A0A077ZE79_TRITR Loading...

Globin

AlphaFold DB , UniProt , Accession A0A077ZE79, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 221 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	48.3	Very low	48.4	Very low	248 Å²	248	127.5 Å²	127.5	100%	1.222	81%	0.806	S	S	*	*				0	127.8	0	-76.4	175	148.8	0	0	107.9
2	G	48.3	Very low	48.4	Very low	71 Å²	71	135.3 Å²	135.3	73%	0.732	82%	0.819	S	S	*	*			trans	82.2	102.8	176.1	0	0	0	0	0	114
3	S	47	Very low	47.9	Very low	135 Å²	135	130 Å²	130	94%	0.944	81%	0.808	S	S	*	*				61.6	127.1	66.6	-50.8	0	0	0	0	111.5
4	G	42.8	Very low	48.3	Very low	69 Å²	69	133.1 Å²	133.1	71%	0.711	82%	0.817	S	S	*	*			cis	159.2	-178.6	9.1	0	0	0	0	0	109.1
5	S	55	Low	47.9	Very low	125 Å²	125	140.1 Å²	140.1	87%	0.874	82%	0.822	S	S	*	*			trans	76	117.6	170.8	-57.1	0	0	0	0	117.8
6	S	52.3	Low	48	Very low	112 Å²	112	139.6 Å²	139.6	78%	0.783	83%	0.829	S	S	*	*			cis	83.1	140.4	24.9	-156.9	0	0	0	0	117.6
7	V	55.2	Low	47.9	Very low	108 Å²	108	137.9 Å²	137.9	66%	0.655	83%	0.826	S	S	*	*			trans	98.5	102	156.6	-167.6	0	0	0	0	116.7
8	Q	46.5	Very low	48.2	Very low	152 Å²	152	137.1 Å²	137.1	71%	0.71	83%	0.828	S	S	*	*				66	150.8	91.1	-59.3	177.3	-61.8	0	0	114
9	R	46.3	Very low	48.2	Very low	206 Å²	206	140.7 Å²	140.7	78%	0.777	83%	0.831	S	S	*	*			cis	-179.3	151.5	31.8	-143.6	174.9	-165.6	-150.3	2.8	110
10	S	47.8	Very low	48.2	Very low	110 Å²	110	138.2 Å²	138.2	77%	0.769	83%	0.827	S	S	*	*			trans	48.8	146.6	139.8	50.6	0	0	0	0	121.4
11	G	43.5	Very low	48.1	Very low	67 Å²	67	137.7 Å²	137.7	69%	0.691	83%	0.825	S	S	*	*			cis	146.7	169.6	17.8	0	0	0	0	0	109.7
12	K	48.2	Very low	48	Very low	221 Å²	221	132.5 Å²	132.5	96%	0.961	81%	0.807	S	S	*	*			trans	81.8	129.8	-179.4	-66.3	175.6	170.3	175.4	0	115.3
13	G	41.6	Very low	47.7	Very low	66 Å²	66	133 Å²	133	68%	0.68	81%	0.813	S	S	*	*			cis	111.4	107	11	0	0	0	0	0	110.2
14	D	53.6	Low	47.7	Very low	174 Å²	174	133 Å²	133	93%	0.93	81%	0.813	S	S	*	*			trans	-156.4	134.9	154.9	-104.9	-33.4	0	0	0	112.6
15	R	42.8	Very low	47.4	Very low	237 Å²	237	133.6 Å²	133.6	89%	0.894	82%	0.818	S	S	*	*			trans	-103.1	143.6	175.4	-80.2	175.2	167.7	172.4	-3.9	108.1
16	S	48.3	Very low	46.7	Very low	133 Å²	133	131 Å²	131	93%	0.93	81%	0.812	S	S	*	*			trans	-156.5	138.2	147.6	-85.5	0	0	0	0	111.8
17	S	46.7	Very low	46.6	Very low	110 Å²	110	134.3 Å²	134.3	77%	0.769	82%	0.815	S	S	*	*			trans	-106.8	145.9	-167.1	50.8	0	0	0	0	112.3
18	S	53.4	Low	46	Very low	124 Å²	124	135.7 Å²	135.7	87%	0.867	82%	0.819	S	S	*	*			trans	-172.3	100.5	154.5	-71.4	0	0	0	0	106.6
19	K	47.9	Very low	45.9	Very low	206 Å²	206	135.9 Å²	135.9	90%	0.896	83%	0.825	S	S	*	*				66.6	123	72.1	-155.1	177.9	-177.6	179.7	0	115.6
20	A	48.1	Very low	45.8	Very low	90 Å²	90	135.1 Å²	135.1	74%	0.744	84%	0.835	S	S	*	*			trans	82.9	136	160.5	0	0	0	0	0	115.6
21	T	47.5	Very low	45.6	Very low	128 Å²	128	133.5 Å²	133.5	79%	0.785	83%	0.829	S	S	*	*			cis	-160.7	146.8	15.5	-47.5	0	0	0	0	109.8
22	T	45.7	Very low	45.4	Very low	138 Å²	138	136.9 Å²	136.9	85%	0.847	84%	0.836	S	S	*	*			trans	-50.2	150.3	168.7	32.6	0	0	0	0	117
23	G	41.7	Very low	45.1	Very low	83 Å²	83	131.3 Å²	131.3	86%	0.856	83%	0.831	S	S	*	*			trans	159.5	86.2	155.7	0	0	0	0	0	114.9
24	S	46	Very low	45.2	Very low	135 Å²	135	137 Å²	137	94%	0.944	84%	0.84	S	S	*	*			trans	-83.4	144	-178.9	-175	0	0	0	0	112.7
25	G	38.2	Very low	44.5	Very low	80 Å²	80	137 Å²	137	83%	0.825	83%	0.834	S	S	*	*			trans	139.7	79.1	154.8	0	0	0	0	0	117.2
26	G	39.4	Very low	44.2	Very low	72 Å²	72	133.9 Å²	133.9	74%	0.742	83%	0.83	S	S	*	*			trans	-165.7	92.8	165	0	0	0	0	0	109.4
27	Q	50.5	Low	44	Very low	181 Å²	181	137.3 Å²	137.3	85%	0.846	83%	0.831	S	S	*	*				51.6	117.7	105.7	-75.2	-175.1	10.7	0	0	115.4
28	N	43.2	Very low	43.8	Very low	137 Å²	137	137 Å²	137	73%	0.733	83%	0.829	S	S	*	*			trans	86	93.5	152.9	-52.2	-18.2	0	0	0	117.5
29	N	44.4	Very low	44.4	Very low	155 Å²	155	134.7 Å²	134.7	83%	0.829	82%	0.824	S	S	*	*				-179.3	90.3	127	-89	-17.6	0	0	0	110.3	A31	N29-A31 PolarHBondContact O-N 3.22Å
30	L	44	Very low	45.2	Very low	190 Å²	190	130.5 Å²	130.5	100%	0.995	82%	0.816	S	S	*	*			trans	-89	82.7	159.5	-91.7	88.1	0	0	0	108.1
31	A	42	Very low	46.6	Very low	77 Å²	77	129.1 Å²	129.1	64%	0.636	80%	0.8	S	S	*	*			trans	-158.1	141.5	162.4	0	0	0	0	0	107.9	N29	N29-A31 PolarHBondContact O-N 3.22Å
32	T	39.9	Very low	48.4	Very low	137 Å²	137	131 Å²	131	84%	0.84	80%	0.799	S	S	*	*			trans	74.7	74.7	172.9	20	0	0	0	0	117.6
33	A	43	Very low	50.7	Low	104 Å²	104	125.8 Å²	125.8	86%	0.86	77%	0.766	S	S	*	*			trans	-115.4	63.8	153.1	0	0	0	0	0	109.5
34	Q	42.7	Very low	53.3	Low	186 Å²	186	123.1 Å²	123.1	87%	0.869	73%	0.732	S	S	*	*			trans	-136.4	62	168	-81.4	-171.6	-24.5	0	0	108.8
35	Q	39.6	Very low	55.7	Low	175 Å²	175	126.5 Å²	126.5	82%	0.818	73%	0.73	S	S	*	*			trans	-142.4	134.4	166	-72	-173.9	-13.6	0	0	109.1
36	Q	36.1	Very low	58.4	Low	170 Å²	170	128 Å²	128	79%	0.794	72%	0.715	S	S	*	*			trans	88.6	68.1	170.3	-63.7	166.7	-10.9	0	0	118.5
37	Q	43.4	Very low	61.2	Low	205 Å²	205	125 Å²	125	96%	0.958	68%	0.682	S	S	*	*			trans	-106.7	74.6	135.2	-83.2	-177.3	-6.8	0	0	108.4	G39	Q37-G39 PolarHBondContact O-N 3.36Å
38	S	42.4	Very low	63.4	Low	105 Å²	105	118.2 Å²	118.2	73%	0.734	65%	0.654	S	S	*	*			trans	-81.1	107.6	177.5	-28.6	0	0	0	0	108.9
39	G	67	Low	65.9	Low	74 Å²	74	112.2 Å²	112.2	76%	0.763	62%	0.622	S	S	*	*	S	Bend	trans	147.6	-12.4	160.4	0	0	0	0	0	118.7	Q37	Q37-G39 PolarHBondContact O-N 3.36Å
40	V	65.5	Low	68.3	Low	118 Å²	118	108.9 Å²	108.9	72%	0.715	62%	0.615	S	S	*	*	S	Bend	trans	-106.3	125	176.9	-174.8	0	0	0	0	109	Q42	V40-Q42 PolarHBondContact O-N 2.91Å
41	P	76	Confident	70.7	Confident	62 Å²	62	103.7 Å²	103.7	40%	0.403	59%	0.588	S	S	.	*			trans	-54.2	130.2	174.1	-23	32.3	0	0	0	110.1	Y52	P41-Y52 HydrophobicContact CB-CD2 3.74Å; P41-Y52 HydrophobicContact CB-CE2 3.61Å; P41-Y52 HydrophobicContact CB-CG 4.29Å; P41-Y52 HydrophobicContact CG-CD1 4.47Å; P41-Y52 HydrophobicContact CG-CD2 4.33Å; P41-Y52 HydrophobicContact CG-CE1 4.14Å; P41-Y52 HydrophobicContact CG-CE2 3.99Å
42	Q	85.9	Confident	73.2	Confident	167 Å²	167	103 Å²	103	78%	0.78	57%	0.57	S	S	*	*			trans	-70.6	140.1	173.2	-65.1	-171.3	3	0	0	108.8	V40 P132 G133	V40-Q42 PolarHBondContact O-N 2.91Å; Q42-P132 CarbonylContact O-C 3.58Å; Q42-G133 WeakPolarHBondContact O-CA 3.37Å; Q42-G133 PolarHBondContact O-N 3.39Å
43	L	94.3	Very high	75.8	Confident	29 Å²	29	105.5 Å²	105.5	15%	0.152	56%	0.564	C	S	.	*			trans	-104.7	132.6	173.2	-168	72.3	0	0	0	107.8	K45 L47 F49 Y52 W55 P132	L43-K45 PolarHBondContact O-N 3Å; L43-L47 HydrophobicContact CD1-CD1 3.42Å; L43-L47 VanDerWaalsContact CD1-CD1 3.42Å; L43-L47 HydrophobicContact CD2-CB 4.39Å; L43-L47 HydrophobicContact CD2-CD1 4.39Å; L43-L47 HydrophobicContact CG-CB 4.39Å; L43-L47 HydrophobicContact CG-CD1 3.74Å; L43-F49 HydrophobicContact CD2-CB 3.89Å; L43-Y52 HydrophobicContact CD1-CD2 4.45Å; L43-W55 HydrophobicContact CD1-CB 3.93Å; L43-W55 HydrophobicContact CD1-CG 3.86Å; L43-W55 HydrophobicContact CD2-CB 3.99Å; L43-P132 CarbonylContact C-O 3.22Å; L43-P132 WeakPolarHBondContact CA-O 3.5Å; L43-P132 HydrophobicContact CD1-CB 3.97Å
44	D	96.3	Very high	78.3	Confident	27 Å²	27	102.1 Å²	102.1	14%	0.144	53%	0.53	C	S	.	.			trans	-56.6	135	175.7	-167.3	-53.4	0	0	0	110	Q46 L47 P132 D134 V135	D44-Q46 PolarHBondContact O-N 2.91Å; D44-Q46 WeakPolarHBondContact OD1-CB 3.41Å; D44-Q46 WeakPolarHBondContact OD1-CG 3.46Å; D44-Q46 PolarHBondContact OD1-N 2.79Å; D44-L47 HydrophobicContact CB-CD1 4.34Å; D44-L47 HydrophobicContact CB-CG 4.47Å; D44-L47 WeakPolarHBondContact O-CB 3.41Å; D44-L47 PolarHBondContact O-N 2.93Å; D44-P132 PolarHBondContact N-O 3.1Å; D44-D134 WeakPolarHBondContact OD2-CA 3.4Å; D44-V135 HydrophobicContact CB-CG1 3.83Å; D44-V135 HydrophobicContact CB-CG2 4.19Å; D44-V135 PolarHBondContact OD2-N 3.27Å; D44-V135 VanDerWaalsContact OD2-N 3.15Å
45	K	94.9	Very high	80.9	Confident	206 Å²	206	93.3 Å²	93.3	90%	0.896	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-16.7	-177	-62.3	-179.5	-177	176.3	0	113.3	L43 L47	L43-K45 PolarHBondContact O-N 3Å; K45-L47 VanDerWaalsContact C-N 3.29Å
46	Q	96.2	Very high	83.5	Confident	110 Å²	110	89.9 Å²	89.9	51%	0.514	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-20.2	175.6	-65.5	-173.6	82	0	0	112.5	D44 V135 F209	D44-Q46 PolarHBondContact O-N 2.91Å; D44-Q46 WeakPolarHBondContact OD1-CB 3.41Å; D44-Q46 WeakPolarHBondContact OD1-CG 3.46Å; D44-Q46 PolarHBondContact OD1-N 2.79Å; Q46-V135 HydrophobicContact CB-CG2 3.93Å; Q46-F209 WeakPolarHBondContact O-CD2 3.33Å
47	L	97.4	Very high	86.4	Confident	9 Å²	9	84.1 Å²	84.1	5%	0.047	44%	0.444	C	S	.	.	S	Bend	trans	-68.7	145.7	175.6	-72.1	169.6	0	0	0	110.7	L43 D44 K45 F49 I128 V135 F209	L43-L47 HydrophobicContact CD1-CD1 3.42Å; L43-L47 VanDerWaalsContact CD1-CD1 3.42Å; L43-L47 HydrophobicContact CD2-CB 4.39Å; L43-L47 HydrophobicContact CD2-CD1 4.39Å; L43-L47 HydrophobicContact CG-CB 4.39Å; L43-L47 HydrophobicContact CG-CD1 3.74Å; D44-L47 HydrophobicContact CB-CD1 4.34Å; D44-L47 HydrophobicContact CB-CG 4.47Å; D44-L47 WeakPolarHBondContact O-CB 3.41Å; D44-L47 PolarHBondContact O-N 2.93Å; K45-L47 VanDerWaalsContact C-N 3.29Å; L47-F49 HydrophobicContact CB-CD2 4.26Å; L47-F49 PolarHBondContact O-N 2.84Å; L47-F49 VanDerWaalsContact O-N 3.09Å; L47-I128 HydrophobicContact CD1-CG2 3.7Å; L47-I128 HydrophobicContact CD2-CD1 3.69Å; L47-I128 HydrophobicContact CD2-CG1 4.2Å; L47-I128 HydrophobicContact CD2-CG2 4.28Å; L47-V135 HydrophobicContact CD1-CG1 3.75Å; L47-V135 HydrophobicContact CD2-CG1 3.88Å; L47-V135 HydrophobicContact CG-CG1 3.69Å; L47-F209 HydrophobicContact CD2-CE1 4.29Å; L47-F209 HydrophobicContact CD2-CE2 4.3Å; L47-F209 HydrophobicContact CD2-CZ 4.12Å
48	P	96.8	Very high	89	Confident	39 Å²	39	74.3 Å²	74.3	25%	0.253	40%	0.398	S	S	.	.	S	Bend	trans	-81.1	11.1	-173.1	37.4	-40.2	0	0	0	113.1	K205 F209	P48-K205 HydrophobicContact CB-CB 3.93Å; P48-K205 HydrophobicContact CG-CB 4.1Å; P48-K205 VanDerWaalsContact CG-O 3.29Å; P48-K205 WeakPolarHBondContact CG-O 3.45Å; P48-F209 HydrophobicContact CB-CB 4.45Å; P48-F209 HydrophobicContact CG-CB 3.86Å
49	F	97.1	Very high	91.6	Very high	12 Å²	12	70 Å²	70	5%	0.053	37%	0.366	C	S	.	.	S	Bend	trans	-103.7	138	-177.9	-52.5	-72.7	0	0	0	110.2	L43 L47 N51 E54 W55 F58 F206	L43-F49 HydrophobicContact CD2-CB 3.89Å; L47-F49 HydrophobicContact CB-CD2 4.26Å; L47-F49 PolarHBondContact O-N 2.84Å; L47-F49 VanDerWaalsContact O-N 3.09Å; F49-N51 VanDerWaalsContact C-N 3.27Å; F49-N51 PolarHBondContact O-N 3.01Å; F49-E54 HydrophobicContact CB-CB 4.15Å; F49-E54 HydrophobicContact CB-CG 4.22Å; F49-E54 HydrophobicContact CD1-CG 3.89Å; F49-W55 HydrophobicContact CB-CB 4.34Å; F49-W55 HydrophobicContact CD2-CB 4.1Å; F49-W55 HydrophobicContact CD2-CD2 4.48Å; F49-W55 AromaticContact CD2-CE3 3.73Å; F49-W55 HydrophobicContact CD2-CE3 3.73Å; F49-W55 HydrophobicContact CE2-CD2 4.42Å; F49-W55 AromaticContact CE2-CE3 3.31Å; F49-W55 HydrophobicContact CE2-CE3 3.31Å; F49-W55 AromaticContact CE2-CZ3 3.76Å; F49-W55 HydrophobicContact CE2-CZ3 3.76Å; F49-W55 HydrophobicContact CG-CB 4.25Å; F49-W55 AromaticContact CZ-CE3 3.93Å; F49-W55 HydrophobicContact CZ-CE3 3.93Å; F49-W55 HydrophobicContact CZ-CZ3 4.29Å; F49-F58 HydrophobicContact CE1-CB 3.77Å; F49-F58 HydrophobicContact CE1-CD1 4.28Å; F49-F58 HydrophobicContact CE1-CD2 4.46Å; F49-F58 AromaticContact CE1-CG 3.9Å; F49-F58 HydrophobicContact CE1-CG 3.9Å; F49-F58 HydrophobicContact CE2-CD1 4.3Å; F49-F58 HydrophobicContact CZ-CB 3.92Å; F49-F58 AromaticContact CZ-CD1 3.57Å; F49-F58 HydrophobicContact CZ-CD1 3.57Å; F49-F58 HydrophobicContact CZ-CD2 4.35Å; F49-F58 HydrophobicContact CZ-CE1 4.18Å; F49-F58 AromaticContact CZ-CG 3.66Å; F49-F58 HydrophobicContact CZ-CG 3.66Å; F49-F206 HydrophobicContact CE2-CD2 4.46Å; F49-F206 HydrophobicContact CZ-CB 4.06Å; F49-F206 HydrophobicContact CZ-CD2 4.42Å
50	A	93.8	Very high	93	Very high	84 Å²	84	68.4 Å²	68.4	69%	0.694	34%	0.34	S	S	*	.	S	Bend	trans	-67.9	-26.9	-174.7	0	0	0	0	0	113.3	E54	A50-E54 VanDerWaalsContact CB-OE2 3.27Å; A50-E54 WeakPolarHBondContact CB-OE2 3.42Å; A50-E54 PolarHBondContact N-OE2 3.45Å
51	N	93.7	Very high	94.5	Very high	81 Å²	81	64.2 Å²	64.2	43%	0.433	31%	0.312	S	S	.	.	S	Bend	trans	-163.2	169.6	-179.9	55	67.6	0	0	0	111.5	F49 R53 E54 W55	F49-N51 VanDerWaalsContact C-N 3.27Å; F49-N51 PolarHBondContact O-N 3.01Å; N51-R53 PolarHBondContact O-N 3.28Å; N51-R53 VanDerWaalsContact O-N 3.14Å; N51-R53 VanDerWaalsContact OD1-CB 3.29Å; N51-R53 WeakPolarHBondContact OD1-CB 3.36Å; N51-R53 PolarHBondContact OD1-N 2.74Å; N51-R53 VanDerWaalsContact OD1-N 3.09Å; N51-E54 PolarHBondContact O-N 3.25Å; N51-E54 PolarHBondContact OD1-N 3.15Å; N51-E54 VanDerWaalsContact OD1-N 3.11Å; N51-W55 PolarHBondContact O-N 2.77Å
52	Y	94.4	Very high	95.5	Very high	62 Å²	62	61.3 Å²	61.3	24%	0.243	29%	0.293	C	S	.	.	H	α-helix	trans	-55.4	-32	179.9	-170.7	-94.1	0	0	0	113.9	P41 L43 W55 Y56 P132	P41-Y52 HydrophobicContact CB-CD2 3.74Å; P41-Y52 HydrophobicContact CB-CE2 3.61Å; P41-Y52 HydrophobicContact CB-CG 4.29Å; P41-Y52 HydrophobicContact CG-CD1 4.47Å; P41-Y52 HydrophobicContact CG-CD2 4.33Å; P41-Y52 HydrophobicContact CG-CE1 4.14Å; P41-Y52 HydrophobicContact CG-CE2 3.99Å; L43-Y52 HydrophobicContact CD1-CD2 4.45Å; Y52-W55 PolarHBondContact O-N 3.01Å; Y52-Y56 HydrophobicContact CE1-CD2 4.47Å; Y52-Y56 VanDerWaalsContact O-CB 3.27Å; Y52-Y56 WeakPolarHBondContact O-CB 3.44Å; Y52-Y56 PolarHBondContact O-N 3.38Å; Y52-P132 HydrophobicContact CD2-CB 4.5Å; Y52-P132 HydrophobicContact CE2-CB 4.13Å; Y52-P132 HydrophobicContact CE2-CG 3.92Å
53	R	94.5	Very high	96	Very high	191 Å²	191	56.9 Å²	56.9	72%	0.721	27%	0.272	S	S	*	.	H	α-helix	trans	-68.6	-38.5	178.7	-178.7	-174.2	-64.3	-97.5	-0.9	111.6	N51 N57	N51-R53 PolarHBondContact O-N 3.28Å; N51-R53 VanDerWaalsContact O-N 3.14Å; N51-R53 VanDerWaalsContact OD1-CB 3.29Å; N51-R53 WeakPolarHBondContact OD1-CB 3.36Å; N51-R53 PolarHBondContact OD1-N 2.74Å; N51-R53 VanDerWaalsContact OD1-N 3.09Å; R53-N57 PolarHBondContact O-N 3.04Å; R53-N57 VanDerWaalsContact O-N 3.08Å; R53-N57 PolarHBondContact O-ND2 3.43Å
54	E	95.8	Very high	96.2	Very high	33 Å²	33	56.9 Å²	56.9	15%	0.154	27%	0.273	C	S	.	.	H	α-helix	trans	-65.2	-47.8	175.3	-169.4	-177.7	177.3	0	0	110.7	F49 A50 N51 Y56 N57 F58 K205	F49-E54 HydrophobicContact CB-CB 4.15Å; F49-E54 HydrophobicContact CB-CG 4.22Å; F49-E54 HydrophobicContact CD1-CG 3.89Å; A50-E54 VanDerWaalsContact CB-OE2 3.27Å; A50-E54 WeakPolarHBondContact CB-OE2 3.42Å; A50-E54 PolarHBondContact N-OE2 3.45Å; N51-E54 PolarHBondContact O-N 3.25Å; N51-E54 PolarHBondContact OD1-N 3.15Å; N51-E54 VanDerWaalsContact OD1-N 3.11Å; E54-Y56 PolarHBondContact O-N 2.83Å; E54-N57 PolarHBondContact O-N 2.8Å; E54-F58 PolarHBondContact O-N 3.39Å; E54-K205 IonicContact OE1-NZ 2.78Å; E54-K205 PolarHBondContact OE1-NZ 3.02Å
55	W	96.9	Very high	96.2	Very high	1 Å²	1	55.7 Å²	55.7	0%	0.004	27%	0.267	C	S	.	.	H	α-helix	trans	-54.3	-49.3	172.5	165.2	-120.8	0	0	0	112.5	L43 F49 N51 Y52 N57 F58 K59 I125 I128	L43-W55 HydrophobicContact CD1-CB 3.93Å; L43-W55 HydrophobicContact CD1-CG 3.86Å; L43-W55 HydrophobicContact CD2-CB 3.99Å; F49-W55 HydrophobicContact CB-CB 4.34Å; F49-W55 HydrophobicContact CD2-CB 4.1Å; F49-W55 HydrophobicContact CD2-CD2 4.48Å; F49-W55 AromaticContact CD2-CE3 3.73Å; F49-W55 HydrophobicContact CD2-CE3 3.73Å; F49-W55 HydrophobicContact CE2-CD2 4.42Å; F49-W55 AromaticContact CE2-CE3 3.31Å; F49-W55 HydrophobicContact CE2-CE3 3.31Å; F49-W55 AromaticContact CE2-CZ3 3.76Å; F49-W55 HydrophobicContact CE2-CZ3 3.76Å; F49-W55 HydrophobicContact CG-CB 4.25Å; F49-W55 AromaticContact CZ-CE3 3.93Å; F49-W55 HydrophobicContact CZ-CE3 3.93Å; F49-W55 HydrophobicContact CZ-CZ3 4.29Å; N51-W55 PolarHBondContact O-N 2.77Å; Y52-W55 PolarHBondContact O-N 3.01Å; W55-N57 VanDerWaalsContact C-N 3.28Å; W55-N57 PolarHBondContact O-N 3.37Å; W55-F58 AromaticContact CE3-CD1 3.86Å; W55-F58 HydrophobicContact CE3-CD1 3.86Å; W55-F58 AromaticContact CZ3-CD1 3.58Å; W55-F58 HydrophobicContact CZ3-CD1 3.58Å; W55-F58 AromaticContact CZ3-CE1 3.9Å; W55-F58 HydrophobicContact CZ3-CE1 3.9Å; W55-F58 WeakPolarHBondContact O-CB 3.46Å; W55-F58 PolarHBondContact O-N 2.85Å; W55-K59 PolarHBondContact O-N 2.82Å; W55-I125 HydrophobicContact CH2-CB 4.38Å; W55-I125 HydrophobicContact CH2-CG1 4.31Å; W55-I125 HydrophobicContact CH2-CG2 4.02Å; W55-I128 HydrophobicContact CD2-CG2 4.28Å; W55-I128 HydrophobicContact CH2-CB 3.75Å; W55-I128 HydrophobicContact CH2-CD1 4.11Å; W55-I128 HydrophobicContact CH2-CG2 3.58Å; W55-I128 HydrophobicContact CZ2-CB 3.69Å; W55-I128 HydrophobicContact CZ2-CG2 3.28Å; W55-I128 HydrophobicContact CZ3-CD1 4.42Å; W55-I128 HydrophobicContact CZ3-CG2 4.2Å
56	Y	95.6	Very high	96.3	Very high	102 Å²	102	48.9 Å²	48.9	40%	0.4	24%	0.238	S	C	.	.	H	α-helix	trans	-60.5	-37.5	-179.9	-177.9	-96.4	0	0	0	112.6	Y52 E54 N60	Y52-Y56 HydrophobicContact CE1-CD2 4.47Å; Y52-Y56 VanDerWaalsContact O-CB 3.27Å; Y52-Y56 WeakPolarHBondContact O-CB 3.44Å; Y52-Y56 PolarHBondContact O-N 3.38Å; E54-Y56 PolarHBondContact O-N 2.83Å; Y56-N60 WeakPolarHBondContact CD1-ND2 3.22Å; Y56-N60 WeakPolarHBondContact CE1-ND2 3.28Å; Y56-N60 PolarHBondContact O-N 2.94Å; Y56-N60 VanDerWaalsContact O-N 3.08Å; Y56-N60 PolarHBondContact O-ND2 2.87Å
57	N	95.7	Very high	96.4	Very high	49 Å²	49	53.7 Å²	53.7	26%	0.262	25%	0.251	S	S	.	.	H	α-helix	trans	-67	-45.6	175.5	-70.7	-33.3	0	0	0	111.7	R53 E54 W55 K59 N60 F61	R53-N57 PolarHBondContact O-N 3.04Å; R53-N57 VanDerWaalsContact O-N 3.08Å; R53-N57 PolarHBondContact O-ND2 3.43Å; E54-N57 PolarHBondContact O-N 2.8Å; W55-N57 VanDerWaalsContact C-N 3.28Å; W55-N57 PolarHBondContact O-N 3.37Å; N57-K59 VanDerWaalsContact C-N 3.33Å; N57-K59 PolarHBondContact O-N 3.02Å; N57-N60 PolarHBondContact O-N 3.07Å; N57-N60 VanDerWaalsContact O-N 3.13Å; N57-F61 VanDerWaalsContact O-CD2 3.24Å; N57-F61 WeakPolarHBondContact O-CD2 3.25Å; N57-F61 PolarHBondContact O-N 2.99Å
