 3.33Å; M40-I43 PolarHBondContact O-N 2.83Å; M40-L44 VanDerWaalsContact O-CG 3.28Å; M40-L44 WeakPolarHBondContact O-CG 3.35Å; M40-L44 PolarHBondContact O-N 3.19Å
41	L	70.2	Confident	62.2	Low	115 Å²	115	89.5 Å²	89.5	60%	0.602	48%	0.479	S	S	*	.	H	α-helix	trans	-60.5	-44.2	171.5	-67	172	0	0	0	114.1	N39 I43 L44 V45	N39-L41 CarbonylContact O-C 3.38Å; N39-L41 PolarHBondContact O-N 3.14Å; N39-L41 PolarHBondContact OD1-N 3.14Å; L41-I43 VanDerWaalsContact C-N 3.35Å; L41-L44 PolarHBondContact O-N 2.96Å; L41-V45 WeakPolarHBondContact O-CB 3.34Å; L41-V45 VanDerWaalsContact O-CG2 3.25Å; L41-V45 WeakPolarHBondContact O-CG2 3.3Å; L41-V45 PolarHBondContact O-N 3.44Å
42	E	73.9	Confident	64.6	Low	115 Å²	115	91 Å²	91	54%	0.537	48%	0.484	S	S	.	.	H	α-helix	trans	-63.7	-42.3	177.2	-67.9	173.2	163.5	0	0	111	N39 L44 V45 E46	N39-E42 HydrophobicContact CB-CG 4.16Å; N39-E42 PolarHBondContact N-OE2 3.08Å; N39-E42 WeakPolarHBondContact O-CA 2.82Å; N39-E42 WeakPolarHBondContact O-CB 2.81Å; N39-E42 PolarHBondContact O-N 2.95Å; E42-L44 VanDerWaalsContact C-N 3.34Å; E42-L44 PolarHBondContact O-N 3.32Å; E42-V45 PolarHBondContact O-N 3.47Å; E42-E46 WeakPolarHBondContact O-CB 3.45Å; E42-E46 WeakPolarHBondContact O-CG 3.33Å; E42-E46 PolarHBondContact O-N 2.9Å
43	I	75.8	Confident	66.9	Low	53 Å²	53	88.5 Å²	88.5	27%	0.272	48%	0.475	S	S	.	.	H	α-helix	trans	-58.5	-47.8	175.5	-61.8	177.7	0	0	0	110.6	N39 M40 L41 N47	N39-I43 PolarHBondContact O-N 3.1Å; M40-I43 PolarHBondContact O-N 2.83Å; L41-I43 VanDerWaalsContact C-N 3.35Å; I43-N47 WeakPolarHBondContact O-CB 3.5Å; I43-N47 VanDerWaalsContact O-CG 3.25Å; I43-N47 PolarHBondContact O-N 3.44Å
44	L	72.9	Confident	69.1	Low	103 Å²	103	90.1 Å²	90.1	54%	0.539	49%	0.485	S	S	.	.	H	α-helix	trans	-64.2	-43.7	179.5	-72.4	171.9	0	0	0	112	M40 L41 E42 N47 A48	M40-L44 VanDerWaalsContact O-CG 3.28Å; M40-L44 WeakPolarHBondContact O-CG 3.35Å; M40-L44 PolarHBondContact O-N 3.19Å; L41-L44 PolarHBondContact O-N 2.96Å; E42-L44 VanDerWaalsContact C-N 3.34Å; E42-L44 PolarHBondContact O-N 3.32Å; L44-N47 PolarHBondContact O-N 3.26Å; L44-A48 VanDerWaalsContact O-CB 3.26Å; L44-A48 WeakPolarHBondContact O-CB 3.48Å; L44-A48 PolarHBondContact O-N 3.4Å
45	V	72.3	Confident	71.4	Confident	80 Å²	80	93 Å²	93	49%	0.485	52%	0.515	S	S	.	.	H	α-helix	trans	-65.1	-43.3	179.5	169.5	0	0	0	0	111.4	L41 E42 A48 K49	L41-V45 WeakPolarHBondContact O-CB 3.34Å; L41-V45 VanDerWaalsContact O-CG2 3.25Å; L41-V45 WeakPolarHBondContact O-CG2 3.3Å; L41-V45 PolarHBondContact O-N 3.44Å; E42-V45 PolarHBondContact O-N 3.47Å; V45-A48 PolarHBondContact O-N 3.05Å; V45-K49 WeakPolarHBondContact O-CG 3.25Å; V45-K49 PolarHBondContact O-N 3.36Å; V45-K49 VanDerWaalsContact O-N 3.08Å
46	E	79.5	Confident	73.7	Confident	77 Å²	77	86.1 Å²	86.1	36%	0.36	49%	0.487	S	S	.	.	H	α-helix	trans	-63.9	-44.4	176.5	-74.3	179.5	165.2	0	0	111.9	E42 K49 I50 R72	E42-E46 WeakPolarHBondContact O-CB 3.45Å; E42-E46 WeakPolarHBondContact O-CG 3.33Å; E42-E46 PolarHBondContact O-N 2.9Å; E46-K49 WeakPolarHBondContact O-CB 3.43Å; E46-K49 PolarHBondContact O-N 2.88Å; E46-I50 WeakPolarHBondContact O-CG1 3.26Å; E46-I50 PolarHBondContact O-N 3.29Å; E46-R72 IonicContact OE2-CZ 3.3Å; E46-R72 VanDerWaalsContact OE2-CZ 3.3Å; E46-R72 IonicContact OE2-NE 3.01Å; E46-R72 PolarHBondContact OE2-NE 2.78Å; E46-R72 IonicContact OE2-NH2 2.72Å; E46-R72 PolarHBondContact OE2-NH2 2.59Å
47	N	81.3	Confident	75.9	Confident	37 Å²	37	83 Å²	83	20%	0.198	48%	0.482	C	S	.	.	H	α-helix	trans	-66.2	-39.3	178.5	-72.5	-3.5	0	0	0	111.5	I43 L44 K49 I50 D51	I43-N47 WeakPolarHBondContact O-CB 3.5Å; I43-N47 VanDerWaalsContact O-CG 3.25Å; I43-N47 PolarHBondContact O-N 3.44Å; L44-N47 PolarHBondContact O-N 3.26Å; N47-K49 VanDerWaalsContact C-N 3.31Å; N47-K49 PolarHBondContact O-N 2.95Å; N47-I50 WeakPolarHBondContact O-CB 3.5Å; N47-I50 PolarHBondContact O-N 2.91Å; N47-I50 VanDerWaalsContact O-N 3.11Å; N47-D51 PolarHBondContact O-N 3.07Å; N47-D51 VanDerWaalsContact O-OD2 3.11Å
48	A	77.2	Confident	78.2	Confident	45 Å²	45	84.5 Å²	84.5	37%	0.372	48%	0.482	S	S	.	.	H	α-helix	trans	-62.1	-37.3	175.4	0	0	0	0	0	112.3	L44 V45 I50 D51 N52	L44-A48 VanDerWaalsContact O-CB 3.26Å; L44-A48 WeakPolarHBondContact O-CB 3.48Å; L44-A48 PolarHBondContact O-N 3.4Å; V45-A48 PolarHBondContact O-N 3.05Å; A48-I50 VanDerWaalsContact C-N 3.33Å; A48-I50 PolarHBondContact O-N 3.5Å; A48-D51 PolarHBondContact O-N 3.26Å; A48-N52 PolarHBondContact O-N 2.83Å; A48-N52 VanDerWaalsContact O-N 3.13Å; A48-N52 PolarHBondContact O-ND2 3.43Å
49	K	85.4	Confident	80.1	Confident	141 Å²	141	85.7 Å²	85.7	61%	0.613	49%	0.49	S	S	*	.	H	α-helix	trans	-61.6	-41.7	172.9	-72.1	173	-177.2	179.3	0	111.6	V45 E46 N47	V45-K49 WeakPolarHBondContact O-CG 3.25Å; V45-K49 PolarHBondContact O-N 3.36Å; V45-K49 VanDerWaalsContact O-N 3.08Å; E46-K49 WeakPolarHBondContact O-CB 3.43Å; E46-K49 PolarHBondContact O-N 2.88Å; N47-K49 VanDerWaalsContact C-N 3.31Å; N47-K49 PolarHBondContact O-N 2.95Å
50	I	84.1	Confident	81.4	Confident	9 Å²	9	82.4 Å²	82.4	5%	0.046	48%	0.476	C	S	.	.	H	α-helix	trans	-67	-42.5	177.1	-65.2	168.4	0	0	0	111	E46 N47 A48 N52 L53 K61 M64 K65	E46-I50 WeakPolarHBondContact O-CG1 3.26Å; E46-I50 PolarHBondContact O-N 3.29Å; N47-I50 WeakPolarHBondContact O-CB 3.5Å; N47-I50 PolarHBondContact O-N 2.91Å; N47-I50 VanDerWaalsContact O-N 3.11Å; A48-I50 VanDerWaalsContact C-N 3.33Å; A48-I50 PolarHBondContact O-N 3.5Å; I50-N52 PolarHBondContact O-N 3.48Å; I50-L53 HydrophobicContact CG2-CD1 4.42Å; I50-L53 WeakPolarHBondContact O-CB 3.31Å; I50-L53 WeakPolarHBondContact O-CG 3.44Å; I50-L53 PolarHBondContact O-N 2.89Å; I50-L53 VanDerWaalsContact O-N 3.08Å; I50-K61 HydrophobicContact CG2-CB 3.78Å; I50-K61 HydrophobicContact CG2-CG 3.96Å; I50-K61 WeakPolarHBondContact O-CE 3.24Å; I50-M64 HydrophobicContact CD1-CB 4.06Å; I50-M64 HydrophobicContact CG2-CB 4.47Å; I50-K65 HydrophobicContact CD1-CG 3.83Å; I50-K65 HydrophobicContact CG2-CG 4.22Å
51	D	82.2	Confident	82.4	Confident	76 Å²	76	77 Å²	77	41%	0.406	45%	0.448	S	S	.	.	H	α-helix	trans	-61.5	-35.4	-179.1	-74.7	-37.9	0	0	0	112	N47 A48 L53 K61 K65	N47-D51 PolarHBondContact O-N 3.07Å; N47-D51 VanDerWaalsContact O-OD2 3.11Å; A48-D51 PolarHBondContact O-N 3.26Å; D51-L53 VanDerWaalsContact C-N 3.28Å; D51-L53 PolarHBondContact O-N 3.5Å; D51-K61 PolarHBondContact O-NZ 3.4Å; D51-K65 VanDerWaalsContact OD1-CE 3.29Å; D51-K65 WeakPolarHBondContact OD1-CE 3.29Å; D51-K65 IonicContact OD1-NZ 2.59Å; D51-K65 PolarHBondContact OD1-NZ 3.06Å; D51-K65 IonicContact OD2-NZ 2.78Å; D51-K65 PolarHBondContact OD2-NZ 3.33Å
52	N	84.3	Confident	83.6	Confident	126 Å²	126	72.9 Å²	72.9	67%	0.674	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	2.3	177.2	-68.9	-40.9	0	0	0	115	A48 I50 C54	A48-N52 PolarHBondContact O-N 2.83Å; A48-N52 VanDerWaalsContact O-N 3.13Å; A48-N52 PolarHBondContact O-ND2 3.43Å; I50-N52 PolarHBondContact O-N 3.48Å; N52-C54 PolarHBondContact O-N 3.45Å
53	L	81.5	Confident	84.5	Confident	70 Å²	70	67.5 Å²	67.5	37%	0.366	40%	0.403	S	S	.	.			trans	-70.3	98.4	174.1	-64.5	174	0	0	0	110.4	I50 D51 C56 K61 M64	I50-L53 HydrophobicContact CG2-CD1 4.42Å; I50-L53 WeakPolarHBondContact O-CB 3.31Å; I50-L53 WeakPolarHBondContact O-CG 3.44Å; I50-L53 PolarHBondContact O-N 2.89Å; I50-L53 VanDerWaalsContact O-N 3.08Å; D51-L53 VanDerWaalsContact C-N 3.28Å; D51-L53 PolarHBondContact O-N 3.5Å; L53-C56 HydrophobicContact CB-CB 3.87Å; L53-K61 WeakPolarHBondContact O-CE 3.34Å; L53-K61 PolarHBondContact O-NZ 3.41Å; L53-M64 HydrophobicContact CD1-CE 4.05Å; L53-M64 HydrophobicContact CD1-SD 4.17Å
54	C	80.4	Confident	85.3	Confident	131 Å²	131	68.8 Å²	68.8	89%	0.885	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	135.7	175	-65.7	0	0	0	0	110.9	N52 C56	N52-C54 PolarHBondContact O-N 3.45Å; C54-C56 PolarHBondContact O-N 3.14Å
55	G	82.9	Confident	86.3	Confident	86 Å²	86	66.4 Å²	66.4	89%	0.887	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.2	-7.3	178.4	0	0	0	0	0	115.8
56	C	86	Confident	87.3	Confident	37 Å²	37	63.4 Å²	63.4	25%	0.25	38%	0.375	C	S	.	.			trans	-79.7	127.4	175	-176.1	0	0	0	0	110.7	L53 C54 K61	L53-C56 HydrophobicContact CB-CB 3.87Å; C54-C56 PolarHBondContact O-N 3.14Å; C56-K61 HydrophobicContact CB-CG 4.21Å; C56-K61 WeakPolarHBondContact O-CE 3.17Å
57	P	91.1	Very high	88	Confident	84 Å²	84	60.7 Å²	60.7	55%	0.545	36%	0.362	S	S	.	.			trans	-57.3	146.2	176.6	-25.1	34.2	0	0	0	112.9	A59 A60 K61	P57-A59 VanDerWaalsContact C-N 3.26Å; P57-A59 PolarHBondContact O-N 2.79Å; P57-A60 HydrophobicContact CB-CB 4.43Å; P57-A60 PolarHBondContact O-N 2.85Å; P57-A60 VanDerWaalsContact O-N 3.1Å; P57-K61 PolarHBondContact O-N 3.4Å
58	L	91.9	Very high	88.4	Confident	137 Å²	137	60.7 Å²	60.7	72%	0.717	36%	0.362	S	S	*	.	H	α-helix	trans	-58.2	-38.1	-179.8	-176.8	63.5	0	0	0	112.5	K61 T62	L58-K61 PolarHBondContact O-N 2.96Å; L58-T62 WeakPolarHBondContact O-CB 3.44Å; L58-T62 PolarHBondContact O-N 3.45Å; L58-T62 PolarHBondContact O-OG1 3.2Å
