A0A087XEW0_POEFO Loading...

ADP-ribosylarginine hydrolase

AlphaFold DB , UniProt , Accession A0A087XEW0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 392 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	34.4	Very low	32.4	Very low	238 Å²	238	169.6 Å²	169.6	100%	1.172	83%	0.83	S	S	*	*				0	113	0	-127.6	166	-179.9	0	0	107.1
2	H	34.9	Very low	32.2	Very low	171 Å²	171	175.1 Å²	175.1	79%	0.792	84%	0.835	S	S	*	*			trans	39.7	107.8	169.3	-66.6	-69.5	0	0	0	121.1
3	H	28.8	Very low	32	Very low	192 Å²	192	180.5 Å²	180.5	89%	0.889	84%	0.842	S	S	*	*			trans	-122.4	122.2	143.7	-101.1	-59.8	0	0	0	109.3
4	I	37	Very low	31.8	Very low	143 Å²	143	184.6 Å²	184.6	73%	0.733	85%	0.846	S	S	*	*			trans	-96.8	130.2	162.1	-67	170.9	0	0	0	106
5	V	35.9	Very low	31.7	Very low	138 Å²	138	188.7 Å²	188.7	84%	0.836	85%	0.851	S	S	*	*			trans	-143	128.6	152.4	-179.2	0	0	0	0	108
6	E	31.9	Very low	31.7	Very low	157 Å²	157	185.9 Å²	185.9	73%	0.734	85%	0.846	S	S	*	*			trans	-81.6	157.4	179	-73.7	179	135.3	0	0	114
7	N	29.8	Very low	31.6	Very low	119 Å²	119	179.1 Å²	179.1	64%	0.636	84%	0.84	S	S	*	*			trans	89	127.5	132	-92.1	-25.8	0	0	0	124.8
8	H	29.8	Very low	31.6	Very low	157 Å²	157	178.6 Å²	178.6	73%	0.727	84%	0.841	S	S	*	*			trans	83.6	110	140	-73.9	14.5	0	0	0	119.4
9	Q	30.1	Very low	31.5	Very low	193 Å²	193	178.5 Å²	178.5	90%	0.902	84%	0.84	S	S	*	*				178.6	140.7	101.3	-93.8	-177	0.6	0	0	113.9
10	N	32.4	Very low	31.6	Very low	156 Å²	156	179.2 Å²	179.2	83%	0.834	84%	0.843	S	S	*	*			trans	-40	136.3	167.3	-102.2	-38.8	0	0	0	116.1
11	K	31	Very low	31.7	Very low	202 Å²	202	179.4 Å²	179.4	88%	0.878	84%	0.844	S	S	*	*			trans	-171.1	103.6	132.6	-105.9	166.8	-173.4	177.8	0	113.6
12	R	30.2	Very low	31.6	Very low	235 Å²	235	177 Å²	177	89%	0.887	83%	0.83	S	S	*	*			trans	20.7	123.2	142.2	-67.2	176.3	172.7	178	-3.2	119.1
13	R	29.3	Very low	31.6	Very low	246 Å²	246	175.2 Å²	175.2	93%	0.928	83%	0.831	S	S	*	*				-172	117.4	106.9	-103.6	173.5	174.1	178.8	-1.4	111.4
14	R	30.2	Very low	31.7	Very low	237 Å²	237	172.8 Å²	172.8	89%	0.894	82%	0.824	S	S	*	*			trans	-64.8	135.9	163.5	-73.7	176.9	171.1	175.6	-4.9	109.5
15	R	29.7	Very low	31.6	Very low	246 Å²	246	170.2 Å²	170.2	93%	0.928	82%	0.824	S	S	*	*			trans	-141	100.3	143.9	-105.2	-177.7	178.4	175.2	-2.3	108
16	N	31.4	Very low	31.5	Very low	144 Å²	144	166.8 Å²	166.8	77%	0.77	80%	0.8	S	S	*	*			trans	-0.1	124.7	154	-49.1	-8.9	0	0	0	114.1
17	G	29.7	Very low	31.7	Very low	71 Å²	71	163.6 Å²	163.6	73%	0.732	79%	0.793	S	S	*	*				81.5	72	52.2	0	0	0	0	0	107.4	E19	G17-E19 PolarHBondContact O-N 3.35Å
18	I	31.5	Very low	32.3	Very low	169 Å²	169	165.5 Å²	165.5	87%	0.867	80%	0.798	S	S	*	*			trans	-85.8	100.6	165.3	-62.7	175.2	0	0	0	103.5
19	E	31.2	Very low	32.9	Very low	177 Å²	177	161.4 Å²	161.4	83%	0.827	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-56.4	132	164.7	-73.2	173.2	157.5	0	0	107.5	G17 E21	G17-E19 PolarHBondContact O-N 3.35Å; E19-E21 PolarHBondContact O-N 2.62Å; E19-E21 VanDerWaalsContact O-N 3.11Å
20	E	32.7	Very low	33.6	Very low	193 Å²	193	162.3 Å²	162.3	90%	0.902	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-49.7	116.9	166.5	-70.4	172	151.8	0	0	107.5	E22	E20-E22 PolarHBondContact O-N 3.11Å; E20-E22 VanDerWaalsContact O-N 3.1Å
21	E	34.6	Very low	34.1	Very low	184 Å²	184	162.4 Å²	162.4	86%	0.86	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-49.3	119.9	172.9	-94.5	175.3	148.6	0	0	108.5	E19 V23	E19-E21 PolarHBondContact O-N 2.62Å; E19-E21 VanDerWaalsContact O-N 3.11Å; E21-V23 VanDerWaalsContact C-N 3.33Å; E21-V23 PolarHBondContact O-N 3.36Å
22	E	31.9	Very low	35.2	Very low	186 Å²	186	158.9 Å²	158.9	87%	0.869	77%	0.772	S	S	*	*			trans	-48.9	102.7	162.5	-82.1	179	140	0	0	107.7	E20 L24	E20-E22 PolarHBondContact O-N 3.11Å; E20-E22 VanDerWaalsContact O-N 3.1Å; E22-L24 VanDerWaalsContact C-N 3.28Å; E22-L24 PolarHBondContact O-N 3.2Å
23	V	33.5	Very low	36.5	Very low	135 Å²	135	151.2 Å²	151.2	82%	0.818	75%	0.746	S	S	*	*			trans	-55.5	105.3	155.8	178.2	0	0	0	0	104.2	E21 A25	E21-V23 VanDerWaalsContact C-N 3.33Å; E21-V23 PolarHBondContact O-N 3.36Å; V23-A25 PolarHBondContact O-N 3.44Å
24	L	32.8	Very low	37.8	Very low	141 Å²	141	143.6 Å²	143.6	74%	0.738	73%	0.73	S	S	*	*			trans	-50.5	96.2	170.1	-88.8	154.8	0	0	0	107	E22 L26	E22-L24 VanDerWaalsContact C-N 3.28Å; E22-L24 PolarHBondContact O-N 3.2Å; L24-L26 VanDerWaalsContact C-N 3.29Å; L24-L26 PolarHBondContact O-N 3.46Å
25	A	33.3	Very low	39.6	Very low	88 Å²	88	134.8 Å²	134.8	73%	0.727	71%	0.708	S	S	*	*			trans	-58.8	104	163.6	0	0	0	0	0	104.4	V23	V23-A25 PolarHBondContact O-N 3.44Å
26	L	35.4	Very low	41.7	Very low	66 Å²	66	124.9 Å²	124.9	35%	0.346	67%	0.673	S	S	.	*			trans	-46.9	139.3	168.1	-71.9	165	0	0	0	106.5	L24 H28 I244	L24-L26 VanDerWaalsContact C-N 3.29Å; L24-L26 PolarHBondContact O-N 3.46Å; L26-H28 PolarHBondContact O-N 3.3Å; L26-I244 HydrophobicContact CD1-CD1 4.21Å; L26-I244 HydrophobicContact CD2-CD1 4.08Å; L26-I244 HydrophobicContact CD2-CG1 3.96Å
27	P	35.8	Very low	43.5	Very low	91 Å²	91	125.2 Å²	125.2	59%	0.591	68%	0.675	S	S	*	*			trans	-58.7	95.6	171.3	24.1	-30.3	0	0	0	107.1	F29	P27-F29 PolarHBondContact O-N 3.27Å
28	H	41.9	Very low	45.6	Very low	158 Å²	158	125.9 Å²	125.9	73%	0.731	68%	0.681	S	S	*	*			trans	-61.5	123.5	167.2	-78.8	-43.2	0	0	0	104.8	L26 K30	L26-H28 PolarHBondContact O-N 3.3Å; H28-K30 PolarHBondContact O-N 3.23Å
29	F	42.6	Very low	48	Very low	72 Å²	72	120 Å²	120	32%	0.316	65%	0.652	S	S	.	*			trans	-45.1	116.5	152.4	-86.7	-87.8	0	0	0	105.9	P27 E31 F33 V235 E240	P27-F29 PolarHBondContact O-N 3.27Å; F29-E31 PolarHBondContact O-N 3.35Å; F29-F33 HydrophobicContact CB-CE2 3.99Å; F29-F33 HydrophobicContact CB-CZ 4.26Å; F29-F33 HydrophobicContact CD1-CE1 4.38Å; F29-F33 HydrophobicContact CD1-CE2 4.21Å; F29-F33 AromaticContact CD1-CZ 3.62Å; F29-F33 HydrophobicContact CD1-CZ 3.62Å; F29-F33 AromaticContact CD2-CE2 3.68Å; F29-F33 HydrophobicContact CD2-CE2 3.68Å; F29-F33 AromaticContact CD2-CZ 3.68Å; F29-F33 HydrophobicContact CD2-CZ 3.68Å; F29-F33 HydrophobicContact CE1-CE1 4.5Å; F29-F33 AromaticContact CE1-CZ 3.81Å; F29-F33 HydrophobicContact CE1-CZ 3.81Å; F29-F33 HydrophobicContact CE2-CE2 4.23Å; F29-F33 AromaticContact CE2-CZ 3.87Å; F29-F33 HydrophobicContact CE2-CZ 3.87Å; F29-F33 AromaticContact CG-CE2 3.68Å; F29-F33 HydrophobicContact CG-CE2 3.68Å; F29-F33 AromaticContact CG-CZ 3.56Å; F29-F33 HydrophobicContact CG-CZ 3.56Å; F29-F33 AromaticContact CZ-CZ 3.94Å; F29-F33 HydrophobicContact CZ-CZ 3.94Å; F29-V235 HydrophobicContact CZ-CG1 3.87Å; F29-E240 WeakPolarHBondContact CD2-OE1 3.29Å; F29-E240 WeakPolarHBondContact CE2-OE1 3.13Å
30	K	43.6	Very low	50.6	Low	212 Å²	212	118.5 Å²	118.5	92%	0.922	64%	0.644	S	S	*	*	S	Bend	trans	-63	-5.2	-169.2	-79.7	-177.3	174.5	178.7	0	113.1	H28	H28-K30 PolarHBondContact O-N 3.23Å
31	E	44.1	Very low	53.3	Low	157 Å²	157	114.5 Å²	114.5	73%	0.734	64%	0.635	S	S	*	*	S	Bend	trans	-134.4	138.9	171.3	-62.9	-170.8	167.9	0	0	109.7	F29 F33	F29-E31 PolarHBondContact O-N 3.35Å; E31-F33 PolarHBondContact O-N 3.02Å
32	P	53.8	Low	56.1	Low	128 Å²	128	106.9 Å²	106.9	83%	0.831	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-58.8	134.8	171.4	24.3	-31.2	0	0	0	109.6	S34	P32-S34 PolarHBondContact O-N 3.41Å
33	F	57	Low	59.3	Low	74 Å²	74	100.5 Å²	100.5	33%	0.325	58%	0.575	S	S	.	*	P	Polyproline II helix	trans	-57.5	132.8	172.5	-71.2	-82.7	0	0	0	109.5	F29 E31 A35 R228	F29-F33 HydrophobicContact CB-CE2 3.99Å; F29-F33 HydrophobicContact CB-CZ 4.26Å; F29-F33 HydrophobicContact CD1-CE1 4.38Å; F29-F33 HydrophobicContact CD1-CE2 4.21Å; F29-F33 AromaticContact CD1-CZ 3.62Å; F29-F33 HydrophobicContact CD1-CZ 3.62Å; F29-F33 AromaticContact CD2-CE2 3.68Å; F29-F33 HydrophobicContact CD2-CE2 3.68Å; F29-F33 AromaticContact CD2-CZ 3.68Å; F29-F33 HydrophobicContact CD2-CZ 3.68Å; F29-F33 HydrophobicContact CE1-CE1 4.5Å; F29-F33 AromaticContact CE1-CZ 3.81Å; F29-F33 HydrophobicContact CE1-CZ 3.81Å; F29-F33 HydrophobicContact CE2-CE2 4.23Å; F29-F33 AromaticContact CE2-CZ 3.87Å; F29-F33 HydrophobicContact CE2-CZ 3.87Å; F29-F33 AromaticContact CG-CE2 3.68Å; F29-F33 HydrophobicContact CG-CE2 3.68Å; F29-F33 AromaticContact CG-CZ 3.56Å; F29-F33 HydrophobicContact CG-CZ 3.56Å; F29-F33 AromaticContact CZ-CZ 3.94Å; F29-F33 HydrophobicContact CZ-CZ 3.94Å; E31-F33 PolarHBondContact O-N 3.02Å; F33-A35 PolarHBondContact O-N 3.22Å; F33-R228 HydrophobicContact CD2-CG 4.48Å; F33-R228 HydrophobicContact CG-CG 4.3Å
34	S	57.1	Low	62.4	Low	86 Å²	86	96.1 Å²	96.1	60%	0.601	55%	0.548	S	S	*	.	P	Polyproline II helix	trans	-64.6	126	162.5	-169.8	0	0	0	0	107.5	P32 P229	P32-S34 PolarHBondContact O-N 3.41Å; S34-P229 WeakPolarHBondContact O-CD 3.38Å; S34-P229 WeakPolarHBondContact O-CG 3.1Å
35	A	68.8	Low	65.5	Low	53 Å²	53	94.3 Å²	94.3	44%	0.438	54%	0.536	S	S	.	.	P	Polyproline II helix	trans	-54.6	151.1	170	0	0	0	0	0	109.6	F33 D37 R227	F33-A35 PolarHBondContact O-N 3.22Å; A35-D37 PolarHBondContact O-N 2.67Å; A35-D37 VanDerWaalsContact O-N 3.13Å; A35-R227 CarbonylContact C-O 3.54Å; A35-R227 WeakPolarHBondContact CA-O 3.21Å; A35-R227 HydrophobicContact CB-CB 4.11Å
36	M	74.3	Confident	68.6	Low	37 Å²	37	91.2 Å²	91.2	18%	0.182	51%	0.506	C	S	.	.	P	Polyproline II helix	trans	-57.2	119.5	173.2	-75	-166.8	-76.3	0	0	109.8	L39 R227 P229 L230 L360	M36-L39 HydrophobicContact CB-CD1 3.96Å; M36-L39 HydrophobicContact CB-CG 4.43Å; M36-L39 HydrophobicContact CE-CD1 3.71Å; M36-L39 HydrophobicContact SD-CD1 4.42Å; M36-R227 PolarHBondContact N-O 2.94Å; M36-P229 HydrophobicContact CG-CG 4.47Å; M36-L230 HydrophobicContact SD-CG 4.41Å; M36-L360 HydrophobicContact CE-CD1 4.32Å; M36-L360 HydrophobicContact CE-CD2 3.31Å; M36-L360 HydrophobicContact CE-CG 4.44Å
37	D	69.2	Low	71.6	Confident	152 Å²	152	88 Å²	88	81%	0.813	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	136.9	-178	-74	-29.8	0	0	0	111.2	A35 L39	A35-D37 PolarHBondContact O-N 2.67Å; A35-D37 VanDerWaalsContact O-N 3.13Å; D37-L39 PolarHBondContact O-N 3.34Å
38	G	73.4	Confident	74.6	Confident	84 Å²	84	85 Å²	85	87%	0.866	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.8	1.1	173.7	0	0	0	0	0	116.1
39	L	81.3	Confident	77.3	Confident	47 Å²	47	77.6 Å²	77.6	25%	0.246	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-88.3	135.1	169.4	-66.7	-177.8	0	0	0	111.7	M36 D37 R227 L360 Y361	M36-L39 HydrophobicContact CB-CD1 3.96Å; M36-L39 HydrophobicContact CB-CG 4.43Å; M36-L39 HydrophobicContact CE-CD1 3.71Å; M36-L39 HydrophobicContact SD-CD1 4.42Å; D37-L39 PolarHBondContact O-N 3.34Å; L39-R227 HydrophobicContact CB-CG 4.48Å; L39-L360 HydrophobicContact CD1-CD2 4Å; L39-Y361 HydrophobicContact CD2-CD1 3.97Å; L39-Y361 HydrophobicContact CD2-CE1 3.9Å
40	E	85	Confident	80	Confident	144 Å²	144	74.2 Å²	74.2	67%	0.673	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-69.9	155.7	175.6	-67	-178.2	-178.2	0	0	111.5	R227	E40-R227 PolarHBondContact O-NE 2.83Å; E40-R227 PolarHBondContact O-NH2 2.71Å
41	P	89.1	Confident	82.7	Confident	110 Å²	110	64.1 Å²	64.1	71%	0.714	38%	0.375	S	S	*	.	P	Polyproline II helix	trans	-50.7	145.2	169.2	-25.8	34.6	0	0	0	111.7
42	V	94.8	Very high	85.3	Confident	23 Å²	23	56.8 Å²	56.8	14%	0.139	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-62.6	142.3	178	78.8	0	0	0	0	110.4	H46 Y47 I225	V42-H46 HydrophobicContact CG2-CB 3.79Å; V42-Y47 HydrophobicContact CG2-CD2 3.98Å; V42-Y47 HydrophobicContact CG2-CE2 3.83Å; V42-I225 HydrophobicContact CB-CG2 4.19Å; V42-I225 HydrophobicContact CG1-CG2 3.89Å; V42-I225 HydrophobicContact CG2-CG1 4.31Å; V42-I225 HydrophobicContact CG2-CG2 4.12Å
43	T	97.8	Very high	87.4	Confident	52 Å²	52	50.7 Å²	50.7	32%	0.319	30%	0.301	S	S	.	.			trans	-133.6	169.8	178	67.8	0	0	0	0	109.8	E45 H46 Y47	T43-E45 PolarHBondContact O-N 3.1Å; T43-E45 VanDerWaalsContact O-N 3.14Å; T43-E45 PolarHBondContact OG1-N 3.13Å; T43-H46 PolarHBondContact N-ND1 3.39Å; T43-H46 VanDerWaalsContact N-ND1 3.12Å; T43-H46 WeakPolarHBondContact O-CB 3.29Å; T43-H46 PolarHBondContact O-N 3.33Å; T43-H46 PolarHBondContact OG1-ND1 2.96Å; T43-Y47 PolarHBondContact O-N 3.21Å
44	V	98.6	Very high	89.4	Confident	43 Å²	43	47.2 Å²	47.2	26%	0.261	29%	0.286	S	S	.	.	H	α-helix	trans	-56.3	-28.7	173.4	68.8	0	0	0	0	112.9	Y47 K48 K385 Y388	V44-Y47 PolarHBondContact O-N 3.09Å; V44-K48 WeakPolarHBondContact O-CG 3.46Å; V44-K48 PolarHBondContact O-N 3.16Å; V44-K385 HydrophobicContact CG2-CB 4.39Å; V44-K385 HydrophobicContact CG2-CG 3.91Å; V44-Y388 HydrophobicContact CB-CD1 3.76Å; V44-Y388 HydrophobicContact CB-CD2 4.34Å; V44-Y388 HydrophobicContact CB-CE1 4.05Å; V44-Y388 HydrophobicContact CB-CG 3.91Å; V44-Y388 HydrophobicContact CG2-CD1 4.09Å; V44-Y388 HydrophobicContact CG2-CG 4.1Å
45	E	98.6	Very high	91.4	Very high	104 Å²	104	43.1 Å²	43.1	49%	0.486	26%	0.257	S	S	.	.	H	α-helix	trans	-71	-31.7	176.9	-65.5	-56.2	130.5	0	0	112.2	T43 K48 A49	T43-E45 PolarHBondContact O-N 3.1Å; T43-E45 VanDerWaalsContact O-N 3.14Å; T43-E45 PolarHBondContact OG1-N 3.13Å; E45-K48 PolarHBondContact O-N 3.46Å; E45-K48 WeakPolarHBondContact OE1-CD 3.35Å; E45-K48 IonicContact OE1-NZ 3.99Å; E45-K48 PolarHBondContact OE1-NZ 3.2Å; E45-K48 IonicContact OE2-NZ 3.41Å; E45-K48 PolarHBondContact OE2-NZ 3.46Å; E45-A49 WeakPolarHBondContact O-CB 3.2Å; E45-A49 PolarHBondContact O-N 3.07Å
46	H	98.7	Very high	92.8	Very high	22 Å²	22	40.6 Å²	40.6	10%	0.102	24%	0.236	C	C	.	.	H	α-helix	trans	-67.4	-40.4	170.7	-65.2	95	0	0	0	111.6	V42 T43 A49 G50 R227 L359	V42-H46 HydrophobicContact CG2-CB 3.79Å; T43-H46 PolarHBondContact N-ND1 3.39Å; T43-H46 VanDerWaalsContact N-ND1 3.12Å; T43-H46 WeakPolarHBondContact O-CB 3.29Å; T43-H46 PolarHBondContact O-N 3.33Å; T43-H46 PolarHBondContact OG1-ND1 2.96Å; H46-A49 PolarHBondContact O-N 3.26Å; H46-G50 PolarHBondContact O-N 3.22Å; H46-R227 PolarHBondContact CD2-NH2 3.35Å; H46-R227 PolarHBondContact NE2-NH2 3.04Å; H46-L359 PolarHBondContact CD2-O 3.22Å; H46-L359 VanDerWaalsContact CD2-O 3.28Å
47	Y	98.9	Very high	94	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-62.8	-44.1	174.6	-88.1	-126	0	0	0	111.6	V42 T43 V44 A49 G50 M51 L182 I225 L359 A384 L387 Y388 H392	V42-Y47 HydrophobicContact CG2-CD2 3.98Å; V42-Y47 HydrophobicContact CG2-CE2 3.83Å; T43-Y47 PolarHBondContact O-N 3.21Å; V44-Y47 PolarHBondContact O-N 3.09Å; Y47-A49 VanDerWaalsContact C-N 3.35Å; Y47-G50 PolarHBondContact O-N 3.45Å; Y47-M51 PolarHBondContact O-N 3.48Å; Y47-L182 HydrophobicContact CD1-CB 4.05Å; Y47-L182 HydrophobicContact CD1-CD2 3.89Å; Y47-L182 HydrophobicContact CD1-CG 3.93Å; Y47-L182 HydrophobicContact CE1-CB 3.65Å; Y47-L182 HydrophobicContact CE1-CD2 4.34Å; Y47-L182 HydrophobicContact CE1-CG 3.9Å; Y47-L182 VanDerWaalsContact CE1-O 3.25Å; Y47-L182 WeakPolarHBondContact CE1-O 3.2Å; Y47-L182 HydrophobicContact CG-CD2 4.38Å; Y47-L182 HydrophobicContact CG-CG 4.48Å; Y47-L182 PolarHBondContact OH-O 3.39Å; Y47-I225 HydrophobicContact CE2-CD1 3.83Å; Y47-I225 HydrophobicContact CE2-CG1 4.03Å; Y47-I225 HydrophobicContact CE2-CG2 4.42Å; Y47-L359 HydrophobicContact CD2-CD2 4.32Å; Y47-A384 WeakPolarHBondContact O-CB 3.38Å; Y47-L387 HydrophobicContact CD1-CB 4.21Å; Y47-L387 HydrophobicContact CE1-CB 4.3Å; Y47-Y388 HydrophobicContact CD1-CD2 4.2Å; Y47-Y388 HydrophobicContact CD1-CG 4.49Å; Y47-Y388 AromaticContact CD2-CD2 3.69Å; Y47-Y388 HydrophobicContact CD2-CD2 3.69Å; Y47-Y388 HydrophobicContact CD2-CE2 4.43Å; Y47-Y388 HydrophobicContact CE1-CD2 4.29Å; Y47-Y388 AromaticContact CE2-CD2 3.79Å; Y47-Y388 HydrophobicContact CE2-CD2 3.79Å; Y47-Y388 HydrophobicContact CE2-CE2 4.4Å; Y47-Y388 AromaticContact CG-CD2 3.91Å; Y47-Y388 HydrophobicContact CG-CD2 3.91Å; Y47-Y388 HydrophobicContact CG-CG 4.45Å; Y47-H392 AromaticContact CZ-CE1 3.94Å; Y47-H392 PolarHBondContact OH-CE1 3.3Å
48	K	98.9	Very high	95.4	Very high	28 Å²	28	31.6 Å²	31.6	12%	0.122	19%	0.189	C	C	.	.	H	α-helix	trans	-61.4	-45	175.2	-73.8	167.7	65.5	-154	0	111	V44 E45 M51 V52 E381 A384 K385	V44-K48 WeakPolarHBondContact O-CG 3.46Å; V44-K48 PolarHBondContact O-N 3.16Å; E45-K48 PolarHBondContact O-N 3.46Å; E45-K48 WeakPolarHBondContact OE1-CD 3.35Å; E45-K48 IonicContact OE1-NZ 3.99Å; E45-K48 PolarHBondContact OE1-NZ 3.2Å; E45-K48 IonicContact OE2-NZ 3.41Å; E45-K48 PolarHBondContact OE2-NZ 3.46Å; K48-M51 PolarHBondContact O-N 3.07Å; K48-V52 VanDerWaalsContact O-CB 3.27Å; K48-V52 WeakPolarHBondContact O-CB 3.42Å; K48-V52 VanDerWaalsContact O-CG2 3.26Å; K48-V52 WeakPolarHBondContact O-CG2 3.43Å; K48-V52 PolarHBondContact O-N 3.1Å; K48-E381 WeakPolarHBondContact CE-OE2 3.33Å; K48-E381 IonicContact NZ-OE2 2.76Å; K48-A384 HydrophobicContact CB-CB 4.33Å; K48-A384 HydrophobicContact CG-CB 3.91Å; K48-K385 HydrophobicContact CD-CG 4.23Å; K48-K385 HydrophobicContact CG-CG 4.33Å
49	A	98.9	Very high	96.7	Very high	2 Å²	2	27.6 Å²	27.6	2%	0.017	15%	0.148	C	C	.	.	H	α-helix	trans	-60.3	-45.7	175.3	0	0	0	0	0	111.6	E45 H46 Y47 M51 V52 L53 G358 G362 T363	E45-A49 WeakPolarHBondContact O-CB 3.2Å; E45-A49 PolarHBondContact O-N 3.07Å; H46-A49 PolarHBondContact O-N 3.26Å; Y47-A49 VanDerWaalsContact C-N 3.35Å; A49-M51 PolarHBondContact O-N 3.19Å; A49-V52 PolarHBondContact O-N 2.9Å; A49-L53 HydrophobicContact CB-CD1 4.44Å; A49-L53 WeakPolarHBondContact O-CB 3.46Å; A49-L53 VanDerWaalsContact O-CG 3.23Å; A49-L53 WeakPolarHBondContact O-CG 3.47Å; A49-L53 PolarHBondContact O-N 3.15Å; A49-G358 WeakPolarHBondContact CB-O 3.49Å; A49-G362 VanDerWaalsContact CB-C 3.46Å; A49-T363 HydrophobicContact CB-CG2 3.96Å
50	G	98.9	Very high	97.5	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-56.1	-50	176.8	0	0	0	0	0	112.7	H46 Y47 S54 C355	H46-G50 PolarHBondContact O-N 3.22Å; Y47-G50 PolarHBondContact O-N 3.45Å; G50-S54 WeakPolarHBondContact O-CB 3.39Å; G50-S54 PolarHBondContact O-N 2.93Å; G50-S54 VanDerWaalsContact O-N 3.09Å; G50-C355 WeakPolarHBondContact CA-O 3.38Å; G50-C355 WeakPolarHBondContact O-CA 3.45Å; G50-C355 PolarHBondContact O-SG 3.27Å
51	M	98.9	Very high	98.1	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-69.2	-43.5	179.2	-66	-61.2	-65.5	0	0	112.6	Y47 K48 A49 S54 G55 A109 C179 L182 L380 A384 L387	Y47-M51 PolarHBondContact O-N 3.48Å; K48-M51 PolarHBondContact O-N 3.07Å; A49-M51 PolarHBondContact O-N 3.19Å; M51-S54 WeakPolarHBondContact O-CB 3.49Å; M51-G55 PolarHBondContact O-N 3.11Å; M51-A109 HydrophobicContact CE-CB 3.73Å; M51-C179 HydrophobicContact CE-CB 4.41Å; M51-C179 HydrophobicContact SD-CB 4.07Å; M51-L182 HydrophobicContact CG-CD2 3.9Å; M51-L182 HydrophobicContact SD-CD2 3.79Å; M51-L380 HydrophobicContact CB-CB 4.2Å; M51-L380 HydrophobicContact CB-CD2 4.27Å; M51-L380 HydrophobicContact CE-CD2 3.99Å; M51-A384 HydrophobicContact CB-CB 4.12Å; M51-A384 HydrophobicContact CG-CB 3.76Å; M51-L387 HydrophobicContact SD-CD1 4.4Å
52	V	98.9	Very high	98.6	Very high	4 Å²	4	13.7 Å²	13.7	2%	0.024	7%	0.072	C	C	.	.	H	α-helix	trans	-71.5	-42	-176.9	170.9	0	0	0	0	111.8	K48 A49 G55 A56 Y371 L374 R377 L380 E381	K48-V52 VanDerWaalsContact O-CB 3.27Å; K48-V52 WeakPolarHBondContact O-CB 3.42Å; K48-V52 VanDerWaalsContact O-CG2 3.26Å; K48-V52 WeakPolarHBondContact O-CG2 3.43Å; K48-V52 PolarHBondContact O-N 3.1Å; A49-V52 PolarHBondContact O-N 2.9Å; V52-G55 PolarHBondContact O-N 3.45Å; V52-A56 PolarHBondContact O-N 2.74Å; V52-Y371 HydrophobicContact CG1-CD2 4.02Å; V52-Y371 HydrophobicContact CG1-CG 4.25Å; V52-L374 HydrophobicContact CG1-CD2 4.2Å; V52-L374 WeakPolarHBondContact O-CD2 3.44Å; V52-R377 HydrophobicContact CG1-CG 4.47Å; V52-R377 HydrophobicContact CG2-CG 4.26Å; V52-L380 HydrophobicContact CG2-CB 4.12Å; V52-E381 HydrophobicContact CG2-CG 3.6Å
53	L	98.9	Very high	98.7	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-74.6	-28.1	179.2	-61.5	-177	0	0	0	112.1	A49 A56 G57 W332 C354 W357 G362 V366 Y371	A49-L53 HydrophobicContact CB-CD1 4.44Å; A49-L53 WeakPolarHBondContact O-CB 3.46Å; A49-L53 VanDerWaalsContact O-CG 3.23Å; A49-L53 WeakPolarHBondContact O-CG 3.47Å; A49-L53 PolarHBondContact O-N 3.15Å; L53-A56 PolarHBondContact O-N 3.41Å; L53-G57 PolarHBondContact O-N 3.46Å; L53-W332 HydrophobicContact CB-CH2 4.24Å; L53-W332 HydrophobicContact CB-CZ3 4.24Å; L53-W332 HydrophobicContact CD1-CZ3 4.12Å; L53-W332 HydrophobicContact CD2-CH2 4.24Å; L53-W332 HydrophobicContact CD2-CZ3 4.49Å; L53-C354 HydrophobicContact CB-CB 4.33Å; L53-C354 WeakPolarHBondContact O-CB 3.45Å; L53-W357 HydrophobicContact CD1-CE3 3.99Å; L53-W357 HydrophobicContact CD1-CZ3 4Å; L53-G362 VanDerWaalsContact CD1-O 3.31Å; L53-G362 WeakPolarHBondContact CD1-O 3.27Å; L53-V366 HydrophobicContact CD1-CG2 3.94Å; L53-V366 HydrophobicContact CD2-CG1 3.89Å; L53-V366 HydrophobicContact CD2-CG2 4.36Å; L53-Y371 HydrophobicContact CD2-CD1 4.09Å; L53-Y371 HydrophobicContact CD2-CG 4.25Å
54	S	98.9	Very high	98.7	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-53.2	-53.7	166.1	-174.1	0	0	0	0	110.5	G50 M51 A56 G57 D58 H105 V351	G50-S54 WeakPolarHBondContact O-CB 3.39Å; G50-S54 PolarHBondContact O-N 2.93Å; G50-S54 VanDerWaalsContact O-N 3.09Å; M51-S54 WeakPolarHBondContact O-CB 3.49Å; S54-A56 PolarHBondContact O-N 2.93Å; S54-G57 PolarHBondContact O-N 3.25Å; S54-D58 PolarHBondContact O-N 2.86Å; S54-H105 PolarHBondContact OG-ND1 3.46Å; S54-V351 WeakPolarHBondContact CB-O 3.42Å; S54-V351 WeakPolarHBondContact OG-CG2 3.48Å; S54-V351 PolarHBondContact OG-O 2.83Å
55	G	98.9	Very high	98.6	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-69.7	-29.3	177.8	0	0	0	0	0	115	M51 V52 A59 T102 L374	M51-G55 PolarHBondContact O-N 3.11Å; V52-G55 PolarHBondContact O-N 3.45Å; G55-A59 WeakPolarHBondContact O-CB 3.26Å; G55-A59 PolarHBondContact O-N 2.92Å; G55-T102 VanDerWaalsContact CA-OG1 3.23Å; G55-T102 WeakPolarHBondContact CA-OG1 3.44Å; G55-L374 WeakPolarHBondContact O-CD1 3.42Å
56	A	98.9	Very high	98.6	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-67.5	-39.1	171.7	0	0	0	0	0	112	V52 L53 S54 L60 N370 L374	V52-A56 PolarHBondContact O-N 2.74Å; L53-A56 PolarHBondContact O-N 3.41Å; S54-A56 PolarHBondContact O-N 2.93Å; A56-L60 VanDerWaalsContact O-CB 3.24Å; A56-L60 WeakPolarHBondContact O-CB 3.29Å; A56-L60 WeakPolarHBondContact O-CD1 3.1Å; A56-L60 WeakPolarHBondContact O-CG 3.48Å; A56-L60 PolarHBondContact O-N 3.24Å; A56-N370 WeakPolarHBondContact CB-O 3.47Å; A56-L374 HydrophobicContact CB-CD2 4.35Å
57	G	98.9	Very high	98.6	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-62	-50.3	176.3	0	0	0	0	0	111.6	L53 S54 L60 G61 A350	L53-G57 PolarHBondContact O-N 3.46Å; S54-G57 PolarHBondContact O-N 3.25Å; G57-L60 PolarHBondContact O-N 3.25Å; G57-G61 PolarHBondContact O-N 2.94Å; G57-A350 WeakPolarHBondContact O-CB 3.34Å
58	D	98.9	Very high	98.5	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-49.6	-63.1	170.3	165.7	-9.6	0	0	0	110.4	S54 L60 G61 Y62 S99 D101 T102 V351	S54-D58 PolarHBondContact O-N 2.86Å; D58-L60 PolarHBondContact O-N 3.42Å; D58-L60 VanDerWaalsContact O-N 3.1Å; D58-G61 PolarHBondContact O-N 3.39Å; D58-Y62 VanDerWaalsContact O-CB 3.28Å; D58-Y62 WeakPolarHBondContact O-CB 3.3Å; D58-Y62 PolarHBondContact O-N 2.71Å; D58-S99 VanDerWaalsContact CG-N 3.34Å; D58-S99 WeakPolarHBondContact OD1-CB 3.49Å; D58-S99 PolarHBondContact OD1-N 3.18Å; D58-S99 PolarHBondContact OD1-OG 2.95Å; D58-S99 VanDerWaalsContact OD1-OG 3.08Å; D58-S99 PolarHBondContact OD2-N 3.16Å; D58-S99 VanDerWaalsContact OD2-N 3.12Å; D58-S99 PolarHBondContact OD2-OG 3.46Å; D58-D101 HydrophobicContact CB-CB 4.43Å; D58-T102 WeakPolarHBondContact CB-OG1 3.46Å; D58-T102 WeakPolarHBondContact OD2-CB 3.47Å; D58-T102 PolarHBondContact OD2-N 3.14Å; D58-T102 PolarHBondContact OD2-OG1 2.96Å; D58-V351 HydrophobicContact CB-CB 4.14Å; D58-V351 HydrophobicContact CB-CG2 4.15Å
59	A	98.9	Very high	98.4	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-58.6	-35	-174.5	0	0	0	0	0	113.2	G55 R63 V91 P97 V98 L374	G55-A59 WeakPolarHBondContact O-CB 3.26Å; G55-A59 PolarHBondContact O-N 2.92Å; A59-R63 PolarHBondContact O-N 2.85Å; A59-V91 HydrophobicContact CB-CG1 3.73Å; A59-P97 WeakPolarHBondContact CA-O 3.38Å; A59-P97 WeakPolarHBondContact CB-O 3.37Å; A59-V98 HydrophobicContact CB-CG1 4.15Å; A59-L374 HydrophobicContact CB-CD1 4.09Å
60	L	98.8	Very high	98.4	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-72.7	-36.4	177.5	-76.5	164.8	0	0	0	112.9	A56 G57 D58 W67 L86 I89 V91 W96 W332 M336 F341 N370	A56-L60 VanDerWaalsContact O-CB 3.24Å; A56-L60 WeakPolarHBondContact O-CB 3.29Å; A56-L60 WeakPolarHBondContact O-CD1 3.1Å; A56-L60 WeakPolarHBondContact O-CG 3.48Å; A56-L60 PolarHBondContact O-N 3.24Å; G57-L60 PolarHBondContact O-N 3.25Å; D58-L60 PolarHBondContact O-N 3.42Å; D58-L60 VanDerWaalsContact O-N 3.1Å; L60-W67 WeakPolarHBondContact O-CZ3 3.5Å; L60-L86 HydrophobicContact CD1-CD1 4.18Å; L60-L86 HydrophobicContact CD2-CD1 4.23Å; L60-I89 HydrophobicContact CD2-CB 4.26Å; L60-I89 HydrophobicContact CD2-CD1 4.2Å; L60-I89 HydrophobicContact CD2-CG2 3.59Å; L60-V91 HydrophobicContact CD1-CG2 4.06Å; L60-V91 HydrophobicContact CD2-CG2 3.57Å; L60-V91 HydrophobicContact CG-CG2 3.63Å; L60-W96 HydrophobicContact CD2-CE3 4.04Å; L60-W96 HydrophobicContact CD2-CZ3 3.89Å; L60-W332 HydrophobicContact CD1-CZ2 4.34Å; L60-M336 HydrophobicContact CB-CE 3.46Å; L60-M336 VanDerWaalsContact CB-CE 3.46Å; L60-M336 HydrophobicContact CD1-CE 3.65Å; L60-M336 HydrophobicContact CG-CE 4.15Å; L60-F341 HydrophobicContact CB-CE1 4.35Å; L60-N370 HydrophobicContact CD1-CB 4.29Å
61	G	98.6	Very high	98.3	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-72.3	-43.7	172.4	0	0	0	0	0	111.6	G57 D58 W67 E68 N346	G57-G61 PolarHBondContact O-N 2.94Å; D58-G61 PolarHBondContact O-N 3.39Å; G61-W67 WeakPolarHBondContact O-CB 3.38Å; G61-E68 PolarHBondContact O-N 3.3Å; G61-N346 PolarHBondContact O-OD1 3.5Å