58	F	97.9	Very high	96.3	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-55.1	-50.1	174.5	170.6	-105.2	0	0	0	111.1	F49 E54 W55 N60 F61 W62 I125 F203 F206	F49-F58 HydrophobicContact CE1-CB 3.77Å; F49-F58 HydrophobicContact CE1-CD1 4.28Å; F49-F58 HydrophobicContact CE1-CD2 4.46Å; F49-F58 AromaticContact CE1-CG 3.9Å; F49-F58 HydrophobicContact CE1-CG 3.9Å; F49-F58 HydrophobicContact CE2-CD1 4.3Å; F49-F58 HydrophobicContact CZ-CB 3.92Å; F49-F58 AromaticContact CZ-CD1 3.57Å; F49-F58 HydrophobicContact CZ-CD1 3.57Å; F49-F58 HydrophobicContact CZ-CD2 4.35Å; F49-F58 HydrophobicContact CZ-CE1 4.18Å; F49-F58 AromaticContact CZ-CG 3.66Å; F49-F58 HydrophobicContact CZ-CG 3.66Å; E54-F58 PolarHBondContact O-N 3.39Å; W55-F58 AromaticContact CE3-CD1 3.86Å; W55-F58 HydrophobicContact CE3-CD1 3.86Å; W55-F58 AromaticContact CZ3-CD1 3.58Å; W55-F58 HydrophobicContact CZ3-CD1 3.58Å; W55-F58 AromaticContact CZ3-CE1 3.9Å; W55-F58 HydrophobicContact CZ3-CE1 3.9Å; W55-F58 WeakPolarHBondContact O-CB 3.46Å; W55-F58 PolarHBondContact O-N 2.85Å; F58-N60 VanDerWaalsContact C-N 3.26Å; F58-N60 PolarHBondContact O-N 3.43Å; F58-F61 WeakPolarHBondContact O-CB 3.47Å; F58-F61 PolarHBondContact O-N 3.43Å; F58-W62 HydrophobicContact CZ-CE3 4.26Å; F58-W62 PolarHBondContact O-N 2.85Å; F58-I125 HydrophobicContact CE1-CD1 3.63Å; F58-I125 HydrophobicContact CE1-CG1 4Å; F58-I125 HydrophobicContact CZ-CD1 3.83Å; F58-F203 HydrophobicContact CD2-CD2 4.08Å; F58-F203 HydrophobicContact CD2-CE2 4.24Å; F58-F203 HydrophobicContact CE2-CD1 4.2Å; F58-F203 AromaticContact CE2-CD2 3.83Å; F58-F203 HydrophobicContact CE2-CD2 3.83Å; F58-F203 HydrophobicContact CE2-CE1 4.35Å; F58-F203 HydrophobicContact CE2-CE2 4.01Å; F58-F203 AromaticContact CE2-CG 3.93Å; F58-F203 HydrophobicContact CE2-CG 3.93Å; F58-F203 HydrophobicContact CE2-CZ 4.26Å; F58-F206 HydrophobicContact CE1-CB 4.05Å; F58-F206 AromaticContact CE1-CD1 3.93Å; F58-F206 HydrophobicContact CE1-CD1 3.93Å; F58-F206 AromaticContact CE1-CD2 3.92Å; F58-F206 HydrophobicContact CE1-CD2 3.92Å; F58-F206 HydrophobicContact CE1-CE1 4.4Å; F58-F206 HydrophobicContact CE1-CE2 4.42Å; F58-F206 AromaticContact CE1-CG 3.67Å; F58-F206 HydrophobicContact CE1-CG 3.67Å; F58-F206 HydrophobicContact CE2-CB 3.98Å; F58-F206 HydrophobicContact CE2-CD1 4.36Å; F58-F206 HydrophobicContact CE2-CG 4.29Å; F58-F206 HydrophobicContact CZ-CB 3.64Å; F58-F206 AromaticContact CZ-CD1 3.41Å; F58-F206 HydrophobicContact CZ-CD1 3.41Å; F58-F206 VanDerWaalsContact CZ-CD1 3.41Å; F58-F206 HydrophobicContact CZ-CD2 4.19Å; F58-F206 HydrophobicContact CZ-CE1 4.12Å; F58-F206 AromaticContact CZ-CG 3.45Å; F58-F206 HydrophobicContact CZ-CG 3.45Å; F58-F206 VanDerWaalsContact CZ-CG 3.45Å
59	K	96.8	Very high	96.3	Very high	13 Å²	13	57.6 Å²	57.6	6%	0.057	27%	0.267	C	S	.	.	H	α-helix	trans	-55	-40.1	175.7	-175.3	179.1	67.7	168.1	0	112.9	W55 N57 F61 W62 K63 E129	W55-K59 PolarHBondContact O-N 2.82Å; N57-K59 VanDerWaalsContact C-N 3.33Å; N57-K59 PolarHBondContact O-N 3.02Å; K59-F61 VanDerWaalsContact C-N 3.3Å; K59-F61 PolarHBondContact O-N 3.35Å; K59-W62 WeakPolarHBondContact O-CB 3.48Å; K59-W62 PolarHBondContact O-N 3.26Å; K59-K63 PolarHBondContact O-N 3.36Å; K59-E129 HydrophobicContact CD-CB 4.28Å; K59-E129 VanDerWaalsContact CD-CD 3.46Å; K59-E129 HydrophobicContact CD-CG 4.01Å; K59-E129 WeakPolarHBondContact CD-OE1 3.29Å; K59-E129 WeakPolarHBondContact CE-OE1 3.15Å; K59-E129 IonicContact NZ-OE1 3.91Å; K59-E129 PolarHBondContact NZ-OE1 3.01Å
60	N	96.5	Very high	96.3	Very high	41 Å²	41	61.3 Å²	61.3	22%	0.219	29%	0.288	C	S	.	.	H	α-helix	trans	-68.4	-26.8	177.7	-75.9	-30.3	0	0	0	113.7	Y56 N57 F58	Y56-N60 WeakPolarHBondContact CD1-ND2 3.22Å; Y56-N60 WeakPolarHBondContact CE1-ND2 3.28Å; Y56-N60 PolarHBondContact O-N 2.94Å; Y56-N60 VanDerWaalsContact O-N 3.08Å; Y56-N60 PolarHBondContact O-ND2 2.87Å; N57-N60 PolarHBondContact O-N 3.07Å; N57-N60 VanDerWaalsContact O-N 3.13Å; F58-N60 VanDerWaalsContact C-N 3.26Å; F58-N60 PolarHBondContact O-N 3.43Å
61	F	97	Very high	96.4	Very high	30 Å²	30	61 Å²	61	13%	0.132	27%	0.274	C	S	.	.	H	α-helix	trans	-70.9	-45.9	168	-62.1	-57.6	0	0	0	110.3	N57 F58 K59 K63 T64 L191 C199 F203	N57-F61 VanDerWaalsContact O-CD2 3.24Å; N57-F61 WeakPolarHBondContact O-CD2 3.25Å; N57-F61 PolarHBondContact O-N 2.99Å; F58-F61 WeakPolarHBondContact O-CB 3.47Å; F58-F61 PolarHBondContact O-N 3.43Å; K59-F61 VanDerWaalsContact C-N 3.3Å; K59-F61 PolarHBondContact O-N 3.35Å; F61-K63 PolarHBondContact O-N 2.99Å; F61-T64 WeakPolarHBondContact O-CB 3.48Å; F61-T64 PolarHBondContact O-N 3.35Å; F61-T64 PolarHBondContact O-OG1 3.18Å; F61-T64 VanDerWaalsContact O-OG1 3.14Å; F61-L191 HydrophobicContact CB-CD1 4.05Å; F61-L191 HydrophobicContact CB-CD2 4.29Å; F61-L191 HydrophobicContact CD1-CD2 4.47Å; F61-C199 HydrophobicContact CD2-CB 4.24Å; F61-C199 HydrophobicContact CE1-CB 4.4Å; F61-C199 HydrophobicContact CE2-CB 3.94Å; F61-C199 HydrophobicContact CZ-CB 4.03Å; F61-F203 HydrophobicContact CB-CE2 3.74Å; F61-F203 HydrophobicContact CB-CZ 4.22Å; F61-F203 HydrophobicContact CG-CE2 4.49Å
62	W	98.1	Very high	96.7	Very high	1 Å²	1	57.1 Å²	57.1	0%	0.004	25%	0.254	C	S	.	.	H	α-helix	trans	-57.6	-31.9	179.3	-164.9	-103.5	0	0	0	113.8	F58 K59 T64 V65 Q66 L118 F121 D122 I125 F183 M186 F203	F58-W62 HydrophobicContact CZ-CE3 4.26Å; F58-W62 PolarHBondContact O-N 2.85Å; K59-W62 WeakPolarHBondContact O-CB 3.48Å; K59-W62 PolarHBondContact O-N 3.26Å; W62-T64 PolarHBondContact O-N 2.85Å; W62-V65 HydrophobicContact CD2-CB 4.14Å; W62-V65 HydrophobicContact CD2-CG1 4.43Å; W62-V65 HydrophobicContact CD2-CG2 4.28Å; W62-V65 HydrophobicContact CE3-CB 4.25Å; W62-V65 HydrophobicContact CE3-CG1 4.44Å; W62-V65 HydrophobicContact CE3-CG2 3.94Å; W62-V65 HydrophobicContact CH2-CG1 4.09Å; W62-V65 HydrophobicContact CZ2-CG1 4.08Å; W62-V65 HydrophobicContact CZ3-CG1 4.28Å; W62-V65 HydrophobicContact CZ3-CG2 4.24Å; W62-V65 WeakPolarHBondContact O-CA 3.25Å; W62-V65 VanDerWaalsContact O-CB 3.26Å; W62-V65 WeakPolarHBondContact O-CB 3.49Å; W62-V65 PolarHBondContact O-N 3.46Å; W62-Q66 PolarHBondContact O-N 3.14Å; W62-L118 HydrophobicContact CH2-CD1 3.83Å; W62-L118 HydrophobicContact CZ2-CD1 4.09Å; W62-F121 HydrophobicContact CH2-CB 3.72Å; W62-F121 HydrophobicContact CZ2-CB 3.87Å; W62-D122 HydrophobicContact CZ2-CB 4.46Å; W62-D122 PolarHBondContact NE1-OD1 3.21Å; W62-D122 VanDerWaalsContact NE1-OD1 3.12Å; W62-I125 HydrophobicContact CB-CD1 4.23Å; W62-I125 HydrophobicContact CD2-CD1 3.23Å; W62-I125 HydrophobicContact CE3-CD1 3.72Å; W62-I125 HydrophobicContact CG-CD1 3.44Å; W62-I125 VanDerWaalsContact CG-CD1 3.44Å; W62-I125 HydrophobicContact CG-CG2 4.37Å; W62-I125 HydrophobicContact CH2-CD1 4.34Å; W62-I125 HydrophobicContact CZ2-CD1 3.92Å; W62-I125 HydrophobicContact CZ3-CD1 4.25Å; W62-F183 AromaticContact CH2-CE2 3.78Å; W62-F183 HydrophobicContact CH2-CE2 3.78Å; W62-F183 HydrophobicContact CH2-CZ 4.25Å; W62-F183 AromaticContact CZ3-CE2 3.69Å; W62-F183 HydrophobicContact CZ3-CE2 3.69Å; W62-F183 AromaticContact CZ3-CZ 3.73Å; W62-F183 HydrophobicContact CZ3-CZ 3.73Å; W62-M186 HydrophobicContact CZ3-CE 4.43Å; W62-F203 AromaticContact CE3-CE1 3.72Å; W62-F203 HydrophobicContact CE3-CE1 3.72Å; W62-F203 HydrophobicContact CE3-CZ 4.08Å; W62-F203 HydrophobicContact CZ3-CD1 4.47Å; W62-F203 AromaticContact CZ3-CE1 3.78Å; W62-F203 HydrophobicContact CZ3-CE1 3.78Å
63	K	97.2	Very high	96.9	Very high	75 Å²	75	54.1 Å²	54.1	33%	0.326	24%	0.242	S	C	.	.	H	α-helix	trans	-53.7	-27.7	172	-76.2	-179.9	177.4	173.1	0	114.1	K59 F61 R67	K59-K63 PolarHBondContact O-N 3.36Å; F61-K63 PolarHBondContact O-N 2.99Å; K63-R67 VanDerWaalsContact O-CG 3.27Å; K63-R67 WeakPolarHBondContact O-CG 3.22Å; K63-R67 PolarHBondContact O-N 3.1Å
64	T	97.1	Very high	97	Very high	29 Å²	29	46.4 Å²	46.4	18%	0.178	21%	0.214	C	C	.	.	H	α-helix	trans	-74	-39.3	175.2	-40.7	0	0	0	0	110.9	F61 W62 R67 N68 V190 L191 R194	F61-T64 WeakPolarHBondContact O-CB 3.48Å; F61-T64 PolarHBondContact O-N 3.35Å; F61-T64 PolarHBondContact O-OG1 3.18Å; F61-T64 VanDerWaalsContact O-OG1 3.14Å; W62-T64 PolarHBondContact O-N 2.85Å; T64-R67 PolarHBondContact O-N 3.19Å; T64-N68 PolarHBondContact O-N 3.24Å; T64-N68 PolarHBondContact O-ND2 2.85Å; T64-V190 HydrophobicContact CG2-CG2 4.18Å; T64-L191 HydrophobicContact CG2-CD2 4.13Å; T64-R194 PolarHBondContact OG1-NH1 3.18Å
65	V	97.6	Very high	97.1	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.012	21%	0.208	C	C	.	.	H	α-helix	trans	-60.6	-49.9	172.8	-177.1	0	0	0	0	109.6	W62 R67 N68 K69 C72 L118 M186 V190 F203	W62-V65 HydrophobicContact CD2-CB 4.14Å; W62-V65 HydrophobicContact CD2-CG1 4.43Å; W62-V65 HydrophobicContact CD2-CG2 4.28Å; W62-V65 HydrophobicContact CE3-CB 4.25Å; W62-V65 HydrophobicContact CE3-CG1 4.44Å; W62-V65 HydrophobicContact CE3-CG2 3.94Å; W62-V65 HydrophobicContact CH2-CG1 4.09Å; W62-V65 HydrophobicContact CZ2-CG1 4.08Å; W62-V65 HydrophobicContact CZ3-CG1 4.28Å; W62-V65 HydrophobicContact CZ3-CG2 4.24Å; W62-V65 WeakPolarHBondContact O-CA 3.25Å; W62-V65 VanDerWaalsContact O-CB 3.26Å; W62-V65 WeakPolarHBondContact O-CB 3.49Å; W62-V65 PolarHBondContact O-N 3.46Å; V65-R67 VanDerWaalsContact C-N 3.31Å; V65-R67 PolarHBondContact O-N 3Å; V65-N68 CarbonylContact O-C 3.6Å; V65-N68 VanDerWaalsContact O-C 3.22Å; V65-N68 WeakPolarHBondContact O-CA 3.43Å; V65-N68 PolarHBondContact O-N 3.33Å; V65-K69 WeakPolarHBondContact O-CA 3.44Å; V65-K69 PolarHBondContact O-N 3.07Å; V65-C72 HydrophobicContact CG1-CB 3.85Å; V65-L118 HydrophobicContact CG1-CD1 4.36Å; V65-L118 HydrophobicContact CG1-CD2 4.29Å; V65-M186 HydrophobicContact CG1-CE 4.17Å; V65-M186 HydrophobicContact CG1-SD 3.98Å; V65-M186 HydrophobicContact CG2-CE 4.49Å; V65-M186 HydrophobicContact CG2-SD 4.05Å; V65-V190 HydrophobicContact CG2-CG1 4.01Å; V65-F203 HydrophobicContact CG2-CE1 4.45Å; V65-F203 HydrophobicContact CG2-CZ 4.39Å
66	Q	96.8	Very high	97.2	Very high	63 Å²	63	45.1 Å²	45.1	29%	0.294	21%	0.208	S	C	.	.	H	α-helix	trans	-58.9	-37.9	-179.6	-70.9	-178.7	-44.8	0	0	113.6	W62 N68 K69 D122	W62-Q66 PolarHBondContact O-N 3.14Å; Q66-N68 PolarHBondContact O-N 2.91Å; Q66-K69 PolarHBondContact O-N 3.41Å; Q66-D122 WeakPolarHBondContact CG-OD1 3.35Å; Q66-D122 PolarHBondContact NE2-OD1 3.02Å
67	R	97.3	Very high	97.3	Very high	210 Å²	210	40.3 Å²	40.3	79%	0.792	19%	0.189	S	C	*	.	H	α-helix	trans	-67.2	-20.7	176.5	-73.6	173.2	-168.9	-149.8	1.5	113.5	K63 T64 V65	K63-R67 VanDerWaalsContact O-CG 3.27Å; K63-R67 WeakPolarHBondContact O-CG 3.22Å; K63-R67 PolarHBondContact O-N 3.1Å; T64-R67 PolarHBondContact O-N 3.19Å; V65-R67 VanDerWaalsContact C-N 3.31Å; V65-R67 PolarHBondContact O-N 3Å
68	N	96.5	Very high	97.4	Very high	73 Å²	73	38 Å²	38	39%	0.39	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-122.4	29.6	-177	-59.4	-81.4	0	0	0	110.9	T64 V65 Q66 D70 N71 C72 V190	T64-N68 PolarHBondContact O-N 3.24Å; T64-N68 PolarHBondContact O-ND2 2.85Å; V65-N68 CarbonylContact O-C 3.6Å; V65-N68 VanDerWaalsContact O-C 3.22Å; V65-N68 WeakPolarHBondContact O-CA 3.43Å; V65-N68 PolarHBondContact O-N 3.33Å; Q66-N68 PolarHBondContact O-N 2.91Å; N68-D70 PolarHBondContact O-N 3.33Å; N68-N71 PolarHBondContact O-N 3.16Å; N68-N71 VanDerWaalsContact O-N 3.08Å; N68-C72 PolarHBondContact O-N 3.47Å; N68-C72 PolarHBondContact O-SG 2.91Å; N68-V190 HydrophobicContact CB-CG2 4.27Å
69	K	96.7	Very high	97.4	Very high	57 Å²	57	39.8 Å²	39.8	25%	0.248	18%	0.184	C	C	.	.	H	α-helix	trans	-48.2	-54.9	-165.6	-176.8	171.3	178.8	163.2	0	113.3	V65 Q66 N71 C72 A73 L118 D119 D122	V65-K69 WeakPolarHBondContact O-CA 3.44Å; V65-K69 PolarHBondContact O-N 3.07Å; Q66-K69 PolarHBondContact O-N 3.41Å; K69-N71 VanDerWaalsContact C-N 3.32Å; K69-N71 PolarHBondContact O-N 3.35Å; K69-C72 PolarHBondContact O-N 3.49Å; K69-A73 WeakPolarHBondContact O-CB 3.48Å; K69-A73 PolarHBondContact O-N 3.18Å; K69-L118 HydrophobicContact CG-CD2 4.06Å; K69-L118 WeakPolarHBondContact O-CD2 3.47Å; K69-D119 WeakPolarHBondContact CE-OD1 3.39Å; K69-D119 IonicContact NZ-OD1 2.79Å; K69-D119 PolarHBondContact NZ-OD1 3.08Å; K69-D122 IonicContact NZ-OD2 3.38Å; K69-D122 PolarHBondContact NZ-OD2 2.82Å
70	D	96.3	Very high	97.3	Very high	90 Å²	90	39.3 Å²	39.3	48%	0.481	18%	0.182	S	C	.	.	H	α-helix	trans	-62.2	-39.7	-176	-54.6	-26.4	0	0	0	112.2	N68 K74	N68-D70 PolarHBondContact O-N 3.33Å; D70-K74 WeakPolarHBondContact O-CG 3.38Å; D70-K74 PolarHBondContact O-N 2.99Å
71	N	97.2	Very high	97.2	Very high	77 Å²	77	37.3 Å²	37.3	41%	0.412	17%	0.172	S	C	.	.	H	α-helix	trans	-70	-42.3	176.7	-172.5	66.6	0	0	0	111.5	N68 K69 K74 L75	N68-N71 PolarHBondContact O-N 3.16Å; N68-N71 VanDerWaalsContact O-N 3.08Å; K69-N71 VanDerWaalsContact C-N 3.32Å; K69-N71 PolarHBondContact O-N 3.35Å; N71-K74 PolarHBondContact O-N 3.17Å; N71-L75 WeakPolarHBondContact O-CB 3.49Å; N71-L75 PolarHBondContact O-N 3.43Å
72	C	98.3	Very high	97.1	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-63	-42	176.6	-74.8	0	0	0	0	112.1	V65 N68 K69 L75 M76 L118 M186	V65-C72 HydrophobicContact CG1-CB 3.85Å; N68-C72 PolarHBondContact O-N 3.47Å; N68-C72 PolarHBondContact O-SG 2.91Å; K69-C72 PolarHBondContact O-N 3.49Å; C72-L75 PolarHBondContact O-N 2.94Å; C72-M76 WeakPolarHBondContact O-CB 3.29Å; C72-M76 PolarHBondContact O-N 3.04Å; C72-L118 HydrophobicContact CB-CD2 3.95Å; C72-M186 HydrophobicContact CB-CG 3.85Å; C72-M186 HydrophobicContact CB-SD 3.85Å; C72-M186 VanDerWaalsContact O-CG 3.3Å; C72-M186 WeakPolarHBondContact O-CG 3.19Å
73	A	98.5	Very high	96.9	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-58.5	-54.2	177.7	0	0	0	0	0	109.8	K69 L75 M76 F77 A114 L118	K69-A73 WeakPolarHBondContact O-CB 3.48Å; K69-A73 PolarHBondContact O-N 3.18Å; A73-L75 VanDerWaalsContact C-N 3.33Å; A73-L75 PolarHBondContact O-N 3.1Å; A73-M76 PolarHBondContact O-N 3.32Å; A73-F77 WeakPolarHBondContact O-CB 3.49Å; A73-F77 PolarHBondContact O-N 3.27Å; A73-A114 HydrophobicContact CB-CB 4.19Å; A73-L118 HydrophobicContact CB-CB 3.9Å; A73-L118 HydrophobicContact CB-CD2 3.8Å; A73-L118 HydrophobicContact CB-CG 4.5Å
74	K	98.2	Very high	96.5	Very high	28 Å²	28	40.8 Å²	40.8	12%	0.122	19%	0.19	C	C	.	.	H	α-helix	trans	-58.9	-43.8	178.1	-72.4	-169.9	-76.6	-160.8	0	112.1	D70 N71 F77 F78 F105 F110 E111 A114	D70-K74 WeakPolarHBondContact O-CG 3.38Å; D70-K74 PolarHBondContact O-N 2.99Å; N71-K74 PolarHBondContact O-N 3.17Å; K74-F77 PolarHBondContact O-N 3.27Å; K74-F78 WeakPolarHBondContact O-CB 3.22Å; K74-F78 PolarHBondContact O-N 3.35Å; K74-F105 HydrophobicContact CB-CD1 4.23Å; K74-F105 HydrophobicContact CB-CD2 4.17Å; K74-F105 HydrophobicContact CB-CE1 3.98Å; K74-F105 HydrophobicContact CB-CE2 3.91Å; K74-F105 HydrophobicContact CB-CG 4.33Å; K74-F105 HydrophobicContact CB-CZ 3.82Å; K74-F105 HydrophobicContact CD-CB 4.43Å; K74-F105 HydrophobicContact CD-CD1 4.39Å; K74-F105 HydrophobicContact CD-CG 4.26Å; K74-F105 PolarHBondContact NZ-O 3.49Å; K74-F110 HydrophobicContact CB-CE1 4.15Å; K74-F110 HydrophobicContact CG-CD1 4.28Å; K74-F110 HydrophobicContact CG-CE1 4.21Å; K74-E111 HydrophobicContact CD-CB 4.15Å; K74-E111 HydrophobicContact CD-CG 4.16Å; K74-E111 HydrophobicContact CG-CB 4.47Å; K74-E111 HydrophobicContact CG-CG 4.42Å; K74-E111 IonicContact NZ-OE2 3.11Å; K74-E111 PolarHBondContact NZ-OE2 2.91Å; K74-A114 HydrophobicContact CG-CB 4.33Å
75	L	97.9	Very high	96.1	Very high	8 Å²	8	43.7 Å²	43.7	4%	0.042	21%	0.209	C	C	.	.	H	α-helix	trans	-63.7	-46.7	180	-174.8	60.4	0	0	0	113.1	N71 C72 A73 F78 K79 F105 M186 Q189	N71-L75 WeakPolarHBondContact O-CB 3.49Å; N71-L75 PolarHBondContact O-N 3.43Å; C72-L75 PolarHBondContact O-N 2.94Å; A73-L75 VanDerWaalsContact C-N 3.33Å; A73-L75 PolarHBondContact O-N 3.1Å; L75-F78 PolarHBondContact O-N 2.87Å; L75-K79 HydrophobicContact CD1-CG 4.34Å; L75-K79 WeakPolarHBondContact O-CG 3.46Å; L75-K79 PolarHBondContact O-N 3.45Å; L75-F105 HydrophobicContact CB-CZ 4.25Å; L75-F105 HydrophobicContact CD1-CZ 4.36Å; L75-M186 HydrophobicContact CB-CG 4.5Å; L75-M186 HydrophobicContact CD2-CB 4.44Å; L75-M186 HydrophobicContact CD2-CG 4.49Å; L75-M186 HydrophobicContact CG-CB 4.4Å; L75-Q189 HydrophobicContact CD2-CB 3.66Å; L75-Q189 HydrophobicContact CD2-CG 4.28Å
76	M	98.4	Very high	95.5	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-59	-50.6	177.3	175.1	-178.2	74.4	0	0	110.8	C72 A73 Y80 L118 F121 F183 M186	C72-M76 WeakPolarHBondContact O-CB 3.29Å; C72-M76 PolarHBondContact O-N 3.04Å; A73-M76 PolarHBondContact O-N 3.32Å; M76-Y80 WeakPolarHBondContact O-CB 3.23Å; M76-Y80 PolarHBondContact O-N 3.43Å; M76-L118 HydrophobicContact CE-CB 4.07Å; M76-L118 HydrophobicContact CE-CD1 4.27Å; M76-L118 HydrophobicContact SD-CD1 4.27Å; M76-F121 HydrophobicContact SD-CE2 4.28Å; M76-F183 HydrophobicContact CG-CB 4.38Å; M76-F183 HydrophobicContact SD-CB 4.17Å; M76-F183 HydrophobicContact SD-CD2 3.76Å; M76-F183 HydrophobicContact SD-CG 4.47Å; M76-M186 HydrophobicContact CB-CB 3.79Å; M76-M186 HydrophobicContact CB-CG 4.09Å
77	F	97.5	Very high	95	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-70.1	-35.8	-176.3	-166.1	-125.7	0	0	0	112	A73 K74 Y80 L81 Y91 L94 F110 L113 A114 Y117	A73-F77 WeakPolarHBondContact O-CB 3.49Å; A73-F77 PolarHBondContact O-N 3.27Å; K74-F77 PolarHBondContact O-N 3.27Å; F77-Y80 AromaticContact CD2-CD1 3.99Å; F77-Y80 HydrophobicContact CD2-CD1 3.99Å; F77-Y80 HydrophobicContact CE2-CD1 4.08Å; F77-Y80 HydrophobicContact CE2-CE1 4.37Å; F77-Y80 PolarHBondContact O-N 3.08Å; F77-L81 HydrophobicContact CD1-CD1 4.11Å; F77-L81 HydrophobicContact CE1-CD1 3.58Å; F77-L81 HydrophobicContact CE1-CG 4.49Å; F77-L81 HydrophobicContact CE2-CD1 4.09Å; F77-L81 HydrophobicContact CE2-CD2 4.48Å; F77-L81 HydrophobicContact CE2-CG 4.24Å; F77-L81 HydrophobicContact CZ-CD1 3.57Å; F77-L81 HydrophobicContact CZ-CG 4.22Å; F77-L81 WeakPolarHBondContact O-CG 3.45Å; F77-L81 PolarHBondContact O-N 3.49Å; F77-Y91 HydrophobicContact CE2-CE1 4Å; F77-Y91 AromaticContact CE2-CZ 3.93Å; F77-Y91 HydrophobicContact CZ-CD1 4.04Å; F77-Y91 AromaticContact CZ-CE1 3.7Å; F77-Y91 HydrophobicContact CZ-CE1 3.7Å; F77-Y91 HydrophobicContact CZ-CE2 4.4Å; F77-Y91 AromaticContact CZ-CZ 3.9Å; F77-L94 HydrophobicContact CE1-CD1 3.68Å; F77-L94 HydrophobicContact CZ-CD1 4.21Å; F77-F110 HydrophobicContact CB-CZ 4.16Å; F77-F110 AromaticContact CD1-CD2 3.92Å; F77-F110 HydrophobicContact CD1-CD2 3.92Å; F77-F110 HydrophobicContact CD1-CE1 4.11Å; F77-F110 AromaticContact CD1-CE2 3.48Å; F77-F110 HydrophobicContact CD1-CE2 3.48Å; F77-F110 VanDerWaalsContact CD1-CE2 3.48Å; F77-F110 HydrophobicContact CD1-CG 4.43Å; F77-F110 AromaticContact CD1-CZ 3.57Å; F77-F110 HydrophobicContact CD1-CZ 3.57Å; F77-F110 HydrophobicContact CE1-CD2 4.04Å; F77-F110 AromaticContact CE1-CE2 3.9Å; F77-F110 HydrophobicContact CE1-CE2 3.9Å; F77-F110 HydrophobicContact CE1-CZ 4.43Å; F77-F110 HydrophobicContact CG-CE2 4.45Å; F77-F110 HydrophobicContact CG-CZ 4.26Å; F77-L113 HydrophobicContact CE1-CB 3.86Å; F77-L113 HydrophobicContact CZ-CB 4.13Å; F77-A114 HydrophobicContact CB-CB 3.68Å; F77-A114 HydrophobicContact CD1-CB 3.9Å; F77-A114 HydrophobicContact CG-CB 4.06Å; F77-Y117 HydrophobicContact CD2-CD1 4.31Å; F77-Y117 HydrophobicContact CD2-CD2 4.44Å; F77-Y117 HydrophobicContact CD2-CE1 4.49Å; F77-Y117 HydrophobicContact CD2-CG 4.3Å; F77-Y117 HydrophobicContact CE2-CD1 4.44Å; F77-Y117 HydrophobicContact CE2-CD2 4.23Å; F77-Y117 HydrophobicContact CE2-CE1 4.22Å; F77-Y117 HydrophobicContact CE2-CE2 4.01Å; F77-Y117 HydrophobicContact CE2-CG 4.46Å