59	A	93.6	Very high	89	Confident	39 Å²	39	62.9 Å²	62.9	32%	0.322	36%	0.364	S	S	.	.	H	α-helix	trans	-60.9	-45.5	176.3	0	0	0	0	0	111.8	P57 T62 V63 L102 A105	P57-A59 VanDerWaalsContact C-N 3.26Å; P57-A59 PolarHBondContact O-N 2.79Å; A59-T62 WeakPolarHBondContact O-CB 3.43Å; A59-T62 PolarHBondContact O-N 2.99Å; A59-V63 WeakPolarHBondContact O-CG2 3.48Å; A59-V63 PolarHBondContact O-N 3.32Å; A59-L102 HydrophobicContact CB-CD2 3.92Å; A59-A105 HydrophobicContact CB-CB 3.93Å
60	A	92.1	Very high	89.2	Confident	23 Å²	23	56.1 Å²	56.1	19%	0.19	34%	0.335	C	S	.	.	H	α-helix	trans	-62.8	-45.3	177	0	0	0	0	0	111.5	P57 T62 V63 M64	P57-A60 HydrophobicContact CB-CB 4.43Å; P57-A60 PolarHBondContact O-N 2.85Å; P57-A60 VanDerWaalsContact O-N 3.1Å; A60-T62 VanDerWaalsContact C-N 3.26Å; A60-T62 PolarHBondContact O-N 3.46Å; A60-V63 PolarHBondContact O-N 2.94Å; A60-M64 VanDerWaalsContact O-CG 3.27Å; A60-M64 WeakPolarHBondContact O-CG 3.48Å; A60-M64 PolarHBondContact O-N 3.1Å
61	K	92.3	Very high	89.3	Confident	32 Å²	32	62.3 Å²	62.3	14%	0.139	36%	0.358	C	S	.	.	H	α-helix	trans	-56.4	-42.2	173.9	-68.2	-174.4	-179.1	-173.5	0	112	I50 D51 L53 C56 P57 L58 M64 K65	I50-K61 HydrophobicContact CG2-CB 3.78Å; I50-K61 HydrophobicContact CG2-CG 3.96Å; I50-K61 WeakPolarHBondContact O-CE 3.24Å; D51-K61 PolarHBondContact O-NZ 3.4Å; L53-K61 WeakPolarHBondContact O-CE 3.34Å; L53-K61 PolarHBondContact O-NZ 3.41Å; C56-K61 HydrophobicContact CB-CG 4.21Å; C56-K61 WeakPolarHBondContact O-CE 3.17Å; P57-K61 PolarHBondContact O-N 3.4Å; L58-K61 PolarHBondContact O-N 2.96Å; K61-M64 PolarHBondContact O-N 3.38Å; K61-K65 WeakPolarHBondContact O-CG 3.39Å; K61-K65 PolarHBondContact O-N 3.26Å
62	T	94.4	Very high	89.2	Confident	30 Å²	30	60.9 Å²	60.9	18%	0.184	35%	0.346	C	S	.	.	H	α-helix	trans	-64.9	-47.9	179.6	-55.3	0	0	0	0	111	L58 A59 A60 M64 K65 L66 L102	L58-T62 WeakPolarHBondContact O-CB 3.44Å; L58-T62 PolarHBondContact O-N 3.45Å; L58-T62 PolarHBondContact O-OG1 3.2Å; A59-T62 WeakPolarHBondContact O-CB 3.43Å; A59-T62 PolarHBondContact O-N 2.99Å; A60-T62 VanDerWaalsContact C-N 3.26Å; A60-T62 PolarHBondContact O-N 3.46Å; T62-M64 VanDerWaalsContact C-N 3.33Å; T62-M64 PolarHBondContact O-N 2.92Å; T62-K65 WeakPolarHBondContact O-CB 3.39Å; T62-K65 PolarHBondContact O-N 2.95Å; T62-K65 VanDerWaalsContact O-N 3.14Å; T62-L66 HydrophobicContact CG2-CD1 4.45Å; T62-L66 WeakPolarHBondContact O-CG 3.49Å; T62-L66 PolarHBondContact O-N 3.27Å; T62-L102 HydrophobicContact CG2-CD1 3.75Å; T62-L102 HydrophobicContact CG2-CD2 4.35Å
63	V	94.4	Very high	88.8	Confident	2 Å²	2	61.6 Å²	61.6	1%	0.012	34%	0.34	C	S	.	.	H	α-helix	trans	-59.2	-43.1	176.1	171.7	0	0	0	0	111.7	A59 A60 K65 L66 W67 L102 A105 V106 M109	A59-V63 WeakPolarHBondContact O-CG2 3.48Å; A59-V63 PolarHBondContact O-N 3.32Å; A60-V63 PolarHBondContact O-N 2.94Å; V63-K65 VanDerWaalsContact C-N 3.31Å; V63-K65 PolarHBondContact O-N 3.37Å; V63-L66 PolarHBondContact O-N 3.01Å; V63-W67 PolarHBondContact O-N 3.1Å; V63-L102 HydrophobicContact CG2-CB 3.92Å; V63-L102 HydrophobicContact CG2-CD1 4.2Å; V63-L102 HydrophobicContact CG2-CG 4.44Å; V63-A105 HydrophobicContact CG2-CB 3.73Å; V63-V106 HydrophobicContact CB-CG2 4.47Å; V63-V106 HydrophobicContact CG1-CG2 3.93Å; V63-V106 HydrophobicContact CG2-CG2 3.63Å; V63-M109 HydrophobicContact CG1-CB 4.31Å; V63-M109 HydrophobicContact CG1-CE 4.18Å; V63-M109 HydrophobicContact CG1-SD 3.59Å; V63-M109 VanDerWaalsContact CG1-SD 3.59Å
64	M	91.9	Very high	88.3	Confident	79 Å²	79	60.4 Å²	60.4	39%	0.389	33%	0.331	S	S	.	.	H	α-helix	trans	-59.9	-41.2	175.9	-68.9	174.1	80.7	0	0	112.1	I50 L53 A60 K61 T62 W67 N68	I50-M64 HydrophobicContact CD1-CB 4.06Å; I50-M64 HydrophobicContact CG2-CB 4.47Å; L53-M64 HydrophobicContact CD1-CE 4.05Å; L53-M64 HydrophobicContact CD1-SD 4.17Å; A60-M64 VanDerWaalsContact O-CG 3.27Å; A60-M64 WeakPolarHBondContact O-CG 3.48Å; A60-M64 PolarHBondContact O-N 3.1Å; K61-M64 PolarHBondContact O-N 3.38Å; T62-M64 VanDerWaalsContact C-N 3.33Å; T62-M64 PolarHBondContact O-N 2.92Å; M64-W67 PolarHBondContact O-N 3.28Å; M64-N68 WeakPolarHBondContact O-CB 3.47Å; M64-N68 PolarHBondContact O-N 3Å
65	K	93.3	Very high	87.8	Confident	53 Å²	53	57.6 Å²	57.6	23%	0.23	31%	0.312	C	S	.	.	H	α-helix	trans	-64.8	-45.1	176.1	-72	179.1	-178.8	-173.6	0	111.8	I50 D51 K61 T62 V63 W67 N68 E69	I50-K65 HydrophobicContact CD1-CG 3.83Å; I50-K65 HydrophobicContact CG2-CG 4.22Å; D51-K65 VanDerWaalsContact OD1-CE 3.29Å; D51-K65 WeakPolarHBondContact OD1-CE 3.29Å; D51-K65 IonicContact OD1-NZ 2.59Å; D51-K65 PolarHBondContact OD1-NZ 3.06Å; D51-K65 IonicContact OD2-NZ 2.78Å; D51-K65 PolarHBondContact OD2-NZ 3.33Å; K61-K65 WeakPolarHBondContact O-CG 3.39Å; K61-K65 PolarHBondContact O-N 3.26Å; T62-K65 WeakPolarHBondContact O-CB 3.39Å; T62-K65 PolarHBondContact O-N 2.95Å; T62-K65 VanDerWaalsContact O-N 3.14Å; V63-K65 VanDerWaalsContact C-N 3.31Å; V63-K65 PolarHBondContact O-N 3.37Å; K65-W67 VanDerWaalsContact C-N 3.34Å; K65-W67 PolarHBondContact O-N 3.47Å; K65-N68 PolarHBondContact O-N 2.97Å; K65-E69 PolarHBondContact O-N 3.41Å
66	L	94.3	Very high	87.4	Confident	18 Å²	18	59.9 Å²	59.9	9%	0.094	30%	0.303	C	S	.	.	H	α-helix	trans	-61.1	-43	176.8	-65.4	176.3	0	0	0	111.5	T62 V63 E69 Y70 F89 Y93 T96 L102	T62-L66 HydrophobicContact CG2-CD1 4.45Å; T62-L66 WeakPolarHBondContact O-CG 3.49Å; T62-L66 PolarHBondContact O-N 3.27Å; V63-L66 PolarHBondContact O-N 3.01Å; L66-E69 PolarHBondContact O-N 3.26Å; L66-Y70 WeakPolarHBondContact O-CB 3.42Å; L66-Y70 PolarHBondContact O-N 3.24Å; L66-F89 HydrophobicContact CB-CE2 3.96Å; L66-F89 HydrophobicContact CB-CZ 4.2Å; L66-Y93 HydrophobicContact CB-CD1 4.37Å; L66-Y93 HydrophobicContact CB-CE1 4.45Å; L66-Y93 HydrophobicContact CD1-CD1 4.5Å; L66-Y93 HydrophobicContact CD2-CD1 3.71Å; L66-Y93 HydrophobicContact CD2-CE1 3.76Å; L66-Y93 HydrophobicContact CG-CD1 4.4Å; L66-T96 HydrophobicContact CD1-CG2 3.89Å; L66-T96 HydrophobicContact CD2-CG2 4.12Å; L66-L102 HydrophobicContact CD1-CD1 3.81Å
67	W	93	Very high	87.1	Confident	19 Å²	19	59.4 Å²	59.4	7%	0.072	30%	0.298	C	S	.	.	H	α-helix	trans	-64.2	-42.6	176.3	178.7	-107.6	0	0	0	112.2	V63 M64 K65 E69 Y70 R71 L77 M82 A85 F89 M109 W113	V63-W67 PolarHBondContact O-N 3.1Å; M64-W67 PolarHBondContact O-N 3.28Å; K65-W67 VanDerWaalsContact C-N 3.34Å; K65-W67 PolarHBondContact O-N 3.47Å; W67-E69 VanDerWaalsContact C-N 3.34Å; W67-E69 PolarHBondContact O-N 2.92Å; W67-Y70 AromaticContact CE3-CD1 3.89Å; W67-Y70 HydrophobicContact CE3-CD1 3.89Å; W67-Y70 HydrophobicContact CH2-CD1 4.21Å; W67-Y70 HydrophobicContact CH2-CE1 4.24Å; W67-Y70 AromaticContact CZ3-CD1 3.69Å; W67-Y70 HydrophobicContact CZ3-CD1 3.69Å; W67-Y70 AromaticContact CZ3-CE1 3.96Å; W67-Y70 HydrophobicContact CZ3-CE1 3.96Å; W67-Y70 WeakPolarHBondContact O-CB 3.48Å; W67-Y70 PolarHBondContact O-N 3.42Å; W67-R71 VanDerWaalsContact O-CB 3.24Å; W67-R71 WeakPolarHBondContact O-CB 3.42Å; W67-R71 PolarHBondContact O-N 2.92Å; W67-L77 HydrophobicContact CH2-CD2 4.19Å; W67-L77 HydrophobicContact CZ2-CD2 4.01Å; W67-M82 HydrophobicContact CH2-SD 3.81Å; W67-M82 HydrophobicContact CZ2-CE 4.34Å; W67-M82 HydrophobicContact CZ2-SD 3.75Å; W67-A85 HydrophobicContact CH2-CB 4.46Å; W67-F89 HydrophobicContact CB-CE2 4.43Å; W67-F89 HydrophobicContact CE3-CB 4.13Å; W67-F89 HydrophobicContact CE3-CD1 4.22Å; W67-F89 AromaticContact CE3-CD2 3.74Å; W67-F89 HydrophobicContact CE3-CD2 3.74Å; W67-F89 HydrophobicContact CE3-CE2 4.2Å; W67-F89 AromaticContact CE3-CG 3.75Å; W67-F89 HydrophobicContact CE3-CG 3.75Å; W67-F89 HydrophobicContact CZ3-CB 3.77Å; W67-F89 HydrophobicContact CZ3-CD1 4.41Å; W67-F89 HydrophobicContact CZ3-CD2 4.27Å; W67-F89 AromaticContact CZ3-CG 3.9Å; W67-F89 HydrophobicContact CZ3-CG 3.9Å; W67-M109 HydrophobicContact CB-SD 4.29Å; W67-M109 HydrophobicContact CG-SD 4.46Å; W67-W113 AromaticContact CD1-CZ2 3.88Å; W67-W113 AromaticContact CD2-CH2 3.38Å; W67-W113 HydrophobicContact CD2-CH2 3.38Å; W67-W113 AromaticContact CD2-CZ2 3.8Å; W67-W113 HydrophobicContact CD2-CZ2 3.8Å; W67-W113 AromaticContact CE2-CH2 3.22Å; W67-W113 AromaticContact CE2-CZ2 3.47Å; W67-W113 VanDerWaalsContact CE2-CZ2 3.47Å; W67-W113 AromaticContact CE3-CH2 3.58Å; W67-W113 HydrophobicContact CE3-CH2 3.58Å; W67-W113 HydrophobicContact CE3-CZ2 4.43Å; W67-W113 HydrophobicContact CE3-CZ3 4.43Å; W67-W113 HydrophobicContact CG-CH2 4.05Å; W67-W113 HydrophobicContact CG-CZ2 4.03Å; W67-W113 AromaticContact CH2-CH2 3.46Å; W67-W113 HydrophobicContact CH2-CH2 3.46Å; W67-W113 VanDerWaalsContact CH2-CH2 3.46Å; W67-W113 HydrophobicContact CH2-CZ2 4.44Å; W67-W113 AromaticContact CH2-CZ3 3.79Å; W67-W113 HydrophobicContact CH2-CZ3 3.79Å; W67-W113 AromaticContact CZ2-CH2 3.28Å; W67-W113 HydrophobicContact CZ2-CH2 3.28Å; W67-W113 AromaticContact CZ2-CZ2 3.83Å; W67-W113 HydrophobicContact CZ2-CZ2 3.83Å; W67-W113 AromaticContact CZ2-CZ3 3.92Å; W67-W113 HydrophobicContact CZ2-CZ3 3.92Å; W67-W113 AromaticContact CZ3-CH2 3.61Å; W67-W113 HydrophobicContact CZ3-CH2 3.61Å; W67-W113 HydrophobicContact CZ3-CZ3 4.06Å; W67-W113 AromaticContact NE1-CH2 3.8Å; W67-W113 AromaticContact NE1-CZ2 3.52Å