62	Y	98.8	Very high	98.3	Very high	10 Å²	10	25.2 Å²	25.2	4%	0.039	13%	0.133	C	C	.	.	H	α-helix	trans	-67.5	-54.9	-174.5	-176.2	-125.5	0	0	0	112.4	D58 G64 G65 T66 W67 E68 P97 G138 R139 A140	D58-Y62 VanDerWaalsContact O-CB 3.28Å; D58-Y62 WeakPolarHBondContact O-CB 3.3Å; D58-Y62 PolarHBondContact O-N 2.71Å; Y62-G64 VanDerWaalsContact C-N 3.3Å; Y62-G64 VanDerWaalsContact CD1-N 3.33Å; Y62-G64 VanDerWaalsContact CE1-CA 3.41Å; Y62-G64 PolarHBondContact O-N 2.84Å; Y62-G65 VanDerWaalsContact CE2-CA 3.49Å; Y62-G65 VanDerWaalsContact CE2-N 3.32Å; Y62-G65 VanDerWaalsContact CZ-N 3.31Å; Y62-G65 CarbonylContact O-C 3.52Å; Y62-G65 WeakPolarHBondContact O-CA 3.49Å; Y62-G65 PolarHBondContact O-N 3.12Å; Y62-T66 PolarHBondContact O-N 2.82Å; Y62-W67 PolarHBondContact O-N 3.28Å; Y62-E68 HydrophobicContact CD2-CB 4.09Å; Y62-E68 WeakPolarHBondContact CD2-OE2 3.32Å; Y62-E68 WeakPolarHBondContact CE2-OE2 3.24Å; Y62-P97 HydrophobicContact CD1-CG 4.22Å; Y62-P97 HydrophobicContact CE1-CG 4.11Å; Y62-G138 PolarHBondContact OH-O 3.42Å; Y62-R139 WeakPolarHBondContact OH-CA 3.42Å; Y62-A140 HydrophobicContact CE2-CB 4.01Å
63	R	97.8	Very high	98.3	Very high	45 Å²	45	25 Å²	25	17%	0.17	13%	0.132	C	C	.	.	G	3₁₀ helix	trans	43.3	53.5	-172.4	-165.3	-177.1	172	-121.6	14.1	112.6	A59 G65 T66 W67 E79 W96	A59-R63 PolarHBondContact O-N 2.85Å; R63-G65 PolarHBondContact O-N 3.38Å; R63-T66 WeakPolarHBondContact CG-OG1 3.38Å; R63-T66 PolarHBondContact NH1-OG1 3.03Å; R63-T66 VanDerWaalsContact NH1-OG1 3.11Å; R63-T66 PolarHBondContact O-N 3.48Å; R63-T66 VanDerWaalsContact O-N 3.12Å; R63-T66 PolarHBondContact O-OG1 3.41Å; R63-W67 HydrophobicContact CB-CB 4.09Å; R63-W67 HydrophobicContact CB-CD2 3.96Å; R63-W67 HydrophobicContact CB-CE3 4.14Å; R63-W67 HydrophobicContact CB-CG 3.94Å; R63-W67 VanDerWaalsContact CD-CD2 3.45Å; R63-W67 HydrophobicContact CG-CD2 4.37Å; R63-E79 IonicContact CZ-OE1 2.66Å; R63-E79 IonicContact CZ-OE2 2.92Å; R63-E79 IonicContact NH1-OE1 3.62Å; R63-E79 PolarHBondContact NH1-OE1 3.49Å; R63-E79 IonicContact NH1-OE2 3.1Å; R63-E79 PolarHBondContact NH1-OE2 3.07Å; R63-E79 VanDerWaalsContact NH1-OE2 3.12Å; R63-E79 IonicContact NH2-OE1 3.67Å; R63-E79 PolarHBondContact NH2-OE1 2.73Å; R63-W96 HydrophobicContact CB-CE3 4.08Å; R63-W96 HydrophobicContact CB-CH2 4.44Å; R63-W96 HydrophobicContact CB-CZ3 3.81Å; R63-W96 HydrophobicContact CG-CD2 4.36Å; R63-W96 HydrophobicContact CG-CE3 3.91Å; R63-W96 HydrophobicContact CG-CH2 3.82Å; R63-W96 HydrophobicContact CG-CZ2 4.28Å; R63-W96 HydrophobicContact CG-CZ3 3.62Å
64	G	96.9	Very high	98.3	Very high	39 Å²	39	27.4 Å²	27.4	40%	0.402	15%	0.147	S	C	.	.	G	3₁₀ helix	trans	62	28.7	-179	0	0	0	0	0	113.7	Y62 T66	Y62-G64 VanDerWaalsContact C-N 3.3Å; Y62-G64 VanDerWaalsContact CD1-N 3.33Å; Y62-G64 VanDerWaalsContact CE1-CA 3.41Å; Y62-G64 PolarHBondContact O-N 2.84Å; G64-T66 VanDerWaalsContact C-N 3.3Å; G64-T66 PolarHBondContact O-N 3.21Å
65	G	97.2	Very high	98.3	Very high	9 Å²	9	31 Å²	31	9%	0.093	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	83.3	-8.7	-176.2	0	0	0	0	0	115	Y62 R63 W67 F69	Y62-G65 VanDerWaalsContact CE2-CA 3.49Å; Y62-G65 VanDerWaalsContact CE2-N 3.32Å; Y62-G65 VanDerWaalsContact CZ-N 3.31Å; Y62-G65 CarbonylContact O-C 3.52Å; Y62-G65 WeakPolarHBondContact O-CA 3.49Å; Y62-G65 PolarHBondContact O-N 3.12Å; R63-G65 PolarHBondContact O-N 3.38Å; G65-W67 VanDerWaalsContact C-N 3.3Å; G65-W67 PolarHBondContact O-N 2.93Å; G65-F69 WeakPolarHBondContact O-CD2 3.46Å; G65-F69 PolarHBondContact O-N 3.43Å
66	T	97.9	Very high	98.3	Very high	76 Å²	76	31 Å²	31	47%	0.466	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-28	-176.5	60.6	0	0	0	0	113.2	Y62 R63 G64	Y62-T66 PolarHBondContact O-N 2.82Å; R63-T66 WeakPolarHBondContact CG-OG1 3.38Å; R63-T66 PolarHBondContact NH1-OG1 3.03Å; R63-T66 VanDerWaalsContact NH1-OG1 3.11Å; R63-T66 PolarHBondContact O-N 3.48Å; R63-T66 VanDerWaalsContact O-N 3.12Å; R63-T66 PolarHBondContact O-OG1 3.41Å; G64-T66 VanDerWaalsContact C-N 3.3Å; G64-T66 PolarHBondContact O-N 3.21Å
67	W	98.3	Very high	98.3	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100	-36.8	179	-76.2	1.1	0	0	0	112.4	L60 G61 Y62 R63 G65 F69 N70 I76 E79 L80 L83 I89 W96 F341 N346	L60-W67 WeakPolarHBondContact O-CZ3 3.5Å; G61-W67 WeakPolarHBondContact O-CB 3.38Å; Y62-W67 PolarHBondContact O-N 3.28Å; R63-W67 HydrophobicContact CB-CB 4.09Å; R63-W67 HydrophobicContact CB-CD2 3.96Å; R63-W67 HydrophobicContact CB-CE3 4.14Å; R63-W67 HydrophobicContact CB-CG 3.94Å; R63-W67 VanDerWaalsContact CD-CD2 3.45Å; R63-W67 HydrophobicContact CG-CD2 4.37Å; G65-W67 VanDerWaalsContact C-N 3.3Å; G65-W67 PolarHBondContact O-N 2.93Å; W67-F69 VanDerWaalsContact C-N 3.3Å; W67-F69 PolarHBondContact O-N 3.17Å; W67-N70 PolarHBondContact O-N 2.85Å; W67-N70 VanDerWaalsContact O-N 3.12Å; W67-I76 HydrophobicContact CB-CD1 4.45Å; W67-I76 HydrophobicContact CD2-CG2 3.77Å; W67-I76 HydrophobicContact CE3-CG2 3.95Å; W67-I76 HydrophobicContact CG-CG1 4.41Å; W67-I76 HydrophobicContact CG-CG2 4.05Å; W67-I76 HydrophobicContact CZ3-CG2 4.45Å; W67-E79 HydrophobicContact CZ2-CB 4.41Å; W67-E79 HydrophobicContact CZ2-CG 4.33Å; W67-E79 PolarHBondContact NE1-OE2 2.96Å; W67-L80 HydrophobicContact CH2-CB 4.2Å; W67-L80 HydrophobicContact CH2-CD1 4.15Å; W67-L83 HydrophobicContact CH2-CD1 4.06Å; W67-L83 HydrophobicContact CZ2-CD1 3.77Å; W67-I89 HydrophobicContact CH2-CD1 4.11Å; W67-W96 HydrophobicContact CE3-CH2 4.46Å; W67-W96 HydrophobicContact CE3-CZ3 4.22Å; W67-W96 AromaticContact CH2-CH2 3.68Å; W67-W96 HydrophobicContact CH2-CH2 3.68Å; W67-W96 HydrophobicContact CH2-CZ3 4.19Å; W67-W96 HydrophobicContact CZ2-CH2 4.29Å; W67-W96 AromaticContact CZ3-CH2 3.76Å; W67-W96 HydrophobicContact CZ3-CH2 3.76Å; W67-W96 AromaticContact CZ3-CZ3 3.78Å; W67-W96 HydrophobicContact CZ3-CZ3 3.78Å; W67-F341 HydrophobicContact CE3-CD1 4.1Å; W67-F341 HydrophobicContact CE3-CE1 4.04Å; W67-F341 AromaticContact CZ3-CD1 3.9Å; W67-F341 HydrophobicContact CZ3-CD1 3.9Å; W67-F341 AromaticContact CZ3-CE1 3.53Å; W67-F341 HydrophobicContact CZ3-CE1 3.53Å; W67-F341 HydrophobicContact CZ3-CZ 4.31Å; W67-N346 PolarHBondContact O-ND2 3.2Å
68	E	97.6	Very high	98.3	Very high	11 Å²	11	37.7 Å²	37.7	5%	0.051	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-46	171.5	-176.8	-163.9	168	0	0	111.8	G61 Y62 N70 W309 N346 D347	G61-E68 PolarHBondContact O-N 3.3Å; Y62-E68 HydrophobicContact CD2-CB 4.09Å; Y62-E68 WeakPolarHBondContact CD2-OE2 3.32Å; Y62-E68 WeakPolarHBondContact CE2-OE2 3.24Å; E68-N70 VanDerWaalsContact C-N 3.3Å; E68-N70 PolarHBondContact O-N 3.05Å; E68-W309 HydrophobicContact CG-CH2 4.26Å; E68-W309 HydrophobicContact CG-CZ2 4.1Å; E68-N346 WeakPolarHBondContact CA-OD1 3.45Å; E68-D347 WeakPolarHBondContact CG-OD1 3.47Å
69	F	97.4	Very high	98.2	Very high	95 Å²	95	40.3 Å²	40.3	42%	0.417	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91	16.1	-179	-56.9	-58.2	0	0	0	114	G65 W67 A140 W309	G65-F69 WeakPolarHBondContact O-CD2 3.46Å; G65-F69 PolarHBondContact O-N 3.43Å; W67-F69 VanDerWaalsContact C-N 3.3Å; W67-F69 PolarHBondContact O-N 3.17Å; F69-A140 HydrophobicContact CE2-CB 4.04Å; F69-A140 HydrophobicContact CZ-CB 3.89Å; F69-W309 HydrophobicContact CE1-CH2 4.4Å
70	N	97.6	Very high	98.2	Very high	34 Å²	34	40.4 Å²	40.4	18%	0.182	21%	0.21	C	C	.	.			trans	-99.1	96.3	170.3	-173.8	-9.5	0	0	0	110.3	W67 E68 V72 I76 G343	W67-N70 PolarHBondContact O-N 2.85Å; W67-N70 VanDerWaalsContact O-N 3.12Å; E68-N70 VanDerWaalsContact C-N 3.3Å; E68-N70 PolarHBondContact O-N 3.05Å; N70-V72 PolarHBondContact O-N 3.39Å; N70-V72 PolarHBondContact OD1-N 2.93Å; N70-I76 HydrophobicContact CB-CD1 4.2Å; N70-I76 HydrophobicContact CB-CG1 3.96Å; N70-G343 WeakPolarHBondContact O-CA 3.45Å
71	Y	98	Very high	98.2	Very high	145 Å²	145	46.6 Å²	46.6	57%	0.569	24%	0.239	S	C	*	.			trans	-72.6	16.2	-174.6	-51.1	-72.3	0	0	0	115.5	W309 G343	Y71-W309 AromaticContact CD1-CD1 3.8Å; Y71-W309 AromaticContact CD1-NE1 3.64Å; Y71-W309 AromaticContact CE1-CD1 3.94Å; Y71-W309 HydrophobicContact CE1-CD2 4.48Å; Y71-W309 AromaticContact CE1-CE2 3.96Å; Y71-W309 HydrophobicContact CE1-CG 4.49Å; Y71-W309 HydrophobicContact CE1-CZ2 4.49Å; Y71-W309 AromaticContact CE1-NE1 3.59Å; Y71-G343 WeakPolarHBondContact CA-O 3.38Å
72	V	98.5	Very high	98.2	Very high	62 Å²	62	53 Å²	53	38%	0.376	27%	0.269	S	S	.	.			trans	-133.5	96.8	-177.4	-176.1	0	0	0	0	108.7	N70 P74 N75 I76	N70-V72 PolarHBondContact O-N 3.39Å; N70-V72 PolarHBondContact OD1-N 2.93Å; V72-P74 VanDerWaalsContact C-N 3.33Å; V72-P74 HydrophobicContact CG1-CB 4.4Å; V72-P74 HydrophobicContact CG1-CG 4.38Å; V72-N75 HydrophobicContact CB-CB 4.29Å; V72-N75 HydrophobicContact CG1-CB 4.35Å; V72-N75 WeakPolarHBondContact O-CB 3.27Å; V72-N75 PolarHBondContact O-N 2.99Å; V72-I76 PolarHBondContact O-N 2.94Å
73	G	98.6	Very high	98.1	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-50.6	-43.6	178.7	0	0	0	0	0	113.8	N75 I76 H77 V294 D298	G73-N75 PolarHBondContact O-N 3.4Å; G73-I76 WeakPolarHBondContact O-CB 3.4Å; G73-I76 PolarHBondContact O-N 3.32Å; G73-H77 PolarHBondContact O-CD2 3.15Å; G73-H77 VanDerWaalsContact O-CD2 3.3Å; G73-H77 PolarHBondContact O-N 3.25Å; G73-V294 VanDerWaalsContact C-CG1 3.45Å; G73-D298 VanDerWaalsContact CA-OD2 3.29Å; G73-D298 WeakPolarHBondContact CA-OD2 3.35Å; G73-D298 PolarHBondContact N-OD2 2.82Å
74	P	98.8	Very high	98.1	Very high	50 Å²	50	55.9 Å²	55.9	33%	0.325	30%	0.299	S	S	.	.	H	α-helix	trans	-55.2	-32.9	174.6	-29.9	37	0	0	0	114.6	V72 Q78 V294 A295 D298	V72-P74 VanDerWaalsContact C-N 3.33Å; V72-P74 HydrophobicContact CG1-CB 4.4Å; V72-P74 HydrophobicContact CG1-CG 4.38Å; P74-Q78 WeakPolarHBondContact O-CB 3.5Å; P74-Q78 PolarHBondContact O-N 2.83Å; P74-V294 HydrophobicContact CG-CG1 4.11Å; P74-A295 HydrophobicContact CG-CB 4.13Å; P74-D298 WeakPolarHBondContact CD-OD2 3.46Å
75	N	98.7	Very high	98.2	Very high	76 Å²	76	54.4 Å²	54.4	41%	0.406	28%	0.284	S	S	.	.	H	α-helix	trans	-70.7	-41.6	176.4	-66	-8.1	0	0	0	111.2	V72 G73 H77 Q78 E79	V72-N75 HydrophobicContact CB-CB 4.29Å; V72-N75 HydrophobicContact CG1-CB 4.35Å; V72-N75 WeakPolarHBondContact O-CB 3.27Å; V72-N75 PolarHBondContact O-N 2.99Å; G73-N75 PolarHBondContact O-N 3.4Å; N75-H77 VanDerWaalsContact C-N 3.32Å; N75-H77 PolarHBondContact O-N 3.38Å; N75-Q78 PolarHBondContact O-N 3.14Å; N75-E79 PolarHBondContact O-N 3.46Å
76	I	98.8	Very high	98.2	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-59.8	-45.4	174.9	-61.4	173	0	0	0	110	W67 N70 V72 G73 Q78 E79 L80 F341 H342	W67-I76 HydrophobicContact CB-CD1 4.45Å; W67-I76 HydrophobicContact CD2-CG2 3.77Å; W67-I76 HydrophobicContact CE3-CG2 3.95Å; W67-I76 HydrophobicContact CG-CG1 4.41Å; W67-I76 HydrophobicContact CG-CG2 4.05Å; W67-I76 HydrophobicContact CZ3-CG2 4.45Å; N70-I76 HydrophobicContact CB-CD1 4.2Å; N70-I76 HydrophobicContact CB-CG1 3.96Å; V72-I76 PolarHBondContact O-N 2.94Å; G73-I76 WeakPolarHBondContact O-CB 3.4Å; G73-I76 PolarHBondContact O-N 3.32Å; I76-Q78 PolarHBondContact O-N 3.48Å; I76-E79 PolarHBondContact O-N 3.44Å; I76-L80 WeakPolarHBondContact O-CB 3.3Å; I76-L80 PolarHBondContact O-N 3.16Å; I76-F341 HydrophobicContact CG2-CB 4.04Å; I76-F341 HydrophobicContact CG2-CD1 4.19Å; I76-F341 HydrophobicContact CG2-CG 4.41Å; I76-H342 VanDerWaalsContact CD1-O 3.32Å; I76-H342 WeakPolarHBondContact CD1-O 3.31Å
77	H	98.8	Very high	98.2	Very high	26 Å²	26	56.5 Å²	56.5	12%	0.12	28%	0.284	C	S	.	.	H	α-helix	trans	-64.9	-38	177.6	-83.3	-101.9	0	0	0	112.6	G73 N75 L80 Q81 V294 N337 F341	G73-H77 PolarHBondContact O-CD2 3.15Å; G73-H77 VanDerWaalsContact O-CD2 3.3Å; G73-H77 PolarHBondContact O-N 3.25Å; N75-H77 VanDerWaalsContact C-N 3.32Å; N75-H77 PolarHBondContact O-N 3.38Å; H77-L80 WeakPolarHBondContact O-CB 3.37Å; H77-L80 PolarHBondContact O-N 3.49Å; H77-Q81 WeakPolarHBondContact O-CG 3.43Å; H77-Q81 PolarHBondContact O-N 2.84Å; H77-Q81 VanDerWaalsContact O-N 3.11Å; H77-V294 VanDerWaalsContact CD2-CG1 3.44Å; H77-V294 WeakPolarHBondContact CD2-CG1 3.2Å; H77-N337 PolarHBondContact CE1-OD1 2.76Å; H77-F341 PolarHBondContact CD2-O 2.96Å; H77-F341 VanDerWaalsContact CD2-O 3.29Å; H77-F341 VanDerWaalsContact NE2-CB 3.29Å; H77-F341 WeakPolarHBondContact NE2-CB 3.33Å; H77-F341 PolarHBondContact NE2-O 3.12Å
78	Q	98.8	Very high	98.2	Very high	114 Å²	114	63.8 Å²	63.8	53%	0.533	32%	0.315	S	S	.	.	H	α-helix	trans	-60.8	-50.1	173.5	-177.8	-174.7	-23	0	0	110.9	P74 N75 I76 L80 Q81 E82	P74-Q78 WeakPolarHBondContact O-CB 3.5Å; P74-Q78 PolarHBondContact O-N 2.83Å; N75-Q78 PolarHBondContact O-N 3.14Å; I76-Q78 PolarHBondContact O-N 3.48Å; Q78-L80 VanDerWaalsContact C-N 3.31Å; Q78-L80 PolarHBondContact O-N 3.02Å; Q78-Q81 WeakPolarHBondContact O-CB 3.47Å; Q78-Q81 PolarHBondContact O-N 3.08Å; Q78-Q81 VanDerWaalsContact O-N 3.08Å; Q78-E82 PolarHBondContact NE2-OE1 3.36Å; Q78-E82 WeakPolarHBondContact O-CG 3.43Å; Q78-E82 PolarHBondContact O-N 2.95Å
79	E	98.4	Very high	98.2	Very high	55 Å²	55	63.5 Å²	63.5	26%	0.257	31%	0.314	S	S	.	.	H	α-helix	trans	-64.9	-36.4	179.6	-170.4	173.2	-168.7	0	0	111.9	R63 W67 N75 I76 Q81 E82 L83	R63-E79 IonicContact CZ-OE1 2.66Å; R63-E79 IonicContact CZ-OE2 2.92Å; R63-E79 IonicContact NH1-OE1 3.62Å; R63-E79 PolarHBondContact NH1-OE1 3.49Å; R63-E79 IonicContact NH1-OE2 3.1Å; R63-E79 PolarHBondContact NH1-OE2 3.07Å; R63-E79 VanDerWaalsContact NH1-OE2 3.12Å; R63-E79 IonicContact NH2-OE1 3.67Å; R63-E79 PolarHBondContact NH2-OE1 2.73Å; W67-E79 HydrophobicContact CZ2-CB 4.41Å; W67-E79 HydrophobicContact CZ2-CG 4.33Å; W67-E79 PolarHBondContact NE1-OE2 2.96Å; N75-E79 PolarHBondContact O-N 3.46Å; I76-E79 PolarHBondContact O-N 3.44Å; E79-Q81 VanDerWaalsContact C-N 3.27Å; E79-Q81 PolarHBondContact O-N 3.36Å; E79-E82 WeakPolarHBondContact O-CB 3.38Å; E79-E82 PolarHBondContact O-N 3.32Å; E79-E82 VanDerWaalsContact O-N 3.14Å; E79-L83 HydrophobicContact CG-CD1 4.45Å; E79-L83 VanDerWaalsContact O-CG 3.3Å; E79-L83 WeakPolarHBondContact O-CG 3.47Å; E79-L83 PolarHBondContact O-N 2.98Å
80	L	98.6	Very high	98.3	Very high	2 Å²	2	61.7 Å²	61.7	1%	0.01	31%	0.311	C	S	.	.	H	α-helix	trans	-55.9	-42.2	171.3	175.2	64.2	0	0	0	111.7	W67 I76 H77 Q78 L83 G84 G85 L86 I89 F341	W67-L80 HydrophobicContact CH2-CB 4.2Å; W67-L80 HydrophobicContact CH2-CD1 4.15Å; I76-L80 WeakPolarHBondContact O-CB 3.3Å; I76-L80 PolarHBondContact O-N 3.16Å; H77-L80 WeakPolarHBondContact O-CB 3.37Å; H77-L80 PolarHBondContact O-N 3.49Å; Q78-L80 VanDerWaalsContact C-N 3.31Å; Q78-L80 PolarHBondContact O-N 3.02Å; L80-L83 PolarHBondContact O-N 3.41Å; L80-G84 PolarHBondContact O-N 3.31Å; L80-G85 WeakPolarHBondContact O-CA 3.25Å; L80-G85 PolarHBondContact O-N 3.21Å; L80-L86 HydrophobicContact CD1-CB 4.49Å; L80-I89 HydrophobicContact CD1-CD1 3.45Å; L80-I89 VanDerWaalsContact CD1-CD1 3.45Å; L80-F341 HydrophobicContact CD1-CE2 4.34Å; L80-F341 HydrophobicContact CD1-CZ 4.45Å; L80-F341 HydrophobicContact CD2-CD2 3.55Å; L80-F341 HydrophobicContact CD2-CE2 3.58Å; L80-F341 HydrophobicContact CD2-CG 4.32Å; L80-F341 HydrophobicContact CD2-CZ 4.39Å
81	Q	98.4	Very high	98.3	Very high	129 Å²	129	60.1 Å²	60.1	60%	0.603	30%	0.303	S	S	*	.	H	α-helix	trans	-67.7	-39.9	175.5	-65.9	-58.7	-39.4	0	0	112.1	H77 Q78 E79 L83 G84	H77-Q81 WeakPolarHBondContact O-CG 3.43Å; H77-Q81 PolarHBondContact O-N 2.84Å; H77-Q81 VanDerWaalsContact O-N 3.11Å; Q78-Q81 WeakPolarHBondContact O-CB 3.47Å; Q78-Q81 PolarHBondContact O-N 3.08Å; Q78-Q81 VanDerWaalsContact O-N 3.08Å; E79-Q81 VanDerWaalsContact C-N 3.27Å; E79-Q81 PolarHBondContact O-N 3.36Å; Q81-L83 PolarHBondContact O-N 3.28Å; Q81-G84 WeakPolarHBondContact O-CA 3.34Å; Q81-G84 PolarHBondContact O-N 2.93Å
82	E	98.4	Very high	98.4	Very high	136 Å²	136	56.5 Å²	56.5	64%	0.636	29%	0.291	S	S	*	.	H	α-helix	trans	-62.3	-31.9	175.5	-68	170.5	-174.1	0	0	112.1	Q78 E79 G84	Q78-E82 PolarHBondContact NE2-OE1 3.36Å; Q78-E82 WeakPolarHBondContact O-CG 3.43Å; Q78-E82 PolarHBondContact O-N 2.95Å; E79-E82 WeakPolarHBondContact O-CB 3.38Å; E79-E82 PolarHBondContact O-N 3.32Å; E79-E82 VanDerWaalsContact O-N 3.14Å; E82-G84 PolarHBondContact O-N 2.94Å
83	L	97.7	Very high	98.3	Very high	68 Å²	68	57.8 Å²	57.8	36%	0.356	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-0.1	171.7	-65.4	172.3	0	0	0	113.8	W67 E79 L80 Q81 W96	W67-L83 HydrophobicContact CH2-CD1 4.06Å; W67-L83 HydrophobicContact CZ2-CD1 3.77Å; E79-L83 HydrophobicContact CG-CD1 4.45Å; E79-L83 VanDerWaalsContact O-CG 3.3Å; E79-L83 WeakPolarHBondContact O-CG 3.47Å; E79-L83 PolarHBondContact O-N 2.98Å; L80-L83 PolarHBondContact O-N 3.41Å; Q81-L83 PolarHBondContact O-N 3.28Å; L83-W96 HydrophobicContact CD1-CH2 4.23Å; L83-W96 HydrophobicContact CD1-CZ2 4.15Å
84	G	97.9	Very high	98.3	Very high	46 Å²	46	63.8 Å²	63.8	47%	0.474	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	87	15.4	179.4	0	0	0	0	0	114.7	L80 Q81 E82 K88	L80-G84 PolarHBondContact O-N 3.31Å; Q81-G84 WeakPolarHBondContact O-CA 3.34Å; Q81-G84 PolarHBondContact O-N 2.93Å; E82-G84 PolarHBondContact O-N 2.94Å; G84-K88 WeakPolarHBondContact O-CG 3.36Å
85	G	98.2	Very high	98.1	Very high	8 Å²	8	63.4 Å²	63.4	8%	0.082	34%	0.34	C	S	.	.			trans	82.9	170.8	179.5	0	0	0	0	0	114.1	L80 K87 K88	L80-G85 WeakPolarHBondContact O-CA 3.25Å; L80-G85 PolarHBondContact O-N 3.21Å; G85-K87 PolarHBondContact O-N 3.26Å; G85-K87 VanDerWaalsContact O-N 3.11Å; G85-K88 PolarHBondContact O-N 2.72Å
86	L	98	Very high	98.1	Very high	1 Å²	1	61.1 Å²	61.1	1%	0.005	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-54.3	-38.7	-172.5	-179.1	60.5	0	0	0	113.2	L60 L80 K88 I89 E333 M336 F341 N370	L60-L86 HydrophobicContact CD1-CD1 4.18Å; L60-L86 HydrophobicContact CD2-CD1 4.23Å; L80-L86 HydrophobicContact CD1-CB 4.49Å; L86-K88 PolarHBondContact O-N 2.88Å; L86-K88 VanDerWaalsContact O-N 3.14Å; L86-I89 PolarHBondContact O-N 2.88Å; L86-E333 HydrophobicContact CB-CG 4.48Å; L86-E333 HydrophobicContact CD2-CB 4.07Å; L86-E333 HydrophobicContact CD2-CG 4.06Å; L86-M336 HydrophobicContact CD1-CG 4.47Å; L86-M336 HydrophobicContact CD2-CB 3.88Å; L86-M336 HydrophobicContact CD2-CG 3.82Å; L86-F341 HydrophobicContact CD1-CE2 4.12Å; L86-F341 HydrophobicContact CD1-CZ 3.86Å; L86-N370 WeakPolarHBondContact CD1-ND2 3.32Å; L86-N370 WeakPolarHBondContact CG-ND2 3.39Å; L86-N370 PolarHBondContact O-OD1 3.14Å
87	K	97.6	Very high	98.1	Very high	128 Å²	128	62 Å²	62	56%	0.557	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-67.6	-9.2	-179	-67.2	171.7	173.6	121.5	0	114	G85 E333 P367	G85-K87 PolarHBondContact O-N 3.26Å; G85-K87 VanDerWaalsContact O-N 3.11Å; K87-E333 IonicContact NZ-OE2 3.44Å; K87-E333 PolarHBondContact NZ-OE2 2.63Å; K87-P367 HydrophobicContact CB-CG 4.43Å; K87-P367 HydrophobicContact CG-CG 3.85Å
88	K	98.1	Very high	98.1	Very high	153 Å²	153	60.8 Å²	60.8	67%	0.665	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-106.1	-8.8	178.6	-61.8	-59.7	-176.4	-178.9	0	113.3	G84 G85 L86 T90	G84-K88 WeakPolarHBondContact O-CG 3.36Å; G85-K88 PolarHBondContact O-N 2.72Å; L86-K88 PolarHBondContact O-N 2.88Å; L86-K88 VanDerWaalsContact O-N 3.14Å; K88-T90 PolarHBondContact O-N 3.1Å
89	I	98.2	Very high	98.1	Very high	6 Å²	6	55.4 Å²	55.4	3%	0.031	30%	0.3	C	S	.	.			trans	-77.4	121.5	177.4	-65.3	170.4	0	0	0	109.6	L60 W67 L80 L86 V91 W96 C369 N370	L60-I89 HydrophobicContact CD2-CB 4.26Å; L60-I89 HydrophobicContact CD2-CD1 4.2Å; L60-I89 HydrophobicContact CD2-CG2 3.59Å; W67-I89 HydrophobicContact CH2-CD1 4.11Å; L80-I89 HydrophobicContact CD1-CD1 3.45Å; L80-I89 VanDerWaalsContact CD1-CD1 3.45Å; L86-I89 PolarHBondContact O-N 2.88Å; I89-V91 HydrophobicContact CG2-CG2 4.06Å; I89-W96 HydrophobicContact CB-CZ2 4.25Å; I89-W96 HydrophobicContact CD1-CH2 3.59Å; I89-W96 HydrophobicContact CD1-CZ2 3.98Å; I89-W96 HydrophobicContact CD1-CZ3 4.36Å; I89-W96 HydrophobicContact CG1-CH2 4.07Å; I89-W96 HydrophobicContact CG1-CZ2 3.91Å; I89-W96 HydrophobicContact CG2-CD2 3.84Å; I89-W96 VanDerWaalsContact CG2-CE2 3.4Å; I89-W96 HydrophobicContact CG2-CE3 4.15Å; I89-W96 HydrophobicContact CG2-CH2 3.73Å; I89-W96 HydrophobicContact CG2-CZ2 3.36Å; I89-W96 HydrophobicContact CG2-CZ3 4.1Å; I89-C369 CarbonylContact O-C 3.58Å; I89-C369 WeakPolarHBondContact O-CB 3.49Å; I89-C369 PolarHBondContact O-SG 2.76Å; I89-N370 PolarHBondContact O-OD1 3.02Å
90	T	98.4	Very high	98.1	Very high	57 Å²	57	53.1 Å²	53.1	35%	0.35	29%	0.29	S	S	.	.			trans	-98.3	107.2	167.8	-56.7	0	0	0	0	108.8	K88 Q92 W96 C369 K373	K88-T90 PolarHBondContact O-N 3.1Å; T90-Q92 HydrophobicContact CG2-CG 3.95Å; T90-Q92 PolarHBondContact O-N 3.12Å; T90-Q92 VanDerWaalsContact O-N 3.11Å; T90-W96 VanDerWaalsContact O-CD1 3.23Å; T90-C369 WeakPolarHBondContact CA-O 3.27Å; T90-C369 HydrophobicContact CG2-CB 4.49Å; T90-K373 HydrophobicContact CG2-CD 4.38Å
91	V	98.6	Very high	98.1	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	29%	0.29	C	S	.	.			trans	-75.3	101.8	178.6	178.4	0	0	0	0	108.4	A59 L60 I89 W96 C369 N370 K373 L374	A59-V91 HydrophobicContact CB-CG1 3.73Å; L60-V91 HydrophobicContact CD1-CG2 4.06Å; L60-V91 HydrophobicContact CD2-CG2 3.57Å; L60-V91 HydrophobicContact CG-CG2 3.63Å; I89-V91 HydrophobicContact CG2-CG2 4.06Å; V91-W96 HydrophobicContact CB-CB 4.35Å; V91-W96 HydrophobicContact CG1-CB 3.95Å; V91-C369 PolarHBondContact N-O 2.85Å; V91-N370 VanDerWaalsContact CB-O 3.25Å; V91-N370 WeakPolarHBondContact CB-O 3.43Å; V91-N370 VanDerWaalsContact CG2-O 3.23Å; V91-N370 WeakPolarHBondContact CG2-O 3.37Å; V91-K373 CarbonylContact O-C 3.51Å; V91-K373 VanDerWaalsContact O-C 3.28Å; V91-L374 HydrophobicContact CG1-CD1 3.58Å; V91-L374 PolarHBondContact O-N 2.86Å
92	Q	98.4	Very high	98.2	Very high	69 Å²	69	47 Å²	47	32%	0.322	26%	0.261	S	S	.	.			trans	-158.6	156.1	177.8	59.9	172	60.4	0	0	110.2	T90 G95 W96 K373	T90-Q92 HydrophobicContact CG2-CG 3.95Å; T90-Q92 PolarHBondContact O-N 3.12Å; T90-Q92 VanDerWaalsContact O-N 3.11Å; Q92-G95 PolarHBondContact O-N 2.79Å; Q92-W96 PolarHBondContact O-N 2.71Å; Q92-K373 HydrophobicContact CB-CB 3.85Å; Q92-K373 HydrophobicContact CB-CD 4.43Å; Q92-K373 VanDerWaalsContact OE1-NZ 3.1Å
93	L	98	Very high	98.2	Very high	89 Å²	89	40.7 Å²	40.7	47%	0.466	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	152.3	169.9	-68.1	175.8	0	0	0	112	P97 E375	L93-P97 HydrophobicContact CD2-CB 3.68Å; L93-E375 HydrophobicContact CD1-CB 4.47Å; L93-E375 HydrophobicContact CD1-CG 4.06Å; L93-E375 HydrophobicContact CG-CB 4.33Å; L93-E375 HydrophobicContact CG-CG 4.39Å
94	P	96.7	Very high	98.3	Very high	126 Å²	126	37.4 Å²	37.4	82%	0.818	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	cis	-84.2	-5.1	-5.7	35.1	-35.9	0	0	0	113.7
95	G	95.9	Very high	98.3	Very high	43 Å²	43	35.3 Å²	35.3	44%	0.443	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-28.4	-168.9	0	0	0	0	0	115	Q92	Q92-G95 PolarHBondContact O-N 2.79Å
96	W	98.4	Very high	98.3	Very high	28 Å²	28	34.9 Å²	34.9	11%	0.106	19%	0.189	C	C	.	.	S	Bend	trans	-132.7	68	-176.8	-54.7	84	0	0	0	109.9	L60 R63 W67 L83 I89 T90 V91 Q92	L60-W96 HydrophobicContact CD2-CE3 4.04Å; L60-W96 HydrophobicContact CD2-CZ3 3.89Å; R63-W96 HydrophobicContact CB-CE3 4.08Å; R63-W96 HydrophobicContact CB-CH2 4.44Å; R63-W96 HydrophobicContact CB-CZ3 3.81Å; R63-W96 HydrophobicContact CG-CD2 4.36Å; R63-W96 HydrophobicContact CG-CE3 3.91Å; R63-W96 HydrophobicContact CG-CH2 3.82Å; R63-W96 HydrophobicContact CG-CZ2 4.28Å; R63-W96 HydrophobicContact CG-CZ3 3.62Å; W67-W96 HydrophobicContact CE3-CH2 4.46Å; W67-W96 HydrophobicContact CE3-CZ3 4.22Å; W67-W96 AromaticContact CH2-CH2 3.68Å; W67-W96 HydrophobicContact CH2-CH2 3.68Å; W67-W96 HydrophobicContact CH2-CZ3 4.19Å; W67-W96 HydrophobicContact CZ2-CH2 4.29Å; W67-W96 AromaticContact CZ3-CH2 3.76Å; W67-W96 HydrophobicContact CZ3-CH2 3.76Å; W67-W96 AromaticContact CZ3-CZ3 3.78Å; W67-W96 HydrophobicContact CZ3-CZ3 3.78Å; L83-W96 HydrophobicContact CD1-CH2 4.23Å; L83-W96 HydrophobicContact CD1-CZ2 4.15Å; I89-W96 HydrophobicContact CB-CZ2 4.25Å; I89-W96 HydrophobicContact CD1-CH2 3.59Å; I89-W96 HydrophobicContact CD1-CZ2 3.98Å; I89-W96 HydrophobicContact CD1-CZ3 4.36Å; I89-W96 HydrophobicContact CG1-CH2 4.07Å; I89-W96 HydrophobicContact CG1-CZ2 3.91Å; I89-W96 HydrophobicContact CG2-CD2 3.84Å; I89-W96 VanDerWaalsContact CG2-CE2 3.4Å; I89-W96 HydrophobicContact CG2-CE3 4.15Å; I89-W96 HydrophobicContact CG2-CH2 3.73Å; I89-W96 HydrophobicContact CG2-CZ2 3.36Å; I89-W96 HydrophobicContact CG2-CZ3 4.1Å; T90-W96 VanDerWaalsContact O-CD1 3.23Å; V91-W96 HydrophobicContact CB-CB 4.35Å; V91-W96 HydrophobicContact CG1-CB 3.95Å; Q92-W96 PolarHBondContact O-N 2.71Å
97	P	98.8	Very high	98.4	Very high	19 Å²	19	35 Å²	35	12%	0.123	19%	0.19	C	C	.	.			trans	-68	156.1	170.7	32.5	-34.6	0	0	0	110	A59 Y62 L93	A59-P97 WeakPolarHBondContact CA-O 3.38Å; A59-P97 WeakPolarHBondContact CB-O 3.37Å; Y62-P97 HydrophobicContact CD1-CG 4.22Å; Y62-P97 HydrophobicContact CE1-CG 4.11Å; L93-P97 HydrophobicContact CD2-CB 3.68Å
98	V	98.9	Very high	98.4	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.163	C	C	.	.			trans	-77	152.7	164.7	-59.9	0	0	0	0	110.5	A59 T102 V103 R139 L374 E375 Y376	A59-V98 HydrophobicContact CB-CG1 4.15Å; V98-T102 HydrophobicContact CB-CG2 4.18Å; V98-T102 HydrophobicContact CG1-CG2 4.1Å; V98-T102 HydrophobicContact CG2-CG2 4.09Å; V98-V103 HydrophobicContact CG2-CG2 4.47Å; V98-R139 PolarHBondContact O-NH1 2.99Å; V98-L374 HydrophobicContact CG1-CD1 3.83Å; V98-E375 HydrophobicContact CG1-CB 4.35Å; V98-E375 HydrophobicContact CG2-CG 4.46Å; V98-E375 WeakPolarHBondContact CG2-OE2 3.21Å; V98-E375 PolarHBondContact N-OE2 3.28Å; V98-E375 VanDerWaalsContact N-OE2 3.07Å; V98-Y376 HydrophobicContact CG2-CD2 4.01Å; V98-Y376 HydrophobicContact CG2-CE2 4.19Å