78	F	97.6	Very high	94.5	Very high	2 Å²	2	35.4 Å²	35.4	1%	0.009	18%	0.183	C	C	.	.	H	α-helix	trans	-63.4	-50.6	175.7	176	-107.8	0	0	0	110.8	K74 L75 Y80 L81 E82 M99 E101 A104 F105 F110	K74-F78 WeakPolarHBondContact O-CB 3.22Å; K74-F78 PolarHBondContact O-N 3.35Å; L75-F78 PolarHBondContact O-N 2.87Å; F78-Y80 VanDerWaalsContact C-N 3.29Å; F78-Y80 PolarHBondContact O-N 2.89Å; F78-L81 PolarHBondContact O-N 3.26Å; F78-E82 HydrophobicContact CE1-CB 4.4Å; F78-E82 HydrophobicContact CE1-CG 4.46Å; F78-E82 WeakPolarHBondContact CE1-OE2 2.95Å; F78-E82 HydrophobicContact CE2-CB 4.35Å; F78-E82 HydrophobicContact CZ-CB 4.2Å; F78-E82 HydrophobicContact CZ-CG 4.18Å; F78-E82 WeakPolarHBondContact CZ-OE1 3.37Å; F78-E82 WeakPolarHBondContact O-CB 3.48Å; F78-E82 PolarHBondContact O-N 3.18Å; F78-M99 HydrophobicContact CD2-SD 3.75Å; F78-M99 HydrophobicContact CE2-CG 4.18Å; F78-M99 HydrophobicContact CE2-SD 3.92Å; F78-E101 HydrophobicContact CE1-CB 4.05Å; F78-E101 HydrophobicContact CE1-CG 4.43Å; F78-E101 HydrophobicContact CE2-CB 4.43Å; F78-E101 HydrophobicContact CZ-CB 3.93Å; F78-A104 HydrophobicContact CD2-CB 3.85Å; F78-A104 HydrophobicContact CE2-CB 4.36Å; F78-F105 HydrophobicContact CB-CE2 3.83Å; F78-F105 HydrophobicContact CD1-CE2 4.39Å; F78-F105 HydrophobicContact CG-CE2 4.04Å; F78-F110 HydrophobicContact CB-CE1 4.41Å; F78-F110 HydrophobicContact CB-CZ 3.82Å
79	K	97.2	Very high	93.8	Very high	36 Å²	36	38.1 Å²	38.1	16%	0.157	19%	0.193	C	C	.	.	H	α-helix	trans	-61.8	-38.8	178.5	-69.1	-67.3	166.5	-157.3	0	112.3	L75 E82 Q83 E185	L75-K79 HydrophobicContact CD1-CG 4.34Å; L75-K79 WeakPolarHBondContact O-CG 3.46Å; L75-K79 PolarHBondContact O-N 3.45Å; K79-E82 WeakPolarHBondContact CD-OE2 3.29Å; K79-E82 IonicContact NZ-OE2 2.65Å; K79-E82 PolarHBondContact NZ-OE2 2.82Å; K79-Q83 WeakPolarHBondContact O-CB 3.07Å; K79-Q83 VanDerWaalsContact O-CG 3.25Å; K79-Q83 WeakPolarHBondContact O-CG 3.29Å; K79-Q83 PolarHBondContact O-N 3.34Å; K79-E185 HydrophobicContact CB-CB 4.5Å; K79-E185 HydrophobicContact CG-CB 4.33Å
80	Y	96.1	Very high	93.1	Very high	3 Å²	3	36.3 Å²	36.3	1%	0.012	19%	0.189	C	C	.	.	H	α-helix	trans	-59.5	-47.3	174.1	170.9	-127.3	0	0	0	112.9	M76 F77 F78 N84 L87 Y91 Y117 I175 K178 L179	M76-Y80 WeakPolarHBondContact O-CB 3.23Å; M76-Y80 PolarHBondContact O-N 3.43Å; F77-Y80 AromaticContact CD2-CD1 3.99Å; F77-Y80 HydrophobicContact CD2-CD1 3.99Å; F77-Y80 HydrophobicContact CE2-CD1 4.08Å; F77-Y80 HydrophobicContact CE2-CE1 4.37Å; F77-Y80 PolarHBondContact O-N 3.08Å; F78-Y80 VanDerWaalsContact C-N 3.29Å; F78-Y80 PolarHBondContact O-N 2.89Å; Y80-N84 VanDerWaalsContact O-CB 3.29Å; Y80-N84 WeakPolarHBondContact O-CB 3.38Å; Y80-N84 PolarHBondContact O-N 3.46Å; Y80-N84 PolarHBondContact O-ND2 3.31Å; Y80-L87 HydrophobicContact CD2-CD1 4.3Å; Y80-L87 HydrophobicContact CE1-CD1 4.26Å; Y80-L87 HydrophobicContact CE2-CD1 3.41Å; Y80-L87 VanDerWaalsContact CE2-CD1 3.41Å; Y80-L87 VanDerWaalsContact CZ-CD1 3.41Å; Y80-L87 WeakPolarHBondContact OH-CD1 3.2Å; Y80-Y91 WeakPolarHBondContact CE1-OH 3.39Å; Y80-Y117 HydrophobicContact CE1-CE1 4.31Å; Y80-I175 WeakPolarHBondContact OH-CG2 3.4Å; Y80-K178 HydrophobicContact CD2-CB 4.07Å; Y80-K178 WeakPolarHBondContact CD2-O 3.45Å; Y80-K178 HydrophobicContact CE2-CB 3.75Å; Y80-L179 HydrophobicContact CD1-CD1 4.23Å; Y80-L179 HydrophobicContact CD2-CB 4.24Å; Y80-L179 HydrophobicContact CD2-CD1 4.47Å; Y80-L179 HydrophobicContact CE1-CD1 4.48Å; Y80-L179 HydrophobicContact CE2-CB 4.05Å; Y80-L179 HydrophobicContact CG-CD1 4.19Å
81	L	94.5	Very high	92.6	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-81	-34.3	-178.4	-63.7	-176.6	0	0	0	113.8	F77 F78 Q83 N84 L87 L88 Y91 L94 M99 F110	F77-L81 HydrophobicContact CD1-CD1 4.11Å; F77-L81 HydrophobicContact CE1-CD1 3.58Å; F77-L81 HydrophobicContact CE1-CG 4.49Å; F77-L81 HydrophobicContact CE2-CD1 4.09Å; F77-L81 HydrophobicContact CE2-CD2 4.48Å; F77-L81 HydrophobicContact CE2-CG 4.24Å; F77-L81 HydrophobicContact CZ-CD1 3.57Å; F77-L81 HydrophobicContact CZ-CG 4.22Å; F77-L81 WeakPolarHBondContact O-CG 3.45Å; F77-L81 PolarHBondContact O-N 3.49Å; F78-L81 PolarHBondContact O-N 3.26Å; L81-Q83 VanDerWaalsContact C-N 3.32Å; L81-Q83 PolarHBondContact O-N 3.05Å; L81-N84 CarbonylContact O-C 3.55Å; L81-N84 PolarHBondContact O-N 3.5Å; L81-N84 VanDerWaalsContact O-N 3.17Å; L81-L87 HydrophobicContact CD2-CB 4.08Å; L81-L88 HydrophobicContact CD1-CD1 4.14Å; L81-Y91 HydrophobicContact CD2-CD2 4.12Å; L81-Y91 HydrophobicContact CD2-CE2 3.55Å; L81-L94 HydrophobicContact CD1-CD1 4.24Å; L81-M99 HydrophobicContact CB-CE 3.61Å; L81-M99 HydrophobicContact CB-SD 3.96Å; L81-M99 HydrophobicContact CD1-CE 3.81Å; L81-M99 HydrophobicContact CG-CE 4.38Å; L81-F110 HydrophobicContact CD1-CE2 4.14Å
82	E	94.6	Very high	92.1	Very high	83 Å²	83	32.7 Å²	32.7	39%	0.388	18%	0.179	S	C	.	.	H	α-helix	trans	-60	-43.3	175.8	179.4	-176.5	-137	0	0	110.9	F78 K79 N84 M99	F78-E82 HydrophobicContact CE1-CB 4.4Å; F78-E82 HydrophobicContact CE1-CG 4.46Å; F78-E82 WeakPolarHBondContact CE1-OE2 2.95Å; F78-E82 HydrophobicContact CE2-CB 4.35Å; F78-E82 HydrophobicContact CZ-CB 4.2Å; F78-E82 HydrophobicContact CZ-CG 4.18Å; F78-E82 WeakPolarHBondContact CZ-OE1 3.37Å; F78-E82 WeakPolarHBondContact O-CB 3.48Å; F78-E82 PolarHBondContact O-N 3.18Å; K79-E82 WeakPolarHBondContact CD-OE2 3.29Å; K79-E82 IonicContact NZ-OE2 2.65Å; K79-E82 PolarHBondContact NZ-OE2 2.82Å; E82-N84 VanDerWaalsContact C-N 3.29Å; E82-N84 PolarHBondContact O-N 2.87Å; E82-M99 HydrophobicContact CB-CG 4.2Å
83	Q	92.6	Very high	91.6	Very high	83 Å²	83	39 Å²	39	39%	0.388	21%	0.207	S	C	.	.	S	Bend	trans	-78.2	-15.1	178.8	-65.6	171.6	-2.1	0	0	112.8	K79 L81	K79-Q83 WeakPolarHBondContact O-CB 3.07Å; K79-Q83 VanDerWaalsContact O-CG 3.25Å; K79-Q83 WeakPolarHBondContact O-CG 3.29Å; K79-Q83 PolarHBondContact O-N 3.34Å; L81-Q83 VanDerWaalsContact C-N 3.32Å; L81-Q83 PolarHBondContact O-N 3.05Å
84	N	90.6	Very high	91.1	Very high	12 Å²	12	39 Å²	39	6%	0.064	21%	0.207	C	C	.	.			trans	-137.3	65.3	-172.7	-56.5	-78.9	0	0	0	111.6	Y80 L81 E82 D86 L87 K178	Y80-N84 VanDerWaalsContact O-CB 3.29Å; Y80-N84 WeakPolarHBondContact O-CB 3.38Å; Y80-N84 PolarHBondContact O-N 3.46Å; Y80-N84 PolarHBondContact O-ND2 3.31Å; L81-N84 CarbonylContact O-C 3.55Å; L81-N84 PolarHBondContact O-N 3.5Å; L81-N84 VanDerWaalsContact O-N 3.17Å; E82-N84 VanDerWaalsContact C-N 3.29Å; E82-N84 PolarHBondContact O-N 2.87Å; N84-D86 VanDerWaalsContact C-OD1 3.26Å; N84-D86 WeakPolarHBondContact CA-OD1 3.31Å; N84-D86 PolarHBondContact O-N 3.18Å; N84-D86 VanDerWaalsContact O-N 3.12Å; N84-L87 HydrophobicContact CB-CD1 3.6Å; N84-L87 HydrophobicContact CB-CG 3.84Å; N84-L87 WeakPolarHBondContact O-CB 3.45Å; N84-L87 PolarHBondContact O-N 3.47Å; N84-K178 HydrophobicContact CB-CD 4.18Å; N84-K178 WeakPolarHBondContact OD1-CD 3.46Å; N84-K178 WeakPolarHBondContact OD1-CE 3.39Å; N84-K178 VanDerWaalsContact OD1-CG 3.23Å; N84-K178 WeakPolarHBondContact OD1-CG 3.46Å; N84-K178 PolarHBondContact OD1-NZ 3.29Å; N84-K178 VanDerWaalsContact OD1-NZ 3.14Å
85	P	87.8	Confident	90.5	Very high	90 Å²	90	45.1 Å²	45.1	58%	0.584	23%	0.229	S	C	*	.	G	3₁₀ helix	trans	-62.9	-21.8	-174	25.3	-35.5	0	0	0	113.6	L87 L88	P85-L87 PolarHBondContact O-N 3.4Å; P85-L88 WeakPolarHBondContact O-CB 3.17Å; P85-L88 PolarHBondContact O-N 3.06Å
86	D	84.6	Confident	90	Very high	75 Å²	75	51.6 Å²	51.6	40%	0.401	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-58.4	-29.9	172.1	57	-56.4	0	0	0	112.6	N84 L88 K178	N84-D86 VanDerWaalsContact C-OD1 3.26Å; N84-D86 WeakPolarHBondContact CA-OD1 3.31Å; N84-D86 PolarHBondContact O-N 3.18Å; N84-D86 VanDerWaalsContact O-N 3.12Å; D86-L88 VanDerWaalsContact C-N 3.33Å; D86-K178 IonicContact OD1-NZ 3.75Å; D86-K178 PolarHBondContact OD1-NZ 3.39Å; D86-K178 IonicContact OD2-NZ 2.74Å; D86-K178 PolarHBondContact OD2-NZ 2.81Å; D86-K178 VanDerWaalsContact OD2-NZ 3.11Å
87	L	86.6	Confident	89.5	Confident	4 Å²	4	52.8 Å²	52.8	2%	0.021	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-78	-18.4	-178.4	-55.9	-176	0	0	0	113.2	Y80 L81 N84 P85 Q89 A90 Y91 V166 I175 K178	Y80-L87 HydrophobicContact CD2-CD1 4.3Å; Y80-L87 HydrophobicContact CE1-CD1 4.26Å; Y80-L87 HydrophobicContact CE2-CD1 3.41Å; Y80-L87 VanDerWaalsContact CE2-CD1 3.41Å; Y80-L87 VanDerWaalsContact CZ-CD1 3.41Å; Y80-L87 WeakPolarHBondContact OH-CD1 3.2Å; L81-L87 HydrophobicContact CD2-CB 4.08Å; N84-L87 HydrophobicContact CB-CD1 3.6Å; N84-L87 HydrophobicContact CB-CG 3.84Å; N84-L87 WeakPolarHBondContact O-CB 3.45Å; N84-L87 PolarHBondContact O-N 3.47Å; P85-L87 PolarHBondContact O-N 3.4Å; L87-Q89 PolarHBondContact O-N 3.22Å; L87-A90 WeakPolarHBondContact O-CB 3.28Å; L87-A90 PolarHBondContact O-N 3.27Å; L87-Y91 WeakPolarHBondContact O-CD2 3.27Å; L87-Y91 VanDerWaalsContact O-CE2 3.28Å; L87-Y91 WeakPolarHBondContact O-CE2 3.26Å; L87-V166 HydrophobicContact CD2-CG1 4.11Å; L87-I175 HydrophobicContact CD1-CD1 4.22Å; L87-I175 HydrophobicContact CD2-CD1 3.5Å; L87-K178 HydrophobicContact CD1-CD 4.09Å
88	L	85.9	Confident	89.2	Confident	22 Å²	22	59.3 Å²	59.3	12%	0.115	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-60	-32.9	-178.3	-169.9	62.2	0	0	0	112.2	L81 P85 D86 A90 Y91 L94 M99	L81-L88 HydrophobicContact CD1-CD1 4.14Å; P85-L88 WeakPolarHBondContact O-CB 3.17Å; P85-L88 PolarHBondContact O-N 3.06Å; D86-L88 VanDerWaalsContact C-N 3.33Å; L88-A90 PolarHBondContact O-N 2.97Å; L88-Y91 PolarHBondContact O-N 2.65Å; L88-Y91 VanDerWaalsContact O-N 3.1Å; L88-L94 HydrophobicContact CD1-CB 3.73Å; L88-L94 WeakPolarHBondContact CD1-O 3.48Å; L88-M99 HydrophobicContact CD1-CE 3.48Å; L88-M99 VanDerWaalsContact CD1-CE 3.48Å; L88-M99 HydrophobicContact CD2-CE 4.32Å; L88-M99 HydrophobicContact CG-CE 4.47Å
89	Q	82.3	Confident	88.9	Confident	130 Å²	130	61.2 Å²	61.2	61%	0.607	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-62.3	-24.9	178.5	-61.2	-174	9.9	0	0	112.9	L87 Y91	L87-Q89 PolarHBondContact O-N 3.22Å; Q89-Y91 PolarHBondContact O-N 3.11Å
90	A	81.6	Confident	88.8	Confident	19 Å²	19	61.5 Å²	61.5	16%	0.157	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-77.3	-11.4	-178.7	0	0	0	0	0	112.3	L87 L88 V166 W170	L87-A90 WeakPolarHBondContact O-CB 3.28Å; L87-A90 PolarHBondContact O-N 3.27Å; L88-A90 PolarHBondContact O-N 2.97Å; A90-V166 HydrophobicContact CB-CG1 4.05Å; A90-W170 HydrophobicContact CB-CH2 3.28Å; A90-W170 HydrophobicContact CB-CZ2 3.24Å; A90-W170 HydrophobicContact CB-CZ3 4.27Å
91	Y	87.1	Confident	88.8	Confident	14 Å²	14	66.4 Å²	66.4	6%	0.055	34%	0.336	C	S	.	.			trans	-109.1	94.7	176.7	-55.6	-87.6	0	0	0	109.7	F77 Y80 L81 L87 L88 Q89 K93 L94 R95 L113 Y117 W170	F77-Y91 HydrophobicContact CE2-CE1 4Å; F77-Y91 AromaticContact CE2-CZ 3.93Å; F77-Y91 HydrophobicContact CZ-CD1 4.04Å; F77-Y91 AromaticContact CZ-CE1 3.7Å; F77-Y91 HydrophobicContact CZ-CE1 3.7Å; F77-Y91 HydrophobicContact CZ-CE2 4.4Å; F77-Y91 AromaticContact CZ-CZ 3.9Å; Y80-Y91 WeakPolarHBondContact CE1-OH 3.39Å; L81-Y91 HydrophobicContact CD2-CD2 4.12Å; L81-Y91 HydrophobicContact CD2-CE2 3.55Å; L87-Y91 WeakPolarHBondContact O-CD2 3.27Å; L87-Y91 VanDerWaalsContact O-CE2 3.28Å; L87-Y91 WeakPolarHBondContact O-CE2 3.26Å; L88-Y91 PolarHBondContact O-N 2.65Å; L88-Y91 VanDerWaalsContact O-N 3.1Å; Q89-Y91 PolarHBondContact O-N 3.11Å; Y91-K93 PolarHBondContact O-N 3.15Å; Y91-L94 HydrophobicContact CG-CD1 4.42Å; Y91-L94 CarbonylContact O-C 3.25Å; Y91-L94 PolarHBondContact O-N 3.17Å; Y91-R95 PolarHBondContact O-N 2.81Å; Y91-L113 HydrophobicContact CD1-CD1 4.15Å; Y91-Y117 HydrophobicContact CE1-CE2 4.3Å; Y91-Y117 WeakPolarHBondContact CE1-OH 3.34Å; Y91-Y117 PolarHBondContact OH-OH 2.96Å; Y91-W170 HydrophobicContact CE1-CH2 4.17Å; Y91-W170 HydrophobicContact CE1-CZ3 4.3Å; Y91-W170 HydrophobicContact CE2-CH2 4.29Å; Y91-W170 HydrophobicContact CE2-CZ3 4.47Å; Y91-W170 AromaticContact CZ-CH2 3.96Å; Y91-W170 AromaticContact CZ-CZ3 3.89Å
92	A	86	Confident	88.8	Confident	78 Å²	78	73.7 Å²	73.7	65%	0.645	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	-34.4	-174.4	0	0	0	0	0	114.5	R95	A92-R95 WeakPolarHBondContact O-CG 3.33Å
93	K	87.7	Confident	88.9	Confident	133 Å²	133	72.2 Å²	72.2	58%	0.578	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-23.6	178.1	-69	177.8	157.2	-151.4	0	114.1	Y91 D109	Y91-K93 PolarHBondContact O-N 3.15Å; K93-D109 HydrophobicContact CB-CB 4.23Å; K93-D109 HydrophobicContact CD-CB 4.32Å; K93-D109 WeakPolarHBondContact CD-OD1 3.41Å; K93-D109 IonicContact NZ-OD1 2.74Å; K93-D109 PolarHBondContact NZ-OD1 3.34Å
94	L	89.4	Confident	89.1	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.7	-9.1	-175.2	-52.1	-178.5	0	0	0	113.1	F77 L81 L88 Y91 N96 M97 D109 F110 L113	F77-L94 HydrophobicContact CE1-CD1 3.68Å; F77-L94 HydrophobicContact CZ-CD1 4.21Å; L81-L94 HydrophobicContact CD1-CD1 4.24Å; L88-L94 HydrophobicContact CD1-CB 3.73Å; L88-L94 WeakPolarHBondContact CD1-O 3.48Å; Y91-L94 HydrophobicContact CG-CD1 4.42Å; Y91-L94 CarbonylContact O-C 3.25Å; Y91-L94 PolarHBondContact O-N 3.17Å; L94-N96 PolarHBondContact O-N 3.37Å; L94-M97 HydrophobicContact CD2-SD 4.14Å; L94-M97 WeakPolarHBondContact O-CB 3.41Å; L94-M97 PolarHBondContact O-N 3.28Å; L94-D109 HydrophobicContact CD2-CB 4.15Å; L94-F110 HydrophobicContact CD1-CD2 3.9Å; L94-F110 HydrophobicContact CD2-CB 4.05Å; L94-F110 HydrophobicContact CD2-CD2 4.48Å; L94-L113 HydrophobicContact CD1-CD1 3.51Å; L94-L113 HydrophobicContact CD2-CD1 4.34Å; L94-L113 HydrophobicContact CG-CD1 3.75Å
95	R	84.6	Confident	89.4	Confident	156 Å²	156	69.1 Å²	69.1	59%	0.589	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-23.9	-173	71.6	-177.7	179	169.8	0.4	115.9	Y91 A92	Y91-R95 PolarHBondContact O-N 2.81Å; A92-R95 WeakPolarHBondContact O-CG 3.33Å
96	N	86.9	Confident	89.8	Confident	144 Å²	144	71.3 Å²	71.3	77%	0.77	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.2	4.8	179.8	-62.6	-28.8	0	0	0	112.8	L94	L94-N96 PolarHBondContact O-N 3.37Å
97	M	89.4	Confident	90.4	Very high	24 Å²	24	69.8 Å²	69.8	12%	0.118	35%	0.35	C	S	.	.	S	Bend	trans	-78.1	137.7	-179.2	-169.5	-176	71.7	0	0	109.6	L94 M99 T103 A104 N107 F110	L94-M97 HydrophobicContact CD2-SD 4.14Å; L94-M97 WeakPolarHBondContact O-CB 3.41Å; L94-M97 PolarHBondContact O-N 3.28Å; M97-M99 HydrophobicContact CE-CE 3.55Å; M97-M99 HydrophobicContact CE-SD 4.16Å; M97-M99 PolarHBondContact O-N 3.22Å; M97-T103 HydrophobicContact CG-CG2 4.01Å; M97-A104 HydrophobicContact CE-CB 4.05Å; M97-N107 HydrophobicContact SD-CB 4.05Å; M97-F110 HydrophobicContact CE-CD2 3.54Å; M97-F110 HydrophobicContact CE-CE2 4.06Å; M97-F110 HydrophobicContact CE-CG 4.35Å; M97-F110 HydrophobicContact SD-CB 4.26Å; M97-F110 HydrophobicContact SD-CD2 4.27Å
98	E	90.9	Very high	90.8	Very high	137 Å²	137	74.1 Å²	74.1	64%	0.64	38%	0.38	S	S	*	.			trans	-70.4	125.1	168.6	-166.5	-174.6	149.9	0	0	109.6	N100 T103	E98-N100 VanDerWaalsContact C-N 3.33Å; E98-N100 WeakPolarHBondContact CG-ND2 3.16Å; E98-N100 PolarHBondContact O-N 3.2Å; E98-N100 PolarHBondContact OE1-ND2 2.96Å; E98-T103 HydrophobicContact CB-CG2 4.49Å
99	M	91.6	Very high	91.2	Very high	42 Å²	42	75.7 Å²	75.7	21%	0.207	39%	0.389	C	S	.	.			trans	-85.6	76.5	-178.9	-166.6	58.3	58.6	0	0	110.6	F78 L81 E82 L88 M97 F110	F78-M99 HydrophobicContact CD2-SD 3.75Å; F78-M99 HydrophobicContact CE2-CG 4.18Å; F78-M99 HydrophobicContact CE2-SD 3.92Å; L81-M99 HydrophobicContact CB-CE 3.61Å; L81-M99 HydrophobicContact CB-SD 3.96Å; L81-M99 HydrophobicContact CD1-CE 3.81Å; L81-M99 HydrophobicContact CG-CE 4.38Å; E82-M99 HydrophobicContact CB-CG 4.2Å; L88-M99 HydrophobicContact CD1-CE 3.48Å; L88-M99 VanDerWaalsContact CD1-CE 3.48Å; L88-M99 HydrophobicContact CD2-CE 4.32Å; L88-M99 HydrophobicContact CG-CE 4.47Å; M97-M99 HydrophobicContact CE-CE 3.55Å; M97-M99 HydrophobicContact CE-SD 4.16Å; M97-M99 PolarHBondContact O-N 3.22Å; M99-F110 HydrophobicContact CE-CE2 4.49Å; M99-F110 HydrophobicContact SD-CE2 4.42Å
100	N	94.8	Very high	91.9	Very high	43 Å²	43	69.5 Å²	69.5	23%	0.23	36%	0.36	C	S	.	.	S	Bend	trans	-128.8	158.2	166	68.2	63.3	0	0	0	109.7	E98 E102 T103 A104	E98-N100 VanDerWaalsContact C-N 3.33Å; E98-N100 WeakPolarHBondContact CG-ND2 3.16Å; E98-N100 PolarHBondContact O-N 3.2Å; E98-N100 PolarHBondContact OE1-ND2 2.96Å; N100-E102 PolarHBondContact O-N 3.48Å; N100-E102 PolarHBondContact OD1-N 2.81Å; N100-T103 VanDerWaalsContact CG-OG1 3.31Å; N100-T103 PolarHBondContact ND2-OG1 3.43Å; N100-T103 PolarHBondContact O-N 3.31Å; N100-T103 VanDerWaalsContact OD1-CB 3.22Å; N100-T103 WeakPolarHBondContact OD1-CB 3.41Å; N100-T103 PolarHBondContact OD1-N 2.8Å; N100-T103 PolarHBondContact OD1-OG1 3.26Å; N100-A104 VanDerWaalsContact O-CB 3.29Å; N100-A104 WeakPolarHBondContact O-CB 3.34Å; N100-A104 PolarHBondContact O-N 3.17Å