68	N	89.7	Confident	86.6	Confident	37 Å²	37	57.7 Å²	57.7	20%	0.198	29%	0.286	C	S	.	.	H	α-helix	trans	-63.5	-42	176.1	-77.9	-9.7	0	0	0	111.5	M64 K65 Y70 R71 R72	M64-N68 WeakPolarHBondContact O-CB 3.47Å; M64-N68 PolarHBondContact O-N 3Å; K65-N68 PolarHBondContact O-N 2.97Å; N68-Y70 VanDerWaalsContact C-N 3.35Å; N68-Y70 PolarHBondContact O-N 3.26Å; N68-R71 PolarHBondContact O-N 3.06Å; N68-R72 VanDerWaalsContact O-CG 3.25Å; N68-R72 WeakPolarHBondContact O-CG 3.49Å; N68-R72 PolarHBondContact O-N 3.35Å
69	E	89.4	Confident	86.1	Confident	91 Å²	91	55.5 Å²	55.5	43%	0.425	28%	0.279	S	S	.	.	H	α-helix	trans	-58.3	-47.1	173.9	-173.4	-174.5	157.7	0	0	111.7	K65 L66 W67 R72 Y93	K65-E69 PolarHBondContact O-N 3.41Å; L66-E69 PolarHBondContact O-N 3.26Å; W67-E69 VanDerWaalsContact C-N 3.34Å; W67-E69 PolarHBondContact O-N 2.92Å; E69-R72 PolarHBondContact O-N 3.48Å; E69-Y93 WeakPolarHBondContact CG-OH 3.32Å; E69-Y93 PolarHBondContact OE1-OH 3.01Å
70	Y	90.1	Very high	85.6	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-58.6	-52.2	174.2	177.9	-104.8	0	0	0	112.1	L66 W67 N68 R72 R73 W74 A85 E88 F89 Y93	L66-Y70 WeakPolarHBondContact O-CB 3.42Å; L66-Y70 PolarHBondContact O-N 3.24Å; W67-Y70 AromaticContact CE3-CD1 3.89Å; W67-Y70 HydrophobicContact CE3-CD1 3.89Å; W67-Y70 HydrophobicContact CH2-CD1 4.21Å; W67-Y70 HydrophobicContact CH2-CE1 4.24Å; W67-Y70 AromaticContact CZ3-CD1 3.69Å; W67-Y70 HydrophobicContact CZ3-CD1 3.69Å; W67-Y70 AromaticContact CZ3-CE1 3.96Å; W67-Y70 HydrophobicContact CZ3-CE1 3.96Å; W67-Y70 WeakPolarHBondContact O-CB 3.48Å; W67-Y70 PolarHBondContact O-N 3.42Å; N68-Y70 VanDerWaalsContact C-N 3.35Å; N68-Y70 PolarHBondContact O-N 3.26Å; Y70-R72 VanDerWaalsContact C-N 3.26Å; Y70-R72 PolarHBondContact O-N 2.93Å; Y70-R73 WeakPolarHBondContact O-CB 3.47Å; Y70-R73 PolarHBondContact O-N 3.39Å; Y70-R73 VanDerWaalsContact O-N 3.12Å; Y70-W74 AromaticContact CE1-NE1 3.59Å; Y70-W74 AromaticContact CE2-NE1 3.96Å; Y70-W74 AromaticContact CZ-NE1 3.4Å; Y70-W74 WeakPolarHBondContact OH-CZ2 3.27Å; Y70-W74 PolarHBondContact OH-NE1 3.27Å; Y70-A85 HydrophobicContact CE1-CB 4.12Å; Y70-A85 WeakPolarHBondContact CE1-O 3.44Å; Y70-A85 PolarHBondContact OH-O 3.05Å; Y70-E88 HydrophobicContact CE2-CB 4.39Å; Y70-E88 HydrophobicContact CE2-CG 3.96Å; Y70-E88 WeakPolarHBondContact OH-CB 3.24Å; Y70-E88 PolarHBondContact OH-OE2 3.23Å; Y70-F89 HydrophobicContact CD1-CB 4.06Å; Y70-F89 HydrophobicContact CD1-CD2 4.28Å; Y70-F89 HydrophobicContact CD2-CB 4.34Å; Y70-F89 HydrophobicContact CD2-CD2 4.46Å; Y70-F89 HydrophobicContact CE1-CB 4.13Å; Y70-F89 HydrophobicContact CE2-CB 4.41Å; Y70-F89 HydrophobicContact CG-CB 4.17Å; Y70-F89 AromaticContact CG-CD2 3.92Å; Y70-F89 HydrophobicContact CG-CD2 3.92Å; Y70-Y93 HydrophobicContact CD2-CE2 4.11Å; Y70-Y93 HydrophobicContact CG-CE2 4.33Å; Y70-Y93 PolarHBondContact N-OH 3.39Å
71	R	85.8	Confident	85.4	Confident	139 Å²	139	65.3 Å²	65.3	53%	0.525	31%	0.306	S	S	.	.	H	α-helix	trans	-61.5	-31.7	-176.1	-175.6	-176.1	171.4	-168.2	-0.4	112.2	W67 N68 R73 W74	W67-R71 VanDerWaalsContact O-CB 3.24Å; W67-R71 WeakPolarHBondContact O-CB 3.42Å; W67-R71 PolarHBondContact O-N 2.92Å; N68-R71 PolarHBondContact O-N 3.06Å; R71-R73 PolarHBondContact O-N 3.32Å; R71-R73 VanDerWaalsContact O-N 3.15Å; R71-W74 WeakPolarHBondContact O-CA 3.23Å; R71-W74 VanDerWaalsContact O-CB 3.31Å; R71-W74 WeakPolarHBondContact O-CB 3.43Å; R71-W74 PolarHBondContact O-N 2.79Å; R71-W74 VanDerWaalsContact O-O 3.11Å
72	R	81.3	Confident	85.3	Confident	45 Å²	45	64.8 Å²	64.8	17%	0.17	31%	0.305	C	S	.	.	H	α-helix	trans	-59.7	-23.9	177.3	-76.6	172.2	-158.2	136.2	-0.4	113.5	E46 N68 E69 Y70 W74	E46-R72 IonicContact OE2-CZ 3.3Å; E46-R72 VanDerWaalsContact OE2-CZ 3.3Å; E46-R72 IonicContact OE2-NE 3.01Å; E46-R72 PolarHBondContact OE2-NE 2.78Å; E46-R72 IonicContact OE2-NH2 2.72Å; E46-R72 PolarHBondContact OE2-NH2 2.59Å; N68-R72 VanDerWaalsContact O-CG 3.25Å; N68-R72 WeakPolarHBondContact O-CG 3.49Å; N68-R72 PolarHBondContact O-N 3.35Å; E69-R72 PolarHBondContact O-N 3.48Å; Y70-R72 VanDerWaalsContact C-N 3.26Å; Y70-R72 PolarHBondContact O-N 2.93Å; R72-W74 PolarHBondContact O-N 3.49Å
73	R	76.6	Confident	85.1	Confident	142 Å²	142	66.4 Å²	66.4	54%	0.536	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-11.6	172.5	-56.9	-178	-176.1	-178.4	1.8	112.9	Y70 R71	Y70-R73 WeakPolarHBondContact O-CB 3.47Å; Y70-R73 PolarHBondContact O-N 3.39Å; Y70-R73 VanDerWaalsContact O-N 3.12Å; R71-R73 PolarHBondContact O-N 3.32Å; R71-R73 VanDerWaalsContact O-N 3.15Å
74	W	70.2	Confident	84.9	Confident	45 Å²	45	69 Å²	69	17%	0.17	33%	0.329	C	S	.	.			trans	-111.1	127.8	-178.3	-57.6	78.3	0	0	0	109.7	F32 Y70 R71 R72 L77 E88	F32-W74 HydrophobicContact CD1-CZ3 4.33Å; F32-W74 AromaticContact CE1-CE3 3.95Å; F32-W74 HydrophobicContact CE1-CE3 3.95Å; F32-W74 AromaticContact CE1-CH2 3.64Å; F32-W74 HydrophobicContact CE1-CH2 3.64Å; F32-W74 AromaticContact CE1-CZ3 3.2Å; F32-W74 HydrophobicContact CE1-CZ3 3.2Å; F32-W74 HydrophobicContact CZ-CE3 4.39Å; F32-W74 HydrophobicContact CZ-CH2 4.25Å; F32-W74 AromaticContact CZ-CZ3 3.57Å; F32-W74 HydrophobicContact CZ-CZ3 3.57Å; Y70-W74 AromaticContact CE1-NE1 3.59Å; Y70-W74 AromaticContact CE2-NE1 3.96Å; Y70-W74 AromaticContact CZ-NE1 3.4Å; Y70-W74 WeakPolarHBondContact OH-CZ2 3.27Å; Y70-W74 PolarHBondContact OH-NE1 3.27Å; R71-W74 WeakPolarHBondContact O-CA 3.23Å; R71-W74 VanDerWaalsContact O-CB 3.31Å; R71-W74 WeakPolarHBondContact O-CB 3.43Å; R71-W74 PolarHBondContact O-N 2.79Å; R71-W74 VanDerWaalsContact O-O 3.11Å; R72-W74 PolarHBondContact O-N 3.49Å; W74-L77 HydrophobicContact CD2-CD1 4.35Å; W74-L77 HydrophobicContact CE3-CD1 4.02Å; W74-L77 HydrophobicContact CZ3-CD1 4.21Å; W74-E88 WeakPolarHBondContact CZ2-OE2 3.38Å
75	S	68.9	Low	84.9	Confident	71 Å²	71	65.2 Å²	65.2	50%	0.497	31%	0.311	S	S	.	.	S	Bend	trans	-67.6	-43.8	173.6	55	0	0	0	0	111.4
76	I	75.2	Confident	84.9	Confident	135 Å²	135	62.7 Å²	62.7	69%	0.692	30%	0.3	S	S	*	.			trans	-146.1	133.7	175	-59.2	177.6	0	0	0	106.2	P78	I76-P78 WeakPolarHBondContact O-CD 3.33Å
77	L	78.9	Confident	84.8	Confident	27 Å²	27	62.5 Å²	62.5	14%	0.141	30%	0.3	C	S	.	.			trans	-108.9	100.2	172.7	179.9	60.6	0	0	0	109.2	W67 W74 L81 M82 A85	W67-L77 HydrophobicContact CH2-CD2 4.19Å; W67-L77 HydrophobicContact CZ2-CD2 4.01Å; W74-L77 HydrophobicContact CD2-CD1 4.35Å; W74-L77 HydrophobicContact CE3-CD1 4.02Å; W74-L77 HydrophobicContact CZ3-CD1 4.21Å; L77-L81 HydrophobicContact CD1-CB 3.96Å; L77-M82 HydrophobicContact CD2-CE 4.14Å; L77-M82 HydrophobicContact CD2-SD 3.76Å; L77-A85 HydrophobicContact CD1-CB 3.68Å; L77-A85 HydrophobicContact CD2-CB 3.75Å; L77-A85 HydrophobicContact CG-CB 4.35Å
78	P	81.4	Confident	84.8	Confident	48 Å²	48	65.7 Å²	65.7	31%	0.312	32%	0.316	S	S	.	.			trans	-60.9	140.2	174.6	-23	33.5	0	0	0	111.5	I76 R80 L81	I76-P78 WeakPolarHBondContact O-CD 3.33Å; P78-R80 HydrophobicContact CB-CG 3.93Å; P78-R80 PolarHBondContact O-N 3.48Å; P78-R80 VanDerWaalsContact O-N 3.13Å; P78-L81 HydrophobicContact CB-CG 4.48Å; P78-L81 HydrophobicContact CG-CD1 4.31Å; P78-L81 WeakPolarHBondContact O-CA 3.42Å; P78-L81 WeakPolarHBondContact O-CB 3.41Å; P78-L81 PolarHBondContact O-N 3.3Å
79	T	80.7	Confident	85	Confident	90 Å²	90	64 Å²	64	55%	0.552	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-52.4	-38.6	178.6	-47.5	0	0	0	0	112.7	L81 M82 V118	T79-L81 PolarHBondContact O-N 2.92Å; T79-M82 WeakPolarHBondContact O-CB 3.35Å; T79-M82 PolarHBondContact O-N 3.49Å; T79-V118 HydrophobicContact CG2-CG1 4.41Å; T79-V118 VanDerWaalsContact CG2-O 3.3Å; T79-V118 WeakPolarHBondContact CG2-O 3.46Å
80	R	83.7	Confident	85.3	Confident	214 Å²	214	59.7 Å²	59.7	81%	0.808	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-59.5	-16.9	175.8	68.4	178	-177.8	-179.8	-0	115	P78	P78-R80 HydrophobicContact CB-CG 3.93Å; P78-R80 PolarHBondContact O-N 3.48Å; P78-R80 VanDerWaalsContact O-N 3.13Å
81	L	87.8	Confident	85.4	Confident	55 Å²	55	64.1 Å²	64.1	29%	0.288	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-102.6	0.6	176.5	-60.7	-173.6	0	0	0	112.1	F32 L77 P78 T79 Y83 A84 A85	F32-L81 HydrophobicContact CZ-CD1 4.43Å; L77-L81 HydrophobicContact CD1-CB 3.96Å; P78-L81 HydrophobicContact CB-CG 4.48Å; P78-L81 HydrophobicContact CG-CD1 4.31Å; P78-L81 WeakPolarHBondContact O-CA 3.42Å; P78-L81 WeakPolarHBondContact O-CB 3.41Å; P78-L81 PolarHBondContact O-N 3.3Å; T79-L81 PolarHBondContact O-N 2.92Å; L81-Y83 PolarHBondContact O-N 2.9Å; L81-A84 PolarHBondContact O-N 3.27Å; L81-A85 WeakPolarHBondContact O-CB 3.48Å; L81-A85 PolarHBondContact O-N 2.89Å