99	S	98.9	Very high	98.5	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	13%	0.132	C	C	.	.			trans	-86.5	-166.4	175.8	81.3	0	0	0	0	111.9	D58 D101 V103 D347	D58-S99 VanDerWaalsContact CG-N 3.34Å; D58-S99 WeakPolarHBondContact OD1-CB 3.49Å; D58-S99 PolarHBondContact OD1-N 3.18Å; D58-S99 PolarHBondContact OD1-OG 2.95Å; D58-S99 VanDerWaalsContact OD1-OG 3.08Å; D58-S99 PolarHBondContact OD2-N 3.16Å; D58-S99 VanDerWaalsContact OD2-N 3.12Å; D58-S99 PolarHBondContact OD2-OG 3.46Å; S99-D101 PolarHBondContact O-N 3.37Å; S99-D101 WeakPolarHBondContact OG-CB 3.43Å; S99-D101 PolarHBondContact OG-N 2.83Å; S99-D101 PolarHBondContact OG-OD1 3.43Å; S99-V103 WeakPolarHBondContact O-CG2 3.43Å; S99-D347 WeakPolarHBondContact CB-OD2 3.49Å; S99-D347 PolarHBondContact OG-OD2 3.36Å
100	D	98.8	Very high	98.5	Very high	8 Å²	8	23 Å²	23	4%	0.043	14%	0.138	C	C	.	.	H	α-helix	trans	-67	-22.4	176.2	66.9	-65	0	0	0	112.8	V103 L104 M136 R139 P141 M175	D100-V103 PolarHBondContact O-N 3Å; D100-L104 WeakPolarHBondContact O-CB 3.49Å; D100-L104 WeakPolarHBondContact O-CG 3.5Å; D100-L104 PolarHBondContact O-N 3.22Å; D100-M136 HydrophobicContact CB-CE 3.73Å; D100-M136 HydrophobicContact CB-SD 3.37Å; D100-M136 WeakPolarHBondContact CB-SD 3.38Å; D100-R139 PolarHBondContact N-O 2.93Å; D100-R139 VanDerWaalsContact N-O 3.1Å; D100-R139 VanDerWaalsContact OD1-O 3.11Å; D100-P141 HydrophobicContact CB-CB 3.9Å; D100-P141 VanDerWaalsContact CG-CA 3.43Å; D100-P141 WeakPolarHBondContact OD2-CA 3.32Å; D100-M175 WeakPolarHBondContact OD2-CE 3.37Å
101	D	98.9	Very high	98.5	Very high	1 Å²	1	20.3 Å²	20.3	1%	0.005	12%	0.121	C	C	.	.	H	α-helix	trans	-52.1	-61.8	174.9	-74.2	48	0	0	0	112.3	D58 S99 V103 L104 H105 M175 S348 V351	D58-D101 HydrophobicContact CB-CB 4.43Å; S99-D101 PolarHBondContact O-N 3.37Å; S99-D101 WeakPolarHBondContact OG-CB 3.43Å; S99-D101 PolarHBondContact OG-N 2.83Å; S99-D101 PolarHBondContact OG-OD1 3.43Å; D101-V103 VanDerWaalsContact C-N 3.31Å; D101-V103 PolarHBondContact O-N 3.18Å; D101-L104 PolarHBondContact O-N 2.77Å; D101-H105 WeakPolarHBondContact O-CB 3.28Å; D101-H105 PolarHBondContact O-N 3.31Å; D101-M175 HydrophobicContact CB-CG 4.39Å; D101-M175 HydrophobicContact CB-SD 4.28Å; D101-M175 VanDerWaalsContact OD2-CB 3.29Å; D101-M175 WeakPolarHBondContact OD2-CB 3.4Å; D101-S348 WeakPolarHBondContact OD2-CA 3.32Å; D101-S348 PolarHBondContact OD2-OG 2.88Å; D101-V351 HydrophobicContact CB-CB 4.27Å; D101-V351 HydrophobicContact CB-CG1 4.09Å; D101-V351 HydrophobicContact CB-CG2 4.18Å; D101-V351 VanDerWaalsContact OD2-CG1 3.26Å; D101-V351 WeakPolarHBondContact OD2-CG1 3.14Å
102	T	98.9	Very high	98.6	Very high	1 Å²	1	20.4 Å²	20.4	1%	0.006	12%	0.122	C	C	.	.	H	α-helix	trans	-65.4	-36.6	178.8	-63.3	0	0	0	0	111.7	G55 D58 V98 L104 H105 L106 L380	G55-T102 VanDerWaalsContact CA-OG1 3.23Å; G55-T102 WeakPolarHBondContact CA-OG1 3.44Å; D58-T102 WeakPolarHBondContact CB-OG1 3.46Å; D58-T102 WeakPolarHBondContact OD2-CB 3.47Å; D58-T102 PolarHBondContact OD2-N 3.14Å; D58-T102 PolarHBondContact OD2-OG1 2.96Å; V98-T102 HydrophobicContact CB-CG2 4.18Å; V98-T102 HydrophobicContact CG1-CG2 4.1Å; V98-T102 HydrophobicContact CG2-CG2 4.09Å; T102-L104 PolarHBondContact O-N 3.47Å; T102-H105 PolarHBondContact O-N 3.24Å; T102-L106 HydrophobicContact CG2-CD1 4.08Å; T102-L106 HydrophobicContact CG2-CG 4.44Å; T102-L106 VanDerWaalsContact O-CB 3.28Å; T102-L106 WeakPolarHBondContact O-CB 3.4Å; T102-L106 WeakPolarHBondContact O-CG 3.37Å; T102-L106 PolarHBondContact O-N 3.06Å; T102-L380 HydrophobicContact CG2-CD1 4.23Å; T102-L380 HydrophobicContact CG2-CD2 4.17Å
103	V	98.9	Very high	98.6	Very high	3 Å²	3	18.9 Å²	18.9	2%	0.018	12%	0.116	C	C	.	.	H	α-helix	trans	-61.7	-45.6	179.7	172.5	0	0	0	0	110.5	V98 S99 D100 D101 A107 D135 M136 Y376	V98-V103 HydrophobicContact CG2-CG2 4.47Å; S99-V103 WeakPolarHBondContact O-CG2 3.43Å; D100-V103 PolarHBondContact O-N 3Å; D101-V103 VanDerWaalsContact C-N 3.31Å; D101-V103 PolarHBondContact O-N 3.18Å; V103-A107 PolarHBondContact O-N 2.91Å; V103-D135 HydrophobicContact CG1-CB 4.33Å; V103-M136 HydrophobicContact CB-CE 4.08Å; V103-M136 HydrophobicContact CG1-CE 3.66Å; V103-M136 HydrophobicContact CG1-SD 4.41Å; V103-Y376 HydrophobicContact CG2-CE2 4.28Å
104	L	98.9	Very high	98.6	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-78.9	-31.6	179.6	-65.2	179.9	0	0	0	112.5	D100 D101 T102 L106 A107 T108 Y129 M136 T145 M175 R176	D100-L104 WeakPolarHBondContact O-CB 3.49Å; D100-L104 WeakPolarHBondContact O-CG 3.5Å; D100-L104 PolarHBondContact O-N 3.22Å; D101-L104 PolarHBondContact O-N 2.77Å; T102-L104 PolarHBondContact O-N 3.47Å; L104-L106 VanDerWaalsContact C-N 3.34Å; L104-A107 WeakPolarHBondContact O-CB 3.37Å; L104-A107 PolarHBondContact O-N 3.41Å; L104-T108 PolarHBondContact O-N 3.46Å; L104-T108 PolarHBondContact O-OG1 2.99Å; L104-T108 VanDerWaalsContact O-OG1 3.13Å; L104-Y129 HydrophobicContact CD2-CD1 4.24Å; L104-M136 HydrophobicContact CD1-CE 4.14Å; L104-M136 HydrophobicContact CD2-CE 3.72Å; L104-M136 HydrophobicContact CG-CE 3.67Å; L104-T145 HydrophobicContact CD1-CG2 3.54Å; L104-M175 HydrophobicContact CD1-CE 3.87Å; L104-R176 HydrophobicContact CB-CB 3.96Å
105	H	98.9	Very high	98.5	Very high	1 Å²	1	13.3 Å²	13.3	1%	0.005	9%	0.09	C	C	.	.	H	α-helix	trans	-62.5	-42.5	170.7	-172.5	-160.2	0	0	0	111.2	S54 D101 T102 A107 T108 A109 R176 C179	S54-H105 PolarHBondContact OG-ND1 3.46Å; D101-H105 WeakPolarHBondContact O-CB 3.28Å; D101-H105 PolarHBondContact O-N 3.31Å; T102-H105 PolarHBondContact O-N 3.24Å; H105-A107 VanDerWaalsContact C-N 3.35Å; H105-T108 PolarHBondContact O-N 3.08Å; H105-A109 WeakPolarHBondContact O-CB 3.27Å; H105-A109 PolarHBondContact O-N 3.2Å; H105-R176 HydrophobicContact CB-CB 4.37Å; H105-C179 VanDerWaalsContact CD2-SG 3.57Å; H105-C179 WeakPolarHBondContact NE2-CB 3.34Å; H105-C179 PolarHBondContact NE2-N 2.99Å
106	L	98.9	Very high	98.6	Very high	0 Å²	0	15 Å²	15	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-61.4	-41	170.2	-87.7	169.5	0	0	0	111.9	T102 L104 T108 A109 E110 Y376 R379 L380	T102-L106 HydrophobicContact CG2-CD1 4.08Å; T102-L106 HydrophobicContact CG2-CG 4.44Å; T102-L106 VanDerWaalsContact O-CB 3.28Å; T102-L106 WeakPolarHBondContact O-CB 3.4Å; T102-L106 WeakPolarHBondContact O-CG 3.37Å; T102-L106 PolarHBondContact O-N 3.06Å; L104-L106 VanDerWaalsContact C-N 3.34Å; L106-T108 PolarHBondContact O-N 3.43Å; L106-A109 PolarHBondContact O-N 2.88Å; L106-E110 VanDerWaalsContact O-CB 3.32Å; L106-E110 WeakPolarHBondContact O-CB 3.46Å; L106-E110 VanDerWaalsContact O-CG 3.3Å; L106-E110 WeakPolarHBondContact O-CG 3.41Å; L106-E110 PolarHBondContact O-N 2.81Å; L106-Y376 HydrophobicContact CD1-CD2 4.05Å; L106-Y376 HydrophobicContact CD1-CG 4.16Å; L106-R379 HydrophobicContact CD1-CB 4.48Å; L106-R379 HydrophobicContact CD2-CB 4.08Å; L106-L380 HydrophobicContact CD1-CD2 4.08Å; L106-L380 HydrophobicContact CD1-CG 4.22Å; L106-L380 HydrophobicContact CD2-CD2 3.57Å; L106-L380 HydrophobicContact CD2-CG 3.99Å; L106-L380 HydrophobicContact CG-CD2 3.62Å; L106-L380 HydrophobicContact CG-CG 4.22Å
107	A	98.9	Very high	98.3	Very high	3 Å²	3	17 Å²	17	3%	0.025	10%	0.101	C	C	.	.	H	α-helix	trans	-60.4	-43.9	177.5	0	0	0	0	0	111.9	V103 L104 H105 A111 C128 Y129	V103-A107 PolarHBondContact O-N 2.91Å; L104-A107 WeakPolarHBondContact O-CB 3.37Å; L104-A107 PolarHBondContact O-N 3.41Å; H105-A107 VanDerWaalsContact C-N 3.35Å; A107-A111 PolarHBondContact O-N 2.97Å; A107-A111 VanDerWaalsContact O-N 3.17Å; A107-C128 HydrophobicContact CB-CB 4.01Å; A107-C128 VanDerWaalsContact O-CB 3.24Å; A107-C128 WeakPolarHBondContact O-CB 3.49Å; A107-Y129 HydrophobicContact CB-CD1 3.86Å; A107-Y129 HydrophobicContact CB-CE1 4.31Å
108	T	98.9	Very high	98	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-61.1	-47.8	173.1	-48.9	0	0	0	0	110.9	L104 H105 L106 E110 A111 L112 Y129 R176 C179 I180	L104-T108 PolarHBondContact O-N 3.46Å; L104-T108 PolarHBondContact O-OG1 2.99Å; L104-T108 VanDerWaalsContact O-OG1 3.13Å; H105-T108 PolarHBondContact O-N 3.08Å; L106-T108 PolarHBondContact O-N 3.43Å; T108-E110 PolarHBondContact O-N 2.84Å; T108-A111 PolarHBondContact O-N 3.07Å; T108-L112 HydrophobicContact CG2-CD1 4.05Å; T108-L112 VanDerWaalsContact O-CG 3.31Å; T108-L112 WeakPolarHBondContact O-CG 3.26Å; T108-L112 PolarHBondContact O-N 3.21Å; T108-Y129 WeakPolarHBondContact OG1-CE1 3.49Å; T108-Y129 PolarHBondContact OG1-OH 2.66Å; T108-R176 VanDerWaalsContact CB-O 3.28Å; T108-R176 WeakPolarHBondContact CB-O 3.34Å; T108-R176 PolarHBondContact OG1-O 3.4Å; T108-C179 VanDerWaalsContact CB-SG 3.54Å; T108-C179 WeakPolarHBondContact CG2-SG 3.45Å; T108-I180 HydrophobicContact CG2-CD1 4.26Å; T108-I180 HydrophobicContact CG2-CG1 3.97Å
109	A	98.9	Very high	97.7	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-63.5	-42.7	-178.9	0	0	0	0	0	112.5	M51 H105 L106 A111 L112 I113 C179 C383 L387	M51-A109 HydrophobicContact CE-CB 3.73Å; H105-A109 WeakPolarHBondContact O-CB 3.27Å; H105-A109 PolarHBondContact O-N 3.2Å; L106-A109 PolarHBondContact O-N 2.88Å; A109-A111 VanDerWaalsContact C-N 3.29Å; A109-A111 PolarHBondContact O-N 3.07Å; A109-L112 PolarHBondContact O-N 3.13Å; A109-I113 WeakPolarHBondContact O-CG1 3.28Å; A109-I113 WeakPolarHBondContact O-CG2 3.31Å; A109-I113 PolarHBondContact O-N 2.89Å; A109-C179 HydrophobicContact CB-CB 3.95Å; A109-C383 HydrophobicContact CB-CB 3.95Å; A109-L387 HydrophobicContact CB-CD1 4.26Å
110	E	98.9	Very high	97.6	Very high	36 Å²	36	35.8 Å²	35.8	17%	0.168	19%	0.187	C	C	.	.	H	α-helix	trans	-60.1	-38.9	176.7	-78.4	-179.8	-175	0	0	111.5	L106 T108 I113 K131 R379	L106-E110 VanDerWaalsContact O-CB 3.32Å; L106-E110 WeakPolarHBondContact O-CB 3.46Å; L106-E110 VanDerWaalsContact O-CG 3.3Å; L106-E110 WeakPolarHBondContact O-CG 3.41Å; L106-E110 PolarHBondContact O-N 2.81Å; T108-E110 PolarHBondContact O-N 2.84Å; E110-I113 WeakPolarHBondContact O-CG1 3.41Å; E110-K131 IonicContact OE2-NZ 2.62Å; E110-K131 PolarHBondContact OE2-NZ 2.93Å; E110-R379 IonicContact OE1-CZ 2.63Å; E110-R379 IonicContact OE1-NE 2.84Å; E110-R379 PolarHBondContact OE1-NE 3.29Å; E110-R379 VanDerWaalsContact OE1-NE 3.12Å; E110-R379 IonicContact OE1-NH2 3.12Å; E110-R379 PolarHBondContact OE1-NH2 3.45Å; E110-R379 IonicContact OE2-NH2 3.89Å
111	A	98.9	Very high	97.6	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-68.1	-44	174.5	0	0	0	0	0	112.3	A107 T108 A109 I113 T114 E124 V125 C128	A107-A111 PolarHBondContact O-N 2.97Å; A107-A111 VanDerWaalsContact O-N 3.17Å; T108-A111 PolarHBondContact O-N 3.07Å; A109-A111 VanDerWaalsContact C-N 3.29Å; A109-A111 PolarHBondContact O-N 3.07Å; A111-I113 VanDerWaalsContact C-N 3.34Å; A111-I113 PolarHBondContact O-N 3.32Å; A111-T114 WeakPolarHBondContact O-CB 3.47Å; A111-T114 WeakPolarHBondContact O-CG2 3.24Å; A111-T114 PolarHBondContact O-N 3.44Å; A111-T114 PolarHBondContact O-OG1 2.96Å; A111-E124 HydrophobicContact CB-CB 4.23Å; A111-E124 HydrophobicContact CB-CG 3.74Å; A111-V125 HydrophobicContact CB-CB 4.19Å; A111-V125 HydrophobicContact CB-CG2 3.51Å; A111-C128 HydrophobicContact CB-CB 4.33Å
112	L	98.8	Very high	97.5	Very high	2 Å²	2	36 Å²	36	1%	0.01	19%	0.188	C	C	.	.	H	α-helix	trans	-62.7	-37.6	-179.8	-69.8	166.6	0	0	0	112.8	T108 A109 T114 G115 L121 C179 I180 R183 Y184 V196 L387	T108-L112 HydrophobicContact CG2-CD1 4.05Å; T108-L112 VanDerWaalsContact O-CG 3.31Å; T108-L112 WeakPolarHBondContact O-CG 3.26Å; T108-L112 PolarHBondContact O-N 3.21Å; A109-L112 PolarHBondContact O-N 3.13Å; L112-T114 PolarHBondContact O-N 3.31Å; L112-G115 PolarHBondContact O-N 3.02Å; L112-L121 HydrophobicContact CD2-CD1 4.06Å; L112-L121 HydrophobicContact CD2-CD2 3.96Å; L112-C179 HydrophobicContact CD1-CB 4.22Å; L112-I180 HydrophobicContact CD1-CG1 4.06Å; L112-R183 HydrophobicContact CD1-CB 4.3Å; L112-R183 HydrophobicContact CD2-CB 4.34Å; L112-R183 HydrophobicContact CD2-CG 4.14Å; L112-Y184 HydrophobicContact CD2-CE2 4.38Å; L112-V196 HydrophobicContact CD2-CG1 4.41Å; L112-L387 HydrophobicContact CB-CD2 3.81Å; L112-L387 HydrophobicContact CD1-CD2 4.26Å
113	I	98.7	Very high	97.5	Very high	37 Å²	37	38.4 Å²	38.4	19%	0.19	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-7.5	-178	64.8	165.3	0	0	0	113.9	A109 E110 A111 G115 K386 L387	A109-I113 WeakPolarHBondContact O-CG1 3.28Å; A109-I113 WeakPolarHBondContact O-CG2 3.31Å; A109-I113 PolarHBondContact O-N 2.89Å; E110-I113 WeakPolarHBondContact O-CG1 3.41Å; A111-I113 VanDerWaalsContact C-N 3.34Å; A111-I113 PolarHBondContact O-N 3.32Å; I113-G115 PolarHBondContact O-N 3.05Å; I113-K386 HydrophobicContact CB-CB 3.74Å; I113-K386 HydrophobicContact CD1-CB 4.35Å; I113-K386 HydrophobicContact CD1-CG 4.39Å; I113-K386 HydrophobicContact CG2-CB 3.47Å; I113-K386 VanDerWaalsContact CG2-CB 3.47Å; I113-L387 HydrophobicContact CG2-CD2 3.94Å; I113-L387 HydrophobicContact CG2-CG 3.74Å
114	T	98.4	Very high	97.5	Very high	62 Å²	62	39.8 Å²	39.8	38%	0.38	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-18.8	170.9	67.8	0	0	0	0	112.5	A111 L112 K116 E124	A111-T114 WeakPolarHBondContact O-CB 3.47Å; A111-T114 WeakPolarHBondContact O-CG2 3.24Å; A111-T114 PolarHBondContact O-N 3.44Å; A111-T114 PolarHBondContact O-OG1 2.96Å; L112-T114 PolarHBondContact O-N 3.31Å; T114-K116 PolarHBondContact O-N 2.82Å; T114-K116 WeakPolarHBondContact OG1-CB 3.33Å; T114-K116 WeakPolarHBondContact OG1-CG 3.46Å; T114-K116 PolarHBondContact OG1-N 3.09Å; T114-E124 HydrophobicContact CG2-CG 3.93Å
115	G	94.8	Very high	97.5	Very high	36 Å²	36	39.8 Å²	39.8	37%	0.371	21%	0.207	S	C	.	.			trans	75.4	2.6	-175.9	0	0	0	0	0	114.3	L112 I113	L112-G115 PolarHBondContact O-N 3.02Å; I113-G115 PolarHBondContact O-N 3.05Å
116	K	97.1	Very high	97.5	Very high	79 Å²	79	39.8 Å²	39.8	34%	0.343	21%	0.207	S	C	.	.			trans	-62.2	152.8	172.3	-67.5	174.3	-179.8	-178.6	0	110.6	T114 Q120 L121 E124	T114-K116 PolarHBondContact O-N 2.82Å; T114-K116 WeakPolarHBondContact OG1-CB 3.33Å; T114-K116 WeakPolarHBondContact OG1-CG 3.46Å; T114-K116 PolarHBondContact OG1-N 3.09Å; K116-Q120 HydrophobicContact CB-CB 4.1Å; K116-Q120 HydrophobicContact CD-CB 4.34Å; K116-Q120 HydrophobicContact CG-CB 4.36Å; K116-L121 HydrophobicContact CB-CB 4.35Å; K116-E124 HydrophobicContact CD-CB 3.95Å; K116-E124 HydrophobicContact CD-CG 4.26Å; K116-E124 IonicContact NZ-OE2 2.97Å; K116-E124 PolarHBondContact NZ-OE2 2.88Å
117	T	94.1	Very high	97.4	Very high	70 Å²	70	44.6 Å²	44.6	43%	0.429	23%	0.228	S	C	.	.			trans	-129.4	164.2	179.9	58.8	0	0	0	0	111	E119 Q120 L121	T117-E119 PolarHBondContact O-N 3.34Å; T117-Q120 PolarHBondContact O-N 3.22Å; T117-L121 PolarHBondContact O-N 3.47Å
118	E	90.8	Very high	97.4	Very high	147 Å²	147	44.7 Å²	44.7	69%	0.687	23%	0.229	S	C	*	.	H	α-helix	trans	50.9	-133.8	172.7	-56.1	-178.7	172.8	0	0	113.1	Q120 L121 L122	E118-Q120 VanDerWaalsContact C-N 3.25Å; E118-Q120 PolarHBondContact O-N 3.09Å; E118-L121 WeakPolarHBondContact O-CB 3.46Å; E118-L121 PolarHBondContact O-N 3.28Å; E118-L122 WeakPolarHBondContact O-CG 3.44Å; E118-L122 PolarHBondContact O-N 2.71Å
119	E	93.1	Very high	97.4	Very high	136 Å²	136	44.8 Å²	44.8	64%	0.636	23%	0.229	S	C	*	.	H	α-helix	trans	-58.3	-35.4	-177.4	-171.5	174.1	-166	0	0	112.6	T117 L121 L122 D123	T117-E119 PolarHBondContact O-N 3.34Å; E119-L121 VanDerWaalsContact C-N 3.32Å; E119-L121 PolarHBondContact O-N 2.73Å; E119-L122 PolarHBondContact O-N 2.96Å; E119-D123 WeakPolarHBondContact O-CB 3.24Å; E119-D123 PolarHBondContact O-N 3.28Å
120	Q	96.8	Very high	97.4	Very high	130 Å²	130	47 Å²	47	61%	0.607	24%	0.242	S	C	*	.	H	α-helix	trans	-66.5	-35.8	177.6	-63.7	-179.4	-19.9	0	0	112.1	K116 T117 E118 E124	K116-Q120 HydrophobicContact CB-CB 4.1Å; K116-Q120 HydrophobicContact CD-CB 4.34Å; K116-Q120 HydrophobicContact CG-CB 4.36Å; T117-Q120 PolarHBondContact O-N 3.22Å; E118-Q120 VanDerWaalsContact C-N 3.25Å; E118-Q120 PolarHBondContact O-N 3.09Å; Q120-E124 WeakPolarHBondContact O-CB 3.48Å; Q120-E124 PolarHBondContact O-N 3.25Å; Q120-E124 VanDerWaalsContact O-N 3.09Å
121	L	98.2	Very high	97.4	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-68.1	-44.3	173.6	176.3	60.9	0	0	0	110.8	L112 K116 T117 E118 E119 D123 E124 V125 V196	L112-L121 HydrophobicContact CD2-CD1 4.06Å; L112-L121 HydrophobicContact CD2-CD2 3.96Å; K116-L121 HydrophobicContact CB-CB 4.35Å; T117-L121 PolarHBondContact O-N 3.47Å; E118-L121 WeakPolarHBondContact O-CB 3.46Å; E118-L121 PolarHBondContact O-N 3.28Å; E119-L121 VanDerWaalsContact C-N 3.32Å; E119-L121 PolarHBondContact O-N 2.73Å; L121-D123 VanDerWaalsContact C-N 3.28Å; L121-D123 PolarHBondContact O-N 2.9Å; L121-E124 PolarHBondContact O-N 3.47Å; L121-V125 HydrophobicContact CD1-CG2 4.1Å; L121-V125 HydrophobicContact CG-CG2 4.36Å; L121-V125 VanDerWaalsContact O-CG2 3.3Å; L121-V125 WeakPolarHBondContact O-CG2 3.38Å; L121-V125 PolarHBondContact O-N 2.92Å; L121-V196 HydrophobicContact CD2-CG1 4.12Å; L121-V196 HydrophobicContact CD2-CG2 3.97Å
122	L	98.1	Very high	97.4	Very high	13 Å²	13	50.6 Å²	50.6	7%	0.068	26%	0.26	C	S	.	.	H	α-helix	trans	-62.8	-37.7	179.4	-60.8	-176.8	0	0	0	111.9	E118 E119 A126 F195 E199 T200 M203	E118-L122 WeakPolarHBondContact O-CG 3.44Å; E118-L122 PolarHBondContact O-N 2.71Å; E119-L122 PolarHBondContact O-N 2.96Å; L122-A126 WeakPolarHBondContact O-CB 3.38Å; L122-A126 PolarHBondContact O-N 3.49Å; L122-F195 HydrophobicContact CD1-CE1 4.4Å; L122-F195 HydrophobicContact CD1-CZ 4.3Å; L122-E199 HydrophobicContact CD1-CB 3.88Å; L122-E199 HydrophobicContact CD1-CG 3.95Å; L122-E199 HydrophobicContact CD2-CB 3.51Å; L122-E199 HydrophobicContact CD2-CG 4.35Å; L122-E199 HydrophobicContact CG-CB 4.36Å; L122-T200 HydrophobicContact CD2-CG2 4.03Å; L122-M203 HydrophobicContact CB-CE 3.87Å; L122-M203 HydrophobicContact CD2-CE 3.93Å; L122-M203 HydrophobicContact CG-CE 4.46Å; L122-M203 WeakPolarHBondContact O-CE 3.47Å
123	D	98.1	Very high	97.3	Very high	50 Å²	50	52.5 Å²	52.5	27%	0.267	27%	0.27	S	S	.	.	H	α-helix	trans	-65.1	-43.7	173.9	-165.3	62.2	0	0	0	112.1	E119 L121 A126 F127 P154 G155	E119-D123 WeakPolarHBondContact O-CB 3.24Å; E119-D123 PolarHBondContact O-N 3.28Å; L121-D123 VanDerWaalsContact C-N 3.28Å; L121-D123 PolarHBondContact O-N 2.9Å; D123-A126 PolarHBondContact O-N 3.4Å; D123-F127 PolarHBondContact O-N 3.39Å; D123-P154 WeakPolarHBondContact OD1-CA 3.31Å; D123-G155 PolarHBondContact OD1-N 3.23Å; D123-G155 PolarHBondContact OD2-N 3.31Å
124	E	98.6	Very high	97.3	Very high	33 Å²	33	59.2 Å²	59.2	15%	0.154	30%	0.297	C	S	.	.	H	α-helix	trans	-63.8	-41.6	176.5	-172.4	66.4	-163	0	0	112.1	A111 T114 K116 Q120 L121 A126 F127 C128	A111-E124 HydrophobicContact CB-CB 4.23Å; A111-E124 HydrophobicContact CB-CG 3.74Å; T114-E124 HydrophobicContact CG2-CG 3.93Å; K116-E124 HydrophobicContact CD-CB 3.95Å; K116-E124 HydrophobicContact CD-CG 4.26Å; K116-E124 IonicContact NZ-OE2 2.97Å; K116-E124 PolarHBondContact NZ-OE2 2.88Å; Q120-E124 WeakPolarHBondContact O-CB 3.48Å; Q120-E124 PolarHBondContact O-N 3.25Å; Q120-E124 VanDerWaalsContact O-N 3.09Å; L121-E124 PolarHBondContact O-N 3.47Å; E124-A126 VanDerWaalsContact C-N 3.35Å; E124-A126 PolarHBondContact O-N 3.09Å; E124-F127 WeakPolarHBondContact O-CB 3.32Å; E124-F127 PolarHBondContact O-N 3.45Å; E124-C128 WeakPolarHBondContact O-CB 3.3Å; E124-C128 PolarHBondContact O-N 2.96Å
125	V	98.8	Very high	97.3	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-61.8	-45	175.8	172.6	0	0	0	0	110.3	A111 L121 F127 C128 Y129 T200 M203	A111-V125 HydrophobicContact CB-CB 4.19Å; A111-V125 HydrophobicContact CB-CG2 3.51Å; L121-V125 HydrophobicContact CD1-CG2 4.1Å; L121-V125 HydrophobicContact CG-CG2 4.36Å; L121-V125 VanDerWaalsContact O-CG2 3.3Å; L121-V125 WeakPolarHBondContact O-CG2 3.38Å; L121-V125 PolarHBondContact O-N 2.92Å; V125-F127 VanDerWaalsContact C-N 3.31Å; V125-F127 PolarHBondContact O-N 3.4Å; V125-C128 PolarHBondContact O-N 3.39Å; V125-Y129 HydrophobicContact CG1-CD1 4.37Å; V125-Y129 HydrophobicContact CG1-CD2 3.91Å; V125-Y129 HydrophobicContact CG1-CE1 3.91Å; V125-Y129 HydrophobicContact CG1-CE2 3.38Å; V125-Y129 HydrophobicContact CG1-CG 4.38Å; V125-Y129 PolarHBondContact O-N 2.89Å; V125-T200 HydrophobicContact CB-CG2 4.12Å; V125-T200 HydrophobicContact CG1-CG2 3.72Å; V125-T200 HydrophobicContact CG2-CG2 3.91Å; V125-M203 HydrophobicContact CB-CE 4.12Å; V125-M203 HydrophobicContact CB-SD 4.34Å; V125-M203 HydrophobicContact CG1-CE 4.11Å; V125-M203 HydrophobicContact CG1-SD 3.82Å
126	A	98.7	Very high	97.5	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-60.2	-42.2	176.1	0	0	0	0	0	111.8	L122 D123 E124 Y129 V130 L152 P154 C160 M203	L122-A126 WeakPolarHBondContact O-CB 3.38Å; L122-A126 PolarHBondContact O-N 3.49Å; D123-A126 PolarHBondContact O-N 3.4Å; E124-A126 VanDerWaalsContact C-N 3.35Å; E124-A126 PolarHBondContact O-N 3.09Å; A126-Y129 PolarHBondContact O-N 2.8Å; A126-V130 WeakPolarHBondContact O-CG2 3.21Å; A126-V130 PolarHBondContact O-N 2.71Å; A126-V130 VanDerWaalsContact O-N 3.08Å; A126-L152 HydrophobicContact CB-CD1 4.14Å; A126-P154 HydrophobicContact CB-CB 4.38Å; A126-C160 HydrophobicContact CB-CB 4.02Å; A126-M203 HydrophobicContact CB-SD 4.22Å
127	F	98.6	Very high	97.5	Very high	102 Å²	102	59.5 Å²	59.5	45%	0.447	30%	0.301	S	S	.	.	H	α-helix	trans	-60.3	-48	173.8	174.6	-97	0	0	0	112.3	D123 E124 V125 Y129 V130 K131 P154	D123-F127 PolarHBondContact O-N 3.39Å; E124-F127 WeakPolarHBondContact O-CB 3.32Å; E124-F127 PolarHBondContact O-N 3.45Å; V125-F127 VanDerWaalsContact C-N 3.31Å; V125-F127 PolarHBondContact O-N 3.4Å; F127-Y129 PolarHBondContact O-N 2.92Å; F127-V130 PolarHBondContact O-N 3.45Å; F127-K131 HydrophobicContact CE1-CD 4.45Å; F127-K131 WeakPolarHBondContact O-CB 3.37Å; F127-K131 PolarHBondContact O-N 3.09Å; F127-P154 HydrophobicContact CB-CB 3.91Å; F127-P154 HydrophobicContact CB-CG 4.27Å; F127-P154 HydrophobicContact CD2-CG 4.47Å
128	C	98.8	Very high	97.6	Very high	5 Å²	5	58.9 Å²	58.9	3%	0.034	31%	0.309	C	S	.	.	H	α-helix	trans	-64	-37.3	178.7	-78.7	0	0	0	0	112.5	A107 A111 E124 V125 K131 G132	A107-C128 HydrophobicContact CB-CB 4.01Å; A107-C128 VanDerWaalsContact O-CB 3.24Å; A107-C128 WeakPolarHBondContact O-CB 3.49Å; A111-C128 HydrophobicContact CB-CB 4.33Å; E124-C128 WeakPolarHBondContact O-CB 3.3Å; E124-C128 PolarHBondContact O-N 2.96Å; V125-C128 PolarHBondContact O-N 3.39Å; C128-K131 PolarHBondContact O-N 3.05Å; C128-G132 PolarHBondContact O-N 3.23Å
129	Y	98.8	Very high	98	Very high	2 Å²	2	52.6 Å²	52.6	1%	0.008	28%	0.279	C	S	.	.	H	α-helix	trans	-63.4	-46.9	173.5	-69.2	-18.3	0	0	0	112	L104 A107 T108 V125 A126 F127 K131 G132 M133 L152 R176 M203	L104-Y129 HydrophobicContact CD2-CD1 4.24Å; A107-Y129 HydrophobicContact CB-CD1 3.86Å; A107-Y129 HydrophobicContact CB-CE1 4.31Å; T108-Y129 WeakPolarHBondContact OG1-CE1 3.49Å; T108-Y129 PolarHBondContact OG1-OH 2.66Å; V125-Y129 HydrophobicContact CG1-CD1 4.37Å; V125-Y129 HydrophobicContact CG1-CD2 3.91Å; V125-Y129 HydrophobicContact CG1-CE1 3.91Å; V125-Y129 HydrophobicContact CG1-CE2 3.38Å; V125-Y129 HydrophobicContact CG1-CG 4.38Å; V125-Y129 PolarHBondContact O-N 2.89Å; A126-Y129 PolarHBondContact O-N 2.8Å; F127-Y129 PolarHBondContact O-N 2.92Å; Y129-K131 VanDerWaalsContact C-N 3.28Å; Y129-K131 PolarHBondContact O-N 2.9Å; Y129-G132 PolarHBondContact O-N 3.47Å; Y129-M133 WeakPolarHBondContact O-CG 3.32Å; Y129-M133 PolarHBondContact O-N 3.13Å; Y129-L152 HydrophobicContact CD2-CD1 4.38Å; Y129-R176 VanDerWaalsContact CZ-NE 3.3Å; Y129-R176 PolarHBondContact OH-NE 3.24Å; Y129-R176 VanDerWaalsContact OH-NE 3.07Å; Y129-M203 HydrophobicContact CD2-SD 4.03Å; Y129-M203 HydrophobicContact CE2-CB 4.39Å; Y129-M203 HydrophobicContact CE2-SD 3.84Å
130	V	98.6	Very high	98.2	Very high	46 Å²	46	47.9 Å²	47.9	28%	0.279	26%	0.263	S	S	.	.	H	α-helix	trans	-60	-39.6	175.9	171.5	0	0	0	0	111.3	A126 F127 V149 L152	A126-V130 WeakPolarHBondContact O-CG2 3.21Å; A126-V130 PolarHBondContact O-N 2.71Å; A126-V130 VanDerWaalsContact O-N 3.08Å; F127-V130 PolarHBondContact O-N 3.45Å; V130-V149 HydrophobicContact CB-CG1 4.35Å; V130-V149 HydrophobicContact CG2-CG1 3.86Å; V130-L152 HydrophobicContact CG2-CB 4.02Å
131	K	98.6	Very high	98.2	Very high	101 Å²	101	43.4 Å²	43.4	44%	0.439	25%	0.245	S	C	.	.	H	α-helix	trans	-66	-46	174.5	-179.6	-170	168.9	-157.3	0	111.6	E110 F127 C128 Y129 M133 K134	E110-K131 IonicContact OE2-NZ 2.62Å; E110-K131 PolarHBondContact OE2-NZ 2.93Å; F127-K131 HydrophobicContact CE1-CD 4.45Å; F127-K131 WeakPolarHBondContact O-CB 3.37Å; F127-K131 PolarHBondContact O-N 3.09Å; C128-K131 PolarHBondContact O-N 3.05Å; Y129-K131 VanDerWaalsContact C-N 3.28Å; Y129-K131 PolarHBondContact O-N 2.9Å; K131-M133 VanDerWaalsContact C-N 3.32Å; K131-M133 PolarHBondContact O-N 3Å; K131-K134 WeakPolarHBondContact O-CB 3.42Å; K131-K134 PolarHBondContact O-N 3.29Å; K131-K134 VanDerWaalsContact O-N 3.16Å
132	G	98.2	Very high	98.1	Very high	11 Å²	11	45 Å²	45	11%	0.113	26%	0.262	C	S	.	.	H	α-helix	trans	-61.3	-37.7	-179.1	0	0	0	0	0	112.8	C128 Y129 K134 D135	C128-G132 PolarHBondContact O-N 3.23Å; Y129-G132 PolarHBondContact O-N 3.47Å; G132-K134 PolarHBondContact O-N 3.19Å; G132-D135 PolarHBondContact O-N 3.24Å
133	M	98	Very high	98	Very high	42 Å²	42	51.4 Å²	51.4	21%	0.207	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-60.6	-14.2	176.5	-75.6	-57.8	-55.5	0	0	114.6	Y129 K131 D135 M136 P141 A146 V149	Y129-M133 WeakPolarHBondContact O-CG 3.32Å; Y129-M133 PolarHBondContact O-N 3.13Å; K131-M133 VanDerWaalsContact C-N 3.32Å; K131-M133 PolarHBondContact O-N 3Å; M133-D135 PolarHBondContact O-N 2.98Å; M133-M136 HydrophobicContact CE-CG 3.78Å; M133-M136 WeakPolarHBondContact O-CG 3.43Å; M133-M136 HydrophobicContact SD-CE 3.66Å; M133-M136 HydrophobicContact SD-CG 3.87Å; M133-M136 HydrophobicContact SD-SD 4.42Å; M133-P141 HydrophobicContact CE-CB 4.19Å; M133-P141 HydrophobicContact CE-CG 4.23Å; M133-A146 HydrophobicContact CE-CB 3.64Å; M133-V149 HydrophobicContact CB-CG1 4.19Å; M133-V149 HydrophobicContact CG-CB 3.75Å; M133-V149 HydrophobicContact CG-CG1 3.42Å; M133-V149 VanDerWaalsContact CG-CG1 3.42Å; M133-V149 HydrophobicContact CG-CG2 3.99Å; M133-V149 HydrophobicContact SD-CG2 4.49Å