101	E	94.9	Very high	92.7	Very high	105 Å²	105	71.7 Å²	71.7	49%	0.491	37%	0.367	S	S	.	.	H	α-helix	trans	-61.4	-45.8	-171.1	-169.5	175.7	136.3	0	0	111.9	F78 T103 A104 F105	F78-E101 HydrophobicContact CE1-CB 4.05Å; F78-E101 HydrophobicContact CE1-CG 4.43Å; F78-E101 HydrophobicContact CE2-CB 4.43Å; F78-E101 HydrophobicContact CZ-CB 3.93Å; E101-T103 PolarHBondContact O-N 2.93Å; E101-A104 PolarHBondContact O-N 3.22Å; E101-F105 HydrophobicContact CG-CD2 3.88Å; E101-F105 HydrophobicContact CG-CE2 3.86Å; E101-F105 HydrophobicContact CG-CG 4.27Å; E101-F105 HydrophobicContact CG-CZ 4.21Å; E101-F105 VanDerWaalsContact O-CB 3.23Å; E101-F105 WeakPolarHBondContact O-CB 3.29Å; E101-F105 VanDerWaalsContact O-CD2 3.29Å; E101-F105 WeakPolarHBondContact O-CD2 3.42Å; E101-F105 PolarHBondContact O-N 3.29Å
102	E	96	Very high	93.1	Very high	153 Å²	153	76 Å²	76	72%	0.715	39%	0.387	S	S	*	.	H	α-helix	trans	-60.1	-45.7	-179.6	-176.7	177	-177.6	0	0	112	N100 N106	N100-E102 PolarHBondContact O-N 3.48Å; N100-E102 PolarHBondContact OD1-N 2.81Å; E102-N106 WeakPolarHBondContact O-CB 3.15Å; E102-N106 PolarHBondContact O-N 3.43Å; E102-N106 PolarHBondContact O-ND2 3.23Å
103	T	96.1	Very high	93.6	Very high	52 Å²	52	73.6 Å²	73.6	32%	0.319	36%	0.364	S	S	.	.	H	α-helix	trans	-69.6	-46.8	-179	-58.7	0	0	0	0	111	M97 E98 N100 E101 N107	M97-T103 HydrophobicContact CG-CG2 4.01Å; E98-T103 HydrophobicContact CB-CG2 4.49Å; N100-T103 VanDerWaalsContact CG-OG1 3.31Å; N100-T103 PolarHBondContact ND2-OG1 3.43Å; N100-T103 PolarHBondContact O-N 3.31Å; N100-T103 VanDerWaalsContact OD1-CB 3.22Å; N100-T103 WeakPolarHBondContact OD1-CB 3.41Å; N100-T103 PolarHBondContact OD1-N 2.8Å; N100-T103 PolarHBondContact OD1-OG1 3.26Å; E101-T103 PolarHBondContact O-N 2.93Å; T103-N107 WeakPolarHBondContact O-CB 3.01Å; T103-N107 PolarHBondContact O-N 2.91Å
104	A	96.1	Very high	94	Very high	0 Å²	0	67.2 Å²	67.2	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-64.4	-42.5	-179.4	0	0	0	0	0	111.6	F78 M97 N100 E101 N106 N107 F110	F78-A104 HydrophobicContact CD2-CB 3.85Å; F78-A104 HydrophobicContact CE2-CB 4.36Å; M97-A104 HydrophobicContact CE-CB 4.05Å; N100-A104 VanDerWaalsContact O-CB 3.29Å; N100-A104 WeakPolarHBondContact O-CB 3.34Å; N100-A104 PolarHBondContact O-N 3.17Å; E101-A104 PolarHBondContact O-N 3.22Å; A104-N106 VanDerWaalsContact C-N 3.29Å; A104-N106 PolarHBondContact O-N 3.21Å; A104-N107 PolarHBondContact O-N 3.31Å; A104-F110 HydrophobicContact CB-CD1 4.13Å; A104-F110 HydrophobicContact CB-CD2 4.11Å; A104-F110 HydrophobicContact CB-CE1 4.02Å; A104-F110 HydrophobicContact CB-CE2 3.97Å; A104-F110 HydrophobicContact CB-CG 4.17Å; A104-F110 HydrophobicContact CB-CZ 3.94Å; A104-F110 VanDerWaalsContact O-CD1 3.25Å; A104-F110 WeakPolarHBondContact O-CD1 3.46Å
105	F	97	Very high	94.4	Very high	30 Å²	30	68.4 Å²	68.4	13%	0.132	34%	0.342	C	S	.	.	H	α-helix	trans	-75.2	-19	-173.4	-82.6	-133	0	0	0	114.1	K74 L75 F78 E101	K74-F105 HydrophobicContact CB-CD1 4.23Å; K74-F105 HydrophobicContact CB-CD2 4.17Å; K74-F105 HydrophobicContact CB-CE1 3.98Å; K74-F105 HydrophobicContact CB-CE2 3.91Å; K74-F105 HydrophobicContact CB-CG 4.33Å; K74-F105 HydrophobicContact CB-CZ 3.82Å; K74-F105 HydrophobicContact CD-CB 4.43Å; K74-F105 HydrophobicContact CD-CD1 4.39Å; K74-F105 HydrophobicContact CD-CG 4.26Å; K74-F105 PolarHBondContact NZ-O 3.49Å; L75-F105 HydrophobicContact CB-CZ 4.25Å; L75-F105 HydrophobicContact CD1-CZ 4.36Å; F78-F105 HydrophobicContact CB-CE2 3.83Å; F78-F105 HydrophobicContact CD1-CE2 4.39Å; F78-F105 HydrophobicContact CG-CE2 4.04Å; E101-F105 HydrophobicContact CG-CD2 3.88Å; E101-F105 HydrophobicContact CG-CE2 3.86Å; E101-F105 HydrophobicContact CG-CG 4.27Å; E101-F105 HydrophobicContact CG-CZ 4.21Å; E101-F105 VanDerWaalsContact O-CB 3.23Å; E101-F105 WeakPolarHBondContact O-CB 3.29Å; E101-F105 VanDerWaalsContact O-CD2 3.29Å; E101-F105 WeakPolarHBondContact O-CD2 3.42Å; E101-F105 PolarHBondContact O-N 3.29Å
106	N	96.3	Very high	95	Very high	136 Å²	136	65.4 Å²	65.4	73%	0.727	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	3.8	174.7	-69.4	-58	0	0	0	113.2	E102 A104	E102-N106 WeakPolarHBondContact O-CB 3.15Å; E102-N106 PolarHBondContact O-N 3.43Å; E102-N106 PolarHBondContact O-ND2 3.23Å; A104-N106 VanDerWaalsContact C-N 3.29Å; A104-N106 PolarHBondContact O-N 3.21Å
107	N	96.4	Very high	95.4	Very high	44 Å²	44	60.3 Å²	60.3	24%	0.235	31%	0.305	C	S	.	.			trans	-98.5	122.2	-179.5	-175.7	-62.3	0	0	0	111.6	M97 T103 A104 D109 F110 E111	M97-N107 HydrophobicContact SD-CB 4.05Å; T103-N107 WeakPolarHBondContact O-CB 3.01Å; T103-N107 PolarHBondContact O-N 2.91Å; A104-N107 PolarHBondContact O-N 3.31Å; N107-D109 WeakPolarHBondContact OD1-CA 3.42Å; N107-D109 WeakPolarHBondContact OD1-CB 3.46Å; N107-D109 PolarHBondContact OD1-N 3.14Å; N107-F110 HydrophobicContact CB-CB 3.87Å; N107-F110 WeakPolarHBondContact O-CB 3.13Å; N107-F110 PolarHBondContact O-N 2.83Å; N107-F110 PolarHBondContact OD1-N 2.92Å; N107-E111 PolarHBondContact O-N 3.22Å
108	S	96.2	Very high	95.9	Very high	94 Å²	94	59.2 Å²	59.2	66%	0.657	30%	0.3	S	S	*	.	H	α-helix	trans	-69.3	-33.4	-177.8	57.6	0	0	0	0	114.2	F110 H112	S108-F110 VanDerWaalsContact C-N 3.35Å; S108-H112 WeakPolarHBondContact O-CB 3.5Å; S108-H112 PolarHBondContact O-N 3.15Å
109	D	95	Very high	96.2	Very high	55 Å²	55	54.8 Å²	54.8	29%	0.294	28%	0.281	S	S	.	.	H	α-helix	trans	-69.7	-37.1	176	-77.8	-51.2	0	0	0	110.8	K93 L94 N107 L113	K93-D109 HydrophobicContact CB-CB 4.23Å; K93-D109 HydrophobicContact CD-CB 4.32Å; K93-D109 WeakPolarHBondContact CD-OD1 3.41Å; K93-D109 IonicContact NZ-OD1 2.74Å; K93-D109 PolarHBondContact NZ-OD1 3.34Å; L94-D109 HydrophobicContact CD2-CB 4.15Å; N107-D109 WeakPolarHBondContact OD1-CA 3.42Å; N107-D109 WeakPolarHBondContact OD1-CB 3.46Å; N107-D109 PolarHBondContact OD1-N 3.14Å; D109-L113 WeakPolarHBondContact O-CG 3.41Å; D109-L113 PolarHBondContact O-N 2.99Å; D109-L113 VanDerWaalsContact O-N 3.14Å
110	F	96.7	Very high	96.5	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-64.1	-50.1	173.9	-176.1	-88.2	0	0	0	111	K74 F77 F78 L81 L94 M97 M99 A104 N107 S108 H112 L113 A114	K74-F110 HydrophobicContact CB-CE1 4.15Å; K74-F110 HydrophobicContact CG-CD1 4.28Å; K74-F110 HydrophobicContact CG-CE1 4.21Å; F77-F110 HydrophobicContact CB-CZ 4.16Å; F77-F110 AromaticContact CD1-CD2 3.92Å; F77-F110 HydrophobicContact CD1-CD2 3.92Å; F77-F110 HydrophobicContact CD1-CE1 4.11Å; F77-F110 AromaticContact CD1-CE2 3.48Å; F77-F110 HydrophobicContact CD1-CE2 3.48Å; F77-F110 VanDerWaalsContact CD1-CE2 3.48Å; F77-F110 HydrophobicContact CD1-CG 4.43Å; F77-F110 AromaticContact CD1-CZ 3.57Å; F77-F110 HydrophobicContact CD1-CZ 3.57Å; F77-F110 HydrophobicContact CE1-CD2 4.04Å; F77-F110 AromaticContact CE1-CE2 3.9Å; F77-F110 HydrophobicContact CE1-CE2 3.9Å; F77-F110 HydrophobicContact CE1-CZ 4.43Å; F77-F110 HydrophobicContact CG-CE2 4.45Å; F77-F110 HydrophobicContact CG-CZ 4.26Å; F78-F110 HydrophobicContact CB-CE1 4.41Å; F78-F110 HydrophobicContact CB-CZ 3.82Å; L81-F110 HydrophobicContact CD1-CE2 4.14Å; L94-F110 HydrophobicContact CD1-CD2 3.9Å; L94-F110 HydrophobicContact CD2-CB 4.05Å; L94-F110 HydrophobicContact CD2-CD2 4.48Å; M97-F110 HydrophobicContact CE-CD2 3.54Å; M97-F110 HydrophobicContact CE-CE2 4.06Å; M97-F110 HydrophobicContact CE-CG 4.35Å; M97-F110 HydrophobicContact SD-CB 4.26Å; M97-F110 HydrophobicContact SD-CD2 4.27Å; M99-F110 HydrophobicContact CE-CE2 4.49Å; M99-F110 HydrophobicContact SD-CE2 4.42Å; A104-F110 HydrophobicContact CB-CD1 4.13Å; A104-F110 HydrophobicContact CB-CD2 4.11Å; A104-F110 HydrophobicContact CB-CE1 4.02Å; A104-F110 HydrophobicContact CB-CE2 3.97Å; A104-F110 HydrophobicContact CB-CG 4.17Å; A104-F110 HydrophobicContact CB-CZ 3.94Å; A104-F110 VanDerWaalsContact O-CD1 3.25Å; A104-F110 WeakPolarHBondContact O-CD1 3.46Å; N107-F110 HydrophobicContact CB-CB 3.87Å; N107-F110 WeakPolarHBondContact O-CB 3.13Å; N107-F110 PolarHBondContact O-N 2.83Å; N107-F110 PolarHBondContact OD1-N 2.92Å; S108-F110 VanDerWaalsContact C-N 3.35Å; F110-H112 VanDerWaalsContact C-N 3.3Å; F110-H112 PolarHBondContact O-N 3.22Å; F110-L113 PolarHBondContact O-N 3.14Å; F110-A114 HydrophobicContact CE1-CB 4.37Å; F110-A114 VanDerWaalsContact O-CB 3.25Å; F110-A114 WeakPolarHBondContact O-CB 3.27Å; F110-A114 PolarHBondContact O-N 3.33Å
111	E	97.3	Very high	96.7	Very high	65 Å²	65	52.3 Å²	52.3	30%	0.304	27%	0.269	S	S	.	.	H	α-helix	trans	-58.1	-42.3	177.8	-177.9	168.5	136.2	0	0	112	K74 N107 A114 N115	K74-E111 HydrophobicContact CD-CB 4.15Å; K74-E111 HydrophobicContact CD-CG 4.16Å; K74-E111 HydrophobicContact CG-CB 4.47Å; K74-E111 HydrophobicContact CG-CG 4.42Å; K74-E111 IonicContact NZ-OE2 3.11Å; K74-E111 PolarHBondContact NZ-OE2 2.91Å; N107-E111 PolarHBondContact O-N 3.22Å; E111-A114 PolarHBondContact O-N 3.02Å; E111-N115 WeakPolarHBondContact CG-ND2 3.25Å; E111-N115 WeakPolarHBondContact O-CB 3.26Å; E111-N115 PolarHBondContact O-N 3.39Å; E111-N115 PolarHBondContact O-ND2 2.99Å
112	H	96.9	Very high	96.8	Very high	105 Å²	105	48.3 Å²	48.3	49%	0.486	25%	0.251	S	S	.	.	H	α-helix	trans	-61.4	-47.8	177.7	-177.6	68.7	0	0	0	112.2	S108 F110 N115 Q116	S108-H112 WeakPolarHBondContact O-CB 3.5Å; S108-H112 PolarHBondContact O-N 3.15Å; F110-H112 VanDerWaalsContact C-N 3.3Å; F110-H112 PolarHBondContact O-N 3.22Å; H112-N115 PolarHBondContact O-N 3.09Å; H112-Q116 PolarHBondContact NE2-NE2 3.25Å; H112-Q116 WeakPolarHBondContact O-CG 3.38Å; H112-Q116 PolarHBondContact O-N 2.84Å
113	L	95.1	Very high	96.9	Very high	27 Å²	27	46.2 Å²	46.2	14%	0.141	24%	0.241	C	C	.	.	H	α-helix	trans	-65.1	-43.2	177.6	-74.8	167.1	0	0	0	111.7	F77 Y91 L94 D109 F110 N115 Q116 Y117	F77-L113 HydrophobicContact CE1-CB 3.86Å; F77-L113 HydrophobicContact CZ-CB 4.13Å; Y91-L113 HydrophobicContact CD1-CD1 4.15Å; L94-L113 HydrophobicContact CD1-CD1 3.51Å; L94-L113 HydrophobicContact CD2-CD1 4.34Å; L94-L113 HydrophobicContact CG-CD1 3.75Å; D109-L113 WeakPolarHBondContact O-CG 3.41Å; D109-L113 PolarHBondContact O-N 2.99Å; D109-L113 VanDerWaalsContact O-N 3.14Å; F110-L113 PolarHBondContact O-N 3.14Å; L113-N115 VanDerWaalsContact C-N 3.3Å; L113-N115 PolarHBondContact O-N 3.47Å; L113-Q116 WeakPolarHBondContact O-CB 3.3Å; L113-Q116 PolarHBondContact O-N 2.74Å; L113-Y117 VanDerWaalsContact O-CD2 3.31Å; L113-Y117 WeakPolarHBondContact O-CD2 3.38Å; L113-Y117 PolarHBondContact O-N 3.26Å
114	A	97.4	Very high	97	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-58.2	-43.4	178.4	0	0	0	0	0	111.9	A73 K74 F77 F110 E111 Y117 L118	A73-A114 HydrophobicContact CB-CB 4.19Å; K74-A114 HydrophobicContact CG-CB 4.33Å; F77-A114 HydrophobicContact CB-CB 3.68Å; F77-A114 HydrophobicContact CD1-CB 3.9Å; F77-A114 HydrophobicContact CG-CB 4.06Å; F110-A114 HydrophobicContact CE1-CB 4.37Å; F110-A114 VanDerWaalsContact O-CB 3.25Å; F110-A114 WeakPolarHBondContact O-CB 3.27Å; F110-A114 PolarHBondContact O-N 3.33Å; E111-A114 PolarHBondContact O-N 3.02Å; A114-Y117 PolarHBondContact O-N 2.96Å; A114-L118 PolarHBondContact O-N 3.48Å; A114-L118 VanDerWaalsContact O-N 3.15Å
115	N	97.9	Very high	97.1	Very high	24 Å²	24	43.9 Å²	43.9	13%	0.128	23%	0.227	C	C	.	.	H	α-helix	trans	-63.8	-43.1	176.3	-82.3	-63.9	0	0	0	112.1	E111 H112 L113 Y117 L118 D119	E111-N115 WeakPolarHBondContact CG-ND2 3.25Å; E111-N115 WeakPolarHBondContact O-CB 3.26Å; E111-N115 PolarHBondContact O-N 3.39Å; E111-N115 PolarHBondContact O-ND2 2.99Å; H112-N115 PolarHBondContact O-N 3.09Å; L113-N115 VanDerWaalsContact C-N 3.3Å; L113-N115 PolarHBondContact O-N 3.47Å; N115-Y117 PolarHBondContact O-N 3.23Å; N115-L118 PolarHBondContact O-N 3.28Å; N115-L118 VanDerWaalsContact O-N 3.11Å; N115-D119 VanDerWaalsContact O-CB 3.29Å; N115-D119 WeakPolarHBondContact O-CB 3.29Å; N115-D119 PolarHBondContact O-N 3.36Å
116	Q	96.2	Very high	97.1	Very high	94 Å²	94	45.7 Å²	45.7	44%	0.439	24%	0.24	S	C	.	.	H	α-helix	trans	-56	-35.4	176	-71	179.7	-11.6	0	0	112.9	H112 L113	H112-Q116 PolarHBondContact NE2-NE2 3.25Å; H112-Q116 WeakPolarHBondContact O-CG 3.38Å; H112-Q116 PolarHBondContact O-N 2.84Å; L113-Q116 WeakPolarHBondContact O-CB 3.3Å; L113-Q116 PolarHBondContact O-N 2.74Å
117	Y	96.2	Very high	97.1	Very high	36 Å²	36	40.7 Å²	40.7	14%	0.141	22%	0.215	C	C	.	.	H	α-helix	trans	-71.3	-47.6	176.4	-83.8	-119.8	0	0	0	111.5	F77 Y80 Y91 L113 A114 N115 D119 V120 F121 L179	F77-Y117 HydrophobicContact CD2-CD1 4.31Å; F77-Y117 HydrophobicContact CD2-CD2 4.44Å; F77-Y117 HydrophobicContact CD2-CE1 4.49Å; F77-Y117 HydrophobicContact CD2-CG 4.3Å; F77-Y117 HydrophobicContact CE2-CD1 4.44Å; F77-Y117 HydrophobicContact CE2-CD2 4.23Å; F77-Y117 HydrophobicContact CE2-CE1 4.22Å; F77-Y117 HydrophobicContact CE2-CE2 4.01Å; F77-Y117 HydrophobicContact CE2-CG 4.46Å; Y80-Y117 HydrophobicContact CE1-CE1 4.31Å; Y91-Y117 HydrophobicContact CE1-CE2 4.3Å; Y91-Y117 WeakPolarHBondContact CE1-OH 3.34Å; Y91-Y117 PolarHBondContact OH-OH 2.96Å; L113-Y117 VanDerWaalsContact O-CD2 3.31Å; L113-Y117 WeakPolarHBondContact O-CD2 3.38Å; L113-Y117 PolarHBondContact O-N 3.26Å; A114-Y117 PolarHBondContact O-N 2.96Å; N115-Y117 PolarHBondContact O-N 3.23Å; Y117-D119 VanDerWaalsContact C-N 3.32Å; Y117-D119 PolarHBondContact O-N 3.47Å; Y117-V120 PolarHBondContact O-N 2.91Å; Y117-F121 VanDerWaalsContact O-CD2 3.28Å; Y117-F121 WeakPolarHBondContact O-CD2 3.43Å; Y117-L179 HydrophobicContact CD1-CD1 3.87Å; Y117-L179 HydrophobicContact CD1-CD2 4.31Å; Y117-L179 HydrophobicContact CE1-CD1 4.21Å; Y117-L179 HydrophobicContact CE1-CD2 4.41Å
118	L	98.1	Very high	97.2	Very high	2 Å²	2	38.6 Å²	38.6	1%	0.01	20%	0.203	C	C	.	.	H	α-helix	trans	-69.1	-33.2	-177.8	-169.3	65	0	0	0	112	W62 V65 K69 C72 A73 M76 A114 N115 V120 F121 D122 M186	W62-L118 HydrophobicContact CH2-CD1 3.83Å; W62-L118 HydrophobicContact CZ2-CD1 4.09Å; V65-L118 HydrophobicContact CG1-CD1 4.36Å; V65-L118 HydrophobicContact CG1-CD2 4.29Å; K69-L118 HydrophobicContact CG-CD2 4.06Å; K69-L118 WeakPolarHBondContact O-CD2 3.47Å; C72-L118 HydrophobicContact CB-CD2 3.95Å; A73-L118 HydrophobicContact CB-CB 3.9Å; A73-L118 HydrophobicContact CB-CD2 3.8Å; A73-L118 HydrophobicContact CB-CG 4.5Å; M76-L118 HydrophobicContact CE-CB 4.07Å; M76-L118 HydrophobicContact CE-CD1 4.27Å; M76-L118 HydrophobicContact SD-CD1 4.27Å; A114-L118 PolarHBondContact O-N 3.48Å; A114-L118 VanDerWaalsContact O-N 3.15Å; N115-L118 PolarHBondContact O-N 3.28Å; N115-L118 VanDerWaalsContact O-N 3.11Å; L118-V120 VanDerWaalsContact C-N 3.26Å; L118-V120 PolarHBondContact O-N 3Å; L118-F121 PolarHBondContact O-N 3.48Å; L118-D122 PolarHBondContact O-N 2.77Å; L118-M186 HydrophobicContact CD1-CE 4.25Å
119	D	98	Very high	97.2	Very high	44 Å²	44	37.9 Å²	37.9	24%	0.235	19%	0.19	C	C	.	.	H	α-helix	trans	-57.8	-36.8	177.6	-76.3	-23.8	0	0	0	112	K69 N115 Y117 F121 D122 E123	K69-D119 WeakPolarHBondContact CE-OD1 3.39Å; K69-D119 IonicContact NZ-OD1 2.79Å; K69-D119 PolarHBondContact NZ-OD1 3.08Å; N115-D119 VanDerWaalsContact O-CB 3.29Å; N115-D119 WeakPolarHBondContact O-CB 3.29Å; N115-D119 PolarHBondContact O-N 3.36Å; Y117-D119 VanDerWaalsContact C-N 3.32Å; Y117-D119 PolarHBondContact O-N 3.47Å; D119-F121 VanDerWaalsContact C-N 3.27Å; D119-F121 PolarHBondContact O-N 3.24Å; D119-D122 PolarHBondContact O-N 2.91Å; D119-E123 VanDerWaalsContact O-CB 3.26Å; D119-E123 WeakPolarHBondContact O-CB 3.48Å; D119-E123 VanDerWaalsContact O-CG 3.27Å; D119-E123 WeakPolarHBondContact O-CG 3.36Å; D119-E123 PolarHBondContact O-N 3.36Å
120	V	97.9	Very high	97.2	Very high	27 Å²	27	39.7 Å²	39.7	16%	0.164	21%	0.207	C	C	.	.	H	α-helix	trans	-58.1	-40.6	175.9	174.8	0	0	0	0	111.7	Y117 L118 A124 L142 V145	Y117-V120 PolarHBondContact O-N 2.91Å; L118-V120 VanDerWaalsContact C-N 3.26Å; L118-V120 PolarHBondContact O-N 3Å; V120-A124 WeakPolarHBondContact O-CB 3.35Å; V120-A124 PolarHBondContact O-N 3.4Å; V120-L142 HydrophobicContact CG1-CD2 3.7Å; V120-V145 HydrophobicContact CG1-CG2 4.45Å; V120-V145 HydrophobicContact CG2-CG1 4.28Å; V120-V145 HydrophobicContact CG2-CG2 4.31Å
121	F	98.5	Very high	97.1	Very high	6 Å²	6	43.4 Å²	43.4	3%	0.026	23%	0.227	C	C	.	.	H	α-helix	trans	-75.6	-41.1	178.3	-61.6	-85.2	0	0	0	111.6	W62 M76 Y117 L118 D119 A124 I125 F183 F206 F207 V210	W62-F121 HydrophobicContact CH2-CB 3.72Å; W62-F121 HydrophobicContact CZ2-CB 3.87Å; M76-F121 HydrophobicContact SD-CE2 4.28Å; Y117-F121 VanDerWaalsContact O-CD2 3.28Å; Y117-F121 WeakPolarHBondContact O-CD2 3.43Å; L118-F121 PolarHBondContact O-N 3.48Å; D119-F121 VanDerWaalsContact C-N 3.27Å; D119-F121 PolarHBondContact O-N 3.24Å; F121-A124 PolarHBondContact O-N 3.07Å; F121-I125 WeakPolarHBondContact O-CG1 3.42Å; F121-I125 PolarHBondContact O-N 3.43Å; F121-F183 HydrophobicContact CB-CE2 4.46Å; F121-F183 HydrophobicContact CD1-CD2 4.35Å; F121-F183 AromaticContact CD1-CE2 3.74Å; F121-F183 HydrophobicContact CD1-CE2 3.74Å; F121-F183 HydrophobicContact CD1-CZ 4.21Å; F121-F183 HydrophobicContact CD2-CD2 4.4Å; F121-F183 HydrophobicContact CD2-CE2 4.25Å; F121-F183 HydrophobicContact CE1-CD2 4.18Å; F121-F183 AromaticContact CE1-CE2 3.97Å; F121-F183 HydrophobicContact CE1-CE2 3.97Å; F121-F183 HydrophobicContact CE1-CZ 4.44Å; F121-F183 HydrophobicContact CE2-CD2 4.24Å; F121-F183 HydrophobicContact CE2-CE2 4.46Å; F121-F183 HydrophobicContact CG-CD2 4.47Å; F121-F183 AromaticContact CG-CE2 3.9Å; F121-F183 HydrophobicContact CG-CE2 3.9Å; F121-F183 HydrophobicContact CZ-CD2 4.13Å; F121-F183 HydrophobicContact CZ-CE2 4.33Å; F121-F206 HydrophobicContact CB-CE1 4.26Å; F121-F206 HydrophobicContact CD1-CD1 4.47Å; F121-F206 AromaticContact CD1-CE1 3.88Å; F121-F206 HydrophobicContact CD1-CE1 3.88Å; F121-F207 AromaticContact CE1-CD2 3.72Å; F121-F207 HydrophobicContact CE1-CD2 3.72Å; F121-F207 HydrophobicContact CE1-CE2 4.03Å; F121-F207 AromaticContact CZ-CD2 3.89Å; F121-F207 HydrophobicContact CZ-CD2 3.89Å; F121-F207 AromaticContact CZ-CE2 3.73Å; F121-F207 HydrophobicContact CZ-CE2 3.73Å; F121-V210 HydrophobicContact CD1-CB 4.4Å; F121-V210 HydrophobicContact CD1-CG1 4.16Å; F121-V210 HydrophobicContact CD1-CG2 4.08Å; F121-V210 HydrophobicContact CE1-CB 4.1Å; F121-V210 HydrophobicContact CE1-CG1 3.77Å; F121-V210 HydrophobicContact CE1-CG2 4.28Å; F121-V210 HydrophobicContact CZ-CG1 4.39Å