82	M	89.5	Confident	85.7	Confident	21 Å²	21	60.5 Å²	60.5	10%	0.103	30%	0.302	C	S	.	.	H	α-helix	trans	-59.5	-48	-173.2	-170.2	62.4	86.6	0	0	111.2	W67 L77 T79 A84 A85 C86 W113 V118 L119	W67-M82 HydrophobicContact CH2-SD 3.81Å; W67-M82 HydrophobicContact CZ2-CE 4.34Å; W67-M82 HydrophobicContact CZ2-SD 3.75Å; L77-M82 HydrophobicContact CD2-CE 4.14Å; L77-M82 HydrophobicContact CD2-SD 3.76Å; T79-M82 WeakPolarHBondContact O-CB 3.35Å; T79-M82 PolarHBondContact O-N 3.49Å; M82-A84 VanDerWaalsContact C-N 3.34Å; M82-A84 PolarHBondContact O-N 2.96Å; M82-A85 CarbonylContact O-C 3.54Å; M82-A85 PolarHBondContact O-N 3.48Å; M82-A85 VanDerWaalsContact O-N 3.13Å; M82-C86 PolarHBondContact O-N 3.4Å; M82-C86 PolarHBondContact O-SG 3.36Å; M82-W113 HydrophobicContact CG-CE3 4.43Å; M82-W113 HydrophobicContact SD-CE3 4.36Å; M82-W113 HydrophobicContact SD-CZ3 4.21Å; M82-V118 HydrophobicContact CE-CG1 3.33Å; M82-V118 HydrophobicContact CG-CG1 3.98Å; M82-V118 HydrophobicContact SD-CG1 4.45Å; M82-L119 HydrophobicContact CB-CD2 3.89Å; M82-L119 HydrophobicContact CG-CD2 3.64Å; M82-L119 HydrophobicContact CG-CG 4.06Å
83	Y	90.7	Very high	86.4	Confident	63 Å²	63	59 Å²	59	25%	0.247	30%	0.296	C	S	.	.	H	α-helix	trans	-54.8	-47.8	177.5	178.3	-94.1	0	0	0	112.9	L81 A85 C86 C87 D123 M126 L127	L81-Y83 PolarHBondContact O-N 2.9Å; Y83-A85 PolarHBondContact O-N 3.26Å; Y83-C86 WeakPolarHBondContact O-CB 3.42Å; Y83-C86 PolarHBondContact O-N 3.43Å; Y83-C87 PolarHBondContact O-N 3.08Å; Y83-C87 PolarHBondContact O-SG 3.33Å; Y83-C87 VanDerWaalsContact O-SG 3.33Å; Y83-D123 HydrophobicContact CD2-CB 3.82Å; Y83-D123 WeakPolarHBondContact CD2-OD1 3.43Å; Y83-M126 HydrophobicContact CE2-CB 4.19Å; Y83-M126 WeakPolarHBondContact OH-CE 3.36Å; Y83-L127 HydrophobicContact CD2-CD1 4.01Å; Y83-L127 HydrophobicContact CD2-CD2 4.03Å; Y83-L127 HydrophobicContact CD2-CG 3.82Å; Y83-L127 HydrophobicContact CE2-CD1 4.46Å; Y83-L127 HydrophobicContact CE2-CD2 3.87Å; Y83-L127 HydrophobicContact CE2-CG 3.77Å
84	A	90.8	Very high	87.2	Confident	56 Å²	56	55.3 Å²	55.3	46%	0.463	29%	0.285	S	S	.	.	H	α-helix	trans	-63.9	-41.9	178.7	0	0	0	0	0	111.6	L81 M82 C87 E88	L81-A84 PolarHBondContact O-N 3.27Å; M82-A84 VanDerWaalsContact C-N 3.34Å; M82-A84 PolarHBondContact O-N 2.96Å; A84-C87 WeakPolarHBondContact O-CB 3.34Å; A84-C87 PolarHBondContact O-N 3.47Å; A84-E88 PolarHBondContact O-N 2.84Å
85	A	91.9	Very high	88.3	Confident	1 Å²	1	61.2 Å²	61.2	1%	0.008	32%	0.315	C	S	.	.	H	α-helix	trans	-65.1	-37.2	176.7	0	0	0	0	0	112.5	W67 Y70 L77 L81 M82 Y83 E88 F89	W67-A85 HydrophobicContact CH2-CB 4.46Å; Y70-A85 HydrophobicContact CE1-CB 4.12Å; Y70-A85 WeakPolarHBondContact CE1-O 3.44Å; Y70-A85 PolarHBondContact OH-O 3.05Å; L77-A85 HydrophobicContact CD1-CB 3.68Å; L77-A85 HydrophobicContact CD2-CB 3.75Å; L77-A85 HydrophobicContact CG-CB 4.35Å; L81-A85 WeakPolarHBondContact O-CB 3.48Å; L81-A85 PolarHBondContact O-N 2.89Å; M82-A85 CarbonylContact O-C 3.54Å; M82-A85 PolarHBondContact O-N 3.48Å; M82-A85 VanDerWaalsContact O-N 3.13Å; Y83-A85 PolarHBondContact O-N 3.26Å; A85-E88 PolarHBondContact O-N 3.21Å; A85-F89 VanDerWaalsContact O-CB 3.29Å; A85-F89 WeakPolarHBondContact O-CB 3.37Å; A85-F89 PolarHBondContact O-N 2.93Å
86	C	93.4	Very high	89.6	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-63.6	-42.2	172.3	-61.5	0	0	0	0	111.6	M82 Y83 F89 L90 F110 W113 L127	M82-C86 PolarHBondContact O-N 3.4Å; M82-C86 PolarHBondContact O-SG 3.36Å; Y83-C86 WeakPolarHBondContact O-CB 3.42Å; Y83-C86 PolarHBondContact O-N 3.43Å; C86-F89 WeakPolarHBondContact O-CB 3.48Å; C86-F89 PolarHBondContact O-N 2.83Å; C86-L90 WeakPolarHBondContact O-CG 3.46Å; C86-L90 PolarHBondContact O-N 3.31Å; C86-F110 HydrophobicContact CB-CE1 3.79Å; C86-F110 HydrophobicContact CB-CZ 4.15Å; C86-W113 WeakPolarHBondContact SG-CZ3 3.25Å; C86-L127 HydrophobicContact CB-CD1 3.44Å; C86-L127 VanDerWaalsContact CB-CD1 3.44Å; C86-L127 HydrophobicContact CB-CD2 3.46Å; C86-L127 VanDerWaalsContact CB-CD2 3.46Å; C86-L127 HydrophobicContact CB-CG 4.08Å
87	C	92.6	Very high	90.5	Very high	13 Å²	13	53.4 Å²	53.4	9%	0.088	27%	0.27	C	S	.	.	H	α-helix	trans	-63.2	-42.7	177.4	-70.4	0	0	0	0	111.9	Y83 A84 L90 H91 L127	Y83-C87 PolarHBondContact O-N 3.08Å; Y83-C87 PolarHBondContact O-SG 3.33Å; Y83-C87 VanDerWaalsContact O-SG 3.33Å; A84-C87 WeakPolarHBondContact O-CB 3.34Å; A84-C87 PolarHBondContact O-N 3.47Å; C87-L90 PolarHBondContact O-N 3.3Å; C87-H91 PolarHBondContact O-N 2.81Å; C87-H91 VanDerWaalsContact O-N 3.14Å; C87-L127 VanDerWaalsContact SG-CD2 3.59Å
88	E	92.7	Very high	91.3	Very high	87 Å²	87	58.5 Å²	58.5	41%	0.407	29%	0.292	S	S	.	.	H	α-helix	trans	-67.1	-42.7	175.9	-176.8	179.5	173.7	0	0	111.4	Y70 W74 A84 A85 L90 H91 C92	Y70-E88 HydrophobicContact CE2-CB 4.39Å; Y70-E88 HydrophobicContact CE2-CG 3.96Å; Y70-E88 WeakPolarHBondContact OH-CB 3.24Å; Y70-E88 PolarHBondContact OH-OE2 3.23Å; W74-E88 WeakPolarHBondContact CZ2-OE2 3.38Å; A84-E88 PolarHBondContact O-N 2.84Å; A85-E88 PolarHBondContact O-N 3.21Å; E88-L90 VanDerWaalsContact C-N 3.34Å; E88-L90 PolarHBondContact O-N 3.24Å; E88-H91 PolarHBondContact O-N 3.49Å; E88-H91 VanDerWaalsContact O-N 3.1Å; E88-C92 PolarHBondContact O-N 3.23Å; E88-C92 PolarHBondContact O-SG 3.05Å; E88-C92 VanDerWaalsContact O-SG 3.4Å
89	F	94.5	Very high	91.9	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-54.2	-48.9	172.2	168.7	-101.1	0	0	0	111.9	L66 W67 Y70 A85 C86 H91 C92 Y93 I97 V106 M109	L66-F89 HydrophobicContact CB-CE2 3.96Å; L66-F89 HydrophobicContact CB-CZ 4.2Å; W67-F89 HydrophobicContact CB-CE2 4.43Å; W67-F89 HydrophobicContact CE3-CB 4.13Å; W67-F89 HydrophobicContact CE3-CD1 4.22Å; W67-F89 AromaticContact CE3-CD2 3.74Å; W67-F89 HydrophobicContact CE3-CD2 3.74Å; W67-F89 HydrophobicContact CE3-CE2 4.2Å; W67-F89 AromaticContact CE3-CG 3.75Å; W67-F89 HydrophobicContact CE3-CG 3.75Å; W67-F89 HydrophobicContact CZ3-CB 3.77Å; W67-F89 HydrophobicContact CZ3-CD1 4.41Å; W67-F89 HydrophobicContact CZ3-CD2 4.27Å; W67-F89 AromaticContact CZ3-CG 3.9Å; W67-F89 HydrophobicContact CZ3-CG 3.9Å; Y70-F89 HydrophobicContact CD1-CB 4.06Å; Y70-F89 HydrophobicContact CD1-CD2 4.28Å; Y70-F89 HydrophobicContact CD2-CB 4.34Å; Y70-F89 HydrophobicContact CD2-CD2 4.46Å; Y70-F89 HydrophobicContact CE1-CB 4.13Å; Y70-F89 HydrophobicContact CE2-CB 4.41Å; Y70-F89 HydrophobicContact CG-CB 4.17Å; Y70-F89 AromaticContact CG-CD2 3.92Å; Y70-F89 HydrophobicContact CG-CD2 3.92Å; A85-F89 VanDerWaalsContact O-CB 3.29Å; A85-F89 WeakPolarHBondContact O-CB 3.37Å; A85-F89 PolarHBondContact O-N 2.93Å; C86-F89 WeakPolarHBondContact O-CB 3.48Å; C86-F89 PolarHBondContact O-N 2.83Å; F89-H91 VanDerWaalsContact C-N 3.27Å; F89-H91 PolarHBondContact O-N 3.13Å; F89-C92 PolarHBondContact O-N 3.4Å; F89-Y93 AromaticContact CD2-CD2 3.48Å; F89-Y93 HydrophobicContact CD2-CD2 3.48Å; F89-Y93 VanDerWaalsContact CD2-CD2 3.48Å; F89-Y93 AromaticContact CD2-CE2 3.87Å; F89-Y93 HydrophobicContact CD2-CE2 3.87Å; F89-Y93 HydrophobicContact CD2-CG 4.41Å; F89-Y93 AromaticContact CE2-CD2 3.58Å; F89-Y93 HydrophobicContact CE2-CD2 3.58Å; F89-Y93 HydrophobicContact CE2-CE2 4.05Å; F89-Y93 HydrophobicContact CE2-CG 4.12Å; F89-Y93 HydrophobicContact CG-CD2 4.37Å; F89-Y93 WeakPolarHBondContact O-CD2 3.34Å; F89-Y93 PolarHBondContact O-N 2.86Å; F89-I97 HydrophobicContact CE1-CD1 4.24Å; F89-V106 HydrophobicContact CE1-CG1 4.45Å; F89-M109 HydrophobicContact CE1-CE 4.09Å
90	L	94.8	Very high	92.5	Very high	1 Å²	1	61.3 Å²	61.3	1%	0.005	31%	0.305	C	S	.	.	H	α-helix	trans	-59.3	-38.3	177.2	-72.6	176.6	0	0	0	112.1	C86 C87 E88 Q94 I97 V106 F110 L127 R130 M131 L134	C86-L90 WeakPolarHBondContact O-CG 3.46Å; C86-L90 PolarHBondContact O-N 3.31Å; C87-L90 PolarHBondContact O-N 3.3Å; E88-L90 VanDerWaalsContact C-N 3.34Å; E88-L90 PolarHBondContact O-N 3.24Å; L90-Q94 WeakPolarHBondContact O-CA 3.48Å; L90-Q94 VanDerWaalsContact O-CB 3.3Å; L90-Q94 WeakPolarHBondContact O-CB 3.46Å; L90-Q94 PolarHBondContact O-N 3.33Å; L90-Q94 VanDerWaalsContact O-N 3.08Å; L90-I97 HydrophobicContact CD2-CD1 4.08Å; L90-V106 HydrophobicContact CD2-CG1 3.88Å; L90-F110 HydrophobicContact CD1-CE2 4.08Å; L90-F110 HydrophobicContact CD1-CZ 4.14Å; L90-F110 HydrophobicContact CD2-CE2 4.08Å; L90-F110 HydrophobicContact CD2-CZ 4.02Å; L90-F110 HydrophobicContact CG-CE2 4.33Å; L90-F110 HydrophobicContact CG-CZ 4.04Å; L90-L127 HydrophobicContact CD1-CD2 4.38Å; L90-R130 HydrophobicContact CD1-CG 4.48Å; L90-M131 HydrophobicContact CD1-CB 3.98Å; L90-M131 HydrophobicContact CD2-CB 3.83Å; L90-M131 HydrophobicContact CD2-CG 3.75Å; L90-L134 HydrophobicContact CB-CD1 4.33Å