134	K	98.1	Very high	97.9	Very high	177 Å²	177	50.9 Å²	50.9	77%	0.77	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-76.2	-11.9	173.2	-59	179.2	-179.3	177.9	0	113.3	K131 G132	K131-K134 WeakPolarHBondContact O-CB 3.42Å; K131-K134 PolarHBondContact O-N 3.29Å; K131-K134 VanDerWaalsContact O-N 3.16Å; G132-K134 PolarHBondContact O-N 3.19Å
135	D	98.3	Very high	97.9	Very high	46 Å²	46	49.5 Å²	49.5	25%	0.246	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-111.3	37.9	-178.5	-176.2	24.8	0	0	0	111.4	V103 G132 M133 R139 Y376	V103-D135 HydrophobicContact CG1-CB 4.33Å; G132-D135 PolarHBondContact O-N 3.24Å; M133-D135 PolarHBondContact O-N 2.98Å; D135-R139 WeakPolarHBondContact O-CD 3.14Å; D135-R139 PolarHBondContact O-NE 3.04Å; D135-R139 IonicContact OD1-CZ 2.85Å; D135-R139 IonicContact OD1-NE 2.84Å; D135-R139 PolarHBondContact OD1-NE 3.32Å; D135-R139 IonicContact OD1-NH2 3.79Å; D135-R139 PolarHBondContact OD1-NH2 2.83Å; D135-R139 IonicContact OD2-NE 3.92Å; D135-R139 IonicContact OD2-NH2 2.88Å; D135-Y376 VanDerWaalsContact CG-OH 3.23Å; D135-Y376 PolarHBondContact OD1-OH 3.41Å; D135-Y376 WeakPolarHBondContact OD2-CE2 3.48Å; D135-Y376 VanDerWaalsContact OD2-CZ 3.27Å; D135-Y376 PolarHBondContact OD2-OH 3.06Å
136	M	98.3	Very high	97.8	Very high	19 Å²	19	50.9 Å²	50.9	9%	0.094	30%	0.3	C	S	.	.			trans	-103.3	5.1	-175.1	-66.2	-58.9	176.9	0	0	114.9	D100 V103 L104 M133 G138 R139 P141	D100-M136 HydrophobicContact CB-CE 3.73Å; D100-M136 HydrophobicContact CB-SD 3.37Å; D100-M136 WeakPolarHBondContact CB-SD 3.38Å; V103-M136 HydrophobicContact CB-CE 4.08Å; V103-M136 HydrophobicContact CG1-CE 3.66Å; V103-M136 HydrophobicContact CG1-SD 4.41Å; L104-M136 HydrophobicContact CD1-CE 4.14Å; L104-M136 HydrophobicContact CD2-CE 3.72Å; L104-M136 HydrophobicContact CG-CE 3.67Å; M133-M136 HydrophobicContact CE-CG 3.78Å; M133-M136 WeakPolarHBondContact O-CG 3.43Å; M133-M136 HydrophobicContact SD-CE 3.66Å; M133-M136 HydrophobicContact SD-CG 3.87Å; M133-M136 HydrophobicContact SD-SD 4.42Å; M136-G138 PolarHBondContact O-N 3.13Å; M136-G138 VanDerWaalsContact O-N 3.14Å; M136-R139 PolarHBondContact O-N 3.48Å; M136-R139 HydrophobicContact SD-CB 4.41Å; M136-P141 HydrophobicContact CB-CG 3.8Å; M136-P141 HydrophobicContact CG-CB 4.26Å; M136-P141 HydrophobicContact CG-CG 4.01Å; M136-P141 HydrophobicContact SD-CB 4.04Å; M136-P141 HydrophobicContact SD-CG 4.26Å
137	S	97.6	Very high	97.7	Very high	119 Å²	119	56.9 Å²	56.9	83%	0.832	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	117.3	-180	-168.7	0	0	0	0	110.2	R139	S137-R139 VanDerWaalsContact C-N 3.33Å
138	G	97.5	Very high	97.7	Very high	57 Å²	57	52.3 Å²	52.3	59%	0.588	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.6	27.7	-178.7	0	0	0	0	0	114.2	Y62 M136	Y62-G138 PolarHBondContact OH-O 3.42Å; M136-G138 PolarHBondContact O-N 3.13Å; M136-G138 VanDerWaalsContact O-N 3.14Å
139	R	98.4	Very high	97.6	Very high	15 Å²	15	52.2 Å²	52.2	6%	0.057	31%	0.306	C	S	.	.	S	Bend	trans	-123.2	6.5	-179.2	-55.7	-163.2	-162.7	-87.2	1.7	114.9	Y62 V98 D100 D135 M136 S137 E375 Y376	Y62-R139 WeakPolarHBondContact OH-CA 3.42Å; V98-R139 PolarHBondContact O-NH1 2.99Å; D100-R139 PolarHBondContact N-O 2.93Å; D100-R139 VanDerWaalsContact N-O 3.1Å; D100-R139 VanDerWaalsContact OD1-O 3.11Å; D135-R139 WeakPolarHBondContact O-CD 3.14Å; D135-R139 PolarHBondContact O-NE 3.04Å; D135-R139 IonicContact OD1-CZ 2.85Å; D135-R139 IonicContact OD1-NE 2.84Å; D135-R139 PolarHBondContact OD1-NE 3.32Å; D135-R139 IonicContact OD1-NH2 3.79Å; D135-R139 PolarHBondContact OD1-NH2 2.83Å; D135-R139 IonicContact OD2-NE 3.92Å; D135-R139 IonicContact OD2-NH2 2.88Å; M136-R139 PolarHBondContact O-N 3.48Å; M136-R139 HydrophobicContact SD-CB 4.41Å; S137-R139 VanDerWaalsContact C-N 3.33Å; R139-E375 IonicContact CZ-OE1 2.69Å; R139-E375 IonicContact CZ-OE2 2.71Å; R139-E375 IonicContact NH1-OE1 3.98Å; R139-E375 PolarHBondContact NH1-OE1 2.99Å; R139-E375 IonicContact NH1-OE2 2.7Å; R139-E375 PolarHBondContact NH1-OE2 3.48Å; R139-E375 IonicContact NH2-OE1 2.69Å; R139-E375 PolarHBondContact NH2-OE1 3.48Å; R139-E375 IonicContact NH2-OE2 2.83Å; R139-Y376 PolarHBondContact NH2-OH 3.39Å; R139-Y376 VanDerWaalsContact NH2-OH 3.14Å
140	A	97.4	Very high	97.5	Very high	37 Å²	37	58.9 Å²	58.9	31%	0.306	34%	0.341	S	S	.	.			trans	52	43.1	171.9	0	0	0	0	0	118.3	Y62 F69 G142	Y62-A140 HydrophobicContact CE2-CB 4.01Å; F69-A140 HydrophobicContact CE2-CB 4.04Å; F69-A140 HydrophobicContact CZ-CB 3.89Å; A140-G142 PolarHBondContact O-N 2.94Å
141	P	97.1	Very high	97.4	Very high	35 Å²	35	62 Å²	62	23%	0.227	35%	0.348	C	S	.	.			trans	-60.3	135.4	-178	31.1	-40.4	0	0	0	113.8	D100 M133 M136	D100-P141 HydrophobicContact CB-CB 3.9Å; D100-P141 VanDerWaalsContact CG-CA 3.43Å; D100-P141 WeakPolarHBondContact OD2-CA 3.32Å; M133-P141 HydrophobicContact CE-CB 4.19Å; M133-P141 HydrophobicContact CE-CG 4.23Å; M136-P141 HydrophobicContact CB-CG 3.8Å; M136-P141 HydrophobicContact CG-CB 4.26Å; M136-P141 HydrophobicContact CG-CG 4.01Å; M136-P141 HydrophobicContact SD-CB 4.04Å; M136-P141 HydrophobicContact SD-CG 4.26Å
142	G	95.1	Very high	97.4	Very high	35 Å²	35	57.8 Å²	57.8	36%	0.361	33%	0.33	S	S	.	.			trans	-58.4	138.2	177.1	0	0	0	0	0	113.2	A140 T144 T145 A146	A140-G142 PolarHBondContact O-N 2.94Å; G142-T144 VanDerWaalsContact C-N 3.3Å; G142-T144 PolarHBondContact O-N 3.4Å; G142-T145 WeakPolarHBondContact O-CB 3.28Å; G142-T145 PolarHBondContact O-N 3.02Å; G142-A146 PolarHBondContact O-N 3.29Å
143	N	96.4	Very high	97.3	Very high	147 Å²	147	62.9 Å²	62.9	79%	0.786	35%	0.349	S	S	*	.	H	α-helix	trans	-55	-40.6	-177	-74	-43.2	0	0	0	113.7	F147	N143-F147 WeakPolarHBondContact O-CB 3.47Å; N143-F147 PolarHBondContact O-N 2.9Å
144	T	96.7	Very high	97.2	Very high	40 Å²	40	62.9 Å²	62.9	25%	0.245	35%	0.353	C	S	.	.	H	α-helix	trans	-63.5	-42	178	-63.4	0	0	0	0	111.5	G142 N148 T204	G142-T144 VanDerWaalsContact C-N 3.3Å; G142-T144 PolarHBondContact O-N 3.4Å; T144-N148 WeakPolarHBondContact O-CB 3.41Å; T144-N148 PolarHBondContact O-N 3.25Å; T144-N148 VanDerWaalsContact O-N 3.14Å; T144-N148 PolarHBondContact O-ND2 3.25Å; T144-T204 WeakPolarHBondContact CG2-O 3.42Å
145	T	97.4	Very high	97	Very high	3 Å²	3	57.5 Å²	57.5	2%	0.018	35%	0.347	C	S	.	.	H	α-helix	trans	-62.1	-56.6	175.4	-58.6	0	0	0	0	110.2	L104 G142 F147 N148 V149 H205	L104-T145 HydrophobicContact CD1-CG2 3.54Å; G142-T145 WeakPolarHBondContact O-CB 3.28Å; G142-T145 PolarHBondContact O-N 3.02Å; T145-F147 PolarHBondContact O-N 3.32Å; T145-N148 PolarHBondContact O-N 3.06Å; T145-V149 HydrophobicContact CG2-CG2 4.26Å; T145-V149 WeakPolarHBondContact O-CG2 3.37Å; T145-V149 PolarHBondContact O-N 2.84Å; T145-H205 PolarHBondContact OG1-CE1 2.95Å; T145-H205 VanDerWaalsContact OG1-CE1 3.23Å
146	A	97.2	Very high	96.9	Very high	29 Å²	29	60.9 Å²	60.9	24%	0.24	36%	0.362	C	S	.	.	H	α-helix	trans	-57.5	-47.7	-176.8	0	0	0	0	0	112.2	M133 G142 N148 V149 D150	M133-A146 HydrophobicContact CE-CB 3.64Å; G142-A146 PolarHBondContact O-N 3.29Å; A146-N148 PolarHBondContact O-N 3.33Å; A146-V149 PolarHBondContact O-N 2.98Å; A146-D150 PolarHBondContact O-N 3.13Å
147	F	97.2	Very high	96.5	Very high	127 Å²	127	69.7 Å²	69.7	56%	0.557	40%	0.4	S	S	*	.	H	α-helix	trans	-61.1	-43.1	179.5	177.1	-99.6	0	0	0	112.6	N143 T145 R151	N143-F147 WeakPolarHBondContact O-CB 3.47Å; N143-F147 PolarHBondContact O-N 2.9Å; T145-F147 PolarHBondContact O-N 3.32Å; F147-R151 WeakPolarHBondContact O-CG 3.46Å
148	N	97.9	Very high	96	Very high	5 Å²	5	65.8 Å²	65.8	3%	0.027	38%	0.378	C	S	.	.	H	α-helix	trans	-80	-29.9	-176.9	-77.4	-37.2	0	0	0	113	T144 T145 A146 D150 R151 L152 V162 T204	T144-N148 WeakPolarHBondContact O-CB 3.41Å; T144-N148 PolarHBondContact O-N 3.25Å; T144-N148 VanDerWaalsContact O-N 3.14Å; T144-N148 PolarHBondContact O-ND2 3.25Å; T145-N148 PolarHBondContact O-N 3.06Å; A146-N148 PolarHBondContact O-N 3.33Å; N148-D150 VanDerWaalsContact C-N 3.32Å; N148-D150 PolarHBondContact O-N 3.46Å; N148-R151 PolarHBondContact O-N 3.26Å; N148-R151 VanDerWaalsContact O-N 3.16Å; N148-L152 PolarHBondContact O-N 3.35Å; N148-V162 HydrophobicContact CB-CG1 4.12Å; N148-T204 HydrophobicContact CB-CG2 4.19Å; N148-T204 PolarHBondContact ND2-O 3.13Å
149	V	97.7	Very high	95.9	Very high	3 Å²	3	63.5 Å²	63.5	2%	0.018	35%	0.354	C	S	.	.	H	α-helix	trans	-62.6	-40.5	171.9	175.4	0	0	0	0	111.2	V130 M133 T145 A146 R151 L152 T204	V130-V149 HydrophobicContact CB-CG1 4.35Å; V130-V149 HydrophobicContact CG2-CG1 3.86Å; M133-V149 HydrophobicContact CB-CG1 4.19Å; M133-V149 HydrophobicContact CG-CB 3.75Å; M133-V149 HydrophobicContact CG-CG1 3.42Å; M133-V149 VanDerWaalsContact CG-CG1 3.42Å; M133-V149 HydrophobicContact CG-CG2 3.99Å; M133-V149 HydrophobicContact SD-CG2 4.49Å; T145-V149 HydrophobicContact CG2-CG2 4.26Å; T145-V149 WeakPolarHBondContact O-CG2 3.37Å; T145-V149 PolarHBondContact O-N 2.84Å; A146-V149 PolarHBondContact O-N 2.98Å; V149-R151 PolarHBondContact O-N 2.8Å; V149-R151 VanDerWaalsContact O-N 3.16Å; V149-L152 HydrophobicContact CG1-CD1 4.42Å; V149-L152 HydrophobicContact CG2-CD1 4.48Å; V149-L152 WeakPolarHBondContact O-CB 3.42Å; V149-L152 PolarHBondContact O-N 3.1Å; V149-T204 HydrophobicContact CG2-CG2 3.62Å
150	D	96.2	Very high	95.7	Very high	142 Å²	142	63.7 Å²	63.7	76%	0.759	36%	0.358	S	S	*	.	H	α-helix	trans	-60.4	-24.5	176	-174	67.3	0	0	0	113.1	A146 N148	A146-D150 PolarHBondContact O-N 3.13Å; N148-D150 VanDerWaalsContact C-N 3.32Å; N148-D150 PolarHBondContact O-N 3.46Å
151	R	96.4	Very high	95.5	Very high	113 Å²	113	67.5 Å²	67.5	43%	0.426	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-12.7	177.7	-62.8	178.5	80.7	-172.8	8.3	113.6	F147 N148 V149 V162	F147-R151 WeakPolarHBondContact O-CG 3.46Å; N148-R151 PolarHBondContact O-N 3.26Å; N148-R151 VanDerWaalsContact O-N 3.16Å; V149-R151 PolarHBondContact O-N 2.8Å; V149-R151 VanDerWaalsContact O-N 3.16Å; R151-V162 HydrophobicContact CB-CG1 4.4Å
152	L	97.8	Very high	95.5	Very high	11 Å²	11	65.9 Å²	65.9	6%	0.058	35%	0.354	C	S	.	.			trans	-69.2	140.8	178	-57.8	177.6	0	0	0	110.2	A126 Y129 V130 N148 V149 G159 V162 M203	A126-L152 HydrophobicContact CB-CD1 4.14Å; Y129-L152 HydrophobicContact CD2-CD1 4.38Å; V130-L152 HydrophobicContact CG2-CB 4.02Å; N148-L152 PolarHBondContact O-N 3.35Å; V149-L152 HydrophobicContact CG1-CD1 4.42Å; V149-L152 HydrophobicContact CG2-CD1 4.48Å; V149-L152 WeakPolarHBondContact O-CB 3.42Å; V149-L152 PolarHBondContact O-N 3.1Å; L152-G159 CarbonylContact C-O 3.58Å; L152-G159 WeakPolarHBondContact CA-O 3.3Å; L152-V162 HydrophobicContact CD2-CG1 4.19Å; L152-M203 HydrophobicContact CD2-CB 4.25Å
153	K	97.5	Very high	95.6	Very high	118 Å²	118	67.4 Å²	67.4	51%	0.513	36%	0.357	S	S	.	.			trans	-129.7	69.5	180	-60.8	-175.9	-174.7	179.3	0	109.7	G155 Q156 G159	K153-G155 PolarHBondContact O-N 3.08Å; K153-Q156 HydrophobicContact CB-CB 4.17Å; K153-Q156 HydrophobicContact CB-CG 4.1Å; K153-Q156 VanDerWaalsContact CD-OE1 3.29Å; K153-Q156 WeakPolarHBondContact O-CB 3.45Å; K153-Q156 PolarHBondContact O-N 3.13Å; K153-Q156 VanDerWaalsContact O-N 3.07Å; K153-G159 PolarHBondContact N-O 3.44Å; K153-G159 WeakPolarHBondContact O-CA 3.45Å
154	P	95.7	Very high	95.7	Very high	43 Å²	43	62.7 Å²	62.7	28%	0.279	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	141.3	177.9	24.9	-34.6	0	0	0	110.7	D123 A126 F127 Q156	D123-P154 WeakPolarHBondContact OD1-CA 3.31Å; A126-P154 HydrophobicContact CB-CB 4.38Å; F127-P154 HydrophobicContact CB-CB 3.91Å; F127-P154 HydrophobicContact CB-CG 4.27Å; F127-P154 HydrophobicContact CD2-CG 4.47Å; P154-Q156 VanDerWaalsContact C-N 3.34Å
155	G	93.9	Very high	95.7	Very high	64 Å²	64	63.1 Å²	63.1	66%	0.66	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.8	-5.4	-172.1	0	0	0	0	0	115	D123 K153	D123-G155 PolarHBondContact OD1-N 3.23Å; D123-G155 PolarHBondContact OD2-N 3.31Å; K153-G155 PolarHBondContact O-N 3.08Å
156	Q	95.1	Very high	95.6	Very high	117 Å²	117	66.8 Å²	66.8	55%	0.547	36%	0.355	S	S	.	.	S	Bend	trans	-105.5	141.1	175.7	-57.9	-174.5	15.4	0	0	111.1	K153 P154 G158 G159	K153-Q156 HydrophobicContact CB-CB 4.17Å; K153-Q156 HydrophobicContact CB-CG 4.1Å; K153-Q156 VanDerWaalsContact CD-OE1 3.29Å; K153-Q156 WeakPolarHBondContact O-CB 3.45Å; K153-Q156 PolarHBondContact O-N 3.13Å; K153-Q156 VanDerWaalsContact O-N 3.07Å; P154-Q156 VanDerWaalsContact C-N 3.34Å; Q156-G158 PolarHBondContact O-N 3.33Å; Q156-G158 VanDerWaalsContact O-N 3.15Å; Q156-G159 WeakPolarHBondContact O-CA 3.37Å; Q156-G159 PolarHBondContact O-N 3.1Å
157	K	90	Very high	95.4	Very high	204 Å²	204	75.1 Å²	75.1	89%	0.887	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	120.7	176.1	-173.9	175.9	-176.9	175.4	0	110.5	G159	K157-G159 PolarHBondContact O-N 3.34Å
158	G	88.2	Confident	95.4	Very high	36 Å²	36	69.1 Å²	69.1	37%	0.371	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.9	8.7	-175.5	0	0	0	0	0	114.8	Q156 C160 R161	Q156-G158 PolarHBondContact O-N 3.33Å; Q156-G158 VanDerWaalsContact O-N 3.15Å; G158-C160 PolarHBondContact O-N 3.43Å; G158-R161 WeakPolarHBondContact O-CB 3.31Å; G158-R161 PolarHBondContact O-N 2.9Å; G158-R161 VanDerWaalsContact O-N 3.07Å
159	G	93.9	Very high	95.4	Very high	9 Å²	9	69.5 Å²	69.5	9%	0.093	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-12.2	-178.4	0	0	0	0	0	114.6	L152 K153 Q156 K157	L152-G159 CarbonylContact C-O 3.58Å; L152-G159 WeakPolarHBondContact CA-O 3.3Å; K153-G159 PolarHBondContact N-O 3.44Å; K153-G159 WeakPolarHBondContact O-CA 3.45Å; Q156-G159 WeakPolarHBondContact O-CA 3.37Å; Q156-G159 PolarHBondContact O-N 3.1Å; K157-G159 PolarHBondContact O-N 3.34Å
160	C	94.2	Very high	95.4	Very high	20 Å²	20	70.3 Å²	70.3	14%	0.135	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-1.8	172	61.8	0	0	0	0	113.9	A126 G158 M203	A126-C160 HydrophobicContact CB-CB 4.02Å; G158-C160 PolarHBondContact O-N 3.43Å; C160-M203 HydrophobicContact CB-CE 4Å; C160-M203 HydrophobicContact CB-SD 4.44Å; C160-M203 WeakPolarHBondContact O-CG 3.24Å
161	R	94.9	Very high	95.5	Very high	116 Å²	116	64.1 Å²	64.1	44%	0.438	34%	0.335	S	S	.	.			trans	-99.8	137.2	-175.3	-62.2	-176.6	-179.8	-173.4	-1.3	111.7	G158 F254	G158-R161 WeakPolarHBondContact O-CB 3.31Å; G158-R161 PolarHBondContact O-N 2.9Å; G158-R161 VanDerWaalsContact O-N 3.07Å; R161-F254 HydrophobicContact CB-CE1 4.1Å; R161-F254 HydrophobicContact CB-CZ 4.31Å
162	V	96.6	Very high	95.7	Very high	2 Å²	2	59 Å²	59	1%	0.012	32%	0.317	C	S	.	.			trans	-117.3	153	167.9	-60.5	0	0	0	0	110.5	N148 R151 L152 R202 M203 H206 F254	N148-V162 HydrophobicContact CB-CG1 4.12Å; R151-V162 HydrophobicContact CB-CG1 4.4Å; L152-V162 HydrophobicContact CD2-CG1 4.19Å; V162-R202 VanDerWaalsContact CG2-O 3.27Å; V162-R202 WeakPolarHBondContact CG2-O 3.27Å; V162-M203 WeakPolarHBondContact CG1-O 3.27Å; V162-M203 WeakPolarHBondContact CG2-O 3.36Å; V162-H206 HydrophobicContact CG2-CB 4.05Å; V162-H206 PolarHBondContact O-ND1 2.97Å; V162-F254 WeakPolarHBondContact O-CE1 3.4Å
163	P	97.3	Very high	95.7	Very high	66 Å²	66	58.4 Å²	58.4	43%	0.429	31%	0.314	S	S	.	.			trans	-60.4	154.6	175.5	-21.5	33.2	0	0	0	112.3
164	Y	98.1	Very high	95.8	Very high	49 Å²	49	52.8 Å²	52.8	19%	0.192	29%	0.29	C	S	.	.			trans	-55.4	143.9	168.7	166.8	-81.4	0	0	0	110.5	S166 H206 H207 E258 D262	Y164-S166 WeakPolarHBondContact OH-CA 3.46Å; Y164-H206 WeakPolarHBondContact CA-O 3.14Å; Y164-H206 WeakPolarHBondContact CD2-O 3.37Å; Y164-H206 PolarHBondContact N-ND1 2.79Å; Y164-H207 AromaticContact CE2-CD2 3.93Å; Y164-H207 AromaticContact CZ-CD2 3.95Å; Y164-H207 PolarHBondContact OH-CD2 3.12Å; Y164-E258 HydrophobicContact CD1-CB 3.75Å; Y164-E258 HydrophobicContact CD1-CG 4.12Å; Y164-E258 HydrophobicContact CD2-CB 3.7Å; Y164-E258 HydrophobicContact CE1-CB 4.06Å; Y164-E258 HydrophobicContact CE2-CB 3.97Å; Y164-E258 HydrophobicContact CG-CB 3.6Å; Y164-E258 HydrophobicContact CG-CG 4.29Å; Y164-D262 PolarHBondContact OH-OD2 2.91Å
165	N	96.6	Very high	95.9	Very high	48 Å²	48	50.9 Å²	50.9	26%	0.257	28%	0.277	S	S	.	.			trans	-141	119	178	178.9	8.5	0	0	0	110.2	R167 G168 H206 H207	N165-R167 PolarHBondContact O-N 3.22Å; N165-R167 VanDerWaalsContact O-N 3.07Å; N165-R167 PolarHBondContact OD1-N 2.94Å; N165-G168 WeakPolarHBondContact O-CA 3.38Å; N165-G168 PolarHBondContact O-N 2.66Å; N165-H206 PolarHBondContact N-O 3.4Å; N165-H207 WeakPolarHBondContact O-CB 3.44Å
166	S	95.3	Very high	96.2	Very high	81 Å²	81	48 Å²	48	57%	0.566	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-16.4	177.6	57.5	0	0	0	0	114.2	Y164	Y164-S166 WeakPolarHBondContact OH-CA 3.46Å
167	R	93.9	Very high	96.3	Very high	204 Å²	204	42.4 Å²	42.4	77%	0.77	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.6	7.3	173.2	-64.3	-176.5	-77.2	-177.9	-4.1	113.2	N165 A169	N165-R167 PolarHBondContact O-N 3.22Å; N165-R167 VanDerWaalsContact O-N 3.07Å; N165-R167 PolarHBondContact OD1-N 2.94Å; R167-A169 PolarHBondContact O-N 3.38Å; R167-A169 VanDerWaalsContact O-N 3.14Å
168	G	96.5	Very high	96.8	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.178	C	C	.	.			trans	-80.6	24.8	-176.9	0	0	0	0	0	115	N165 H205 H207	N165-G168 WeakPolarHBondContact O-CA 3.38Å; N165-G168 PolarHBondContact O-N 2.66Å; G168-H205 WeakPolarHBondContact O-CB 3.37Å; G168-H205 PolarHBondContact O-CD2 3.18Å; G168-H207 WeakPolarHBondContact O-CB 3.4Å
169	A	97.8	Very high	97.3	Very high	13 Å²	13	31 Å²	31	11%	0.107	16%	0.16	C	C	.	.			trans	-85.7	-3.2	-170.5	0	0	0	0	0	115.2	R167 I209 L306 C313 G314	R167-A169 PolarHBondContact O-N 3.38Å; R167-A169 VanDerWaalsContact O-N 3.14Å; A169-I209 HydrophobicContact CB-CB 3.94Å; A169-I209 HydrophobicContact CB-CG2 3.9Å; A169-L306 HydrophobicContact CB-CD1 4.11Å; A169-C313 CarbonylContact O-C 3.48Å; A169-C313 WeakPolarHBondContact O-CA 3.42Å; A169-C313 WeakPolarHBondContact O-CB 3.38Å; A169-G314 PolarHBondContact O-N 3.21Å
170	G	98.2	Very high	97.5	Very high	21 Å²	21	30.6 Å²	30.6	22%	0.216	16%	0.156	C	C	.	.	B	Isolated β-bridge	trans	-58	157.9	-174.8	0	0	0	0	0	115.3	G172 H205 S312	G170-G172 PolarHBondContact O-N 2.97Å; G170-H205 PolarHBondContact O-CD2 2.92Å; G170-H205 VanDerWaalsContact O-CD2 3.29Å; G170-S312 WeakPolarHBondContact CA-O 3.41Å
171	C	98.6	Very high	97.7	Very high	12 Å²	12	29.6 Å²	29.6	8%	0.081	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-66.6	-14.5	-179.9	59.2	0	0	0	0	113.9	A173 A174 M175 G311 S312 A317 D345 S348	C171-A173 CarbonylContact O-C 3.35Å; C171-A173 PolarHBondContact O-N 3.46Å; C171-A174 WeakPolarHBondContact O-CA 3.33Å; C171-A174 VanDerWaalsContact O-CB 3.25Å; C171-A174 WeakPolarHBondContact O-CB 3.31Å; C171-A174 PolarHBondContact O-N 3.15Å; C171-M175 PolarHBondContact O-N 3.25Å; C171-M175 VanDerWaalsContact O-N 3.1Å; C171-G311 WeakPolarHBondContact CB-O 3.42Å; C171-S312 PolarHBondContact N-O 2.98Å; C171-A317 HydrophobicContact CB-CB 3.76Å; C171-D345 PolarHBondContact SG-OD2 3.12Å; C171-S348 PolarHBondContact SG-OG 3.16Å
172	G	98.7	Very high	97.9	Very high	4 Å²	4	24.1 Å²	24.1	4%	0.041	13%	0.129	C	C	.	.	G	3₁₀ helix	trans	-60.6	-19.8	-169.5	0	0	0	0	0	115.8	G170 M175 R176 H205	G170-G172 PolarHBondContact O-N 2.97Å; G172-M175 VanDerWaalsContact CA-SD 3.56Å; G172-R176 WeakPolarHBondContact O-CD 3.08Å; G172-R176 WeakPolarHBondContact O-CG 3.49Å; G172-R176 VanDerWaalsContact O-CZ 3.24Å; G172-R176 PolarHBondContact O-NE 2.57Å; G172-R176 PolarHBondContact O-NH1 2.76Å; G172-H205 VanDerWaalsContact C-CE1 3.49Å; G172-H205 WeakPolarHBondContact CA-CE1 3.5Å
173	A	98.8	Very high	98	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-77.8	-36.6	168.6	0	0	0	0	0	113.1	C171 H205 S214	C171-A173 CarbonylContact O-C 3.35Å; C171-A173 PolarHBondContact O-N 3.46Å; A173-H205 HydrophobicContact CB-CB 3.79Å; A173-H205 PolarHBondContact N-CE1 3.24Å; A173-H205 PolarHBondContact N-ND1 3.19Å; A173-H205 VanDerWaalsContact N-ND1 3.19Å; A173-S214 WeakPolarHBondContact O-CB 3.49Å
174	A	98.9	Very high	98.1	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-50.8	178.3	0	0	0	0	0	112	C171 R176 A177 G213 S217 I352	C171-A174 WeakPolarHBondContact O-CA 3.33Å; C171-A174 VanDerWaalsContact O-CB 3.25Å; C171-A174 WeakPolarHBondContact O-CB 3.31Å; C171-A174 PolarHBondContact O-N 3.15Å; A174-R176 PolarHBondContact O-N 3.14Å; A174-A177 PolarHBondContact O-N 2.91Å; A174-A177 VanDerWaalsContact O-N 3.13Å; A174-G213 VanDerWaalsContact CB-C 3.46Å; A174-G213 WeakPolarHBondContact CB-O 3.38Å; A174-S217 WeakPolarHBondContact CB-OG 3.08Å; A174-S217 VanDerWaalsContact O-CB 3.26Å; A174-S217 WeakPolarHBondContact O-CB 3.49Å; A174-S217 PolarHBondContact O-OG 3.49Å; A174-I352 HydrophobicContact CB-CD1 4.11Å
175	M	98.9	Very high	98.1	Very high	3 Å²	3	21.3 Å²	21.3	2%	0.015	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-16.2	-171.8	78.1	-164.9	-169.1	0	0	115.2	D100 D101 L104 C171 G172 M178 V351	D100-M175 WeakPolarHBondContact OD2-CE 3.37Å; D101-M175 HydrophobicContact CB-CG 4.39Å; D101-M175 HydrophobicContact CB-SD 4.28Å; D101-M175 VanDerWaalsContact OD2-CB 3.29Å; D101-M175 WeakPolarHBondContact OD2-CB 3.4Å; L104-M175 HydrophobicContact CD1-CE 3.87Å; C171-M175 PolarHBondContact O-N 3.25Å; C171-M175 VanDerWaalsContact O-N 3.1Å; G172-M175 VanDerWaalsContact CA-SD 3.56Å; M175-M178 WeakPolarHBondContact O-CE 3.13Å; M175-V351 HydrophobicContact CB-CG1 3.85Å
176	R	98.9	Very high	98	Very high	2 Å²	2	22.1 Å²	22.1	1%	0.008	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.4	9.4	-175.3	67.4	-175.7	-173.3	-126.4	3.9	114.7	L104 H105 T108 Y129 G172 A174 T200 T204	L104-R176 HydrophobicContact CB-CB 3.96Å; H105-R176 HydrophobicContact CB-CB 4.37Å; T108-R176 VanDerWaalsContact CB-O 3.28Å; T108-R176 WeakPolarHBondContact CB-O 3.34Å; T108-R176 PolarHBondContact OG1-O 3.4Å; Y129-R176 VanDerWaalsContact CZ-NE 3.3Å; Y129-R176 PolarHBondContact OH-NE 3.24Å; Y129-R176 VanDerWaalsContact OH-NE 3.07Å; G172-R176 WeakPolarHBondContact O-CD 3.08Å; G172-R176 WeakPolarHBondContact O-CG 3.49Å; G172-R176 VanDerWaalsContact O-CZ 3.24Å; G172-R176 PolarHBondContact O-NE 2.57Å; G172-R176 PolarHBondContact O-NH1 2.76Å; A174-R176 PolarHBondContact O-N 3.14Å; R176-T200 PolarHBondContact NH2-O 2.79Å; R176-T204 PolarHBondContact NH1-OG1 3.28Å; R176-T204 VanDerWaalsContact NH1-OG1 3.17Å; R176-T204 PolarHBondContact NH2-OG1 3.48Å
177	A	98.9	Very high	98.1	Very high	1 Å²	1	22.6 Å²	22.6	1%	0.008	12%	0.115	C	C	.	.			trans	-105.7	-12.3	-168.4	0	0	0	0	0	115	A174 C179 I180 S214 A218	A174-A177 PolarHBondContact O-N 2.91Å; A174-A177 VanDerWaalsContact O-N 3.13Å; A177-C179 VanDerWaalsContact C-N 3.29Å; A177-C179 PolarHBondContact O-N 2.98Å; A177-I180 HydrophobicContact CB-CD1 4.06Å; A177-I180 VanDerWaalsContact O-CB 3.24Å; A177-I180 WeakPolarHBondContact O-CB 3.5Å; A177-I180 WeakPolarHBondContact O-CG1 3.49Å; A177-I180 PolarHBondContact O-N 2.93Å; A177-S214 WeakPolarHBondContact CB-O 3.28Å; A177-S214 WeakPolarHBondContact CB-OG 3.18Å; A177-A218 WeakPolarHBondContact O-CB 3.23Å
178	M	98.9	Very high	98.2	Very high	0 Å²	0	19 Å²	19	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-56.6	-40.5	-174.8	-61.4	76.8	73.5	0	0	112.7	M175 I180 G181 L182 A221 V351 I352 C355	M175-M178 WeakPolarHBondContact O-CE 3.13Å; M178-I180 PolarHBondContact O-N 3.43Å; M178-I180 VanDerWaalsContact O-N 3.09Å; M178-G181 WeakPolarHBondContact O-CA 3.47Å; M178-G181 PolarHBondContact O-N 3.38Å; M178-L182 WeakPolarHBondContact O-CD1 3.32Å; M178-L182 PolarHBondContact O-N 2.84Å; M178-A221 HydrophobicContact CB-CB 4.03Å; M178-A221 VanDerWaalsContact O-CB 3.32Å; M178-A221 WeakPolarHBondContact O-CB 3.37Å; M178-V351 HydrophobicContact CE-CG1 4.15Å; M178-V351 HydrophobicContact CE-CG2 4Å; M178-V351 WeakPolarHBondContact CE-O 3.38Å; M178-I352 HydrophobicContact CE-CG1 4.32Å; M178-I352 HydrophobicContact CG-CG2 4.4Å; M178-I352 HydrophobicContact SD-CB 4.27Å; M178-I352 HydrophobicContact SD-CG1 3.76Å; M178-I352 HydrophobicContact SD-CG2 4.41Å; M178-C355 HydrophobicContact CB-CB 4.13Å; M178-C355 VanDerWaalsContact CB-SG 3.6Å; M178-C355 HydrophobicContact CE-CB 4.25Å; M178-C355 HydrophobicContact CG-CB 4.03Å
179	C	98.9	Very high	98.3	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-59.8	-18.6	177	63.4	0	0	0	0	115	M51 H105 T108 A109 L112 A177 G181 L182 R183 L387	M51-C179 HydrophobicContact CE-CB 4.41Å; M51-C179 HydrophobicContact SD-CB 4.07Å; H105-C179 VanDerWaalsContact CD2-SG 3.57Å; H105-C179 WeakPolarHBondContact NE2-CB 3.34Å; H105-C179 PolarHBondContact NE2-N 2.99Å; T108-C179 VanDerWaalsContact CB-SG 3.54Å; T108-C179 WeakPolarHBondContact CG2-SG 3.45Å; A109-C179 HydrophobicContact CB-CB 3.95Å; L112-C179 HydrophobicContact CD1-CB 4.22Å; A177-C179 VanDerWaalsContact C-N 3.29Å; A177-C179 PolarHBondContact O-N 2.98Å; C179-G181 VanDerWaalsContact C-N 3.33Å; C179-L182 WeakPolarHBondContact O-CB 3.45Å; C179-L182 PolarHBondContact O-N 2.73Å; C179-R183 PolarHBondContact O-N 3.33Å; C179-L387 HydrophobicContact CB-CD1 3.91Å
180	I	98.9	Very high	98.3	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-66.8	-39.6	170.9	-56.9	167.9	0	0	0	109.5	T108 L112 A177 M178 R183 Y184 L193 V196 A197 A218	T108-I180 HydrophobicContact CG2-CD1 4.26Å; T108-I180 HydrophobicContact CG2-CG1 3.97Å; L112-I180 HydrophobicContact CD1-CG1 4.06Å; A177-I180 HydrophobicContact CB-CD1 4.06Å; A177-I180 VanDerWaalsContact O-CB 3.24Å; A177-I180 WeakPolarHBondContact O-CB 3.5Å; A177-I180 WeakPolarHBondContact O-CG1 3.49Å; A177-I180 PolarHBondContact O-N 2.93Å; M178-I180 PolarHBondContact O-N 3.43Å; M178-I180 VanDerWaalsContact O-N 3.09Å; I180-R183 WeakPolarHBondContact O-CB 3.42Å; I180-R183 PolarHBondContact O-N 3.3Å; I180-R183 VanDerWaalsContact O-N 3.16Å; I180-Y184 HydrophobicContact CG2-CD2 3.88Å; I180-Y184 HydrophobicContact CG2-CE2 4.25Å; I180-Y184 WeakPolarHBondContact O-CD2 3.04Å; I180-Y184 PolarHBondContact O-N 3.42Å; I180-L193 HydrophobicContact CG2-CG 4.3Å; I180-V196 HydrophobicContact CD1-CG1 4.07Å; I180-V196 HydrophobicContact CG1-CG1 4.16Å; I180-V196 HydrophobicContact CG2-CB 4.01Å; I180-V196 HydrophobicContact CG2-CG1 3.94Å; I180-A197 HydrophobicContact CD1-CB 4.15Å; I180-A218 HydrophobicContact CB-CB 3.88Å; I180-A218 HydrophobicContact CG2-CB 4.2Å