122	D	98.1	Very high	97	Very high	21 Å²	21	41.2 Å²	41.2	11%	0.112	22%	0.218	C	C	.	.	H	α-helix	trans	-67.5	-42.3	-178.1	-165.6	46.7	0	0	0	112.2	W62 Q66 K69 L118 D119 I125 T126	W62-D122 HydrophobicContact CZ2-CB 4.46Å; W62-D122 PolarHBondContact NE1-OD1 3.21Å; W62-D122 VanDerWaalsContact NE1-OD1 3.12Å; Q66-D122 WeakPolarHBondContact CG-OD1 3.35Å; Q66-D122 PolarHBondContact NE2-OD1 3.02Å; K69-D122 IonicContact NZ-OD2 3.38Å; K69-D122 PolarHBondContact NZ-OD2 2.82Å; L118-D122 PolarHBondContact O-N 2.77Å; D119-D122 PolarHBondContact O-N 2.91Å; D122-I125 PolarHBondContact O-N 3.17Å; D122-T126 VanDerWaalsContact O-CB 3.32Å; D122-T126 WeakPolarHBondContact O-CB 3.4Å; D122-T126 PolarHBondContact O-N 3.17Å; D122-T126 PolarHBondContact O-OG1 3.12Å
123	E	97.7	Very high	96.9	Very high	109 Å²	109	38 Å²	38	51%	0.509	21%	0.213	S	C	.	.	H	α-helix	trans	-61.5	-48.6	173	-73.1	177.9	177.9	0	0	110.5	D119 I125 T126 T127	D119-E123 VanDerWaalsContact O-CB 3.26Å; D119-E123 WeakPolarHBondContact O-CB 3.48Å; D119-E123 VanDerWaalsContact O-CG 3.27Å; D119-E123 WeakPolarHBondContact O-CG 3.36Å; D119-E123 PolarHBondContact O-N 3.36Å; E123-I125 VanDerWaalsContact C-N 3.32Å; E123-I125 PolarHBondContact O-N 3.49Å; E123-T126 PolarHBondContact O-N 3.48Å; E123-T127 WeakPolarHBondContact O-CB 3.35Å; E123-T127 PolarHBondContact O-N 3.12Å; E123-T127 PolarHBondContact O-OG1 2.92Å; E123-T127 VanDerWaalsContact O-OG1 3.08Å
124	A	98.3	Very high	96.9	Very high	2 Å²	2	39.9 Å²	39.9	2%	0.017	22%	0.223	C	C	.	.	H	α-helix	trans	-57.1	-44.7	177.5	0	0	0	0	0	112	V120 F121 I128 V138 F206	V120-A124 WeakPolarHBondContact O-CB 3.35Å; V120-A124 PolarHBondContact O-N 3.4Å; F121-A124 PolarHBondContact O-N 3.07Å; A124-I128 WeakPolarHBondContact O-CB 3.32Å; A124-I128 VanDerWaalsContact O-CD1 3.29Å; A124-I128 WeakPolarHBondContact O-CD1 3.28Å; A124-I128 WeakPolarHBondContact O-CG1 3.35Å; A124-I128 PolarHBondContact O-N 3.36Å; A124-V138 HydrophobicContact CB-CG1 3.8Å; A124-F206 HydrophobicContact CB-CZ 4.16Å
125	I	98.2	Very high	96.9	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-66.3	-42.7	178.6	-71	168.1	0	0	0	111.5	W55 F58 W62 F121 D122 E123 I128 E129 F206	W55-I125 HydrophobicContact CH2-CB 4.38Å; W55-I125 HydrophobicContact CH2-CG1 4.31Å; W55-I125 HydrophobicContact CH2-CG2 4.02Å; F58-I125 HydrophobicContact CE1-CD1 3.63Å; F58-I125 HydrophobicContact CE1-CG1 4Å; F58-I125 HydrophobicContact CZ-CD1 3.83Å; W62-I125 HydrophobicContact CB-CD1 4.23Å; W62-I125 HydrophobicContact CD2-CD1 3.23Å; W62-I125 HydrophobicContact CE3-CD1 3.72Å; W62-I125 HydrophobicContact CG-CD1 3.44Å; W62-I125 VanDerWaalsContact CG-CD1 3.44Å; W62-I125 HydrophobicContact CG-CG2 4.37Å; W62-I125 HydrophobicContact CH2-CD1 4.34Å; W62-I125 HydrophobicContact CZ2-CD1 3.92Å; W62-I125 HydrophobicContact CZ3-CD1 4.25Å; F121-I125 WeakPolarHBondContact O-CG1 3.42Å; F121-I125 PolarHBondContact O-N 3.43Å; D122-I125 PolarHBondContact O-N 3.17Å; E123-I125 VanDerWaalsContact C-N 3.32Å; E123-I125 PolarHBondContact O-N 3.49Å; I125-I128 PolarHBondContact O-N 3.19Å; I125-E129 WeakPolarHBondContact O-CB 3.49Å; I125-E129 PolarHBondContact O-N 3.32Å; I125-F206 HydrophobicContact CD1-CD1 4.31Å; I125-F206 HydrophobicContact CD1-CE1 3.63Å; I125-F206 HydrophobicContact CD1-CZ 3.79Å; I125-F206 HydrophobicContact CG1-CE1 3.79Å; I125-F206 HydrophobicContact CG1-CE2 3.9Å; I125-F206 HydrophobicContact CG1-CZ 3.37Å
126	T	97.1	Very high	96.9	Very high	67 Å²	67	41.9 Å²	41.9	41%	0.411	24%	0.239	S	C	.	.	H	α-helix	trans	-62.9	-44.4	179.1	-60.7	0	0	0	0	111.1	D122 E123 E129 S130	D122-T126 VanDerWaalsContact O-CB 3.32Å; D122-T126 WeakPolarHBondContact O-CB 3.4Å; D122-T126 PolarHBondContact O-N 3.17Å; D122-T126 PolarHBondContact O-OG1 3.12Å; E123-T126 PolarHBondContact O-N 3.48Å; T126-E129 PolarHBondContact O-N 2.85Å; T126-S130 PolarHBondContact O-N 3Å; T126-S130 VanDerWaalsContact O-N 3.1Å
127	T	96.9	Very high	96.9	Very high	31 Å²	31	39.8 Å²	39.8	19%	0.19	24%	0.235	C	C	.	.	H	α-helix	trans	-67.3	-43.5	178.3	-55.7	0	0	0	0	111.3	E123 E129 S130 N131 S137 V138	E123-T127 WeakPolarHBondContact O-CB 3.35Å; E123-T127 PolarHBondContact O-N 3.12Å; E123-T127 PolarHBondContact O-OG1 2.92Å; E123-T127 VanDerWaalsContact O-OG1 3.08Å; T127-E129 VanDerWaalsContact C-N 3.31Å; T127-E129 PolarHBondContact O-N 3.11Å; T127-S130 PolarHBondContact O-N 3.44Å; T127-S130 PolarHBondContact O-OG 3.38Å; T127-N131 PolarHBondContact O-N 2.78Å; T127-S137 VanDerWaalsContact CG2-OG 3.31Å; T127-S137 WeakPolarHBondContact CG2-OG 3.23Å; T127-V138 HydrophobicContact CG2-CG2 3.45Å; T127-V138 VanDerWaalsContact CG2-CG2 3.45Å
128	I	97.3	Very high	97	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-61.3	-39.1	173.3	-63.5	158.5	0	0	0	111.1	L47 W55 A124 I125 S130 N131 P132 V135 V138 F206 F209	L47-I128 HydrophobicContact CD1-CG2 3.7Å; L47-I128 HydrophobicContact CD2-CD1 3.69Å; L47-I128 HydrophobicContact CD2-CG1 4.2Å; L47-I128 HydrophobicContact CD2-CG2 4.28Å; W55-I128 HydrophobicContact CD2-CG2 4.28Å; W55-I128 HydrophobicContact CH2-CB 3.75Å; W55-I128 HydrophobicContact CH2-CD1 4.11Å; W55-I128 HydrophobicContact CH2-CG2 3.58Å; W55-I128 HydrophobicContact CZ2-CB 3.69Å; W55-I128 HydrophobicContact CZ2-CG2 3.28Å; W55-I128 HydrophobicContact CZ3-CD1 4.42Å; W55-I128 HydrophobicContact CZ3-CG2 4.2Å; A124-I128 WeakPolarHBondContact O-CB 3.32Å; A124-I128 VanDerWaalsContact O-CD1 3.29Å; A124-I128 WeakPolarHBondContact O-CD1 3.28Å; A124-I128 WeakPolarHBondContact O-CG1 3.35Å; A124-I128 PolarHBondContact O-N 3.36Å; I125-I128 PolarHBondContact O-N 3.19Å; I128-S130 VanDerWaalsContact C-N 3.27Å; I128-S130 PolarHBondContact O-N 3.07Å; I128-N131 CarbonylContact O-C 3.57Å; I128-N131 VanDerWaalsContact O-C 3.25Å; I128-N131 PolarHBondContact O-N 3.41Å; I128-P132 WeakPolarHBondContact O-CA 3.38Å; I128-P132 WeakPolarHBondContact O-CD 3.31Å; I128-V135 HydrophobicContact CG1-CG1 4.15Å; I128-V138 HydrophobicContact CD1-CG1 4.34Å; I128-V138 HydrophobicContact CG1-CB 4.45Å; I128-V138 HydrophobicContact CG1-CG1 4.32Å; I128-V138 HydrophobicContact CG1-CG2 3.79Å; I128-F206 HydrophobicContact CD1-CE2 4.08Å; I128-F209 HydrophobicContact CD1-CE1 4.39Å
129	E	95.5	Very high	97	Very high	79 Å²	79	38.9 Å²	38.9	37%	0.369	23%	0.233	S	C	.	.	H	α-helix	trans	-61.7	-37.6	177.6	175.7	168.4	-152.1	0	0	112	K59 I125 T126 T127	K59-E129 HydrophobicContact CD-CB 4.28Å; K59-E129 VanDerWaalsContact CD-CD 3.46Å; K59-E129 HydrophobicContact CD-CG 4.01Å; K59-E129 WeakPolarHBondContact CD-OE1 3.29Å; K59-E129 WeakPolarHBondContact CE-OE1 3.15Å; K59-E129 IonicContact NZ-OE1 3.91Å; K59-E129 PolarHBondContact NZ-OE1 3.01Å; I125-E129 WeakPolarHBondContact O-CB 3.49Å; I125-E129 PolarHBondContact O-N 3.32Å; T126-E129 PolarHBondContact O-N 2.85Å; T127-E129 VanDerWaalsContact C-N 3.31Å; T127-E129 PolarHBondContact O-N 3.11Å
130	S	95.3	Very high	96.9	Very high	94 Å²	94	42.4 Å²	42.4	66%	0.657	25%	0.248	S	C	*	.	H	α-helix	trans	-68.3	-34.4	179.6	78.9	0	0	0	0	113.3	T126 T127 I128	T126-S130 PolarHBondContact O-N 3Å; T126-S130 VanDerWaalsContact O-N 3.1Å; T127-S130 PolarHBondContact O-N 3.44Å; T127-S130 PolarHBondContact O-OG 3.38Å; I128-S130 VanDerWaalsContact C-N 3.27Å; I128-S130 PolarHBondContact O-N 3.07Å
131	N	94.8	Very high	96.9	Very high	78 Å²	78	45 Å²	45	42%	0.417	26%	0.258	S	S	.	.			trans	-146.8	77	179.3	-169.9	7.6	0	0	0	111.6	T127 I128 G133 D134	T127-N131 PolarHBondContact O-N 2.78Å; I128-N131 CarbonylContact O-C 3.57Å; I128-N131 VanDerWaalsContact O-C 3.25Å; I128-N131 PolarHBondContact O-N 3.41Å; N131-G133 PolarHBondContact O-N 3.18Å; N131-D134 PolarHBondContact O-N 3.4Å; N131-D134 VanDerWaalsContact O-O 3.06Å
132	P	95	Very high	96.9	Very high	19 Å²	19	44.9 Å²	44.9	12%	0.123	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-13.8	-173.7	25.1	-34.7	0	0	0	113.9	Q42 L43 D44 Y52 I128	Q42-P132 CarbonylContact O-C 3.58Å; L43-P132 CarbonylContact C-O 3.22Å; L43-P132 WeakPolarHBondContact CA-O 3.5Å; L43-P132 HydrophobicContact CD1-CB 3.97Å; D44-P132 PolarHBondContact N-O 3.1Å; Y52-P132 HydrophobicContact CD2-CB 4.5Å; Y52-P132 HydrophobicContact CE2-CB 4.13Å; Y52-P132 HydrophobicContact CE2-CG 3.92Å; I128-P132 WeakPolarHBondContact O-CA 3.38Å; I128-P132 WeakPolarHBondContact O-CD 3.31Å
133	G	95.7	Very high	96.8	Very high	36 Å²	36	46.1 Å²	46.1	37%	0.371	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-7.3	179.9	0	0	0	0	0	114.6	Q42 N131	Q42-G133 WeakPolarHBondContact O-CA 3.37Å; Q42-G133 PolarHBondContact O-N 3.39Å; N131-G133 PolarHBondContact O-N 3.18Å
134	D	95.5	Very high	96.8	Very high	67 Å²	67	43.1 Å²	43.1	36%	0.358	25%	0.251	S	S	.	.			trans	-147.8	111.1	179.5	174	15.4	0	0	0	110.2	D44 N131 S136	D44-D134 WeakPolarHBondContact OD2-CA 3.4Å; N131-D134 PolarHBondContact O-N 3.4Å; N131-D134 VanDerWaalsContact O-O 3.06Å; D134-S136 WeakPolarHBondContact OD1-CB 3.34Å; D134-S136 PolarHBondContact OD1-N 3.29Å; D134-S136 PolarHBondContact OD1-OG 3.08Å
135	V	97	Very high	96.6	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	25%	0.254	C	S	.	.			trans	-100.2	12.7	179.7	-58.5	0	0	0	0	113.7	D44 Q46 L47 I128 S137 V138 V139 F209	D44-V135 HydrophobicContact CB-CG1 3.83Å; D44-V135 HydrophobicContact CB-CG2 4.19Å; D44-V135 PolarHBondContact OD2-N 3.27Å; D44-V135 VanDerWaalsContact OD2-N 3.15Å; Q46-V135 HydrophobicContact CB-CG2 3.93Å; L47-V135 HydrophobicContact CD1-CG1 3.75Å; L47-V135 HydrophobicContact CD2-CG1 3.88Å; L47-V135 HydrophobicContact CG-CG1 3.69Å; I128-V135 HydrophobicContact CG1-CG1 4.15Å; V135-S137 VanDerWaalsContact C-N 3.3Å; V135-S137 PolarHBondContact O-N 2.69Å; V135-V138 HydrophobicContact CB-CB 4.49Å; V135-V138 PolarHBondContact O-N 3Å; V135-V138 VanDerWaalsContact O-N 3.1Å; V135-V139 HydrophobicContact CG2-CG2 4.02Å; V135-V139 WeakPolarHBondContact O-CG2 3.34Å; V135-V139 PolarHBondContact O-N 3Å; V135-F209 HydrophobicContact CG2-CZ 4.42Å
136	S	97	Very high	96.4	Very high	67 Å²	67	43.6 Å²	43.6	47%	0.469	25%	0.254	S	S	.	.	H	α-helix	trans	-57.7	-41.8	-174.9	-55.5	0	0	0	0	112.3	D134 V139 E140	D134-S136 WeakPolarHBondContact OD1-CB 3.34Å; D134-S136 PolarHBondContact OD1-N 3.29Å; D134-S136 PolarHBondContact OD1-OG 3.08Å; S136-V139 PolarHBondContact O-N 2.82Å; S136-E140 WeakPolarHBondContact O-CB 3.38Å; S136-E140 PolarHBondContact O-N 3.39Å
137	S	96.8	Very high	96.1	Very high	49 Å²	49	43.9 Å²	43.9	34%	0.343	25%	0.249	S	C	.	.	H	α-helix	trans	-63.9	-43.2	176.1	55.1	0	0	0	0	112.3	T127 V135 V139 E140 E141	T127-S137 VanDerWaalsContact CG2-OG 3.31Å; T127-S137 WeakPolarHBondContact CG2-OG 3.23Å; V135-S137 VanDerWaalsContact C-N 3.3Å; V135-S137 PolarHBondContact O-N 2.69Å; S137-V139 PolarHBondContact O-N 2.85Å; S137-E140 PolarHBondContact O-N 2.86Å; S137-E141 WeakPolarHBondContact O-CB 3.24Å; S137-E141 VanDerWaalsContact O-CG 3.29Å; S137-E141 WeakPolarHBondContact O-CG 3.35Å; S137-E141 PolarHBondContact O-N 2.87Å
138	V	97.6	Very high	95.8	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.006	26%	0.262	C	S	.	.	H	α-helix	trans	-63.7	-43.2	177.6	179.8	0	0	0	0	110.9	A124 T127 I128 V135 E140 E141 L142 F209	A124-V138 HydrophobicContact CB-CG1 3.8Å; T127-V138 HydrophobicContact CG2-CG2 3.45Å; T127-V138 VanDerWaalsContact CG2-CG2 3.45Å; I128-V138 HydrophobicContact CD1-CG1 4.34Å; I128-V138 HydrophobicContact CG1-CB 4.45Å; I128-V138 HydrophobicContact CG1-CG1 4.32Å; I128-V138 HydrophobicContact CG1-CG2 3.79Å; V135-V138 HydrophobicContact CB-CB 4.49Å; V135-V138 PolarHBondContact O-N 3Å; V135-V138 VanDerWaalsContact O-N 3.1Å; V138-E140 VanDerWaalsContact C-N 3.35Å; V138-E141 PolarHBondContact O-N 3.48Å; V138-L142 HydrophobicContact CG1-CD1 3.88Å; V138-L142 HydrophobicContact CG1-CG 4.29Å; V138-L142 WeakPolarHBondContact O-CB 3.31Å; V138-L142 WeakPolarHBondContact O-CG 3.21Å; V138-L142 PolarHBondContact O-N 3.3Å; V138-F209 HydrophobicContact CG1-CE1 4.14Å; V138-F209 HydrophobicContact CG1-CZ 4.5Å
139	V	98	Very high	95.2	Very high	18 Å²	18	50.6 Å²	50.6	11%	0.109	27%	0.273	C	S	.	.	H	α-helix	trans	-61.3	-45.6	176.4	169.3	0	0	0	0	110.4	V135 S136 S137 Q143 F209 N213	V135-V139 HydrophobicContact CG2-CG2 4.02Å; V135-V139 WeakPolarHBondContact O-CG2 3.34Å; V135-V139 PolarHBondContact O-N 3Å; S136-V139 PolarHBondContact O-N 2.82Å; S137-V139 PolarHBondContact O-N 2.85Å; V139-Q143 HydrophobicContact CG1-CG 4.42Å; V139-Q143 WeakPolarHBondContact O-CB 3.36Å; V139-Q143 WeakPolarHBondContact O-CG 3.21Å; V139-Q143 PolarHBondContact O-N 2.88Å; V139-F209 HydrophobicContact CG2-CZ 4.28Å; V139-N213 WeakPolarHBondContact CG1-OD1 3.34Å
140	E	97.5	Very high	94.5	Very high	119 Å²	119	51.4 Å²	51.4	56%	0.556	27%	0.273	S	S	*	.	H	α-helix	trans	-61.8	-46.2	176.8	-176.4	179.1	179.9	0	0	112.1	S136 S137 V138 Q143 N144	S136-E140 WeakPolarHBondContact O-CB 3.38Å; S136-E140 PolarHBondContact O-N 3.39Å; S137-E140 PolarHBondContact O-N 2.86Å; V138-E140 VanDerWaalsContact C-N 3.35Å; E140-Q143 PolarHBondContact O-N 3.41Å; E140-N144 WeakPolarHBondContact O-CB 3.3Å; E140-N144 PolarHBondContact O-N 2.93Å; E140-N144 PolarHBondContact O-ND2 2.9Å
141	E	97.4	Very high	93.7	Very high	80 Å²	80	54.3 Å²	54.3	37%	0.374	27%	0.269	S	S	.	.	H	α-helix	trans	-59.8	-49	178.2	-76.4	168.2	-175.7	0	0	111.7	S137 V138 N144 V145	S137-E141 WeakPolarHBondContact O-CB 3.24Å; S137-E141 VanDerWaalsContact O-CG 3.29Å; S137-E141 WeakPolarHBondContact O-CG 3.35Å; S137-E141 PolarHBondContact O-N 2.87Å; V138-E141 PolarHBondContact O-N 3.48Å; E141-N144 WeakPolarHBondContact O-CB 3.42Å; E141-N144 PolarHBondContact O-N 3.1Å; E141-N144 VanDerWaalsContact O-N 3.14Å; E141-V145 WeakPolarHBondContact O-CG2 3.35Å; E141-V145 PolarHBondContact O-N 3.34Å
142	L	97.9	Very high	92.8	Very high	4 Å²	4	54.7 Å²	54.7	2%	0.021	27%	0.27	C	S	.	.	H	α-helix	trans	-62.4	-44.2	176.5	-69.5	175.4	0	0	0	111.5	V120 V138 N144 V145 G146 F209 V210 N213 L214	V120-L142 HydrophobicContact CG1-CD2 3.7Å; V138-L142 HydrophobicContact CG1-CD1 3.88Å; V138-L142 HydrophobicContact CG1-CG 4.29Å; V138-L142 WeakPolarHBondContact O-CB 3.31Å; V138-L142 WeakPolarHBondContact O-CG 3.21Å; V138-L142 PolarHBondContact O-N 3.3Å; L142-N144 VanDerWaalsContact C-N 3.25Å; L142-N144 PolarHBondContact O-N 3.28Å; L142-V145 WeakPolarHBondContact O-CB 3.39Å; L142-V145 PolarHBondContact O-N 2.89Å; L142-V145 VanDerWaalsContact O-N 3.15Å; L142-G146 PolarHBondContact O-N 3.28Å; L142-F209 HydrophobicContact CD1-CE1 4.03Å; L142-V210 HydrophobicContact CD1-CG2 4.29Å; L142-V210 HydrophobicContact CD2-CG1 3.92Å; L142-N213 HydrophobicContact CB-CB 3.72Å; L142-N213 HydrophobicContact CD1-CB 3.86Å; L142-N213 HydrophobicContact CG-CB 4.47Å; L142-L214 HydrophobicContact CD2-CD2 4.28Å; L142-L214 WeakPolarHBondContact O-CD2 3.27Å
143	Q	97.2	Very high	91.4	Very high	47 Å²	47	54.1 Å²	54.1	22%	0.22	27%	0.267	C	S	.	.	H	α-helix	trans	-62.5	-35.9	175.2	-73.2	178	5.6	0	0	111.5	V139 E140 G146 K147 N213 Q216 G217	V139-Q143 HydrophobicContact CG1-CG 4.42Å; V139-Q143 WeakPolarHBondContact O-CB 3.36Å; V139-Q143 WeakPolarHBondContact O-CG 3.21Å; V139-Q143 PolarHBondContact O-N 2.88Å; E140-Q143 PolarHBondContact O-N 3.41Å; Q143-G146 PolarHBondContact O-N 3.25Å; Q143-K147 WeakPolarHBondContact O-CG 3.46Å; Q143-K147 PolarHBondContact O-N 3.31Å; Q143-N213 VanDerWaalsContact CG-O 3.31Å; Q143-N213 WeakPolarHBondContact CG-O 3.38Å; Q143-Q216 HydrophobicContact CG-CB 4.3Å; Q143-G217 VanDerWaalsContact O-CA 3.24Å; Q143-G217 WeakPolarHBondContact O-CA 3.44Å
144	N	95.9	Very high	89.5	Confident	47 Å²	47	55.8 Å²	55.8	25%	0.251	27%	0.272	S	S	.	.	H	α-helix	trans	-66.9	-36.9	174.7	-73.3	-26.6	0	0	0	112.3	E140 E141 L142 G146 K147 R148	E140-N144 WeakPolarHBondContact O-CB 3.3Å; E140-N144 PolarHBondContact O-N 2.93Å; E140-N144 PolarHBondContact O-ND2 2.9Å; E141-N144 WeakPolarHBondContact O-CB 3.42Å; E141-N144 PolarHBondContact O-N 3.1Å; E141-N144 VanDerWaalsContact O-N 3.14Å; L142-N144 VanDerWaalsContact C-N 3.25Å; L142-N144 PolarHBondContact O-N 3.28Å; N144-G146 VanDerWaalsContact C-N 3.34Å; N144-K147 PolarHBondContact O-N 3.46Å; N144-K147 PolarHBondContact OD1-NZ 3.02Å; N144-R148 WeakPolarHBondContact O-CG 3.47Å; N144-R148 PolarHBondContact O-N 3.46Å
145	V	94.8	Very high	87.8	Confident	13 Å²	13	57.7 Å²	57.7	8%	0.079	28%	0.281	C	S	.	.	H	α-helix	trans	-59.7	-45.1	169.9	178.4	0	0	0	0	110.4	V120 E141 L142 R148 H149 L214	V120-V145 HydrophobicContact CG1-CG2 4.45Å; V120-V145 HydrophobicContact CG2-CG1 4.28Å; V120-V145 HydrophobicContact CG2-CG2 4.31Å; E141-V145 WeakPolarHBondContact O-CG2 3.35Å; E141-V145 PolarHBondContact O-N 3.34Å; L142-V145 WeakPolarHBondContact O-CB 3.39Å; L142-V145 PolarHBondContact O-N 2.89Å; L142-V145 VanDerWaalsContact O-N 3.15Å; V145-R148 WeakPolarHBondContact O-CB 3.43Å; V145-R148 PolarHBondContact O-N 3.36Å; V145-H149 PolarHBondContact O-N 3.12Å; V145-H149 VanDerWaalsContact O-N 3.14Å; V145-H149 PolarHBondContact O-ND1 3.14Å; V145-L214 HydrophobicContact CB-CD2 3.57Å; V145-L214 HydrophobicContact CG1-CD2 3.5Å; V145-L214 HydrophobicContact CG2-CD2 4.5Å
146	G	93.4	Very high	85.8	Confident	0 Å²	0	61 Å²	61	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-59.3	-46.7	175.2	0	0	0	0	0	113.3	L142 Q143 N144 R148 H149 R150 L214	L142-G146 PolarHBondContact O-N 3.28Å; Q143-G146 PolarHBondContact O-N 3.25Å; N144-G146 VanDerWaalsContact C-N 3.34Å; G146-R148 VanDerWaalsContact C-N 3.28Å; G146-R148 PolarHBondContact O-N 3.04Å; G146-H149 PolarHBondContact O-N 3.31Å; G146-R150 PolarHBondContact O-N 2.95Å; G146-R150 VanDerWaalsContact O-N 3.09Å; G146-L214 WeakPolarHBondContact CA-O 3.29Å
147	K	92.2	Very high	83.7	Confident	72 Å²	72	60.7 Å²	60.7	31%	0.313	30%	0.298	S	S	.	.	H	α-helix	trans	-60.5	-34.3	175.3	-69.1	171.4	-169.5	164.8	0	112.7	Q143 N144 R151 G217	Q143-K147 WeakPolarHBondContact O-CG 3.46Å; Q143-K147 PolarHBondContact O-N 3.31Å; N144-K147 PolarHBondContact O-N 3.46Å; N144-K147 PolarHBondContact OD1-NZ 3.02Å; K147-R151 PolarHBondContact O-N 3.2Å; K147-G217 WeakPolarHBondContact CG-O 3.35Å
148	R	89.1	Confident	81.9	Confident	125 Å²	125	63.1 Å²	63.1	47%	0.472	32%	0.315	S	S	.	.	H	α-helix	trans	-67.1	-44.3	175.9	-74.3	-168.8	-59.7	-96.9	11.6	111.3	N144 V145 G146 R150 R151 I152	N144-R148 WeakPolarHBondContact O-CG 3.47Å; N144-R148 PolarHBondContact O-N 3.46Å; V145-R148 WeakPolarHBondContact O-CB 3.43Å; V145-R148 PolarHBondContact O-N 3.36Å; G146-R148 VanDerWaalsContact C-N 3.28Å; G146-R148 PolarHBondContact O-N 3.04Å; R148-R150 VanDerWaalsContact C-N 3.32Å; R148-R150 PolarHBondContact O-N 2.98Å; R148-R151 WeakPolarHBondContact O-CB 3.2Å; R148-R151 PolarHBondContact O-N 3.09Å; R148-R151 VanDerWaalsContact O-N 3.16Å; R148-I152 WeakPolarHBondContact O-CG1 3.49Å; R148-I152 PolarHBondContact O-N 3.38Å; R148-I152 VanDerWaalsContact O-N 3.07Å