91	H	92.3	Very high	93	Very high	93 Å²	93	56.3 Å²	56.3	43%	0.431	29%	0.294	S	S	.	.	H	α-helix	trans	-72	-41.2	176.4	-75	-25.1	0	0	0	113	C87 E88 F89 Y93 R130	C87-H91 PolarHBondContact O-N 2.81Å; C87-H91 VanDerWaalsContact O-N 3.14Å; E88-H91 PolarHBondContact O-N 3.49Å; E88-H91 VanDerWaalsContact O-N 3.1Å; F89-H91 VanDerWaalsContact C-N 3.27Å; F89-H91 PolarHBondContact O-N 3.13Å; H91-Y93 VanDerWaalsContact C-N 3.35Å; H91-Y93 PolarHBondContact O-N 2.9Å; H91-R130 PolarHBondContact NE2-NH2 3.32Å
92	C	92.9	Very high	93.4	Very high	63 Å²	63	53.9 Å²	53.9	43%	0.426	28%	0.281	S	S	.	.	H	α-helix	trans	-67.1	-34.9	179.9	-71.4	0	0	0	0	113.1	E88 F89	E88-C92 PolarHBondContact O-N 3.23Å; E88-C92 PolarHBondContact O-SG 3.05Å; E88-C92 VanDerWaalsContact O-SG 3.4Å; F89-C92 PolarHBondContact O-N 3.4Å
93	Y	94.8	Very high	93.7	Very high	13 Å²	13	53.3 Å²	53.3	5%	0.051	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.1	14.2	-174	-64.6	-84.5	0	0	0	113.3	L66 E69 Y70 F89 H91 E95 T96 I97	L66-Y93 HydrophobicContact CB-CD1 4.37Å; L66-Y93 HydrophobicContact CB-CE1 4.45Å; L66-Y93 HydrophobicContact CD1-CD1 4.5Å; L66-Y93 HydrophobicContact CD2-CD1 3.71Å; L66-Y93 HydrophobicContact CD2-CE1 3.76Å; L66-Y93 HydrophobicContact CG-CD1 4.4Å; E69-Y93 WeakPolarHBondContact CG-OH 3.32Å; E69-Y93 PolarHBondContact OE1-OH 3.01Å; Y70-Y93 HydrophobicContact CD2-CE2 4.11Å; Y70-Y93 HydrophobicContact CG-CE2 4.33Å; Y70-Y93 PolarHBondContact N-OH 3.39Å; F89-Y93 AromaticContact CD2-CD2 3.48Å; F89-Y93 HydrophobicContact CD2-CD2 3.48Å; F89-Y93 VanDerWaalsContact CD2-CD2 3.48Å; F89-Y93 AromaticContact CD2-CE2 3.87Å; F89-Y93 HydrophobicContact CD2-CE2 3.87Å; F89-Y93 HydrophobicContact CD2-CG 4.41Å; F89-Y93 AromaticContact CE2-CD2 3.58Å; F89-Y93 HydrophobicContact CE2-CD2 3.58Å; F89-Y93 HydrophobicContact CE2-CE2 4.05Å; F89-Y93 HydrophobicContact CE2-CG 4.12Å; F89-Y93 HydrophobicContact CG-CD2 4.37Å; F89-Y93 WeakPolarHBondContact O-CD2 3.34Å; F89-Y93 PolarHBondContact O-N 2.86Å; H91-Y93 VanDerWaalsContact C-N 3.35Å; H91-Y93 PolarHBondContact O-N 2.9Å; Y93-E95 VanDerWaalsContact C-N 3.33Å; Y93-E95 PolarHBondContact O-N 2.97Å; Y93-T96 PolarHBondContact O-N 3.34Å; Y93-T96 VanDerWaalsContact O-N 3.14Å; Y93-I97 WeakPolarHBondContact O-CB 3.29Å; Y93-I97 VanDerWaalsContact O-CG1 3.25Å; Y93-I97 WeakPolarHBondContact O-CG1 3.4Å; Y93-I97 PolarHBondContact O-N 2.91Å
94	Q	94.3	Very high	93.9	Very high	65 Å²	65	57 Å²	57	30%	0.304	30%	0.296	S	S	.	.	H	α-helix	trans	-52.1	-48.5	-177.4	-173.8	179.7	-19	0	0	112.5	L90 I97 K98 L134	L90-Q94 WeakPolarHBondContact O-CA 3.48Å; L90-Q94 VanDerWaalsContact O-CB 3.3Å; L90-Q94 WeakPolarHBondContact O-CB 3.46Å; L90-Q94 PolarHBondContact O-N 3.33Å; L90-Q94 VanDerWaalsContact O-N 3.08Å; Q94-I97 PolarHBondContact O-N 2.89Å; Q94-K98 WeakPolarHBondContact O-CB 3.38Å; Q94-K98 PolarHBondContact O-N 3.03Å; Q94-L134 PolarHBondContact NE2-O 3.28Å
95	E	93.4	Very high	94.1	Very high	169 Å²	169	54.9 Å²	54.9	79%	0.79	28%	0.278	S	S	*	.	H	α-helix	trans	-65.5	-41.1	-179.4	-64.6	-175.3	166.9	0	0	112	Y93 K98 S99	Y93-E95 VanDerWaalsContact C-N 3.33Å; Y93-E95 PolarHBondContact O-N 2.97Å; E95-K98 PolarHBondContact O-N 3.38Å; E95-S99 VanDerWaalsContact O-CB 3.27Å; E95-S99 WeakPolarHBondContact O-CB 3.4Å; E95-S99 PolarHBondContact O-N 3.07Å; E95-S99 PolarHBondContact O-OG 3.33Å
96	T	95.1	Very high	94.3	Very high	42 Å²	42	54.8 Å²	54.8	26%	0.258	28%	0.277	S	S	.	.	H	α-helix	trans	-65	-46.2	176.8	-52.9	0	0	0	0	111.4	L66 Y93 K98 S99 Q100	L66-T96 HydrophobicContact CD1-CG2 3.89Å; L66-T96 HydrophobicContact CD2-CG2 4.12Å; Y93-T96 PolarHBondContact O-N 3.34Å; Y93-T96 VanDerWaalsContact O-N 3.14Å; T96-K98 VanDerWaalsContact C-N 3.31Å; T96-K98 PolarHBondContact O-N 3.12Å; T96-S99 WeakPolarHBondContact CA-OG 3.04Å; T96-S99 PolarHBondContact O-N 3.07Å; T96-S99 PolarHBondContact O-OG 3.44Å; T96-Q100 WeakPolarHBondContact O-CB 3.47Å; T96-Q100 PolarHBondContact O-N 3.39Å; T96-Q100 VanDerWaalsContact O-N 3.12Å
97	I	95.5	Very high	94.5	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-59.2	-46.2	178.1	-69.3	165	0	0	0	109.7	F89 L90 Y93 Q94 D101 L102 Q103 V106 C135	F89-I97 HydrophobicContact CE1-CD1 4.24Å; L90-I97 HydrophobicContact CD2-CD1 4.08Å; Y93-I97 WeakPolarHBondContact O-CB 3.29Å; Y93-I97 VanDerWaalsContact O-CG1 3.25Å; Y93-I97 WeakPolarHBondContact O-CG1 3.4Å; Y93-I97 PolarHBondContact O-N 2.91Å; Q94-I97 PolarHBondContact O-N 2.89Å; I97-D101 PolarHBondContact O-N 3.04Å; I97-L102 HydrophobicContact CG2-CB 4.27Å; I97-L102 PolarHBondContact O-N 3.01Å; I97-Q103 HydrophobicContact CG2-CG 4.09Å; I97-Q103 PolarHBondContact O-OE1 3.26Å; I97-V106 HydrophobicContact CD1-CG2 4.13Å; I97-V106 HydrophobicContact CG1-CG2 4.16Å; I97-V106 HydrophobicContact CG2-CG2 4.37Å; I97-C135 HydrophobicContact CG2-CB 4.35Å
98	K	94.1	Very high	94.6	Very high	135 Å²	135	59.6 Å²	59.6	59%	0.587	30%	0.3	S	S	*	.	H	α-helix	trans	-67.9	-46.2	179.8	-175.3	177	-178.5	178.4	0	113	Q94 E95 T96 Q100 D101 C135	Q94-K98 WeakPolarHBondContact O-CB 3.38Å; Q94-K98 PolarHBondContact O-N 3.03Å; E95-K98 PolarHBondContact O-N 3.38Å; T96-K98 VanDerWaalsContact C-N 3.31Å; T96-K98 PolarHBondContact O-N 3.12Å; K98-Q100 VanDerWaalsContact C-N 3.27Å; K98-Q100 PolarHBondContact O-N 2.95Å; K98-D101 PolarHBondContact O-N 3.3Å; K98-C135 WeakPolarHBondContact CD-O 3.27Å
99	S	94	Very high	94.7	Very high	94 Å²	94	56.6 Å²	56.6	66%	0.657	29%	0.287	S	S	*	.	H	α-helix	trans	-68.9	-25	-176	54.7	0	0	0	0	113.6	E95 T96	E95-S99 VanDerWaalsContact O-CB 3.27Å; E95-S99 WeakPolarHBondContact O-CB 3.4Å; E95-S99 PolarHBondContact O-N 3.07Å; E95-S99 PolarHBondContact O-OG 3.33Å; T96-S99 WeakPolarHBondContact CA-OG 3.04Å; T96-S99 PolarHBondContact O-N 3.07Å; T96-S99 PolarHBondContact O-OG 3.44Å
100	Q	94.7	Very high	94.7	Very high	103 Å²	103	56.6 Å²	56.6	48%	0.481	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108	9.7	-179	-62.5	-177.6	36.8	0	0	113.6	T96 K98 L102	T96-Q100 WeakPolarHBondContact O-CB 3.47Å; T96-Q100 PolarHBondContact O-N 3.39Å; T96-Q100 VanDerWaalsContact O-N 3.12Å; K98-Q100 VanDerWaalsContact C-N 3.27Å; K98-Q100 PolarHBondContact O-N 2.95Å; Q100-L102 VanDerWaalsContact C-N 3.31Å; Q100-L102 HydrophobicContact CB-CD1 4.01Å; Q100-L102 HydrophobicContact CB-CD2 4.13Å; Q100-L102 HydrophobicContact CB-CG 3.73Å; Q100-L102 PolarHBondContact O-N 3.38Å
101	D	94	Very high	94.6	Very high	108 Å²	108	58.4 Å²	58.4	58%	0.578	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	45.3	-179.8	-163.3	35.1	0	0	0	113.6	I97 K98 Q103	I97-D101 PolarHBondContact O-N 3.04Å; K98-D101 PolarHBondContact O-N 3.3Å; D101-Q103 VanDerWaalsContact CA-OE1 3.29Å
102	L	96.1	Very high	94.7	Very high	4 Å²	4	56.3 Å²	56.3	2%	0.021	30%	0.301	C	S	.	.			trans	-89.4	0.9	-174.6	-57.4	178.6	0	0	0	113.7	A59 T62 V63 L66 I97 Q100 K104 A105 V106	A59-L102 HydrophobicContact CB-CD2 3.92Å; T62-L102 HydrophobicContact CG2-CD1 3.75Å; T62-L102 HydrophobicContact CG2-CD2 4.35Å; V63-L102 HydrophobicContact CG2-CB 3.92Å; V63-L102 HydrophobicContact CG2-CD1 4.2Å; V63-L102 HydrophobicContact CG2-CG 4.44Å; L66-L102 HydrophobicContact CD1-CD1 3.81Å; I97-L102 HydrophobicContact CG2-CB 4.27Å; I97-L102 PolarHBondContact O-N 3.01Å; Q100-L102 VanDerWaalsContact C-N 3.31Å; Q100-L102 HydrophobicContact CB-CD1 4.01Å; Q100-L102 HydrophobicContact CB-CD2 4.13Å; Q100-L102 HydrophobicContact CB-CG 3.73Å; Q100-L102 PolarHBondContact O-N 3.38Å; L102-K104 VanDerWaalsContact C-N 3.32Å; L102-K104 PolarHBondContact O-N 2.75Å; L102-A105 PolarHBondContact O-N 3.32Å; L102-V106 HydrophobicContact CB-CG2 4.45Å; L102-V106 WeakPolarHBondContact O-CG2 3.26Å; L102-V106 PolarHBondContact O-N 3.42Å
103	Q	95.3	Very high	94.6	Very high	10 Å²	10	55.3 Å²	55.3	5%	0.047	29%	0.288	C	S	.	.	H	α-helix	trans	-54.8	-46.3	-172.1	-68.5	87.9	-47.8	0	0	111.7	I97 D101 A105 V106 A107 M131 Y132 C135 G136	I97-Q103 HydrophobicContact CG2-CG 4.09Å; I97-Q103 PolarHBondContact O-OE1 3.26Å; D101-Q103 VanDerWaalsContact CA-OE1 3.29Å; Q103-A105 PolarHBondContact O-N 2.97Å; Q103-V106 PolarHBondContact O-N 2.92Å; Q103-A107 WeakPolarHBondContact O-CB 3.48Å; Q103-A107 PolarHBondContact O-N 3.24Å; Q103-M131 HydrophobicContact CB-CE 3.82Å; Q103-M131 HydrophobicContact CB-SD 4.16Å; Q103-M131 HydrophobicContact CG-CE 4.45Å; Q103-M131 VanDerWaalsContact O-CE 3.31Å; Q103-M131 WeakPolarHBondContact O-CE 3.44Å; Q103-Y132 HydrophobicContact CB-CD1 4.16Å; Q103-Y132 HydrophobicContact CB-CE1 3.67Å; Q103-Y132 HydrophobicContact CG-CD1 4.43Å; Q103-Y132 HydrophobicContact CG-CE1 4.39Å; Q103-C135 HydrophobicContact CG-CB 3.82Å; Q103-G136 PolarHBondContact NE2-O 3.15Å
