A0A077ZNH4_TRITR Loading...

Zinc knuckle protein

AlphaFold DB , UniProt , Accession A0A077ZNH4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 223 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	43	Very low	47.2	Very low	241 Å²	241	174.3 Å²	174.3	100%	1.187	83%	0.826	S	S	*	*				0	127.2	0	-157.3	173.2	-148.5	0	0	106.6
2	M	42.9	Very low	46.9	Very low	166 Å²	166	176.2 Å²	176.2	82%	0.818	83%	0.834	S	S	*	*			trans	76.2	89.2	-167.8	-52.8	-81.3	-143.4	0	0	114.2
3	R	41.5	Very low	46.5	Very low	216 Å²	216	169.5 Å²	169.5	82%	0.815	83%	0.827	S	S	*	*				77.9	100.6	86.8	-77.9	-178.8	177.2	162	-0.1	112.6
4	E	50.3	Low	46.3	Very low	140 Å²	140	170.5 Å²	170.5	65%	0.654	83%	0.829	S	S	*	*				62.7	127.9	86.2	-75.6	-169	123.9	0	0	112.1	R6	E4-R6 IonicContact OE1-CZ 3.82Å; E4-R6 IonicContact OE1-NH1 2.66Å; E4-R6 PolarHBondContact OE1-NH1 3.43Å; E4-R6 IonicContact OE1-NH2 2.72Å
5	T	52.8	Low	46.2	Very low	117 Å²	117	164.1 Å²	164.1	72%	0.718	81%	0.814	S	S	*	*				-168.1	124.3	58.7	38.4	0	0	0	0	110.6
6	R	54.8	Low	46.1	Very low	209 Å²	209	163.9 Å²	163.9	79%	0.789	81%	0.811	S	S	*	*				73.3	106	96.6	-78.8	-172	175.2	102.9	2.3	117.3	E4	E4-R6 IonicContact OE1-CZ 3.82Å; E4-R6 IonicContact OE1-NH1 2.66Å; E4-R6 PolarHBondContact OE1-NH1 3.43Å; E4-R6 IonicContact OE1-NH2 2.72Å
7	N	48	Very low	46.2	Very low	165 Å²	165	164.2 Å²	164.2	88%	0.882	81%	0.812	S	S	*	*			trans	-65.8	135.7	148.8	-76.4	-30.5	0	0	0	111.1
8	R	53.6	Low	46	Very low	206 Å²	206	162.7 Å²	162.7	78%	0.777	81%	0.807	S	S	*	*			trans	-173	137.6	146	-134	176.2	61.3	138.4	-12	113.8
9	K	45.9	Very low	45.9	Very low	167 Å²	167	165.8 Å²	165.8	73%	0.726	81%	0.809	S	S	*	*			trans	78.1	114	149.2	-89.2	-176.9	171.9	-155.4	0	119.2
10	A	43.8	Very low	45.9	Very low	101 Å²	101	167.5 Å²	167.5	84%	0.835	81%	0.812	S	S	*	*				-177.7	90	108.6	0	0	0	0	0	111
11	E	42.4	Very low	45.6	Very low	189 Å²	189	165.3 Å²	165.3	88%	0.883	81%	0.814	S	S	*	*			trans	-74.7	129.9	139.3	-81.8	171.5	111.3	0	0	106.4
12	E	43.5	Very low	45.6	Very low	197 Å²	197	158.4 Å²	158.4	92%	0.921	80%	0.795	S	S	*	*			trans	-175.2	136.3	140	-103.9	160.7	-171	0	0	111
13	A	42	Very low	45.5	Very low	90 Å²	90	156.8 Å²	156.8	74%	0.744	80%	0.797	S	S	*	*			trans	-50.3	147.5	-174.5	0	0	0	0	0	116.5
14	Q	43.2	Very low	45.4	Very low	183 Å²	183	150.5 Å²	150.5	86%	0.855	80%	0.8	S	S	*	*			trans	-132.5	97.7	147.9	-165.4	67.9	21.7	0	0	109.4
15	A	45	Very low	44.9	Very low	74 Å²	74	147.9 Å²	147.9	61%	0.612	81%	0.81	S	S	*	*			trans	-91.8	161.8	157.6	0	0	0	0	0	108.9
16	E	45.8	Very low	44.4	Very low	162 Å²	162	151.4 Å²	151.4	76%	0.757	82%	0.818	S	S	*	*			trans	84.3	99.7	163.3	-140.7	74.2	-154.6	0	0	117.7
17	M	47.5	Very low	43.9	Very low	168 Å²	168	146.1 Å²	146.1	83%	0.828	81%	0.811	S	S	*	*			trans	168	126.7	139.9	-90.1	-178.5	83.6	0	0	104.4
18	D	42.9	Very low	43.6	Very low	137 Å²	137	147.1 Å²	147.1	73%	0.733	81%	0.81	S	S	*	*			cis	-164	151.4	23.5	-135	-27.9	0	0	0	109.4
19	R	43.6	Very low	42.9	Very low	222 Å²	222	142.2 Å²	142.2	84%	0.838	81%	0.808	S	S	*	*			trans	-72.3	137.1	-178.2	-65.1	172	174.8	159.3	-2.2	111.5
20	K	45	Very low	42.4	Very low	200 Å²	200	139.8 Å²	139.8	87%	0.87	81%	0.807	S	S	*	*				-169.9	108.5	129.6	-107.9	169.6	-175.7	178.8	0	113.4
21	S	40.5	Very low	42	Very low	122 Å²	122	143.8 Å²	143.8	85%	0.853	81%	0.808	S	S	*	*			trans	49.4	121.8	135.7	-55.1	0	0	0	0	121.7
22	A	42.7	Very low	41.9	Very low	96 Å²	96	139.5 Å²	139.5	79%	0.793	81%	0.805	S	S	*	*			trans	-87.2	-163.1	174.8	0	0	0	0	0	112.5
23	P	41.8	Very low	41.4	Very low	132 Å²	132	134 Å²	134	86%	0.857	80%	0.801	S	S	*	*				-119.4	169.5	-112.7	27.8	-5.1	0	0	0	113.7
24	G	38.8	Very low	41.4	Very low	84 Å²	84	140.8 Å²	140.8	87%	0.866	81%	0.807	S	S	*	*			trans	179.6	136.3	168.5	0	0	0	0	0	115.2
25	G	39.8	Very low	41.2	Very low	84 Å²	84	139.3 Å²	139.3	87%	0.866	81%	0.811	S	S	*	*			trans	127.3	92.4	157.8	0	0	0	0	0	115.8
26	Q	42.3	Very low	41.3	Very low	191 Å²	191	141.8 Å²	141.8	89%	0.893	82%	0.818	S	S	*	*			trans	-84.7	-177.1	171.1	-129.7	-164.7	-78.4	0	0	110.8
27	P	44.7	Very low	41.1	Very low	98 Å²	98	141.1 Å²	141.1	64%	0.636	82%	0.82	S	S	*	*				-119.2	155.5	-125.1	37.2	-18.3	0	0	0	114.5
28	E	40.2	Very low	40.8	Very low	186 Å²	186	142 Å²	142	87%	0.869	82%	0.822	S	S	*	*			trans	-147	117.1	160.5	-76	-162.5	109.8	0	0	112.7
29	S	39	Very low	40.3	Very low	104 Å²	104	138.2 Å²	138.2	73%	0.727	82%	0.815	S	S	*	*				38.2	125	126.2	-42.9	0	0	0	0	120
30	T	37	Very low	40.2	Very low	115 Å²	115	139.5 Å²	139.5	71%	0.706	82%	0.82	S	S	*	*				156.1	127.5	98.2	-49.2	0	0	0	0	111.4
31	E	34.5	Very low	40.1	Very low	185 Å²	185	135.9 Å²	135.9	86%	0.864	82%	0.817	S	S	*	*			trans	22.4	127.2	154.3	-58.9	172.9	96.7	0	0	121.9
32	A	39.9	Very low	39.9	Very low	100 Å²	100	141.3 Å²	141.3	83%	0.826	82%	0.819	S	S	*	*				-166.6	119.2	125.2	0	0	0	0	0	109.9
33	G	33.3	Very low	39.8	Very low	80 Å²	80	142 Å²	142	83%	0.825	82%	0.817	S	S	*	*			trans	-63.7	145	-174.6	0	0	0	0	0	114.9
34	R	41	Very low	39.7	Very low	234 Å²	234	139.3 Å²	139.3	88%	0.883	81%	0.814	S	S	*	*			trans	-142.7	102	154.6	-87.9	-173.2	-167.7	-138.1	1.2	109.5	V36	R34-V36 PolarHBondContact O-N 2.99Å
35	T	39.4	Very low	39.7	Very low	152 Å²	152	142 Å²	142	93%	0.933	81%	0.814	S	S	*	*			trans	-58.2	109.3	153.1	5.8	0	0	0	0	107.8
36	V	48.5	Very low	39.9	Very low	125 Å²	125	144.3 Å²	144.3	76%	0.758	81%	0.812	S	S	*	*			trans	-98.4	107.6	169.2	169	0	0	0	0	107.4	R34	R34-V36 PolarHBondContact O-N 2.99Å
37	D	40.6	Very low	39.7	Very low	148 Å²	148	145.2 Å²	145.2	79%	0.791	82%	0.816	S	S	*	*			trans	-60.1	122.8	172.8	-174.6	38	0	0	0	110.3	G39	D37-G39 PolarHBondContact O-N 3.35Å
38	Q	41.1	Very low	39.7	Very low	188 Å²	188	143.3 Å²	143.3	88%	0.879	81%	0.814	S	S	*	*			trans	-77.8	73.8	175.4	-71.6	-100.7	33.4	0	0	108.8	W40	Q38-W40 PolarHBondContact O-N 3.27Å
39	G	32.4	Very low	40.4	Very low	56 Å²	56	139 Å²	139	58%	0.577	81%	0.811	S	S	*	*			trans	-76.9	104	172.2	0	0	0	0	0	111	D37	D37-G39 PolarHBondContact O-N 3.35Å
40	W	40.6	Very low	41.3	Very low	249 Å²	249	140.2 Å²	140.2	94%	0.943	81%	0.813	S	S	*	*			trans	-52.9	129.1	166	-115.6	-33.7	0	0	0	109.8	Q38 R42	Q38-W40 PolarHBondContact O-N 3.27Å; W40-R42 PolarHBondContact O-N 3.4Å
41	P	43.3	Very low	42.7	Very low	125 Å²	125	142.1 Å²	142.1	81%	0.812	81%	0.808	S	S	*	*			trans	-69.1	110.2	175.8	-13	27.9	0	0	0	109.4	S43	P41-S43 PolarHBondContact O-N 3.25Å
42	R	37.9	Very low	44.5	Very low	235 Å²	235	140.9 Å²	140.9	89%	0.887	81%	0.806	S	S	*	*			trans	-76.2	115.6	173.2	-173.9	176	167.6	-159.8	-3.4	109.5	W40	W40-R42 PolarHBondContact O-N 3.4Å
43	S	39.3	Very low	46.2	Very low	110 Å²	110	145.1 Å²	145.1	77%	0.769	80%	0.801	S	S	*	*			trans	57.8	90.4	152.4	-56	0	0	0	0	117.8	P41	P41-S43 PolarHBondContact O-N 3.25Å
44	G	39.4	Very low	48.4	Very low	76 Å²	76	143.9 Å²	143.9	78%	0.784	78%	0.779	S	S	*	*			trans	-102.7	118.2	150.3	0	0	0	0	0	109.7	T46	G44-T46 PolarHBondContact O-N 3.09Å
45	T	38.4	Very low	50.4	Low	142 Å²	142	143.7 Å²	143.7	87%	0.871	78%	0.778	S	S	*	*			trans	-72.2	110.4	171	36.6	0	0	0	0	110.3
46	T	45.5	Very low	52.3	Low	132 Å²	132	139.8 Å²	139.8	81%	0.81	76%	0.756	S	S	*	*			trans	-145.2	123.2	157.6	47	0	0	0	0	108.5	G44 G48	G44-T46 PolarHBondContact O-N 3.09Å; T46-G48 PolarHBondContact O-N 3.42Å
47	E	37.5	Very low	53.8	Low	209 Å²	209	135.5 Å²	135.5	98%	0.977	73%	0.73	S	S	*	*			trans	-48.1	94.9	167.5	-70.6	166.1	118.8	0	0	110.4
48	G	44	Very low	55.8	Low	59 Å²	59	132.3 Å²	132.3	61%	0.608	72%	0.72	S	S	*	*			trans	-120.1	97.9	174.2	0	0	0	0	0	107.1	T46 T50	T46-G48 PolarHBondContact O-N 3.42Å; G48-T50 PolarHBondContact O-N 2.65Å
49	A	55.5	Low	57.8	Low	96 Å²	96	127 Å²	127	79%	0.793	70%	0.703	S	S	*	*			trans	-45	118.9	173	0	0	0	0	0	108.9	R51	A49-R51 VanDerWaalsContact C-N 3.26Å; A49-R51 PolarHBondContact O-N 2.75Å
50	T	58.4	Low	60.2	Low	128 Å²	128	124.7 Å²	124.7	79%	0.785	68%	0.677	S	S	*	*			trans	-59	92	177.3	-14.2	0	0	0	0	107.1	G48 L52	G48-T50 PolarHBondContact O-N 2.65Å; T50-L52 PolarHBondContact O-N 3.26Å
51	R	65.9	Low	62	Low	156 Å²	156	114.2 Å²	114.2	59%	0.589	64%	0.641	S	S	*	*			trans	-61.6	107	172.9	-93.2	-173.1	175.3	-113.7	7.7	105.8	A49 W53 E81	A49-R51 VanDerWaalsContact C-N 3.26Å; A49-R51 PolarHBondContact O-N 2.75Å; R51-W53 PolarHBondContact O-N 3.34Å; R51-W53 VanDerWaalsContact O-N 3.1Å; R51-E81 IonicContact CZ-OE1 2.76Å; R51-E81 VanDerWaalsContact CZ-OE1 3.25Å; R51-E81 IonicContact CZ-OE2 3.17Å; R51-E81 IonicContact NH1-OE1 3.91Å; R51-E81 PolarHBondContact NH1-OE1 3.24Å; R51-E81 IonicContact NH1-OE2 2.8Å; R51-E81 PolarHBondContact NH1-OE2 3.06Å; R51-E81 VanDerWaalsContact NH1-OE2 3.17Å; R51-E81 VanDerWaalsContact NH2-CD 3.28Å; R51-E81 IonicContact NH2-OE1 2.86Å; R51-E81 PolarHBondContact NH2-OE1 3.29Å; R51-E81 IonicContact NH2-OE2 3.25Å; R51-E81 PolarHBondContact NH2-OE2 3.18Å
52	L	71.6	Confident	63.5	Low	158 Å²	158	113.3 Å²	113.3	83%	0.827	63%	0.626	S	S	*	*			trans	-71.3	104.3	174.2	-69.4	169.4	0	0	0	106.5	T50 C54	T50-L52 PolarHBondContact O-N 3.26Å; L52-C54 PolarHBondContact O-N 3.42Å
53	W	76.1	Confident	65.3	Low	189 Å²	189	107.5 Å²	107.5	72%	0.716	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-60.4	130.2	172.7	-78.4	51.6	0	0	0	108.4	R51 N80	R51-W53 PolarHBondContact O-N 3.34Å; R51-W53 VanDerWaalsContact O-N 3.1Å; W53-N80 WeakPolarHBondContact CA-OD1 3.4Å
54	C	79.6	Confident	67.1	Low	54 Å²	54	104.5 Å²	104.5	37%	0.365	59%	0.594	S	S	.	*	P	Polyproline II helix	trans	-63.5	141.7	172.6	-68.1	0	0	0	0	108.1	L52 Y76 N80	L52-C54 PolarHBondContact O-N 3.42Å; C54-Y76 VanDerWaalsContact O-CE2 3.31Å; C54-Y76 WeakPolarHBondContact O-CE2 3.41Å; C54-N80 PolarHBondContact N-OD1 2.78Å
55	R	82.7	Confident	69.2	Low	230 Å²	230	105.4 Å²	105.4	87%	0.868	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-63.6	134.4	177.6	-167.6	-179.8	-179.2	175.2	1.1	109.1
56	P	80.8	Confident	71.5	Confident	71 Å²	71	98.8 Å²	98.8	46%	0.461	54%	0.54	S	S	.	.	P	Polyproline II helix	trans	-57.3	140.1	172.8	23.7	-32.7	0	0	0	109.5	Y76 F94	P56-Y76 VanDerWaalsContact CA-CE2 3.45Å; P56-Y76 HydrophobicContact CB-CE2 3.97Å; P56-F94 HydrophobicContact CB-CE2 4.08Å
57	P	79.8	Confident	73.4	Confident	35 Å²	35	93.9 Å²	93.9	23%	0.227	52%	0.516	C	S	.	.	P	Polyproline II helix	trans	-62.7	173.2	174.7	4.6	-0.2	0	0	0	110.6	R72 F94	P57-R72 HydrophobicContact CG-CB 4.41Å; P57-F94 HydrophobicContact CB-CE1 4.23Å; P57-F94 HydrophobicContact CB-CE2 4.3Å; P57-F94 HydrophobicContact CB-CZ 3.44Å; P57-F94 VanDerWaalsContact CB-CZ 3.44Å; P57-F94 HydrophobicContact CG-CE1 3.98Å; P57-F94 HydrophobicContact CG-CE2 4.01Å; P57-F94 HydrophobicContact CG-CZ 3.28Å; P57-F94 WeakPolarHBondContact O-CE2 3.49Å; P57-F94 WeakPolarHBondContact O-CZ 3.34Å
58	S	82.7	Confident	75.7	Confident	81 Å²	81	87.3 Å²	87.3	57%	0.566	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-59.7	161	175.6	63.5	0	0	0	0	111.1	R69 F94	S58-R69 PolarHBondContact O-NH1 3.44Å; S58-R69 PolarHBondContact O-NH2 2.96Å; S58-R69 PolarHBondContact OG-NH1 3.2Å; S58-F94 WeakPolarHBondContact O-CE1 3.25Å; S58-F94 WeakPolarHBondContact O-CZ 3.27Å
59	C	82.6	Confident	77.8	Confident	77 Å²	77	85 Å²	85	52%	0.52	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-63.3	152.9	173.9	-59.3	0	0	0	0	111.9	R69 F94	C59-R69 PolarHBondContact O-NH2 2.75Å; C59-F94 CarbonylContact C-O 3.5Å; C59-F94 VanDerWaalsContact CA-O 3.31Å; C59-F94 WeakPolarHBondContact CA-O 3.49Å
60	F	83.6	Confident	79.5	Confident	7 Å²	7	81.2 Å²	81.2	3%	0.031	43%	0.429	C	S	.	.	B	Isolated β-bridge	trans	-78.7	126.7	172.2	170.4	-91.7	0	0	0	109.3	V66 R69 F94 V95 D96 V99 L119 Y123	F60-V66 HydrophobicContact CE2-CB 3.9Å; F60-V66 HydrophobicContact CE2-CG2 3.92Å; F60-V66 HydrophobicContact CZ-CB 4.19Å; F60-V66 HydrophobicContact CZ-CG2 4.05Å; F60-R69 HydrophobicContact CD2-CB 3.64Å; F60-R69 HydrophobicContact CD2-CG 3.85Å; F60-R69 HydrophobicContact CE2-CB 4.28Å; F60-R69 HydrophobicContact CE2-CG 4.4Å; F60-F94 PolarHBondContact N-O 3.06Å; F60-V95 HydrophobicContact CB-CG1 4.11Å; F60-V95 HydrophobicContact CD1-CB 4.49Å; F60-V95 HydrophobicContact CD1-CG1 4.03Å; F60-V95 HydrophobicContact CG-CG1 4.44Å; F60-D96 PolarHBondContact O-N 3.32Å; F60-V99 HydrophobicContact CD1-CB 4.18Å; F60-V99 HydrophobicContact CD1-CG1 3.73Å; F60-V99 HydrophobicContact CD1-CG2 3.8Å; F60-V99 HydrophobicContact CE1-CB 4.28Å; F60-V99 HydrophobicContact CE1-CG1 3.74Å; F60-V99 HydrophobicContact CE1-CG2 3.61Å; F60-L119 HydrophobicContact CD1-CD2 4.43Å; F60-L119 HydrophobicContact CE1-CD2 3.94Å; F60-Y123 AromaticContact CE1-CD2 3.94Å; F60-Y123 HydrophobicContact CE1-CD2 3.94Å; F60-Y123 HydrophobicContact CE1-CE2 4.3Å; F60-Y123 HydrophobicContact CE1-CG 4.28Å; F60-Y123 HydrophobicContact CZ-CD2 4Å; F60-Y123 HydrophobicContact CZ-CG 4.02Å
61	S	78.2	Confident	81	Confident	29 Å²	29	78.5 Å²	78.5	20%	0.203	42%	0.415	C	S	.	.			trans	-115.8	156.6	169	65.1	0	0	0	0	110.4	T63 T64 D96	S61-T63 PolarHBondContact O-N 3.08Å; S61-T63 PolarHBondContact OG-OG1 2.97Å; S61-T64 PolarHBondContact N-OG1 3.09Å; S61-T64 PolarHBondContact O-N 3.34Å; S61-T64 PolarHBondContact O-OG1 3.29Å; S61-D96 VanDerWaalsContact CA-OD2 3.25Å; S61-D96 WeakPolarHBondContact CA-OD2 3.29Å; S61-D96 WeakPolarHBondContact CB-OD2 3.27Å
62	H	75.1	Confident	82.1	Confident	105 Å²	105	77.3 Å²	77.3	49%	0.486	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-14	175.9	59.6	-90.5	0	0	0	114.2	D96 Y123	H62-D96 IonicContact ND1-OD2 2.66Å; H62-Y123 HydrophobicContact CB-CD1 3.8Å; H62-Y123 HydrophobicContact CB-CE1 3.61Å
63	T	74.2	Confident	83.1	Confident	113 Å²	113	69.8 Å²	69.8	69%	0.693	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-8	175.8	55.6	0	0	0	0	114.1	S61	S61-T63 PolarHBondContact O-N 3.08Å; S61-T63 PolarHBondContact OG-OG1 2.97Å
64	T	77.4	Confident	83.9	Confident	48 Å²	48	63.7 Å²	63.7	29%	0.294	35%	0.353	S	S	.	.	S	Bend	trans	-102.3	149.8	-176.5	55.3	0	0	0	0	112.8	S61 V66 R69	S61-T64 PolarHBondContact N-OG1 3.09Å; S61-T64 PolarHBondContact O-N 3.34Å; S61-T64 PolarHBondContact O-OG1 3.29Å; T64-V66 PolarHBondContact O-N 3.43Å; T64-V66 VanDerWaalsContact O-N 3.07Å; T64-R69 WeakPolarHBondContact OG1-CG 3.48Å
65	D	83.6	Confident	84.4	Confident	95 Å²	95	65.5 Å²	65.5	51%	0.508	36%	0.359	S	S	.	.			trans	-61.8	110.9	176.1	-176.8	-63.1	0	0	0	110.7	G67 V68 R69	D65-G67 PolarHBondContact O-N 3.42Å; D65-G67 WeakPolarHBondContact OD1-CA 3.33Å; D65-G67 PolarHBondContact OD1-N 2.98Å; D65-V68 HydrophobicContact CB-CB 4.16Å; D65-V68 HydrophobicContact CB-CG2 4.05Å; D65-V68 PolarHBondContact O-N 3.34Å; D65-V68 PolarHBondContact OD1-N 2.94Å; D65-R69 WeakPolarHBondContact O-CB 3.49Å; D65-R69 WeakPolarHBondContact O-CG 3.49Å; D65-R69 PolarHBondContact O-N 2.93Å
66	V	87.5	Confident	84.9	Confident	3 Å²	3	56 Å²	56	2%	0.018	32%	0.323	C	S	.	.	H	α-helix	trans	-58.4	-35.2	-177.2	70.5	0	0	0	0	113.1	F60 T64 R69 L70 L119 G124	F60-V66 HydrophobicContact CE2-CB 3.9Å; F60-V66 HydrophobicContact CE2-CG2 3.92Å; F60-V66 HydrophobicContact CZ-CB 4.19Å; F60-V66 HydrophobicContact CZ-CG2 4.05Å; T64-V66 PolarHBondContact O-N 3.43Å; T64-V66 VanDerWaalsContact O-N 3.07Å; V66-R69 PolarHBondContact O-N 3.4Å; V66-L70 HydrophobicContact CG2-CD1 4.03Å; V66-L70 HydrophobicContact CG2-CG 4.22Å; V66-L70 WeakPolarHBondContact O-CB 3.3Å; V66-L70 VanDerWaalsContact O-CG 3.23Å; V66-L70 WeakPolarHBondContact O-CG 3.38Å; V66-L70 PolarHBondContact O-N 3.21Å; V66-L119 HydrophobicContact CG2-CB 3.68Å; V66-G124 VanDerWaalsContact CG1-CA 3.48Å