181	G	98.9	Very high	98.3	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-64.5	-37.2	172.4	0	0	0	0	0	113.3	M178 C179 R183 Y184 P185 A218	M178-G181 WeakPolarHBondContact O-CA 3.47Å; M178-G181 PolarHBondContact O-N 3.38Å; C179-G181 VanDerWaalsContact C-N 3.33Å; G181-R183 VanDerWaalsContact C-N 3.28Å; G181-R183 PolarHBondContact O-N 2.52Å; G181-Y184 CarbonylContact O-C 3.42Å; G181-Y184 PolarHBondContact O-N 3.48Å; G181-P185 WeakPolarHBondContact O-CA 3.12Å; G181-A218 WeakPolarHBondContact CA-O 3.46Å
182	L	98.9	Very high	98.3	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-61.8	-37.9	171.5	-82	63.3	0	0	0	111.5	Y47 M51 M178 C179 A221 I225 L359 L387 S391	Y47-L182 HydrophobicContact CD1-CB 4.05Å; Y47-L182 HydrophobicContact CD1-CD2 3.89Å; Y47-L182 HydrophobicContact CD1-CG 3.93Å; Y47-L182 HydrophobicContact CE1-CB 3.65Å; Y47-L182 HydrophobicContact CE1-CD2 4.34Å; Y47-L182 HydrophobicContact CE1-CG 3.9Å; Y47-L182 VanDerWaalsContact CE1-O 3.25Å; Y47-L182 WeakPolarHBondContact CE1-O 3.2Å; Y47-L182 HydrophobicContact CG-CD2 4.38Å; Y47-L182 HydrophobicContact CG-CG 4.48Å; Y47-L182 PolarHBondContact OH-O 3.39Å; M51-L182 HydrophobicContact CG-CD2 3.9Å; M51-L182 HydrophobicContact SD-CD2 3.79Å; M178-L182 WeakPolarHBondContact O-CD1 3.32Å; M178-L182 PolarHBondContact O-N 2.84Å; C179-L182 WeakPolarHBondContact O-CB 3.45Å; C179-L182 PolarHBondContact O-N 2.73Å; L182-A221 HydrophobicContact CD1-CB 3.96Å; L182-I225 HydrophobicContact CB-CD1 4.45Å; L182-I225 HydrophobicContact CD1-CD1 4.24Å; L182-I225 HydrophobicContact CG-CD1 4.15Å; L182-L359 HydrophobicContact CD1-CD1 3.6Å; L182-L359 HydrophobicContact CD1-CD2 3.92Å; L182-L359 HydrophobicContact CD1-CG 4.32Å; L182-L359 HydrophobicContact CD2-CD2 4.35Å; L182-L359 HydrophobicContact CG-CD2 4Å; L182-L387 HydrophobicContact CB-CB 4.42Å; L182-L387 HydrophobicContact CB-CD1 4.17Å; L182-L387 HydrophobicContact CD2-CD1 4.04Å; L182-S391 PolarHBondContact O-OG 3.44Å
183	R	98.8	Very high	98.3	Very high	36 Å²	36	25.4 Å²	25.4	14%	0.136	14%	0.144	C	C	.	.	H	α-helix	trans	-73.1	-36.8	180	178.7	61.5	-173.5	91.9	-7.2	113	L112 C179 I180 G181 P185 L387 L390 S391	L112-R183 HydrophobicContact CD1-CB 4.3Å; L112-R183 HydrophobicContact CD2-CB 4.34Å; L112-R183 HydrophobicContact CD2-CG 4.14Å; C179-R183 PolarHBondContact O-N 3.33Å; I180-R183 WeakPolarHBondContact O-CB 3.42Å; I180-R183 PolarHBondContact O-N 3.3Å; I180-R183 VanDerWaalsContact O-N 3.16Å; G181-R183 VanDerWaalsContact C-N 3.28Å; G181-R183 PolarHBondContact O-N 2.52Å; R183-P185 WeakPolarHBondContact O-CD 3.35Å; R183-L387 HydrophobicContact CB-CD2 4.02Å; R183-L390 PolarHBondContact NH1-O 3.34Å; R183-S391 VanDerWaalsContact C-OG 3.23Å; R183-S391 VanDerWaalsContact CA-OG 3.29Å; R183-S391 WeakPolarHBondContact CA-OG 3.47Å; R183-S391 PolarHBondContact O-OG 3.14Å
184	Y	98.5	Very high	98.4	Very high	21 Å²	21	25.4 Å²	25.4	8%	0.082	14%	0.144	C	C	.	.	S	Bend	trans	-123	63.9	-175.5	-56.6	-73.8	0	0	0	111.5	L112 I180 G181 Q189 L193 V196 S222	L112-Y184 HydrophobicContact CD2-CE2 4.38Å; I180-Y184 HydrophobicContact CG2-CD2 3.88Å; I180-Y184 HydrophobicContact CG2-CE2 4.25Å; I180-Y184 WeakPolarHBondContact O-CD2 3.04Å; I180-Y184 PolarHBondContact O-N 3.42Å; G181-Y184 CarbonylContact O-C 3.42Å; G181-Y184 PolarHBondContact O-N 3.48Å; Y184-Q189 HydrophobicContact CD1-CB 4.45Å; Y184-L193 WeakPolarHBondContact O-CD1 3.33Å; Y184-V196 HydrophobicContact CE2-CB 4.39Å; Y184-V196 HydrophobicContact CE2-CG2 3.98Å; Y184-S222 PolarHBondContact O-OG 3.45Å
185	P	97.6	Very high	98.3	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.006	16%	0.159	C	C	.	.			trans	-79.2	-18.4	-170.5	32.8	-37.8	0	0	0	114.1	G181 R183 S222 I225 Q226	G181-P185 WeakPolarHBondContact O-CA 3.12Å; R183-P185 WeakPolarHBondContact O-CD 3.35Å; P185-S222 WeakPolarHBondContact CA-OG 3.27Å; P185-S222 PolarHBondContact O-OG 2.84Å; P185-S222 VanDerWaalsContact O-OG 3.08Å; P185-I225 HydrophobicContact CB-CB 4.17Å; P185-I225 HydrophobicContact CB-CD1 4.07Å; P185-I225 HydrophobicContact CB-CG2 3.6Å; P185-Q226 VanDerWaalsContact O-CG 3.27Å; P185-Q226 WeakPolarHBondContact O-CG 3.49Å; P185-Q226 PolarHBondContact O-NE2 2.95Å
186	N	96.1	Very high	98.3	Very high	65 Å²	65	29 Å²	29	35%	0.348	16%	0.16	S	C	.	.	S	Bend	trans	-86.2	146.2	-170.5	-60	-43.3	0	0	0	112.1	D188 Q189	N186-D188 VanDerWaalsContact C-N 3.28Å; N186-D188 WeakPolarHBondContact CB-OD1 3.38Å; N186-D188 PolarHBondContact O-N 3.43Å; N186-Q189 HydrophobicContact CB-CG 4.16Å; N186-Q189 WeakPolarHBondContact O-CB 3.23Å; N186-Q189 PolarHBondContact O-N 3.16Å
187	P	96.1	Very high	98.3	Very high	91 Å²	91	28.9 Å²	28.9	59%	0.591	16%	0.159	S	C	*	.	G	3₁₀ helix	trans	-55.4	-36.8	-178	-28.5	35.5	0	0	0	115	Q189 L190	P187-Q189 PolarHBondContact O-N 3.16Å; P187-L190 WeakPolarHBondContact O-CB 3.31Å; P187-L190 PolarHBondContact O-N 3.02Å
188	D	96.6	Very high	98.3	Very high	130 Å²	130	28.9 Å²	28.9	70%	0.695	16%	0.159	S	C	*	.	G	3₁₀ helix	trans	-68.4	-18.7	177.5	63.9	-50	0	0	0	113.1	N186	N186-D188 VanDerWaalsContact C-N 3.28Å; N186-D188 WeakPolarHBondContact CB-OD1 3.38Å; N186-D188 PolarHBondContact O-N 3.43Å
189	Q	97.9	Very high	98.3	Very high	42 Å²	42	29.5 Å²	29.5	20%	0.196	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-89.3	-0.6	178	-58.4	175.3	-37.4	0	0	113.1	Y184 N186 P187 P191 S192 L193	Y184-Q189 HydrophobicContact CD1-CB 4.45Å; N186-Q189 HydrophobicContact CB-CG 4.16Å; N186-Q189 WeakPolarHBondContact O-CB 3.23Å; N186-Q189 PolarHBondContact O-N 3.16Å; P187-Q189 PolarHBondContact O-N 3.16Å; Q189-P191 VanDerWaalsContact C-CD 3.49Å; Q189-P191 VanDerWaalsContact C-N 3.33Å; Q189-S192 WeakPolarHBondContact O-CA 3.37Å; Q189-S192 WeakPolarHBondContact O-CB 3.17Å; Q189-S192 PolarHBondContact O-N 3.22Å; Q189-L193 PolarHBondContact O-N 3.34Å
190	L	98.7	Very high	98.3	Very high	18 Å²	18	29.5 Å²	29.5	9%	0.094	16%	0.162	C	C	.	.	H	α-helix	trans	-51	-43.3	-179.1	178.7	65.5	0	0	0	113.3	P187 S192 L193 V194 L219 E240 I244	P187-L190 WeakPolarHBondContact O-CB 3.31Å; P187-L190 PolarHBondContact O-N 3.02Å; L190-S192 VanDerWaalsContact C-N 3.32Å; L190-S192 PolarHBondContact O-N 3.48Å; L190-L193 PolarHBondContact O-N 3.09Å; L190-V194 HydrophobicContact CD1-CG2 3.89Å; L190-V194 HydrophobicContact CG-CG2 4.32Å; L190-V194 VanDerWaalsContact O-CG2 3.31Å; L190-V194 WeakPolarHBondContact O-CG2 3.42Å; L190-V194 PolarHBondContact O-N 2.95Å; L190-L219 HydrophobicContact CD1-CD1 3.47Å; L190-L219 VanDerWaalsContact CD1-CD1 3.47Å; L190-E240 HydrophobicContact CD2-CB 3.91Å; L190-I244 HydrophobicContact CD2-CD1 3.67Å; L190-I244 HydrophobicContact CG-CD1 3.74Å
191	P	98.6	Very high	98.3	Very high	64 Å²	64	29.5 Å²	29.5	42%	0.416	16%	0.162	S	C	.	.	H	α-helix	trans	-59.7	-38.9	175.2	-25.3	36	0	0	0	114	Q189 F195	Q189-P191 VanDerWaalsContact C-CD 3.49Å; Q189-P191 VanDerWaalsContact C-N 3.33Å; P191-F195 VanDerWaalsContact O-CB 3.32Å; P191-F195 WeakPolarHBondContact O-CB 3.16Å; P191-F195 PolarHBondContact O-N 3.5Å
192	S	98.6	Very high	98.3	Very high	60 Å²	60	29.9 Å²	29.9	42%	0.42	16%	0.163	S	C	.	.	H	α-helix	trans	-70.2	-42.9	177.9	-64.7	0	0	0	0	111.5	Q189 L190 V194 F195 V196	Q189-S192 WeakPolarHBondContact O-CA 3.37Å; Q189-S192 WeakPolarHBondContact O-CB 3.17Å; Q189-S192 PolarHBondContact O-N 3.22Å; L190-S192 VanDerWaalsContact C-N 3.32Å; L190-S192 PolarHBondContact O-N 3.48Å; S192-V194 PolarHBondContact O-N 2.91Å; S192-F195 PolarHBondContact O-N 3.28Å; S192-V196 WeakPolarHBondContact O-CG2 3.36Å; S192-V196 PolarHBondContact O-N 3.34Å
193	L	98.8	Very high	98.3	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-55.8	-52.3	174.2	-178.6	158.4	0	0	0	110.6	I180 Y184 Q189 L190 V196 A197 A218	I180-L193 HydrophobicContact CG2-CG 4.3Å; Y184-L193 WeakPolarHBondContact O-CD1 3.33Å; Q189-L193 PolarHBondContact O-N 3.34Å; L190-L193 PolarHBondContact O-N 3.09Å; L193-V196 PolarHBondContact O-N 2.78Å; L193-A197 VanDerWaalsContact O-CB 3.28Å; L193-A197 WeakPolarHBondContact O-CB 3.33Å; L193-A197 PolarHBondContact O-N 3.22Å; L193-A218 HydrophobicContact CD2-CB 3.77Å; L193-A218 HydrophobicContact CG-CB 4.18Å
194	V	98.9	Very high	98.2	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-64.3	-43.2	-177.6	173.8	0	0	0	0	111	L190 S192 A197 V198 V215 A241 I244 A245	L190-V194 HydrophobicContact CD1-CG2 3.89Å; L190-V194 HydrophobicContact CG-CG2 4.32Å; L190-V194 VanDerWaalsContact O-CG2 3.31Å; L190-V194 WeakPolarHBondContact O-CG2 3.42Å; L190-V194 PolarHBondContact O-N 2.95Å; S192-V194 PolarHBondContact O-N 2.91Å; V194-A197 PolarHBondContact O-N 2.82Å; V194-V198 HydrophobicContact CG1-CG2 4.16Å; V194-V198 WeakPolarHBondContact O-CB 3.46Å; V194-V198 VanDerWaalsContact O-CG2 3.27Å; V194-V198 WeakPolarHBondContact O-CG2 3.34Å; V194-V198 PolarHBondContact O-N 3.42Å; V194-V215 HydrophobicContact CG1-CG2 4.46Å; V194-V215 HydrophobicContact CG2-CG1 4.26Å; V194-A241 HydrophobicContact CG2-CB 3.95Å; V194-I244 HydrophobicContact CB-CB 4.36Å; V194-I244 HydrophobicContact CB-CG2 3.77Å; V194-I244 HydrophobicContact CG1-CB 4.04Å; V194-I244 HydrophobicContact CG1-CG2 3.68Å; V194-I244 HydrophobicContact CG2-CB 4.38Å; V194-I244 HydrophobicContact CG2-CG2 4.23Å; V194-A245 HydrophobicContact CG1-CB 3.7Å
195	F	98.8	Very high	98.3	Very high	72 Å²	72	27.4 Å²	27.4	32%	0.316	15%	0.154	S	C	.	.	H	α-helix	trans	-56.8	-52.7	176.1	174.9	-95.8	0	0	0	111.8	L122 P191 S192 A197 V198 E199 V248	L122-F195 HydrophobicContact CD1-CE1 4.4Å; L122-F195 HydrophobicContact CD1-CZ 4.3Å; P191-F195 VanDerWaalsContact O-CB 3.32Å; P191-F195 WeakPolarHBondContact O-CB 3.16Å; P191-F195 PolarHBondContact O-N 3.5Å; S192-F195 PolarHBondContact O-N 3.28Å; F195-A197 PolarHBondContact O-N 2.81Å; F195-V198 PolarHBondContact O-N 2.77Å; F195-E199 HydrophobicContact CD2-CG 4.22Å; F195-E199 HydrophobicContact CE1-CG 4.19Å; F195-E199 HydrophobicContact CE2-CG 3.83Å; F195-E199 HydrophobicContact CZ-CG 3.82Å; F195-E199 WeakPolarHBondContact O-CB 3.26Å; F195-E199 WeakPolarHBondContact O-CG 3.21Å; F195-E199 PolarHBondContact O-N 3.41Å; F195-V248 HydrophobicContact CB-CG2 4.33Å; F195-V248 HydrophobicContact CD2-CG1 3.95Å; F195-V248 HydrophobicContact CD2-CG2 4.29Å
196	V	98.8	Very high	98.3	Very high	6 Å²	6	27.4 Å²	27.4	4%	0.036	15%	0.154	C	C	.	.	H	α-helix	trans	-64.6	-40.7	-179	177.5	0	0	0	0	111.1	L112 L121 I180 Y184 S192 L193 T200	L112-V196 HydrophobicContact CD2-CG1 4.41Å; L121-V196 HydrophobicContact CD2-CG1 4.12Å; L121-V196 HydrophobicContact CD2-CG2 3.97Å; I180-V196 HydrophobicContact CD1-CG1 4.07Å; I180-V196 HydrophobicContact CG1-CG1 4.16Å; I180-V196 HydrophobicContact CG2-CB 4.01Å; I180-V196 HydrophobicContact CG2-CG1 3.94Å; Y184-V196 HydrophobicContact CE2-CB 4.39Å; Y184-V196 HydrophobicContact CE2-CG2 3.98Å; S192-V196 WeakPolarHBondContact O-CG2 3.36Å; S192-V196 PolarHBondContact O-N 3.34Å; L193-V196 PolarHBondContact O-N 2.78Å; V196-T200 HydrophobicContact CG1-CG2 3.99Å; V196-T200 WeakPolarHBondContact O-CB 3.32Å; V196-T200 WeakPolarHBondContact O-CG2 3.37Å; V196-T200 PolarHBondContact O-N 3.29Å; V196-T200 PolarHBondContact O-OG1 3.41Å
197	A	98.9	Very high	98.4	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-65.5	-42.2	178.5	0	0	0	0	0	112.7	I180 L193 V194 F195 G201 S214 V215 A218	I180-A197 HydrophobicContact CD1-CB 4.15Å; L193-A197 VanDerWaalsContact O-CB 3.28Å; L193-A197 WeakPolarHBondContact O-CB 3.33Å; L193-A197 PolarHBondContact O-N 3.22Å; V194-A197 PolarHBondContact O-N 2.82Å; F195-A197 PolarHBondContact O-N 2.81Å; A197-G201 PolarHBondContact O-N 3.46Å; A197-S214 WeakPolarHBondContact CA-OG 3.37Å; A197-S214 WeakPolarHBondContact O-CB 3.48Å; A197-S214 PolarHBondContact O-OG 2.98Å; A197-V215 HydrophobicContact CB-CB 4.47Å; A197-V215 HydrophobicContact CB-CG2 3.97Å; A197-A218 HydrophobicContact CB-CB 4.02Å
198	V	98.9	Very high	98.5	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-63.4	-52.6	175.3	168.7	0	0	0	0	110.5	V194 F195 G201 R202 F211 V215 A245 V248 I249	V194-V198 HydrophobicContact CG1-CG2 4.16Å; V194-V198 WeakPolarHBondContact O-CB 3.46Å; V194-V198 VanDerWaalsContact O-CG2 3.27Å; V194-V198 WeakPolarHBondContact O-CG2 3.34Å; V194-V198 PolarHBondContact O-N 3.42Å; F195-V198 PolarHBondContact O-N 2.77Å; V198-G201 PolarHBondContact O-N 3.12Å; V198-R202 WeakPolarHBondContact O-CB 3.49Å; V198-R202 WeakPolarHBondContact O-CG 3.37Å; V198-R202 PolarHBondContact O-N 3.35Å; V198-F211 HydrophobicContact CG1-CD2 4.12Å; V198-F211 HydrophobicContact CG1-CE2 4.35Å; V198-F211 HydrophobicContact CG2-CD2 4.17Å; V198-V215 HydrophobicContact CG2-CG2 3.59Å; V198-A245 HydrophobicContact CG2-CB 3.77Å; V198-V248 HydrophobicContact CB-CG1 4.18Å; V198-V248 HydrophobicContact CG1-CG1 3.86Å; V198-I249 HydrophobicContact CG1-CD1 3.77Å; V198-I249 HydrophobicContact CG1-CG1 4.44Å
199	E	98.7	Very high	98.6	Very high	13 Å²	13	14.7 Å²	14.7	6%	0.061	8%	0.08	C	C	.	.	H	α-helix	trans	-64.8	-46.6	-174.3	-70.8	-66.6	172.4	0	0	111.8	L122 F195 R202 M203	L122-E199 HydrophobicContact CD1-CB 3.88Å; L122-E199 HydrophobicContact CD1-CG 3.95Å; L122-E199 HydrophobicContact CD2-CB 3.51Å; L122-E199 HydrophobicContact CD2-CG 4.35Å; L122-E199 HydrophobicContact CG-CB 4.36Å; F195-E199 HydrophobicContact CD2-CG 4.22Å; F195-E199 HydrophobicContact CE1-CG 4.19Å; F195-E199 HydrophobicContact CE2-CG 3.83Å; F195-E199 HydrophobicContact CZ-CG 3.82Å; F195-E199 WeakPolarHBondContact O-CB 3.26Å; F195-E199 WeakPolarHBondContact O-CG 3.21Å; F195-E199 PolarHBondContact O-N 3.41Å; E199-R202 WeakPolarHBondContact O-CG 3.41Å; E199-R202 PolarHBondContact O-N 3.17Å; E199-R202 IonicContact OE1-CZ 3.74Å; E199-R202 IonicContact OE1-NE 3.28Å; E199-R202 IonicContact OE1-NH2 3.25Å; E199-R202 PolarHBondContact OE1-NH2 3.31Å; E199-R202 IonicContact OE2-CZ 3.34Å; E199-R202 VanDerWaalsContact OE2-CZ 3.26Å; E199-R202 IonicContact OE2-NE 2.71Å; E199-R202 PolarHBondContact OE2-NE 3.32Å; E199-R202 IonicContact OE2-NH2 3.98Å; E199-R202 PolarHBondContact OE2-NH2 3.3Å; E199-M203 VanDerWaalsContact O-CG 3.31Å; E199-M203 WeakPolarHBondContact O-CG 3.43Å; E199-M203 PolarHBondContact O-N 2.77Å
200	T	98.6	Very high	98.7	Very high	1 Å²	1	12.7 Å²	12.7	1%	0.006	7%	0.071	C	C	.	.	H	α-helix	trans	-72.2	-30.5	179.3	64	0	0	0	0	112.8	L122 V125 R176 V196 M203	L122-T200 HydrophobicContact CD2-CG2 4.03Å; V125-T200 HydrophobicContact CB-CG2 4.12Å; V125-T200 HydrophobicContact CG1-CG2 3.72Å; V125-T200 HydrophobicContact CG2-CG2 3.91Å; R176-T200 PolarHBondContact NH2-O 2.79Å; V196-T200 HydrophobicContact CG1-CG2 3.99Å; V196-T200 WeakPolarHBondContact O-CB 3.32Å; V196-T200 WeakPolarHBondContact O-CG2 3.37Å; V196-T200 PolarHBondContact O-N 3.29Å; V196-T200 PolarHBondContact O-OG1 3.41Å; T200-M203 HydrophobicContact CG2-CE 4.05Å
201	G	98.8	Very high	98.7	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-65.7	-48	172.7	0	0	0	0	0	111.7	A197 V198 M203 T204 H205	A197-G201 PolarHBondContact O-N 3.46Å; V198-G201 PolarHBondContact O-N 3.12Å; G201-M203 PolarHBondContact O-N 3.49Å; G201-T204 PolarHBondContact O-N 2.91Å; G201-H205 PolarHBondContact O-N 3.44Å
202	R	98.4	Very high	98.7	Very high	7 Å²	7	8.8 Å²	8.8	3%	0.026	5%	0.047	C	C	.	.	H	α-helix	trans	-75	-4.4	-178.6	80.2	-176.8	-177.2	164.1	-3.8	114.6	V162 V198 E199 T204 H206 F211 S252	V162-R202 VanDerWaalsContact CG2-O 3.27Å; V162-R202 WeakPolarHBondContact CG2-O 3.27Å; V198-R202 WeakPolarHBondContact O-CB 3.49Å; V198-R202 WeakPolarHBondContact O-CG 3.37Å; V198-R202 PolarHBondContact O-N 3.35Å; E199-R202 WeakPolarHBondContact O-CG 3.41Å; E199-R202 PolarHBondContact O-N 3.17Å; E199-R202 IonicContact OE1-CZ 3.74Å; E199-R202 IonicContact OE1-NE 3.28Å; E199-R202 IonicContact OE1-NH2 3.25Å; E199-R202 PolarHBondContact OE1-NH2 3.31Å; E199-R202 IonicContact OE2-CZ 3.34Å; E199-R202 VanDerWaalsContact OE2-CZ 3.26Å; E199-R202 IonicContact OE2-NE 2.71Å; E199-R202 PolarHBondContact OE2-NE 3.32Å; E199-R202 IonicContact OE2-NH2 3.98Å; E199-R202 PolarHBondContact OE2-NH2 3.3Å; R202-T204 PolarHBondContact O-N 3.43Å; R202-H206 HydrophobicContact CB-CB 4.26Å; R202-F211 HydrophobicContact CB-CB 4.22Å; R202-F211 HydrophobicContact CB-CD1 3.99Å; R202-F211 HydrophobicContact CB-CG 4.36Å; R202-S252 PolarHBondContact NH1-OG 3.48Å
203	M	98.5	Very high	98.7	Very high	2 Å²	2	5.9 Å²	5.9	1%	0.01	3%	0.027	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-28.8	167.4	-65	-176	-175.7	0	0	112.1	L122 V125 A126 Y129 L152 C160 V162 E199 T200 G201	L122-M203 HydrophobicContact CB-CE 3.87Å; L122-M203 HydrophobicContact CD2-CE 3.93Å; L122-M203 HydrophobicContact CG-CE 4.46Å; L122-M203 WeakPolarHBondContact O-CE 3.47Å; V125-M203 HydrophobicContact CB-CE 4.12Å; V125-M203 HydrophobicContact CB-SD 4.34Å; V125-M203 HydrophobicContact CG1-CE 4.11Å; V125-M203 HydrophobicContact CG1-SD 3.82Å; A126-M203 HydrophobicContact CB-SD 4.22Å; Y129-M203 HydrophobicContact CD2-SD 4.03Å; Y129-M203 HydrophobicContact CE2-CB 4.39Å; Y129-M203 HydrophobicContact CE2-SD 3.84Å; L152-M203 HydrophobicContact CD2-CB 4.25Å; C160-M203 HydrophobicContact CB-CE 4Å; C160-M203 HydrophobicContact CB-SD 4.44Å; C160-M203 WeakPolarHBondContact O-CG 3.24Å; V162-M203 WeakPolarHBondContact CG1-O 3.27Å; V162-M203 WeakPolarHBondContact CG2-O 3.36Å; E199-M203 VanDerWaalsContact O-CG 3.31Å; E199-M203 WeakPolarHBondContact O-CG 3.43Å; E199-M203 PolarHBondContact O-N 2.77Å; T200-M203 HydrophobicContact CG2-CE 4.05Å; G201-M203 PolarHBondContact O-N 3.49Å
204	T	98.4	Very high	98.7	Very high	0 Å²	0	6 Å²	6	0%	0	3%	0.027	C	C	.	.	T	Hydrogen-bonded Turn	trans	-130.3	-22.1	176	76	0	0	0	0	114.4	T144 N148 V149 R176 G201 R202	T144-T204 WeakPolarHBondContact CG2-O 3.42Å; N148-T204 HydrophobicContact CB-CG2 4.19Å; N148-T204 PolarHBondContact ND2-O 3.13Å; V149-T204 HydrophobicContact CG2-CG2 3.62Å; R176-T204 PolarHBondContact NH1-OG1 3.28Å; R176-T204 VanDerWaalsContact NH1-OG1 3.17Å; R176-T204 PolarHBondContact NH2-OG1 3.48Å; G201-T204 PolarHBondContact O-N 2.91Å; R202-T204 PolarHBondContact O-N 3.43Å
205	H	98.6	Very high	98.7	Very high	4 Å²	4	6 Å²	6	2%	0.019	3%	0.027	C	C	.	.			trans	-121.5	67.9	-179	-66.4	89.7	0	0	0	109.8	T145 G168 G170 G172 A173 G201 H207	T145-H205 PolarHBondContact OG1-CE1 2.95Å; T145-H205 VanDerWaalsContact OG1-CE1 3.23Å; G168-H205 WeakPolarHBondContact O-CB 3.37Å; G168-H205 PolarHBondContact O-CD2 3.18Å; G170-H205 PolarHBondContact O-CD2 2.92Å; G170-H205 VanDerWaalsContact O-CD2 3.29Å; G172-H205 VanDerWaalsContact C-CE1 3.49Å; G172-H205 WeakPolarHBondContact CA-CE1 3.5Å; A173-H205 HydrophobicContact CB-CB 3.79Å; A173-H205 PolarHBondContact N-CE1 3.24Å; A173-H205 PolarHBondContact N-ND1 3.19Å; A173-H205 VanDerWaalsContact N-ND1 3.19Å; G201-H205 PolarHBondContact O-N 3.44Å; H205-H207 PolarHBondContact O-N 2.92Å
206	H	98.6	Very high	98.7	Very high	1 Å²	1	2.5 Å²	2.5	1%	0.005	1%	0.012	C	C	.	.			trans	-78.9	67.7	178.9	-163	175.4	0	0	0	111.3	V162 Y164 N165 R202 F254 N259	V162-H206 HydrophobicContact CG2-CB 4.05Å; V162-H206 PolarHBondContact O-ND1 2.97Å; Y164-H206 WeakPolarHBondContact CA-O 3.14Å; Y164-H206 WeakPolarHBondContact CD2-O 3.37Å; Y164-H206 PolarHBondContact N-ND1 2.79Å; N165-H206 PolarHBondContact N-O 3.4Å; R202-H206 HydrophobicContact CB-CB 4.26Å; H206-F254 AromaticContact CE1-CD1 3.55Å; H206-F254 AromaticContact CE1-CE1 3.32Å; H206-F254 WeakPolarHBondContact CE1-CE1 3.44Å; H206-F254 AromaticContact ND1-CE1 3.72Å; H206-N259 PolarHBondContact NE2-ND2 3.29Å
207	H	98.7	Very high	98.7	Very high	12 Å²	12	2.2 Å²	2.2	6%	0.056	1%	0.01	C	C	.	.	S	Bend	trans	-150.6	139.2	172.6	-175.4	-90.6	0	0	0	107.9	Y164 N165 G168 H205 I209 G210 F211 D262	Y164-H207 AromaticContact CE2-CD2 3.93Å; Y164-H207 AromaticContact CZ-CD2 3.95Å; Y164-H207 PolarHBondContact OH-CD2 3.12Å; N165-H207 WeakPolarHBondContact O-CB 3.44Å; G168-H207 WeakPolarHBondContact O-CB 3.4Å; H205-H207 PolarHBondContact O-N 2.92Å; H207-I209 VanDerWaalsContact C-N 3.29Å; H207-I209 WeakPolarHBondContact ND1-CB 3.2Å; H207-I209 PolarHBondContact ND1-N 3.07Å; H207-I209 VanDerWaalsContact ND1-N 3.17Å; H207-I209 PolarHBondContact O-N 2.86Å; H207-G210 WeakPolarHBondContact O-CA 3.42Å; H207-G210 PolarHBondContact O-N 3.44Å; H207-F211 VanDerWaalsContact C-CD1 3.5Å; H207-F211 VanDerWaalsContact C-CE1 3.4Å; H207-F211 WeakPolarHBondContact O-CD1 3.37Å; H207-F211 WeakPolarHBondContact O-CE1 3.49Å; H207-F211 PolarHBondContact O-N 3.02Å; H207-F211 VanDerWaalsContact O-N 3.13Å; H207-D262 IonicContact NE2-OD2 2.8Å
208	P	98.6	Very high	98.7	Very high	0 Å²	0	2.2 Å²	2.2	0%	0	1%	0.01	C	C	.	.	H	α-helix	trans	-51.6	-43.4	-177	-28.8	34.8	0	0	0	114.1	G210 F211 L212 N259 D262 W263	P208-G210 VanDerWaalsContact C-N 3.27Å; P208-G210 PolarHBondContact O-N 3.3Å; P208-F211 VanDerWaalsContact CA-CE1 3.48Å; P208-F211 VanDerWaalsContact CA-CZ 3.49Å; P208-F211 HydrophobicContact CB-CE1 4.42Å; P208-F211 HydrophobicContact CB-CZ 4.09Å; P208-F211 HydrophobicContact CG-CE1 4.3Å; P208-F211 HydrophobicContact CG-CZ 4.15Å; P208-L212 HydrophobicContact CB-CD1 4.22Å; P208-L212 WeakPolarHBondContact O-CB 3.15Å; P208-L212 WeakPolarHBondContact O-CD1 3.32Å; P208-L212 WeakPolarHBondContact O-CG 3.44Å; P208-L212 PolarHBondContact O-N 2.86Å; P208-N259 WeakPolarHBondContact CD-OD1 3.49Å; P208-N259 HydrophobicContact CG-CB 4.26Å; P208-N259 VanDerWaalsContact CG-O 3.27Å; P208-N259 WeakPolarHBondContact CG-O 3.39Å; P208-D262 HydrophobicContact CG-CB 4.33Å; P208-W263 HydrophobicContact CB-CE3 4.25Å; P208-W263 HydrophobicContact CG-CE3 4.34Å
209	I	98.6	Very high	98.7	Very high	6 Å²	6	2.2 Å²	2.2	3%	0.031	1%	0.01	C	C	.	.	H	α-helix	trans	-58	-40.9	176.8	-64.5	177	0	0	0	112.2	A169 H207 G213 F266 L306 C313 G314 H315	A169-I209 HydrophobicContact CB-CB 3.94Å; A169-I209 HydrophobicContact CB-CG2 3.9Å; H207-I209 VanDerWaalsContact C-N 3.29Å; H207-I209 WeakPolarHBondContact ND1-CB 3.2Å; H207-I209 PolarHBondContact ND1-N 3.07Å; H207-I209 VanDerWaalsContact ND1-N 3.17Å; H207-I209 PolarHBondContact O-N 2.86Å; I209-G213 PolarHBondContact O-N 3.17Å; I209-F266 HydrophobicContact CG1-CB 4.33Å; I209-L306 HydrophobicContact CD1-CD1 3.65Å; I209-L306 HydrophobicContact CD1-CD2 4.25Å; I209-L306 HydrophobicContact CG2-CD1 4.12Å; I209-C313 HydrophobicContact CG2-CB 4.38Å; I209-G314 CarbonylContact O-C 3.44Å; I209-G314 VanDerWaalsContact O-CA 3.22Å; I209-G314 WeakPolarHBondContact O-CA 3.49Å; I209-H315 HydrophobicContact CG2-CB 4.05Å
210	G	98.7	Very high	98.8	Very high	0 Å²	0	1.7 Å²	1.7	0%	0	1%	0.008	C	C	.	.	H	α-helix	trans	-71.4	-59.8	-177.4	0	0	0	0	0	112.3	H207 P208 L212 G213 S214	H207-G210 WeakPolarHBondContact O-CA 3.42Å; H207-G210 PolarHBondContact O-N 3.44Å; P208-G210 VanDerWaalsContact C-N 3.27Å; P208-G210 PolarHBondContact O-N 3.3Å; G210-L212 PolarHBondContact O-N 3.32Å; G210-G213 WeakPolarHBondContact O-CA 3.45Å; G210-G213 PolarHBondContact O-N 3.39Å; G210-G213 VanDerWaalsContact O-N 3.08Å; G210-S214 PolarHBondContact O-N 3.23Å
211	F	98.8	Very high	98.8	Very high	0 Å²	0	1.6 Å²	1.6	0%	0	1%	0.007	C	C	.	.	H	α-helix	trans	-73.2	-24.2	-176.2	66.9	-108.5	0	0	0	113.8	V198 R202 H207 P208 G213 S214 V215 I249 N259 W263	V198-F211 HydrophobicContact CG1-CD2 4.12Å; V198-F211 HydrophobicContact CG1-CE2 4.35Å; V198-F211 HydrophobicContact CG2-CD2 4.17Å; R202-F211 HydrophobicContact CB-CB 4.22Å; R202-F211 HydrophobicContact CB-CD1 3.99Å; R202-F211 HydrophobicContact CB-CG 4.36Å; H207-F211 VanDerWaalsContact C-CD1 3.5Å; H207-F211 VanDerWaalsContact C-CE1 3.4Å; H207-F211 WeakPolarHBondContact O-CD1 3.37Å; H207-F211 WeakPolarHBondContact O-CE1 3.49Å; H207-F211 PolarHBondContact O-N 3.02Å; H207-F211 VanDerWaalsContact O-N 3.13Å; P208-F211 VanDerWaalsContact CA-CE1 3.48Å; P208-F211 VanDerWaalsContact CA-CZ 3.49Å; P208-F211 HydrophobicContact CB-CE1 4.42Å; P208-F211 HydrophobicContact CB-CZ 4.09Å; P208-F211 HydrophobicContact CG-CE1 4.3Å; P208-F211 HydrophobicContact CG-CZ 4.15Å; F211-G213 PolarHBondContact O-N 3.29Å; F211-S214 VanDerWaalsContact O-CB 3.27Å; F211-S214 WeakPolarHBondContact O-CB 3.49Å; F211-S214 PolarHBondContact O-N 3.42Å; F211-V215 PolarHBondContact O-N 3.01Å; F211-V215 VanDerWaalsContact O-N 3.14Å; F211-I249 HydrophobicContact CE1-CD1 4.34Å; F211-I249 HydrophobicContact CE2-CD1 4.21Å; F211-I249 HydrophobicContact CE2-CG1 4.18Å; F211-I249 HydrophobicContact CZ-CD1 3.83Å; F211-I249 HydrophobicContact CZ-CG1 3.93Å; F211-N259 VanDerWaalsContact CE1-OD1 3.24Å; F211-N259 WeakPolarHBondContact CE1-OD1 3.5Å; F211-W263 HydrophobicContact CE2-CH2 4.29Å; F211-W263 AromaticContact CE2-CZ3 3.96Å; F211-W263 HydrophobicContact CE2-CZ3 3.96Å; F211-W263 AromaticContact CZ-CZ3 3.96Å; F211-W263 HydrophobicContact CZ-CZ3 3.96Å
212	L	98.9	Very high	98.8	Very high	0 Å²	0	1.8 Å²	1.8	0%	0	1%	0.008	C	C	.	.	H	α-helix	trans	-70.2	-21.4	170.2	-66.3	173.4	0	0	0	111.7	P208 G210 V215 A216 A245 W263 F266	P208-L212 HydrophobicContact CB-CD1 4.22Å; P208-L212 WeakPolarHBondContact O-CB 3.15Å; P208-L212 WeakPolarHBondContact O-CD1 3.32Å; P208-L212 WeakPolarHBondContact O-CG 3.44Å; P208-L212 PolarHBondContact O-N 2.86Å; G210-L212 PolarHBondContact O-N 3.32Å; L212-V215 HydrophobicContact CD2-CG2 4.31Å; L212-V215 WeakPolarHBondContact O-CB 3.45Å; L212-V215 PolarHBondContact O-N 3.47Å; L212-A216 PolarHBondContact O-N 3.35Å; L212-A245 HydrophobicContact CD2-CB 3.63Å; L212-W263 HydrophobicContact CD1-CH2 4.18Å; L212-W263 HydrophobicContact CD1-CZ2 4.07Å; L212-W263 HydrophobicContact CD2-CH2 3.85Å; L212-W263 HydrophobicContact CD2-CZ2 4.09Å; L212-W263 HydrophobicContact CG-CH2 4.41Å; L212-F266 HydrophobicContact CB-CD1 3.91Å; L212-F266 HydrophobicContact CB-CD2 3.69Å; L212-F266 HydrophobicContact CB-CE1 3.83Å; L212-F266 HydrophobicContact CB-CE2 3.57Å; L212-F266 HydrophobicContact CB-CG 3.84Å; L212-F266 HydrophobicContact CB-CZ 3.64Å; L212-F266 HydrophobicContact CD1-CB 3.83Å; L212-F266 HydrophobicContact CD1-CD1 3.77Å; L212-F266 HydrophobicContact CD1-CD2 4.39Å; L212-F266 HydrophobicContact CD1-CE1 4.41Å; L212-F266 HydrophobicContact CD1-CG 3.75Å; L212-F266 HydrophobicContact CG-CD1 4.46Å; L212-F266 HydrophobicContact CG-CG 4.46Å; L212-F266 WeakPolarHBondContact O-CZ 3.48Å