149	H	85.9	Confident	80.1	Confident	47 Å²	47	67.2 Å²	67.2	22%	0.218	34%	0.344	C	S	.	.	H	α-helix	trans	-59.5	-43.3	175.3	-75.7	82.3	0	0	0	111.5	V145 G146 R151 I152 S153 L171 F218	V145-H149 PolarHBondContact O-N 3.12Å; V145-H149 VanDerWaalsContact O-N 3.14Å; V145-H149 PolarHBondContact O-ND1 3.14Å; G146-H149 PolarHBondContact O-N 3.31Å; H149-R151 VanDerWaalsContact C-N 3.32Å; H149-R151 PolarHBondContact O-N 3.21Å; H149-I152 PolarHBondContact O-N 2.96Å; H149-S153 PolarHBondContact O-N 3.45Å; H149-S153 PolarHBondContact O-OG 2.89Å; H149-L171 HydrophobicContact CB-CD1 3.87Å; H149-L171 HydrophobicContact CB-CG 4.43Å; H149-F218 HydrophobicContact CB-CD2 4.21Å; H149-F218 HydrophobicContact CB-CE2 4.46Å
150	R	81.6	Confident	77.8	Confident	97 Å²	97	73.3 Å²	73.3	37%	0.366	37%	0.369	S	S	.	.	H	α-helix	trans	-57.5	-43.6	174.7	-179.1	166.8	172.1	-118.7	2.3	112.4	G146 R148 I152 S153 C154 F218 A220 S221	G146-R150 PolarHBondContact O-N 2.95Å; G146-R150 VanDerWaalsContact O-N 3.09Å; R148-R150 VanDerWaalsContact C-N 3.32Å; R148-R150 PolarHBondContact O-N 2.98Å; R150-I152 PolarHBondContact O-N 3.37Å; R150-S153 WeakPolarHBondContact O-CB 3.46Å; R150-S153 PolarHBondContact O-N 3.02Å; R150-C154 PolarHBondContact O-N 3.01Å; R150-C154 PolarHBondContact O-SG 3.27Å; R150-F218 VanDerWaalsContact CA-CE2 3.44Å; R150-F218 HydrophobicContact CB-CD2 3.6Å; R150-F218 HydrophobicContact CB-CE2 3.72Å; R150-F218 HydrophobicContact CB-CG 4.28Å; R150-F218 HydrophobicContact CB-CZ 4.45Å; R150-F218 WeakPolarHBondContact CD-O 3.43Å; R150-F218 HydrophobicContact CG-CE2 4.42Å; R150-A220 PolarHBondContact NH1-O 2.93Å; R150-S221 PolarHBondContact NH1-OXT 3.04Å
151	R	78.1	Confident	75.5	Confident	154 Å²	154	72.6 Å²	72.6	58%	0.581	38%	0.383	S	S	*	.	H	α-helix	trans	-61.5	-43.2	177.7	-78	-177	-99.6	173.5	-10.3	112.1	K147 R148 H149 C154 I155	K147-R151 PolarHBondContact O-N 3.2Å; R148-R151 WeakPolarHBondContact O-CB 3.2Å; R148-R151 PolarHBondContact O-N 3.09Å; R148-R151 VanDerWaalsContact O-N 3.16Å; H149-R151 VanDerWaalsContact C-N 3.32Å; H149-R151 PolarHBondContact O-N 3.21Å; R151-C154 PolarHBondContact O-N 3.44Å; R151-I155 VanDerWaalsContact O-CG1 3.28Å; R151-I155 WeakPolarHBondContact O-CG1 2.97Å; R151-I155 PolarHBondContact O-N 3.01Å; R151-I155 VanDerWaalsContact O-N 3.08Å
152	I	74.4	Confident	73.2	Confident	86 Å²	86	72 Å²	72	44%	0.441	39%	0.385	S	S	.	.	H	α-helix	trans	-62.7	-47.4	176.7	-64.3	167.1	0	0	0	110.2	R148 H149 R150 C154 I155 E156	R148-I152 WeakPolarHBondContact O-CG1 3.49Å; R148-I152 PolarHBondContact O-N 3.38Å; R148-I152 VanDerWaalsContact O-N 3.07Å; H149-I152 PolarHBondContact O-N 2.96Å; R150-I152 PolarHBondContact O-N 3.37Å; I152-C154 VanDerWaalsContact C-N 3.28Å; I152-C154 PolarHBondContact O-N 3.42Å; I152-I155 PolarHBondContact O-N 3.18Å; I152-I155 VanDerWaalsContact O-N 3.1Å; I152-E156 PolarHBondContact O-N 3.38Å
153	S	67.2	Low	70.8	Confident	8 Å²	8	78.5 Å²	78.5	6%	0.056	43%	0.425	C	S	.	.	H	α-helix	trans	-55.6	-38.8	175.8	-57.9	0	0	0	0	113.2	H149 R150 A157 S167 W170	H149-S153 PolarHBondContact O-N 3.45Å; H149-S153 PolarHBondContact O-OG 2.89Å; R150-S153 WeakPolarHBondContact O-CB 3.46Å; R150-S153 PolarHBondContact O-N 3.02Å; S153-A157 WeakPolarHBondContact O-CB 3.48Å; S153-A157 PolarHBondContact O-N 3.18Å; S153-S167 WeakPolarHBondContact CB-O 3.01Å; S153-S167 PolarHBondContact OG-O 3.44Å; S153-W170 VanDerWaalsContact OG-CD1 3.23Å
154	C	55.3	Low	68.6	Low	71 Å²	71	78.6 Å²	78.6	48%	0.48	43%	0.429	S	S	.	.	H	α-helix	trans	-73.3	-33.4	177.2	-67.5	0	0	0	0	113.5	R150 R151 I152 S158	R150-C154 PolarHBondContact O-N 3.01Å; R150-C154 PolarHBondContact O-SG 3.27Å; R151-C154 PolarHBondContact O-N 3.44Å; I152-C154 VanDerWaalsContact C-N 3.28Å; I152-C154 PolarHBondContact O-N 3.42Å; C154-S158 PolarHBondContact O-N 2.83Å; C154-S158 PolarHBondContact O-OG 3.01Å
155	I	59.4	Low	66.5	Low	107 Å²	107	82.2 Å²	82.2	55%	0.549	45%	0.453	S	S	.	.	H	α-helix	trans	-72.2	-41.8	178.8	-68.4	164.3	0	0	0	110.8	R151 I152 A157 S158 S159	R151-I155 VanDerWaalsContact O-CG1 3.28Å; R151-I155 WeakPolarHBondContact O-CG1 2.97Å; R151-I155 PolarHBondContact O-N 3.01Å; R151-I155 VanDerWaalsContact O-N 3.08Å; I152-I155 PolarHBondContact O-N 3.18Å; I152-I155 VanDerWaalsContact O-N 3.1Å; I155-A157 VanDerWaalsContact C-N 3.34Å; I155-S158 PolarHBondContact O-N 2.93Å; I155-S158 PolarHBondContact O-OG 3.45Å; I155-S159 WeakPolarHBondContact O-CB 3.28Å; I155-S159 PolarHBondContact O-N 3.3Å; I155-S159 VanDerWaalsContact O-N 3.15Å; I155-S159 PolarHBondContact O-OG 2.84Å
156	E	54.8	Low	64.6	Low	68 Å²	68	82.9 Å²	82.9	32%	0.318	46%	0.457	S	S	.	.	H	α-helix	trans	-65.4	-40.6	177.1	-69.3	-174.7	160.4	0	0	111.4	I152 S158 S159 F160	I152-E156 PolarHBondContact O-N 3.38Å; E156-S158 PolarHBondContact O-N 3.46Å; E156-S159 PolarHBondContact O-N 3.42Å; E156-F160 PolarHBondContact O-N 3.13Å
157	A	54.3	Low	62.7	Low	61 Å²	61	83.9 Å²	83.9	50%	0.504	46%	0.464	S	S	.	.	H	α-helix	trans	-63	-25.3	176.2	0	0	0	0	0	113.8	S153 I155	S153-A157 WeakPolarHBondContact O-CB 3.48Å; S153-A157 PolarHBondContact O-N 3.18Å; I155-A157 VanDerWaalsContact C-N 3.34Å
158	S	58.4	Low	61.1	Low	101 Å²	101	88.1 Å²	88.1	71%	0.706	48%	0.482	S	S	*	.	H	α-helix	trans	-93.9	-19.4	-179.9	69.3	0	0	0	0	114	C154 I155 E156	C154-S158 PolarHBondContact O-N 2.83Å; C154-S158 PolarHBondContact O-OG 3.01Å; I155-S158 PolarHBondContact O-N 2.93Å; I155-S158 PolarHBondContact O-OG 3.45Å; E156-S158 PolarHBondContact O-N 3.46Å
159	S	59.6	Low	60.3	Low	86 Å²	86	86.3 Å²	86.3	60%	0.601	48%	0.482	S	S	*	.	H	α-helix	trans	-103.8	-17.2	-172.4	53.2	0	0	0	0	114.6	I155 E156	I155-S159 WeakPolarHBondContact O-CB 3.28Å; I155-S159 PolarHBondContact O-N 3.3Å; I155-S159 VanDerWaalsContact O-N 3.15Å; I155-S159 PolarHBondContact O-OG 2.84Å; E156-S159 PolarHBondContact O-N 3.42Å
160	F	49.7	Very low	59.6	Low	147 Å²	147	85.2 Å²	85.2	65%	0.645	48%	0.476	S	S	*	.			trans	-141.4	122.5	-177.6	-154.9	-136.8	0	0	0	110.6	E156 V162	E156-F160 PolarHBondContact O-N 3.13Å; F160-V162 HydrophobicContact CD1-CB 3.33Å; F160-V162 HydrophobicContact CD1-CG1 4.27Å; F160-V162 HydrophobicContact CD1-CG2 3.29Å; F160-V162 HydrophobicContact CD2-CG2 4.5Å; F160-V162 HydrophobicContact CE1-CB 3.53Å; F160-V162 HydrophobicContact CE1-CG1 4.22Å; F160-V162 HydrophobicContact CE1-CG2 2.99Å; F160-V162 HydrophobicContact CE2-CG2 4.26Å; F160-V162 HydrophobicContact CG-CB 4.17Å; F160-V162 HydrophobicContact CG-CG2 4.03Å; F160-V162 HydrophobicContact CZ-CB 4.47Å; F160-V162 HydrophobicContact CZ-CG2 3.51Å; F160-V162 PolarHBondContact O-N 3.39Å
161	A	48.9	Very low	59.6	Low	103 Å²	103	81.3 Å²	81.3	85%	0.851	46%	0.462	S	S	*	.			trans	-70.5	26.6	175.7	0	0	0	0	0	113.1	T163	A161-T163 PolarHBondContact O-N 3Å
162	V	49.3	Very low	59.9	Low	67 Å²	67	75.6 Å²	75.6	41%	0.406	45%	0.446	S	S	.	.			trans	-90.4	113.1	179.9	166.7	0	0	0	0	109.8	F160 T164	F160-V162 HydrophobicContact CD1-CB 3.33Å; F160-V162 HydrophobicContact CD1-CG1 4.27Å; F160-V162 HydrophobicContact CD1-CG2 3.29Å; F160-V162 HydrophobicContact CD2-CG2 4.5Å; F160-V162 HydrophobicContact CE1-CB 3.53Å; F160-V162 HydrophobicContact CE1-CG1 4.22Å; F160-V162 HydrophobicContact CE1-CG2 2.99Å; F160-V162 HydrophobicContact CE2-CG2 4.26Å; F160-V162 HydrophobicContact CG-CB 4.17Å; F160-V162 HydrophobicContact CG-CG2 4.03Å; F160-V162 HydrophobicContact CZ-CB 4.47Å; F160-V162 HydrophobicContact CZ-CG2 3.51Å; F160-V162 PolarHBondContact O-N 3.39Å; V162-T164 HydrophobicContact CG1-CG2 3.66Å; V162-T164 PolarHBondContact O-N 3.29Å
163	T	47.5	Very low	60.5	Low	142 Å²	142	76.4 Å²	76.4	87%	0.871	45%	0.454	S	S	*	.			trans	-68.1	34.6	178.9	-10.9	0	0	0	0	113.3	A161 T165	A161-T163 PolarHBondContact O-N 3Å; T163-T165 PolarHBondContact O-N 3.34Å
164	T	50.9	Low	61.5	Low	49 Å²	49	78.7 Å²	78.7	30%	0.301	47%	0.474	S	S	.	.			trans	-81.3	109.5	171.8	46.3	0	0	0	0	108.3	V162 V166 S167	V162-T164 HydrophobicContact CG1-CG2 3.66Å; V162-T164 PolarHBondContact O-N 3.29Å; T164-V166 PolarHBondContact O-N 3.1Å; T164-S167 PolarHBondContact O-N 2.89Å; T164-S167 PolarHBondContact O-OG 3.02Å
165	T	52.3	Low	63.2	Low	122 Å²	122	76.3 Å²	76.3	75%	0.748	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-50	-18.5	179.6	37.6	0	0	0	0	114.7	T163 S167	T163-T165 PolarHBondContact O-N 3.34Å; T165-S167 PolarHBondContact O-N 3.42Å
166	V	54.1	Low	64.8	Low	28 Å²	28	71.6 Å²	71.6	17%	0.17	43%	0.432	C	S	.	.	G	3₁₀ helix	trans	-57.8	-33	178.2	-161.2	0	0	0	0	112.2	L87 A90 T164 K168 D169	L87-V166 HydrophobicContact CD2-CG1 4.11Å; A90-V166 HydrophobicContact CB-CG1 4.05Å; T164-V166 PolarHBondContact O-N 3.1Å; V166-K168 VanDerWaalsContact C-N 3.31Å; V166-K168 PolarHBondContact O-N 3.14Å; V166-K168 VanDerWaalsContact O-N 3.17Å; V166-D169 PolarHBondContact O-N 2.65Å
167	S	53.9	Low	66.7	Low	20 Å²	20	73.4 Å²	73.4	14%	0.14	44%	0.44	C	S	.	.	G	3₁₀ helix	trans	-67	-21.6	-168.6	-57.2	0	0	0	0	115.5	S153 T164 T165	S153-S167 WeakPolarHBondContact CB-O 3.01Å; S153-S167 PolarHBondContact OG-O 3.44Å; T164-S167 PolarHBondContact O-N 2.89Å; T164-S167 PolarHBondContact O-OG 3.02Å; T165-S167 PolarHBondContact O-N 3.42Å
168	K	57.6	Low	68.6	Low	162 Å²	162	72.7 Å²	72.7	70%	0.704	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-94.3	-15	179.1	-74.5	-173.6	179.1	177.9	0	114.3	V166	V166-K168 VanDerWaalsContact C-N 3.31Å; V166-K168 PolarHBondContact O-N 3.14Å; V166-K168 VanDerWaalsContact O-N 3.17Å
169	D	73.6	Confident	70.4	Confident	86 Å²	86	68.6 Å²	68.6	46%	0.46	40%	0.396	S	S	.	.			trans	-121.5	21.7	-160.3	-67.9	-21.8	0	0	0	113.5	V166 L171 S172 I175	V166-D169 PolarHBondContact O-N 2.65Å; D169-L171 PolarHBondContact O-N 2.86Å; D169-S172 VanDerWaalsContact O-CB 3.23Å; D169-S172 WeakPolarHBondContact O-CB 3.23Å; D169-S172 PolarHBondContact O-N 3.36Å; D169-S172 PolarHBondContact O-OG 3.15Å; D169-I175 VanDerWaalsContact O-CG1 3.31Å; D169-I175 WeakPolarHBondContact O-CG1 3.36Å
170	W	71.7	Confident	72.2	Confident	25 Å²	25	66.8 Å²	66.8	10%	0.095	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-24.4	-176.9	-86.7	99.8	0	0	0	115.3	A90 Y91 S153 I175	A90-W170 HydrophobicContact CB-CH2 3.28Å; A90-W170 HydrophobicContact CB-CZ2 3.24Å; A90-W170 HydrophobicContact CB-CZ3 4.27Å; Y91-W170 HydrophobicContact CE1-CH2 4.17Å; Y91-W170 HydrophobicContact CE1-CZ3 4.3Å; Y91-W170 HydrophobicContact CE2-CH2 4.29Å; Y91-W170 HydrophobicContact CE2-CZ3 4.47Å; Y91-W170 AromaticContact CZ-CH2 3.96Å; Y91-W170 AromaticContact CZ-CZ3 3.89Å; S153-W170 VanDerWaalsContact OG-CD1 3.23Å; W170-I175 WeakPolarHBondContact O-CG2 3.37Å
171	L	79.9	Confident	74.4	Confident	14 Å²	14	63.8 Å²	63.8	7%	0.073	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.8	25	173.6	-73	171.6	0	0	0	112.5	H149 D169 L176 L214 Q215 F218	H149-L171 HydrophobicContact CB-CD1 3.87Å; H149-L171 HydrophobicContact CB-CG 4.43Å; D169-L171 PolarHBondContact O-N 2.86Å; L171-L176 HydrophobicContact CB-CD1 4.44Å; L171-L176 HydrophobicContact CD2-CD1 4.13Å; L171-L176 HydrophobicContact CD2-CD2 3.75Å; L171-L176 HydrophobicContact CD2-CG 4.06Å; L171-L176 WeakPolarHBondContact O-CD1 3.28Å; L171-L214 HydrophobicContact CD1-CB 4.35Å; L171-L214 HydrophobicContact CD2-CB 4.26Å; L171-L214 HydrophobicContact CD2-CD1 4.39Å; L171-Q215 PolarHBondContact O-NE2 3.25Å; L171-F218 HydrophobicContact CB-CB 4.32Å; L171-F218 HydrophobicContact CB-CD1 4.48Å; L171-F218 HydrophobicContact CB-CD2 4.16Å; L171-F218 HydrophobicContact CB-CG 4.08Å; L171-F218 HydrophobicContact CD1-CB 3.72Å; L171-F218 HydrophobicContact CD1-CD2 3.73Å; L171-F218 HydrophobicContact CD1-CG 3.97Å; L171-F218 HydrophobicContact CG-CD2 4.31Å
172	S	85.1	Confident	76.8	Confident	34 Å²	34	58.9 Å²	58.9	24%	0.238	33%	0.326	C	S	.	.	S	Bend	trans	-60	154.5	167.2	66.5	0	0	0	0	110.3	D169 A174 I175 L176	D169-S172 VanDerWaalsContact O-CB 3.23Å; D169-S172 WeakPolarHBondContact O-CB 3.23Å; D169-S172 PolarHBondContact O-N 3.36Å; D169-S172 PolarHBondContact O-OG 3.15Å; S172-A174 PolarHBondContact O-N 3.36Å; S172-I175 PolarHBondContact O-N 3.44Å; S172-I175 VanDerWaalsContact O-N 3.15Å; S172-I175 WeakPolarHBondContact OG-CG1 3.46Å; S172-I175 PolarHBondContact OG-N 2.78Å; S172-L176 PolarHBondContact O-N 3.12Å
173	V	86.3	Confident	79.1	Confident	103 Å²	103	55.7 Å²	55.7	62%	0.624	31%	0.306	S	S	*	.	H	α-helix	trans	-54.5	-38.4	177.3	177.2	0	0	0	0	111	L176 Q177	V173-L176 PolarHBondContact O-N 2.92Å; V173-Q177 WeakPolarHBondContact O-CB 3.46Å; V173-Q177 PolarHBondContact O-N 3.33Å
174	A	88.8	Confident	81.5	Confident	57 Å²	57	50 Å²	50	47%	0.471	27%	0.27	S	S	.	.	H	α-helix	trans	-64.8	-44.2	179	0	0	0	0	0	112.8	S172 Q177 K178	S172-A174 PolarHBondContact O-N 3.36Å; A174-Q177 PolarHBondContact O-N 3.08Å; A174-K178 WeakPolarHBondContact O-CG 3.35Å; A174-K178 PolarHBondContact O-N 3.02Å; A174-K178 VanDerWaalsContact O-N 3.1Å
175	I	90.7	Very high	83.7	Confident	20 Å²	20	50.5 Å²	50.5	10%	0.103	27%	0.269	C	S	.	.	H	α-helix	trans	-68.2	-39.5	178.1	-64.7	-58.3	0	0	0	111.4	Y80 L87 D169 W170 S172 Q177 K178 L179	Y80-I175 WeakPolarHBondContact OH-CG2 3.4Å; L87-I175 HydrophobicContact CD1-CD1 4.22Å; L87-I175 HydrophobicContact CD2-CD1 3.5Å; D169-I175 VanDerWaalsContact O-CG1 3.31Å; D169-I175 WeakPolarHBondContact O-CG1 3.36Å; W170-I175 WeakPolarHBondContact O-CG2 3.37Å; S172-I175 PolarHBondContact O-N 3.44Å; S172-I175 VanDerWaalsContact O-N 3.15Å; S172-I175 WeakPolarHBondContact OG-CG1 3.46Å; S172-I175 PolarHBondContact OG-N 2.78Å; I175-Q177 VanDerWaalsContact C-N 3.35Å; I175-K178 HydrophobicContact CD1-CD 4.23Å; I175-K178 WeakPolarHBondContact O-CB 3.32Å; I175-K178 PolarHBondContact O-N 2.79Å; I175-L179 PolarHBondContact O-N 3.35Å
176	L	93.6	Very high	85.9	Confident	8 Å²	8	44.7 Å²	44.7	4%	0.042	23%	0.233	C	C	.	.	H	α-helix	trans	-67.1	-35.5	176.3	-77.8	164.7	0	0	0	112.3	L171 S172 V173 L179 Q180 F207 A211 L214 Q215	L171-L176 HydrophobicContact CB-CD1 4.44Å; L171-L176 HydrophobicContact CD2-CD1 4.13Å; L171-L176 HydrophobicContact CD2-CD2 3.75Å; L171-L176 HydrophobicContact CD2-CG 4.06Å; L171-L176 WeakPolarHBondContact O-CD1 3.28Å; S172-L176 PolarHBondContact O-N 3.12Å; V173-L176 PolarHBondContact O-N 2.92Å; L176-L179 PolarHBondContact O-N 2.92Å; L176-Q180 WeakPolarHBondContact O-CB 3.5Å; L176-Q180 PolarHBondContact O-N 3.39Å; L176-F207 WeakPolarHBondContact O-CE1 3.18Å; L176-F207 VanDerWaalsContact O-CZ 3.28Å; L176-F207 WeakPolarHBondContact O-CZ 3.45Å; L176-A211 HydrophobicContact CD1-CB 4.2Å; L176-A211 HydrophobicContact CD2-CB 4.21Å; L176-L214 HydrophobicContact CD2-CD1 4.41Å; L176-Q215 HydrophobicContact CD1-CG 3.51Å; L176-Q215 VanDerWaalsContact CD1-NE2 3.28Å
177	Q	94.1	Very high	88	Confident	106 Å²	106	43.4 Å²	43.4	50%	0.495	23%	0.225	S	C	.	.	H	α-helix	trans	-63.5	-44.3	173	-176.3	177.1	-8.8	0	0	111.5	V173 A174 I175 L179 Q180 E181	V173-Q177 WeakPolarHBondContact O-CB 3.46Å; V173-Q177 PolarHBondContact O-N 3.33Å; A174-Q177 PolarHBondContact O-N 3.08Å; I175-Q177 VanDerWaalsContact C-N 3.35Å; Q177-L179 VanDerWaalsContact C-N 3.3Å; Q177-L179 PolarHBondContact O-N 2.92Å; Q177-Q180 VanDerWaalsContact O-CB 3.28Å; Q177-Q180 WeakPolarHBondContact O-CB 3.4Å; Q177-Q180 PolarHBondContact O-N 3.46Å; Q177-Q180 VanDerWaalsContact O-N 3.13Å; Q177-E181 WeakPolarHBondContact O-CG 3.16Å; Q177-E181 PolarHBondContact O-N 3.2Å
178	K	94.3	Very high	90.1	Very high	46 Å²	46	47.1 Å²	47.1	20%	0.2	24%	0.237	C	C	.	.	H	α-helix	trans	-58.9	-41.3	173.4	-70	173.1	167.6	-151.4	0	111.9	Y80 N84 D86 L87 A174 I175 E181 G182	Y80-K178 HydrophobicContact CD2-CB 4.07Å; Y80-K178 WeakPolarHBondContact CD2-O 3.45Å; Y80-K178 HydrophobicContact CE2-CB 3.75Å; N84-K178 HydrophobicContact CB-CD 4.18Å; N84-K178 WeakPolarHBondContact OD1-CD 3.46Å; N84-K178 WeakPolarHBondContact OD1-CE 3.39Å; N84-K178 VanDerWaalsContact OD1-CG 3.23Å; N84-K178 WeakPolarHBondContact OD1-CG 3.46Å; N84-K178 PolarHBondContact OD1-NZ 3.29Å; N84-K178 VanDerWaalsContact OD1-NZ 3.14Å; D86-K178 IonicContact OD1-NZ 3.75Å; D86-K178 PolarHBondContact OD1-NZ 3.39Å; D86-K178 IonicContact OD2-NZ 2.74Å; D86-K178 PolarHBondContact OD2-NZ 2.81Å; D86-K178 VanDerWaalsContact OD2-NZ 3.11Å; L87-K178 HydrophobicContact CD1-CD 4.09Å; A174-K178 WeakPolarHBondContact O-CG 3.35Å; A174-K178 PolarHBondContact O-N 3.02Å; A174-K178 VanDerWaalsContact O-N 3.1Å; I175-K178 HydrophobicContact CD1-CD 4.23Å; I175-K178 WeakPolarHBondContact O-CB 3.32Å; I175-K178 PolarHBondContact O-N 2.79Å; K178-E181 PolarHBondContact O-N 3.21Å; K178-G182 PolarHBondContact O-N 3.3Å
179	L	96.3	Very high	92	Very high	15 Å²	15	43.4 Å²	43.4	8%	0.079	22%	0.221	C	C	.	.	H	α-helix	trans	-67.1	-37.8	175.5	179.2	61.7	0	0	0	111.8	Y80 Y117 I175 L176 Q177 E181 G182 F183 F207	Y80-L179 HydrophobicContact CD1-CD1 4.23Å; Y80-L179 HydrophobicContact CD2-CB 4.24Å; Y80-L179 HydrophobicContact CD2-CD1 4.47Å; Y80-L179 HydrophobicContact CE1-CD1 4.48Å; Y80-L179 HydrophobicContact CE2-CB 4.05Å; Y80-L179 HydrophobicContact CG-CD1 4.19Å; Y117-L179 HydrophobicContact CD1-CD1 3.87Å; Y117-L179 HydrophobicContact CD1-CD2 4.31Å; Y117-L179 HydrophobicContact CE1-CD1 4.21Å; Y117-L179 HydrophobicContact CE1-CD2 4.41Å; I175-L179 PolarHBondContact O-N 3.35Å; L176-L179 PolarHBondContact O-N 2.92Å; Q177-L179 VanDerWaalsContact C-N 3.3Å; Q177-L179 PolarHBondContact O-N 2.92Å; L179-E181 VanDerWaalsContact C-N 3.31Å; L179-E181 PolarHBondContact O-N 3.21Å; L179-G182 PolarHBondContact O-N 3.43Å; L179-F183 WeakPolarHBondContact O-CB 3.31Å; L179-F183 PolarHBondContact O-N 3.39Å; L179-F207 HydrophobicContact CB-CZ 4.22Å; L179-F207 HydrophobicContact CD2-CE2 4.4Å; L179-F207 HydrophobicContact CD2-CZ 4.35Å; L179-F207 HydrophobicContact CG-CE2 4.1Å; L179-F207 HydrophobicContact CG-CZ 4.15Å