67	G	84.6	Confident	85.5	Confident	29 Å²	29	52.6 Å²	52.6	30%	0.299	30%	0.301	S	S	.	.	H	α-helix	trans	-64.6	-52.5	179.2	0	0	0	0	0	111	D65 R69 L70 S71	D65-G67 PolarHBondContact O-N 3.42Å; D65-G67 WeakPolarHBondContact OD1-CA 3.33Å; D65-G67 PolarHBondContact OD1-N 2.98Å; G67-R69 VanDerWaalsContact C-N 3.25Å; G67-R69 PolarHBondContact O-N 3.41Å; G67-L70 PolarHBondContact O-N 3.49Å; G67-S71 PolarHBondContact O-N 3.07Å; G67-S71 PolarHBondContact O-OG 3.08Å
68	V	85.5	Confident	86.1	Confident	70 Å²	70	56.4 Å²	56.4	42%	0.424	32%	0.317	S	S	.	.	H	α-helix	trans	-59	-39.7	178.2	175	0	0	0	0	111.3	D65 S71 R72	D65-V68 HydrophobicContact CB-CB 4.16Å; D65-V68 HydrophobicContact CB-CG2 4.05Å; D65-V68 PolarHBondContact O-N 3.34Å; D65-V68 PolarHBondContact OD1-N 2.94Å; V68-S71 PolarHBondContact O-N 3.46Å; V68-R72 WeakPolarHBondContact O-CG 3.41Å; V68-R72 PolarHBondContact O-N 3.14Å
69	R	88.6	Confident	86.5	Confident	10 Å²	10	58.1 Å²	58.1	4%	0.038	32%	0.32	C	S	.	.	H	α-helix	trans	-71.2	-41.5	-177.3	-66.7	-73.2	-56.8	143.5	28.3	112.3	S58 C59 F60 T64 D65 V66 G67 R72 L73	S58-R69 PolarHBondContact O-NH1 3.44Å; S58-R69 PolarHBondContact O-NH2 2.96Å; S58-R69 PolarHBondContact OG-NH1 3.2Å; C59-R69 PolarHBondContact O-NH2 2.75Å; F60-R69 HydrophobicContact CD2-CB 3.64Å; F60-R69 HydrophobicContact CD2-CG 3.85Å; F60-R69 HydrophobicContact CE2-CB 4.28Å; F60-R69 HydrophobicContact CE2-CG 4.4Å; T64-R69 WeakPolarHBondContact OG1-CG 3.48Å; D65-R69 WeakPolarHBondContact O-CB 3.49Å; D65-R69 WeakPolarHBondContact O-CG 3.49Å; D65-R69 PolarHBondContact O-N 2.93Å; V66-R69 PolarHBondContact O-N 3.4Å; G67-R69 VanDerWaalsContact C-N 3.25Å; G67-R69 PolarHBondContact O-N 3.41Å; R69-R72 PolarHBondContact O-N 2.78Å; R69-L73 PolarHBondContact O-N 3.33Å
70	L	91.2	Very high	86.9	Confident	17 Å²	17	55.5 Å²	55.5	9%	0.089	30%	0.3	C	S	.	.	H	α-helix	trans	-65.2	-38.3	173	-71.1	179.8	0	0	0	112	V66 G67 L73 N74 L91 T116 L119 K120	V66-L70 HydrophobicContact CG2-CD1 4.03Å; V66-L70 HydrophobicContact CG2-CG 4.22Å; V66-L70 WeakPolarHBondContact O-CB 3.3Å; V66-L70 VanDerWaalsContact O-CG 3.23Å; V66-L70 WeakPolarHBondContact O-CG 3.38Å; V66-L70 PolarHBondContact O-N 3.21Å; G67-L70 PolarHBondContact O-N 3.49Å; L70-L73 PolarHBondContact O-N 3.26Å; L70-N74 WeakPolarHBondContact O-CB 3.19Å; L70-N74 PolarHBondContact O-N 3.44Å; L70-L91 HydrophobicContact CD2-CD1 4.06Å; L70-T116 HydrophobicContact CD1-CG2 4.07Å; L70-T116 HydrophobicContact CD2-CG2 3.76Å; L70-L119 HydrophobicContact CD2-CD1 3.97Å; L70-K120 HydrophobicContact CD1-CG 4.09Å
71	S	89.1	Confident	87.4	Confident	71 Å²	71	61.4 Å²	61.4	50%	0.497	33%	0.328	S	S	.	.	H	α-helix	trans	-61.6	-46	173.6	-65.9	0	0	0	0	112.1	G67 V68 L73 N74 D75	G67-S71 PolarHBondContact O-N 3.07Å; G67-S71 PolarHBondContact O-OG 3.08Å; V68-S71 PolarHBondContact O-N 3.46Å; S71-L73 VanDerWaalsContact C-N 3.3Å; S71-L73 PolarHBondContact O-N 2.93Å; S71-N74 WeakPolarHBondContact O-CB 3.38Å; S71-N74 PolarHBondContact O-N 3.26Å; S71-N74 VanDerWaalsContact O-N 3.13Å; S71-D75 PolarHBondContact O-N 3.07Å
72	R	90.1	Very high	88.1	Confident	131 Å²	131	61.2 Å²	61.2	49%	0.494	33%	0.326	S	S	.	.	H	α-helix	trans	-62.4	-37	176.5	-73.8	177.1	179.7	178.2	1.2	112.9	P57 V68 R69 Y76	P57-R72 HydrophobicContact CG-CB 4.41Å; V68-R72 WeakPolarHBondContact O-CG 3.41Å; V68-R72 PolarHBondContact O-N 3.14Å; R69-R72 PolarHBondContact O-N 2.78Å; R72-Y76 WeakPolarHBondContact O-CB 3.46Å; R72-Y76 PolarHBondContact O-N 3.05Å
73	L	92.7	Very high	89	Confident	1 Å²	1	59.2 Å²	59.2	1%	0.005	32%	0.324	C	S	.	.	H	α-helix	trans	-65.3	-43.3	173.7	177.9	62.7	0	0	0	110.8	R69 L70 S71 D75 Y76 L77 V90 L91 F94 Y112	R69-L73 PolarHBondContact O-N 3.33Å; L70-L73 PolarHBondContact O-N 3.26Å; S71-L73 VanDerWaalsContact C-N 3.3Å; S71-L73 PolarHBondContact O-N 2.93Å; L73-D75 VanDerWaalsContact C-N 3.35Å; L73-D75 PolarHBondContact O-N 3.05Å; L73-Y76 HydrophobicContact CD1-CD1 4.23Å; L73-Y76 WeakPolarHBondContact O-CB 3.29Å; L73-Y76 PolarHBondContact O-N 3.38Å; L73-L77 HydrophobicContact CD1-CD1 4.39Å; L73-L77 HydrophobicContact CD1-CG 4.22Å; L73-L77 HydrophobicContact CG-CD1 4Å; L73-L77 HydrophobicContact CG-CG 4.3Å; L73-L77 VanDerWaalsContact O-CG 3.28Å; L73-L77 WeakPolarHBondContact O-CG 3.49Å; L73-L77 PolarHBondContact O-N 3.29Å; L73-V90 HydrophobicContact CD1-CG1 4.05Å; L73-L91 HydrophobicContact CD2-CB 3.91Å; L73-L91 HydrophobicContact CD2-CD1 3.41Å; L73-L91 VanDerWaalsContact CD2-CD1 3.41Å; L73-L91 HydrophobicContact CD2-CG 4.21Å; L73-F94 HydrophobicContact CB-CD1 4.41Å; L73-F94 HydrophobicContact CB-CE1 4.4Å; L73-F94 HydrophobicContact CD1-CD1 3.99Å; L73-F94 HydrophobicContact CD1-CE1 4.34Å; L73-F94 HydrophobicContact CD1-CG 4.11Å; L73-F94 HydrophobicContact CD2-CD1 4.42Å; L73-Y112 HydrophobicContact CD2-CE2 4.11Å
74	N	92.1	Very high	89.9	Confident	60 Å²	60	61 Å²	61	32%	0.321	32%	0.324	S	S	.	.	H	α-helix	trans	-59	-45.8	176	-170.8	83.2	0	0	0	111.6	L70 S71 Y76 L77 M78	L70-N74 WeakPolarHBondContact O-CB 3.19Å; L70-N74 PolarHBondContact O-N 3.44Å; S71-N74 WeakPolarHBondContact O-CB 3.38Å; S71-N74 PolarHBondContact O-N 3.26Å; S71-N74 VanDerWaalsContact O-N 3.13Å; N74-Y76 VanDerWaalsContact C-N 3.3Å; N74-Y76 PolarHBondContact O-N 3Å; N74-L77 PolarHBondContact O-N 3.14Å; N74-M78 WeakPolarHBondContact O-CB 3.41Å; N74-M78 VanDerWaalsContact O-CG 3.27Å; N74-M78 WeakPolarHBondContact O-CG 3.23Å; N74-M78 PolarHBondContact O-N 3.42Å
75	D	90.9	Very high	90.7	Very high	92 Å²	92	64.4 Å²	64.4	49%	0.492	34%	0.341	S	S	.	.	H	α-helix	trans	-58.7	-43.2	175.2	-63.3	-22.4	0	0	0	111.4	S71 L73 M78 L79	S71-D75 PolarHBondContact O-N 3.07Å; L73-D75 VanDerWaalsContact C-N 3.35Å; L73-D75 PolarHBondContact O-N 3.05Å; D75-M78 PolarHBondContact O-N 2.87Å; D75-L79 VanDerWaalsContact O-CB 3.28Å; D75-L79 WeakPolarHBondContact O-CB 3.36Å; D75-L79 WeakPolarHBondContact O-CG 3.39Å; D75-L79 PolarHBondContact O-N 2.68Å
76	Y	92.7	Very high	91.2	Very high	30 Å²	30	65.5 Å²	65.5	12%	0.118	34%	0.341	C	S	.	.	H	α-helix	trans	-62.1	-45.9	176	169.6	-92.2	0	0	0	112.7	C54 P56 R72 L73 N74 M78 N80 V90	C54-Y76 VanDerWaalsContact O-CE2 3.31Å; C54-Y76 WeakPolarHBondContact O-CE2 3.41Å; P56-Y76 VanDerWaalsContact CA-CE2 3.45Å; P56-Y76 HydrophobicContact CB-CE2 3.97Å; R72-Y76 WeakPolarHBondContact O-CB 3.46Å; R72-Y76 PolarHBondContact O-N 3.05Å; L73-Y76 HydrophobicContact CD1-CD1 4.23Å; L73-Y76 WeakPolarHBondContact O-CB 3.29Å; L73-Y76 PolarHBondContact O-N 3.38Å; N74-Y76 VanDerWaalsContact C-N 3.3Å; N74-Y76 PolarHBondContact O-N 3Å; Y76-M78 VanDerWaalsContact C-N 3.33Å; Y76-M78 PolarHBondContact O-N 2.98Å; Y76-N80 WeakPolarHBondContact CD2-ND2 3.3Å; Y76-N80 WeakPolarHBondContact CE2-ND2 3.4Å; Y76-N80 WeakPolarHBondContact O-CB 3.22Å; Y76-N80 PolarHBondContact O-N 2.65Å; Y76-N80 VanDerWaalsContact O-N 3.09Å; Y76-N80 PolarHBondContact O-ND2 2.96Å; Y76-V90 HydrophobicContact CE1-CG1 4.15Å
77	L	94	Very high	91.6	Very high	0 Å²	0	67 Å²	67	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-61.2	-44.4	179	-69.2	168.3	0	0	0	110.7	L73 N74 E81 V82 W87 V90 Y112	L73-L77 HydrophobicContact CD1-CD1 4.39Å; L73-L77 HydrophobicContact CD1-CG 4.22Å; L73-L77 HydrophobicContact CG-CD1 4Å; L73-L77 HydrophobicContact CG-CG 4.3Å; L73-L77 VanDerWaalsContact O-CG 3.28Å; L73-L77 WeakPolarHBondContact O-CG 3.49Å; L73-L77 PolarHBondContact O-N 3.29Å; N74-L77 PolarHBondContact O-N 3.14Å; L77-E81 PolarHBondContact O-N 3.5Å; L77-E81 VanDerWaalsContact O-N 3.16Å; L77-V82 HydrophobicContact CB-CB 4.47Å; L77-V82 HydrophobicContact CD2-CB 3.8Å; L77-V82 HydrophobicContact CD2-CG1 3.86Å; L77-V82 HydrophobicContact CD2-CG2 4Å; L77-V82 PolarHBondContact O-N 3.3Å; L77-W87 HydrophobicContact CB-CZ2 4.4Å; L77-W87 HydrophobicContact CD1-CB 4.27Å; L77-W87 HydrophobicContact CD1-CD2 3.78Å; L77-W87 HydrophobicContact CD1-CE3 4.17Å; L77-W87 HydrophobicContact CD1-CG 3.83Å; L77-W87 HydrophobicContact CD2-CG 4.21Å; L77-V90 HydrophobicContact CD2-CB 4Å; L77-V90 HydrophobicContact CD2-CG1 3.8Å; L77-V90 HydrophobicContact CD2-CG2 4.27Å; L77-Y112 HydrophobicContact CD1-CE2 4.15Å
78	M	91.2	Very high	92.2	Very high	115 Å²	115	66.6 Å²	66.6	57%	0.567	34%	0.34	S	S	*	.	H	α-helix	trans	-66.9	-47.2	178.8	-67.5	-57.5	-61.2	0	0	112.3	N74 D75 Y76 N80 E81 W87	N74-M78 WeakPolarHBondContact O-CB 3.41Å; N74-M78 VanDerWaalsContact O-CG 3.27Å; N74-M78 WeakPolarHBondContact O-CG 3.23Å; N74-M78 PolarHBondContact O-N 3.42Å; D75-M78 PolarHBondContact O-N 2.87Å; Y76-M78 VanDerWaalsContact C-N 3.33Å; Y76-M78 PolarHBondContact O-N 2.98Å; M78-N80 VanDerWaalsContact C-N 3.28Å; M78-N80 PolarHBondContact O-N 3.48Å; M78-E81 PolarHBondContact O-N 3.12Å; M78-E81 VanDerWaalsContact O-N 3.1Å; M78-W87 HydrophobicContact SD-CH2 4.38Å; M78-W87 HydrophobicContact SD-CZ2 4.23Å
79	L	91.6	Very high	92.6	Very high	118 Å²	118	66.3 Å²	66.3	62%	0.618	35%	0.345	S	S	*	.	H	α-helix	trans	-64.4	-31.4	-179.1	-75.6	170.1	0	0	0	113.1	D75	D75-L79 VanDerWaalsContact O-CB 3.28Å; D75-L79 WeakPolarHBondContact O-CB 3.36Å; D75-L79 WeakPolarHBondContact O-CG 3.39Å; D75-L79 PolarHBondContact O-N 2.68Å
80	N	92	Very high	92.9	Very high	21 Å²	21	67.2 Å²	67.2	11%	0.112	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	5	176.9	-66.7	-79.1	0	0	0	113.2	W53 C54 Y76 M78 V82	W53-N80 WeakPolarHBondContact CA-OD1 3.4Å; C54-N80 PolarHBondContact N-OD1 2.78Å; Y76-N80 WeakPolarHBondContact CD2-ND2 3.3Å; Y76-N80 WeakPolarHBondContact CE2-ND2 3.4Å; Y76-N80 WeakPolarHBondContact O-CB 3.22Å; Y76-N80 PolarHBondContact O-N 2.65Å; Y76-N80 VanDerWaalsContact O-N 3.09Å; Y76-N80 PolarHBondContact O-ND2 2.96Å; M78-N80 VanDerWaalsContact C-N 3.28Å; M78-N80 PolarHBondContact O-N 3.48Å; N80-V82 HydrophobicContact CB-CG2 3.88Å; N80-V82 PolarHBondContact O-N 3.24Å
81	E	92.9	Very high	93	Very high	131 Å²	131	66.5 Å²	66.5	61%	0.612	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	50	41.6	-177.9	-63.9	170.5	-155.6	0	0	112.2	R51 L77 M78 S83	R51-E81 IonicContact CZ-OE1 2.76Å; R51-E81 VanDerWaalsContact CZ-OE1 3.25Å; R51-E81 IonicContact CZ-OE2 3.17Å; R51-E81 IonicContact NH1-OE1 3.91Å; R51-E81 PolarHBondContact NH1-OE1 3.24Å; R51-E81 IonicContact NH1-OE2 2.8Å; R51-E81 PolarHBondContact NH1-OE2 3.06Å; R51-E81 VanDerWaalsContact NH1-OE2 3.17Å; R51-E81 VanDerWaalsContact NH2-CD 3.28Å; R51-E81 IonicContact NH2-OE1 2.86Å; R51-E81 PolarHBondContact NH2-OE1 3.29Å; R51-E81 IonicContact NH2-OE2 3.25Å; R51-E81 PolarHBondContact NH2-OE2 3.18Å; L77-E81 PolarHBondContact O-N 3.5Å; L77-E81 VanDerWaalsContact O-N 3.16Å; M78-E81 PolarHBondContact O-N 3.12Å; M78-E81 VanDerWaalsContact O-N 3.1Å; E81-S83 PolarHBondContact O-N 2.96Å
82	V	92.3	Very high	93.3	Very high	25 Å²	25	64.6 Å²	64.6	15%	0.152	33%	0.329	C	S	.	.			trans	-67.9	125	179.6	-177.3	0	0	0	0	108.4	L77 N80 K86 W87 V90	L77-V82 HydrophobicContact CB-CB 4.47Å; L77-V82 HydrophobicContact CD2-CB 3.8Å; L77-V82 HydrophobicContact CD2-CG1 3.86Å; L77-V82 HydrophobicContact CD2-CG2 4Å; L77-V82 PolarHBondContact O-N 3.3Å; N80-V82 HydrophobicContact CB-CG2 3.88Å; N80-V82 PolarHBondContact O-N 3.24Å; V82-K86 HydrophobicContact CG1-CB 3.93Å; V82-W87 PolarHBondContact O-NE1 3.04Å; V82-V90 HydrophobicContact CG1-CG2 4.17Å
83	S	94	Very high	93.4	Very high	64 Å²	64	62.5 Å²	62.5	45%	0.448	34%	0.335	S	S	.	.			trans	-59.5	138	175.9	-166.7	0	0	0	0	111.8	E81 D85 K86	E81-S83 PolarHBondContact O-N 2.96Å; S83-D85 VanDerWaalsContact C-N 3.25Å; S83-D85 WeakPolarHBondContact CB-OD1 3.42Å; S83-D85 PolarHBondContact O-N 2.93Å; S83-D85 PolarHBondContact OG-OD1 3.47Å; S83-K86 WeakPolarHBondContact O-CB 3.19Å; S83-K86 PolarHBondContact O-N 3.44Å
84	E	93.2	Very high	93.3	Very high	151 Å²	151	63 Å²	63	71%	0.706	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-58.3	-32.7	-172.2	-71.3	-173.2	-171.7	0	0	113.8	K86 W87	E84-K86 PolarHBondContact O-N 3.4Å; E84-K86 VanDerWaalsContact O-N 3.11Å; E84-W87 VanDerWaalsContact CA-CD1 3.48Å; E84-W87 HydrophobicContact CG-CD2 4.32Å; E84-W87 HydrophobicContact CG-CH2 4.33Å; E84-W87 HydrophobicContact CG-CZ2 3.91Å; E84-W87 WeakPolarHBondContact O-CB 3.32Å; E84-W87 PolarHBondContact O-N 2.98Å
85	D	94.1	Very high	93.3	Very high	119 Å²	119	60.7 Å²	60.7	64%	0.636	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-60.2	-20.3	175	62.6	-63.6	0	0	0	113.2	S83	S83-D85 VanDerWaalsContact C-N 3.25Å; S83-D85 WeakPolarHBondContact CB-OD1 3.42Å; S83-D85 PolarHBondContact O-N 2.93Å; S83-D85 PolarHBondContact OG-OD1 3.47Å
86	K	94.8	Very high	93.4	Very high	118 Å²	118	58.1 Å²	58.1	51%	0.513	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-96.1	-10.8	178.9	-59.2	178.8	-176.6	173.2	0	113.2	V82 S83 E84 A88 A89 V90	V82-K86 HydrophobicContact CG1-CB 3.93Å; S83-K86 WeakPolarHBondContact O-CB 3.19Å; S83-K86 PolarHBondContact O-N 3.44Å; E84-K86 PolarHBondContact O-N 3.4Å; E84-K86 VanDerWaalsContact O-N 3.11Å; K86-A88 VanDerWaalsContact C-N 3.33Å; K86-A88 PolarHBondContact O-N 3.29Å; K86-A89 PolarHBondContact O-N 3.06Å; K86-A89 VanDerWaalsContact O-N 3.14Å; K86-V90 WeakPolarHBondContact O-CG2 3.44Å; K86-V90 PolarHBondContact O-N 3.42Å
87	W	96.2	Very high	93.4	Very high	35 Å²	35	63.2 Å²	63.2	13%	0.133	34%	0.341	C	S	.	.	H	α-helix	trans	-61.4	-39.9	-171.6	-74.2	17.5	0	0	0	113	L77 M78 V82 E84 V90 L91 Y112	L77-W87 HydrophobicContact CB-CZ2 4.4Å; L77-W87 HydrophobicContact CD1-CB 4.27Å; L77-W87 HydrophobicContact CD1-CD2 3.78Å; L77-W87 HydrophobicContact CD1-CE3 4.17Å; L77-W87 HydrophobicContact CD1-CG 3.83Å; L77-W87 HydrophobicContact CD2-CG 4.21Å; M78-W87 HydrophobicContact SD-CH2 4.38Å; M78-W87 HydrophobicContact SD-CZ2 4.23Å; V82-W87 PolarHBondContact O-NE1 3.04Å; E84-W87 VanDerWaalsContact CA-CD1 3.48Å; E84-W87 HydrophobicContact CG-CD2 4.32Å; E84-W87 HydrophobicContact CG-CH2 4.33Å; E84-W87 HydrophobicContact CG-CZ2 3.91Å; E84-W87 WeakPolarHBondContact O-CB 3.32Å; E84-W87 PolarHBondContact O-N 2.98Å; W87-V90 PolarHBondContact O-N 3.5Å; W87-L91 WeakPolarHBondContact O-CB 3.36Å; W87-L91 PolarHBondContact O-N 3.38Å; W87-Y112 HydrophobicContact CB-CD2 3.79Å; W87-Y112 HydrophobicContact CB-CE2 4.42Å; W87-Y112 HydrophobicContact CB-CG 3.94Å; W87-Y112 AromaticContact CE3-CD1 3.69Å; W87-Y112 HydrophobicContact CE3-CD1 3.69Å; W87-Y112 AromaticContact CE3-CE1 3.8Å; W87-Y112 HydrophobicContact CE3-CE1 3.8Å; W87-Y112 HydrophobicContact CE3-CG 4.06Å; W87-Y112 HydrophobicContact CZ3-CD1 4.3Å; W87-Y112 HydrophobicContact CZ3-CE1 4.17Å
88	A	96	Very high	93.3	Very high	19 Å²	19	68.4 Å²	68.4	16%	0.157	37%	0.369	C	S	.	.	H	α-helix	trans	-63.1	-43.5	176.8	0	0	0	0	0	111.8	K86 L91 R92 L115	K86-A88 VanDerWaalsContact C-N 3.33Å; K86-A88 PolarHBondContact O-N 3.29Å; A88-L91 PolarHBondContact O-N 2.9Å; A88-R92 WeakPolarHBondContact O-CG 3.29Å; A88-R92 PolarHBondContact O-N 3.35Å; A88-L115 HydrophobicContact CB-CD1 3.92Å
89	A	94.7	Very high	93.3	Very high	65 Å²	65	63 Å²	63	54%	0.537	34%	0.342	S	S	.	.	H	α-helix	trans	-65.3	-43	177.1	0	0	0	0	0	111.6	K86 R92 S93	K86-A89 PolarHBondContact O-N 3.06Å; K86-A89 VanDerWaalsContact O-N 3.14Å; A89-R92 PolarHBondContact O-N 2.95Å; A89-S93 PolarHBondContact O-N 3.4Å