213	G	98.9	Very high	98.8	Very high	0 Å²	0	1.6 Å²	1.6	0%	0	1%	0.008	C	C	.	.	H	α-helix	trans	-66.1	-36.8	167	0	0	0	0	0	113.8	A174 I209 G210 F211 V215 A216 S217 G314	A174-G213 VanDerWaalsContact CB-C 3.46Å; A174-G213 WeakPolarHBondContact CB-O 3.38Å; I209-G213 PolarHBondContact O-N 3.17Å; G210-G213 WeakPolarHBondContact O-CA 3.45Å; G210-G213 PolarHBondContact O-N 3.39Å; G210-G213 VanDerWaalsContact O-N 3.08Å; F211-G213 PolarHBondContact O-N 3.29Å; G213-V215 VanDerWaalsContact C-N 3.35Å; G213-A216 PolarHBondContact O-N 3.46Å; G213-S217 PolarHBondContact O-N 3.31Å; G213-S217 PolarHBondContact O-OG 3.46Å; G213-G314 WeakPolarHBondContact CA-O 3.34Å
214	S	98.9	Very high	98.8	Very high	1 Å²	1	1.5 Å²	1.5	1%	0.007	1%	0.007	C	C	.	.	H	α-helix	trans	-60.5	-45.8	168.9	174.2	0	0	0	0	110.8	A173 A177 A197 G210 F211 A216 S217 A218	A173-S214 WeakPolarHBondContact O-CB 3.49Å; A177-S214 WeakPolarHBondContact CB-O 3.28Å; A177-S214 WeakPolarHBondContact CB-OG 3.18Å; A197-S214 WeakPolarHBondContact CA-OG 3.37Å; A197-S214 WeakPolarHBondContact O-CB 3.48Å; A197-S214 PolarHBondContact O-OG 2.98Å; G210-S214 PolarHBondContact O-N 3.23Å; F211-S214 VanDerWaalsContact O-CB 3.27Å; F211-S214 WeakPolarHBondContact O-CB 3.49Å; F211-S214 PolarHBondContact O-N 3.42Å; S214-A216 PolarHBondContact O-N 3.49Å; S214-S217 PolarHBondContact O-N 3.14Å; S214-A218 WeakPolarHBondContact O-CB 3.48Å; S214-A218 PolarHBondContact O-N 3.18Å
215	V	98.9	Very high	98.8	Very high	0 Å²	0	2.1 Å²	2.1	0%	0	1%	0.011	C	C	.	.	H	α-helix	trans	-58.7	-47.7	175.4	177.1	0	0	0	0	111.1	V194 A197 V198 F211 L212 G213 S217 A218 L219 L237 A241	V194-V215 HydrophobicContact CG1-CG2 4.46Å; V194-V215 HydrophobicContact CG2-CG1 4.26Å; A197-V215 HydrophobicContact CB-CB 4.47Å; A197-V215 HydrophobicContact CB-CG2 3.97Å; V198-V215 HydrophobicContact CG2-CG2 3.59Å; F211-V215 PolarHBondContact O-N 3.01Å; F211-V215 VanDerWaalsContact O-N 3.14Å; L212-V215 HydrophobicContact CD2-CG2 4.31Å; L212-V215 WeakPolarHBondContact O-CB 3.45Å; L212-V215 PolarHBondContact O-N 3.47Å; G213-V215 VanDerWaalsContact C-N 3.35Å; V215-S217 PolarHBondContact O-N 2.76Å; V215-A218 PolarHBondContact O-N 3.42Å; V215-L219 WeakPolarHBondContact O-CB 3.47Å; V215-L219 PolarHBondContact O-N 2.86Å; V215-L237 HydrophobicContact CG1-CD1 4.22Å; V215-A241 HydrophobicContact CG1-CB 3.75Å
216	A	99	Very high	98.7	Very high	0 Å²	0	4.9 Å²	4.9	0%	0	2%	0.023	C	C	.	.	H	α-helix	trans	-58.8	-47.8	178.5	0	0	0	0	0	112.2	L212 G213 S214 L219 F220 L237 F266 W270 P318	L212-A216 PolarHBondContact O-N 3.35Å; G213-A216 PolarHBondContact O-N 3.46Å; S214-A216 PolarHBondContact O-N 3.49Å; A216-L219 PolarHBondContact O-N 2.89Å; A216-F220 WeakPolarHBondContact O-CB 3.36Å; A216-F220 WeakPolarHBondContact O-CD1 3.41Å; A216-F220 WeakPolarHBondContact O-CG 3.46Å; A216-F220 PolarHBondContact O-N 3.31Å; A216-L237 HydrophobicContact CB-CD1 3.96Å; A216-L237 HydrophobicContact CB-CD2 3.65Å; A216-L237 HydrophobicContact CB-CG 4.46Å; A216-F266 HydrophobicContact CB-CZ 4.46Å; A216-W270 HydrophobicContact CB-CZ2 4.49Å; A216-P318 HydrophobicContact CB-CB 3.84Å; A216-P318 HydrophobicContact CB-CG 3.79Å
217	S	99	Very high	98.6	Very high	0 Å²	0	5.5 Å²	5.5	0%	0	3%	0.026	C	C	.	.	H	α-helix	trans	-66.9	-42	-177.5	-53.8	0	0	0	0	112.3	A174 G213 S214 V215 A221	A174-S217 WeakPolarHBondContact CB-OG 3.08Å; A174-S217 VanDerWaalsContact O-CB 3.26Å; A174-S217 WeakPolarHBondContact O-CB 3.49Å; A174-S217 PolarHBondContact O-OG 3.49Å; G213-S217 PolarHBondContact O-N 3.31Å; G213-S217 PolarHBondContact O-OG 3.46Å; S214-S217 PolarHBondContact O-N 3.14Å; V215-S217 PolarHBondContact O-N 2.76Å; S217-A221 PolarHBondContact O-N 2.88Å
218	A	99	Very high	98.5	Very high	0 Å²	0	5.4 Å²	5.4	0%	0	3%	0.025	C	C	.	.	H	α-helix	trans	-63.5	-44.5	173.6	0	0	0	0	0	111.7	A177 I180 G181 L193 A197 S214 V215 A221 S222	A177-A218 WeakPolarHBondContact O-CB 3.23Å; I180-A218 HydrophobicContact CB-CB 3.88Å; I180-A218 HydrophobicContact CG2-CB 4.2Å; G181-A218 WeakPolarHBondContact CA-O 3.46Å; L193-A218 HydrophobicContact CD2-CB 3.77Å; L193-A218 HydrophobicContact CG-CB 4.18Å; A197-A218 HydrophobicContact CB-CB 4.02Å; S214-A218 WeakPolarHBondContact O-CB 3.48Å; S214-A218 PolarHBondContact O-N 3.18Å; V215-A218 PolarHBondContact O-N 3.42Å; A218-A221 PolarHBondContact O-N 3.29Å; A218-S222 PolarHBondContact O-N 3.01Å; A218-S222 VanDerWaalsContact O-N 3.09Å
219	L	98.9	Very high	98.4	Very high	0 Å²	0	7 Å²	7	0%	0	4%	0.035	C	C	.	.	H	α-helix	trans	-64.5	-44.7	-178.9	-173.9	68.8	0	0	0	111.8	L190 V215 A216 A221 S222 Y223 L237 A241	L190-L219 HydrophobicContact CD1-CD1 3.47Å; L190-L219 VanDerWaalsContact CD1-CD1 3.47Å; V215-L219 WeakPolarHBondContact O-CB 3.47Å; V215-L219 PolarHBondContact O-N 2.86Å; A216-L219 PolarHBondContact O-N 2.89Å; L219-A221 VanDerWaalsContact C-N 3.34Å; L219-A221 PolarHBondContact O-N 2.87Å; L219-S222 CarbonylContact O-C 3.58Å; L219-S222 WeakPolarHBondContact O-CB 3.23Å; L219-S222 PolarHBondContact O-N 3.25Å; L219-S222 VanDerWaalsContact O-N 3.13Å; L219-Y223 HydrophobicContact CD1-CD1 4.39Å; L219-Y223 HydrophobicContact CD1-CE1 3.7Å; L219-Y223 HydrophobicContact CD1-CE2 4.07Å; L219-Y223 HydrophobicContact CD2-CE2 3.65Å; L219-Y223 HydrophobicContact CG-CD2 4.05Å; L219-Y223 HydrophobicContact CG-CE1 4.08Å; L219-Y223 HydrophobicContact CG-CE2 3.54Å; L219-Y223 PolarHBondContact O-N 3.39Å; L219-L237 HydrophobicContact CD2-CB 3.95Å; L219-L237 HydrophobicContact CD2-CD1 4.19Å; L219-A241 HydrophobicContact CD1-CB 4.37Å; L219-A241 HydrophobicContact CD2-CB 3.69Å
220	F	98.9	Very high	98.4	Very high	1 Å²	1	7.3 Å²	7.3	0%	0.004	4%	0.037	C	C	.	.	H	α-helix	trans	-65.1	-38.5	-179.4	-70	-0.9	0	0	0	111.9	A216 S222 Y223 A224 W233 L237 W270 P318 L322	A216-F220 WeakPolarHBondContact O-CB 3.36Å; A216-F220 WeakPolarHBondContact O-CD1 3.41Å; A216-F220 WeakPolarHBondContact O-CG 3.46Å; A216-F220 PolarHBondContact O-N 3.31Å; F220-S222 VanDerWaalsContact C-N 3.34Å; F220-S222 PolarHBondContact O-N 3.07Å; F220-Y223 HydrophobicContact CD1-CD2 4.4Å; F220-Y223 PolarHBondContact O-N 2.87Å; F220-A224 WeakPolarHBondContact O-CB 3.37Å; F220-A224 PolarHBondContact O-N 3.06Å; F220-W233 HydrophobicContact CB-CE3 3.58Å; F220-W233 HydrophobicContact CB-CZ3 3.66Å; F220-W233 HydrophobicContact CD1-CB 3.94Å; F220-W233 HydrophobicContact CD1-CD2 4.33Å; F220-W233 AromaticContact CD1-CE3 3.86Å; F220-W233 HydrophobicContact CD1-CE3 3.86Å; F220-W233 HydrophobicContact CD1-CG 4.42Å; F220-W233 HydrophobicContact CD2-CE3 4.07Å; F220-W233 HydrophobicContact CE1-CB 3.76Å; F220-W233 HydrophobicContact CG-CD2 4.46Å; F220-W233 AromaticContact CG-CE3 3.57Å; F220-W233 HydrophobicContact CG-CE3 3.57Å; F220-W233 HydrophobicContact CG-CZ3 4.13Å; F220-W233 HydrophobicContact CZ-CB 4.38Å; F220-W233 WeakPolarHBondContact O-CH2 3.33Å; F220-L237 HydrophobicContact CE1-CB 4.23Å; F220-L237 HydrophobicContact CE1-CD2 4.41Å; F220-L237 HydrophobicContact CZ-CD2 4.17Å; F220-W270 AromaticContact CE2-CH2 3.64Å; F220-W270 HydrophobicContact CE2-CH2 3.64Å; F220-W270 HydrophobicContact CE2-CZ2 4.34Å; F220-W270 HydrophobicContact CE2-CZ3 4.44Å; F220-W270 AromaticContact CZ-CH2 3.47Å; F220-W270 HydrophobicContact CZ-CH2 3.47Å; F220-W270 VanDerWaalsContact CZ-CH2 3.47Å; F220-W270 HydrophobicContact CZ-CZ2 4.19Å; F220-W270 AromaticContact CZ-CZ3 3.93Å; F220-W270 HydrophobicContact CZ-CZ3 3.93Å; F220-P318 HydrophobicContact CD2-CB 4.47Å; F220-P318 HydrophobicContact CE2-CB 4.2Å; F220-L322 HydrophobicContact CE2-CB 3.98Å; F220-L322 HydrophobicContact CE2-CD2 4.17Å; F220-L322 HydrophobicContact CZ-CD2 4.04Å
221	A	98.9	Very high	98.3	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-62.7	-40.4	171.9	0	0	0	0	0	112.1	M178 L182 S217 A218 L219 A224 I225 L359	M178-A221 HydrophobicContact CB-CB 4.03Å; M178-A221 VanDerWaalsContact O-CB 3.32Å; M178-A221 WeakPolarHBondContact O-CB 3.37Å; L182-A221 HydrophobicContact CD1-CB 3.96Å; S217-A221 PolarHBondContact O-N 2.88Å; A218-A221 PolarHBondContact O-N 3.29Å; L219-A221 VanDerWaalsContact C-N 3.34Å; L219-A221 PolarHBondContact O-N 2.87Å; A221-A224 WeakPolarHBondContact O-CB 3.48Å; A221-A224 PolarHBondContact O-N 3.47Å; A221-I225 WeakPolarHBondContact O-CD1 3.39Å; A221-I225 WeakPolarHBondContact O-CG1 3.41Å; A221-I225 PolarHBondContact O-N 3.21Å; A221-L359 HydrophobicContact CB-CD1 3.78Å
222	S	98.8	Very high	98.3	Very high	3 Å²	3	10 Å²	10	2%	0.021	5%	0.05	C	C	.	.	H	α-helix	trans	-63.7	-44.7	173.8	-176.7	0	0	0	0	111.7	Y184 P185 A218 L219 F220 A224 I225 Q226	Y184-S222 PolarHBondContact O-OG 3.45Å; P185-S222 WeakPolarHBondContact CA-OG 3.27Å; P185-S222 PolarHBondContact O-OG 2.84Å; P185-S222 VanDerWaalsContact O-OG 3.08Å; A218-S222 PolarHBondContact O-N 3.01Å; A218-S222 VanDerWaalsContact O-N 3.09Å; L219-S222 CarbonylContact O-C 3.58Å; L219-S222 WeakPolarHBondContact O-CB 3.23Å; L219-S222 PolarHBondContact O-N 3.25Å; L219-S222 VanDerWaalsContact O-N 3.13Å; F220-S222 VanDerWaalsContact C-N 3.34Å; F220-S222 PolarHBondContact O-N 3.07Å; S222-A224 VanDerWaalsContact C-N 3.34Å; S222-A224 PolarHBondContact O-N 2.69Å; S222-I225 WeakPolarHBondContact O-CB 3.33Å; S222-I225 PolarHBondContact O-N 3.32Å; S222-I225 VanDerWaalsContact O-N 3.13Å; S222-Q226 VanDerWaalsContact O-CG 3.31Å; S222-Q226 WeakPolarHBondContact O-CG 3.25Å; S222-Q226 PolarHBondContact O-N 2.9Å; S222-Q226 PolarHBondContact OG-NE2 3.36Å
223	Y	98.7	Very high	98.3	Very high	3 Å²	3	10 Å²	10	1%	0.012	5%	0.05	C	C	.	.	H	α-helix	trans	-63.9	-35.5	175.8	-71.1	-13.8	0	0	0	113.6	L219 F220 I225 Q226 R227 R228 W233 E240	L219-Y223 HydrophobicContact CD1-CD1 4.39Å; L219-Y223 HydrophobicContact CD1-CE1 3.7Å; L219-Y223 HydrophobicContact CD1-CE2 4.07Å; L219-Y223 HydrophobicContact CD2-CE2 3.65Å; L219-Y223 HydrophobicContact CG-CD2 4.05Å; L219-Y223 HydrophobicContact CG-CE1 4.08Å; L219-Y223 HydrophobicContact CG-CE2 3.54Å; L219-Y223 PolarHBondContact O-N 3.39Å; F220-Y223 HydrophobicContact CD1-CD2 4.4Å; F220-Y223 PolarHBondContact O-N 2.87Å; Y223-I225 VanDerWaalsContact C-N 3.31Å; Y223-I225 PolarHBondContact O-N 2.93Å; Y223-Q226 CarbonylContact O-C 3.56Å; Y223-Q226 PolarHBondContact O-N 3.31Å; Y223-R227 PolarHBondContact O-N 3.43Å; Y223-R228 HydrophobicContact CG-CB 4.36Å; Y223-R228 PolarHBondContact O-N 2.91Å; Y223-R228 PolarHBondContact OH-NH1 3.29Å; Y223-W233 HydrophobicContact CD2-CB 4Å; Y223-W233 AromaticContact CD2-CD1 3.69Å; Y223-W233 HydrophobicContact CD2-CD2 4.22Å; Y223-W233 AromaticContact CD2-CG 3.69Å; Y223-W233 HydrophobicContact CD2-CG 3.69Å; Y223-W233 HydrophobicContact CG-CG 4.44Å; Y223-E240 PolarHBondContact OH-OE2 2.97Å; Y223-E240 VanDerWaalsContact OH-OE2 3.06Å
224	A	98.5	Very high	98.3	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-59.7	-42.8	172	0	0	0	0	0	111.7	F220 A221 S222 R227 W233 L359 L360	F220-A224 WeakPolarHBondContact O-CB 3.37Å; F220-A224 PolarHBondContact O-N 3.06Å; A221-A224 WeakPolarHBondContact O-CB 3.48Å; A221-A224 PolarHBondContact O-N 3.47Å; S222-A224 VanDerWaalsContact C-N 3.34Å; S222-A224 PolarHBondContact O-N 2.69Å; A224-R227 PolarHBondContact O-N 2.94Å; A224-R227 PolarHBondContact O-NH1 2.97Å; A224-W233 HydrophobicContact CB-CH2 3.75Å; A224-W233 HydrophobicContact CB-CZ2 4.06Å; A224-L359 HydrophobicContact CB-CB 3.81Å; A224-L359 HydrophobicContact CB-CD1 4.1Å; A224-L360 HydrophobicContact CB-CD2 4.09Å; A224-L360 HydrophobicContact CB-CG 3.97Å; A224-L360 WeakPolarHBondContact O-CD2 3.48Å
225	I	98.3	Very high	98.3	Very high	14 Å²	14	10.2 Å²	10.2	7%	0.072	5%	0.051	C	C	.	.	H	α-helix	trans	-66.8	-41.3	177	-69	161.2	0	0	0	110.9	V42 Y47 L182 P185 A221 S222 Y223 R227 L359	V42-I225 HydrophobicContact CB-CG2 4.19Å; V42-I225 HydrophobicContact CG1-CG2 3.89Å; V42-I225 HydrophobicContact CG2-CG1 4.31Å; V42-I225 HydrophobicContact CG2-CG2 4.12Å; Y47-I225 HydrophobicContact CE2-CD1 3.83Å; Y47-I225 HydrophobicContact CE2-CG1 4.03Å; Y47-I225 HydrophobicContact CE2-CG2 4.42Å; L182-I225 HydrophobicContact CB-CD1 4.45Å; L182-I225 HydrophobicContact CD1-CD1 4.24Å; L182-I225 HydrophobicContact CG-CD1 4.15Å; P185-I225 HydrophobicContact CB-CB 4.17Å; P185-I225 HydrophobicContact CB-CD1 4.07Å; P185-I225 HydrophobicContact CB-CG2 3.6Å; A221-I225 WeakPolarHBondContact O-CD1 3.39Å; A221-I225 WeakPolarHBondContact O-CG1 3.41Å; A221-I225 PolarHBondContact O-N 3.21Å; S222-I225 WeakPolarHBondContact O-CB 3.33Å; S222-I225 PolarHBondContact O-N 3.32Å; S222-I225 VanDerWaalsContact O-N 3.13Å; Y223-I225 VanDerWaalsContact C-N 3.31Å; Y223-I225 PolarHBondContact O-N 2.93Å; I225-R227 PolarHBondContact O-N 3.26Å; I225-L359 HydrophobicContact CD1-CD1 4.33Å; I225-L359 HydrophobicContact CD1-CD2 4.2Å; I225-L359 HydrophobicContact CG1-CB 4.48Å; I225-L359 HydrophobicContact CG1-CD1 4.23Å; I225-L359 HydrophobicContact CG1-CD2 4Å; I225-L359 HydrophobicContact CG1-CG 4.46Å
226	Q	97.1	Very high	98.3	Very high	61 Å²	61	10.2 Å²	10.2	29%	0.285	5%	0.051	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-5.3	175.8	-65.8	172.8	41.1	0	0	113.8	P185 S222 Y223 R228	P185-Q226 VanDerWaalsContact O-CG 3.27Å; P185-Q226 WeakPolarHBondContact O-CG 3.49Å; P185-Q226 PolarHBondContact O-NE2 2.95Å; S222-Q226 VanDerWaalsContact O-CG 3.31Å; S222-Q226 WeakPolarHBondContact O-CG 3.25Å; S222-Q226 PolarHBondContact O-N 2.9Å; S222-Q226 PolarHBondContact OG-NE2 3.36Å; Y223-Q226 CarbonylContact O-C 3.56Å; Y223-Q226 PolarHBondContact O-N 3.31Å; Q226-R228 PolarHBondContact O-N 2.85Å
227	R	96.6	Very high	98.3	Very high	15 Å²	15	10.2 Å²	10.2	6%	0.057	5%	0.051	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.7	31.9	-174.1	-50.7	-59.3	-174.4	-143	13.1	112.8	A35 M36 L39 E40 H46 Y223 A224 I225 L359	A35-R227 CarbonylContact C-O 3.54Å; A35-R227 WeakPolarHBondContact CA-O 3.21Å; A35-R227 HydrophobicContact CB-CB 4.11Å; M36-R227 PolarHBondContact N-O 2.94Å; L39-R227 HydrophobicContact CB-CG 4.48Å; E40-R227 PolarHBondContact O-NE 2.83Å; E40-R227 PolarHBondContact O-NH2 2.71Å; H46-R227 PolarHBondContact CD2-NH2 3.35Å; H46-R227 PolarHBondContact NE2-NH2 3.04Å; Y223-R227 PolarHBondContact O-N 3.43Å; A224-R227 PolarHBondContact O-N 2.94Å; A224-R227 PolarHBondContact O-NH1 2.97Å; I225-R227 PolarHBondContact O-N 3.26Å; R227-L359 PolarHBondContact NH1-O 3.46Å
228	R	96.1	Very high	98.3	Very high	10 Å²	10	11.4 Å²	11.4	4%	0.038	6%	0.057	C	C	.	.			trans	-70.5	138.8	179.9	-174.5	176.4	173.8	163.4	-2.6	110.1	F33 Y223 Q226 L230 S232 W233 E240	F33-R228 HydrophobicContact CD2-CG 4.48Å; F33-R228 HydrophobicContact CG-CG 4.3Å; Y223-R228 HydrophobicContact CG-CB 4.36Å; Y223-R228 PolarHBondContact O-N 2.91Å; Y223-R228 PolarHBondContact OH-NH1 3.29Å; Q226-R228 PolarHBondContact O-N 2.85Å; R228-L230 PolarHBondContact O-N 3.01Å; R228-S232 WeakPolarHBondContact CG-OG 3.35Å; R228-S232 PolarHBondContact NE-OG 3.31Å; R228-W233 PolarHBondContact O-NE1 3.11Å; R228-E240 IonicContact CZ-OE1 3.26Å; R228-E240 VanDerWaalsContact CZ-OE1 3.25Å; R228-E240 IonicContact NH1-OE1 3.12Å; R228-E240 PolarHBondContact NH1-OE1 3.15Å; R228-E240 IonicContact NH1-OE2 2.71Å; R228-E240 PolarHBondContact NH1-OE2 3.23Å; R228-E240 VanDerWaalsContact NH1-OE2 3.1Å; R228-E240 IonicContact NH2-OE1 3.07Å; R228-E240 PolarHBondContact NH2-OE1 2.97Å
229	P	96.8	Very high	98.2	Very high	33 Å²	33	16.1 Å²	16.1	21%	0.214	8%	0.079	C	C	.	.			trans	-54.8	131.4	177.8	-26.4	34.9	0	0	0	112.5	S34 M36 E231 S232 W233	S34-P229 WeakPolarHBondContact O-CD 3.38Å; S34-P229 WeakPolarHBondContact O-CG 3.1Å; M36-P229 HydrophobicContact CG-CG 4.47Å; P229-E231 VanDerWaalsContact C-N 3.25Å; P229-E231 PolarHBondContact O-N 2.96Å; P229-S232 PolarHBondContact O-N 2.84Å; P229-S232 VanDerWaalsContact O-N 3.07Å; P229-S232 PolarHBondContact O-OG 3.07Å; P229-W233 PolarHBondContact O-NE1 2.77Å
230	L	97.9	Very high	98.2	Very high	12 Å²	12	17.7 Å²	17.7	6%	0.063	9%	0.086	C	C	.	.	G	3₁₀ helix	trans	-57.4	-37.7	-173.5	-70.7	172	0	0	0	112.5	M36 R228 S232 W233 L322 L325 L326 L360	M36-L230 HydrophobicContact SD-CG 4.41Å; R228-L230 PolarHBondContact O-N 3.01Å; L230-S232 PolarHBondContact O-N 3.19Å; L230-S232 VanDerWaalsContact O-N 3.14Å; L230-W233 HydrophobicContact CD2-CD2 4.01Å; L230-W233 HydrophobicContact CD2-CE3 4.05Å; L230-W233 HydrophobicContact CD2-CH2 3.48Å; L230-W233 VanDerWaalsContact CD2-CH2 3.48Å; L230-W233 HydrophobicContact CD2-CZ2 3.45Å; L230-W233 VanDerWaalsContact CD2-CZ2 3.45Å; L230-W233 HydrophobicContact CD2-CZ3 3.79Å; L230-W233 WeakPolarHBondContact O-CB 3.19Å; L230-W233 PolarHBondContact O-N 2.91Å; L230-W233 VanDerWaalsContact O-N 3.09Å; L230-L322 HydrophobicContact CD2-CD1 4.5Å; L230-L325 HydrophobicContact CD1-CB 4.24Å; L230-L325 HydrophobicContact CD2-CB 4.15Å; L230-L325 HydrophobicContact CD2-CD1 4.42Å; L230-L326 HydrophobicContact CB-CD2 3.46Å; L230-L326 VanDerWaalsContact CB-CD2 3.46Å; L230-L326 HydrophobicContact CB-CG 4.33Å; L230-L326 HydrophobicContact CD1-CD2 4.45Å; L230-L360 HydrophobicContact CD2-CD1 4.13Å
231	E	98.2	Very high	98.2	Very high	58 Å²	58	17.6 Å²	17.6	27%	0.271	9%	0.086	S	C	.	.	G	3₁₀ helix	trans	-60.9	-25.3	-178.8	-59.4	86.5	167	0	0	112.2	P229 I279 G282 V286 L326	P229-E231 VanDerWaalsContact C-N 3.25Å; P229-E231 PolarHBondContact O-N 2.96Å; E231-I279 HydrophobicContact CB-CG2 4.23Å; E231-I279 HydrophobicContact CG-CG2 4.27Å; E231-G282 CarbonylContact C-O 3.59Å; E231-G282 WeakPolarHBondContact O-CA 3.4Å; E231-V286 HydrophobicContact CG-CG2 4.13Å; E231-L326 HydrophobicContact CG-CD2 4.07Å
232	S	98.3	Very high	98.2	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.087	C	C	.	.	G	3₁₀ helix	trans	-86.9	-11.5	-179.5	74.8	0	0	0	0	114.2	R228 P229 L230 G234 V235 G236 G282	R228-S232 WeakPolarHBondContact CG-OG 3.35Å; R228-S232 PolarHBondContact NE-OG 3.31Å; P229-S232 PolarHBondContact O-N 2.84Å; P229-S232 VanDerWaalsContact O-N 3.07Å; P229-S232 PolarHBondContact O-OG 3.07Å; L230-S232 PolarHBondContact O-N 3.19Å; L230-S232 VanDerWaalsContact O-N 3.14Å; S232-G234 PolarHBondContact O-N 3.09Å; S232-V235 PolarHBondContact O-N 3.12Å; S232-G236 PolarHBondContact O-N 3.32Å; S232-G282 PolarHBondContact N-O 2.91Å
233	W	98.8	Very high	98.2	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-65.8	-44.5	-168.6	-72.6	16.9	0	0	0	112.6	F220 Y223 A224 R228 P229 L230 G236 L237 L322 L325 C356 L360	F220-W233 HydrophobicContact CB-CE3 3.58Å; F220-W233 HydrophobicContact CB-CZ3 3.66Å; F220-W233 HydrophobicContact CD1-CB 3.94Å; F220-W233 HydrophobicContact CD1-CD2 4.33Å; F220-W233 AromaticContact CD1-CE3 3.86Å; F220-W233 HydrophobicContact CD1-CE3 3.86Å; F220-W233 HydrophobicContact CD1-CG 4.42Å; F220-W233 HydrophobicContact CD2-CE3 4.07Å; F220-W233 HydrophobicContact CE1-CB 3.76Å; F220-W233 HydrophobicContact CG-CD2 4.46Å; F220-W233 AromaticContact CG-CE3 3.57Å; F220-W233 HydrophobicContact CG-CE3 3.57Å; F220-W233 HydrophobicContact CG-CZ3 4.13Å; F220-W233 HydrophobicContact CZ-CB 4.38Å; F220-W233 WeakPolarHBondContact O-CH2 3.33Å; Y223-W233 HydrophobicContact CD2-CB 4Å; Y223-W233 AromaticContact CD2-CD1 3.69Å; Y223-W233 HydrophobicContact CD2-CD2 4.22Å; Y223-W233 AromaticContact CD2-CG 3.69Å; Y223-W233 HydrophobicContact CD2-CG 3.69Å; Y223-W233 HydrophobicContact CG-CG 4.44Å; A224-W233 HydrophobicContact CB-CH2 3.75Å; A224-W233 HydrophobicContact CB-CZ2 4.06Å; R228-W233 PolarHBondContact O-NE1 3.11Å; P229-W233 PolarHBondContact O-NE1 2.77Å; L230-W233 HydrophobicContact CD2-CD2 4.01Å; L230-W233 HydrophobicContact CD2-CE3 4.05Å; L230-W233 HydrophobicContact CD2-CH2 3.48Å; L230-W233 VanDerWaalsContact CD2-CH2 3.48Å; L230-W233 HydrophobicContact CD2-CZ2 3.45Å; L230-W233 VanDerWaalsContact CD2-CZ2 3.45Å; L230-W233 HydrophobicContact CD2-CZ3 3.79Å; L230-W233 WeakPolarHBondContact O-CB 3.19Å; L230-W233 PolarHBondContact O-N 2.91Å; L230-W233 VanDerWaalsContact O-N 3.09Å; W233-G236 PolarHBondContact O-N 3.23Å; W233-L237 PolarHBondContact O-N 3.08Å; W233-L322 HydrophobicContact CB-CD1 4.23Å; W233-L322 HydrophobicContact CB-CD2 4.36Å; W233-L322 HydrophobicContact CD2-CD1 4.33Å; W233-L322 HydrophobicContact CE3-CD1 3.86Å; W233-L325 HydrophobicContact CH2-CD1 4.36Å; W233-L325 HydrophobicContact CZ3-CD1 3.77Å; W233-C356 HydrophobicContact CH2-CB 4.26Å; W233-C356 HydrophobicContact CZ3-CB 4.18Å; W233-L360 HydrophobicContact CH2-CD1 4.29Å
234	G	98.7	Very high	98.2	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-68.8	-33.4	179.5	0	0	0	0	0	113.2	S232 L237 L238	S232-G234 PolarHBondContact O-N 3.09Å; G234-L237 WeakPolarHBondContact O-CB 3.06Å; G234-L237 PolarHBondContact O-N 3.31Å; G234-L238 WeakPolarHBondContact O-CG 3.22Å; G234-L238 PolarHBondContact O-N 3.04Å
235	V	98.6	Very high	98.2	Very high	5 Å²	5	21.4 Å²	21.4	3%	0.03	11%	0.11	C	C	.	.	H	α-helix	trans	-66.9	-46.2	171.9	179.9	0	0	0	0	110.1	F29 S232 L237 L238 E239 L274	F29-V235 HydrophobicContact CZ-CG1 3.87Å; S232-V235 PolarHBondContact O-N 3.12Å; V235-L237 VanDerWaalsContact C-N 3.27Å; V235-L237 PolarHBondContact O-N 3.4Å; V235-L238 PolarHBondContact O-N 2.82Å; V235-E239 VanDerWaalsContact CG1-CD 3.47Å; V235-E239 HydrophobicContact CG1-CG 3.95Å; V235-E239 WeakPolarHBondContact CG1-OE2 3.49Å; V235-E239 WeakPolarHBondContact O-CB 3.26Å; V235-E239 PolarHBondContact O-N 2.79Å; V235-L274 HydrophobicContact CG2-CD1 4.05Å
236	G	98.7	Very high	98.2	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-58.4	-36.7	174.8	0	0	0	0	0	113.1	S232 W233 E240 A241	S232-G236 PolarHBondContact O-N 3.32Å; W233-G236 PolarHBondContact O-N 3.23Å; G236-E240 WeakPolarHBondContact O-CA 3.24Å; G236-E240 WeakPolarHBondContact O-CB 3.35Å; G236-E240 PolarHBondContact O-N 3.5Å; G236-A241 PolarHBondContact O-N 3.37Å
237	L	98.8	Very high	98.3	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.13	C	C	.	.	I	π-helix	trans	-59.2	-47	172.2	173	60.4	0	0	0	111.9	V215 A216 L219 F220 W233 G234 V235 A241 C242 F266 W270	V215-L237 HydrophobicContact CG1-CD1 4.22Å; A216-L237 HydrophobicContact CB-CD1 3.96Å; A216-L237 HydrophobicContact CB-CD2 3.65Å; A216-L237 HydrophobicContact CB-CG 4.46Å; L219-L237 HydrophobicContact CD2-CB 3.95Å; L219-L237 HydrophobicContact CD2-CD1 4.19Å; F220-L237 HydrophobicContact CE1-CB 4.23Å; F220-L237 HydrophobicContact CE1-CD2 4.41Å; F220-L237 HydrophobicContact CZ-CD2 4.17Å; W233-L237 PolarHBondContact O-N 3.08Å; G234-L237 WeakPolarHBondContact O-CB 3.06Å; G234-L237 PolarHBondContact O-N 3.31Å; V235-L237 VanDerWaalsContact C-N 3.27Å; V235-L237 PolarHBondContact O-N 3.4Å; L237-A241 HydrophobicContact CD1-CB 4.37Å; L237-C242 WeakPolarHBondContact O-CB 3.34Å; L237-C242 PolarHBondContact O-N 3.44Å; L237-C242 PolarHBondContact O-SG 3.1Å; L237-F266 HydrophobicContact CD1-CE1 4.39Å; L237-F266 HydrophobicContact CD2-CE1 3.97Å; L237-F266 HydrophobicContact CD2-CZ 3.99Å; L237-F266 HydrophobicContact CG-CE1 4.23Å; L237-W270 HydrophobicContact CD2-CD2 3.75Å; L237-W270 HydrophobicContact CD2-CE3 4.17Å; L237-W270 HydrophobicContact CD2-CG 4.26Å; L237-W270 HydrophobicContact CD2-CH2 4.17Å; L237-W270 HydrophobicContact CD2-CZ2 3.73Å; L237-W270 HydrophobicContact CD2-CZ3 4.36Å
238	L	98.7	Very high	98.4	Very high	25 Å²	25	26.6 Å²	26.6	13%	0.131	13%	0.133	C	C	.	.	I	π-helix	trans	-74	-39.7	-177.3	-68.8	179.1	0	0	0	113.7	G234 V235 P243 W270 K271 L274	G234-L238 WeakPolarHBondContact O-CG 3.22Å; G234-L238 PolarHBondContact O-N 3.04Å; V235-L238 PolarHBondContact O-N 2.82Å; L238-P243 WeakPolarHBondContact O-CD 3.37Å; L238-W270 HydrophobicContact CD1-CB 4.18Å; L238-W270 HydrophobicContact CD2-CB 3.85Å; L238-W270 HydrophobicContact CG-CB 4.23Å; L238-K271 HydrophobicContact CD1-CG 3.62Å; L238-L274 HydrophobicContact CD1-CD1 3.77Å
239	E	98.3	Very high	98.5	Very high	99 Å²	99	26.1 Å²	26.1	46%	0.463	13%	0.131	S	C	.	.	I	π-helix	trans	-97.5	-26.4	-169.3	-61.9	-169.2	162.8	0	0	113.4	V235 P243	V235-E239 VanDerWaalsContact CG1-CD 3.47Å; V235-E239 HydrophobicContact CG1-CG 3.95Å; V235-E239 WeakPolarHBondContact CG1-OE2 3.49Å; V235-E239 WeakPolarHBondContact O-CB 3.26Å; V235-E239 PolarHBondContact O-N 2.79Å; E239-P243 WeakPolarHBondContact O-CG 3.45Å
240	E	98.3	Very high	98.5	Very high	32 Å²	32	27.8 Å²	27.8	15%	0.15	14%	0.14	C	C	.	.	I	π-helix	trans	-106.7	-56.1	-177.8	-52.8	168.4	-144	0	0	110.9	F29 L190 Y223 R228 G236 I244	F29-E240 WeakPolarHBondContact CD2-OE1 3.29Å; F29-E240 WeakPolarHBondContact CE2-OE1 3.13Å; L190-E240 HydrophobicContact CD2-CB 3.91Å; Y223-E240 PolarHBondContact OH-OE2 2.97Å; Y223-E240 VanDerWaalsContact OH-OE2 3.06Å; R228-E240 IonicContact CZ-OE1 3.26Å; R228-E240 VanDerWaalsContact CZ-OE1 3.25Å; R228-E240 IonicContact NH1-OE1 3.12Å; R228-E240 PolarHBondContact NH1-OE1 3.15Å; R228-E240 IonicContact NH1-OE2 2.71Å; R228-E240 PolarHBondContact NH1-OE2 3.23Å; R228-E240 VanDerWaalsContact NH1-OE2 3.1Å; R228-E240 IonicContact NH2-OE1 3.07Å; R228-E240 PolarHBondContact NH2-OE1 2.97Å; G236-E240 WeakPolarHBondContact O-CA 3.24Å; G236-E240 WeakPolarHBondContact O-CB 3.35Å; G236-E240 PolarHBondContact O-N 3.5Å; E240-I244 WeakPolarHBondContact O-CD1 3.4Å; E240-I244 WeakPolarHBondContact O-CG1 3.43Å