104	K	94.8	Very high	94.5	Very high	141 Å²	141	57.4 Å²	57.4	61%	0.613	30%	0.298	S	S	*	.	H	α-helix	trans	-60.8	-45.3	178.4	-174.3	178.7	177.7	-177.5	0	111.9	L102 V106 A107 E108	L102-K104 VanDerWaalsContact C-N 3.32Å; L102-K104 PolarHBondContact O-N 2.75Å; K104-V106 VanDerWaalsContact C-N 3.35Å; K104-V106 PolarHBondContact O-N 2.75Å; K104-A107 PolarHBondContact O-N 3.3Å; K104-E108 WeakPolarHBondContact CE-OE1 3.44Å; K104-E108 WeakPolarHBondContact O-CG 3.38Å; K104-E108 PolarHBondContact O-N 2.91Å
105	A	95.9	Very high	94.3	Very high	10 Å²	10	60.4 Å²	60.4	8%	0.083	32%	0.316	C	S	.	.	H	α-helix	trans	-66.6	-35.5	179.3	0	0	0	0	0	112.4	A59 V63 L102 Q103 M109	A59-A105 HydrophobicContact CB-CB 3.93Å; V63-A105 HydrophobicContact CG2-CB 3.73Å; L102-A105 PolarHBondContact O-N 3.32Å; Q103-A105 PolarHBondContact O-N 2.97Å; A105-M109 WeakPolarHBondContact O-CB 3.3Å; A105-M109 PolarHBondContact O-N 2.9Å
106	V	96.2	Very high	94.2	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-68.4	-40.1	173.7	173.9	0	0	0	0	111.1	V63 F89 L90 I97 L102 Q103 K104 M109 F110 M131	V63-V106 HydrophobicContact CB-CG2 4.47Å; V63-V106 HydrophobicContact CG1-CG2 3.93Å; V63-V106 HydrophobicContact CG2-CG2 3.63Å; F89-V106 HydrophobicContact CE1-CG1 4.45Å; L90-V106 HydrophobicContact CD2-CG1 3.88Å; I97-V106 HydrophobicContact CD1-CG2 4.13Å; I97-V106 HydrophobicContact CG1-CG2 4.16Å; I97-V106 HydrophobicContact CG2-CG2 4.37Å; L102-V106 HydrophobicContact CB-CG2 4.45Å; L102-V106 WeakPolarHBondContact O-CG2 3.26Å; L102-V106 PolarHBondContact O-N 3.42Å; Q103-V106 PolarHBondContact O-N 2.92Å; K104-V106 VanDerWaalsContact C-N 3.35Å; K104-V106 PolarHBondContact O-N 2.75Å; V106-M109 HydrophobicContact CG1-CE 4.5Å; V106-M109 WeakPolarHBondContact O-CB 3.32Å; V106-M109 PolarHBondContact O-N 3.21Å; V106-F110 HydrophobicContact CG1-CD2 4.18Å; V106-F110 HydrophobicContact CG1-CE2 3.54Å; V106-F110 HydrophobicContact CG1-CZ 3.8Å; V106-F110 WeakPolarHBondContact O-CD2 3.47Å; V106-F110 PolarHBondContact O-N 2.89Å; V106-F110 VanDerWaalsContact O-N 3.1Å; V106-M131 HydrophobicContact CB-SD 3.54Å; V106-M131 VanDerWaalsContact CB-SD 3.54Å; V106-M131 HydrophobicContact CG1-CG 4.09Å; V106-M131 HydrophobicContact CG1-SD 3.5Å; V106-M131 WeakPolarHBondContact CG1-SD 3.35Å
107	A	95.8	Very high	94	Very high	11 Å²	11	61.9 Å²	61.9	9%	0.091	33%	0.331	C	S	.	.	H	α-helix	trans	-63.6	-44.3	175.2	0	0	0	0	0	112.1	Q103 K104 M109 F110 A111 I128 M131 Y132	Q103-A107 WeakPolarHBondContact O-CB 3.48Å; Q103-A107 PolarHBondContact O-N 3.24Å; K104-A107 PolarHBondContact O-N 3.3Å; A107-M109 VanDerWaalsContact C-N 3.29Å; A107-M109 PolarHBondContact O-N 2.74Å; A107-F110 PolarHBondContact O-N 3.21Å; A107-A111 PolarHBondContact O-N 2.93Å; A107-I128 HydrophobicContact CB-CG1 4.07Å; A107-I128 HydrophobicContact CB-CG2 4.11Å; A107-M131 HydrophobicContact CB-CE 4Å; A107-M131 HydrophobicContact CB-SD 4.39Å; A107-Y132 HydrophobicContact CB-CE2 4.42Å
108	E	95	Very high	93.7	Very high	102 Å²	102	63.8 Å²	63.8	48%	0.477	34%	0.343	S	S	.	.	H	α-helix	trans	-60.5	-38	173.9	-73.7	172.7	-177.2	0	0	111.8	K104 A111 A112	K104-E108 WeakPolarHBondContact CE-OE1 3.44Å; K104-E108 WeakPolarHBondContact O-CG 3.38Å; K104-E108 PolarHBondContact O-N 2.91Å; E108-A111 PolarHBondContact O-N 3.46Å; E108-A112 WeakPolarHBondContact O-CB 3.4Å; E108-A112 PolarHBondContact O-N 2.89Å
109	M	94.9	Very high	93.5	Very high	25 Å²	25	57.8 Å²	57.8	12%	0.123	32%	0.317	C	S	.	.	H	α-helix	trans	-61.5	-45.5	174.4	-177.9	-173.7	70.9	0	0	112	V63 W67 F89 A105 V106 A107 A112 W113	V63-M109 HydrophobicContact CG1-CB 4.31Å; V63-M109 HydrophobicContact CG1-CE 4.18Å; V63-M109 HydrophobicContact CG1-SD 3.59Å; V63-M109 VanDerWaalsContact CG1-SD 3.59Å; W67-M109 HydrophobicContact CB-SD 4.29Å; W67-M109 HydrophobicContact CG-SD 4.46Å; F89-M109 HydrophobicContact CE1-CE 4.09Å; A105-M109 WeakPolarHBondContact O-CB 3.3Å; A105-M109 PolarHBondContact O-N 2.9Å; V106-M109 HydrophobicContact CG1-CE 4.5Å; V106-M109 WeakPolarHBondContact O-CB 3.32Å; V106-M109 PolarHBondContact O-N 3.21Å; A107-M109 VanDerWaalsContact C-N 3.29Å; A107-M109 PolarHBondContact O-N 2.74Å; M109-A112 PolarHBondContact O-N 3.15Å; M109-W113 HydrophobicContact CE-CH2 3.5Å; M109-W113 HydrophobicContact CE-CZ2 4.05Å; M109-W113 HydrophobicContact CE-CZ3 3.91Å; M109-W113 HydrophobicContact CG-CD2 4.39Å; M109-W113 HydrophobicContact CG-CH2 4.18Å; M109-W113 HydrophobicContact CG-CZ2 3.8Å; M109-W113 PolarHBondContact O-N 3.35Å; M109-W113 HydrophobicContact SD-CH2 3.69Å; M109-W113 HydrophobicContact SD-CZ2 3.59Å; M109-W113 VanDerWaalsContact SD-CZ2 3.59Å
110	F	94.9	Very high	93.4	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-66.2	-37.5	177.6	-64.1	-36.6	0	0	0	112.5	C86 L90 V106 A107 W113 H114 L119 L127 I128	C86-F110 HydrophobicContact CB-CE1 3.79Å; C86-F110 HydrophobicContact CB-CZ 4.15Å; L90-F110 HydrophobicContact CD1-CE2 4.08Å; L90-F110 HydrophobicContact CD1-CZ 4.14Å; L90-F110 HydrophobicContact CD2-CE2 4.08Å; L90-F110 HydrophobicContact CD2-CZ 4.02Å; L90-F110 HydrophobicContact CG-CE2 4.33Å; L90-F110 HydrophobicContact CG-CZ 4.04Å; V106-F110 HydrophobicContact CG1-CD2 4.18Å; V106-F110 HydrophobicContact CG1-CE2 3.54Å; V106-F110 HydrophobicContact CG1-CZ 3.8Å; V106-F110 WeakPolarHBondContact O-CD2 3.47Å; V106-F110 PolarHBondContact O-N 2.89Å; V106-F110 VanDerWaalsContact O-N 3.1Å; A107-F110 PolarHBondContact O-N 3.21Å; F110-W113 AromaticContact CD1-CE3 3.92Å; F110-W113 HydrophobicContact CD1-CE3 3.92Å; F110-W113 AromaticContact CD1-CZ3 3.88Å; F110-W113 HydrophobicContact CD1-CZ3 3.88Å; F110-W113 HydrophobicContact CE1-CE3 4.36Å; F110-W113 AromaticContact CE1-CZ3 3.86Å; F110-W113 HydrophobicContact CE1-CZ3 3.86Å; F110-W113 PolarHBondContact O-N 3.33Å; F110-H114 PolarHBondContact O-N 3.03Å; F110-L119 HydrophobicContact CD1-CD1 4.42Å; F110-L127 HydrophobicContact CD1-CD1 4.22Å; F110-L127 HydrophobicContact CD2-CB 3.72Å; F110-L127 HydrophobicContact CE1-CD1 4.33Å; F110-L127 HydrophobicContact CE2-CB 3.82Å; F110-L127 HydrophobicContact CG-CB 4.13Å; F110-L127 HydrophobicContact CG-CD1 4.46Å; F110-L127 HydrophobicContact CZ-CB 4.31Å; F110-I128 HydrophobicContact CB-CG1 4.17Å; F110-I128 HydrophobicContact CD2-CG1 4.17Å
111	A	93.4	Very high	93.3	Very high	38 Å²	38	55.9 Å²	55.9	31%	0.314	30%	0.303	S	S	.	.	H	α-helix	trans	-62.1	-46	172.5	0	0	0	0	0	111.5	A107 E108 W113 H114 D115	A107-A111 PolarHBondContact O-N 2.93Å; E108-A111 PolarHBondContact O-N 3.46Å; A111-W113 VanDerWaalsContact C-N 3.26Å; A111-W113 PolarHBondContact O-N 3.43Å; A111-H114 WeakPolarHBondContact O-CA 3.44Å; A111-H114 WeakPolarHBondContact O-CB 3.28Å; A111-H114 PolarHBondContact O-N 3.03Å; A111-D115 PolarHBondContact O-N 3.08Å
112	A	93.2	Very high	93.3	Very high	50 Å²	50	57.8 Å²	57.8	41%	0.413	31%	0.309	S	S	.	.	H	α-helix	trans	-62.3	-32.5	177	0	0	0	0	0	112.9	E108 M109 D115 A116	E108-A112 WeakPolarHBondContact O-CB 3.4Å; E108-A112 PolarHBondContact O-N 2.89Å; M109-A112 PolarHBondContact O-N 3.15Å; A112-D115 PolarHBondContact O-N 3.12Å; A112-A116 WeakPolarHBondContact O-CB 3.46Å; A112-A116 PolarHBondContact O-N 3.01Å
113	W	92	Very high	93.1	Very high	41 Å²	41	60 Å²	60	16%	0.155	32%	0.321	C	S	.	.	H	α-helix	trans	-73.2	-28.2	173.5	-74.3	-4.8	0	0	0	113.6	W67 M82 C86 M109 F110 A111 E117 V118 L119	W67-W113 AromaticContact CD1-CZ2 3.88Å; W67-W113 AromaticContact CD2-CH2 3.38Å; W67-W113 HydrophobicContact CD2-CH2 3.38Å; W67-W113 AromaticContact CD2-CZ2 3.8Å; W67-W113 HydrophobicContact CD2-CZ2 3.8Å; W67-W113 AromaticContact CE2-CH2 3.22Å; W67-W113 AromaticContact CE2-CZ2 3.47Å; W67-W113 VanDerWaalsContact CE2-CZ2 3.47Å; W67-W113 AromaticContact CE3-CH2 3.58Å; W67-W113 HydrophobicContact CE3-CH2 3.58Å; W67-W113 HydrophobicContact CE3-CZ2 4.43Å; W67-W113 HydrophobicContact CE3-CZ3 4.43Å; W67-W113 HydrophobicContact CG-CH2 4.05Å; W67-W113 HydrophobicContact CG-CZ2 4.03Å; W67-W113 AromaticContact CH2-CH2 3.46Å; W67-W113 HydrophobicContact CH2-CH2 3.46Å; W67-W113 VanDerWaalsContact CH2-CH2 3.46Å; W67-W113 HydrophobicContact CH2-CZ2 4.44Å; W67-W113 AromaticContact CH2-CZ3 3.79Å; W67-W113 HydrophobicContact CH2-CZ3 3.79Å; W67-W113 AromaticContact CZ2-CH2 3.28Å; W67-W113 HydrophobicContact CZ2-CH2 3.28Å; W67-W113 AromaticContact CZ2-CZ2 3.83Å; W67-W113 HydrophobicContact CZ2-CZ2 3.83Å; W67-W113 AromaticContact CZ2-CZ3 3.92Å; W67-W113 HydrophobicContact CZ2-CZ3 3.92Å; W67-W113 AromaticContact CZ3-CH2 3.61Å; W67-W113 HydrophobicContact CZ3-CH2 3.61Å; W67-W113 HydrophobicContact CZ3-CZ3 4.06Å; W67-W113 AromaticContact NE1-CH2 3.8Å; W67-W113 AromaticContact NE1-CZ2 3.52Å; M82-W113 HydrophobicContact CG-CE3 4.43Å; M82-W113 HydrophobicContact SD-CE3 4.36Å; M82-W113 HydrophobicContact SD-CZ3 4.21Å; C86-W113 WeakPolarHBondContact SG-CZ3 3.25Å; M109-W113 HydrophobicContact CE-CH2 3.5Å; M109-W113 HydrophobicContact CE-CZ2 4.05Å; M109-W113 HydrophobicContact CE-CZ3 3.91Å; M109-W113 HydrophobicContact CG-CD2 4.39Å; M109-W113 HydrophobicContact CG-CH2 4.18Å; M109-W113 HydrophobicContact CG-CZ2 3.8Å; M109-W113 PolarHBondContact O-N 3.35Å; M109-W113 HydrophobicContact SD-CH2 3.69Å; M109-W113 HydrophobicContact SD-CZ2 3.59Å; M109-W113 VanDerWaalsContact SD-CZ2 3.59Å; F110-W113 AromaticContact CD1-CE3 3.92Å; F110-W113 HydrophobicContact CD1-CE3 3.92Å; F110-W113 AromaticContact CD1-CZ3 3.88Å; F110-W113 HydrophobicContact CD1-CZ3 3.88Å; F110-W113 HydrophobicContact CE1-CE3 4.36Å; F110-W113 AromaticContact CE1-CZ3 3.86Å; F110-W113 HydrophobicContact CE1-CZ3 3.86Å; F110-W113 PolarHBondContact O-N 3.33Å; A111-W113 VanDerWaalsContact C-N 3.26Å; A111-W113 PolarHBondContact O-N 3.43Å; W113-E117 PolarHBondContact O-N 3.23Å; W113-V118 HydrophobicContact CB-CB 4.19Å; W113-V118 WeakPolarHBondContact O-CA 3.25Å; W113-V118 WeakPolarHBondContact O-CB 3.26Å; W113-V118 PolarHBondContact O-N 2.72Å; W113-L119 HydrophobicContact CB-CD1 3.99Å; W113-L119 HydrophobicContact CB-CG 4.24Å; W113-L119 HydrophobicContact CE3-CD1 3.95Å; W113-L119 PolarHBondContact O-N 3.29Å; W113-L119 VanDerWaalsContact O-N 3.13Å