90	V	94.3	Very high	93.5	Very high	28 Å²	28	62.9 Å²	62.9	17%	0.17	33%	0.334	C	S	.	.	H	α-helix	trans	-61.8	-47.1	175.7	177	0	0	0	0	110.5	L73 Y76 L77 V82 K86 W87 R92 S93 F94	L73-V90 HydrophobicContact CD1-CG1 4.05Å; Y76-V90 HydrophobicContact CE1-CG1 4.15Å; L77-V90 HydrophobicContact CD2-CB 4Å; L77-V90 HydrophobicContact CD2-CG1 3.8Å; L77-V90 HydrophobicContact CD2-CG2 4.27Å; V82-V90 HydrophobicContact CG1-CG2 4.17Å; K86-V90 WeakPolarHBondContact O-CG2 3.44Å; K86-V90 PolarHBondContact O-N 3.42Å; W87-V90 PolarHBondContact O-N 3.5Å; V90-R92 VanDerWaalsContact C-N 3.32Å; V90-R92 PolarHBondContact O-N 3.36Å; V90-S93 PolarHBondContact O-N 3Å; V90-S93 VanDerWaalsContact O-N 3.07Å; V90-S93 PolarHBondContact O-OG 3.48Å; V90-F94 WeakPolarHBondContact O-CB 3.35Å; V90-F94 PolarHBondContact O-N 3.43Å
91	L	95	Very high	93.6	Very high	3 Å²	3	66.2 Å²	66.2	2%	0.016	36%	0.355	C	S	.	.	H	α-helix	trans	-56.4	-45.2	176.4	174.2	59.8	0	0	0	112.1	L70 L73 W87 A88 S93 F94 L103 Y112 L115 T116 L119	L70-L91 HydrophobicContact CD2-CD1 4.06Å; L73-L91 HydrophobicContact CD2-CB 3.91Å; L73-L91 HydrophobicContact CD2-CD1 3.41Å; L73-L91 VanDerWaalsContact CD2-CD1 3.41Å; L73-L91 HydrophobicContact CD2-CG 4.21Å; W87-L91 WeakPolarHBondContact O-CB 3.36Å; W87-L91 PolarHBondContact O-N 3.38Å; A88-L91 PolarHBondContact O-N 2.9Å; L91-S93 VanDerWaalsContact C-N 3.3Å; L91-S93 PolarHBondContact O-N 2.92Å; L91-F94 WeakPolarHBondContact O-CB 3.49Å; L91-F94 PolarHBondContact O-N 3.44Å; L91-L103 HydrophobicContact CG-CD1 4.4Å; L91-Y112 HydrophobicContact CB-CD2 4.14Å; L91-Y112 HydrophobicContact CB-CE2 4.11Å; L91-Y112 HydrophobicContact CD2-CD2 3.93Å; L91-Y112 HydrophobicContact CD2-CE2 3.96Å; L91-L115 HydrophobicContact CD2-CB 3.51Å; L91-L115 HydrophobicContact CD2-CD1 4.2Å; L91-T116 HydrophobicContact CD2-CG2 4Å; L91-L119 HydrophobicContact CD1-CD1 3.85Å; L91-L119 HydrophobicContact CD2-CD1 4.27Å; L91-L119 HydrophobicContact CG-CD1 4.45Å
92	R	94.5	Very high	93.6	Very high	30 Å²	30	60.5 Å²	60.5	11%	0.113	33%	0.329	C	S	.	.	H	α-helix	trans	-62	-35.6	176.2	-72.8	177.5	176.4	-72.2	-0.8	112.7	A88 A89 V90 F94 V95 Y100 L103 G107 L115	A88-R92 WeakPolarHBondContact O-CG 3.29Å; A88-R92 PolarHBondContact O-N 3.35Å; A89-R92 PolarHBondContact O-N 2.95Å; V90-R92 VanDerWaalsContact C-N 3.32Å; V90-R92 PolarHBondContact O-N 3.36Å; R92-F94 PolarHBondContact O-N 2.91Å; R92-V95 WeakPolarHBondContact O-CG2 3.48Å; R92-Y100 HydrophobicContact CB-CD2 4.4Å; R92-Y100 HydrophobicContact CB-CE2 4.1Å; R92-Y100 WeakPolarHBondContact O-CD2 3.18Å; R92-L103 HydrophobicContact CG-CD1 4.4Å; R92-L103 VanDerWaalsContact CZ-O 3.31Å; R92-L103 PolarHBondContact NH1-O 3.29Å; R92-L103 PolarHBondContact NH2-O 3.4Å; R92-G107 PolarHBondContact NH2-O 3.46Å; R92-L115 HydrophobicContact CG-CD1 4.09Å
93	S	92.3	Very high	93.7	Very high	87 Å²	87	59.3 Å²	59.3	61%	0.608	32%	0.322	S	S	*	.	H	α-helix	trans	-72.8	-9.4	175.3	75.3	0	0	0	0	113.7	A89 V90 L91	A89-S93 PolarHBondContact O-N 3.4Å; V90-S93 PolarHBondContact O-N 3Å; V90-S93 VanDerWaalsContact O-N 3.07Å; V90-S93 PolarHBondContact O-OG 3.48Å; L91-S93 VanDerWaalsContact C-N 3.3Å; L91-S93 PolarHBondContact O-N 2.92Å
94	F	91.3	Very high	93.7	Very high	12 Å²	12	58.5 Å²	58.5	5%	0.053	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.6	2.8	-168.1	-156	-112.3	0	0	0	114.1	P56 P57 S58 C59 F60 L73 V90 L91 R92	P56-F94 HydrophobicContact CB-CE2 4.08Å; P57-F94 HydrophobicContact CB-CE1 4.23Å; P57-F94 HydrophobicContact CB-CE2 4.3Å; P57-F94 HydrophobicContact CB-CZ 3.44Å; P57-F94 VanDerWaalsContact CB-CZ 3.44Å; P57-F94 HydrophobicContact CG-CE1 3.98Å; P57-F94 HydrophobicContact CG-CE2 4.01Å; P57-F94 HydrophobicContact CG-CZ 3.28Å; P57-F94 WeakPolarHBondContact O-CE2 3.49Å; P57-F94 WeakPolarHBondContact O-CZ 3.34Å; S58-F94 WeakPolarHBondContact O-CE1 3.25Å; S58-F94 WeakPolarHBondContact O-CZ 3.27Å; C59-F94 CarbonylContact C-O 3.5Å; C59-F94 VanDerWaalsContact CA-O 3.31Å; C59-F94 WeakPolarHBondContact CA-O 3.49Å; F60-F94 PolarHBondContact N-O 3.06Å; L73-F94 HydrophobicContact CB-CD1 4.41Å; L73-F94 HydrophobicContact CB-CE1 4.4Å; L73-F94 HydrophobicContact CD1-CD1 3.99Å; L73-F94 HydrophobicContact CD1-CE1 4.34Å; L73-F94 HydrophobicContact CD1-CG 4.11Å; L73-F94 HydrophobicContact CD2-CD1 4.42Å; V90-F94 WeakPolarHBondContact O-CB 3.35Å; V90-F94 PolarHBondContact O-N 3.43Å; L91-F94 WeakPolarHBondContact O-CB 3.49Å; L91-F94 PolarHBondContact O-N 3.44Å; R92-F94 PolarHBondContact O-N 2.91Å
95	V	92.3	Very high	93.8	Very high	12 Å²	12	57.4 Å²	57.4	7%	0.073	31%	0.314	C	S	.	.	B	Isolated β-bridge	trans	-108.4	158.2	179.7	-61.9	0	0	0	0	110.2	F60 R92 V99 Y100 L103	F60-V95 HydrophobicContact CB-CG1 4.11Å; F60-V95 HydrophobicContact CD1-CB 4.49Å; F60-V95 HydrophobicContact CD1-CG1 4.03Å; F60-V95 HydrophobicContact CG-CG1 4.44Å; R92-V95 WeakPolarHBondContact O-CG2 3.48Å; V95-V99 HydrophobicContact CB-CB 3.86Å; V95-V99 HydrophobicContact CB-CG1 3.65Å; V95-V99 HydrophobicContact CG1-CB 4.41Å; V95-V99 HydrophobicContact CG1-CG1 3.66Å; V95-V99 HydrophobicContact CG2-CB 4.35Å; V95-V99 HydrophobicContact CG2-CG1 4.15Å; V95-Y100 HydrophobicContact CG2-CD2 4.36Å; V95-L103 HydrophobicContact CG1-CD1 3.97Å; V95-L103 HydrophobicContact CG2-CD1 4.08Å
96	D	91.7	Very high	93.9	Very high	37 Å²	37	55 Å²	55	20%	0.198	30%	0.299	C	S	.	.			trans	-70.1	170.3	168.4	66.5	21.3	0	0	0	111.9	F60 S61 H62 D98 V99 Y100	F60-D96 PolarHBondContact O-N 3.32Å; S61-D96 VanDerWaalsContact CA-OD2 3.25Å; S61-D96 WeakPolarHBondContact CA-OD2 3.29Å; S61-D96 WeakPolarHBondContact CB-OD2 3.27Å; H62-D96 IonicContact ND1-OD2 2.66Å; D96-D98 VanDerWaalsContact C-N 3.3Å; D96-D98 PolarHBondContact O-N 3.02Å; D96-D98 PolarHBondContact OD1-N 3.02Å; D96-V99 PolarHBondContact O-N 2.93Å; D96-V99 VanDerWaalsContact OD1-CB 3.29Å; D96-V99 WeakPolarHBondContact OD1-CB 3.44Å; D96-V99 WeakPolarHBondContact OD1-CG2 3.49Å; D96-V99 PolarHBondContact OD1-N 3.29Å; D96-Y100 WeakPolarHBondContact O-CB 3.27Å; D96-Y100 PolarHBondContact O-N 3.44Å
97	D	93.4	Very high	93.9	Very high	138 Å²	138	50.3 Å²	50.3	74%	0.738	28%	0.283	S	S	*	.	H	α-helix	trans	-60.2	-39.4	-175.6	-65.7	-13.6	0	0	0	112	V99 Y100 V101	D97-V99 PolarHBondContact O-N 3.04Å; D97-Y100 WeakPolarHBondContact O-CB 3.4Å; D97-Y100 PolarHBondContact O-N 3.46Å; D97-V101 WeakPolarHBondContact O-CG2 3.26Å; D97-V101 PolarHBondContact O-N 3.2Å; D97-V101 VanDerWaalsContact O-N 3.13Å
98	D	90.7	Very high	93.7	Very high	109 Å²	109	54.7 Å²	54.7	58%	0.583	32%	0.316	S	S	*	.	H	α-helix	trans	-63.8	-44	179.8	-69.9	-28.1	0	0	0	111.7	D96	D96-D98 VanDerWaalsContact C-N 3.3Å; D96-D98 PolarHBondContact O-N 3.02Å; D96-D98 PolarHBondContact OD1-N 3.02Å
99	V	92.5	Very high	93.6	Very high	0 Å²	0	60 Å²	60	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-73.7	-32.2	177.2	175.8	0	0	0	0	111	F60 V95 D96 D97 V101 V102 L103 L119 Y123	F60-V99 HydrophobicContact CD1-CB 4.18Å; F60-V99 HydrophobicContact CD1-CG1 3.73Å; F60-V99 HydrophobicContact CD1-CG2 3.8Å; F60-V99 HydrophobicContact CE1-CB 4.28Å; F60-V99 HydrophobicContact CE1-CG1 3.74Å; F60-V99 HydrophobicContact CE1-CG2 3.61Å; V95-V99 HydrophobicContact CB-CB 3.86Å; V95-V99 HydrophobicContact CB-CG1 3.65Å; V95-V99 HydrophobicContact CG1-CB 4.41Å; V95-V99 HydrophobicContact CG1-CG1 3.66Å; V95-V99 HydrophobicContact CG2-CB 4.35Å; V95-V99 HydrophobicContact CG2-CG1 4.15Å; D96-V99 PolarHBondContact O-N 2.93Å; D96-V99 VanDerWaalsContact OD1-CB 3.29Å; D96-V99 WeakPolarHBondContact OD1-CB 3.44Å; D96-V99 WeakPolarHBondContact OD1-CG2 3.49Å; D96-V99 PolarHBondContact OD1-N 3.29Å; D97-V99 PolarHBondContact O-N 3.04Å; V99-V101 VanDerWaalsContact C-N 3.31Å; V99-V101 PolarHBondContact O-N 3.4Å; V99-V102 WeakPolarHBondContact O-CB 3.31Å; V99-V102 PolarHBondContact O-N 3.5Å; V99-L103 HydrophobicContact CG1-CG 4.43Å; V99-L103 PolarHBondContact O-N 2.82Å; V99-L119 HydrophobicContact CG1-CD2 3.48Å; V99-L119 VanDerWaalsContact CG1-CD2 3.48Å; V99-Y123 HydrophobicContact CG1-CE2 4.01Å; V99-Y123 HydrophobicContact CG2-CE1 4.4Å; V99-Y123 HydrophobicContact CG2-CE2 4.04Å
100	Y	94.4	Very high	93.6	Very high	117 Å²	117	57.3 Å²	57.3	46%	0.459	33%	0.325	S	S	.	.	H	α-helix	trans	-58.7	-44.4	175.5	-177.7	-88.5	0	0	0	111.4	R92 V95 D96 D97 V102 L103 A104	R92-Y100 HydrophobicContact CB-CD2 4.4Å; R92-Y100 HydrophobicContact CB-CE2 4.1Å; R92-Y100 WeakPolarHBondContact O-CD2 3.18Å; V95-Y100 HydrophobicContact CG2-CD2 4.36Å; D96-Y100 WeakPolarHBondContact O-CB 3.27Å; D96-Y100 PolarHBondContact O-N 3.44Å; D97-Y100 WeakPolarHBondContact O-CB 3.4Å; D97-Y100 PolarHBondContact O-N 3.46Å; Y100-V102 VanDerWaalsContact C-N 3.29Å; Y100-V102 PolarHBondContact O-N 2.74Å; Y100-L103 PolarHBondContact O-N 3.37Å; Y100-L103 VanDerWaalsContact O-N 3.12Å; Y100-A104 PolarHBondContact O-N 3.02Å
101	V	94.5	Very high	93.7	Very high	91 Å²	91	59.4 Å²	59.4	55%	0.552	34%	0.338	S	S	*	.	H	α-helix	trans	-56.5	-45.2	176.2	172.1	0	0	0	0	110.6	D97 V99 L103 A104 E105	D97-V101 WeakPolarHBondContact O-CG2 3.26Å; D97-V101 PolarHBondContact O-N 3.2Å; D97-V101 VanDerWaalsContact O-N 3.13Å; V99-V101 VanDerWaalsContact C-N 3.31Å; V99-V101 PolarHBondContact O-N 3.4Å; V101-L103 PolarHBondContact O-N 3.3Å; V101-A104 WeakPolarHBondContact O-CB 3.26Å; V101-A104 PolarHBondContact O-N 3.23Å; V101-E105 PolarHBondContact O-N 3.29Å
102	V	93.2	Very high	93.8	Very high	11 Å²	11	61.3 Å²	61.3	7%	0.067	35%	0.345	C	S	.	.	H	α-helix	trans	-59.8	-44.7	175.6	164	0	0	0	0	112.3	V99 Y100 A104 E105 R122 Y123	V99-V102 WeakPolarHBondContact O-CB 3.31Å; V99-V102 PolarHBondContact O-N 3.5Å; Y100-V102 VanDerWaalsContact C-N 3.29Å; Y100-V102 PolarHBondContact O-N 2.74Å; V102-A104 VanDerWaalsContact C-N 3.28Å; V102-A104 PolarHBondContact O-N 3.4Å; V102-E105 WeakPolarHBondContact O-CB 3.44Å; V102-E105 PolarHBondContact O-N 3.36Å; V102-R122 VanDerWaalsContact CG1-CD 3.47Å; V102-R122 VanDerWaalsContact CG1-NH1 3.34Å; V102-R122 VanDerWaalsContact CG2-NH1 3.32Å; V102-Y123 HydrophobicContact CG1-CE2 4.31Å; V102-Y123 WeakPolarHBondContact CG2-OH 3.49Å
103	L	94.9	Very high	93.8	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-68.6	-29.1	178.5	-69	-170.8	0	0	0	112.4	L91 R92 V95 V99 Y100 V101 E105 E106 L115 C118 L119	L91-L103 HydrophobicContact CG-CD1 4.4Å; R92-L103 HydrophobicContact CG-CD1 4.4Å; R92-L103 VanDerWaalsContact CZ-O 3.31Å; R92-L103 PolarHBondContact NH1-O 3.29Å; R92-L103 PolarHBondContact NH2-O 3.4Å; V95-L103 HydrophobicContact CG1-CD1 3.97Å; V95-L103 HydrophobicContact CG2-CD1 4.08Å; V99-L103 HydrophobicContact CG1-CG 4.43Å; V99-L103 PolarHBondContact O-N 2.82Å; Y100-L103 PolarHBondContact O-N 3.37Å; Y100-L103 VanDerWaalsContact O-N 3.12Å; V101-L103 PolarHBondContact O-N 3.3Å; L103-E105 PolarHBondContact O-N 3.45Å; L103-E106 PolarHBondContact O-N 3.45Å; L103-L115 HydrophobicContact CB-CD2 4.15Å; L103-L115 HydrophobicContact CD2-CB 4.25Å; L103-L115 HydrophobicContact CD2-CD2 3.94Å; L103-L115 HydrophobicContact CG-CD2 4.48Å; L103-C118 HydrophobicContact CD2-CB 4.44Å; L103-L119 HydrophobicContact CD2-CD1 4.45Å; L103-L119 HydrophobicContact CD2-CD2 3.84Å; L103-L119 HydrophobicContact CD2-CG 3.86Å; L103-L119 HydrophobicContact CG-CD2 4.3Å
104	A	94.3	Very high	94	Very high	47 Å²	47	64 Å²	64	39%	0.388	36%	0.358	S	S	.	.	H	α-helix	trans	-65.8	-29.2	177.5	0	0	0	0	0	112	Y100 V101 V102 E106 G107	Y100-A104 PolarHBondContact O-N 3.02Å; V101-A104 WeakPolarHBondContact O-CB 3.26Å; V101-A104 PolarHBondContact O-N 3.23Å; V102-A104 VanDerWaalsContact C-N 3.28Å; V102-A104 PolarHBondContact O-N 3.4Å; A104-E106 PolarHBondContact O-N 3.22Å; A104-G107 PolarHBondContact O-N 2.99Å
105	E	95.1	Very high	94.2	Very high	128 Å²	128	63.4 Å²	63.4	60%	0.598	36%	0.355	S	S	*	.	H	α-helix	trans	-61.6	-28.6	175.6	-62.2	176.2	157.7	0	0	112.8	V101 V102 L103 G107 R122	V101-E105 PolarHBondContact O-N 3.29Å; V102-E105 WeakPolarHBondContact O-CB 3.44Å; V102-E105 PolarHBondContact O-N 3.36Å; L103-E105 PolarHBondContact O-N 3.45Å; E105-G107 PolarHBondContact O-N 2.86Å; E105-R122 IonicContact OE2-CZ 3.88Å; E105-R122 IonicContact OE2-NH1 3.62Å; E105-R122 PolarHBondContact OE2-NH1 3.01Å
106	E	95.2	Very high	94.2	Very high	69 Å²	69	63.5 Å²	63.5	32%	0.322	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-10.3	175.9	-58.7	-71.5	157	0	0	112.6	L103 A104 A110 L115 C118 R121	L103-E106 PolarHBondContact O-N 3.45Å; A104-E106 PolarHBondContact O-N 3.22Å; E106-A110 HydrophobicContact CB-CB 3.9Å; E106-L115 HydrophobicContact CB-CD2 4.05Å; E106-L115 HydrophobicContact CG-CD2 4.31Å; E106-C118 HydrophobicContact CG-CB 3.91Å; E106-C118 WeakPolarHBondContact OE1-CB 3.41Å; E106-C118 PolarHBondContact OE1-SG 3.4Å; E106-R121 IonicContact OE1-NH2 2.7Å; E106-R121 PolarHBondContact OE1-NH2 2.88Å
107	G	94.6	Very high	94.2	Very high	18 Å²	18	64.4 Å²	64.4	19%	0.186	37%	0.365	C	S	.	.			trans	92.4	159.7	177.3	0	0	0	0	0	114.8	R92 A104 E105 T109 A110	R92-G107 PolarHBondContact NH2-O 3.46Å; A104-G107 PolarHBondContact O-N 2.99Å; E105-G107 PolarHBondContact O-N 2.86Å; G107-T109 VanDerWaalsContact C-N 3.26Å; G107-T109 PolarHBondContact O-N 3.02Å; G107-A110 WeakPolarHBondContact O-CB 3.28Å; G107-A110 PolarHBondContact O-N 3.42Å
108	P	92.8	Very high	94.2	Very high	127 Å²	127	57.9 Å²	57.9	83%	0.825	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-23	-171.9	27.3	-35.2	0	0	0	113.8
109	T	94	Very high	94.3	Very high	132 Å²	132	52.7 Å²	52.7	81%	0.81	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	5.3	-179.1	55.9	0	0	0	0	113.4	G107 T111	G107-T109 VanDerWaalsContact C-N 3.26Å; G107-T109 PolarHBondContact O-N 3.02Å; T109-T111 PolarHBondContact O-N 3.39Å
110	A	95.7	Very high	94.1	Very high	8 Å²	8	58.5 Å²	58.5	7%	0.066	33%	0.328	C	S	.	.			trans	-58.3	130.6	178.7	0	0	0	0	0	111.1	E106 G107 E114 L115	E106-A110 HydrophobicContact CB-CB 3.9Å; G107-A110 WeakPolarHBondContact O-CB 3.28Å; G107-A110 PolarHBondContact O-N 3.42Å; A110-E114 WeakPolarHBondContact CA-OE2 3.24Å; A110-L115 HydrophobicContact CB-CD2 3.76Å; A110-L115 HydrophobicContact CB-CG 4.04Å
111	T	96.4	Very high	93.8	Very high	71 Å²	71	60.9 Å²	60.9	44%	0.436	34%	0.336	S	S	.	.			trans	-70.3	161.1	177.9	64.5	0	0	0	0	111.2	T109 S113 E114 L115	T109-T111 PolarHBondContact O-N 3.39Å; T111-S113 PolarHBondContact O-N 3.16Å; T111-E114 WeakPolarHBondContact CB-OE2 3.45Å; T111-E114 WeakPolarHBondContact CG2-OE2 3.47Å; T111-E114 PolarHBondContact N-OE2 3.37Å; T111-E114 PolarHBondContact O-N 2.93Å; T111-E114 VanDerWaalsContact OG1-CD 3.31Å; T111-E114 VanDerWaalsContact OG1-CG 3.32Å; T111-E114 WeakPolarHBondContact OG1-CG 3.44Å; T111-E114 PolarHBondContact OG1-N 3.41Å; T111-E114 PolarHBondContact OG1-OE2 3.01Å; T111-L115 WeakPolarHBondContact O-CG 3.38Å; T111-L115 PolarHBondContact O-N 2.97Å
112	Y	95.6	Very high	93.4	Very high	43 Å²	43	62.9 Å²	62.9	17%	0.169	33%	0.333	C	S	.	.	H	α-helix	trans	-56.1	-37	173.2	-180	-103.3	0	0	0	112.2	L73 L77 W87 L91 T116	L73-Y112 HydrophobicContact CD2-CE2 4.11Å; L77-Y112 HydrophobicContact CD1-CE2 4.15Å; W87-Y112 HydrophobicContact CB-CD2 3.79Å; W87-Y112 HydrophobicContact CB-CE2 4.42Å; W87-Y112 HydrophobicContact CB-CG 3.94Å; W87-Y112 AromaticContact CE3-CD1 3.69Å; W87-Y112 HydrophobicContact CE3-CD1 3.69Å; W87-Y112 AromaticContact CE3-CE1 3.8Å; W87-Y112 HydrophobicContact CE3-CE1 3.8Å; W87-Y112 HydrophobicContact CE3-CG 4.06Å; W87-Y112 HydrophobicContact CZ3-CD1 4.3Å; W87-Y112 HydrophobicContact CZ3-CE1 4.17Å; L91-Y112 HydrophobicContact CB-CD2 4.14Å; L91-Y112 HydrophobicContact CB-CE2 4.11Å; L91-Y112 HydrophobicContact CD2-CD2 3.93Å; L91-Y112 HydrophobicContact CD2-CE2 3.96Å; Y112-T116 HydrophobicContact CD1-CG2 4.14Å; Y112-T116 HydrophobicContact CD2-CG2 4.25Å; Y112-T116 HydrophobicContact CE1-CG2 3.77Å; Y112-T116 HydrophobicContact CE2-CG2 3.89Å; Y112-T116 HydrophobicContact CG-CG2 4.38Å; Y112-T116 WeakPolarHBondContact O-CB 3.46Å; Y112-T116 VanDerWaalsContact O-CG2 3.27Å; Y112-T116 WeakPolarHBondContact O-CG2 3.42Å; Y112-T116 PolarHBondContact O-N 3.2Å; Y112-T116 PolarHBondContact O-OG1 2.97Å