241	A	98.8	Very high	98.6	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.164	C	C	.	.	I	π-helix	trans	-81.1	-43	-170.5	0	0	0	0	0	113.9	V194 V215 L219 G236 L237 I244 A245	V194-A241 HydrophobicContact CG2-CB 3.95Å; V215-A241 HydrophobicContact CG1-CB 3.75Å; L219-A241 HydrophobicContact CD1-CB 4.37Å; L219-A241 HydrophobicContact CD2-CB 3.69Å; G236-A241 PolarHBondContact O-N 3.37Å; L237-A241 HydrophobicContact CD1-CB 4.37Å; A241-I244 PolarHBondContact O-N 3.32Å; A241-A245 PolarHBondContact O-N 3.45Å
242	C	98.8	Very high	98.5	Very high	4 Å²	4	30.8 Å²	30.8	3%	0.027	16%	0.161	C	C	.	.	H	α-helix	trans	-58.8	-43.3	-179.9	-84	0	0	0	0	113.7	L237 I244 A245 K246 W263	L237-C242 WeakPolarHBondContact O-CB 3.34Å; L237-C242 PolarHBondContact O-N 3.44Å; L237-C242 PolarHBondContact O-SG 3.1Å; C242-I244 VanDerWaalsContact C-N 3.34Å; C242-I244 PolarHBondContact O-N 2.82Å; C242-A245 PolarHBondContact O-N 3.06Å; C242-K246 PolarHBondContact O-N 3.14Å; C242-W263 WeakPolarHBondContact O-CZ2 3.4Å
243	P	98.7	Very high	98.4	Very high	63 Å²	63	33.9 Å²	33.9	41%	0.409	19%	0.192	S	C	.	.	H	α-helix	trans	-60.1	-41.9	175.1	-27.2	37.2	0	0	0	113	L238 E239 K246 K247	L238-P243 WeakPolarHBondContact O-CD 3.37Å; E239-P243 WeakPolarHBondContact O-CG 3.45Å; P243-K246 PolarHBondContact O-N 2.92Å; P243-K247 PolarHBondContact O-N 3.41Å; P243-K247 VanDerWaalsContact O-N 3.08Å
244	I	98.8	Very high	98.3	Very high	18 Å²	18	36.7 Å²	36.7	9%	0.092	21%	0.205	C	C	.	.	H	α-helix	trans	-63.4	-44.8	175.8	-61.6	170.3	0	0	0	110.1	L26 L190 V194 E240 A241 C242 K246 K247 V248	L26-I244 HydrophobicContact CD1-CD1 4.21Å; L26-I244 HydrophobicContact CD2-CD1 4.08Å; L26-I244 HydrophobicContact CD2-CG1 3.96Å; L190-I244 HydrophobicContact CD2-CD1 3.67Å; L190-I244 HydrophobicContact CG-CD1 3.74Å; V194-I244 HydrophobicContact CB-CB 4.36Å; V194-I244 HydrophobicContact CB-CG2 3.77Å; V194-I244 HydrophobicContact CG1-CB 4.04Å; V194-I244 HydrophobicContact CG1-CG2 3.68Å; V194-I244 HydrophobicContact CG2-CB 4.38Å; V194-I244 HydrophobicContact CG2-CG2 4.23Å; E240-I244 WeakPolarHBondContact O-CD1 3.4Å; E240-I244 WeakPolarHBondContact O-CG1 3.43Å; A241-I244 PolarHBondContact O-N 3.32Å; C242-I244 VanDerWaalsContact C-N 3.34Å; C242-I244 PolarHBondContact O-N 2.82Å; I244-K246 VanDerWaalsContact C-N 3.29Å; I244-K246 PolarHBondContact O-N 3.23Å; I244-K247 WeakPolarHBondContact O-CA 3.4Å; I244-K247 WeakPolarHBondContact O-CB 3.19Å; I244-K247 PolarHBondContact O-N 3.32Å; I244-K247 VanDerWaalsContact O-N 3.1Å; I244-V248 WeakPolarHBondContact O-CG2 3.25Å; I244-V248 PolarHBondContact O-N 2.75Å
245	A	98.8	Very high	98.2	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-60.9	-39.2	178.3	0	0	0	0	0	111.7	V194 V198 L212 A241 C242 K247 V248 I249 W263	V194-A245 HydrophobicContact CG1-CB 3.7Å; V198-A245 HydrophobicContact CG2-CB 3.77Å; L212-A245 HydrophobicContact CD2-CB 3.63Å; A241-A245 PolarHBondContact O-N 3.45Å; C242-A245 PolarHBondContact O-N 3.06Å; A245-K247 VanDerWaalsContact C-N 3.32Å; A245-K247 PolarHBondContact O-N 3.4Å; A245-V248 PolarHBondContact O-N 3.36Å; A245-I249 PolarHBondContact O-N 3.48Å; A245-W263 HydrophobicContact CB-CH2 3.84Å; A245-W263 HydrophobicContact CB-CZ2 4.24Å
246	K	98.7	Very high	98.2	Very high	72 Å²	72	39 Å²	39	31%	0.313	22%	0.221	S	C	.	.	H	α-helix	trans	-62.9	-40.6	175.7	-166.3	172.5	-123.8	177	0	111.3	C242 P243 I244 I249 T250 L260 W263	C242-K246 PolarHBondContact O-N 3.14Å; P243-K246 PolarHBondContact O-N 2.92Å; I244-K246 VanDerWaalsContact C-N 3.29Å; I244-K246 PolarHBondContact O-N 3.23Å; K246-I249 PolarHBondContact O-N 2.85Å; K246-T250 WeakPolarHBondContact O-CB 3.37Å; K246-T250 PolarHBondContact O-N 3.02Å; K246-T250 PolarHBondContact O-OG1 3.23Å; K246-L260 HydrophobicContact CD-CD2 4.24Å; K246-L260 HydrophobicContact CG-CD2 3.94Å; K246-W263 VanDerWaalsContact CA-CH2 3.43Å; K246-W263 HydrophobicContact CB-CH2 3.87Å; K246-W263 HydrophobicContact CB-CZ2 3.51Å; K246-W263 VanDerWaalsContact CE-CD1 3.43Å; K246-W263 HydrophobicContact CG-CD2 4.33Å; K246-W263 HydrophobicContact CG-CH2 4.49Å; K246-W263 HydrophobicContact CG-CZ2 4.17Å; K246-W263 VanDerWaalsContact N-CH2 3.27Å
247	K	98.6	Very high	98.2	Very high	109 Å²	109	46.9 Å²	46.9	47%	0.474	26%	0.258	S	S	.	.	H	α-helix	trans	-63	-46.4	174.1	-170	179.6	-172.7	-62.7	0	111.3	P243 I244 A245 I249 T250 D251	P243-K247 PolarHBondContact O-N 3.41Å; P243-K247 VanDerWaalsContact O-N 3.08Å; I244-K247 WeakPolarHBondContact O-CA 3.4Å; I244-K247 WeakPolarHBondContact O-CB 3.19Å; I244-K247 PolarHBondContact O-N 3.32Å; I244-K247 VanDerWaalsContact O-N 3.1Å; A245-K247 VanDerWaalsContact C-N 3.32Å; A245-K247 PolarHBondContact O-N 3.4Å; K247-I249 VanDerWaalsContact C-N 3.3Å; K247-I249 PolarHBondContact O-N 3.35Å; K247-T250 PolarHBondContact O-N 3.31Å; K247-T250 VanDerWaalsContact O-N 3.13Å; K247-D251 WeakPolarHBondContact CG-OD2 3.35Å; K247-D251 IonicContact NZ-OD1 2.73Å; K247-D251 IonicContact NZ-OD2 3.28Å; K247-D251 PolarHBondContact NZ-OD2 2.94Å; K247-D251 WeakPolarHBondContact O-CB 3.5Å; K247-D251 VanDerWaalsContact O-CG 3.26Å; K247-D251 PolarHBondContact O-N 3.1Å
248	V	98.4	Very high	98.2	Very high	18 Å²	18	51.1 Å²	51.1	11%	0.109	28%	0.277	C	S	.	.	H	α-helix	trans	-54.2	-46	174.9	171.9	0	0	0	0	111.4	F195 V198 I244 A245 S252	F195-V248 HydrophobicContact CB-CG2 4.33Å; F195-V248 HydrophobicContact CD2-CG1 3.95Å; F195-V248 HydrophobicContact CD2-CG2 4.29Å; V198-V248 HydrophobicContact CB-CG1 4.18Å; V198-V248 HydrophobicContact CG1-CG1 3.86Å; I244-V248 WeakPolarHBondContact O-CG2 3.25Å; I244-V248 PolarHBondContact O-N 2.75Å; A245-V248 PolarHBondContact O-N 3.36Å; V248-S252 VanDerWaalsContact O-CB 3.3Å; V248-S252 WeakPolarHBondContact O-CB 3.35Å; V248-S252 PolarHBondContact O-N 3.16Å
249	I	98.4	Very high	98.2	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-63	-48.5	176.9	-68.4	-55.6	0	0	0	111.5	V198 F211 A245 K246 K247 S252 N259 W263	V198-I249 HydrophobicContact CG1-CD1 3.77Å; V198-I249 HydrophobicContact CG1-CG1 4.44Å; F211-I249 HydrophobicContact CE1-CD1 4.34Å; F211-I249 HydrophobicContact CE2-CD1 4.21Å; F211-I249 HydrophobicContact CE2-CG1 4.18Å; F211-I249 HydrophobicContact CZ-CD1 3.83Å; F211-I249 HydrophobicContact CZ-CG1 3.93Å; A245-I249 PolarHBondContact O-N 3.48Å; K246-I249 PolarHBondContact O-N 2.85Å; K247-I249 VanDerWaalsContact C-N 3.3Å; K247-I249 PolarHBondContact O-N 3.35Å; I249-S252 PolarHBondContact O-N 3.19Å; I249-S252 PolarHBondContact O-OG 2.99Å; I249-N259 HydrophobicContact CG2-CB 3.72Å; I249-W263 HydrophobicContact CB-CZ3 4.5Å; I249-W263 HydrophobicContact CG1-CH2 4.5Å; I249-W263 HydrophobicContact CG1-CZ3 3.92Å
250	T	98.4	Very high	98.1	Very high	68 Å²	68	48.5 Å²	48.5	42%	0.417	27%	0.266	S	S	.	.	H	α-helix	trans	-61.4	-48.7	-177.4	-55.1	0	0	0	0	111.2	K246 K247 S252 G253	K246-T250 WeakPolarHBondContact O-CB 3.37Å; K246-T250 PolarHBondContact O-N 3.02Å; K246-T250 PolarHBondContact O-OG1 3.23Å; K247-T250 PolarHBondContact O-N 3.31Å; K247-T250 VanDerWaalsContact O-N 3.13Å; T250-S252 VanDerWaalsContact C-N 3.25Å; T250-S252 PolarHBondContact O-N 3.27Å; T250-G253 PolarHBondContact O-N 3.07Å
251	D	98.1	Very high	98.1	Very high	106 Å²	106	55.2 Å²	55.2	57%	0.567	30%	0.295	S	S	*	.	H	α-helix	trans	-66.3	-28.2	-179.8	-67.3	-4.6	0	0	0	112.1	K247 G253	K247-D251 WeakPolarHBondContact CG-OD2 3.35Å; K247-D251 IonicContact NZ-OD1 2.73Å; K247-D251 IonicContact NZ-OD2 3.28Å; K247-D251 PolarHBondContact NZ-OD2 2.94Å; K247-D251 WeakPolarHBondContact O-CB 3.5Å; K247-D251 VanDerWaalsContact O-CG 3.26Å; K247-D251 PolarHBondContact O-N 3.1Å; D251-G253 PolarHBondContact O-N 2.73Å
252	S	96.1	Very high	98	Very high	28 Å²	28	57.4 Å²	57.4	20%	0.196	31%	0.306	C	S	.	.	H	α-helix	trans	-67.6	-21	179.2	78.3	0	0	0	0	113.8	R202 V248 I249 T250 F254	R202-S252 PolarHBondContact NH1-OG 3.48Å; V248-S252 VanDerWaalsContact O-CB 3.3Å; V248-S252 WeakPolarHBondContact O-CB 3.35Å; V248-S252 PolarHBondContact O-N 3.16Å; I249-S252 PolarHBondContact O-N 3.19Å; I249-S252 PolarHBondContact O-OG 2.99Å; T250-S252 VanDerWaalsContact C-N 3.25Å; T250-S252 PolarHBondContact O-N 3.27Å; S252-F254 PolarHBondContact O-N 3.29Å; S252-F254 VanDerWaalsContact O-N 3.09Å; S252-F254 PolarHBondContact OG-N 2.85Å
253	G	97.1	Very high	97.9	Very high	64 Å²	64	57.6 Å²	57.6	66%	0.66	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.8	13.1	-177.4	0	0	0	0	0	114.7	T250 D251	T250-G253 PolarHBondContact O-N 3.07Å; D251-G253 PolarHBondContact O-N 2.73Å
254	F	96.2	Very high	97.8	Very high	60 Å²	60	58.7 Å²	58.7	26%	0.263	31%	0.309	S	S	.	.	S	Bend	trans	-116.8	116.8	-172.5	-176.6	-119.4	0	0	0	111.6	R161 V162 H206 S252 V256	R161-F254 HydrophobicContact CB-CE1 4.1Å; R161-F254 HydrophobicContact CB-CZ 4.31Å; V162-F254 WeakPolarHBondContact O-CE1 3.4Å; H206-F254 AromaticContact CE1-CD1 3.55Å; H206-F254 AromaticContact CE1-CE1 3.32Å; H206-F254 WeakPolarHBondContact CE1-CE1 3.44Å; H206-F254 AromaticContact ND1-CE1 3.72Å; S252-F254 PolarHBondContact O-N 3.29Å; S252-F254 VanDerWaalsContact O-N 3.09Å; S252-F254 PolarHBondContact OG-N 2.85Å; F254-V256 PolarHBondContact O-N 3.46Å
255	A	97.4	Very high	97.6	Very high	18 Å²	18	59.8 Å²	59.8	15%	0.149	32%	0.318	C	S	.	.	S	Bend	trans	51.9	38.1	-176.1	0	0	0	0	0	113.5	E258 N259	A255-E258 VanDerWaalsContact C-OE2 3.25Å; A255-E258 VanDerWaalsContact CA-OE2 3.24Å; A255-E258 WeakPolarHBondContact CA-OE2 3.45Å; A255-N259 WeakPolarHBondContact O-CB 3.32Å; A255-N259 PolarHBondContact O-N 2.9Å; A255-N259 VanDerWaalsContact O-N 3.07Å; A255-N259 PolarHBondContact O-ND2 3.3Å
256	V	98.4	Very high	97.6	Very high	36 Å²	36	59.8 Å²	59.8	22%	0.218	32%	0.318	C	S	.	.	H	α-helix	trans	-63.8	-46.6	-173.1	179.9	0	0	0	0	110.8	F254 E258 N259 L260	F254-V256 PolarHBondContact O-N 3.46Å; V256-E258 PolarHBondContact O-N 2.91Å; V256-N259 PolarHBondContact O-N 3.44Å; V256-L260 HydrophobicContact CG1-CD1 3.68Å; V256-L260 HydrophobicContact CG1-CG 4.11Å; V256-L260 WeakPolarHBondContact O-CB 3.3Å; V256-L260 WeakPolarHBondContact O-CG 3.23Å; V256-L260 PolarHBondContact O-N 2.89Å
257	E	98.3	Very high	97.6	Very high	165 Å²	165	57.2 Å²	57.2	77%	0.771	31%	0.309	S	S	*	.	H	α-helix	trans	-62.4	-46.8	-177.8	-173	-179.9	167.2	0	0	111.7	N259 L260 K261	E257-N259 PolarHBondContact O-N 3.08Å; E257-L260 PolarHBondContact O-N 3.18Å; E257-K261 WeakPolarHBondContact O-CB 2.92Å; E257-K261 PolarHBondContact O-N 3.48Å
258	E	98.3	Very high	97.5	Very high	88 Å²	88	58.5 Å²	58.5	41%	0.411	32%	0.315	S	S	.	.	H	α-helix	trans	-63.6	-43.3	179.6	-59.3	92.8	149.3	0	0	111.8	Y164 A255 V256 K261	Y164-E258 HydrophobicContact CD1-CB 3.75Å; Y164-E258 HydrophobicContact CD1-CG 4.12Å; Y164-E258 HydrophobicContact CD2-CB 3.7Å; Y164-E258 HydrophobicContact CE1-CB 4.06Å; Y164-E258 HydrophobicContact CE2-CB 3.97Å; Y164-E258 HydrophobicContact CG-CB 3.6Å; Y164-E258 HydrophobicContact CG-CG 4.29Å; A255-E258 VanDerWaalsContact C-OE2 3.25Å; A255-E258 VanDerWaalsContact CA-OE2 3.24Å; A255-E258 WeakPolarHBondContact CA-OE2 3.45Å; V256-E258 PolarHBondContact O-N 2.91Å; E258-K261 PolarHBondContact O-N 3.39Å
259	N	98.4	Very high	97.5	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-66.5	-42.3	176.9	-79.3	-66.5	0	0	0	112.3	H206 P208 F211 I249 A255 V256 E257 K261 D262 W263	H206-N259 PolarHBondContact NE2-ND2 3.29Å; P208-N259 WeakPolarHBondContact CD-OD1 3.49Å; P208-N259 HydrophobicContact CG-CB 4.26Å; P208-N259 VanDerWaalsContact CG-O 3.27Å; P208-N259 WeakPolarHBondContact CG-O 3.39Å; F211-N259 VanDerWaalsContact CE1-OD1 3.24Å; F211-N259 WeakPolarHBondContact CE1-OD1 3.5Å; I249-N259 HydrophobicContact CG2-CB 3.72Å; A255-N259 WeakPolarHBondContact O-CB 3.32Å; A255-N259 PolarHBondContact O-N 2.9Å; A255-N259 VanDerWaalsContact O-N 3.07Å; A255-N259 PolarHBondContact O-ND2 3.3Å; V256-N259 PolarHBondContact O-N 3.44Å; E257-N259 PolarHBondContact O-N 3.08Å; N259-K261 VanDerWaalsContact C-N 3.29Å; N259-K261 PolarHBondContact O-N 3.44Å; N259-D262 PolarHBondContact O-N 2.95Å; N259-W263 PolarHBondContact O-N 3.13Å; N259-W263 VanDerWaalsContact O-N 3.07Å
260	L	97.9	Very high	97.6	Very high	69 Å²	69	60.1 Å²	60.1	36%	0.361	32%	0.321	S	S	.	.	H	α-helix	trans	-67.3	-32.1	-179.7	-71	-178.2	0	0	0	112.1	K246 V256 E257 D262 W263	K246-L260 HydrophobicContact CD-CD2 4.24Å; K246-L260 HydrophobicContact CG-CD2 3.94Å; V256-L260 HydrophobicContact CG1-CD1 3.68Å; V256-L260 HydrophobicContact CG1-CG 4.11Å; V256-L260 WeakPolarHBondContact O-CB 3.3Å; V256-L260 WeakPolarHBondContact O-CG 3.23Å; V256-L260 PolarHBondContact O-N 2.89Å; E257-L260 PolarHBondContact O-N 3.18Å; L260-D262 VanDerWaalsContact C-N 3.35Å; L260-D262 PolarHBondContact O-N 2.76Å; L260-W263 WeakPolarHBondContact O-CB 3.14Å
261	K	97.8	Very high	97.6	Very high	173 Å²	173	62.6 Å²	62.6	75%	0.752	33%	0.326	S	S	*	.	H	α-helix	trans	-60.1	-41.8	175.6	-179.8	-178.3	173.3	-175.4	0	112.7	E257 E258 N259	E257-K261 WeakPolarHBondContact O-CB 2.92Å; E257-K261 PolarHBondContact O-N 3.48Å; E258-K261 PolarHBondContact O-N 3.39Å; N259-K261 VanDerWaalsContact C-N 3.29Å; N259-K261 PolarHBondContact O-N 3.44Å
262	D	96.1	Very high	97.6	Very high	46 Å²	46	65.7 Å²	65.7	25%	0.246	33%	0.33	C	S	.	.	H	α-helix	trans	-101.2	2.8	-175.6	-62.2	-46	0	0	0	114	Y164 H207 P208 N259 L260 D264 S265	Y164-D262 PolarHBondContact OH-OD2 2.91Å; H207-D262 IonicContact NE2-OD2 2.8Å; P208-D262 HydrophobicContact CG-CB 4.33Å; N259-D262 PolarHBondContact O-N 2.95Å; L260-D262 VanDerWaalsContact C-N 3.35Å; L260-D262 PolarHBondContact O-N 2.76Å; D262-D264 PolarHBondContact O-N 3.07Å; D262-S265 WeakPolarHBondContact O-CB 3.48Å; D262-S265 PolarHBondContact O-N 3.29Å
263	W	97.1	Very high	97.7	Very high	8 Å²	8	64.5 Å²	64.5	3%	0.03	32%	0.321	C	S	.	.	H	α-helix	trans	-54.1	-49.6	-173.8	-169.5	-88.8	0	0	0	113.5	P208 F211 L212 C242 A245 K246 I249 N259 L260 S265 F266	P208-W263 HydrophobicContact CB-CE3 4.25Å; P208-W263 HydrophobicContact CG-CE3 4.34Å; F211-W263 HydrophobicContact CE2-CH2 4.29Å; F211-W263 AromaticContact CE2-CZ3 3.96Å; F211-W263 HydrophobicContact CE2-CZ3 3.96Å; F211-W263 AromaticContact CZ-CZ3 3.96Å; F211-W263 HydrophobicContact CZ-CZ3 3.96Å; L212-W263 HydrophobicContact CD1-CH2 4.18Å; L212-W263 HydrophobicContact CD1-CZ2 4.07Å; L212-W263 HydrophobicContact CD2-CH2 3.85Å; L212-W263 HydrophobicContact CD2-CZ2 4.09Å; L212-W263 HydrophobicContact CG-CH2 4.41Å; C242-W263 WeakPolarHBondContact O-CZ2 3.4Å; A245-W263 HydrophobicContact CB-CH2 3.84Å; A245-W263 HydrophobicContact CB-CZ2 4.24Å; K246-W263 VanDerWaalsContact CA-CH2 3.43Å; K246-W263 HydrophobicContact CB-CH2 3.87Å; K246-W263 HydrophobicContact CB-CZ2 3.51Å; K246-W263 VanDerWaalsContact CE-CD1 3.43Å; K246-W263 HydrophobicContact CG-CD2 4.33Å; K246-W263 HydrophobicContact CG-CH2 4.49Å; K246-W263 HydrophobicContact CG-CZ2 4.17Å; K246-W263 VanDerWaalsContact N-CH2 3.27Å; I249-W263 HydrophobicContact CB-CZ3 4.5Å; I249-W263 HydrophobicContact CG1-CH2 4.5Å; I249-W263 HydrophobicContact CG1-CZ3 3.92Å; N259-W263 PolarHBondContact O-N 3.13Å; N259-W263 VanDerWaalsContact O-N 3.07Å; L260-W263 WeakPolarHBondContact O-CB 3.14Å; W263-S265 PolarHBondContact O-N 3.36Å; W263-S265 VanDerWaalsContact O-N 3.14Å; W263-F266 PolarHBondContact O-N 3.42Å
264	D	96.1	Very high	97.8	Very high	86 Å²	86	61.7 Å²	61.7	46%	0.46	29%	0.291	S	S	.	.	H	α-helix	trans	-70	-16.1	-169.1	-69.1	-14	0	0	0	113.1	D262 F266 S267 K268	D262-D264 PolarHBondContact O-N 3.07Å; D264-F266 VanDerWaalsContact C-N 3.35Å; D264-F266 PolarHBondContact O-N 3.49Å; D264-S267 PolarHBondContact O-N 3.09Å; D264-K268 WeakPolarHBondContact O-CB 3.09Å; D264-K268 VanDerWaalsContact O-CG 3.23Å; D264-K268 WeakPolarHBondContact O-CG 3.24Å; D264-K268 PolarHBondContact O-N 3.14Å
265	S	95.9	Very high	97.9	Very high	41 Å²	41	63.9 Å²	63.9	29%	0.287	31%	0.305	S	S	.	.	H	α-helix	trans	-59.1	-47.3	179.5	-171.3	0	0	0	0	111	D262 W263 S267 K268 H269	D262-S265 WeakPolarHBondContact O-CB 3.48Å; D262-S265 PolarHBondContact O-N 3.29Å; W263-S265 PolarHBondContact O-N 3.36Å; W263-S265 VanDerWaalsContact O-N 3.14Å; S265-S267 PolarHBondContact O-N 3.39Å; S265-K268 PolarHBondContact O-N 3.44Å; S265-H269 PolarHBondContact O-N 3.07Å; S265-H269 PolarHBondContact O-ND1 3.37Å
266	F	98.3	Very high	97.9	Very high	0 Å²	0	67 Å²	67	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-59.1	-51.8	178.5	-178.1	-89.8	0	0	0	111.5	I209 L212 A216 L237 W263 D264 K268 H269 W270 H315	I209-F266 HydrophobicContact CG1-CB 4.33Å; L212-F266 HydrophobicContact CB-CD1 3.91Å; L212-F266 HydrophobicContact CB-CD2 3.69Å; L212-F266 HydrophobicContact CB-CE1 3.83Å; L212-F266 HydrophobicContact CB-CE2 3.57Å; L212-F266 HydrophobicContact CB-CG 3.84Å; L212-F266 HydrophobicContact CB-CZ 3.64Å; L212-F266 HydrophobicContact CD1-CB 3.83Å; L212-F266 HydrophobicContact CD1-CD1 3.77Å; L212-F266 HydrophobicContact CD1-CD2 4.39Å; L212-F266 HydrophobicContact CD1-CE1 4.41Å; L212-F266 HydrophobicContact CD1-CG 3.75Å; L212-F266 HydrophobicContact CG-CD1 4.46Å; L212-F266 HydrophobicContact CG-CG 4.46Å; L212-F266 WeakPolarHBondContact O-CZ 3.48Å; A216-F266 HydrophobicContact CB-CZ 4.46Å; L237-F266 HydrophobicContact CD1-CE1 4.39Å; L237-F266 HydrophobicContact CD2-CE1 3.97Å; L237-F266 HydrophobicContact CD2-CZ 3.99Å; L237-F266 HydrophobicContact CG-CE1 4.23Å; W263-F266 PolarHBondContact O-N 3.42Å; D264-F266 VanDerWaalsContact C-N 3.35Å; D264-F266 PolarHBondContact O-N 3.49Å; F266-K268 VanDerWaalsContact C-N 3.29Å; F266-K268 PolarHBondContact O-N 3.48Å; F266-H269 PolarHBondContact O-N 3.5Å; F266-W270 AromaticContact CD1-CD1 3.75Å; F266-W270 AromaticContact CE1-CD1 3.37Å; F266-W270 HydrophobicContact CE1-CG 4.29Å; F266-W270 AromaticContact CE1-NE1 3.56Å; F266-W270 AromaticContact CE2-CD1 3.95Å; F266-W270 AromaticContact CE2-NE1 3.58Å; F266-W270 AromaticContact CZ-CD1 3.5Å; F266-W270 AromaticContact CZ-NE1 3.17Å; F266-W270 PolarHBondContact O-N 2.98Å; F266-H315 HydrophobicContact CD2-CB 3.63Å; F266-H315 HydrophobicContact CE2-CB 3.87Å
267	S	97.3	Very high	97.9	Very high	18 Å²	18	65.4 Å²	65.4	13%	0.126	31%	0.31	C	S	.	.	H	α-helix	trans	-63.1	-33.7	-177.9	-57.7	0	0	0	0	113	D264 S265 K271	D264-S267 PolarHBondContact O-N 3.09Å; S265-S267 PolarHBondContact O-N 3.39Å; S267-K271 WeakPolarHBondContact O-CB 3.49Å; S267-K271 VanDerWaalsContact O-CG 3.27Å; S267-K271 WeakPolarHBondContact O-CG 3.12Å; S267-K271 PolarHBondContact O-N 3.03Å
268	K	98.3	Very high	97.9	Very high	137 Å²	137	59.3 Å²	59.3	60%	0.596	29%	0.291	S	S	*	.	H	α-helix	trans	-65.5	-42.2	176.7	-76.4	168.8	-177.5	170.5	0	112.2	D264 S265 F266 R272	D264-K268 WeakPolarHBondContact O-CB 3.09Å; D264-K268 VanDerWaalsContact O-CG 3.23Å; D264-K268 WeakPolarHBondContact O-CG 3.24Å; D264-K268 PolarHBondContact O-N 3.14Å; S265-K268 PolarHBondContact O-N 3.44Å; F266-K268 VanDerWaalsContact C-N 3.29Å; F266-K268 PolarHBondContact O-N 3.48Å; K268-R272 WeakPolarHBondContact O-CB 3.4Å; K268-R272 PolarHBondContact O-N 3.11Å; K268-R272 VanDerWaalsContact O-N 3.09Å
269	H	98.6	Very high	97.9	Very high	51 Å²	51	55.1 Å²	55.1	24%	0.236	27%	0.271	C	S	.	.	H	α-helix	trans	-64.1	-45.3	177.3	-70.6	86	0	0	0	111.3	S265 F266 R272 Y273 H315 M319	S265-H269 PolarHBondContact O-N 3.07Å; S265-H269 PolarHBondContact O-ND1 3.37Å; F266-H269 PolarHBondContact O-N 3.5Å; H269-R272 PolarHBondContact O-N 3.41Å; H269-Y273 PolarHBondContact O-N 2.94Å; H269-H315 AromaticContact CD2-CD2 3.79Å; H269-H315 AromaticContact CD2-NE2 3.89Å; H269-H315 AromaticContact CG-CD2 3.67Å; H269-M319 HydrophobicContact CB-CE 4.32Å
270	W	98.8	Very high	97.9	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-63.5	-45.1	177.5	-86.2	95.8	0	0	0	113	A216 F220 L237 L238 F266 R272 Y273 L274 H315 P318 M319 L322	A216-W270 HydrophobicContact CB-CZ2 4.49Å; F220-W270 AromaticContact CE2-CH2 3.64Å; F220-W270 HydrophobicContact CE2-CH2 3.64Å; F220-W270 HydrophobicContact CE2-CZ2 4.34Å; F220-W270 HydrophobicContact CE2-CZ3 4.44Å; F220-W270 AromaticContact CZ-CH2 3.47Å; F220-W270 HydrophobicContact CZ-CH2 3.47Å; F220-W270 VanDerWaalsContact CZ-CH2 3.47Å; F220-W270 HydrophobicContact CZ-CZ2 4.19Å; F220-W270 AromaticContact CZ-CZ3 3.93Å; F220-W270 HydrophobicContact CZ-CZ3 3.93Å; L237-W270 HydrophobicContact CD2-CD2 3.75Å; L237-W270 HydrophobicContact CD2-CE3 4.17Å; L237-W270 HydrophobicContact CD2-CG 4.26Å; L237-W270 HydrophobicContact CD2-CH2 4.17Å; L237-W270 HydrophobicContact CD2-CZ2 3.73Å; L237-W270 HydrophobicContact CD2-CZ3 4.36Å; L238-W270 HydrophobicContact CD1-CB 4.18Å; L238-W270 HydrophobicContact CD2-CB 3.85Å; L238-W270 HydrophobicContact CG-CB 4.23Å; F266-W270 AromaticContact CD1-CD1 3.75Å; F266-W270 AromaticContact CE1-CD1 3.37Å; F266-W270 HydrophobicContact CE1-CG 4.29Å; F266-W270 AromaticContact CE1-NE1 3.56Å; F266-W270 AromaticContact CE2-CD1 3.95Å; F266-W270 AromaticContact CE2-NE1 3.58Å; F266-W270 AromaticContact CZ-CD1 3.5Å; F266-W270 AromaticContact CZ-NE1 3.17Å; F266-W270 PolarHBondContact O-N 2.98Å; W270-R272 VanDerWaalsContact C-N 3.33Å; W270-R272 PolarHBondContact O-N 3.2Å; W270-Y273 HydrophobicContact CE3-CD1 4.08Å; W270-Y273 HydrophobicContact CZ3-CD1 4.09Å; W270-Y273 HydrophobicContact CZ3-CE1 4.17Å; W270-Y273 PolarHBondContact O-N 3.48Å; W270-L274 VanDerWaalsContact O-CG 3.29Å; W270-L274 WeakPolarHBondContact O-CG 3.27Å; W270-L274 PolarHBondContact O-N 3.32Å; W270-H315 PolarHBondContact NE1-O 3.39Å; W270-P318 HydrophobicContact CZ2-CB 4.3Å; W270-P318 HydrophobicContact CZ2-CG 4.14Å; W270-M319 HydrophobicContact CD2-CE 3.95Å; W270-M319 HydrophobicContact CE3-CE 4.42Å; W270-M319 HydrophobicContact CG-CE 4.07Å; W270-M319 HydrophobicContact CH2-CB 3.88Å; W270-M319 HydrophobicContact CH2-CG 4.35Å; W270-M319 HydrophobicContact CZ2-CB 3.84Å; W270-M319 HydrophobicContact CZ3-CB 4.47Å; W270-M319 HydrophobicContact CZ3-CG 4.46Å; W270-L322 HydrophobicContact CH2-CD2 4.3Å; W270-L322 HydrophobicContact CZ3-CD2 3.91Å
271	K	98.7	Very high	97.8	Very high	121 Å²	121	59.1 Å²	59.1	53%	0.526	30%	0.297	S	S	.	.	H	α-helix	trans	-57.1	-47.1	174.8	-74.8	176.8	179.9	-173.4	0	111.8	L238 S267 Y273 L274 D275	L238-K271 HydrophobicContact CD1-CG 3.62Å; S267-K271 WeakPolarHBondContact O-CB 3.49Å; S267-K271 VanDerWaalsContact O-CG 3.27Å; S267-K271 WeakPolarHBondContact O-CG 3.12Å; S267-K271 PolarHBondContact O-N 3.03Å; K271-Y273 VanDerWaalsContact C-N 3.31Å; K271-Y273 PolarHBondContact O-N 2.83Å; K271-L274 PolarHBondContact O-N 3.42Å; K271-D275 WeakPolarHBondContact O-CB 3.22Å; K271-D275 VanDerWaalsContact O-CG 3.25Å; K271-D275 PolarHBondContact O-N 2.87Å
272	R	98.6	Very high	97.7	Very high	170 Å²	170	51.3 Å²	51.3	64%	0.642	27%	0.265	S	S	*	.	H	α-helix	trans	-59.7	-40.8	177.3	-178.8	180	176.8	-170.1	-3	112.3	K268 H269 W270 L276	K268-R272 WeakPolarHBondContact O-CB 3.4Å; K268-R272 PolarHBondContact O-N 3.11Å; K268-R272 VanDerWaalsContact O-N 3.09Å; H269-R272 PolarHBondContact O-N 3.41Å; W270-R272 VanDerWaalsContact C-N 3.33Å; W270-R272 PolarHBondContact O-N 3.2Å; R272-L276 VanDerWaalsContact O-CB 3.27Å; R272-L276 WeakPolarHBondContact O-CB 3.29Å; R272-L276 PolarHBondContact O-N 2.97Å
273	Y	98.8	Very high	97.6	Very high	4 Å²	4	55.8 Å²	55.8	2%	0.016	28%	0.283	C	S	.	.	H	α-helix	trans	-64.4	-45.9	176.3	164.2	-98.8	0	0	0	112.1	H269 W270 K271 D275 L276 R277 F304 M319 L322 D323	H269-Y273 PolarHBondContact O-N 2.94Å; W270-Y273 HydrophobicContact CE3-CD1 4.08Å; W270-Y273 HydrophobicContact CZ3-CD1 4.09Å; W270-Y273 HydrophobicContact CZ3-CE1 4.17Å; W270-Y273 PolarHBondContact O-N 3.48Å; K271-Y273 VanDerWaalsContact C-N 3.31Å; K271-Y273 PolarHBondContact O-N 2.83Å; Y273-D275 VanDerWaalsContact C-N 3.33Å; Y273-D275 PolarHBondContact O-N 3.25Å; Y273-L276 WeakPolarHBondContact O-CB 3.5Å; Y273-L276 PolarHBondContact O-N 3.14Å; Y273-R277 HydrophobicContact CD2-CG 4.27Å; Y273-R277 HydrophobicContact CE2-CG 3.74Å; Y273-R277 PolarHBondContact O-N 3.23Å; Y273-F304 HydrophobicContact CD2-CE2 4.28Å; Y273-F304 HydrophobicContact CD2-CZ 4.16Å; Y273-F304 HydrophobicContact CE2-CE2 4.42Å; Y273-M319 WeakPolarHBondContact CB-SD 3.36Å; Y273-M319 HydrophobicContact CD1-CG 3.83Å; Y273-M319 HydrophobicContact CD1-SD 4.38Å; Y273-M319 HydrophobicContact CD2-CG 3.53Å; Y273-M319 HydrophobicContact CD2-SD 3.72Å; Y273-M319 HydrophobicContact CE1-CG 4.14Å; Y273-M319 HydrophobicContact CE2-CG 3.86Å; Y273-M319 HydrophobicContact CG-CE 4.25Å; Y273-M319 HydrophobicContact CG-CG 3.51Å; Y273-M319 HydrophobicContact CG-SD 3.6Å; Y273-M319 VanDerWaalsContact CG-SD 3.6Å; Y273-L322 HydrophobicContact CE1-CD2 4.17Å; Y273-D323 HydrophobicContact CE2-CB 4.21Å; Y273-D323 WeakPolarHBondContact OH-CA 3.33Å; Y273-D323 PolarHBondContact OH-N 3.17Å
274	L	98.8	Very high	97.4	Very high	4 Å²	4	57.3 Å²	57.3	2%	0.021	30%	0.301	C	S	.	.	H	α-helix	trans	-63.3	-40.9	178.4	-62.3	172.5	0	0	0	111.5	V235 L238 W270 K271 R277 G278 I279 S280	V235-L274 HydrophobicContact CG2-CD1 4.05Å; L238-L274 HydrophobicContact CD1-CD1 3.77Å; W270-L274 VanDerWaalsContact O-CG 3.29Å; W270-L274 WeakPolarHBondContact O-CG 3.27Å; W270-L274 PolarHBondContact O-N 3.32Å; K271-L274 PolarHBondContact O-N 3.42Å; L274-R277 CarbonylContact O-C 3.56Å; L274-R277 PolarHBondContact O-N 3.14Å; L274-G278 PolarHBondContact O-N 2.99Å; L274-I279 HydrophobicContact CB-CG1 4.37Å; L274-I279 HydrophobicContact CD2-CD1 3.78Å; L274-I279 HydrophobicContact CD2-CG1 3.74Å; L274-I279 PolarHBondContact O-N 3.04Å; L274-S280 VanDerWaalsContact C-OG 3.22Å; L274-S280 PolarHBondContact O-OG 3.3Å
275	D	98.4	Very high	97.3	Very high	106 Å²	106	58.8 Å²	58.8	57%	0.567	32%	0.315	S	S	*	.	H	α-helix	trans	-61.6	-45.4	174.1	-68.8	-28.3	0	0	0	110.9	K271 Y273 R277 G278 S280	K271-D275 WeakPolarHBondContact O-CB 3.22Å; K271-D275 VanDerWaalsContact O-CG 3.25Å; K271-D275 PolarHBondContact O-N 2.87Å; Y273-D275 VanDerWaalsContact C-N 3.33Å; Y273-D275 PolarHBondContact O-N 3.25Å; D275-R277 PolarHBondContact O-N 2.95Å; D275-G278 PolarHBondContact O-N 3.1Å; D275-G278 VanDerWaalsContact O-N 3.1Å; D275-S280 WeakPolarHBondContact CA-OG 3.4Å; D275-S280 PolarHBondContact N-OG 3.35Å; D275-S280 WeakPolarHBondContact OD1-CB 3.36Å; D275-S280 PolarHBondContact OD1-OG 3.21Å