180	Q	97.7	Very high	93.1	Very high	48 Å²	48	40.5 Å²	40.5	22%	0.224	21%	0.207	C	C	.	.	H	α-helix	trans	-59	-43.6	175.2	-168.1	172.4	11	0	0	111	L176 Q177 G182 F183 M184 F207	L176-Q180 WeakPolarHBondContact O-CB 3.5Å; L176-Q180 PolarHBondContact O-N 3.39Å; Q177-Q180 VanDerWaalsContact O-CB 3.28Å; Q177-Q180 WeakPolarHBondContact O-CB 3.4Å; Q177-Q180 PolarHBondContact O-N 3.46Å; Q177-Q180 VanDerWaalsContact O-N 3.13Å; Q180-G182 PolarHBondContact O-N 2.94Å; Q180-F183 WeakPolarHBondContact O-CB 3.32Å; Q180-F183 PolarHBondContact O-N 3.03Å; Q180-M184 HydrophobicContact CG-CG 4.17Å; Q180-M184 WeakPolarHBondContact O-CB 3.37Å; Q180-M184 WeakPolarHBondContact O-CG 3.41Å; Q180-M184 PolarHBondContact O-N 3.14Å; Q180-F207 HydrophobicContact CB-CD1 3.8Å; Q180-F207 HydrophobicContact CB-CD2 4.38Å; Q180-F207 HydrophobicContact CB-CE1 3.47Å; Q180-F207 VanDerWaalsContact CB-CE1 3.47Å; Q180-F207 HydrophobicContact CB-CE2 4.07Å; Q180-F207 HydrophobicContact CB-CG 4.25Å; Q180-F207 HydrophobicContact CB-CZ 3.62Å; Q180-F207 HydrophobicContact CG-CB 4.46Å; Q180-F207 HydrophobicContact CG-CD1 3.59Å; Q180-F207 HydrophobicContact CG-CD2 4.28Å; Q180-F207 HydrophobicContact CG-CE1 3.85Å; Q180-F207 HydrophobicContact CG-CE2 4.47Å; Q180-F207 HydrophobicContact CG-CG 3.84Å; Q180-F207 HydrophobicContact CG-CZ 4.28Å
181	E	96.9	Very high	94.3	Very high	85 Å²	85	39.6 Å²	39.6	40%	0.397	20%	0.204	S	C	.	.	H	α-helix	trans	-57.3	-48.7	177	-70.1	166.2	-172.8	0	0	111.2	Q177 K178 L179 F183 M184 E185	Q177-E181 WeakPolarHBondContact O-CG 3.16Å; Q177-E181 PolarHBondContact O-N 3.2Å; K178-E181 PolarHBondContact O-N 3.21Å; L179-E181 VanDerWaalsContact C-N 3.31Å; L179-E181 PolarHBondContact O-N 3.21Å; E181-F183 PolarHBondContact O-N 3.06Å; E181-M184 PolarHBondContact O-N 3.15Å; E181-E185 WeakPolarHBondContact O-CB 3.48Å; E181-E185 PolarHBondContact O-N 2.9Å
182	G	97.4	Very high	95.1	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-61.4	-40.7	174.5	0	0	0	0	0	113.7	K178 L179 Q180 E185 M186	K178-G182 PolarHBondContact O-N 3.3Å; L179-G182 PolarHBondContact O-N 3.43Å; Q180-G182 PolarHBondContact O-N 2.94Å; G182-E185 PolarHBondContact O-N 3.42Å; G182-M186 PolarHBondContact O-N 2.61Å
183	F	98.3	Very high	95.7	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-63.1	-44.6	176.9	177.5	-98.4	0	0	0	112.4	W62 M76 F121 L179 Q180 E181 E185 M186 A187 F203 F206 F207	W62-F183 AromaticContact CH2-CE2 3.78Å; W62-F183 HydrophobicContact CH2-CE2 3.78Å; W62-F183 HydrophobicContact CH2-CZ 4.25Å; W62-F183 AromaticContact CZ3-CE2 3.69Å; W62-F183 HydrophobicContact CZ3-CE2 3.69Å; W62-F183 AromaticContact CZ3-CZ 3.73Å; W62-F183 HydrophobicContact CZ3-CZ 3.73Å; M76-F183 HydrophobicContact CG-CB 4.38Å; M76-F183 HydrophobicContact SD-CB 4.17Å; M76-F183 HydrophobicContact SD-CD2 3.76Å; M76-F183 HydrophobicContact SD-CG 4.47Å; F121-F183 HydrophobicContact CB-CE2 4.46Å; F121-F183 HydrophobicContact CD1-CD2 4.35Å; F121-F183 AromaticContact CD1-CE2 3.74Å; F121-F183 HydrophobicContact CD1-CE2 3.74Å; F121-F183 HydrophobicContact CD1-CZ 4.21Å; F121-F183 HydrophobicContact CD2-CD2 4.4Å; F121-F183 HydrophobicContact CD2-CE2 4.25Å; F121-F183 HydrophobicContact CE1-CD2 4.18Å; F121-F183 AromaticContact CE1-CE2 3.97Å; F121-F183 HydrophobicContact CE1-CE2 3.97Å; F121-F183 HydrophobicContact CE1-CZ 4.44Å; F121-F183 HydrophobicContact CE2-CD2 4.24Å; F121-F183 HydrophobicContact CE2-CE2 4.46Å; F121-F183 HydrophobicContact CG-CD2 4.47Å; F121-F183 AromaticContact CG-CE2 3.9Å; F121-F183 HydrophobicContact CG-CE2 3.9Å; F121-F183 HydrophobicContact CZ-CD2 4.13Å; F121-F183 HydrophobicContact CZ-CE2 4.33Å; L179-F183 WeakPolarHBondContact O-CB 3.31Å; L179-F183 PolarHBondContact O-N 3.39Å; Q180-F183 WeakPolarHBondContact O-CB 3.32Å; Q180-F183 PolarHBondContact O-N 3.03Å; E181-F183 PolarHBondContact O-N 3.06Å; F183-E185 VanDerWaalsContact C-N 3.33Å; F183-M186 HydrophobicContact CD2-CE 4.11Å; F183-M186 HydrophobicContact CE2-CE 4.23Å; F183-A187 PolarHBondContact O-N 3.25Å; F183-A187 VanDerWaalsContact O-N 3.09Å; F183-F203 HydrophobicContact CD1-CD1 4.42Å; F183-F203 HydrophobicContact CE1-CB 4.09Å; F183-F203 AromaticContact CE1-CD1 3.53Å; F183-F203 HydrophobicContact CE1-CD1 3.53Å; F183-F203 HydrophobicContact CE1-CE1 4.48Å; F183-F203 HydrophobicContact CE1-CG 4.28Å; F183-F203 AromaticContact CZ-CD1 3.71Å; F183-F203 HydrophobicContact CZ-CD1 3.71Å; F183-F203 HydrophobicContact CZ-CE1 4.27Å; F183-F206 HydrophobicContact CZ-CD1 4.4Å; F183-F207 HydrophobicContact CB-CD2 4.05Å; F183-F207 HydrophobicContact CB-CE2 4.11Å; F183-F207 HydrophobicContact CD1-CB 4.27Å; F183-F207 AromaticContact CD1-CD2 3.73Å; F183-F207 HydrophobicContact CD1-CD2 3.73Å; F183-F207 HydrophobicContact CD1-CG 4.39Å; F183-F207 HydrophobicContact CD2-CD2 4.39Å; F183-F207 HydrophobicContact CE1-CB 4.15Å; F183-F207 HydrophobicContact CE1-CD2 4.21Å; F183-F207 AromaticContact CG-CD2 3.82Å; F183-F207 HydrophobicContact CG-CD2 3.82Å; F183-F207 HydrophobicContact CG-CE2 4.32Å
184	M	98.1	Very high	96.1	Very high	22 Å²	22	52.5 Å²	52.5	11%	0.108	25%	0.253	C	S	.	.	H	α-helix	trans	-67.4	-36.5	178.1	-66.6	-55.8	-75.8	0	0	111.3	Q180 E181 A187 R188 F195 E200 F203	Q180-M184 HydrophobicContact CG-CG 4.17Å; Q180-M184 WeakPolarHBondContact O-CB 3.37Å; Q180-M184 WeakPolarHBondContact O-CG 3.41Å; Q180-M184 PolarHBondContact O-N 3.14Å; E181-M184 PolarHBondContact O-N 3.15Å; M184-A187 PolarHBondContact O-N 3.03Å; M184-R188 WeakPolarHBondContact O-CB 3.28Å; M184-R188 PolarHBondContact O-N 2.89Å; M184-F195 HydrophobicContact CE-CZ 3.95Å; M184-E200 HydrophobicContact CE-CB 4.25Å; M184-E200 HydrophobicContact CE-CG 3.42Å; M184-E200 VanDerWaalsContact CE-CG 3.42Å; M184-E200 WeakPolarHBondContact CE-O 3.15Å; M184-F203 HydrophobicContact CE-CB 4.17Å; M184-F203 HydrophobicContact SD-CB 3.73Å
185	E	97.7	Very high	96.5	Very high	60 Å²	60	50.9 Å²	50.9	28%	0.28	24%	0.236	S	C	.	.	H	α-helix	trans	-74.7	-31	180	-140.1	64.9	133.7	0	0	113.8	K79 E181 G182 F183 R188 Q189	K79-E185 HydrophobicContact CB-CB 4.5Å; K79-E185 HydrophobicContact CG-CB 4.33Å; E181-E185 WeakPolarHBondContact O-CB 3.48Å; E181-E185 PolarHBondContact O-N 2.9Å; G182-E185 PolarHBondContact O-N 3.42Å; F183-E185 VanDerWaalsContact C-N 3.33Å; E185-R188 VanDerWaalsContact OE2-CD 3.3Å; E185-R188 WeakPolarHBondContact OE2-CD 3.25Å; E185-R188 IonicContact OE2-CZ 3.9Å; E185-R188 IonicContact OE2-NE 2.82Å; E185-R188 PolarHBondContact OE2-NE 2.88Å; E185-R188 IonicContact OE2-NH2 3.87Å; E185-Q189 WeakPolarHBondContact O-CB 3.5Å; E185-Q189 VanDerWaalsContact O-CG 3.3Å; E185-Q189 WeakPolarHBondContact O-CG 3.21Å; E185-Q189 PolarHBondContact O-N 3Å; E185-Q189 VanDerWaalsContact O-N 3.12Å
186	M	98.1	Very high	96.8	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-60.1	-49.2	164.2	173.9	-79.5	-65.5	0	0	111.2	W62 V65 C72 L75 M76 L118 G182 F183 R188 Q189 V190	W62-M186 HydrophobicContact CZ3-CE 4.43Å; V65-M186 HydrophobicContact CG1-CE 4.17Å; V65-M186 HydrophobicContact CG1-SD 3.98Å; V65-M186 HydrophobicContact CG2-CE 4.49Å; V65-M186 HydrophobicContact CG2-SD 4.05Å; C72-M186 HydrophobicContact CB-CG 3.85Å; C72-M186 HydrophobicContact CB-SD 3.85Å; C72-M186 VanDerWaalsContact O-CG 3.3Å; C72-M186 WeakPolarHBondContact O-CG 3.19Å; L75-M186 HydrophobicContact CB-CG 4.5Å; L75-M186 HydrophobicContact CD2-CB 4.44Å; L75-M186 HydrophobicContact CD2-CG 4.49Å; L75-M186 HydrophobicContact CG-CB 4.4Å; M76-M186 HydrophobicContact CB-CB 3.79Å; M76-M186 HydrophobicContact CB-CG 4.09Å; L118-M186 HydrophobicContact CD1-CE 4.25Å; G182-M186 PolarHBondContact O-N 2.61Å; F183-M186 HydrophobicContact CD2-CE 4.11Å; F183-M186 HydrophobicContact CE2-CE 4.23Å; M186-R188 PolarHBondContact O-N 2.93Å; M186-Q189 PolarHBondContact O-N 2.74Å; M186-V190 WeakPolarHBondContact O-CG1 3.3Å; M186-V190 PolarHBondContact O-N 2.86Å; M186-V190 HydrophobicContact SD-CG1 4.01Å
187	A	98.1	Very high	97	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-62.2	-42.4	-178.4	0	0	0	0	0	111.8	F183 M184 L191 F195 F203	F183-A187 PolarHBondContact O-N 3.25Å; F183-A187 VanDerWaalsContact O-N 3.09Å; M184-A187 PolarHBondContact O-N 3.03Å; A187-L191 WeakPolarHBondContact O-CB 3.47Å; A187-L191 WeakPolarHBondContact O-CG 3.48Å; A187-L191 PolarHBondContact O-N 3.29Å; A187-F195 HydrophobicContact CB-CD2 4.21Å; A187-F195 HydrophobicContact CB-CE2 3.66Å; A187-F203 HydrophobicContact CB-CD1 3.57Å; A187-F203 HydrophobicContact CB-CE1 3.54Å; A187-F203 HydrophobicContact CB-CG 4.16Å; A187-F203 HydrophobicContact CB-CZ 4.1Å
188	R	98.1	Very high	97	Very high	99 Å²	99	61.9 Å²	61.9	37%	0.374	29%	0.289	S	S	.	.	H	α-helix	trans	-59.2	-47.5	176.3	-169.6	-176.7	-51.9	-76	-6.9	111.7	M184 E185 M186 Q192 F195 E200	M184-R188 WeakPolarHBondContact O-CB 3.28Å; M184-R188 PolarHBondContact O-N 2.89Å; E185-R188 VanDerWaalsContact OE2-CD 3.3Å; E185-R188 WeakPolarHBondContact OE2-CD 3.25Å; E185-R188 IonicContact OE2-CZ 3.9Å; E185-R188 IonicContact OE2-NE 2.82Å; E185-R188 PolarHBondContact OE2-NE 2.88Å; E185-R188 IonicContact OE2-NH2 3.87Å; M186-R188 PolarHBondContact O-N 2.93Å; R188-Q192 PolarHBondContact O-N 3.08Å; R188-F195 HydrophobicContact CB-CD1 3.98Å; R188-F195 HydrophobicContact CB-CD2 4.44Å; R188-F195 HydrophobicContact CB-CE1 4.05Å; R188-F195 HydrophobicContact CB-CG 4.17Å; R188-F195 HydrophobicContact CB-CZ 4.3Å; R188-F195 HydrophobicContact CG-CD1 3.81Å; R188-F195 HydrophobicContact CG-CE1 4.17Å; R188-F195 HydrophobicContact CG-CG 4.26Å; R188-F195 VanDerWaalsContact NH1-CE1 3.31Å; R188-E200 IonicContact CZ-OE1 2.65Å; R188-E200 IonicContact NH1-OE1 2.97Å; R188-E200 IonicContact NH2-OE1 2.93Å; R188-E200 PolarHBondContact NH2-OE1 2.86Å
189	Q	96.9	Very high	97.1	Very high	83 Å²	83	59.7 Å²	59.7	39%	0.388	28%	0.28	S	S	.	.	H	α-helix	trans	-70.8	-41.4	-177	-74.6	-176.1	59.6	0	0	113.3	L75 E185 M186 Q192	L75-Q189 HydrophobicContact CD2-CB 3.66Å; L75-Q189 HydrophobicContact CD2-CG 4.28Å; E185-Q189 WeakPolarHBondContact O-CB 3.5Å; E185-Q189 VanDerWaalsContact O-CG 3.3Å; E185-Q189 WeakPolarHBondContact O-CG 3.21Å; E185-Q189 PolarHBondContact O-N 3Å; E185-Q189 VanDerWaalsContact O-N 3.12Å; M186-Q189 PolarHBondContact O-N 2.74Å; Q189-Q192 WeakPolarHBondContact O-CG 3.36Å
190	V	97	Very high	97.2	Very high	26 Å²	26	62.3 Å²	62.3	16%	0.158	29%	0.292	C	S	.	.	H	α-helix	trans	-77.2	-29.5	-178.5	74.2	0	0	0	0	112.9	T64 V65 N68 M186	T64-V190 HydrophobicContact CG2-CG2 4.18Å; V65-V190 HydrophobicContact CG2-CG1 4.01Å; N68-V190 HydrophobicContact CB-CG2 4.27Å; M186-V190 WeakPolarHBondContact O-CG1 3.3Å; M186-V190 PolarHBondContact O-N 2.86Å; M186-V190 HydrophobicContact SD-CG1 4.01Å
191	L	97.2	Very high	97.2	Very high	5 Å²	5	64.2 Å²	64.2	3%	0.026	30%	0.303	C	S	.	.	H	α-helix	trans	-90.6	-20.6	-179.8	-65.7	171.4	0	0	0	113.3	F61 T64 A187 D193 R194 F195 C199 F203	F61-L191 HydrophobicContact CB-CD1 4.05Å; F61-L191 HydrophobicContact CB-CD2 4.29Å; F61-L191 HydrophobicContact CD1-CD2 4.47Å; T64-L191 HydrophobicContact CG2-CD2 4.13Å; A187-L191 WeakPolarHBondContact O-CB 3.47Å; A187-L191 WeakPolarHBondContact O-CG 3.48Å; A187-L191 PolarHBondContact O-N 3.29Å; L191-D193 PolarHBondContact O-N 3.13Å; L191-R194 HydrophobicContact CB-CB 4.29Å; L191-R194 WeakPolarHBondContact O-CA 3.41Å; L191-R194 VanDerWaalsContact O-CB 3.28Å; L191-R194 WeakPolarHBondContact O-CB 3.43Å; L191-R194 PolarHBondContact O-N 2.98Å; L191-F195 HydrophobicContact CB-CB 4.03Å; L191-F195 HydrophobicContact CB-CD2 4.39Å; L191-F195 HydrophobicContact CD1-CD2 4.06Å; L191-C199 WeakPolarHBondContact CD1-SG 3.38Å; L191-F203 HydrophobicContact CD1-CE2 3.71Å; L191-F203 HydrophobicContact CD1-CZ 3.78Å
192	Q	96.5	Very high	97.3	Very high	144 Å²	144	60.2 Å²	60.2	67%	0.673	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	49.1	-123.9	177	-57	-176.7	-31.8	0	0	111	R188 Q189 R194 F195	R188-Q192 PolarHBondContact O-N 3.08Å; Q189-Q192 WeakPolarHBondContact O-CG 3.36Å; Q192-R194 PolarHBondContact O-N 3.17Å; Q192-F195 VanDerWaalsContact O-CB 3.25Å; Q192-F195 WeakPolarHBondContact O-CB 2.99Å; Q192-F195 PolarHBondContact O-N 3.23Å
193	D	96.9	Very high	97.3	Very high	160 Å²	160	60.2 Å²	60.2	86%	0.856	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-59.4	-18.6	179.6	-61.6	-30	0	0	0	114	L191 F195	L191-D193 PolarHBondContact O-N 3.13Å; D193-F195 VanDerWaalsContact C-N 3.31Å
194	R	95.7	Very high	97.3	Very high	119 Å²	119	60.8 Å²	60.8	45%	0.449	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-79.9	-13.6	174.8	-58.4	-176.6	64.3	-154.7	-4.8	112.7	T64 L191 Q192 T196	T64-R194 PolarHBondContact OG1-NH1 3.18Å; L191-R194 HydrophobicContact CB-CB 4.29Å; L191-R194 WeakPolarHBondContact O-CA 3.41Å; L191-R194 VanDerWaalsContact O-CB 3.28Å; L191-R194 WeakPolarHBondContact O-CB 3.43Å; L191-R194 PolarHBondContact O-N 2.98Å; Q192-R194 PolarHBondContact O-N 3.17Å; R194-T196 PolarHBondContact O-N 3.45Å
195	F	97.4	Very high	97.3	Very high	23 Å²	23	62.4 Å²	62.4	10%	0.101	30%	0.297	C	S	.	.			trans	-76.4	74.1	176.7	-162.8	-98.6	0	0	0	111.1	M184 A187 R188 L191 Q192 D193 E200	M184-F195 HydrophobicContact CE-CZ 3.95Å; A187-F195 HydrophobicContact CB-CD2 4.21Å; A187-F195 HydrophobicContact CB-CE2 3.66Å; R188-F195 HydrophobicContact CB-CD1 3.98Å; R188-F195 HydrophobicContact CB-CD2 4.44Å; R188-F195 HydrophobicContact CB-CE1 4.05Å; R188-F195 HydrophobicContact CB-CG 4.17Å; R188-F195 HydrophobicContact CB-CZ 4.3Å; R188-F195 HydrophobicContact CG-CD1 3.81Å; R188-F195 HydrophobicContact CG-CE1 4.17Å; R188-F195 HydrophobicContact CG-CG 4.26Å; R188-F195 VanDerWaalsContact NH1-CE1 3.31Å; L191-F195 HydrophobicContact CB-CB 4.03Å; L191-F195 HydrophobicContact CB-CD2 4.39Å; L191-F195 HydrophobicContact CD1-CD2 4.06Å; Q192-F195 VanDerWaalsContact O-CB 3.25Å; Q192-F195 WeakPolarHBondContact O-CB 2.99Å; Q192-F195 PolarHBondContact O-N 3.23Å; D193-F195 VanDerWaalsContact C-N 3.31Å; F195-E200 HydrophobicContact CE1-CB 3.76Å; F195-E200 HydrophobicContact CE1-CG 3.86Å; F195-E200 HydrophobicContact CE2-CB 4.44Å; F195-E200 HydrophobicContact CZ-CB 3.69Å; F195-E200 HydrophobicContact CZ-CG 3.77Å
196	T	97.1	Very high	97.3	Very high	70 Å²	70	59.5 Å²	59.5	43%	0.429	28%	0.283	S	S	.	.			trans	-83.6	165.1	175.1	59.9	0	0	0	0	111.4	R194 K198 C199 E200	R194-T196 PolarHBondContact O-N 3.45Å; T196-K198 PolarHBondContact O-N 2.93Å; T196-K198 VanDerWaalsContact O-N 3.14Å; T196-C199 CarbonylContact O-C 3.17Å; T196-C199 WeakPolarHBondContact O-CA 3.38Å; T196-C199 VanDerWaalsContact O-CB 3.25Å; T196-C199 WeakPolarHBondContact O-CB 3.24Å; T196-C199 PolarHBondContact O-N 3.04Å; T196-C199 PolarHBondContact OG1-N 3.19Å; T196-E200 PolarHBondContact O-N 2.91Å
197	E	96.9	Very high	97.4	Very high	166 Å²	166	59.7 Å²	59.7	78%	0.776	28%	0.284	S	S	*	.	H	α-helix	trans	-51.7	-38	172.5	-174.8	-174.2	177.5	0	0	112.4	C199 E200 N201	E197-C199 PolarHBondContact O-N 2.95Å; E197-E200 PolarHBondContact O-N 3.48Å; E197-N201 WeakPolarHBondContact O-CB 3.39Å; E197-N201 PolarHBondContact O-N 3.42Å
198	K	95.1	Very high	97.3	Very high	128 Å²	128	63.9 Å²	63.9	56%	0.557	31%	0.307	S	S	*	.	H	α-helix	trans	-64.4	-39.4	175.1	-177.1	176.8	179	179.9	0	112.4	T196 S202	T196-K198 PolarHBondContact O-N 2.93Å; T196-K198 VanDerWaalsContact O-N 3.14Å; K198-S202 PolarHBondContact O-N 3.17Å; K198-S202 VanDerWaalsContact O-N 3.17Å; K198-S202 PolarHBondContact O-OG 3.16Å
199	C	96.7	Very high	97.4	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-66.3	-50.5	175.2	-177	0	0	0	0	110.2	F61 L191 T196 E197 N201 S202 F203	F61-C199 HydrophobicContact CD2-CB 4.24Å; F61-C199 HydrophobicContact CE1-CB 4.4Å; F61-C199 HydrophobicContact CE2-CB 3.94Å; F61-C199 HydrophobicContact CZ-CB 4.03Å; L191-C199 WeakPolarHBondContact CD1-SG 3.38Å; T196-C199 CarbonylContact O-C 3.17Å; T196-C199 WeakPolarHBondContact O-CA 3.38Å; T196-C199 VanDerWaalsContact O-CB 3.25Å; T196-C199 WeakPolarHBondContact O-CB 3.24Å; T196-C199 PolarHBondContact O-N 3.04Å; T196-C199 PolarHBondContact OG1-N 3.19Å; E197-C199 PolarHBondContact O-N 2.95Å; C199-N201 VanDerWaalsContact C-N 3.35Å; C199-N201 PolarHBondContact O-N 3.23Å; C199-S202 WeakPolarHBondContact O-CA 3.45Å; C199-S202 WeakPolarHBondContact O-CB 3.27Å; C199-S202 PolarHBondContact O-N 2.88Å; C199-F203 WeakPolarHBondContact O-CD2 3.48Å; C199-F203 PolarHBondContact O-N 2.89Å; C199-F203 VanDerWaalsContact SG-CE2 3.51Å
200	E	98	Very high	97.4	Very high	71 Å²	71	55.9 Å²	55.9	33%	0.332	27%	0.273	S	S	.	.	H	α-helix	trans	-52.3	-50.6	177.6	-173.7	163.8	-146.7	0	0	111.7	M184 R188 F195 T196 E197 S202 F203 G204	M184-E200 HydrophobicContact CE-CB 4.25Å; M184-E200 HydrophobicContact CE-CG 3.42Å; M184-E200 VanDerWaalsContact CE-CG 3.42Å; M184-E200 WeakPolarHBondContact CE-O 3.15Å; R188-E200 IonicContact CZ-OE1 2.65Å; R188-E200 IonicContact NH1-OE1 2.97Å; R188-E200 IonicContact NH2-OE1 2.93Å; R188-E200 PolarHBondContact NH2-OE1 2.86Å; F195-E200 HydrophobicContact CE1-CB 3.76Å; F195-E200 HydrophobicContact CE1-CG 3.86Å; F195-E200 HydrophobicContact CE2-CB 4.44Å; F195-E200 HydrophobicContact CZ-CB 3.69Å; F195-E200 HydrophobicContact CZ-CG 3.77Å; T196-E200 PolarHBondContact O-N 2.91Å; E197-E200 PolarHBondContact O-N 3.48Å; E200-S202 VanDerWaalsContact C-N 3.3Å; E200-S202 PolarHBondContact O-N 3.45Å; E200-F203 PolarHBondContact O-N 3.33Å; E200-G204 PolarHBondContact O-N 3.28Å
201	N	97.7	Very high	97.4	Very high	87 Å²	87	55.1 Å²	55.1	47%	0.465	27%	0.27	S	S	.	.	H	α-helix	trans	-59.6	-39.2	175.6	-174.5	16.4	0	0	0	112.5	E197 C199 G204 K205	E197-N201 WeakPolarHBondContact O-CB 3.39Å; E197-N201 PolarHBondContact O-N 3.42Å; C199-N201 VanDerWaalsContact C-N 3.35Å; C199-N201 PolarHBondContact O-N 3.23Å; N201-G204 PolarHBondContact O-N 3.24Å; N201-K205 WeakPolarHBondContact O-CB 3.45Å; N201-K205 VanDerWaalsContact O-CG 3.27Å; N201-K205 WeakPolarHBondContact O-CG 3.47Å; N201-K205 PolarHBondContact O-N 3.09Å; N201-K205 VanDerWaalsContact OD1-CE 3.32Å; N201-K205 WeakPolarHBondContact OD1-CE 3.34Å
202	S	97.8	Very high	97.4	Very high	2 Å²	2	60.7 Å²	60.7	1%	0.014	29%	0.294	C	S	.	.	H	α-helix	trans	-66.6	-40.7	178.5	-56.7	0	0	0	0	112.1	K198 C199 E200 F206	K198-S202 PolarHBondContact O-N 3.17Å; K198-S202 VanDerWaalsContact O-N 3.17Å; K198-S202 PolarHBondContact O-OG 3.16Å; C199-S202 WeakPolarHBondContact O-CA 3.45Å; C199-S202 WeakPolarHBondContact O-CB 3.27Å; C199-S202 PolarHBondContact O-N 2.88Å; E200-S202 VanDerWaalsContact C-N 3.3Å; E200-S202 PolarHBondContact O-N 3.45Å; S202-F206 PolarHBondContact O-N 3.43Å