113	S	94.8	Very high	93	Very high	77 Å²	77	64.8 Å²	64.8	54%	0.538	34%	0.34	S	S	.	.	H	α-helix	trans	-65.2	-42.6	177.9	-169.9	0	0	0	0	112.7	T111 T116 S117	T111-S113 PolarHBondContact O-N 3.16Å; S113-T116 WeakPolarHBondContact CA-OG1 3.27Å; S113-T116 PolarHBondContact O-OG1 2.98Å; S113-S117 VanDerWaalsContact O-CB 3.3Å; S113-S117 WeakPolarHBondContact O-CB 3.42Å; S113-S117 PolarHBondContact O-N 3.23Å; S113-S117 PolarHBondContact O-OG 3.25Å
114	E	96	Very high	92.3	Very high	96 Å²	96	65.7 Å²	65.7	45%	0.449	35%	0.349	S	S	.	.	H	α-helix	trans	-65.4	-45.5	177.5	-72	161.2	145.6	0	0	111.2	A110 T111 S117 C118	A110-E114 WeakPolarHBondContact CA-OE2 3.24Å; T111-E114 WeakPolarHBondContact CB-OE2 3.45Å; T111-E114 WeakPolarHBondContact CG2-OE2 3.47Å; T111-E114 PolarHBondContact N-OE2 3.37Å; T111-E114 PolarHBondContact O-N 2.93Å; T111-E114 VanDerWaalsContact OG1-CD 3.31Å; T111-E114 VanDerWaalsContact OG1-CG 3.32Å; T111-E114 WeakPolarHBondContact OG1-CG 3.44Å; T111-E114 PolarHBondContact OG1-N 3.41Å; T111-E114 PolarHBondContact OG1-OE2 3.01Å; E114-S117 WeakPolarHBondContact O-CB 3.32Å; E114-S117 PolarHBondContact O-N 3.18Å; E114-C118 WeakPolarHBondContact O-CB 3.29Å; E114-C118 PolarHBondContact O-N 2.86Å
115	L	95.9	Very high	91.1	Very high	0 Å²	0	67 Å²	67	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-63.5	-44.5	178.1	-62.9	177.2	0	0	0	112.2	A88 L91 R92 L103 E106 A110 T111 S117 C118 L119	A88-L115 HydrophobicContact CB-CD1 3.92Å; L91-L115 HydrophobicContact CD2-CB 3.51Å; L91-L115 HydrophobicContact CD2-CD1 4.2Å; R92-L115 HydrophobicContact CG-CD1 4.09Å; L103-L115 HydrophobicContact CB-CD2 4.15Å; L103-L115 HydrophobicContact CD2-CB 4.25Å; L103-L115 HydrophobicContact CD2-CD2 3.94Å; L103-L115 HydrophobicContact CG-CD2 4.48Å; E106-L115 HydrophobicContact CB-CD2 4.05Å; E106-L115 HydrophobicContact CG-CD2 4.31Å; A110-L115 HydrophobicContact CB-CD2 3.76Å; A110-L115 HydrophobicContact CB-CG 4.04Å; T111-L115 WeakPolarHBondContact O-CG 3.38Å; T111-L115 PolarHBondContact O-N 2.97Å; L115-S117 VanDerWaalsContact C-N 3.3Å; L115-S117 PolarHBondContact O-N 3.16Å; L115-C118 WeakPolarHBondContact O-CB 3.42Å; L115-C118 PolarHBondContact O-N 2.85Å; L115-L119 WeakPolarHBondContact O-CG 3.44Å; L115-L119 PolarHBondContact O-N 3.27Å
116	T	93.5	Very high	89.6	Confident	15 Å²	15	64.8 Å²	64.8	9%	0.092	37%	0.365	C	S	.	.	H	α-helix	trans	-64.6	-35.4	176	53.8	0	0	0	0	112.2	L70 L91 Y112 S113 L119 K120	L70-T116 HydrophobicContact CD1-CG2 4.07Å; L70-T116 HydrophobicContact CD2-CG2 3.76Å; L91-T116 HydrophobicContact CD2-CG2 4Å; Y112-T116 HydrophobicContact CD1-CG2 4.14Å; Y112-T116 HydrophobicContact CD2-CG2 4.25Å; Y112-T116 HydrophobicContact CE1-CG2 3.77Å; Y112-T116 HydrophobicContact CE2-CG2 3.89Å; Y112-T116 HydrophobicContact CG-CG2 4.38Å; Y112-T116 WeakPolarHBondContact O-CB 3.46Å; Y112-T116 VanDerWaalsContact O-CG2 3.27Å; Y112-T116 WeakPolarHBondContact O-CG2 3.42Å; Y112-T116 PolarHBondContact O-N 3.2Å; Y112-T116 PolarHBondContact O-OG1 2.97Å; S113-T116 WeakPolarHBondContact CA-OG1 3.27Å; S113-T116 PolarHBondContact O-OG1 2.98Å; T116-L119 PolarHBondContact O-N 3.4Å; T116-K120 WeakPolarHBondContact O-CB 3.38Å; T116-K120 VanDerWaalsContact O-CG 3.3Å; T116-K120 WeakPolarHBondContact O-CG 3.29Å; T116-K120 PolarHBondContact O-N 2.78Å
117	S	91.7	Very high	88.2	Confident	55 Å²	55	63.2 Å²	63.2	39%	0.385	36%	0.359	S	S	.	.	H	α-helix	trans	-67.2	-40.5	174.3	-61.3	0	0	0	0	111.9	S113 E114 L115 K120 R121	S113-S117 VanDerWaalsContact O-CB 3.3Å; S113-S117 WeakPolarHBondContact O-CB 3.42Å; S113-S117 PolarHBondContact O-N 3.23Å; S113-S117 PolarHBondContact O-OG 3.25Å; E114-S117 WeakPolarHBondContact O-CB 3.32Å; E114-S117 PolarHBondContact O-N 3.18Å; L115-S117 VanDerWaalsContact C-N 3.3Å; L115-S117 PolarHBondContact O-N 3.16Å; S117-K120 PolarHBondContact O-N 2.89Å; S117-R121 VanDerWaalsContact O-CB 3.27Å; S117-R121 WeakPolarHBondContact O-CB 3.46Å; S117-R121 PolarHBondContact O-N 3.26Å
118	C	92.9	Very high	87.3	Confident	1 Å²	1	65.2 Å²	65.2	1%	0.007	37%	0.37	C	S	.	.	H	α-helix	trans	-58.9	-49.5	172.9	-178.9	0	0	0	0	111.5	L103 E106 E114 L115 K120 R121 R122	L103-C118 HydrophobicContact CD2-CB 4.44Å; E106-C118 HydrophobicContact CG-CB 3.91Å; E106-C118 WeakPolarHBondContact OE1-CB 3.41Å; E106-C118 PolarHBondContact OE1-SG 3.4Å; E114-C118 WeakPolarHBondContact O-CB 3.29Å; E114-C118 PolarHBondContact O-N 2.86Å; L115-C118 WeakPolarHBondContact O-CB 3.42Å; L115-C118 PolarHBondContact O-N 2.85Å; C118-K120 PolarHBondContact O-N 3.14Å; C118-R121 PolarHBondContact O-N 3.34Å; C118-R122 PolarHBondContact O-N 2.9Å
119	L	92	Very high	86.5	Confident	1 Å²	1	66.6 Å²	66.6	1%	0.005	37%	0.365	C	S	.	.	H	α-helix	trans	-60.1	-45.6	177.7	-68.8	173.9	0	0	0	112.1	F60 V66 L70 L91 V99 L103 L115 T116 R121 R122 Y123 G124	F60-L119 HydrophobicContact CD1-CD2 4.43Å; F60-L119 HydrophobicContact CE1-CD2 3.94Å; V66-L119 HydrophobicContact CG2-CB 3.68Å; L70-L119 HydrophobicContact CD2-CD1 3.97Å; L91-L119 HydrophobicContact CD1-CD1 3.85Å; L91-L119 HydrophobicContact CD2-CD1 4.27Å; L91-L119 HydrophobicContact CG-CD1 4.45Å; V99-L119 HydrophobicContact CG1-CD2 3.48Å; V99-L119 VanDerWaalsContact CG1-CD2 3.48Å; L103-L119 HydrophobicContact CD2-CD1 4.45Å; L103-L119 HydrophobicContact CD2-CD2 3.84Å; L103-L119 HydrophobicContact CD2-CG 3.86Å; L103-L119 HydrophobicContact CG-CD2 4.3Å; L115-L119 WeakPolarHBondContact O-CG 3.44Å; L115-L119 PolarHBondContact O-N 3.27Å; T116-L119 PolarHBondContact O-N 3.4Å; L119-R121 VanDerWaalsContact C-N 3.32Å; L119-R121 PolarHBondContact O-N 2.83Å; L119-R122 PolarHBondContact O-N 2.84Å; L119-Y123 HydrophobicContact CD2-CD2 3.82Å; L119-Y123 HydrophobicContact CD2-CE2 3.89Å; L119-Y123 WeakPolarHBondContact O-CA 3.42Å; L119-Y123 WeakPolarHBondContact O-CB 3.42Å; L119-Y123 PolarHBondContact O-N 3.43Å; L119-G124 PolarHBondContact O-N 3.07Å
120	K	89.1	Confident	85.9	Confident	121 Å²	121	65.6 Å²	65.6	53%	0.526	36%	0.355	S	S	.	.	H	α-helix	trans	-62.6	-38.6	176.7	-74.6	174.1	-179.8	177.5	0	112.2	L70 T116 S117 C118 G124	L70-K120 HydrophobicContact CD1-CG 4.09Å; T116-K120 WeakPolarHBondContact O-CB 3.38Å; T116-K120 VanDerWaalsContact O-CG 3.3Å; T116-K120 WeakPolarHBondContact O-CG 3.29Å; T116-K120 PolarHBondContact O-N 2.78Å; S117-K120 PolarHBondContact O-N 2.89Å; C118-K120 PolarHBondContact O-N 3.14Å; K120-G124 WeakPolarHBondContact O-CA 3.46Å; K120-G124 PolarHBondContact O-N 3.13Å
121	R	87	Confident	85.4	Confident	167 Å²	167	69.2 Å²	69.2	63%	0.63	37%	0.371	S	S	*	.	H	α-helix	trans	-68.8	-40.3	179	-176.3	177.5	65	-115	1.8	112.2	E106 S117 C118 L119	E106-R121 IonicContact OE1-NH2 2.7Å; E106-R121 PolarHBondContact OE1-NH2 2.88Å; S117-R121 VanDerWaalsContact O-CB 3.27Å; S117-R121 WeakPolarHBondContact O-CB 3.46Å; S117-R121 PolarHBondContact O-N 3.26Å; C118-R121 PolarHBondContact O-N 3.34Å; L119-R121 VanDerWaalsContact C-N 3.32Å; L119-R121 PolarHBondContact O-N 2.83Å
122	R	87.1	Confident	84.9	Confident	133 Å²	133	66.4 Å²	66.4	50%	0.502	35%	0.354	S	S	.	.	H	α-helix	trans	-90	-35.9	-173.5	-156.8	171.1	-154.2	153	-1.2	114	V102 E105 C118 L119	V102-R122 VanDerWaalsContact CG1-CD 3.47Å; V102-R122 VanDerWaalsContact CG1-NH1 3.34Å; V102-R122 VanDerWaalsContact CG2-NH1 3.32Å; E105-R122 IonicContact OE2-CZ 3.88Å; E105-R122 IonicContact OE2-NH1 3.62Å; E105-R122 PolarHBondContact OE2-NH1 3.01Å; C118-R122 PolarHBondContact O-N 2.9Å; L119-R122 PolarHBondContact O-N 2.84Å
123	Y	85.5	Confident	84.5	Confident	51 Å²	51	70.3 Å²	70.3	20%	0.2	37%	0.368	C	S	.	.	H	α-helix	trans	-121.4	1.5	-174.8	-51.6	-72.9	0	0	0	113.4	F60 H62 V99 V102 L119	F60-Y123 AromaticContact CE1-CD2 3.94Å; F60-Y123 HydrophobicContact CE1-CD2 3.94Å; F60-Y123 HydrophobicContact CE1-CE2 4.3Å; F60-Y123 HydrophobicContact CE1-CG 4.28Å; F60-Y123 HydrophobicContact CZ-CD2 4Å; F60-Y123 HydrophobicContact CZ-CG 4.02Å; H62-Y123 HydrophobicContact CB-CD1 3.8Å; H62-Y123 HydrophobicContact CB-CE1 3.61Å; V99-Y123 HydrophobicContact CG1-CE2 4.01Å; V99-Y123 HydrophobicContact CG2-CE1 4.4Å; V99-Y123 HydrophobicContact CG2-CE2 4.04Å; V102-Y123 HydrophobicContact CG1-CE2 4.31Å; V102-Y123 WeakPolarHBondContact CG2-OH 3.49Å; L119-Y123 HydrophobicContact CD2-CD2 3.82Å; L119-Y123 HydrophobicContact CD2-CE2 3.89Å; L119-Y123 WeakPolarHBondContact O-CA 3.42Å; L119-Y123 WeakPolarHBondContact O-CB 3.42Å; L119-Y123 PolarHBondContact O-N 3.43Å
124	G	78.9	Confident	84.3	Confident	19 Å²	19	68.6 Å²	68.6	20%	0.196	36%	0.355	C	S	.	.	S	Bend	trans	-65.6	161.2	172.2	0	0	0	0	0	111.9	V66 L119 K120 G126	V66-G124 VanDerWaalsContact CG1-CA 3.48Å; L119-G124 PolarHBondContact O-N 3.07Å; K120-G124 WeakPolarHBondContact O-CA 3.46Å; K120-G124 PolarHBondContact O-N 3.13Å; G124-G126 PolarHBondContact O-N 2.89Å
125	P	69.2	Low	84.2	Confident	76 Å²	76	68.8 Å²	68.8	49%	0.494	35%	0.351	S	S	.	.			trans	-57.3	109.6	167.2	24.2	-30.2	0	0	0	107.1	D127	P125-D127 PolarHBondContact O-N 2.84Å
126	G	64.4	Low	84.2	Confident	81 Å²	81	69.2 Å²	69.2	84%	0.835	35%	0.353	S	S	*	.			trans	-64.3	11.2	-179.8	0	0	0	0	0	114.2	G124 S128	G124-G126 PolarHBondContact O-N 2.89Å; G126-S128 PolarHBondContact O-N 3.49Å
127	D	65.9	Low	84.2	Confident	36 Å²	36	70 Å²	70	19%	0.193	36%	0.361	C	S	.	.			trans	-68.2	117	171.3	-59	-43	0	0	0	107.9	P125 M131 V132 R135 R160	P125-D127 PolarHBondContact O-N 2.84Å; D127-M131 HydrophobicContact CB-CB 4.2Å; D127-V132 HydrophobicContact CB-CG2 3.58Å; D127-R135 IonicContact OD1-CZ 3.19Å; D127-R135 VanDerWaalsContact OD1-CZ 3.26Å; D127-R135 IonicContact OD1-NH1 3.84Å; D127-R135 PolarHBondContact OD1-NH1 3.32Å; D127-R135 VanDerWaalsContact OD1-NH1 3.07Å; D127-R135 IonicContact OD1-NH2 2.71Å; D127-R135 PolarHBondContact OD1-NH2 2.72Å; D127-R135 IonicContact OD2-CZ 3.56Å; D127-R135 IonicContact OD2-NH1 3.65Å; D127-R135 PolarHBondContact OD2-NH1 3.1Å; D127-R135 IonicContact OD2-NH2 2.62Å; D127-R160 IonicContact OD2-CZ 2.96Å; D127-R160 IonicContact OD2-NH2 3.33Å; D127-R160 PolarHBondContact OD2-NH2 3.06Å
128	S	74.4	Confident	84.4	Confident	59 Å²	59	74 Å²	74	41%	0.413	37%	0.373	S	S	.	.			trans	-54.8	150.9	165.6	65.5	0	0	0	0	109.4	G126 L130 M131 V132	G126-S128 PolarHBondContact O-N 3.49Å; S128-L130 PolarHBondContact O-N 3.36Å; S128-L130 VanDerWaalsContact O-N 3.08Å; S128-M131 WeakPolarHBondContact O-CA 3.48Å; S128-M131 WeakPolarHBondContact O-CB 3.49Å; S128-M131 PolarHBondContact O-N 3.01Å; S128-M131 WeakPolarHBondContact OG-CG 3.25Å; S128-M131 PolarHBondContact OG-N 2.69Å; S128-V132 PolarHBondContact O-N 3.13Å
129	E	77.1	Confident	84.6	Confident	156 Å²	156	74.8 Å²	74.8	73%	0.729	38%	0.377	S	S	*	.	H	α-helix	trans	-50.7	-37.7	175.6	-173.7	177.3	-174.9	0	0	111.3	M131 V132 W133	E129-M131 PolarHBondContact O-N 3.44Å; E129-V132 PolarHBondContact O-N 3.48Å; E129-W133 WeakPolarHBondContact O-CB 3.31Å; E129-W133 PolarHBondContact O-N 3.01Å
130	L	81	Confident	84.9	Confident	112 Å²	112	80.6 Å²	80.6	59%	0.586	40%	0.398	S	S	*	.	H	α-helix	trans	-60.3	-42.3	173.4	-175.8	68.7	0	0	0	113	S128 W133 T134	S128-L130 PolarHBondContact O-N 3.36Å; S128-L130 VanDerWaalsContact O-N 3.08Å; L130-W133 HydrophobicContact CD1-CE3 3.69Å; L130-W133 HydrophobicContact CD1-CZ3 3.9Å; L130-T134 VanDerWaalsContact O-CB 3.29Å; L130-T134 WeakPolarHBondContact O-CB 3.35Å; L130-T134 PolarHBondContact O-N 2.96Å; L130-T134 PolarHBondContact O-OG1 3.37Å
131	M	85.1	Confident	85.3	Confident	84 Å²	84	76 Å²	76	41%	0.414	38%	0.379	S	S	.	.	H	α-helix	trans	-66.5	-41.1	176.7	-79.6	-175.8	59.9	0	0	112.2	D127 S128 E129 T134 R135	D127-M131 HydrophobicContact CB-CB 4.2Å; S128-M131 WeakPolarHBondContact O-CA 3.48Å; S128-M131 WeakPolarHBondContact O-CB 3.49Å; S128-M131 PolarHBondContact O-N 3.01Å; S128-M131 WeakPolarHBondContact OG-CG 3.25Å; S128-M131 PolarHBondContact OG-N 2.69Å; E129-M131 PolarHBondContact O-N 3.44Å; M131-T134 PolarHBondContact O-N 2.82Å; M131-R135 WeakPolarHBondContact O-CG 3.41Å; M131-R135 PolarHBondContact O-N 2.96Å
132	V	85.6	Confident	85.8	Confident	11 Å²	11	75.7 Å²	75.7	7%	0.067	38%	0.378	C	S	.	.	H	α-helix	trans	-63.6	-45.7	177	-173.4	0	0	0	0	110.2	D127 S128 E129 T134 R135 F136 R160 A161	D127-V132 HydrophobicContact CB-CG2 3.58Å; S128-V132 PolarHBondContact O-N 3.13Å; E129-V132 PolarHBondContact O-N 3.48Å; V132-T134 PolarHBondContact O-N 2.82Å; V132-R135 PolarHBondContact O-N 3.5Å; V132-F136 PolarHBondContact O-N 3.19Å; V132-R160 HydrophobicContact CG1-CB 3.53Å; V132-A161 HydrophobicContact CG1-CB 3.94Å
133	W	88.3	Confident	86.2	Confident	125 Å²	125	75 Å²	75	47%	0.473	39%	0.39	S	S	.	.	H	α-helix	trans	-59.6	-44.9	173.6	172.2	73.5	0	0	0	112.3	E129 L130 R135 F136 A137	E129-W133 WeakPolarHBondContact O-CB 3.31Å; E129-W133 PolarHBondContact O-N 3.01Å; L130-W133 HydrophobicContact CD1-CE3 3.69Å; L130-W133 HydrophobicContact CD1-CZ3 3.9Å; W133-R135 VanDerWaalsContact C-N 3.33Å; W133-R135 PolarHBondContact O-N 2.92Å; W133-F136 WeakPolarHBondContact O-CB 3.43Å; W133-F136 PolarHBondContact O-N 3.48Å; W133-F136 VanDerWaalsContact O-N 3.14Å; W133-A137 WeakPolarHBondContact O-CB 3.41Å; W133-A137 PolarHBondContact O-N 2.62Å
134	T	90.2	Very high	86.7	Confident	41 Å²	41	79.1 Å²	79.1	25%	0.252	42%	0.421	S	S	.	.	H	α-helix	trans	-60	-44.1	179.1	-61	0	0	0	0	111.1	L130 M131 V132 F136 A137 Q138	L130-T134 VanDerWaalsContact O-CB 3.29Å; L130-T134 WeakPolarHBondContact O-CB 3.35Å; L130-T134 PolarHBondContact O-N 2.96Å; L130-T134 PolarHBondContact O-OG1 3.37Å; M131-T134 PolarHBondContact O-N 2.82Å; V132-T134 PolarHBondContact O-N 2.82Å; T134-F136 VanDerWaalsContact C-N 3.35Å; T134-F136 PolarHBondContact O-N 3.08Å; T134-A137 PolarHBondContact O-N 3.31Å; T134-Q138 HydrophobicContact CG2-CG 4.29Å; T134-Q138 VanDerWaalsContact CG2-NE2 3.31Å; T134-Q138 VanDerWaalsContact O-CB 3.31Å; T134-Q138 WeakPolarHBondContact O-CB 3.4Å; T134-Q138 VanDerWaalsContact O-CG 3.26Å; T134-Q138 WeakPolarHBondContact O-CG 3.44Å; T134-Q138 PolarHBondContact O-N 3.04Å
135	R	93	Very high	87.5	Confident	100 Å²	100	79.6 Å²	79.6	38%	0.377	42%	0.418	S	S	.	.	H	α-helix	trans	-62.5	-41.3	175.6	-72.5	-178.3	-170.9	148.8	7.9	112.1	D127 M131 V132 W133 R139 L157	D127-R135 IonicContact OD1-CZ 3.19Å; D127-R135 VanDerWaalsContact OD1-CZ 3.26Å; D127-R135 IonicContact OD1-NH1 3.84Å; D127-R135 PolarHBondContact OD1-NH1 3.32Å; D127-R135 VanDerWaalsContact OD1-NH1 3.07Å; D127-R135 IonicContact OD1-NH2 2.71Å; D127-R135 PolarHBondContact OD1-NH2 2.72Å; D127-R135 IonicContact OD2-CZ 3.56Å; D127-R135 IonicContact OD2-NH1 3.65Å; D127-R135 PolarHBondContact OD2-NH1 3.1Å; D127-R135 IonicContact OD2-NH2 2.62Å; M131-R135 WeakPolarHBondContact O-CG 3.41Å; M131-R135 PolarHBondContact O-N 2.96Å; V132-R135 PolarHBondContact O-N 3.5Å; W133-R135 VanDerWaalsContact C-N 3.33Å; W133-R135 PolarHBondContact O-N 2.92Å; R135-R139 WeakPolarHBondContact O-CB 3.39Å; R135-R139 PolarHBondContact O-N 3.42Å; R135-L157 HydrophobicContact CB-CD2 4.06Å