114	H	91.4	Very high	93.1	Very high	58 Å²	58	59.6 Å²	59.6	27%	0.269	32%	0.319	S	S	.	.	H	α-helix	trans	-66.1	-48	167.3	170.7	47	0	0	0	110.9	F110 A111 A116 E117 L119 H121 A124	F110-H114 PolarHBondContact O-N 3.03Å; A111-H114 WeakPolarHBondContact O-CA 3.44Å; A111-H114 WeakPolarHBondContact O-CB 3.28Å; A111-H114 PolarHBondContact O-N 3.03Å; H114-A116 PolarHBondContact O-N 3.42Å; H114-E117 WeakPolarHBondContact O-CA 3.47Å; H114-E117 PolarHBondContact O-N 2.94Å; H114-L119 WeakPolarHBondContact CA-O 3.37Å; H114-L119 PolarHBondContact ND1-O 3.49Å; H114-H121 AromaticContact CD2-ND1 3.58Å; H114-H121 VanDerWaalsContact CE1-CB 3.48Å; H114-H121 WeakPolarHBondContact CE1-CB 3.38Å; H114-H121 AromaticContact CE1-ND1 3.97Å; H114-H121 PolarHBondContact ND1-N 3.38Å; H114-H121 AromaticContact NE2-CG 3.8Å; H114-H121 AromaticContact NE2-ND1 3.19Å; H114-H121 PolarHBondContact NE2-ND1 3.01Å; H114-H121 VanDerWaalsContact NE2-ND1 3.19Å; H114-A124 HydrophobicContact CB-CB 3.85Å
115	D	91.1	Very high	93.1	Very high	128 Å²	128	57.3 Å²	57.3	68%	0.684	31%	0.31	S	S	*	.	H	α-helix	trans	-60.3	-31.3	178.7	-64.6	-19.5	0	0	0	112.4	A111 A112 E117	A111-D115 PolarHBondContact O-N 3.08Å; A112-D115 PolarHBondContact O-N 3.12Å; D115-E117 VanDerWaalsContact C-N 3.27Å; D115-E117 PolarHBondContact O-N 3.41Å
116	A	91.6	Very high	93	Very high	64 Å²	64	61.7 Å²	61.7	53%	0.529	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	9.9	175.4	0	0	0	0	0	114.2	A112 H114 V118	A112-A116 WeakPolarHBondContact O-CB 3.46Å; A112-A116 PolarHBondContact O-N 3.01Å; H114-A116 PolarHBondContact O-N 3.42Å; A116-V118 HydrophobicContact CB-CG2 4.01Å; A116-V118 PolarHBondContact O-N 3.08Å; A116-V118 VanDerWaalsContact O-N 3.15Å
117	E	90.3	Very high	93	Very high	177 Å²	177	61.7 Å²	61.7	83%	0.827	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.2	24.2	-179.3	-55.4	-177.3	166.3	0	0	114.3	W113 H114 D115	W113-E117 PolarHBondContact O-N 3.23Å; H114-E117 WeakPolarHBondContact O-CA 3.47Å; H114-E117 PolarHBondContact O-N 2.94Å; D115-E117 VanDerWaalsContact C-N 3.27Å; D115-E117 PolarHBondContact O-N 3.41Å
118	V	89.6	Confident	92.9	Very high	41 Å²	41	62.3 Å²	62.3	25%	0.248	33%	0.332	C	S	.	.	S	Bend	trans	-86.9	-32.2	177.2	-175.1	0	0	0	0	111.2	T79 M82 W113 A116	T79-V118 HydrophobicContact CG2-CG1 4.41Å; T79-V118 VanDerWaalsContact CG2-O 3.3Å; T79-V118 WeakPolarHBondContact CG2-O 3.46Å; M82-V118 HydrophobicContact CE-CG1 3.33Å; M82-V118 HydrophobicContact CG-CG1 3.98Å; M82-V118 HydrophobicContact SD-CG1 4.45Å; W113-V118 HydrophobicContact CB-CB 4.19Å; W113-V118 WeakPolarHBondContact O-CA 3.25Å; W113-V118 WeakPolarHBondContact O-CB 3.26Å; W113-V118 PolarHBondContact O-N 2.72Å; A116-V118 HydrophobicContact CB-CG2 4.01Å; A116-V118 PolarHBondContact O-N 3.08Å; A116-V118 VanDerWaalsContact O-N 3.15Å
119	L	89.2	Confident	92.9	Very high	9 Å²	9	62 Å²	62	5%	0.047	34%	0.337	C	S	.	.	S	Bend	trans	-121.3	147.6	174	-72.1	173.7	0	0	0	110.3	M82 F110 W113 H114 D123 A124 L127	M82-L119 HydrophobicContact CB-CD2 3.89Å; M82-L119 HydrophobicContact CG-CD2 3.64Å; M82-L119 HydrophobicContact CG-CG 4.06Å; F110-L119 HydrophobicContact CD1-CD1 4.42Å; W113-L119 HydrophobicContact CB-CD1 3.99Å; W113-L119 HydrophobicContact CB-CG 4.24Å; W113-L119 HydrophobicContact CE3-CD1 3.95Å; W113-L119 PolarHBondContact O-N 3.29Å; W113-L119 VanDerWaalsContact O-N 3.13Å; H114-L119 WeakPolarHBondContact CA-O 3.37Å; H114-L119 PolarHBondContact ND1-O 3.49Å; L119-D123 HydrophobicContact CB-CB 4.48Å; L119-D123 HydrophobicContact CD2-CB 4.17Å; L119-A124 HydrophobicContact CB-CB 4.46Å; L119-A124 HydrophobicContact CD1-CB 4.47Å; L119-L127 HydrophobicContact CD1-CD1 3.7Å; L119-L127 HydrophobicContact CD2-CD1 4.27Å
120	S	91.3	Very high	92.8	Very high	52 Å²	52	65.1 Å²	65.1	36%	0.364	35%	0.347	S	S	.	.			trans	-67.3	158.6	165.4	74	0	0	0	0	110.2	E122 D123 A124	S120-E122 VanDerWaalsContact C-N 3.27Å; S120-E122 PolarHBondContact O-N 3.13Å; S120-D123 PolarHBondContact O-N 3.46Å; S120-D123 VanDerWaalsContact OG-CB 3.3Å; S120-D123 WeakPolarHBondContact OG-CB 3.5Å; S120-D123 PolarHBondContact OG-N 2.86Å; S120-D123 VanDerWaalsContact OG-N 3.07Å; S120-D123 PolarHBondContact OG-OD2 2.86Å; S120-A124 PolarHBondContact O-N 2.85Å
121	H	92.6	Very high	92.8	Very high	104 Å²	104	65.1 Å²	65.1	48%	0.481	35%	0.347	S	S	.	.	H	α-helix	trans	-56.6	-44.7	175.6	-174.3	76	0	0	0	111.5	H114 A124 Q125	H114-H121 AromaticContact CD2-ND1 3.58Å; H114-H121 VanDerWaalsContact CE1-CB 3.48Å; H114-H121 WeakPolarHBondContact CE1-CB 3.38Å; H114-H121 AromaticContact CE1-ND1 3.97Å; H114-H121 PolarHBondContact ND1-N 3.38Å; H114-H121 AromaticContact NE2-CG 3.8Å; H114-H121 AromaticContact NE2-ND1 3.19Å; H114-H121 PolarHBondContact NE2-ND1 3.01Å; H114-H121 VanDerWaalsContact NE2-ND1 3.19Å; H121-A124 PolarHBondContact O-N 2.97Å; H121-Q125 WeakPolarHBondContact O-CG 3.31Å; H121-Q125 PolarHBondContact O-N 2.99Å
122	E	94.1	Very high	92.8	Very high	149 Å²	149	66.3 Å²	66.3	70%	0.696	34%	0.344	S	S	*	.	H	α-helix	trans	-61.8	-46.8	179.5	-64.9	178.6	-177.7	0	0	111.4	S120 A124 Q125 M126	S120-E122 VanDerWaalsContact C-N 3.27Å; S120-E122 PolarHBondContact O-N 3.13Å; E122-A124 PolarHBondContact O-N 2.93Å; E122-Q125 PolarHBondContact O-N 2.81Å; E122-M126 WeakPolarHBondContact O-CB 3.42Å; E122-M126 WeakPolarHBondContact O-CG 3.5Å; E122-M126 PolarHBondContact O-N 3.29Å
123	D	93.1	Very high	92.7	Very high	51 Å²	51	68.8 Å²	68.8	27%	0.273	36%	0.358	S	S	.	.	H	α-helix	trans	-60.5	-44.8	178.2	-73.6	-39.6	0	0	0	111.7	Y83 L119 S120 M126 L127	Y83-D123 HydrophobicContact CD2-CB 3.82Å; Y83-D123 WeakPolarHBondContact CD2-OD1 3.43Å; L119-D123 HydrophobicContact CB-CB 4.48Å; L119-D123 HydrophobicContact CD2-CB 4.17Å; S120-D123 PolarHBondContact O-N 3.46Å; S120-D123 VanDerWaalsContact OG-CB 3.3Å; S120-D123 WeakPolarHBondContact OG-CB 3.5Å; S120-D123 PolarHBondContact OG-N 2.86Å; S120-D123 VanDerWaalsContact OG-N 3.07Å; S120-D123 PolarHBondContact OG-OD2 2.86Å; D123-M126 PolarHBondContact O-N 3.11Å; D123-L127 WeakPolarHBondContact O-CB 3.48Å; D123-L127 VanDerWaalsContact O-CG 3.23Å; D123-L127 WeakPolarHBondContact O-CG 3.27Å; D123-L127 PolarHBondContact O-N 2.86Å
124	A	94.3	Very high	92.5	Very high	1 Å²	1	69 Å²	69	1%	0.008	36%	0.363	C	S	.	.	H	α-helix	trans	-62.2	-46.3	179	0	0	0	0	0	111.6	H114 L119 S120 H121 E122 M126 L127 I128	H114-A124 HydrophobicContact CB-CB 3.85Å; L119-A124 HydrophobicContact CB-CB 4.46Å; L119-A124 HydrophobicContact CD1-CB 4.47Å; S120-A124 PolarHBondContact O-N 2.85Å; H121-A124 PolarHBondContact O-N 2.97Å; E122-A124 PolarHBondContact O-N 2.93Å; A124-M126 PolarHBondContact O-N 3.19Å; A124-L127 PolarHBondContact O-N 2.85Å; A124-I128 VanDerWaalsContact O-CG1 3.27Å; A124-I128 WeakPolarHBondContact O-CG1 3.29Å; A124-I128 PolarHBondContact O-N 3.03Å
125	Q	94.4	Very high	92.3	Very high	92 Å²	92	66.4 Å²	66.4	43%	0.43	35%	0.351	S	S	.	.	H	α-helix	trans	-63.6	-40.4	177.2	-69.7	-58.7	-34.7	0	0	112.5	H121 E122 I128 T129	H121-Q125 WeakPolarHBondContact O-CG 3.31Å; H121-Q125 PolarHBondContact O-N 2.99Å; E122-Q125 PolarHBondContact O-N 2.81Å; Q125-I128 PolarHBondContact O-N 2.88Å; Q125-T129 WeakPolarHBondContact O-CB 3.5Å; Q125-T129 PolarHBondContact O-N 2.87Å; Q125-T129 PolarHBondContact O-OG1 3.13Å
126	M	94.6	Very high	91.6	Very high	102 Å²	102	61.9 Å²	61.9	50%	0.502	33%	0.334	S	S	.	.	H	α-helix	trans	-63.2	-40.8	175	-76.5	-177.8	58.8	0	0	112	Y83 E122 D123 A124 T129 R130	Y83-M126 HydrophobicContact CE2-CB 4.19Å; Y83-M126 WeakPolarHBondContact OH-CE 3.36Å; E122-M126 WeakPolarHBondContact O-CB 3.42Å; E122-M126 WeakPolarHBondContact O-CG 3.5Å; E122-M126 PolarHBondContact O-N 3.29Å; D123-M126 PolarHBondContact O-N 3.11Å; A124-M126 PolarHBondContact O-N 3.19Å; M126-T129 PolarHBondContact O-N 2.73Å; M126-R130 VanDerWaalsContact O-CB 3.24Å; M126-R130 WeakPolarHBondContact O-CB 3.19Å; M126-R130 PolarHBondContact O-N 2.99Å