203	F	98.4	Very high	97.4	Very high	0 Å²	0	54 Å²	54	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-66.9	-44.2	175.2	-87.1	-105.8	0	0	0	111.6	F58 F61 W62 V65 F183 M184 A187 L191 C199 E200 F206 F207	F58-F203 HydrophobicContact CD2-CD2 4.08Å; F58-F203 HydrophobicContact CD2-CE2 4.24Å; F58-F203 HydrophobicContact CE2-CD1 4.2Å; F58-F203 AromaticContact CE2-CD2 3.83Å; F58-F203 HydrophobicContact CE2-CD2 3.83Å; F58-F203 HydrophobicContact CE2-CE1 4.35Å; F58-F203 HydrophobicContact CE2-CE2 4.01Å; F58-F203 AromaticContact CE2-CG 3.93Å; F58-F203 HydrophobicContact CE2-CG 3.93Å; F58-F203 HydrophobicContact CE2-CZ 4.26Å; F61-F203 HydrophobicContact CB-CE2 3.74Å; F61-F203 HydrophobicContact CB-CZ 4.22Å; F61-F203 HydrophobicContact CG-CE2 4.49Å; W62-F203 AromaticContact CE3-CE1 3.72Å; W62-F203 HydrophobicContact CE3-CE1 3.72Å; W62-F203 HydrophobicContact CE3-CZ 4.08Å; W62-F203 HydrophobicContact CZ3-CD1 4.47Å; W62-F203 AromaticContact CZ3-CE1 3.78Å; W62-F203 HydrophobicContact CZ3-CE1 3.78Å; V65-F203 HydrophobicContact CG2-CE1 4.45Å; V65-F203 HydrophobicContact CG2-CZ 4.39Å; F183-F203 HydrophobicContact CD1-CD1 4.42Å; F183-F203 HydrophobicContact CE1-CB 4.09Å; F183-F203 AromaticContact CE1-CD1 3.53Å; F183-F203 HydrophobicContact CE1-CD1 3.53Å; F183-F203 HydrophobicContact CE1-CE1 4.48Å; F183-F203 HydrophobicContact CE1-CG 4.28Å; F183-F203 AromaticContact CZ-CD1 3.71Å; F183-F203 HydrophobicContact CZ-CD1 3.71Å; F183-F203 HydrophobicContact CZ-CE1 4.27Å; M184-F203 HydrophobicContact CE-CB 4.17Å; M184-F203 HydrophobicContact SD-CB 3.73Å; A187-F203 HydrophobicContact CB-CD1 3.57Å; A187-F203 HydrophobicContact CB-CE1 3.54Å; A187-F203 HydrophobicContact CB-CG 4.16Å; A187-F203 HydrophobicContact CB-CZ 4.1Å; L191-F203 HydrophobicContact CD1-CE2 3.71Å; L191-F203 HydrophobicContact CD1-CZ 3.78Å; C199-F203 WeakPolarHBondContact O-CD2 3.48Å; C199-F203 PolarHBondContact O-N 2.89Å; C199-F203 VanDerWaalsContact SG-CE2 3.51Å; E200-F203 PolarHBondContact O-N 3.33Å; F203-F206 PolarHBondContact O-N 3.45Å; F203-F207 WeakPolarHBondContact O-CB 3.43Å; F203-F207 PolarHBondContact O-N 3.17Å
204	G	98.3	Very high	97.4	Very high	11 Å²	11	47 Å²	47	11%	0.113	23%	0.225	C	C	.	.	H	α-helix	trans	-59.1	-50.2	177.4	0	0	0	0	0	112.3	E200 N201 F206 F207 D208	E200-G204 PolarHBondContact O-N 3.28Å; N201-G204 PolarHBondContact O-N 3.24Å; G204-F206 VanDerWaalsContact C-N 3.32Å; G204-F206 PolarHBondContact O-N 2.81Å; G204-F207 WeakPolarHBondContact O-CB 3.29Å; G204-F207 PolarHBondContact O-N 3.26Å; G204-F207 VanDerWaalsContact O-N 3.16Å; G204-D208 VanDerWaalsContact O-CG 3.29Å; G204-D208 PolarHBondContact O-N 2.86Å
205	K	97.8	Very high	97.3	Very high	56 Å²	56	43.8 Å²	43.8	24%	0.243	22%	0.216	C	C	.	.	H	α-helix	trans	-54.5	-45.5	174.7	-80	174.7	177.8	-167.2	0	113.2	P48 E54 N201 D208 F209	P48-K205 HydrophobicContact CB-CB 3.93Å; P48-K205 HydrophobicContact CG-CB 4.1Å; P48-K205 VanDerWaalsContact CG-O 3.29Å; P48-K205 WeakPolarHBondContact CG-O 3.45Å; E54-K205 IonicContact OE1-NZ 2.78Å; E54-K205 PolarHBondContact OE1-NZ 3.02Å; N201-K205 WeakPolarHBondContact O-CB 3.45Å; N201-K205 VanDerWaalsContact O-CG 3.27Å; N201-K205 WeakPolarHBondContact O-CG 3.47Å; N201-K205 PolarHBondContact O-N 3.09Å; N201-K205 VanDerWaalsContact OD1-CE 3.32Å; N201-K205 WeakPolarHBondContact OD1-CE 3.34Å; K205-D208 PolarHBondContact O-N 3.42Å; K205-F209 PolarHBondContact O-N 2.86Å; K205-F209 VanDerWaalsContact O-N 3.09Å
206	F	98.5	Very high	97.2	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-65.5	-43.3	178.3	179.6	-110.1	0	0	0	111.7	F49 F58 F121 A124 I125 I128 F183 S202 F203 G204 D208 F209 V210	F49-F206 HydrophobicContact CE2-CD2 4.46Å; F49-F206 HydrophobicContact CZ-CB 4.06Å; F49-F206 HydrophobicContact CZ-CD2 4.42Å; F58-F206 HydrophobicContact CE1-CB 4.05Å; F58-F206 AromaticContact CE1-CD1 3.93Å; F58-F206 HydrophobicContact CE1-CD1 3.93Å; F58-F206 AromaticContact CE1-CD2 3.92Å; F58-F206 HydrophobicContact CE1-CD2 3.92Å; F58-F206 HydrophobicContact CE1-CE1 4.4Å; F58-F206 HydrophobicContact CE1-CE2 4.42Å; F58-F206 AromaticContact CE1-CG 3.67Å; F58-F206 HydrophobicContact CE1-CG 3.67Å; F58-F206 HydrophobicContact CE2-CB 3.98Å; F58-F206 HydrophobicContact CE2-CD1 4.36Å; F58-F206 HydrophobicContact CE2-CG 4.29Å; F58-F206 HydrophobicContact CZ-CB 3.64Å; F58-F206 AromaticContact CZ-CD1 3.41Å; F58-F206 HydrophobicContact CZ-CD1 3.41Å; F58-F206 VanDerWaalsContact CZ-CD1 3.41Å; F58-F206 HydrophobicContact CZ-CD2 4.19Å; F58-F206 HydrophobicContact CZ-CE1 4.12Å; F58-F206 AromaticContact CZ-CG 3.45Å; F58-F206 HydrophobicContact CZ-CG 3.45Å; F58-F206 VanDerWaalsContact CZ-CG 3.45Å; F121-F206 HydrophobicContact CB-CE1 4.26Å; F121-F206 HydrophobicContact CD1-CD1 4.47Å; F121-F206 AromaticContact CD1-CE1 3.88Å; F121-F206 HydrophobicContact CD1-CE1 3.88Å; A124-F206 HydrophobicContact CB-CZ 4.16Å; I125-F206 HydrophobicContact CD1-CD1 4.31Å; I125-F206 HydrophobicContact CD1-CE1 3.63Å; I125-F206 HydrophobicContact CD1-CZ 3.79Å; I125-F206 HydrophobicContact CG1-CE1 3.79Å; I125-F206 HydrophobicContact CG1-CE2 3.9Å; I125-F206 HydrophobicContact CG1-CZ 3.37Å; I128-F206 HydrophobicContact CD1-CE2 4.08Å; F183-F206 HydrophobicContact CZ-CD1 4.4Å; S202-F206 PolarHBondContact O-N 3.43Å; F203-F206 PolarHBondContact O-N 3.45Å; G204-F206 VanDerWaalsContact C-N 3.32Å; G204-F206 PolarHBondContact O-N 2.81Å; F206-D208 VanDerWaalsContact C-N 3.33Å; F206-D208 PolarHBondContact O-N 3.36Å; F206-F209 HydrophobicContact CE2-CD1 4.42Å; F206-F209 WeakPolarHBondContact O-CB 3.47Å; F206-F209 PolarHBondContact O-N 3.48Å; F206-V210 HydrophobicContact CD1-CG2 4.45Å; F206-V210 HydrophobicContact CE1-CG2 3.93Å; F206-V210 HydrophobicContact CE2-CG2 4.1Å; F206-V210 HydrophobicContact CZ-CG2 3.71Å; F206-V210 PolarHBondContact O-N 2.93Å
207	F	98.5	Very high	97	Very high	3 Å²	3	43.3 Å²	43.3	1%	0.013	21%	0.209	C	C	.	.	H	α-helix	trans	-58.3	-46	174.9	-172.9	-82.6	0	0	0	111.2	F121 L176 L179 Q180 F183 F203 G204 F209 V210 A211	F121-F207 AromaticContact CE1-CD2 3.72Å; F121-F207 HydrophobicContact CE1-CD2 3.72Å; F121-F207 HydrophobicContact CE1-CE2 4.03Å; F121-F207 AromaticContact CZ-CD2 3.89Å; F121-F207 HydrophobicContact CZ-CD2 3.89Å; F121-F207 AromaticContact CZ-CE2 3.73Å; F121-F207 HydrophobicContact CZ-CE2 3.73Å; L176-F207 WeakPolarHBondContact O-CE1 3.18Å; L176-F207 VanDerWaalsContact O-CZ 3.28Å; L176-F207 WeakPolarHBondContact O-CZ 3.45Å; L179-F207 HydrophobicContact CB-CZ 4.22Å; L179-F207 HydrophobicContact CD2-CE2 4.4Å; L179-F207 HydrophobicContact CD2-CZ 4.35Å; L179-F207 HydrophobicContact CG-CE2 4.1Å; L179-F207 HydrophobicContact CG-CZ 4.15Å; Q180-F207 HydrophobicContact CB-CD1 3.8Å; Q180-F207 HydrophobicContact CB-CD2 4.38Å; Q180-F207 HydrophobicContact CB-CE1 3.47Å; Q180-F207 VanDerWaalsContact CB-CE1 3.47Å; Q180-F207 HydrophobicContact CB-CE2 4.07Å; Q180-F207 HydrophobicContact CB-CG 4.25Å; Q180-F207 HydrophobicContact CB-CZ 3.62Å; Q180-F207 HydrophobicContact CG-CB 4.46Å; Q180-F207 HydrophobicContact CG-CD1 3.59Å; Q180-F207 HydrophobicContact CG-CD2 4.28Å; Q180-F207 HydrophobicContact CG-CE1 3.85Å; Q180-F207 HydrophobicContact CG-CE2 4.47Å; Q180-F207 HydrophobicContact CG-CG 3.84Å; Q180-F207 HydrophobicContact CG-CZ 4.28Å; F183-F207 HydrophobicContact CB-CD2 4.05Å; F183-F207 HydrophobicContact CB-CE2 4.11Å; F183-F207 HydrophobicContact CD1-CB 4.27Å; F183-F207 AromaticContact CD1-CD2 3.73Å; F183-F207 HydrophobicContact CD1-CD2 3.73Å; F183-F207 HydrophobicContact CD1-CG 4.39Å; F183-F207 HydrophobicContact CD2-CD2 4.39Å; F183-F207 HydrophobicContact CE1-CB 4.15Å; F183-F207 HydrophobicContact CE1-CD2 4.21Å; F183-F207 AromaticContact CG-CD2 3.82Å; F183-F207 HydrophobicContact CG-CD2 3.82Å; F183-F207 HydrophobicContact CG-CE2 4.32Å; F203-F207 WeakPolarHBondContact O-CB 3.43Å; F203-F207 PolarHBondContact O-N 3.17Å; G204-F207 WeakPolarHBondContact O-CB 3.29Å; G204-F207 PolarHBondContact O-N 3.26Å; G204-F207 VanDerWaalsContact O-N 3.16Å; F207-F209 VanDerWaalsContact C-N 3.3Å; F207-F209 PolarHBondContact O-N 2.81Å; F207-V210 CarbonylContact O-C 3.59Å; F207-V210 PolarHBondContact O-N 3.03Å; F207-V210 VanDerWaalsContact O-N 3.08Å; F207-A211 HydrophobicContact CD1-CB 4.17Å; F207-A211 HydrophobicContact CE1-CB 3.92Å; F207-A211 VanDerWaalsContact O-CB 3.32Å; F207-A211 WeakPolarHBondContact O-CB 3.44Å; F207-A211 PolarHBondContact O-N 2.76Å
208	D	97.8	Very high	96.7	Very high	89 Å²	89	36.7 Å²	36.7	48%	0.476	18%	0.177	S	C	.	.	H	α-helix	trans	-60.3	-39.7	178.5	-67.5	-17	0	0	0	112	G204 K205 F206 K212	G204-D208 VanDerWaalsContact O-CG 3.29Å; G204-D208 PolarHBondContact O-N 2.86Å; K205-D208 PolarHBondContact O-N 3.42Å; F206-D208 VanDerWaalsContact C-N 3.33Å; F206-D208 PolarHBondContact O-N 3.36Å; D208-K212 WeakPolarHBondContact O-CB 3.4Å; D208-K212 PolarHBondContact O-N 3.37Å
209	F	98.3	Very high	96.5	Very high	12 Å²	12	36.3 Å²	36.3	5%	0.053	18%	0.181	C	C	.	.	H	α-helix	trans	-60.6	-46.3	173	169.2	-94.5	0	0	0	111.6	Q46 L47 P48 I128 V135 V138 V139 L142 K205 F206 F207 N213	Q46-F209 WeakPolarHBondContact O-CD2 3.33Å; L47-F209 HydrophobicContact CD2-CE1 4.29Å; L47-F209 HydrophobicContact CD2-CE2 4.3Å; L47-F209 HydrophobicContact CD2-CZ 4.12Å; P48-F209 HydrophobicContact CB-CB 4.45Å; P48-F209 HydrophobicContact CG-CB 3.86Å; I128-F209 HydrophobicContact CD1-CE1 4.39Å; V135-F209 HydrophobicContact CG2-CZ 4.42Å; V138-F209 HydrophobicContact CG1-CE1 4.14Å; V138-F209 HydrophobicContact CG1-CZ 4.5Å; V139-F209 HydrophobicContact CG2-CZ 4.28Å; L142-F209 HydrophobicContact CD1-CE1 4.03Å; K205-F209 PolarHBondContact O-N 2.86Å; K205-F209 VanDerWaalsContact O-N 3.09Å; F206-F209 HydrophobicContact CE2-CD1 4.42Å; F206-F209 WeakPolarHBondContact O-CB 3.47Å; F206-F209 PolarHBondContact O-N 3.48Å; F207-F209 VanDerWaalsContact C-N 3.3Å; F207-F209 PolarHBondContact O-N 2.81Å; F209-N213 WeakPolarHBondContact CE2-ND2 3.46Å; F209-N213 PolarHBondContact O-N 3.14Å; F209-N213 PolarHBondContact O-ND2 2.91Å
210	V	98.3	Very high	96	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.006	20%	0.197	C	C	.	.	H	α-helix	trans	-63	-53.8	177.4	170.9	0	0	0	0	110.6	F121 L142 F206 F207 K212 N213 L214	F121-V210 HydrophobicContact CD1-CB 4.4Å; F121-V210 HydrophobicContact CD1-CG1 4.16Å; F121-V210 HydrophobicContact CD1-CG2 4.08Å; F121-V210 HydrophobicContact CE1-CB 4.1Å; F121-V210 HydrophobicContact CE1-CG1 3.77Å; F121-V210 HydrophobicContact CE1-CG2 4.28Å; F121-V210 HydrophobicContact CZ-CG1 4.39Å; L142-V210 HydrophobicContact CD1-CG2 4.29Å; L142-V210 HydrophobicContact CD2-CG1 3.92Å; F206-V210 HydrophobicContact CD1-CG2 4.45Å; F206-V210 HydrophobicContact CE1-CG2 3.93Å; F206-V210 HydrophobicContact CE2-CG2 4.1Å; F206-V210 HydrophobicContact CZ-CG2 3.71Å; F206-V210 PolarHBondContact O-N 2.93Å; F207-V210 CarbonylContact O-C 3.59Å; F207-V210 PolarHBondContact O-N 3.03Å; F207-V210 VanDerWaalsContact O-N 3.08Å; V210-K212 VanDerWaalsContact C-N 3.33Å; V210-K212 PolarHBondContact O-N 3.08Å; V210-N213 PolarHBondContact O-N 3.19Å; V210-N213 VanDerWaalsContact O-N 3.12Å; V210-L214 HydrophobicContact CG1-CD1 3.83Å; V210-L214 HydrophobicContact CG1-CG 4.17Å; V210-L214 WeakPolarHBondContact O-CG 3.36Å; V210-L214 PolarHBondContact O-N 3.31Å
211	A	97	Very high	94.5	Very high	11 Å²	11	42.8 Å²	42.8	9%	0.091	24%	0.237	C	C	.	.	H	α-helix	trans	-55.7	-44.7	-179.2	0	0	0	0	0	112.3	L176 F207 N213 L214 Q215	L176-A211 HydrophobicContact CD1-CB 4.2Å; L176-A211 HydrophobicContact CD2-CB 4.21Å; F207-A211 HydrophobicContact CD1-CB 4.17Å; F207-A211 HydrophobicContact CE1-CB 3.92Å; F207-A211 VanDerWaalsContact O-CB 3.32Å; F207-A211 WeakPolarHBondContact O-CB 3.44Å; F207-A211 PolarHBondContact O-N 2.76Å; A211-N213 PolarHBondContact O-N 2.98Å; A211-L214 PolarHBondContact O-N 3.17Å; A211-Q215 WeakPolarHBondContact O-CB 3.45Å; A211-Q215 WeakPolarHBondContact O-CG 3.25Å; A211-Q215 PolarHBondContact O-N 3.33Å
212	K	96.7	Very high	94.3	Very high	122 Å²	122	40.6 Å²	40.6	53%	0.53	23%	0.225	S	C	.	.	H	α-helix	trans	-58.3	-47.4	176.3	177.2	-175.6	172.4	-172	0	111.9	D208 V210 Q215 Q216	D208-K212 WeakPolarHBondContact O-CB 3.4Å; D208-K212 PolarHBondContact O-N 3.37Å; V210-K212 VanDerWaalsContact C-N 3.33Å; V210-K212 PolarHBondContact O-N 3.08Å; K212-Q215 PolarHBondContact O-N 3.06Å; K212-Q216 VanDerWaalsContact O-CG 3.32Å; K212-Q216 WeakPolarHBondContact O-CG 3.37Å; K212-Q216 PolarHBondContact O-N 2.78Å
213	N	97.3	Very high	94.1	Very high	4 Å²	4	42.6 Å²	42.6	2%	0.021	24%	0.236	C	C	.	.	H	α-helix	trans	-72.1	-35.4	-178.3	-72.4	-66.5	0	0	0	112.1	V139 L142 Q143 F209 V210 A211 Q216 G217	V139-N213 WeakPolarHBondContact CG1-OD1 3.34Å; L142-N213 HydrophobicContact CB-CB 3.72Å; L142-N213 HydrophobicContact CD1-CB 3.86Å; L142-N213 HydrophobicContact CG-CB 4.47Å; Q143-N213 VanDerWaalsContact CG-O 3.31Å; Q143-N213 WeakPolarHBondContact CG-O 3.38Å; F209-N213 WeakPolarHBondContact CE2-ND2 3.46Å; F209-N213 PolarHBondContact O-N 3.14Å; F209-N213 PolarHBondContact O-ND2 2.91Å; V210-N213 PolarHBondContact O-N 3.19Å; V210-N213 VanDerWaalsContact O-N 3.12Å; A211-N213 PolarHBondContact O-N 2.98Å; N213-Q216 PolarHBondContact O-N 3Å; N213-G217 PolarHBondContact O-N 2.91Å
214	L	95.9	Very high	93.9	Very high	12 Å²	12	44.9 Å²	44.9	6%	0.063	25%	0.25	C	C	.	.	H	α-helix	trans	-57.8	-48.3	169.5	-68.5	176	0	0	0	111.2	L142 V145 G146 L171 L176 V210 A211 G217 F218	L142-L214 HydrophobicContact CD2-CD2 4.28Å; L142-L214 WeakPolarHBondContact O-CD2 3.27Å; V145-L214 HydrophobicContact CB-CD2 3.57Å; V145-L214 HydrophobicContact CG1-CD2 3.5Å; V145-L214 HydrophobicContact CG2-CD2 4.5Å; G146-L214 WeakPolarHBondContact CA-O 3.29Å; L171-L214 HydrophobicContact CD1-CB 4.35Å; L171-L214 HydrophobicContact CD2-CB 4.26Å; L171-L214 HydrophobicContact CD2-CD1 4.39Å; L176-L214 HydrophobicContact CD2-CD1 4.41Å; V210-L214 HydrophobicContact CG1-CD1 3.83Å; V210-L214 HydrophobicContact CG1-CG 4.17Å; V210-L214 WeakPolarHBondContact O-CG 3.36Å; V210-L214 PolarHBondContact O-N 3.31Å; A211-L214 PolarHBondContact O-N 3.17Å; L214-G217 PolarHBondContact O-N 3.11Å; L214-F218 PolarHBondContact O-N 3.43Å
215	Q	94.1	Very high	93.6	Very high	52 Å²	52	46.9 Å²	46.9	24%	0.243	26%	0.258	C	S	.	.	H	α-helix	trans	-64.2	-41.7	178.7	-76.4	-177.2	-21.7	0	0	112.8	L171 L176 A211 K212 G217 F218 N219	L171-Q215 PolarHBondContact O-NE2 3.25Å; L176-Q215 HydrophobicContact CD1-CG 3.51Å; L176-Q215 VanDerWaalsContact CD1-NE2 3.28Å; A211-Q215 WeakPolarHBondContact O-CB 3.45Å; A211-Q215 WeakPolarHBondContact O-CG 3.25Å; A211-Q215 PolarHBondContact O-N 3.33Å; K212-Q215 PolarHBondContact O-N 3.06Å; Q215-G217 VanDerWaalsContact C-N 3.28Å; Q215-G217 PolarHBondContact O-N 3.09Å; Q215-F218 PolarHBondContact O-N 2.75Å; Q215-N219 WeakPolarHBondContact O-CB 3.27Å; Q215-N219 PolarHBondContact O-N 3.14Å; Q215-N219 PolarHBondContact O-ND2 3.5Å; Q215-N219 VanDerWaalsContact O-ND2 3.14Å
216	Q	94.2	Very high	93.4	Very high	82 Å²	82	46.4 Å²	46.4	38%	0.383	26%	0.258	S	S	.	.	H	α-helix	trans	-58.8	-42.8	174.4	-75.6	178.3	1.9	0	0	111.3	Q143 K212 N213 N219 A220	Q143-Q216 HydrophobicContact CG-CB 4.3Å; K212-Q216 VanDerWaalsContact O-CG 3.32Å; K212-Q216 WeakPolarHBondContact O-CG 3.37Å; K212-Q216 PolarHBondContact O-N 2.78Å; N213-Q216 PolarHBondContact O-N 3Å; Q216-N219 PolarHBondContact O-N 3.3Å; Q216-A220 WeakPolarHBondContact O-CB 3.32Å; Q216-A220 PolarHBondContact O-N 3.09Å
217	G	93.4	Very high	93	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-64.4	-43.8	175.1	0	0	0	0	0	113.5	Q143 K147 N213 L214 Q215 N219 A220	Q143-G217 VanDerWaalsContact O-CA 3.24Å; Q143-G217 WeakPolarHBondContact O-CA 3.44Å; K147-G217 WeakPolarHBondContact CG-O 3.35Å; N213-G217 PolarHBondContact O-N 2.91Å; L214-G217 PolarHBondContact O-N 3.11Å; Q215-G217 VanDerWaalsContact C-N 3.28Å; Q215-G217 PolarHBondContact O-N 3.09Å; G217-N219 VanDerWaalsContact C-N 3.32Å; G217-N219 PolarHBondContact O-N 3.45Å; G217-A220 PolarHBondContact O-N 3.28Å
218	F	90.6	Very high	92.7	Very high	28 Å²	28	52.8 Å²	52.8	12%	0.123	29%	0.294	C	S	.	.	H	α-helix	trans	-61.9	-40.2	177.1	-174.2	-94.1	0	0	0	111.9	H149 R150 L171 L214 Q215	H149-F218 HydrophobicContact CB-CD2 4.21Å; H149-F218 HydrophobicContact CB-CE2 4.46Å; R150-F218 VanDerWaalsContact CA-CE2 3.44Å; R150-F218 HydrophobicContact CB-CD2 3.6Å; R150-F218 HydrophobicContact CB-CE2 3.72Å; R150-F218 HydrophobicContact CB-CG 4.28Å; R150-F218 HydrophobicContact CB-CZ 4.45Å; R150-F218 WeakPolarHBondContact CD-O 3.43Å; R150-F218 HydrophobicContact CG-CE2 4.42Å; L171-F218 HydrophobicContact CB-CB 4.32Å; L171-F218 HydrophobicContact CB-CD1 4.48Å; L171-F218 HydrophobicContact CB-CD2 4.16Å; L171-F218 HydrophobicContact CB-CG 4.08Å; L171-F218 HydrophobicContact CD1-CB 3.72Å; L171-F218 HydrophobicContact CD1-CD2 3.73Å; L171-F218 HydrophobicContact CD1-CG 3.97Å; L171-F218 HydrophobicContact CG-CD2 4.31Å; L214-F218 PolarHBondContact O-N 3.43Å; Q215-F218 PolarHBondContact O-N 2.75Å
219	N	90.2	Very high	92.3	Very high	119 Å²	119	50 Å²	50	64%	0.636	28%	0.281	S	S	*	.	H	α-helix	trans	-84.8	-6.1	-179.3	-65.7	-35.4	0	0	0	113.9	Q215 Q216 G217 S221	Q215-N219 WeakPolarHBondContact O-CB 3.27Å; Q215-N219 PolarHBondContact O-N 3.14Å; Q215-N219 PolarHBondContact O-ND2 3.5Å; Q215-N219 VanDerWaalsContact O-ND2 3.14Å; Q216-N219 PolarHBondContact O-N 3.3Å; G217-N219 VanDerWaalsContact C-N 3.32Å; G217-N219 PolarHBondContact O-N 3.45Å; N219-S221 PolarHBondContact O-N 3.42Å
220	A	86.1	Confident	91.7	Very high	39 Å²	39	53.2 Å²	53.2	32%	0.322	30%	0.3	S	S	.	.			trans	-71.9	119.8	175.9	0	0	0	0	0	109.9	R150 Q216 G217	R150-A220 PolarHBondContact NH1-O 2.93Å; Q216-A220 WeakPolarHBondContact O-CB 3.32Å; Q216-A220 PolarHBondContact O-N 3.09Å; G217-A220 PolarHBondContact O-N 3.28Å
221	S	67.1	Low	91.2	Very high	168 Å²	168	57.9 Å²	57.9	100%	1.175	33%	0.326	S	S	*	.			trans	-56.9	0	-177.3	-66	0	0	0	0	113.4	R150 N219	R150-S221 PolarHBondContact NH1-OXT 3.04Å; N219-S221 PolarHBondContact O-N 3.42Å

Retrieved 221 of 221 residues in 137.9 ms (Link to these results)

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