136	F	95.6	Very high	88.8	Confident	9 Å²	9	78.5 Å²	78.5	4%	0.039	41%	0.412	C	S	.	.	H	α-helix	trans	-60.8	-51.8	174.4	175.2	-96	0	0	0	111.5	V132 W133 T134 Q138 R139 L154 L157 A161 R163 D167 L168 Q171	V132-F136 PolarHBondContact O-N 3.19Å; W133-F136 WeakPolarHBondContact O-CB 3.43Å; W133-F136 PolarHBondContact O-N 3.48Å; W133-F136 VanDerWaalsContact O-N 3.14Å; T134-F136 VanDerWaalsContact C-N 3.35Å; T134-F136 PolarHBondContact O-N 3.08Å; F136-Q138 VanDerWaalsContact C-N 3.31Å; F136-Q138 PolarHBondContact O-N 2.71Å; F136-R139 VanDerWaalsContact O-CB 3.28Å; F136-R139 WeakPolarHBondContact O-CB 3.49Å; F136-R139 PolarHBondContact O-N 2.86Å; F136-R139 VanDerWaalsContact O-N 3.13Å; F136-L154 HydrophobicContact CD2-CD2 4.31Å; F136-L154 HydrophobicContact CE2-CD2 4.16Å; F136-L157 HydrophobicContact CB-CB 4.24Å; F136-L157 HydrophobicContact CD2-CB 4.06Å; F136-A161 HydrophobicContact CB-CB 4.37Å; F136-R163 HydrophobicContact CD1-CG 3.82Å; F136-R163 HydrophobicContact CD2-CG 4.25Å; F136-R163 HydrophobicContact CE1-CB 4.41Å; F136-R163 HydrophobicContact CE1-CG 3.68Å; F136-R163 HydrophobicContact CE2-CB 4.4Å; F136-R163 HydrophobicContact CE2-CG 4.12Å; F136-R163 HydrophobicContact CG-CG 4.1Å; F136-R163 HydrophobicContact CZ-CB 4.13Å; F136-R163 HydrophobicContact CZ-CG 3.83Å; F136-D167 HydrophobicContact CE1-CB 4.38Å; F136-D167 HydrophobicContact CZ-CB 4.28Å; F136-L168 HydrophobicContact CE2-CD2 3.86Å; F136-L168 HydrophobicContact CZ-CD2 4.44Å; F136-Q171 HydrophobicContact CE1-CB 3.99Å; F136-Q171 HydrophobicContact CE1-CG 4.01Å; F136-Q171 HydrophobicContact CE2-CB 4.27Å; F136-Q171 HydrophobicContact CE2-CG 4.11Å; F136-Q171 HydrophobicContact CZ-CB 3.61Å; F136-Q171 HydrophobicContact CZ-CG 3.78Å; F136-Q171 PolarHBondContact O-OE1 2.93Å
137	A	95.2	Very high	90.4	Very high	31 Å²	31	75.1 Å²	75.1	26%	0.256	38%	0.375	S	S	.	.	H	α-helix	trans	-65.3	-31.6	-176.3	0	0	0	0	0	113.4	W133 T134 R139 R140 Q171	W133-A137 WeakPolarHBondContact O-CB 3.41Å; W133-A137 PolarHBondContact O-N 2.62Å; T134-A137 PolarHBondContact O-N 3.31Å; A137-R139 VanDerWaalsContact C-N 3.34Å; A137-R140 PolarHBondContact O-NH1 3.47Å; A137-R140 PolarHBondContact O-NH2 2.76Å; A137-Q171 PolarHBondContact O-OE1 3.46Å
138	Q	95.5	Very high	91.8	Very high	139 Å²	139	76.6 Å²	76.6	65%	0.65	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-5.4	178.4	-69.1	177.1	-3.2	0	0	113.3	T134 F136 R140	T134-Q138 HydrophobicContact CG2-CG 4.29Å; T134-Q138 VanDerWaalsContact CG2-NE2 3.31Å; T134-Q138 VanDerWaalsContact O-CB 3.31Å; T134-Q138 WeakPolarHBondContact O-CB 3.4Å; T134-Q138 VanDerWaalsContact O-CG 3.26Å; T134-Q138 WeakPolarHBondContact O-CG 3.44Å; T134-Q138 PolarHBondContact O-N 3.04Å; F136-Q138 VanDerWaalsContact C-N 3.31Å; F136-Q138 PolarHBondContact O-N 2.71Å; Q138-R140 PolarHBondContact O-N 2.84Å
139	R	97.3	Very high	92.9	Very high	19 Å²	19	78.9 Å²	78.9	7%	0.072	39%	0.385	C	S	.	.			trans	-70.7	121.5	-173.4	-169.2	47.2	172	96.7	11.3	111.2	R135 F136 A137 E145 F150 D153 L154 L157 Q171	R135-R139 WeakPolarHBondContact O-CB 3.39Å; R135-R139 PolarHBondContact O-N 3.42Å; F136-R139 VanDerWaalsContact O-CB 3.28Å; F136-R139 WeakPolarHBondContact O-CB 3.49Å; F136-R139 PolarHBondContact O-N 2.86Å; F136-R139 VanDerWaalsContact O-N 3.13Å; A137-R139 VanDerWaalsContact C-N 3.34Å; R139-E145 IonicContact CZ-OE1 4Å; R139-E145 IonicContact CZ-OE2 3.78Å; R139-E145 IonicContact NH1-OE1 3.74Å; R139-E145 IonicContact NH1-OE2 2.89Å; R139-E145 PolarHBondContact NH1-OE2 3.46Å; R139-E145 VanDerWaalsContact NH2-CD 3.27Å; R139-E145 IonicContact NH2-OE1 3.76Å; R139-E145 PolarHBondContact NH2-OE1 3.28Å; R139-E145 IonicContact NH2-OE2 2.86Å; R139-E145 PolarHBondContact NH2-OE2 3.17Å; R139-F150 HydrophobicContact CG-CD2 4.42Å; R139-F150 HydrophobicContact CG-CE2 4.02Å; R139-D153 IonicContact CZ-OD2 2.72Å; R139-D153 IonicContact NE-OD2 2.86Å; R139-D153 PolarHBondContact NE-OD2 3.06Å; R139-D153 IonicContact NH2-OD2 3.8Å; R139-D153 PolarHBondContact NH2-OD2 3.47Å; R139-D153 VanDerWaalsContact NH2-OD2 3.1Å; R139-L154 HydrophobicContact CB-CD2 3.75Å; R139-L154 HydrophobicContact CG-CD2 3.65Å; R139-L154 HydrophobicContact CG-CG 4.27Å; R139-L157 HydrophobicContact CB-CD1 4.19Å; R139-L157 HydrophobicContact CG-CD1 3.99Å; R139-Q171 PolarHBondContact O-NE2 3.24Å; R139-Q171 VanDerWaalsContact O-NE2 3.07Å
140	R	97.8	Very high	93.9	Very high	122 Å²	122	71.4 Å²	71.4	46%	0.46	35%	0.35	S	S	.	.			trans	-131.7	145.8	175.7	-58.6	-64.1	178.1	-82	-1.7	109	A137 Q138 R142	A137-R140 PolarHBondContact O-NH1 3.47Å; A137-R140 PolarHBondContact O-NH2 2.76Å; Q138-R140 PolarHBondContact O-N 2.84Å; R140-R142 PolarHBondContact O-N 2.86Å
141	Q	98.2	Very high	94.8	Very high	25 Å²	25	66.1 Å²	66.1	12%	0.117	32%	0.322	C	S	.	.			trans	-56.7	132.7	177	-175.9	-177.2	7.1	0	0	110.2	E145 F150 G175 L177	Q141-E145 WeakPolarHBondContact CA-OE2 3.35Å; Q141-E145 HydrophobicContact CG-CB 4.48Å; Q141-E145 PolarHBondContact NE2-O 3.42Å; Q141-F150 HydrophobicContact CB-CB 4.3Å; Q141-F150 HydrophobicContact CB-CD1 3.77Å; Q141-F150 HydrophobicContact CB-CD2 4.24Å; Q141-F150 HydrophobicContact CB-CE1 4.13Å; Q141-F150 HydrophobicContact CB-CG 3.84Å; Q141-F150 HydrophobicContact CG-CB 4.15Å; Q141-F150 HydrophobicContact CG-CD1 4.28Å; Q141-F150 HydrophobicContact CG-CG 4.24Å; Q141-G175 VanDerWaalsContact CB-O 3.27Å; Q141-G175 WeakPolarHBondContact CB-O 3.5Å; Q141-G175 PolarHBondContact N-O 3.13Å; Q141-L177 HydrophobicContact CB-CB 4.02Å; Q141-L177 HydrophobicContact CG-CB 4.12Å
142	R	97.3	Very high	95.4	Very high	161 Å²	161	65 Å²	65	61%	0.608	32%	0.318	S	S	*	.			trans	-83.5	154.8	177.2	-56.8	179.8	-174.3	-176.9	2.7	111	R140 T144 E145	R140-R142 PolarHBondContact O-N 2.86Å; R142-T144 PolarHBondContact O-N 3.45Å; R142-T144 VanDerWaalsContact O-N 3.13Å; R142-E145 HydrophobicContact CB-CB 3.83Å; R142-E145 PolarHBondContact N-OE2 3.4Å; R142-E145 WeakPolarHBondContact O-CB 3.3Å; R142-E145 PolarHBondContact O-N 3.15Å
143	P	95.9	Very high	95.9	Very high	117 Å²	117	66.8 Å²	66.8	76%	0.76	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-32.7	179.5	-29.1	36.6	0	0	0	115.8	L177	P143-L177 HydrophobicContact CB-CD2 4.32Å; P143-L177 HydrophobicContact CG-CD2 4.45Å
144	T	95.2	Very high	96.3	Very high	138 Å²	138	60.9 Å²	60.9	85%	0.847	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	3.9	-178.9	60.3	0	0	0	0	113.2	R142	R142-T144 PolarHBondContact O-N 3.45Å; R142-T144 VanDerWaalsContact O-N 3.13Å
145	E	96.6	Very high	96.6	Very high	30 Å²	30	61.9 Å²	61.9	14%	0.14	30%	0.304	C	S	.	.			trans	-99.7	132.5	-172.4	175.3	174.7	-120.4	0	0	111	R139 Q141 R142 E149 F150	R139-E145 IonicContact CZ-OE1 4Å; R139-E145 IonicContact CZ-OE2 3.78Å; R139-E145 IonicContact NH1-OE1 3.74Å; R139-E145 IonicContact NH1-OE2 2.89Å; R139-E145 PolarHBondContact NH1-OE2 3.46Å; R139-E145 VanDerWaalsContact NH2-CD 3.27Å; R139-E145 IonicContact NH2-OE1 3.76Å; R139-E145 PolarHBondContact NH2-OE1 3.28Å; R139-E145 IonicContact NH2-OE2 2.86Å; R139-E145 PolarHBondContact NH2-OE2 3.17Å; Q141-E145 WeakPolarHBondContact CA-OE2 3.35Å; Q141-E145 HydrophobicContact CG-CB 4.48Å; Q141-E145 PolarHBondContact NE2-O 3.42Å; R142-E145 HydrophobicContact CB-CB 3.83Å; R142-E145 PolarHBondContact N-OE2 3.4Å; R142-E145 WeakPolarHBondContact O-CB 3.3Å; R142-E145 PolarHBondContact O-N 3.15Å; E145-E149 HydrophobicContact CG-CB 3.74Å; E145-F150 HydrophobicContact CG-CB 4.11Å
146	S	96.1	Very high	96.6	Very high	53 Å²	53	62.4 Å²	62.4	37%	0.371	31%	0.309	S	S	.	.			trans	-70.9	157.7	174.1	68	0	0	0	0	112.1	E148 E149 F150	S146-E148 PolarHBondContact O-N 3.36Å; S146-E149 WeakPolarHBondContact CB-OE2 3.48Å; S146-E149 PolarHBondContact N-OE2 3Å; S146-E149 PolarHBondContact O-N 3.49Å; S146-E149 WeakPolarHBondContact OG-CB 3.47Å; S146-E149 VanDerWaalsContact OG-CD 3.3Å; S146-E149 VanDerWaalsContact OG-CG 3.25Å; S146-E149 WeakPolarHBondContact OG-CG 3.27Å; S146-E149 PolarHBondContact OG-N 3.21Å; S146-E149 PolarHBondContact OG-OE2 3.04Å; S146-F150 PolarHBondContact O-N 3.39Å
147	L	96.6	Very high	96.4	Very high	10 Å²	10	62.8 Å²	62.8	5%	0.052	31%	0.311	C	S	.	.	H	α-helix	trans	-58.4	-31.3	174.1	-72.5	168.9	0	0	0	112.6	A151 F172 I176 I181 A200 H204	L147-A151 VanDerWaalsContact O-CB 3.24Å; L147-A151 WeakPolarHBondContact O-CB 3.09Å; L147-A151 PolarHBondContact O-N 3.42Å; L147-F172 HydrophobicContact CD2-CZ 4.29Å; L147-I176 HydrophobicContact CD2-CG1 4.23Å; L147-I176 HydrophobicContact CD2-CG2 4.44Å; L147-I181 HydrophobicContact CD1-CG2 4.46Å; L147-A200 HydrophobicContact CD1-CB 4.02Å; L147-H204 HydrophobicContact CD1-CB 3.94Å
148	E	96.7	Very high	96.4	Very high	66 Å²	66	61.3 Å²	61.3	31%	0.308	30%	0.299	S	S	.	.	H	α-helix	trans	-70.6	-47.8	178.3	-166.7	70.5	-139.3	0	0	111.3	S146 F150 A151 D152 R155 K201	S146-E148 PolarHBondContact O-N 3.36Å; E148-F150 VanDerWaalsContact C-N 3.33Å; E148-F150 PolarHBondContact O-N 3.28Å; E148-A151 PolarHBondContact O-N 2.83Å; E148-D152 WeakPolarHBondContact O-CB 3.48Å; E148-D152 PolarHBondContact O-N 2.98Å; E148-R155 IonicContact OE1-NH1 2.72Å; E148-K201 WeakPolarHBondContact OE2-CD 3.35Å; E148-K201 WeakPolarHBondContact OE2-CE 3.37Å; E148-K201 IonicContact OE2-NZ 3.39Å; E148-K201 PolarHBondContact OE2-NZ 3.43Å
149	E	97.6	Very high	96.2	Very high	107 Å²	107	62.8 Å²	62.8	50%	0.5	30%	0.299	S	S	.	.	H	α-helix	trans	-61.1	-43.3	178	-72.7	164.5	137.5	0	0	111.5	E145 S146 D152 D153	E145-E149 HydrophobicContact CG-CB 3.74Å; S146-E149 WeakPolarHBondContact CB-OE2 3.48Å; S146-E149 PolarHBondContact N-OE2 3Å; S146-E149 PolarHBondContact O-N 3.49Å; S146-E149 WeakPolarHBondContact OG-CB 3.47Å; S146-E149 VanDerWaalsContact OG-CD 3.3Å; S146-E149 VanDerWaalsContact OG-CG 3.25Å; S146-E149 WeakPolarHBondContact OG-CG 3.27Å; S146-E149 PolarHBondContact OG-N 3.21Å; S146-E149 PolarHBondContact OG-OE2 3.04Å; E149-D152 PolarHBondContact O-N 3.44Å; E149-D153 WeakPolarHBondContact O-CB 3.3Å; E149-D153 PolarHBondContact O-N 3.22Å
150	F	98.1	Very high	95.6	Very high	0 Å²	0	67.6 Å²	67.6	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-60.5	-47.5	174.5	173	-134	0	0	0	111.7	R139 Q141 E145 S146 E148 D152 D153 L154 F172 I176	R139-F150 HydrophobicContact CG-CD2 4.42Å; R139-F150 HydrophobicContact CG-CE2 4.02Å; Q141-F150 HydrophobicContact CB-CB 4.3Å; Q141-F150 HydrophobicContact CB-CD1 3.77Å; Q141-F150 HydrophobicContact CB-CD2 4.24Å; Q141-F150 HydrophobicContact CB-CE1 4.13Å; Q141-F150 HydrophobicContact CB-CG 3.84Å; Q141-F150 HydrophobicContact CG-CB 4.15Å; Q141-F150 HydrophobicContact CG-CD1 4.28Å; Q141-F150 HydrophobicContact CG-CG 4.24Å; E145-F150 HydrophobicContact CG-CB 4.11Å; S146-F150 PolarHBondContact O-N 3.39Å; E148-F150 VanDerWaalsContact C-N 3.33Å; E148-F150 PolarHBondContact O-N 3.28Å; F150-D152 PolarHBondContact O-N 3.22Å; F150-D153 PolarHBondContact O-N 3.3Å; F150-L154 HydrophobicContact CD2-CD1 4.19Å; F150-L154 HydrophobicContact CD2-CG 4.14Å; F150-L154 HydrophobicContact CE1-CD1 4.04Å; F150-L154 HydrophobicContact CE2-CD1 3.54Å; F150-L154 HydrophobicContact CE2-CD2 4.2Å; F150-L154 HydrophobicContact CE2-CG 3.7Å; F150-L154 HydrophobicContact CZ-CD1 3.45Å; F150-L154 VanDerWaalsContact CZ-CD1 3.45Å; F150-L154 HydrophobicContact CZ-CG 4.15Å; F150-L154 PolarHBondContact O-N 3.04Å; F150-F172 AromaticContact CD1-CD2 3.81Å; F150-F172 HydrophobicContact CD1-CD2 3.81Å; F150-F172 AromaticContact CD1-CE2 3.73Å; F150-F172 HydrophobicContact CD1-CE2 3.73Å; F150-F172 AromaticContact CE1-CD2 3.58Å; F150-F172 HydrophobicContact CE1-CD2 3.58Å; F150-F172 AromaticContact CE1-CE2 3.92Å; F150-F172 HydrophobicContact CE1-CE2 3.92Å; F150-F172 HydrophobicContact CE1-CG 4.41Å; F150-F172 HydrophobicContact CZ-CD2 4.4Å; F150-I176 HydrophobicContact CE1-CG1 4.44Å
151	A	98.1	Very high	95.1	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-62.2	-42.2	177.9	0	0	0	0	0	112.1	L147 E148 L154 R155 F172 F193 V197	L147-A151 VanDerWaalsContact O-CB 3.24Å; L147-A151 WeakPolarHBondContact O-CB 3.09Å; L147-A151 PolarHBondContact O-N 3.42Å; E148-A151 PolarHBondContact O-N 2.83Å; A151-L154 PolarHBondContact O-N 2.93Å; A151-R155 WeakPolarHBondContact O-CG 3.09Å; A151-R155 PolarHBondContact O-N 2.7Å; A151-F172 HydrophobicContact CB-CD2 4.45Å; A151-F172 HydrophobicContact CB-CE2 4.03Å; A151-F193 HydrophobicContact CB-CZ 3.88Å; A151-V197 HydrophobicContact CB-CG1 4.1Å; A151-V197 HydrophobicContact CB-CG2 3.69Å
152	D	97.8	Very high	94.6	Very high	61 Å²	61	63.8 Å²	63.8	33%	0.326	32%	0.322	S	S	.	.	H	α-helix	trans	-65.4	-40.2	178.7	-84.9	-15.5	0	0	0	112.9	E148 E149 F150 R155 K156	E148-D152 WeakPolarHBondContact O-CB 3.48Å; E148-D152 PolarHBondContact O-N 2.98Å; E149-D152 PolarHBondContact O-N 3.44Å; F150-D152 PolarHBondContact O-N 3.22Å; D152-R155 WeakPolarHBondContact O-CB 3.37Å; D152-R155 PolarHBondContact O-N 2.66Å; D152-R155 IonicContact OD1-CZ 3.38Å; D152-R155 IonicContact OD1-NH1 3.1Å; D152-R155 PolarHBondContact OD1-NH1 3.2Å; D152-K156 VanDerWaalsContact O-CG 3.3Å; D152-K156 WeakPolarHBondContact O-CG 3.43Å; D152-K156 PolarHBondContact O-N 2.72Å
153	D	96.3	Very high	94.5	Very high	49 Å²	49	60.2 Å²	60.2	26%	0.262	31%	0.308	S	S	.	.	H	α-helix	trans	-68.3	-39.6	175.8	-166.4	51.5	0	0	0	111.7	R139 E149 F150 R155 K156 L157	R139-D153 IonicContact CZ-OD2 2.72Å; R139-D153 IonicContact NE-OD2 2.86Å; R139-D153 PolarHBondContact NE-OD2 3.06Å; R139-D153 IonicContact NH2-OD2 3.8Å; R139-D153 PolarHBondContact NH2-OD2 3.47Å; R139-D153 VanDerWaalsContact NH2-OD2 3.1Å; E149-D153 WeakPolarHBondContact O-CB 3.3Å; E149-D153 PolarHBondContact O-N 3.22Å; F150-D153 PolarHBondContact O-N 3.3Å; D153-R155 VanDerWaalsContact C-N 3.35Å; D153-R155 PolarHBondContact O-N 3.01Å; D153-K156 WeakPolarHBondContact O-CB 3.3Å; D153-K156 PolarHBondContact O-N 2.86Å; D153-K156 VanDerWaalsContact O-N 3.15Å; D153-L157 WeakPolarHBondContact O-CG 3.32Å; D153-L157 PolarHBondContact O-N 3.26Å
154	L	97.3	Very high	94.5	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-59.7	-42.8	171.1	-79.3	-178.3	0	0	0	112.3	F136 R139 F150 A151 K156 L157 G158 L168 Q171 F172 F193	F136-L154 HydrophobicContact CD2-CD2 4.31Å; F136-L154 HydrophobicContact CE2-CD2 4.16Å; R139-L154 HydrophobicContact CB-CD2 3.75Å; R139-L154 HydrophobicContact CG-CD2 3.65Å; R139-L154 HydrophobicContact CG-CG 4.27Å; F150-L154 HydrophobicContact CD2-CD1 4.19Å; F150-L154 HydrophobicContact CD2-CG 4.14Å; F150-L154 HydrophobicContact CE1-CD1 4.04Å; F150-L154 HydrophobicContact CE2-CD1 3.54Å; F150-L154 HydrophobicContact CE2-CD2 4.2Å; F150-L154 HydrophobicContact CE2-CG 3.7Å; F150-L154 HydrophobicContact CZ-CD1 3.45Å; F150-L154 VanDerWaalsContact CZ-CD1 3.45Å; F150-L154 HydrophobicContact CZ-CG 4.15Å; F150-L154 PolarHBondContact O-N 3.04Å; A151-L154 PolarHBondContact O-N 2.93Å; L154-K156 VanDerWaalsContact C-N 3.3Å; L154-K156 PolarHBondContact O-N 3.36Å; L154-L157 PolarHBondContact O-N 2.66Å; L154-G158 WeakPolarHBondContact O-CA 3.48Å; L154-G158 PolarHBondContact O-N 3.19Å; L154-L168 HydrophobicContact CB-CD2 4.27Å; L154-L168 VanDerWaalsContact O-CD2 3.29Å; L154-L168 WeakPolarHBondContact O-CD2 3.23Å; L154-Q171 HydrophobicContact CD1-CG 4.35Å; L154-Q171 HydrophobicContact CD2-CB 4.44Å; L154-Q171 HydrophobicContact CD2-CG 3.53Å; L154-F172 HydrophobicContact CD1-CB 3.98Å; L154-F172 HydrophobicContact CD1-CD2 4.05Å; L154-F193 HydrophobicContact CB-CZ 4.47Å; L154-F193 HydrophobicContact CD1-CE2 4.39Å