127	L	95.2	Very high	90.2	Very high	0 Å²	0	63 Å²	63	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-66.1	-41.6	176.8	-73.6	168.3	0	0	0	112.3	Y83 C86 C87 L90 F110 L119 D123 A124 R130 M131	Y83-L127 HydrophobicContact CD2-CD1 4.01Å; Y83-L127 HydrophobicContact CD2-CD2 4.03Å; Y83-L127 HydrophobicContact CD2-CG 3.82Å; Y83-L127 HydrophobicContact CE2-CD1 4.46Å; Y83-L127 HydrophobicContact CE2-CD2 3.87Å; Y83-L127 HydrophobicContact CE2-CG 3.77Å; C86-L127 HydrophobicContact CB-CD1 3.44Å; C86-L127 VanDerWaalsContact CB-CD1 3.44Å; C86-L127 HydrophobicContact CB-CD2 3.46Å; C86-L127 VanDerWaalsContact CB-CD2 3.46Å; C86-L127 HydrophobicContact CB-CG 4.08Å; C87-L127 VanDerWaalsContact SG-CD2 3.59Å; L90-L127 HydrophobicContact CD1-CD2 4.38Å; F110-L127 HydrophobicContact CD1-CD1 4.22Å; F110-L127 HydrophobicContact CD2-CB 3.72Å; F110-L127 HydrophobicContact CE1-CD1 4.33Å; F110-L127 HydrophobicContact CE2-CB 3.82Å; F110-L127 HydrophobicContact CG-CB 4.13Å; F110-L127 HydrophobicContact CG-CD1 4.46Å; F110-L127 HydrophobicContact CZ-CB 4.31Å; L119-L127 HydrophobicContact CD1-CD1 3.7Å; L119-L127 HydrophobicContact CD2-CD1 4.27Å; D123-L127 WeakPolarHBondContact O-CB 3.48Å; D123-L127 VanDerWaalsContact O-CG 3.23Å; D123-L127 WeakPolarHBondContact O-CG 3.27Å; D123-L127 PolarHBondContact O-N 2.86Å; A124-L127 PolarHBondContact O-N 2.85Å; L127-R130 PolarHBondContact O-N 3.22Å; L127-M131 WeakPolarHBondContact O-CB 3.5Å; L127-M131 PolarHBondContact O-N 2.86Å
128	I	95	Very high	88	Confident	24 Å²	24	57.9 Å²	57.9	12%	0.123	31%	0.313	C	S	.	.	H	α-helix	trans	-61.3	-48	175.1	-68	165.4	0	0	0	110.4	A107 F110 A124 Q125 R130 M131 Y132	A107-I128 HydrophobicContact CB-CG1 4.07Å; A107-I128 HydrophobicContact CB-CG2 4.11Å; F110-I128 HydrophobicContact CB-CG1 4.17Å; F110-I128 HydrophobicContact CD2-CG1 4.17Å; A124-I128 VanDerWaalsContact O-CG1 3.27Å; A124-I128 WeakPolarHBondContact O-CG1 3.29Å; A124-I128 PolarHBondContact O-N 3.03Å; Q125-I128 PolarHBondContact O-N 2.88Å; I128-R130 VanDerWaalsContact C-N 3.33Å; I128-R130 PolarHBondContact O-N 3.47Å; I128-M131 WeakPolarHBondContact O-CB 3.3Å; I128-M131 PolarHBondContact O-N 3.42Å; I128-Y132 HydrophobicContact CG2-CD2 3.81Å; I128-Y132 HydrophobicContact CG2-CE2 3.67Å; I128-Y132 WeakPolarHBondContact O-CD2 3.48Å; I128-Y132 PolarHBondContact O-N 3.19Å
129	T	94.4	Very high	85.3	Confident	95 Å²	95	62.7 Å²	62.7	58%	0.583	34%	0.342	S	S	*	.	H	α-helix	trans	-59.7	-45.4	177.2	-58.2	0	0	0	0	111.1	Q125 M126 M131 Y132 S133	Q125-T129 WeakPolarHBondContact O-CB 3.5Å; Q125-T129 PolarHBondContact O-N 2.87Å; Q125-T129 PolarHBondContact O-OG1 3.13Å; M126-T129 PolarHBondContact O-N 2.73Å; T129-M131 PolarHBondContact O-N 3.31Å; T129-Y132 PolarHBondContact O-N 3.3Å; T129-S133 WeakPolarHBondContact O-CB 3.45Å; T129-S133 PolarHBondContact O-N 3.2Å
130	R	93.3	Very high	82.8	Confident	91 Å²	91	72.9 Å²	72.9	34%	0.343	40%	0.395	S	S	.	.	H	α-helix	trans	-61.4	-44.6	177.2	-173.9	-179.5	-173.9	114.6	1.6	111.5	L90 H91 M126 L127 I128 S133 L134	L90-R130 HydrophobicContact CD1-CG 4.48Å; H91-R130 PolarHBondContact NE2-NH2 3.32Å; M126-R130 VanDerWaalsContact O-CB 3.24Å; M126-R130 WeakPolarHBondContact O-CB 3.19Å; M126-R130 PolarHBondContact O-N 2.99Å; L127-R130 PolarHBondContact O-N 3.22Å; I128-R130 VanDerWaalsContact C-N 3.33Å; I128-R130 PolarHBondContact O-N 3.47Å; R130-S133 PolarHBondContact O-N 2.8Å; R130-L134 HydrophobicContact CG-CD1 3.76Å; R130-L134 HydrophobicContact CG-CG 4.28Å; R130-L134 WeakPolarHBondContact O-CB 3.36Å; R130-L134 VanDerWaalsContact O-CG 3.26Å; R130-L134 WeakPolarHBondContact O-CG 3.48Å; R130-L134 PolarHBondContact O-N 2.85Å
131	M	94.7	Very high	82.3	Confident	0 Å²	0	74 Å²	74	0%	0	40%	0.396	C	S	.	.	H	α-helix	trans	-58.8	-49.2	178.2	177.3	-150.1	68.4	0	0	111.1	L90 Q103 V106 A107 L127 I128 T129 S133 L134 C135	L90-M131 HydrophobicContact CD1-CB 3.98Å; L90-M131 HydrophobicContact CD2-CB 3.83Å; L90-M131 HydrophobicContact CD2-CG 3.75Å; Q103-M131 HydrophobicContact CB-CE 3.82Å; Q103-M131 HydrophobicContact CB-SD 4.16Å; Q103-M131 HydrophobicContact CG-CE 4.45Å; Q103-M131 VanDerWaalsContact O-CE 3.31Å; Q103-M131 WeakPolarHBondContact O-CE 3.44Å; V106-M131 HydrophobicContact CB-SD 3.54Å; V106-M131 VanDerWaalsContact CB-SD 3.54Å; V106-M131 HydrophobicContact CG1-CG 4.09Å; V106-M131 HydrophobicContact CG1-SD 3.5Å; V106-M131 WeakPolarHBondContact CG1-SD 3.35Å; A107-M131 HydrophobicContact CB-CE 4Å; A107-M131 HydrophobicContact CB-SD 4.39Å; L127-M131 WeakPolarHBondContact O-CB 3.5Å; L127-M131 PolarHBondContact O-N 2.86Å; I128-M131 WeakPolarHBondContact O-CB 3.3Å; I128-M131 PolarHBondContact O-N 3.42Å; T129-M131 PolarHBondContact O-N 3.31Å; M131-S133 VanDerWaalsContact C-N 3.33Å; M131-S133 PolarHBondContact O-N 3.28Å; M131-L134 PolarHBondContact O-N 3.08Å; M131-C135 WeakPolarHBondContact O-CB 3.48Å; M131-C135 PolarHBondContact O-N 3.27Å; M131-C135 PolarHBondContact O-SG 3.15Å
132	Y	93	Very high	81.8	Confident	64 Å²	64	72.4 Å²	72.4	25%	0.251	39%	0.392	S	S	.	.	H	α-helix	trans	-67.1	-33.4	178.3	-75	-55.3	0	0	0	113.1	Q103 A107 I128 T129 G136 N137	Q103-Y132 HydrophobicContact CB-CD1 4.16Å; Q103-Y132 HydrophobicContact CB-CE1 3.67Å; Q103-Y132 HydrophobicContact CG-CD1 4.43Å; Q103-Y132 HydrophobicContact CG-CE1 4.39Å; A107-Y132 HydrophobicContact CB-CE2 4.42Å; I128-Y132 HydrophobicContact CG2-CD2 3.81Å; I128-Y132 HydrophobicContact CG2-CE2 3.67Å; I128-Y132 WeakPolarHBondContact O-CD2 3.48Å; I128-Y132 PolarHBondContact O-N 3.19Å; T129-Y132 PolarHBondContact O-N 3.3Å; Y132-G136 CarbonylContact O-C 3.5Å; Y132-G136 WeakPolarHBondContact O-CA 3.09Å; Y132-G136 PolarHBondContact O-N 3.13Å; Y132-N137 HydrophobicContact CD1-CB 4.31Å; Y132-N137 VanDerWaalsContact CD1-ND2 3.34Å; Y132-N137 WeakPolarHBondContact CD1-ND2 3.19Å; Y132-N137 WeakPolarHBondContact CD1-OD1 3.38Å; Y132-N137 WeakPolarHBondContact CE1-OD1 3.49Å
133	S	91	Very high	81.1	Confident	102 Å²	102	68.1 Å²	68.1	71%	0.713	38%	0.375	S	S	*	.	H	α-helix	trans	-66.6	-38.1	172.9	178.5	0	0	0	0	112.6	T129 R130 M131	T129-S133 WeakPolarHBondContact O-CB 3.45Å; T129-S133 PolarHBondContact O-N 3.2Å; R130-S133 PolarHBondContact O-N 2.8Å; M131-S133 VanDerWaalsContact C-N 3.33Å; M131-S133 PolarHBondContact O-N 3.28Å
134	L	88.8	Confident	80.4	Confident	46 Å²	46	69.1 Å²	69.1	24%	0.241	38%	0.381	C	S	.	.	H	α-helix	trans	-80.5	-44.8	-178.7	-71.5	172.3	0	0	0	113.3	L90 Q94 R130 M131	L90-L134 HydrophobicContact CB-CD1 4.33Å; Q94-L134 PolarHBondContact NE2-O 3.28Å; R130-L134 HydrophobicContact CG-CD1 3.76Å; R130-L134 HydrophobicContact CG-CG 4.28Å; R130-L134 WeakPolarHBondContact O-CB 3.36Å; R130-L134 VanDerWaalsContact O-CG 3.26Å; R130-L134 WeakPolarHBondContact O-CG 3.48Å; R130-L134 PolarHBondContact O-N 2.85Å; M131-L134 PolarHBondContact O-N 3.08Å
135	C	87.7	Confident	79.5	Confident	3 Å²	3	73.4 Å²	73.4	2%	0.02	40%	0.404	C	S	.	.	H	α-helix	trans	-89.2	-15.3	-173.6	-56	0	0	0	0	112.1	I97 K98 Q103 M131	I97-C135 HydrophobicContact CG2-CB 4.35Å; K98-C135 WeakPolarHBondContact CD-O 3.27Å; Q103-C135 HydrophobicContact CG-CB 3.82Å; M131-C135 WeakPolarHBondContact O-CB 3.48Å; M131-C135 PolarHBondContact O-N 3.27Å; M131-C135 PolarHBondContact O-SG 3.15Å
136	G	75.9	Confident	78.6	Confident	32 Å²	32	72.1 Å²	72.1	33%	0.33	40%	0.402	S	S	.	.			trans	76.9	144.8	-166	0	0	0	0	0	110.8	Q103 Y132	Q103-G136 PolarHBondContact NE2-O 3.15Å; Y132-G136 CarbonylContact O-C 3.5Å; Y132-G136 WeakPolarHBondContact O-CA 3.09Å; Y132-G136 PolarHBondContact O-N 3.13Å
137	N	61	Low	77.4	Confident	87 Å²	87	70 Å²	70	47%	0.465	40%	0.395	S	S	.	.			trans	-86.6	143	160.3	-106.5	-38.9	0	0	0	108.5	Y132 V139	Y132-N137 HydrophobicContact CD1-CB 4.31Å; Y132-N137 VanDerWaalsContact CD1-ND2 3.34Å; Y132-N137 WeakPolarHBondContact CD1-ND2 3.19Å; Y132-N137 WeakPolarHBondContact CD1-OD1 3.38Å; Y132-N137 WeakPolarHBondContact CE1-OD1 3.49Å; N137-V139 VanDerWaalsContact C-N 3.28Å; N137-V139 PolarHBondContact O-N 2.91Å
138	P	45.9	Very low	76	Confident	71 Å²	71	75.4 Å²	75.4	46%	0.461	43%	0.426	S	S	.	.			trans	-61.1	107.2	147.7	28.1	-25.2	0	0	0	105.3	I140	P138-I140 HydrophobicContact CB-CG1 4.4Å; P138-I140 PolarHBondContact O-N 3.46Å
139	V	32.2	Very low	74.5	Confident	141 Å²	141	79.7 Å²	79.7	86%	0.855	45%	0.451	S	S	*	.			trans	-61.3	93.8	157.9	176.5	0	0	0	0	105.3	N137	N137-V139 VanDerWaalsContact C-N 3.28Å; N137-V139 PolarHBondContact O-N 2.91Å
140	I	35.7	Very low	72.7	Confident	224 Å²	224	78.3 Å²	78.3	100%	1.149	44%	0.439	S	S	*	.			trans	-141.4	0	158.8	-48.3	179.4	0	0	0	107.3	P138	P138-I140 HydrophobicContact CB-CG1 4.4Å; P138-I140 PolarHBondContact O-N 3.46Å

Retrieved 140 of 140 residues in 103.9 ms (Link to these results)

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