155	R	96.7	Very high	94.6	Very high	62 Å²	62	54.2 Å²	54.2	23%	0.234	27%	0.269	C	S	.	.	H	α-helix	trans	-58.3	-43.3	174	-71.7	174.8	-175.6	115.8	10.1	111.3	E148 A151 D152 D153 R159 F193	E148-R155 IonicContact OE1-NH1 2.72Å; A151-R155 WeakPolarHBondContact O-CG 3.09Å; A151-R155 PolarHBondContact O-N 2.7Å; D152-R155 WeakPolarHBondContact O-CB 3.37Å; D152-R155 PolarHBondContact O-N 2.66Å; D152-R155 IonicContact OD1-CZ 3.38Å; D152-R155 IonicContact OD1-NH1 3.1Å; D152-R155 PolarHBondContact OD1-NH1 3.2Å; D153-R155 VanDerWaalsContact C-N 3.35Å; D153-R155 PolarHBondContact O-N 3.01Å; R155-R159 WeakPolarHBondContact O-CB 3.33Å; R155-R159 VanDerWaalsContact O-CG 3.31Å; R155-R159 WeakPolarHBondContact O-CG 3.47Å; R155-R159 PolarHBondContact O-N 2.89Å; R155-F193 HydrophobicContact CG-CD1 4.45Å; R155-F193 HydrophobicContact CG-CE1 3.47Å; R155-F193 VanDerWaalsContact CG-CE1 3.47Å; R155-F193 HydrophobicContact CG-CZ 4.04Å
156	K	92.9	Very high	94.6	Very high	112 Å²	112	59 Å²	59	49%	0.487	29%	0.294	S	S	.	.	H	α-helix	trans	-65.4	-49.8	179.6	-70.2	167.3	-170.7	169.6	0	111.3	D152 D153 L154 R160	D152-K156 VanDerWaalsContact O-CG 3.3Å; D152-K156 WeakPolarHBondContact O-CG 3.43Å; D152-K156 PolarHBondContact O-N 2.72Å; D153-K156 WeakPolarHBondContact O-CB 3.3Å; D153-K156 PolarHBondContact O-N 2.86Å; D153-K156 VanDerWaalsContact O-N 3.15Å; L154-K156 VanDerWaalsContact C-N 3.3Å; L154-K156 PolarHBondContact O-N 3.36Å; K156-R160 WeakPolarHBondContact O-CG 3.27Å; K156-R160 PolarHBondContact O-N 3.07Å
157	L	92.1	Very high	94.7	Very high	16 Å²	16	59.3 Å²	59.3	8%	0.084	29%	0.292	C	S	.	.	H	α-helix	trans	-65.5	-44.2	179	-71	171.2	0	0	0	111.9	R135 F136 R139 D153 L154 R159 R160 A161	R135-L157 HydrophobicContact CB-CD2 4.06Å; F136-L157 HydrophobicContact CB-CB 4.24Å; F136-L157 HydrophobicContact CD2-CB 4.06Å; R139-L157 HydrophobicContact CB-CD1 4.19Å; R139-L157 HydrophobicContact CG-CD1 3.99Å; D153-L157 WeakPolarHBondContact O-CG 3.32Å; D153-L157 PolarHBondContact O-N 3.26Å; L154-L157 PolarHBondContact O-N 2.66Å; L157-R159 PolarHBondContact O-N 3.07Å; L157-R160 PolarHBondContact O-N 2.76Å; L157-R160 VanDerWaalsContact O-N 3.17Å; L157-A161 WeakPolarHBondContact O-CB 3.45Å; L157-A161 PolarHBondContact O-N 2.72Å
158	G	93.9	Very high	94.7	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-61.9	-42.7	179.3	0	0	0	0	0	112.4	L154 R160 A161 G162 R163	L154-G158 WeakPolarHBondContact O-CA 3.48Å; L154-G158 PolarHBondContact O-N 3.19Å; G158-R160 PolarHBondContact O-N 2.8Å; G158-A161 CarbonylContact O-C 3.53Å; G158-A161 PolarHBondContact O-N 3.21Å; G158-G162 PolarHBondContact O-N 3.45Å; G158-R163 PolarHBondContact O-N 3.19Å
159	R	90.8	Very high	94.8	Very high	170 Å²	170	57.9 Å²	57.9	64%	0.642	29%	0.286	S	S	*	.	H	α-helix	trans	-59.8	-45	172.3	-77.8	-167	-57.1	-91.6	1.8	112.2	R155 L157 A161 G162	R155-R159 WeakPolarHBondContact O-CB 3.33Å; R155-R159 VanDerWaalsContact O-CG 3.31Å; R155-R159 WeakPolarHBondContact O-CG 3.47Å; R155-R159 PolarHBondContact O-N 2.89Å; L157-R159 PolarHBondContact O-N 3.07Å; R159-A161 VanDerWaalsContact C-N 3.31Å; R159-A161 PolarHBondContact O-N 3.41Å; R159-G162 PolarHBondContact O-N 2.91Å
160	R	85.5	Confident	94.8	Very high	121 Å²	121	54.8 Å²	54.8	46%	0.457	28%	0.282	S	S	.	.	H	α-helix	trans	-66.5	-33.1	179.1	-68.9	176.5	63.8	-165.9	-3.3	112.4	D127 V132 K156 L157 G158	D127-R160 IonicContact OD2-CZ 2.96Å; D127-R160 IonicContact OD2-NH2 3.33Å; D127-R160 PolarHBondContact OD2-NH2 3.06Å; V132-R160 HydrophobicContact CG1-CB 3.53Å; K156-R160 WeakPolarHBondContact O-CG 3.27Å; K156-R160 PolarHBondContact O-N 3.07Å; L157-R160 PolarHBondContact O-N 2.76Å; L157-R160 VanDerWaalsContact O-N 3.17Å; G158-R160 PolarHBondContact O-N 2.8Å
161	A	87.3	Confident	94.7	Very high	6 Å²	6	56 Å²	56	5%	0.05	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	2.3	178.1	0	0	0	0	0	113.8	V132 F136 L157 G158 R159 R163	V132-A161 HydrophobicContact CG1-CB 3.94Å; F136-A161 HydrophobicContact CB-CB 4.37Å; L157-A161 WeakPolarHBondContact O-CB 3.45Å; L157-A161 PolarHBondContact O-N 2.72Å; G158-A161 CarbonylContact O-C 3.53Å; G158-A161 PolarHBondContact O-N 3.21Å; R159-A161 VanDerWaalsContact C-N 3.31Å; R159-A161 PolarHBondContact O-N 3.41Å; A161-R163 VanDerWaalsContact C-N 3.35Å; A161-R163 HydrophobicContact CB-CG 3.82Å; A161-R163 VanDerWaalsContact O-CZ 3.3Å; A161-R163 PolarHBondContact O-N 2.93Å; A161-R163 PolarHBondContact O-NE 2.96Å; A161-R163 PolarHBondContact O-NH2 2.84Å
162	G	88.1	Confident	94.7	Very high	61 Å²	61	56 Å²	56	63%	0.629	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.2	38.9	-177.3	0	0	0	0	0	113.7	G158 R159	G158-G162 PolarHBondContact O-N 3.45Å; R159-G162 PolarHBondContact O-N 2.91Å
163	R	94.2	Very high	94.7	Very high	85 Å²	85	54 Å²	54	32%	0.321	28%	0.277	S	S	.	.			trans	-85.8	143.1	-177.5	-64.1	-55.5	94.6	-167.4	4.3	112	F136 G158 A161 D167	F136-R163 HydrophobicContact CD1-CG 3.82Å; F136-R163 HydrophobicContact CD2-CG 4.25Å; F136-R163 HydrophobicContact CE1-CB 4.41Å; F136-R163 HydrophobicContact CE1-CG 3.68Å; F136-R163 HydrophobicContact CE2-CB 4.4Å; F136-R163 HydrophobicContact CE2-CG 4.12Å; F136-R163 HydrophobicContact CG-CG 4.1Å; F136-R163 HydrophobicContact CZ-CB 4.13Å; F136-R163 HydrophobicContact CZ-CG 3.83Å; G158-R163 PolarHBondContact O-N 3.19Å; A161-R163 VanDerWaalsContact C-N 3.35Å; A161-R163 HydrophobicContact CB-CG 3.82Å; A161-R163 VanDerWaalsContact O-CZ 3.3Å; A161-R163 PolarHBondContact O-N 2.93Å; A161-R163 PolarHBondContact O-NE 2.96Å; A161-R163 PolarHBondContact O-NH2 2.84Å; R163-D167 HydrophobicContact CB-CB 3.8Å; R163-D167 HydrophobicContact CG-CB 4.31Å
164	S	95.9	Very high	94.7	Very high	55 Å²	55	53.7 Å²	53.7	39%	0.385	29%	0.286	S	S	.	.			trans	-74.7	168.5	175.7	67.3	0	0	0	0	111.8	L166 D167 L168	S164-L166 PolarHBondContact O-N 2.77Å; S164-D167 WeakPolarHBondContact CB-OD2 3.2Å; S164-D167 PolarHBondContact N-OD2 3.49Å; S164-D167 WeakPolarHBondContact O-CB 3.27Å; S164-D167 PolarHBondContact O-N 2.99Å; S164-D167 PolarHBondContact OG-N 3.43Å; S164-D167 PolarHBondContact OG-OD2 3.42Å; S164-L168 PolarHBondContact O-N 3.45Å
165	D	97.7	Very high	94.8	Very high	74 Å²	74	53.9 Å²	53.9	40%	0.396	29%	0.287	S	S	.	.	H	α-helix	trans	-60.3	-35.6	172	-168.4	79	0	0	0	111.7	D167 L168 H169 S192 F193	D165-D167 PolarHBondContact O-N 3.23Å; D165-L168 WeakPolarHBondContact O-CB 3.48Å; D165-L168 PolarHBondContact O-N 2.85Å; D165-H169 VanDerWaalsContact O-CB 3.25Å; D165-H169 WeakPolarHBondContact O-CB 3.36Å; D165-H169 PolarHBondContact O-N 2.94Å; D165-S192 WeakPolarHBondContact OD2-CA 3.41Å; D165-S192 VanDerWaalsContact OD2-CB 3.27Å; D165-S192 WeakPolarHBondContact OD2-CB 3.38Å; D165-F193 WeakPolarHBondContact OD1-CB 3.39Å; D165-F193 PolarHBondContact OD2-N 3.27Å
166	L	97.1	Very high	94.8	Very high	130 Å²	130	51.1 Å²	51.1	68%	0.681	28%	0.277	S	S	*	.	H	α-helix	trans	-62.8	-41.9	175.7	-178.5	62.7	0	0	0	112	S164 H169 G170	S164-L166 PolarHBondContact O-N 2.77Å; L166-H169 PolarHBondContact O-N 3.44Å; L166-G170 PolarHBondContact O-N 3.25Å
167	D	97	Very high	95	Very high	61 Å²	61	49.9 Å²	49.9	33%	0.326	28%	0.276	S	S	.	.	H	α-helix	trans	-64.3	-44.6	175.7	-64	-51.7	0	0	0	111.1	F136 R163 S164 D165 H169 Q171	F136-D167 HydrophobicContact CE1-CB 4.38Å; F136-D167 HydrophobicContact CZ-CB 4.28Å; R163-D167 HydrophobicContact CB-CB 3.8Å; R163-D167 HydrophobicContact CG-CB 4.31Å; S164-D167 WeakPolarHBondContact CB-OD2 3.2Å; S164-D167 PolarHBondContact N-OD2 3.49Å; S164-D167 WeakPolarHBondContact O-CB 3.27Å; S164-D167 PolarHBondContact O-N 2.99Å; S164-D167 PolarHBondContact OG-N 3.43Å; S164-D167 PolarHBondContact OG-OD2 3.42Å; D165-D167 PolarHBondContact O-N 3.23Å; D167-H169 VanDerWaalsContact C-N 3.33Å; D167-H169 PolarHBondContact O-N 2.96Å; D167-Q171 WeakPolarHBondContact O-CB 3.49Å; D167-Q171 PolarHBondContact O-N 3.22Å
168	L	98.1	Very high	95.2	Very high	20 Å²	20	51 Å²	51	11%	0.105	28%	0.282	C	S	.	.	H	α-helix	trans	-60.5	-43.9	176.1	-77.2	164.8	0	0	0	111.4	F136 L154 S164 D165 Q171 F172 F193	F136-L168 HydrophobicContact CE2-CD2 3.86Å; F136-L168 HydrophobicContact CZ-CD2 4.44Å; L154-L168 HydrophobicContact CB-CD2 4.27Å; L154-L168 VanDerWaalsContact O-CD2 3.29Å; L154-L168 WeakPolarHBondContact O-CD2 3.23Å; S164-L168 PolarHBondContact O-N 3.45Å; D165-L168 WeakPolarHBondContact O-CB 3.48Å; D165-L168 PolarHBondContact O-N 2.85Å; L168-Q171 PolarHBondContact O-N 3.19Å; L168-F172 VanDerWaalsContact O-CB 3.32Å; L168-F172 WeakPolarHBondContact O-CB 3.49Å; L168-F172 PolarHBondContact O-N 2.98Å; L168-F193 HydrophobicContact CB-CB 3.85Å; L168-F193 HydrophobicContact CB-CD1 4.23Å; L168-F193 HydrophobicContact CB-CD2 3.9Å; L168-F193 HydrophobicContact CB-CG 3.72Å; L168-F193 WeakPolarHBondContact O-CD2 3.28Å
169	H	97.7	Very high	95.3	Very high	26 Å²	26	57.1 Å²	57.1	12%	0.12	31%	0.31	C	S	.	.	H	α-helix	trans	-60.3	-53.8	178.7	178.3	-114.6	0	0	0	111.6	D165 L166 D167 Q171 F172 L173 T190 S192 F193	D165-H169 VanDerWaalsContact O-CB 3.25Å; D165-H169 WeakPolarHBondContact O-CB 3.36Å; D165-H169 PolarHBondContact O-N 2.94Å; L166-H169 PolarHBondContact O-N 3.44Å; D167-H169 VanDerWaalsContact C-N 3.33Å; D167-H169 PolarHBondContact O-N 2.96Å; H169-Q171 VanDerWaalsContact C-N 3.33Å; H169-Q171 PolarHBondContact O-N 2.97Å; H169-F172 PolarHBondContact O-N 2.91Å; H169-L173 WeakPolarHBondContact O-CG 3.4Å; H169-L173 PolarHBondContact O-N 3.34Å; H169-T190 PolarHBondContact CE1-O 3.29Å; H169-T190 PolarHBondContact NE2-O 2.88Å; H169-T190 VanDerWaalsContact NE2-O 3.08Å; H169-T190 PolarHBondContact NE2-OG1 3.05Å; H169-S192 PolarHBondContact CD2-O 2.9Å; H169-S192 VanDerWaalsContact CD2-O 3.29Å; H169-F193 HydrophobicContact CB-CB 4.22Å
170	G	97.2	Very high	95.5	Very high	41 Å²	41	54.1 Å²	54.1	42%	0.423	30%	0.303	S	S	.	.	H	α-helix	trans	-60.6	-41.3	177.4	0	0	0	0	0	112.7	L166 L173 G174	L166-G170 PolarHBondContact O-N 3.25Å; G170-L173 PolarHBondContact O-N 3.03Å; G170-G174 PolarHBondContact O-N 2.8Å
171	Q	97.7	Very high	96	Very high	26 Å²	26	48.5 Å²	48.5	12%	0.121	28%	0.282	C	S	.	.	H	α-helix	trans	-68.4	-34.9	179.9	-172.6	54.4	73.5	0	0	112.9	F136 A137 R139 L154 D167 L168 H169 G175	F136-Q171 HydrophobicContact CE1-CB 3.99Å; F136-Q171 HydrophobicContact CE1-CG 4.01Å; F136-Q171 HydrophobicContact CE2-CB 4.27Å; F136-Q171 HydrophobicContact CE2-CG 4.11Å; F136-Q171 HydrophobicContact CZ-CB 3.61Å; F136-Q171 HydrophobicContact CZ-CG 3.78Å; F136-Q171 PolarHBondContact O-OE1 2.93Å; A137-Q171 PolarHBondContact O-OE1 3.46Å; R139-Q171 PolarHBondContact O-NE2 3.24Å; R139-Q171 VanDerWaalsContact O-NE2 3.07Å; L154-Q171 HydrophobicContact CD1-CG 4.35Å; L154-Q171 HydrophobicContact CD2-CB 4.44Å; L154-Q171 HydrophobicContact CD2-CG 3.53Å; D167-Q171 WeakPolarHBondContact O-CB 3.49Å; D167-Q171 PolarHBondContact O-N 3.22Å; L168-Q171 PolarHBondContact O-N 3.19Å; H169-Q171 VanDerWaalsContact C-N 3.33Å; H169-Q171 PolarHBondContact O-N 2.97Å; Q171-G175 PolarHBondContact O-N 3.03Å; Q171-G175 VanDerWaalsContact O-N 3.14Å
172	F	98.3	Very high	96.5	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-65.9	-53.4	173.6	-175.6	-107.7	0	0	0	110.8	L147 F150 A151 L154 L168 H169 G174 G175 I176 F193 A196 V197 A200	L147-F172 HydrophobicContact CD2-CZ 4.29Å; F150-F172 AromaticContact CD1-CD2 3.81Å; F150-F172 HydrophobicContact CD1-CD2 3.81Å; F150-F172 AromaticContact CD1-CE2 3.73Å; F150-F172 HydrophobicContact CD1-CE2 3.73Å; F150-F172 AromaticContact CE1-CD2 3.58Å; F150-F172 HydrophobicContact CE1-CD2 3.58Å; F150-F172 AromaticContact CE1-CE2 3.92Å; F150-F172 HydrophobicContact CE1-CE2 3.92Å; F150-F172 HydrophobicContact CE1-CG 4.41Å; F150-F172 HydrophobicContact CZ-CD2 4.4Å; A151-F172 HydrophobicContact CB-CD2 4.45Å; A151-F172 HydrophobicContact CB-CE2 4.03Å; L154-F172 HydrophobicContact CD1-CB 3.98Å; L154-F172 HydrophobicContact CD1-CD2 4.05Å; L168-F172 VanDerWaalsContact O-CB 3.32Å; L168-F172 WeakPolarHBondContact O-CB 3.49Å; L168-F172 PolarHBondContact O-N 2.98Å; H169-F172 PolarHBondContact O-N 2.91Å; F172-G174 VanDerWaalsContact C-N 3.34Å; F172-G174 PolarHBondContact O-N 3.35Å; F172-G175 CarbonylContact O-C 3.6Å; F172-G175 PolarHBondContact O-N 3.39Å; F172-I176 HydrophobicContact CD1-CD1 4.11Å; F172-I176 HydrophobicContact CD1-CG1 4.49Å; F172-I176 HydrophobicContact CE1-CD1 3.78Å; F172-I176 HydrophobicContact CE1-CG1 4.23Å; F172-I176 HydrophobicContact CZ-CD1 4.24Å; F172-I176 HydrophobicContact CZ-CG1 4.27Å; F172-I176 WeakPolarHBondContact O-CG1 3.43Å; F172-I176 PolarHBondContact O-N 2.92Å; F172-F193 HydrophobicContact CB-CD2 3.72Å; F172-F193 HydrophobicContact CB-CE2 3.61Å; F172-F193 AromaticContact CD2-CE2 3.79Å; F172-F193 HydrophobicContact CD2-CE2 3.79Å; F172-F193 HydrophobicContact CG-CD2 4.11Å; F172-F193 AromaticContact CG-CE2 3.75Å; F172-F193 HydrophobicContact CG-CE2 3.75Å; F172-A196 HydrophobicContact CD1-CB 3.83Å; F172-A196 HydrophobicContact CE1-CB 4.15Å; F172-V197 HydrophobicContact CD1-CG2 4.31Å; F172-V197 HydrophobicContact CD2-CG2 4.21Å; F172-V197 HydrophobicContact CE1-CB 4.5Å; F172-V197 HydrophobicContact CE1-CG2 3.98Å; F172-V197 HydrophobicContact CE2-CG2 3.87Å; F172-V197 HydrophobicContact CG-CG2 4.42Å; F172-V197 HydrophobicContact CZ-CB 4.3Å; F172-V197 HydrophobicContact CZ-CG2 3.76Å; F172-A200 HydrophobicContact CE1-CB 3.91Å; F172-A200 HydrophobicContact CZ-CB 3.97Å
173	L	97.2	Very high	96.9	Very high	19 Å²	19	48.6 Å²	48.6	10%	0.099	27%	0.272	C	S	.	.	H	α-helix	trans	-57.5	-46.8	179.4	-67	175.7	0	0	0	111.7	H169 G170 G175 Q182 V185 L186 A196	H169-L173 WeakPolarHBondContact O-CG 3.4Å; H169-L173 PolarHBondContact O-N 3.34Å; G170-L173 PolarHBondContact O-N 3.03Å; L173-G175 PolarHBondContact O-N 3.31Å; L173-Q182 WeakPolarHBondContact O-CG 3.39Å; L173-Q182 PolarHBondContact O-NE2 3.02Å; L173-V185 HydrophobicContact CD2-CB 4.05Å; L173-V185 HydrophobicContact CD2-CG1 3.42Å; L173-V185 VanDerWaalsContact CD2-CG1 3.42Å; L173-L186 HydrophobicContact CD1-CD2 3.95Å; L173-L186 HydrophobicContact CD2-CD2 4.49Å; L173-A196 HydrophobicContact CD2-CB 4.35Å
174	G	96.9	Very high	97	Very high	43 Å²	43	46.4 Å²	46.4	44%	0.443	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-7	178.2	0	0	0	0	0	114.8	G170 F172	G170-G174 PolarHBondContact O-N 2.8Å; F172-G174 VanDerWaalsContact C-N 3.34Å; F172-G174 PolarHBondContact O-N 3.35Å
175	G	97.8	Very high	97	Very high	3 Å²	3	43.8 Å²	43.8	3%	0.031	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.4	-5.1	-175.8	0	0	0	0	0	115.9	Q141 Q171 F172 L173 L177	Q141-G175 VanDerWaalsContact CB-O 3.27Å; Q141-G175 WeakPolarHBondContact CB-O 3.5Å; Q141-G175 PolarHBondContact N-O 3.13Å; Q171-G175 PolarHBondContact O-N 3.03Å; Q171-G175 VanDerWaalsContact O-N 3.14Å; F172-G175 CarbonylContact O-C 3.6Å; F172-G175 PolarHBondContact O-N 3.39Å; L173-G175 PolarHBondContact O-N 3.31Å; G175-L177 PolarHBondContact O-N 3.46Å
176	I	98	Very high	97	Very high	5 Å²	5	45 Å²	45	3%	0.026	25%	0.254	C	S	.	.			trans	-60.6	130.6	171.7	-69.8	162.8	0	0	0	109	L147 F150 F172 D178 I181 Q182 A200	L147-I176 HydrophobicContact CD2-CG1 4.23Å; L147-I176 HydrophobicContact CD2-CG2 4.44Å; F150-I176 HydrophobicContact CE1-CG1 4.44Å; F172-I176 HydrophobicContact CD1-CD1 4.11Å; F172-I176 HydrophobicContact CD1-CG1 4.49Å; F172-I176 HydrophobicContact CE1-CD1 3.78Å; F172-I176 HydrophobicContact CE1-CG1 4.23Å; F172-I176 HydrophobicContact CZ-CD1 4.24Å; F172-I176 HydrophobicContact CZ-CG1 4.27Å; F172-I176 WeakPolarHBondContact O-CG1 3.43Å; F172-I176 PolarHBondContact O-N 2.92Å; I176-D178 HydrophobicContact CG2-CB 4.22Å; I176-D178 VanDerWaalsContact CG2-O 3.3Å; I176-D178 WeakPolarHBondContact CG2-O 3.44Å; I176-I181 HydrophobicContact CG2-CB 4.47Å; I176-I181 HydrophobicContact CG2-CG2 4.46Å; I176-Q182 HydrophobicContact CB-CB 4.13Å; I176-Q182 HydrophobicContact CB-CG 4.44Å; I176-Q182 HydrophobicContact CG2-CB 4Å; I176-A200 HydrophobicContact CD1-CB 4.48Å
177	L	97.3	Very high	96.9	Very high	86 Å²	86	46.7 Å²	46.7	45%	0.45	26%	0.256	S	S	.	.	S	Bend	trans	-71.5	-43.3	179.4	177.6	64.3	0	0	0	111.3	Q141 P143 G175 Q179	Q141-L177 HydrophobicContact CB-CB 4.02Å; Q141-L177 HydrophobicContact CG-CB 4.12Å; P143-L177 HydrophobicContact CB-CD2 4.32Å; P143-L177 HydrophobicContact CG-CD2 4.45Å; G175-L177 PolarHBondContact O-N 3.46Å; L177-Q179 PolarHBondContact O-N 3.39Å; L177-Q179 PolarHBondContact O-NE2 3.46Å
178	D	95.8	Very high	96.9	Very high	39 Å²	39	45.9 Å²	45.9	21%	0.209	26%	0.258	C	S	.	.			trans	-78.1	106.7	-175.4	-166.4	-57.2	0	0	0	112.1	I176 E180 I181 Q182 R207	I176-D178 HydrophobicContact CG2-CB 4.22Å; I176-D178 VanDerWaalsContact CG2-O 3.3Å; I176-D178 WeakPolarHBondContact CG2-O 3.44Å; D178-E180 VanDerWaalsContact C-N 3.26Å; D178-E180 PolarHBondContact O-N 2.89Å; D178-E180 WeakPolarHBondContact OD1-CB 3.41Å; D178-E180 PolarHBondContact OD1-N 3.1Å; D178-E180 VanDerWaalsContact OD1-N 3.08Å; D178-I181 HydrophobicContact CB-CB 4.03Å; D178-I181 HydrophobicContact CB-CD1 3.83Å; D178-I181 HydrophobicContact CB-CG1 4.08Å; D178-I181 PolarHBondContact O-N 3.11Å; D178-I181 PolarHBondContact OD1-N 3.43Å; D178-Q182 WeakPolarHBondContact O-CB 3.36Å; D178-Q182 PolarHBondContact O-N 2.97Å; D178-R207 IonicContact OD1-NH1 3.26Å; D178-R207 PolarHBondContact OD1-NH1 3.25Å; D178-R207 IonicContact OD2-CZ 3.34Å; D178-R207 IonicContact OD2-NH1 3.9Å; D178-R207 PolarHBondContact OD2-NH1 3.32Å; D178-R207 IonicContact OD2-NH2 3.08Å; D178-R207 PolarHBondContact OD2-NH2 3.41Å
179	Q	96	Very high	96.7	Very high	128 Å²	128	49.7 Å²	49.7	60%	0.598	28%	0.278	S	S	*	.	H	α-helix	trans	-64.2	-29.5	-174.5	-61.6	-59.8	-61.6	0	0	113.1	L177 A183	L177-Q179 PolarHBondContact O-N 3.39Å; L177-Q179 PolarHBondContact O-NE2 3.46Å; Q179-A183 VanDerWaalsContact O-CB 3.29Å; Q179-A183 WeakPolarHBondContact O-CB 3.28Å; Q179-A183 PolarHBondContact O-N 3.39Å
180	E	95.3	Very high	96.6	Very high	107 Å²	107	48.8 Å²	48.8	50%	0.5	28%	0.275	S	S	.	.	H	α-helix	trans	-73.9	-45.9	178.6	-173.4	-176.2	-168.2	0	0	110.7	D178 Q182 A183 N184 R207	D178-E180 VanDerWaalsContact C-N 3.26Å; D178-E180 PolarHBondContact O-N 2.89Å; D178-E180 WeakPolarHBondContact OD1-CB 3.41Å; D178-E180 PolarHBondContact OD1-N 3.1Å; D178-E180 VanDerWaalsContact OD1-N 3.08Å; E180-Q182 VanDerWaalsContact C-N 3.33Å; E180-Q182 PolarHBondContact O-N 3.07Å; E180-A183 PolarHBondContact O-N 2.74Å; E180-N184 WeakPolarHBondContact O-CB 3.41Å; E180-N184 VanDerWaalsContact O-CG 3.29Å; E180-N184 PolarHBondContact O-N 3.46Å; E180-N184 PolarHBondContact O-ND2 3.35Å; E180-R207 WeakPolarHBondContact OE2-CD 3.38Å; E180-R207 IonicContact OE2-NH1 3.63Å; E180-R207 PolarHBondContact OE2-NH1 2.86Å
181	I	96.1	Very high	96.5	Very high	3 Å²	3	53.6 Å²	53.6	2%	0.015	28%	0.284	C	S	.	.	H	α-helix	trans	-61.3	-45.9	174.3	-63.7	172.4	0	0	0	109.7	L147 I176 D178 A183 N184 V185 A200 H204	L147-I181 HydrophobicContact CD1-CG2 4.46Å; I176-I181 HydrophobicContact CG2-CB 4.47Å; I176-I181 HydrophobicContact CG2-CG2 4.46Å; D178-I181 HydrophobicContact CB-CB 4.03Å; D178-I181 HydrophobicContact CB-CD1 3.83Å; D178-I181 HydrophobicContact CB-CG1 4.08Å; D178-I181 PolarHBondContact O-N 3.11Å; D178-I181 PolarHBondContact OD1-N 3.43Å; I181-A183 VanDerWaalsContact C-N 3.34Å; I181-A183 PolarHBondContact O-N 3.06Å; I181-N184 PolarHBondContact O-N 2.74Å; I181-V185 HydrophobicContact CG2-CG2 4.22Å; I181-V185 VanDerWaalsContact O-CG2 3.22Å; I181-V185 WeakPolarHBondContact O-CG2 3.49Å; I181-V185 PolarHBondContact O-N 3.36Å; I181-A200 HydrophobicContact CG2-CB 3.96Å; I181-H204 HydrophobicContact CD1-CB 3.77Å
182	Q	96.9	Very high	96.5	Very high	31 Å²	31	54 Å²	54	15%	0.145	29%	0.29	C	S	.	.	H	α-helix	trans	-55.1	-49.4	176.7	-174.1	-174.5	24.8	0	0	111.5	L173 I176 D178 E180 N184 V185 L186	L173-Q182 WeakPolarHBondContact O-CG 3.39Å; L173-Q182 PolarHBondContact O-NE2 3.02Å; I176-Q182 HydrophobicContact CB-CB 4.13Å; I176-Q182 HydrophobicContact CB-CG 4.44Å; I176-Q182 HydrophobicContact CG2-CB 4Å; D178-Q182 WeakPolarHBondContact O-CB 3.36Å; D178-Q182 PolarHBondContact O-N 2.97Å; E180-Q182 VanDerWaalsContact C-N 3.33Å; E180-Q182 PolarHBondContact O-N 3.07Å; Q182-N184 VanDerWaalsContact C-N 3.34Å; Q182-N184 PolarHBondContact O-N 2.99Å; Q182-V185 PolarHBondContact O-N 2.84Å; Q182-L186 HydrophobicContact CG-CD1 4.19Å; Q182-L186 WeakPolarHBondContact O-CG 3.42Å; Q182-L186 PolarHBondContact O-N 2.91Å
183	A	97	Very high	96.5	Very high	38 Å²	38	54.3 Å²	54.3	31%	0.314	29%	0.291	S	S	.	.	H	α-helix	trans	-62.2	-40	178.7	0	0	0	0	0	112.5	Q179 E180 I181 L186 K187	Q179-A183 VanDerWaalsContact O-CB 3.29Å; Q179-A183 WeakPolarHBondContact O-CB 3.28Å; Q179-A183 PolarHBondContact O-N 3.39Å; E180-A183 PolarHBondContact O-N 2.74Å; I181-A183 VanDerWaalsContact C-N 3.34Å; I181-A183 PolarHBondContact O-N 3.06Å; A183-L186 PolarHBondContact O-N 2.98Å; A183-K187 VanDerWaalsContact O-CG 3.27Å; A183-K187 WeakPolarHBondContact O-CG 3.47Å; A183-K187 PolarHBondContact O-N 2.94Å
184	N	96.3	Very high	96.6	Very high	39 Å²	39	55.6 Å²	55.6	21%	0.209	30%	0.304	C	S	.	.	H	α-helix	trans	-67.8	-38.5	178.4	-72.7	-26.4	0	0	0	112.4	E180 I181 Q182 K187 A188 F203	E180-N184 WeakPolarHBondContact O-CB 3.41Å; E180-N184 VanDerWaalsContact O-CG 3.29Å; E180-N184 PolarHBondContact O-N 3.46Å; E180-N184 PolarHBondContact O-ND2 3.35Å; I181-N184 PolarHBondContact O-N 2.74Å; Q182-N184 VanDerWaalsContact C-N 3.34Å; Q182-N184 PolarHBondContact O-N 2.99Å; N184-K187 PolarHBondContact O-N 3.02Å; N184-A188 PolarHBondContact O-N 3.31Å; N184-A188 VanDerWaalsContact O-N 3.09Å; N184-F203 HydrophobicContact CB-CB 4.46Å; N184-F203 HydrophobicContact CB-CD1 3.9Å; N184-F203 HydrophobicContact CB-CD2 3.58Å; N184-F203 HydrophobicContact CB-CE1 3.97Å; N184-F203 HydrophobicContact CB-CE2 3.63Å; N184-F203 HydrophobicContact CB-CG 3.72Å; N184-F203 HydrophobicContact CB-CZ 3.84Å; N184-F203 WeakPolarHBondContact O-CE2 3.49Å
185	V	96.7	Very high	96.6	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-68.3	-39.3	175.3	-176.5	0	0	0	0	111.2	L173 I181 Q182 A188 T190 A196 T199 A200 F203	L173-V185 HydrophobicContact CD2-CB 4.05Å; L173-V185 HydrophobicContact CD2-CG1 3.42Å; L173-V185 VanDerWaalsContact CD2-CG1 3.42Å; I181-V185 HydrophobicContact CG2-CG2 4.22Å; I181-V185 VanDerWaalsContact O-CG2 3.22Å; I181-V185 WeakPolarHBondContact O-CG2 3.49Å; I181-V185 PolarHBondContact O-N 3.36Å; Q182-V185 PolarHBondContact O-N 2.84Å; V185-A188 PolarHBondContact O-N 3.07Å; V185-T190 HydrophobicContact CG1-CG2 4.2Å; V185-A196 HydrophobicContact CG1-CB 4.07Å; V185-T199 HydrophobicContact CB-CG2 4.48Å; V185-T199 HydrophobicContact CG1-CG2 4.36Å; V185-T199 HydrophobicContact CG2-CG2 4.16Å; V185-A200 VanDerWaalsContact CG2-CA 3.48Å; V185-A200 HydrophobicContact CG2-CB 3.66Å; V185-F203 HydrophobicContact CG2-CD2 4.33Å
186	L	95.9	Very high	96.6	Very high	100 Å²	100	56.3 Å²	56.3	52%	0.524	30%	0.295	S	S	.	.	H	α-helix	trans	-61.5	-43	174.2	-75.5	168.2	0	0	0	111.9	L173 Q182 A183 A188 D189	L173-L186 HydrophobicContact CD1-CD2 3.95Å; L173-L186 HydrophobicContact CD2-CD2 4.49Å; Q182-L186 HydrophobicContact CG-CD1 4.19Å; Q182-L186 WeakPolarHBondContact O-CG 3.42Å; Q182-L186 PolarHBondContact O-N 2.91Å; A183-L186 PolarHBondContact O-N 2.98Å; L186-A188 VanDerWaalsContact C-N 3.27Å; L186-A188 PolarHBondContact O-N 2.88Å; L186-D189 PolarHBondContact O-N 2.87Å
187	K	96.7	Very high	96.6	Very high	165 Å²	165	56.4 Å²	56.4	72%	0.717	30%	0.296	S	S	*	.	H	α-helix	trans	-64.9	-29.8	176.2	-73.1	170.2	-173.8	172.2	0	113.2	A183 N184 D189	A183-K187 VanDerWaalsContact O-CG 3.27Å; A183-K187 WeakPolarHBondContact O-CG 3.47Å; A183-K187 PolarHBondContact O-N 2.94Å; N184-K187 PolarHBondContact O-N 3.02Å; K187-D189 PolarHBondContact O-N 3.17Å
188	A	96.1	Very high	96.7	Very high	44 Å²	44	59.9 Å²	59.9	36%	0.364	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-6.9	178.9	0	0	0	0	0	113.9	N184 V185 L186 T190 T199 F203	N184-A188 PolarHBondContact O-N 3.31Å; N184-A188 VanDerWaalsContact O-N 3.09Å; V185-A188 PolarHBondContact O-N 3.07Å; L186-A188 VanDerWaalsContact C-N 3.27Å; L186-A188 PolarHBondContact O-N 2.88Å; A188-T190 VanDerWaalsContact C-N 3.3Å; A188-T190 HydrophobicContact CB-CG2 4.3Å; A188-T190 PolarHBondContact O-N 3.4Å; A188-T199 HydrophobicContact CB-CG2 3.75Å; A188-F203 HydrophobicContact CB-CE2 4.47Å
189	D	94.2	Very high	96.7	Very high	101 Å²	101	59.2 Å²	59.2	54%	0.54	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.5	43.3	174.8	-169.4	25.9	0	0	0	114.3	L186 K187 K191	L186-D189 PolarHBondContact O-N 2.87Å; K187-D189 PolarHBondContact O-N 3.17Å; D189-K191 VanDerWaalsContact O-CE 3.3Å; D189-K191 WeakPolarHBondContact O-CE 3.04Å; D189-K191 IonicContact OD1-NZ 2.75Å; D189-K191 PolarHBondContact OD1-NZ 3.2Å; D189-K191 WeakPolarHBondContact OD2-CE 3.42Å; D189-K191 IonicContact OD2-NZ 2.65Å; D189-K191 PolarHBondContact OD2-NZ 3.11Å
190	T	96.3	Very high	96.8	Very high	6 Å²	6	53.1 Å²	53.1	4%	0.037	27%	0.272	C	S	.	.			trans	-59.9	139.1	178.9	60.4	0	0	0	0	112.2	H169 V185 A188 E195 T199	H169-T190 PolarHBondContact CE1-O 3.29Å; H169-T190 PolarHBondContact NE2-O 2.88Å; H169-T190 VanDerWaalsContact NE2-O 3.08Å; H169-T190 PolarHBondContact NE2-OG1 3.05Å; V185-T190 HydrophobicContact CG1-CG2 4.2Å; A188-T190 VanDerWaalsContact C-N 3.3Å; A188-T190 HydrophobicContact CB-CG2 4.3Å; A188-T190 PolarHBondContact O-N 3.4Å; T190-E195 HydrophobicContact CG2-CB 4.42Å; T190-E195 HydrophobicContact CG2-CG 3.8Å; T190-T199 HydrophobicContact CG2-CG2 4.21Å
191	K	95.1	Very high	96.9	Very high	142 Å²	142	52.8 Å²	52.8	62%	0.617	27%	0.269	S	S	*	.			trans	-101.6	-7.6	-172.7	-56.9	-56.4	177.5	-167.2	0	114.7	D189 E195	D189-K191 VanDerWaalsContact O-CE 3.3Å; D189-K191 WeakPolarHBondContact O-CE 3.04Å; D189-K191 IonicContact OD1-NZ 2.75Å; D189-K191 PolarHBondContact OD1-NZ 3.2Å; D189-K191 WeakPolarHBondContact OD2-CE 3.42Å; D189-K191 IonicContact OD2-NZ 2.65Å; D189-K191 PolarHBondContact OD2-NZ 3.11Å; K191-E195 PolarHBondContact N-OE2 3.29Å
192	S	97.7	Very high	97	Very high	36 Å²	36	58.1 Å²	58.1	25%	0.252	29%	0.294	S	S	.	.	S	Bend	trans	-143.9	159.2	-179.9	63	0	0	0	0	111.6	D165 H169 A194 E195 A196	D165-S192 WeakPolarHBondContact OD2-CA 3.41Å; D165-S192 VanDerWaalsContact OD2-CB 3.27Å; D165-S192 WeakPolarHBondContact OD2-CB 3.38Å; H169-S192 PolarHBondContact CD2-O 2.9Å; H169-S192 VanDerWaalsContact CD2-O 3.29Å; S192-A194 VanDerWaalsContact C-N 3.29Å; S192-A194 PolarHBondContact O-N 2.93Å; S192-E195 PolarHBondContact O-N 2.81Å; S192-E195 VanDerWaalsContact OG-CB 3.26Å; S192-E195 WeakPolarHBondContact OG-CB 3.33Å; S192-E195 PolarHBondContact OG-N 3.16Å; S192-A196 PolarHBondContact O-N 3.49Å
193	F	98.2	Very high	96.9	Very high	6 Å²	6	59.4 Å²	59.4	3%	0.026	30%	0.299	C	S	.	.	H	α-helix	trans	-59	-42	174.3	171.5	-109.3	0	0	0	111.8	A151 L154 R155 D165 L168 H169 F172 E195 A196 V197	A151-F193 HydrophobicContact CB-CZ 3.88Å; L154-F193 HydrophobicContact CB-CZ 4.47Å; L154-F193 HydrophobicContact CD1-CE2 4.39Å; R155-F193 HydrophobicContact CG-CD1 4.45Å; R155-F193 HydrophobicContact CG-CE1 3.47Å; R155-F193 VanDerWaalsContact CG-CE1 3.47Å; R155-F193 HydrophobicContact CG-CZ 4.04Å; D165-F193 WeakPolarHBondContact OD1-CB 3.39Å; D165-F193 PolarHBondContact OD2-N 3.27Å; L168-F193 HydrophobicContact CB-CB 3.85Å; L168-F193 HydrophobicContact CB-CD1 4.23Å; L168-F193 HydrophobicContact CB-CD2 3.9Å; L168-F193 HydrophobicContact CB-CG 3.72Å; L168-F193 WeakPolarHBondContact O-CD2 3.28Å; H169-F193 HydrophobicContact CB-CB 4.22Å; F172-F193 HydrophobicContact CB-CD2 3.72Å; F172-F193 HydrophobicContact CB-CE2 3.61Å; F172-F193 AromaticContact CD2-CE2 3.79Å; F172-F193 HydrophobicContact CD2-CE2 3.79Å; F172-F193 HydrophobicContact CG-CD2 4.11Å; F172-F193 AromaticContact CG-CE2 3.75Å; F172-F193 HydrophobicContact CG-CE2 3.75Å; F193-E195 VanDerWaalsContact C-N 3.32Å; F193-E195 PolarHBondContact O-N 2.95Å; F193-A196 PolarHBondContact O-N 3.09Å; F193-V197 HydrophobicContact CD2-CG2 4.2Å; F193-V197 HydrophobicContact CE1-CG2 4.18Å; F193-V197 HydrophobicContact CE2-CG2 3.76Å; F193-V197 HydrophobicContact CZ-CG2 3.76Å; F193-V197 WeakPolarHBondContact O-CG2 3.13Å; F193-V197 PolarHBondContact O-N 2.82Å
194	A	97.8	Very high	96.8	Very high	45 Å²	45	61.3 Å²	61.3	37%	0.372	30%	0.301	S	S	.	.	H	α-helix	trans	-62.4	-38.3	178.3	0	0	0	0	0	112.8	S192 R198	S192-A194 VanDerWaalsContact C-N 3.29Å; S192-A194 PolarHBondContact O-N 2.93Å; A194-R198 PolarHBondContact O-N 2.76Å; A194-R198 VanDerWaalsContact O-N 3.16Å
195	E	97.8	Very high	96.7	Very high	61 Å²	61	61.5 Å²	61.5	29%	0.285	31%	0.308	S	S	.	.	H	α-helix	trans	-68	-45.1	175	-169.5	-174.7	176.5	0	0	111.8	T190 K191 S192 F193 V197 R198 T199	T190-E195 HydrophobicContact CG2-CB 4.42Å; T190-E195 HydrophobicContact CG2-CG 3.8Å; K191-E195 PolarHBondContact N-OE2 3.29Å; S192-E195 PolarHBondContact O-N 2.81Å; S192-E195 VanDerWaalsContact OG-CB 3.26Å; S192-E195 WeakPolarHBondContact OG-CB 3.33Å; S192-E195 PolarHBondContact OG-N 3.16Å; F193-E195 VanDerWaalsContact C-N 3.32Å; F193-E195 PolarHBondContact O-N 2.95Å; E195-V197 VanDerWaalsContact C-N 3.32Å; E195-V197 PolarHBondContact O-N 3.17Å; E195-R198 PolarHBondContact O-N 2.86Å; E195-T199 WeakPolarHBondContact O-CB 3.35Å; E195-T199 PolarHBondContact O-N 2.51Å; E195-T199 PolarHBondContact O-OG1 3.33Å; E195-T199 VanDerWaalsContact O-OG1 3.05Å
196	A	98.1	Very high	96.6	Very high	0 Å²	0	65 Å²	65	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-57.2	-43.9	176.1	0	0	0	0	0	112.4	F172 L173 V185 S192 F193 T199 A200	F172-A196 HydrophobicContact CD1-CB 3.83Å; F172-A196 HydrophobicContact CE1-CB 4.15Å; L173-A196 HydrophobicContact CD2-CB 4.35Å; V185-A196 HydrophobicContact CG1-CB 4.07Å; S192-A196 PolarHBondContact O-N 3.49Å; F193-A196 PolarHBondContact O-N 3.09Å; A196-T199 PolarHBondContact O-N 3.19Å; A196-A200 VanDerWaalsContact O-CB 3.27Å; A196-A200 WeakPolarHBondContact O-CB 3.29Å; A196-A200 PolarHBondContact O-N 2.96Å
197	V	98.2	Very high	96.3	Very high	7 Å²	7	63.1 Å²	63.1	4%	0.042	32%	0.315	C	S	.	.	H	α-helix	trans	-62.8	-45.6	176.8	174.7	0	0	0	0	111.2	A151 F172 F193 E195 T199 A200 K201	A151-V197 HydrophobicContact CB-CG1 4.1Å; A151-V197 HydrophobicContact CB-CG2 3.69Å; F172-V197 HydrophobicContact CD1-CG2 4.31Å; F172-V197 HydrophobicContact CD2-CG2 4.21Å; F172-V197 HydrophobicContact CE1-CB 4.5Å; F172-V197 HydrophobicContact CE1-CG2 3.98Å; F172-V197 HydrophobicContact CE2-CG2 3.87Å; F172-V197 HydrophobicContact CG-CG2 4.42Å; F172-V197 HydrophobicContact CZ-CB 4.3Å; F172-V197 HydrophobicContact CZ-CG2 3.76Å; F193-V197 HydrophobicContact CD2-CG2 4.2Å; F193-V197 HydrophobicContact CE1-CG2 4.18Å; F193-V197 HydrophobicContact CE2-CG2 3.76Å; F193-V197 HydrophobicContact CZ-CG2 3.76Å; F193-V197 WeakPolarHBondContact O-CG2 3.13Å; F193-V197 PolarHBondContact O-N 2.82Å; E195-V197 VanDerWaalsContact C-N 3.32Å; E195-V197 PolarHBondContact O-N 3.17Å; V197-T199 PolarHBondContact O-N 2.8Å; V197-A200 PolarHBondContact O-N 3.38Å; V197-K201 HydrophobicContact CG1-CD 4.09Å; V197-K201 WeakPolarHBondContact O-CG 3.35Å; V197-K201 PolarHBondContact O-N 3.46Å
198	R	97.9	Very high	96.1	Very high	160 Å²	160	61.9 Å²	61.9	60%	0.604	31%	0.306	S	S	*	.	H	α-helix	trans	-61.5	-46.2	179	-169.6	-173.4	-55	103.4	3.3	111.3	A194 E195 K201 H202	A194-R198 PolarHBondContact O-N 2.76Å; A194-R198 VanDerWaalsContact O-N 3.16Å; E195-R198 PolarHBondContact O-N 2.86Å; R198-K201 PolarHBondContact O-N 3.12Å; R198-H202 PolarHBondContact O-N 3.19Å
199	T	97.7	Very high	95.9	Very high	25 Å²	25	64 Å²	64	15%	0.153	31%	0.311	C	S	.	.	H	α-helix	trans	-64.9	-42.7	179.1	-61.7	0	0	0	0	111.5	V185 A188 T190 E195 A196 V197 K201 H202 F203	V185-T199 HydrophobicContact CB-CG2 4.48Å; V185-T199 HydrophobicContact CG1-CG2 4.36Å; V185-T199 HydrophobicContact CG2-CG2 4.16Å; A188-T199 HydrophobicContact CB-CG2 3.75Å; T190-T199 HydrophobicContact CG2-CG2 4.21Å; E195-T199 WeakPolarHBondContact O-CB 3.35Å; E195-T199 PolarHBondContact O-N 2.51Å; E195-T199 PolarHBondContact O-OG1 3.33Å; E195-T199 VanDerWaalsContact O-OG1 3.05Å; A196-T199 PolarHBondContact O-N 3.19Å; V197-T199 PolarHBondContact O-N 2.8Å; T199-K201 PolarHBondContact O-N 2.98Å; T199-H202 WeakPolarHBondContact O-CB 3.25Å; T199-H202 PolarHBondContact O-N 3.38Å; T199-F203 HydrophobicContact CG2-CD2 3.71Å; T199-F203 HydrophobicContact CG2-CE2 3.39Å; T199-F203 VanDerWaalsContact O-CD2 3.23Å; T199-F203 WeakPolarHBondContact O-CD2 3.34Å; T199-F203 PolarHBondContact O-N 3.3Å
200	A	97.8	Very high	95.7	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-60.7	-45.5	176.5	0	0	0	0	0	111.7	L147 F172 I176 I181 V185 A196 V197 H202 F203 H204	L147-A200 HydrophobicContact CD1-CB 4.02Å; F172-A200 HydrophobicContact CE1-CB 3.91Å; F172-A200 HydrophobicContact CZ-CB 3.97Å; I176-A200 HydrophobicContact CD1-CB 4.48Å; I181-A200 HydrophobicContact CG2-CB 3.96Å; V185-A200 VanDerWaalsContact CG2-CA 3.48Å; V185-A200 HydrophobicContact CG2-CB 3.66Å; A196-A200 VanDerWaalsContact O-CB 3.27Å; A196-A200 WeakPolarHBondContact O-CB 3.29Å; A196-A200 PolarHBondContact O-N 2.96Å; V197-A200 PolarHBondContact O-N 3.38Å; A200-H202 VanDerWaalsContact C-N 3.32Å; A200-H202 PolarHBondContact O-N 3.43Å; A200-F203 PolarHBondContact O-N 3.45Å; A200-H204 WeakPolarHBondContact O-CB 3.4Å; A200-H204 PolarHBondContact O-N 3.01Å
201	K	97.1	Very high	95.5	Very high	99 Å²	99	65 Å²	65	43%	0.43	32%	0.318	S	S	.	.	H	α-helix	trans	-62.9	-38.8	176.4	-72	176.4	68.2	172.4	0	112.2	E148 V197 R198 T199 H204 A205	E148-K201 WeakPolarHBondContact OE2-CD 3.35Å; E148-K201 WeakPolarHBondContact OE2-CE 3.37Å; E148-K201 IonicContact OE2-NZ 3.39Å; E148-K201 PolarHBondContact OE2-NZ 3.43Å; V197-K201 HydrophobicContact CG1-CD 4.09Å; V197-K201 WeakPolarHBondContact O-CG 3.35Å; V197-K201 PolarHBondContact O-N 3.46Å; R198-K201 PolarHBondContact O-N 3.12Å; T199-K201 PolarHBondContact O-N 2.98Å; K201-H204 PolarHBondContact O-N 3.3Å; K201-A205 WeakPolarHBondContact O-CB 3.32Å; K201-A205 PolarHBondContact O-N 2.84Å
202	H	96.8	Very high	95.2	Very high	116 Å²	116	62.6 Å²	62.6	54%	0.537	31%	0.309	S	S	.	.	H	α-helix	trans	-61.9	-51	176.1	178.7	68	0	0	0	111.4	R198 T199 A200 H204 A205 V206	R198-H202 PolarHBondContact O-N 3.19Å; T199-H202 WeakPolarHBondContact O-CB 3.25Å; T199-H202 PolarHBondContact O-N 3.38Å; A200-H202 VanDerWaalsContact C-N 3.32Å; A200-H202 PolarHBondContact O-N 3.43Å; H202-H204 VanDerWaalsContact C-N 3.33Å; H202-H204 PolarHBondContact O-N 3.34Å; H202-A205 PolarHBondContact O-N 2.93Å; H202-A205 VanDerWaalsContact O-N 3.16Å; H202-V206 WeakPolarHBondContact O-CG2 3.15Å; H202-V206 PolarHBondContact O-N 2.83Å
203	F	96.2	Very high	94.9	Very high	57 Å²	57	66.6 Å²	66.6	25%	0.25	33%	0.325	C	S	.	.	H	α-helix	trans	-62.8	-39.4	177.7	-75.2	-60.4	0	0	0	112.8	N184 V185 A188 T199 A200 A205 V206 R207	N184-F203 HydrophobicContact CB-CB 4.46Å; N184-F203 HydrophobicContact CB-CD1 3.9Å; N184-F203 HydrophobicContact CB-CD2 3.58Å; N184-F203 HydrophobicContact CB-CE1 3.97Å; N184-F203 HydrophobicContact CB-CE2 3.63Å; N184-F203 HydrophobicContact CB-CG 3.72Å; N184-F203 HydrophobicContact CB-CZ 3.84Å; N184-F203 WeakPolarHBondContact O-CE2 3.49Å; V185-F203 HydrophobicContact CG2-CD2 4.33Å; A188-F203 HydrophobicContact CB-CE2 4.47Å; T199-F203 HydrophobicContact CG2-CD2 3.71Å; T199-F203 HydrophobicContact CG2-CE2 3.39Å; T199-F203 VanDerWaalsContact O-CD2 3.23Å; T199-F203 WeakPolarHBondContact O-CD2 3.34Å; T199-F203 PolarHBondContact O-N 3.3Å; A200-F203 PolarHBondContact O-N 3.45Å; F203-A205 VanDerWaalsContact C-N 3.32Å; F203-A205 PolarHBondContact O-N 3.26Å; F203-V206 PolarHBondContact O-N 3.27Å; F203-R207 PolarHBondContact O-N 2.78Å
204	H	94.7	Very high	94.5	Very high	78 Å²	78	72.4 Å²	72.4	36%	0.361	35%	0.352	S	S	.	.	H	α-helix	trans	-58.4	-44.4	173.6	-174	-74.9	0	0	0	111.8	L147 I181 A200 K201 H202 R208	L147-H204 HydrophobicContact CD1-CB 3.94Å; I181-H204 HydrophobicContact CD1-CB 3.77Å; A200-H204 WeakPolarHBondContact O-CB 3.4Å; A200-H204 PolarHBondContact O-N 3.01Å; K201-H204 PolarHBondContact O-N 3.3Å; H202-H204 VanDerWaalsContact C-N 3.33Å; H202-H204 PolarHBondContact O-N 3.34Å; H204-R208 WeakPolarHBondContact O-CB 3.31Å; H204-R208 PolarHBondContact O-N 2.88Å
205	A	94.7	Very high	93.9	Very high	44 Å²	44	73.7 Å²	73.7	36%	0.364	36%	0.359	S	S	.	.	H	α-helix	trans	-66.9	-43	178.3	0	0	0	0	0	112.2	K201 H202 F203 R207 R208 N209	K201-A205 WeakPolarHBondContact O-CB 3.32Å; K201-A205 PolarHBondContact O-N 2.84Å; H202-A205 PolarHBondContact O-N 2.93Å; H202-A205 VanDerWaalsContact O-N 3.16Å; F203-A205 VanDerWaalsContact C-N 3.32Å; F203-A205 PolarHBondContact O-N 3.26Å; A205-R207 VanDerWaalsContact C-N 3.34Å; A205-R207 PolarHBondContact O-N 2.78Å; A205-R208 PolarHBondContact O-N 3.03Å; A205-N209 WeakPolarHBondContact O-CB 2.99Å; A205-N209 PolarHBondContact O-N 3.3Å; A205-N209 PolarHBondContact O-OD1 3.14Å
206	V	93.6	Very high	93.3	Very high	73 Å²	73	74.4 Å²	74.4	44%	0.442	37%	0.37	S	S	.	.	H	α-helix	trans	-59.6	-45.3	176.5	170.3	0	0	0	0	111	H202 F203 N209 A210	H202-V206 WeakPolarHBondContact O-CG2 3.15Å; H202-V206 PolarHBondContact O-N 2.83Å; F203-V206 PolarHBondContact O-N 3.27Å; V206-N209 PolarHBondContact O-N 3.19Å; V206-A210 PolarHBondContact O-N 2.96Å
207	R	90.7	Very high	92.5	Very high	60 Å²	60	80.7 Å²	80.7	23%	0.226	40%	0.399	C	S	.	.	H	α-helix	trans	-65.8	-45.8	179.9	-164.7	-176.1	70.7	-160.3	-8.6	112.1	D178 E180 F203 A205 N209 A210 E211	D178-R207 IonicContact OD1-NH1 3.26Å; D178-R207 PolarHBondContact OD1-NH1 3.25Å; D178-R207 IonicContact OD2-CZ 3.34Å; D178-R207 IonicContact OD2-NH1 3.9Å; D178-R207 PolarHBondContact OD2-NH1 3.32Å; D178-R207 IonicContact OD2-NH2 3.08Å; D178-R207 PolarHBondContact OD2-NH2 3.41Å; E180-R207 WeakPolarHBondContact OE2-CD 3.38Å; E180-R207 IonicContact OE2-NH1 3.63Å; E180-R207 PolarHBondContact OE2-NH1 2.86Å; F203-R207 PolarHBondContact O-N 2.78Å; A205-R207 VanDerWaalsContact C-N 3.34Å; A205-R207 PolarHBondContact O-N 2.78Å; R207-N209 VanDerWaalsContact C-N 3.29Å; R207-N209 PolarHBondContact O-N 2.57Å; R207-A210 WeakPolarHBondContact O-CA 3.31Å; R207-A210 WeakPolarHBondContact O-CB 3.4Å; R207-A210 PolarHBondContact O-N 3.31Å; R207-E211 WeakPolarHBondContact CD-OE1 3.39Å; R207-E211 HydrophobicContact CG-CG 4.47Å; R207-E211 WeakPolarHBondContact CG-OE1 3.45Å; R207-E211 IonicContact CZ-OE1 3.05Å; R207-E211 IonicContact NE-OE1 2.68Å; R207-E211 PolarHBondContact NE-OE1 3.36Å; R207-E211 WeakPolarHBondContact O-CG 3.43Å; R207-E211 PolarHBondContact O-N 3.02Å
208	R	91.1	Very high	91.6	Very high	139 Å²	139	83.4 Å²	83.4	53%	0.525	42%	0.422	S	S	.	.	H	α-helix	trans	-55.9	-45.9	175.9	-175.1	-174.7	178.9	135.9	5	111.6	H204 A205 A210 E211 E212	H204-R208 WeakPolarHBondContact O-CB 3.31Å; H204-R208 PolarHBondContact O-N 2.88Å; A205-R208 PolarHBondContact O-N 3.03Å; R208-A210 VanDerWaalsContact C-N 3.29Å; R208-A210 PolarHBondContact O-N 2.67Å; R208-E211 PolarHBondContact O-N 3.35Å; R208-E212 WeakPolarHBondContact CG-OE1 3.11Å; R208-E212 IonicContact CZ-OE1 2.65Å; R208-E212 IonicContact NE-OE1 2.96Å; R208-E212 PolarHBondContact NE-OE1 3.42Å; R208-E212 IonicContact NH2-OE1 3.07Å; R208-E212 WeakPolarHBondContact O-CB 3.44Å; R208-E212 WeakPolarHBondContact O-CG 3Å; R208-E212 PolarHBondContact O-N 3.04Å
209	N	91.9	Very high	90.8	Very high	89 Å²	89	79.6 Å²	79.6	48%	0.476	42%	0.42	S	S	.	.	H	α-helix	trans	-62.7	-37.6	177.3	-67.7	-6.3	0	0	0	111.7	A205 V206 R207 M213	A205-N209 WeakPolarHBondContact O-CB 2.99Å; A205-N209 PolarHBondContact O-N 3.3Å; A205-N209 PolarHBondContact O-OD1 3.14Å; V206-N209 PolarHBondContact O-N 3.19Å; R207-N209 VanDerWaalsContact C-N 3.29Å; R207-N209 PolarHBondContact O-N 2.57Å; N209-M213 VanDerWaalsContact O-CG 3.29Å; N209-M213 WeakPolarHBondContact O-CG 3.16Å; N209-M213 PolarHBondContact O-N 3.19Å
210	A	91	Very high	89.8	Confident	33 Å²	33	84.6 Å²	84.6	27%	0.273	45%	0.446	S	S	.	.	H	α-helix	trans	-66.1	-42.1	176.1	0	0	0	0	0	112.6	V206 R207 R208 M213 Q214	V206-A210 PolarHBondContact O-N 2.96Å; R207-A210 WeakPolarHBondContact O-CA 3.31Å; R207-A210 WeakPolarHBondContact O-CB 3.4Å; R207-A210 PolarHBondContact O-N 3.31Å; R208-A210 VanDerWaalsContact C-N 3.29Å; R208-A210 PolarHBondContact O-N 2.67Å; A210-M213 HydrophobicContact CB-CE 4.44Å; A210-M213 PolarHBondContact O-N 2.91Å; A210-Q214 VanDerWaalsContact O-CG 3.29Å; A210-Q214 WeakPolarHBondContact O-CG 3.45Å; A210-Q214 PolarHBondContact O-N 2.9Å
211	E	90.7	Very high	88.7	Confident	95 Å²	95	89.7 Å²	89.7	44%	0.444	48%	0.481	S	S	.	.	H	α-helix	trans	-63.3	-44.1	175.1	-68.9	165.6	-168.8	0	0	111.4	R207 R208 M213 Q214 S215	R207-E211 WeakPolarHBondContact CD-OE1 3.39Å; R207-E211 HydrophobicContact CG-CG 4.47Å; R207-E211 WeakPolarHBondContact CG-OE1 3.45Å; R207-E211 IonicContact CZ-OE1 3.05Å; R207-E211 IonicContact NE-OE1 2.68Å; R207-E211 PolarHBondContact NE-OE1 3.36Å; R207-E211 WeakPolarHBondContact O-CG 3.43Å; R207-E211 PolarHBondContact O-N 3.02Å; R208-E211 PolarHBondContact O-N 3.35Å; E211-M213 PolarHBondContact O-N 3.1Å; E211-Q214 PolarHBondContact O-N 2.9Å; E211-S215 PolarHBondContact O-N 2.73Å
212	E	90.1	Very high	87.4	Confident	91 Å²	91	90.1 Å²	90.1	43%	0.425	50%	0.497	S	S	.	.	H	α-helix	trans	-61.5	-43.9	176.5	-73.4	173.6	-172.8	0	0	111.3	R208 Q214 S215 C216	R208-E212 WeakPolarHBondContact CG-OE1 3.11Å; R208-E212 IonicContact CZ-OE1 2.65Å; R208-E212 IonicContact NE-OE1 2.96Å; R208-E212 PolarHBondContact NE-OE1 3.42Å; R208-E212 IonicContact NH2-OE1 3.07Å; R208-E212 WeakPolarHBondContact O-CB 3.44Å; R208-E212 WeakPolarHBondContact O-CG 3Å; R208-E212 PolarHBondContact O-N 3.04Å; E212-Q214 PolarHBondContact O-N 3.13Å; E212-S215 PolarHBondContact O-N 2.88Å; E212-C216 PolarHBondContact O-N 3.36Å; E212-C216 VanDerWaalsContact O-N 3.12Å; E212-C216 PolarHBondContact O-SG 3.07Å
213	M	90.9	Very high	85.5	Confident	120 Å²	120	90.7 Å²	90.7	59%	0.591	54%	0.535	S	S	*	.	H	α-helix	trans	-62.5	-40.4	175.9	-74.2	-174.6	-60.9	0	0	112.8	N209 A210 E211 C216 Q217	N209-M213 VanDerWaalsContact O-CG 3.29Å; N209-M213 WeakPolarHBondContact O-CG 3.16Å; N209-M213 PolarHBondContact O-N 3.19Å; A210-M213 HydrophobicContact CB-CE 4.44Å; A210-M213 PolarHBondContact O-N 2.91Å; E211-M213 PolarHBondContact O-N 3.1Å; M213-C216 PolarHBondContact O-N 2.84Å; M213-Q217 WeakPolarHBondContact O-CG 3.4Å; M213-Q217 PolarHBondContact O-N 3Å
214	Q	89	Confident	85	Confident	128 Å²	128	92.4 Å²	92.4	60%	0.598	55%	0.549	S	S	*	.	H	α-helix	trans	-66.7	-38.1	177.1	-71.6	171.2	14.1	0	0	111.7	A210 E211 E212 Q217 A218	A210-Q214 VanDerWaalsContact O-CG 3.29Å; A210-Q214 WeakPolarHBondContact O-CG 3.45Å; A210-Q214 PolarHBondContact O-N 2.9Å; E211-Q214 PolarHBondContact O-N 2.9Å; E212-Q214 PolarHBondContact O-N 3.13Å; Q214-Q217 PolarHBondContact O-N 3.27Å; Q214-A218 PolarHBondContact O-N 3.5Å; Q214-A218 VanDerWaalsContact O-N 3.09Å
215	S	86	Confident	84.5	Confident	73 Å²	73	93.2 Å²	93.2	51%	0.51	56%	0.559	S	S	.	*	H	α-helix	trans	-65	-38.9	177.4	-170.9	0	0	0	0	112.6	E211 E212 S219	E211-S215 PolarHBondContact O-N 2.73Å; E212-S215 PolarHBondContact O-N 2.88Å; S215-S219 PolarHBondContact O-N 3.3Å; S215-S219 PolarHBondContact O-OG 3.41Å
216	C	85	Confident	83.9	Confident	76 Å²	76	95.9 Å²	95.9	51%	0.514	57%	0.57	S	S	.	*	H	α-helix	trans	-65.5	-45.5	175.8	-67.5	0	0	0	0	111.7	E212 M213 A218 S219 D220	E212-C216 PolarHBondContact O-N 3.36Å; E212-C216 VanDerWaalsContact O-N 3.12Å; E212-C216 PolarHBondContact O-SG 3.07Å; M213-C216 PolarHBondContact O-N 2.84Å; C216-A218 PolarHBondContact O-N 3.42Å; C216-S219 PolarHBondContact O-N 3.44Å; C216-D220 PolarHBondContact O-N 3.03Å
217	Q	80.7	Confident	83.3	Confident	132 Å²	132	97.2 Å²	97.2	62%	0.617	58%	0.577	S	S	*	*	H	α-helix	trans	-63.2	-38.2	179.6	-70.5	178	-10.6	0	0	113.4	M213 Q214 S219 S221	M213-Q217 WeakPolarHBondContact O-CG 3.4Å; M213-Q217 PolarHBondContact O-N 3Å; Q214-Q217 PolarHBondContact O-N 3.27Å; Q217-S219 VanDerWaalsContact C-N 3.32Å; Q217-S221 PolarHBondContact O-N 2.86Å; Q217-S221 PolarHBondContact O-OG 3.32Å
218	A	80.1	Confident	82.9	Confident	64 Å²	64	99.6 Å²	99.6	53%	0.529	60%	0.599	S	S	.	*	H	α-helix	trans	-67.7	-33.7	176.9	0	0	0	0	0	112.2	Q214 C216	Q214-A218 PolarHBondContact O-N 3.5Å; Q214-A218 VanDerWaalsContact O-N 3.09Å; C216-A218 PolarHBondContact O-N 3.42Å
219	S	80.2	Confident	82.3	Confident	79 Å²	79	96.9 Å²	96.9	55%	0.552	60%	0.604	S	S	*	*	H	α-helix	trans	-71.5	-40.5	177.8	-54	0	0	0	0	111.6	S215 C216 Q217 S221 S222	S215-S219 PolarHBondContact O-N 3.3Å; S215-S219 PolarHBondContact O-OG 3.41Å; C216-S219 PolarHBondContact O-N 3.44Å; Q217-S219 VanDerWaalsContact C-N 3.32Å; S219-S221 VanDerWaalsContact C-N 3.29Å; S219-S221 PolarHBondContact O-N 2.95Å; S219-S222 PolarHBondContact O-N 3.25Å
220	D	78.1	Confident	81.6	Confident	130 Å²	130	97.5 Å²	97.5	70%	0.695	61%	0.613	S	S	*	*	H	α-helix	trans	-69.5	-25.8	178.3	-69	-18.2	0	0	0	113	C216	C216-D220 PolarHBondContact O-N 3.03Å
221	S	75.1	Confident	80.9	Confident	107 Å²	107	102.5 Å²	102.5	75%	0.748	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	-7.5	-179.7	-56.8	0	0	0	0	114	Q217 S219	Q217-S221 PolarHBondContact O-N 2.86Å; Q217-S221 PolarHBondContact O-OG 3.32Å; S219-S221 VanDerWaalsContact C-N 3.29Å; S219-S221 PolarHBondContact O-N 2.95Å
222	S	69.7	Low	80.1	Confident	108 Å²	108	103.1 Å²	103.1	76%	0.755	66%	0.655	S	S	*	*			trans	-111.8	4.2	-176.4	-168.3	0	0	0	0	114.1	S219	S219-S222 PolarHBondContact O-N 3.25Å
223	G	56.3	Low	79.2	Confident	129 Å²	129	104.2 Å²	104.2	100%	1.33	68%	0.676	S	S	*	*			trans	-102.6	0	171.2	0	0	0	0	0	111.7

Retrieved 223 of 223 residues in 101.6 ms (Link to these results)

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