276	L	98.2	Very high	97.4	Very high	85 Å²	85	58 Å²	58	45%	0.445	31%	0.308	S	S	.	.	H	α-helix	trans	-60.8	-33.9	178.2	179.2	67.3	0	0	0	112.4	R272 Y273 F304	R272-L276 VanDerWaalsContact O-CB 3.27Å; R272-L276 WeakPolarHBondContact O-CB 3.29Å; R272-L276 PolarHBondContact O-N 2.97Å; Y273-L276 WeakPolarHBondContact O-CB 3.5Å; Y273-L276 PolarHBondContact O-N 3.14Å; L276-F304 HydrophobicContact CD2-CE1 3.57Å; L276-F304 HydrophobicContact CD2-CZ 3.98Å
277	R	98.5	Very high	97.4	Very high	2 Å²	2	61.8 Å²	61.8	1%	0.008	33%	0.332	C	S	.	.	H	α-helix	trans	-90.7	-2.5	177.9	-71.9	-63.6	-179.9	-96.7	-1.7	113.7	Y273 L274 D275 I279 V286 T287 Y292 D323	Y273-R277 HydrophobicContact CD2-CG 4.27Å; Y273-R277 HydrophobicContact CE2-CG 3.74Å; Y273-R277 PolarHBondContact O-N 3.23Å; L274-R277 CarbonylContact O-C 3.56Å; L274-R277 PolarHBondContact O-N 3.14Å; D275-R277 PolarHBondContact O-N 2.95Å; R277-I279 VanDerWaalsContact C-N 3.28Å; R277-I279 HydrophobicContact CB-CD1 4.08Å; R277-I279 HydrophobicContact CB-CG1 3.84Å; R277-I279 PolarHBondContact O-N 2.79Å; R277-V286 HydrophobicContact CB-CG1 4.18Å; R277-V286 HydrophobicContact CG-CG1 4.38Å; R277-T287 WeakPolarHBondContact CD-O 3.45Å; R277-T287 PolarHBondContact O-N 2.81Å; R277-Y292 PolarHBondContact NH2-OH 3.35Å; R277-D323 IonicContact CZ-OD1 3.11Å; R277-D323 IonicContact NE-OD1 2.69Å; R277-D323 PolarHBondContact NE-OD1 2.5Å; R277-D323 IonicContact NH2-OD1 2.69Å; R277-D323 PolarHBondContact NH2-OD1 3.15Å; R277-D323 IonicContact NH2-OD2 3.41Å; R277-D323 PolarHBondContact NH2-OD2 3.49Å
278	G	98.3	Very high	97.4	Very high	37 Å²	37	64.8 Å²	64.8	38%	0.381	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.4	26.8	-179.4	0	0	0	0	0	113.9	L274 D275	L274-G278 PolarHBondContact O-N 2.99Å; D275-G278 PolarHBondContact O-N 3.1Å; D275-G278 VanDerWaalsContact O-N 3.1Å
279	I	98.1	Very high	97.3	Very high	0 Å²	0	61 Å²	61	0%	0	33%	0.33	C	S	.	.			trans	-121	26.5	-176.1	60.2	173.1	0	0	0	112.5	E231 L274 R277 D281 G282 K283 V286 L326	E231-I279 HydrophobicContact CB-CG2 4.23Å; E231-I279 HydrophobicContact CG-CG2 4.27Å; L274-I279 HydrophobicContact CB-CG1 4.37Å; L274-I279 HydrophobicContact CD2-CD1 3.78Å; L274-I279 HydrophobicContact CD2-CG1 3.74Å; L274-I279 PolarHBondContact O-N 3.04Å; R277-I279 VanDerWaalsContact C-N 3.28Å; R277-I279 HydrophobicContact CB-CD1 4.08Å; R277-I279 HydrophobicContact CB-CG1 3.84Å; R277-I279 PolarHBondContact O-N 2.79Å; I279-D281 PolarHBondContact O-N 3.02Å; I279-G282 PolarHBondContact O-N 3.03Å; I279-K283 WeakPolarHBondContact CG2-O 3.46Å; I279-V286 HydrophobicContact CG2-CG2 4.1Å; I279-L326 HydrophobicContact CD1-CD1 3.93Å
280	S	97.5	Very high	97.1	Very high	51 Å²	51	66.3 Å²	66.3	36%	0.357	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-17.2	-177.9	-54.4	0	0	0	0	114.4	L274 D275	L274-S280 VanDerWaalsContact C-OG 3.22Å; L274-S280 PolarHBondContact O-OG 3.3Å; D275-S280 WeakPolarHBondContact CA-OG 3.4Å; D275-S280 PolarHBondContact N-OG 3.35Å; D275-S280 WeakPolarHBondContact OD1-CB 3.36Å; D275-S280 PolarHBondContact OD1-OG 3.21Å
281	D	95.8	Very high	96.9	Very high	102 Å²	102	70.2 Å²	70.2	55%	0.545	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	6.1	172.3	70.5	-13.9	0	0	0	112.9	I279 K283	I279-D281 PolarHBondContact O-N 3.02Å; D281-K283 VanDerWaalsContact C-N 3.33Å; D281-K283 PolarHBondContact OD1-N 3.26Å; D281-K283 VanDerWaalsContact OD1-N 3.11Å
282	G	95.8	Very high	96.9	Very high	8 Å²	8	65.7 Å²	65.7	8%	0.082	37%	0.366	C	S	.	.	S	Bend	trans	77.7	15.4	178.2	0	0	0	0	0	114.1	E231 S232 I279	E231-G282 CarbonylContact C-O 3.59Å; E231-G282 WeakPolarHBondContact O-CA 3.4Å; S232-G282 PolarHBondContact N-O 2.91Å; I279-G282 PolarHBondContact O-N 3.03Å
283	K	95.1	Very high	96.9	Very high	140 Å²	140	59 Å²	59	61%	0.609	35%	0.349	S	S	*	.			trans	-123.3	147.6	-178.1	-61.2	177.3	-177.4	177.2	0	111	I279 D281	I279-K283 WeakPolarHBondContact CG2-O 3.46Å; D281-K283 VanDerWaalsContact C-N 3.33Å; D281-K283 PolarHBondContact OD1-N 3.26Å; D281-K283 VanDerWaalsContact OD1-N 3.11Å
284	G	91.4	Very high	96.9	Very high	41 Å²	41	60.3 Å²	60.3	42%	0.423	36%	0.357	S	S	.	.	S	Bend	trans	-83.3	178.7	172.8	0	0	0	0	0	113.4
285	P	95.3	Very high	96.9	Very high	116 Å²	116	61.9 Å²	61.9	75%	0.753	37%	0.371	S	S	*	.	P	Polyproline II helix	cis	-79.6	152	6.7	32	-35.7	0	0	0	113.5
286	V	97.5	Very high	96.9	Very high	24 Å²	24	59.7 Å²	59.7	15%	0.145	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-67.8	133	173.3	-176	0	0	0	0	110.3	E231 R277 I279 W288 L326	E231-V286 HydrophobicContact CG-CG2 4.13Å; R277-V286 HydrophobicContact CB-CG1 4.18Å; R277-V286 HydrophobicContact CG-CG1 4.38Å; I279-V286 HydrophobicContact CG2-CG2 4.1Å; V286-W288 HydrophobicContact CB-CZ2 4.34Å; V286-W288 HydrophobicContact CG1-CD2 4.18Å; V286-W288 HydrophobicContact CG1-CH2 4.27Å; V286-W288 HydrophobicContact CG1-CZ2 3.62Å; V286-L326 HydrophobicContact CG2-CB 4.3Å; V286-L326 HydrophobicContact CG2-CD1 4.31Å; V286-L326 HydrophobicContact CG2-CD2 3.84Å; V286-L326 HydrophobicContact CG2-CG 4.38Å
287	T	97.8	Very high	96.9	Very high	81 Å²	81	56.4 Å²	56.4	50%	0.497	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-87.7	117.7	173.7	-59.1	0	0	0	0	110.4	R277	R277-T287 WeakPolarHBondContact CD-O 3.45Å; R277-T287 PolarHBondContact O-N 2.81Å
288	W	97.6	Very high	96.9	Very high	81 Å²	81	57.4 Å²	57.4	31%	0.307	34%	0.344	S	S	.	.			trans	-105.6	142.3	175.7	-63.2	103.8	0	0	0	110.9	V286 Y292 D323 L326 G327	V286-W288 HydrophobicContact CB-CZ2 4.34Å; V286-W288 HydrophobicContact CG1-CD2 4.18Å; V286-W288 HydrophobicContact CG1-CH2 4.27Å; V286-W288 HydrophobicContact CG1-CZ2 3.62Å; W288-Y292 AromaticContact CE3-CD1 3.61Å; W288-Y292 HydrophobicContact CE3-CD1 3.61Å; W288-Y292 AromaticContact CE3-CE1 3.59Å; W288-Y292 HydrophobicContact CE3-CE1 3.59Å; W288-Y292 AromaticContact CZ3-CD1 3.99Å; W288-Y292 HydrophobicContact CZ3-CD1 3.99Å; W288-Y292 AromaticContact CZ3-CE1 3.55Å; W288-Y292 HydrophobicContact CZ3-CE1 3.55Å; W288-D323 WeakPolarHBondContact CH2-O 3.5Å; W288-D323 WeakPolarHBondContact CZ3-OD1 3.49Å; W288-L326 HydrophobicContact CH2-CB 4.27Å; W288-L326 HydrophobicContact CZ2-CB 4Å; W288-G327 VanDerWaalsContact CZ2-CA 3.49Å
289	P	96	Very high	96.9	Very high	58 Å²	58	62.7 Å²	62.7	38%	0.377	36%	0.357	S	S	.	.			trans	-58.9	153.6	162.7	-20.4	33.6	0	0	0	110.8	Y292	P289-Y292 HydrophobicContact CB-CD2 3.8Å; P289-Y292 HydrophobicContact CB-CE2 4.48Å; P289-Y292 HydrophobicContact CB-CG 4.43Å; P289-Y292 HydrophobicContact CG-CD2 3.58Å; P289-Y292 HydrophobicContact CG-CE2 3.81Å; P289-Y292 HydrophobicContact CG-CG 4.32Å; P289-Y292 WeakPolarHBondContact O-CB 3.42Å
290	D	93.8	Very high	96.9	Very high	161 Å²	161	63.4 Å²	63.4	86%	0.861	36%	0.363	S	S	*	.	S	Bend	trans	-132.4	112.1	169	-174.1	14.7	0	0	0	108.2
291	P	95.9	Very high	97	Very high	83 Å²	83	61 Å²	61	54%	0.539	35%	0.346	S	S	.	.	S	Bend	cis	-76.3	159.6	4.4	30.6	-34.6	0	0	0	114.7	E296	P291-E296 HydrophobicContact CB-CG 4.4Å; P291-E296 HydrophobicContact CG-CG 4.09Å
292	Y	97.9	Very high	97.1	Very high	26 Å²	26	59.7 Å²	59.7	10%	0.102	34%	0.342	C	S	.	.			trans	-136.3	48.5	171	-152.8	-124.2	0	0	0	113.3	R277 W288 P289 E296 R297 A300	R277-Y292 PolarHBondContact NH2-OH 3.35Å; W288-Y292 AromaticContact CE3-CD1 3.61Å; W288-Y292 HydrophobicContact CE3-CD1 3.61Å; W288-Y292 AromaticContact CE3-CE1 3.59Å; W288-Y292 HydrophobicContact CE3-CE1 3.59Å; W288-Y292 AromaticContact CZ3-CD1 3.99Å; W288-Y292 HydrophobicContact CZ3-CD1 3.99Å; W288-Y292 AromaticContact CZ3-CE1 3.55Å; W288-Y292 HydrophobicContact CZ3-CE1 3.55Å; P289-Y292 HydrophobicContact CB-CD2 3.8Å; P289-Y292 HydrophobicContact CB-CE2 4.48Å; P289-Y292 HydrophobicContact CB-CG 4.43Å; P289-Y292 HydrophobicContact CG-CD2 3.58Å; P289-Y292 HydrophobicContact CG-CE2 3.81Å; P289-Y292 HydrophobicContact CG-CG 4.32Å; P289-Y292 WeakPolarHBondContact O-CB 3.42Å; Y292-E296 HydrophobicContact CD2-CB 4.27Å; Y292-R297 HydrophobicContact CD1-CG 3.87Å; Y292-R297 HydrophobicContact CD2-CG 4.41Å; Y292-R297 HydrophobicContact CE1-CG 3.62Å; Y292-R297 HydrophobicContact CE2-CG 4.17Å; Y292-R297 HydrophobicContact CG-CG 4.25Å; Y292-R297 PolarHBondContact O-NH1 2.85Å; Y292-A300 HydrophobicContact CE2-CB 3.77Å; Y292-A300 VanDerWaalsContact OH-CB 3.3Å; Y292-A300 WeakPolarHBondContact OH-CB 3.09Å
293	G	98.2	Very high	97.2	Very high	28 Å²	28	62.1 Å²	62.1	29%	0.289	36%	0.358	S	S	.	.	S	Bend	trans	-76.9	-170.3	176.2	0	0	0	0	0	113.3	A295 E296 R297	G293-A295 PolarHBondContact O-N 3.21Å; G293-E296 VanDerWaalsContact CA-OE2 3.26Å; G293-E296 WeakPolarHBondContact CA-OE2 3.41Å; G293-E296 PolarHBondContact N-OE2 3.18Å; G293-E296 VanDerWaalsContact N-OE2 3.12Å; G293-E296 PolarHBondContact O-N 3.2Å; G293-R297 WeakPolarHBondContact O-CB 3.39Å; G293-R297 WeakPolarHBondContact O-CG 3.28Å; G293-R297 PolarHBondContact O-N 2.69Å
294	V	98.4	Very high	97.4	Very high	32 Å²	32	56.1 Å²	56.1	19%	0.194	33%	0.332	C	S	.	.	H	α-helix	trans	-58.3	-49	-175	-177.8	0	0	0	0	111.9	G73 P74 H77 E296 R297 D298	G73-V294 VanDerWaalsContact C-CG1 3.45Å; P74-V294 HydrophobicContact CG-CG1 4.11Å; H77-V294 VanDerWaalsContact CD2-CG1 3.44Å; H77-V294 WeakPolarHBondContact CD2-CG1 3.2Å; V294-E296 VanDerWaalsContact C-N 3.33Å; V294-E296 PolarHBondContact O-N 3.3Å; V294-R297 PolarHBondContact O-N 2.75Å; V294-D298 PolarHBondContact O-N 3.49Å
295	A	98.5	Very high	97.7	Very high	37 Å²	37	55 Å²	55	31%	0.306	32%	0.317	S	S	.	.	H	α-helix	trans	-68.5	-32.6	-179.1	0	0	0	0	0	112.6	P74 G293 K299	P74-A295 HydrophobicContact CG-CB 4.13Å; G293-A295 PolarHBondContact O-N 3.21Å; A295-K299 WeakPolarHBondContact O-CG 3.33Å; A295-K299 PolarHBondContact O-N 3.03Å
296	E	98.7	Very high	97.6	Very high	61 Å²	61	52.9 Å²	52.9	29%	0.285	30%	0.299	S	S	.	.	H	α-helix	trans	-71.2	-37.5	174.9	-66.9	67.1	-136.3	0	0	111.5	P291 Y292 G293 V294 K299 A300	P291-E296 HydrophobicContact CB-CG 4.4Å; P291-E296 HydrophobicContact CG-CG 4.09Å; Y292-E296 HydrophobicContact CD2-CB 4.27Å; G293-E296 VanDerWaalsContact CA-OE2 3.26Å; G293-E296 WeakPolarHBondContact CA-OE2 3.41Å; G293-E296 PolarHBondContact N-OE2 3.18Å; G293-E296 VanDerWaalsContact N-OE2 3.12Å; G293-E296 PolarHBondContact O-N 3.2Å; V294-E296 VanDerWaalsContact C-N 3.33Å; V294-E296 PolarHBondContact O-N 3.3Å; E296-K299 PolarHBondContact O-N 3.2Å; E296-A300 WeakPolarHBondContact O-CB 3.2Å; E296-A300 PolarHBondContact O-N 2.95Å
297	R	98.8	Very high	97.4	Very high	15 Å²	15	56.6 Å²	56.6	6%	0.057	33%	0.326	C	S	.	.	H	α-helix	trans	-65.2	-44.3	174.4	-73.9	-166.1	-54.5	-93.7	11.5	112.1	Y292 G293 V294 K299 A300 Y301 N337	Y292-R297 HydrophobicContact CD1-CG 3.87Å; Y292-R297 HydrophobicContact CD2-CG 4.41Å; Y292-R297 HydrophobicContact CE1-CG 3.62Å; Y292-R297 HydrophobicContact CE2-CG 4.17Å; Y292-R297 HydrophobicContact CG-CG 4.25Å; Y292-R297 PolarHBondContact O-NH1 2.85Å; G293-R297 WeakPolarHBondContact O-CB 3.39Å; G293-R297 WeakPolarHBondContact O-CG 3.28Å; G293-R297 PolarHBondContact O-N 2.69Å; V294-R297 PolarHBondContact O-N 2.75Å; R297-K299 VanDerWaalsContact C-N 3.31Å; R297-K299 PolarHBondContact O-N 3.09Å; R297-A300 CarbonylContact O-C 3.58Å; R297-A300 WeakPolarHBondContact O-CB 3.2Å; R297-A300 PolarHBondContact O-N 3.41Å; R297-Y301 HydrophobicContact CB-CD2 4.5Å; R297-Y301 HydrophobicContact CB-CE1 4.48Å; R297-Y301 HydrophobicContact CB-CE2 3.98Å; R297-Y301 WeakPolarHBondContact CD-OH 3.31Å; R297-Y301 WeakPolarHBondContact O-CB 3.33Å; R297-Y301 WeakPolarHBondContact O-CD1 3.4Å; R297-Y301 PolarHBondContact O-N 3.15Å; R297-N337 PolarHBondContact NH2-O 3.11Å
298	D	98.7	Very high	97.3	Very high	23 Å²	23	54.7 Å²	54.7	12%	0.123	32%	0.323	C	S	.	.	H	α-helix	trans	-54.6	-47.9	173.5	-83.2	-1.2	0	0	0	111.4	G73 P74 V294 A300 Y301 T302 G343	G73-D298 VanDerWaalsContact CA-OD2 3.29Å; G73-D298 WeakPolarHBondContact CA-OD2 3.35Å; G73-D298 PolarHBondContact N-OD2 2.82Å; P74-D298 WeakPolarHBondContact CD-OD2 3.46Å; V294-D298 PolarHBondContact O-N 3.49Å; D298-A300 VanDerWaalsContact C-N 3.33Å; D298-A300 PolarHBondContact O-N 2.93Å; D298-Y301 PolarHBondContact O-N 3.46Å; D298-T302 WeakPolarHBondContact O-CB 3.03Å; D298-T302 PolarHBondContact O-N 3.36Å; D298-T302 PolarHBondContact O-OG1 2.85Å; D298-G343 PolarHBondContact OD1-N 3.45Å
299	K	98.5	Very high	97.4	Very high	148 Å²	148	53.7 Å²	53.7	64%	0.643	32%	0.319	S	S	*	.	H	α-helix	trans	-60.3	-41.9	176.4	-69.8	170.8	-174	167.6	0	112.1	A295 E296 R297 S303	A295-K299 WeakPolarHBondContact O-CG 3.33Å; A295-K299 PolarHBondContact O-N 3.03Å; E296-K299 PolarHBondContact O-N 3.2Å; R297-K299 VanDerWaalsContact C-N 3.31Å; R297-K299 PolarHBondContact O-N 3.09Å; K299-S303 PolarHBondContact O-N 3.41Å; K299-S303 VanDerWaalsContact O-N 3.07Å
300	A	98.5	Very high	97.5	Very high	15 Å²	15	51 Å²	51	12%	0.124	30%	0.302	C	S	.	.	H	α-helix	trans	-65	-45.6	177.7	0	0	0	0	0	111.6	Y292 E296 R297 D298 S303 F304	Y292-A300 HydrophobicContact CE2-CB 3.77Å; Y292-A300 VanDerWaalsContact OH-CB 3.3Å; Y292-A300 WeakPolarHBondContact OH-CB 3.09Å; E296-A300 WeakPolarHBondContact O-CB 3.2Å; E296-A300 PolarHBondContact O-N 2.95Å; R297-A300 CarbonylContact O-C 3.58Å; R297-A300 WeakPolarHBondContact O-CB 3.2Å; R297-A300 PolarHBondContact O-N 3.41Å; D298-A300 VanDerWaalsContact C-N 3.33Å; D298-A300 PolarHBondContact O-N 2.93Å; A300-S303 CarbonylContact O-C 3.28Å; A300-S303 WeakPolarHBondContact O-CA 3.11Å; A300-S303 WeakPolarHBondContact O-CB 3.25Å; A300-S303 PolarHBondContact O-N 3.11Å; A300-S303 PolarHBondContact O-OG 2.79Å; A300-F304 HydrophobicContact CB-CZ 4.28Å; A300-F304 VanDerWaalsContact O-CD1 3.29Å; A300-F304 WeakPolarHBondContact O-CD1 3.41Å; A300-F304 WeakPolarHBondContact O-CG 3.32Å; A300-F304 PolarHBondContact O-N 3.15Å; A300-F304 VanDerWaalsContact O-N 3.07Å
301	Y	98.7	Very high	97.7	Very high	1 Å²	1	43.3 Å²	43.3	0%	0.004	26%	0.261	C	S	.	.	H	α-helix	trans	-66.2	-40.1	-179.6	-60.8	-13.6	0	0	0	111.5	R297 D298 S303 F304 S305 G310 I320 R338 H342	R297-Y301 HydrophobicContact CB-CD2 4.5Å; R297-Y301 HydrophobicContact CB-CE1 4.48Å; R297-Y301 HydrophobicContact CB-CE2 3.98Å; R297-Y301 WeakPolarHBondContact CD-OH 3.31Å; R297-Y301 WeakPolarHBondContact O-CB 3.33Å; R297-Y301 WeakPolarHBondContact O-CD1 3.4Å; R297-Y301 PolarHBondContact O-N 3.15Å; D298-Y301 PolarHBondContact O-N 3.46Å; Y301-S303 PolarHBondContact O-N 3.42Å; Y301-F304 HydrophobicContact CD1-CD2 4.01Å; Y301-F304 AromaticContact CD1-CE2 3.91Å; Y301-F304 HydrophobicContact CD1-CE2 3.91Å; Y301-F304 HydrophobicContact CE1-CE2 4.29Å; Y301-F304 PolarHBondContact O-N 3.34Å; Y301-F304 VanDerWaalsContact O-N 3.09Å; Y301-S305 PolarHBondContact O-N 2.7Å; Y301-G310 WeakPolarHBondContact O-CA 3.23Å; Y301-I320 HydrophobicContact CD1-CD1 4.12Å; Y301-I320 HydrophobicContact CD1-CG1 3.81Å; Y301-I320 HydrophobicContact CD1-CG2 4.27Å; Y301-I320 HydrophobicContact CD2-CD1 4.36Å; Y301-I320 HydrophobicContact CD2-CG2 4.14Å; Y301-I320 HydrophobicContact CE1-CG1 4.23Å; Y301-I320 HydrophobicContact CE1-CG2 4.02Å; Y301-I320 HydrophobicContact CE2-CG2 3.88Å; Y301-I320 HydrophobicContact CG-CD1 3.84Å; Y301-I320 HydrophobicContact CG-CG1 4.05Å; Y301-I320 HydrophobicContact CG-CG2 4.33Å; Y301-R338 WeakPolarHBondContact CE2-O 3.35Å; Y301-R338 PolarHBondContact OH-O 3.44Å; Y301-H342 HydrophobicContact CD2-CB 4.01Å; Y301-H342 AromaticContact CD2-CD2 3.83Å; Y301-H342 AromaticContact CD2-CG 3.88Å; Y301-H342 HydrophobicContact CE2-CB 4.03Å; Y301-H342 AromaticContact CE2-CD2 3.63Å; Y301-H342 AromaticContact CE2-CG 4Å
302	T	98.4	Very high	97.9	Very high	74 Å²	74	40.3 Å²	40.3	45%	0.454	24%	0.242	S	C	.	.	H	α-helix	trans	-57.4	-38.8	168	-64.9	0	0	0	0	111.6	D298 F304 S305 G308	D298-T302 WeakPolarHBondContact O-CB 3.03Å; D298-T302 PolarHBondContact O-N 3.36Å; D298-T302 PolarHBondContact O-OG1 2.85Å; T302-F304 VanDerWaalsContact C-N 3.28Å; T302-F304 PolarHBondContact O-N 3.35Å; T302-S305 WeakPolarHBondContact O-CB 3.06Å; T302-S305 PolarHBondContact O-N 2.85Å; T302-S305 PolarHBondContact O-OG 3.04Å; T302-G308 PolarHBondContact OG1-O 3.14Å
303	S	98	Very high	97.9	Very high	60 Å²	60	39.5 Å²	39.5	42%	0.42	24%	0.24	S	C	.	.	H	α-helix	trans	-70.7	-20.1	177.8	85.9	0	0	0	0	114.5	K299 A300 Y301	K299-S303 PolarHBondContact O-N 3.41Å; K299-S303 VanDerWaalsContact O-N 3.07Å; A300-S303 CarbonylContact O-C 3.28Å; A300-S303 WeakPolarHBondContact O-CA 3.11Å; A300-S303 WeakPolarHBondContact O-CB 3.25Å; A300-S303 PolarHBondContact O-N 3.11Å; A300-S303 PolarHBondContact O-OG 2.79Å; Y301-S303 PolarHBondContact O-N 3.42Å
304	F	97.9	Very high	97.9	Very high	14 Å²	14	38.2 Å²	38.2	6%	0.061	23%	0.226	C	C	.	.	H	α-helix	trans	-83.7	-24.4	174.4	-57.1	-17.5	0	0	0	111.9	Y273 L276 A300 Y301 T302 H315 D316 M319 I320	Y273-F304 HydrophobicContact CD2-CE2 4.28Å; Y273-F304 HydrophobicContact CD2-CZ 4.16Å; Y273-F304 HydrophobicContact CE2-CE2 4.42Å; L276-F304 HydrophobicContact CD2-CE1 3.57Å; L276-F304 HydrophobicContact CD2-CZ 3.98Å; A300-F304 HydrophobicContact CB-CZ 4.28Å; A300-F304 VanDerWaalsContact O-CD1 3.29Å; A300-F304 WeakPolarHBondContact O-CD1 3.41Å; A300-F304 WeakPolarHBondContact O-CG 3.32Å; A300-F304 PolarHBondContact O-N 3.15Å; A300-F304 VanDerWaalsContact O-N 3.07Å; Y301-F304 HydrophobicContact CD1-CD2 4.01Å; Y301-F304 AromaticContact CD1-CE2 3.91Å; Y301-F304 HydrophobicContact CD1-CE2 3.91Å; Y301-F304 HydrophobicContact CE1-CE2 4.29Å; Y301-F304 PolarHBondContact O-N 3.34Å; Y301-F304 VanDerWaalsContact O-N 3.09Å; T302-F304 VanDerWaalsContact C-N 3.28Å; T302-F304 PolarHBondContact O-N 3.35Å; F304-H315 PolarHBondContact O-NE2 2.88Å; F304-D316 HydrophobicContact CB-CB 4.28Å; F304-M319 HydrophobicContact CB-SD 4.13Å; F304-M319 HydrophobicContact CD2-SD 4.22Å; F304-M319 HydrophobicContact CG-SD 4.09Å; F304-I320 HydrophobicContact CD2-CG1 4.06Å
305	S	97.7	Very high	97.9	Very high	17 Å²	17	36.7 Å²	36.7	12%	0.119	22%	0.217	C	C	.	.	S	Bend	trans	-69.1	156.1	-176.1	79.5	0	0	0	0	114.4	Y301 T302 G308 W309 D316	Y301-S305 PolarHBondContact O-N 2.7Å; T302-S305 WeakPolarHBondContact O-CB 3.06Å; T302-S305 PolarHBondContact O-N 2.85Å; T302-S305 PolarHBondContact O-OG 3.04Å; S305-G308 WeakPolarHBondContact OG-CA 3.49Å; S305-G308 PolarHBondContact OG-N 2.87Å; S305-W309 WeakPolarHBondContact CB-O 3.43Å; S305-D316 WeakPolarHBondContact CA-OD2 3.43Å
306	L	94.4	Very high	98	Very high	72 Å²	72	34.9 Å²	34.9	38%	0.377	20%	0.202	S	C	.	.	S	Bend	trans	-76.9	-34	170.4	-75.9	171	0	0	0	112.8	A169 I209 C313 H315	A169-L306 HydrophobicContact CB-CD1 4.11Å; I209-L306 HydrophobicContact CD1-CD1 3.65Å; I209-L306 HydrophobicContact CD1-CD2 4.25Å; I209-L306 HydrophobicContact CG2-CD1 4.12Å; L306-C313 HydrophobicContact CD1-CB 4.11Å; L306-H315 VanDerWaalsContact CG-CE1 3.44Å; L306-H315 WeakPolarHBondContact CG-CE1 3.47Å
307	S	93.5	Very high	98	Very high	101 Å²	101	32 Å²	32	71%	0.706	19%	0.189	S	C	*	.	S	Bend	trans	-142.5	29.5	-168.5	61.2	0	0	0	0	114.4
308	G	96.3	Very high	98	Very high	42 Å²	42	31.3 Å²	31.3	43%	0.433	19%	0.186	S	C	.	.	S	Bend	trans	100	-20.1	168	0	0	0	0	0	115.9	T302 S305	T302-G308 PolarHBondContact OG1-O 3.14Å; S305-G308 WeakPolarHBondContact OG-CA 3.49Å; S305-G308 PolarHBondContact OG-N 2.87Å
309	W	98.1	Very high	98	Very high	60 Å²	60	30.3 Å²	30.3	23%	0.227	18%	0.181	C	C	.	.	S	Bend	trans	-105.1	103.3	178.4	-162.6	37	0	0	0	109.6	E68 F69 Y71 S305 S312 G343 G344 D345	E68-W309 HydrophobicContact CG-CH2 4.26Å; E68-W309 HydrophobicContact CG-CZ2 4.1Å; F69-W309 HydrophobicContact CE1-CH2 4.4Å; Y71-W309 AromaticContact CD1-CD1 3.8Å; Y71-W309 AromaticContact CD1-NE1 3.64Å; Y71-W309 AromaticContact CE1-CD1 3.94Å; Y71-W309 HydrophobicContact CE1-CD2 4.48Å; Y71-W309 AromaticContact CE1-CE2 3.96Å; Y71-W309 HydrophobicContact CE1-CG 4.49Å; Y71-W309 HydrophobicContact CE1-CZ2 4.49Å; Y71-W309 AromaticContact CE1-NE1 3.59Å; S305-W309 WeakPolarHBondContact CB-O 3.43Å; W309-S312 PolarHBondContact O-N 2.97Å; W309-S312 PolarHBondContact O-OG 3.27Å; W309-G343 PolarHBondContact NE1-O 2.9Å; W309-G344 PolarHBondContact NE1-O 3.39Å; W309-D345 HydrophobicContact CD2-CB 4.03Å; W309-D345 HydrophobicContact CE3-CB 4.14Å; W309-D345 HydrophobicContact CH2-CB 3.81Å; W309-D345 HydrophobicContact CZ2-CB 3.73Å; W309-D345 HydrophobicContact CZ3-CB 4.02Å
310	G	98.6	Very high	98	Very high	1 Å²	1	23.3 Å²	23.3	1%	0.01	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	129.9	-174.5	0	0	0	0	0	112.3	Y301 G344 D345	Y301-G310 WeakPolarHBondContact O-CA 3.23Å; G310-G344 CarbonylContact O-C 3.59Å; G310-G344 WeakPolarHBondContact O-CA 3.32Å; G310-D345 PolarHBondContact O-N 3.46Å
311	G	98.7	Very high	98	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.9	-5.5	179.5	0	0	0	0	0	113.9	C171 C313 D316 A317	C171-G311 WeakPolarHBondContact CB-O 3.42Å; G311-C313 VanDerWaalsContact C-N 3.28Å; G311-C313 PolarHBondContact O-N 3.07Å; G311-D316 VanDerWaalsContact N-CG 3.27Å; G311-D316 PolarHBondContact N-OD2 2.86Å; G311-A317 WeakPolarHBondContact O-CB 3.29Å
312	S	98.5	Very high	98	Very high	20 Å²	20	22.6 Å²	22.6	14%	0.14	14%	0.144	C	C	.	.			trans	-85.1	1.4	-172.5	89	0	0	0	0	114.6	G170 C171 W309 D345	G170-S312 WeakPolarHBondContact CA-O 3.41Å; C171-S312 PolarHBondContact N-O 2.98Å; W309-S312 PolarHBondContact O-N 2.97Å; W309-S312 PolarHBondContact O-OG 3.27Å; S312-D345 VanDerWaalsContact CA-OD2 3.25Å; S312-D345 WeakPolarHBondContact CA-OD2 3.44Å
313	C	98.8	Very high	98.1	Very high	9 Å²	9	19 Å²	19	6%	0.061	12%	0.123	C	C	.	.	B	Isolated β-bridge	trans	-125.2	161.8	-178.6	-63.6	0	0	0	0	111.4	A169 I209 L306 G311 H315 D316 A317	A169-C313 CarbonylContact O-C 3.48Å; A169-C313 WeakPolarHBondContact O-CA 3.42Å; A169-C313 WeakPolarHBondContact O-CB 3.38Å; I209-C313 HydrophobicContact CG2-CB 4.38Å; L306-C313 HydrophobicContact CD1-CB 4.11Å; G311-C313 VanDerWaalsContact C-N 3.28Å; G311-C313 PolarHBondContact O-N 3.07Å; C313-H315 VanDerWaalsContact CB-CE1 3.47Å; C313-H315 WeakPolarHBondContact CB-CE1 3.48Å; C313-H315 WeakPolarHBondContact CB-ND1 3.38Å; C313-H315 PolarHBondContact O-N 3.42Å; C313-D316 VanDerWaalsContact C-OD1 3.27Å; C313-D316 VanDerWaalsContact CA-OD1 3.23Å; C313-D316 WeakPolarHBondContact CA-OD1 3.48Å; C313-D316 VanDerWaalsContact CB-OD1 3.24Å; C313-D316 WeakPolarHBondContact CB-OD1 3.45Å; C313-D316 PolarHBondContact N-OD1 2.9Å; C313-D316 PolarHBondContact O-N 3.03Å; C313-A317 WeakPolarHBondContact O-CB 3.46Å; C313-A317 PolarHBondContact O-N 3.07Å; C313-A317 VanDerWaalsContact O-N 3.08Å
314	G	98.8	Very high	98.1	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-22	-177.1	0	0	0	0	0	113.9	A169 I209 G213 P318	A169-G314 PolarHBondContact O-N 3.21Å; I209-G314 CarbonylContact O-C 3.44Å; I209-G314 VanDerWaalsContact O-CA 3.22Å; I209-G314 WeakPolarHBondContact O-CA 3.49Å; G213-G314 WeakPolarHBondContact CA-O 3.34Å; G314-P318 VanDerWaalsContact O-CD 3.29Å; G314-P318 WeakPolarHBondContact O-CD 3.22Å; G314-P318 VanDerWaalsContact O-CG 3.23Å; G314-P318 WeakPolarHBondContact O-CG 3.46Å
315	H	98.8	Very high	98.2	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-37.6	176.1	70.7	-61.8	0	0	0	113	I209 F266 H269 W270 F304 L306 C313 M319	I209-H315 HydrophobicContact CG2-CB 4.05Å; F266-H315 HydrophobicContact CD2-CB 3.63Å; F266-H315 HydrophobicContact CE2-CB 3.87Å; H269-H315 AromaticContact CD2-CD2 3.79Å; H269-H315 AromaticContact CD2-NE2 3.89Å; H269-H315 AromaticContact CG-CD2 3.67Å; W270-H315 PolarHBondContact NE1-O 3.39Å; F304-H315 PolarHBondContact O-NE2 2.88Å; L306-H315 VanDerWaalsContact CG-CE1 3.44Å; L306-H315 WeakPolarHBondContact CG-CE1 3.47Å; C313-H315 VanDerWaalsContact CB-CE1 3.47Å; C313-H315 WeakPolarHBondContact CB-CE1 3.48Å; C313-H315 WeakPolarHBondContact CB-ND1 3.38Å; C313-H315 PolarHBondContact O-N 3.42Å; H315-M319 WeakPolarHBondContact O-CB 3.48Å
316	D	98.9	Very high	98.2	Very high	0 Å²	0	16 Å²	16	0%	0	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-26.9	-170.6	61.1	-14.9	0	0	0	114.3	F304 S305 G311 C313 M319 I320	F304-D316 HydrophobicContact CB-CB 4.28Å; S305-D316 WeakPolarHBondContact CA-OD2 3.43Å; G311-D316 VanDerWaalsContact N-CG 3.27Å; G311-D316 PolarHBondContact N-OD2 2.86Å; C313-D316 VanDerWaalsContact C-OD1 3.27Å; C313-D316 VanDerWaalsContact CA-OD1 3.23Å; C313-D316 WeakPolarHBondContact CA-OD1 3.48Å; C313-D316 VanDerWaalsContact CB-OD1 3.24Å; C313-D316 WeakPolarHBondContact CB-OD1 3.45Å; C313-D316 PolarHBondContact N-OD1 2.9Å; C313-D316 PolarHBondContact O-N 3.03Å; D316-M319 WeakPolarHBondContact O-CB 3.17Å; D316-M319 PolarHBondContact O-N 3.49Å; D316-I320 WeakPolarHBondContact O-CG1 3.45Å; D316-I320 PolarHBondContact O-N 2.85Å
317	A	98.9	Very high	98.4	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-56.8	-56.8	174	0	0	0	0	0	112.5	C171 G311 C313 M319 I320 A321 I352	C171-A317 HydrophobicContact CB-CB 3.76Å; G311-A317 WeakPolarHBondContact O-CB 3.29Å; C313-A317 WeakPolarHBondContact O-CB 3.46Å; C313-A317 PolarHBondContact O-N 3.07Å; C313-A317 VanDerWaalsContact O-N 3.08Å; A317-M319 VanDerWaalsContact C-N 3.25Å; A317-M319 PolarHBondContact O-N 3.49Å; A317-I320 PolarHBondContact O-N 3.33Å; A317-A321 WeakPolarHBondContact O-CB 3.44Å; A317-A321 PolarHBondContact O-N 3.08Å; A317-I352 HydrophobicContact CB-CD1 3.87Å
318	P	98.9	Very high	98.6	Very high	0 Å²	0	9.2 Å²	9.2	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-67.3	-23	174.6	25.3	-33.9	0	0	0	113.5	A216 F220 W270 G314 L322 I352	A216-P318 HydrophobicContact CB-CB 3.84Å; A216-P318 HydrophobicContact CB-CG 3.79Å; F220-P318 HydrophobicContact CD2-CB 4.47Å; F220-P318 HydrophobicContact CE2-CB 4.2Å; W270-P318 HydrophobicContact CZ2-CB 4.3Å; W270-P318 HydrophobicContact CZ2-CG 4.14Å; G314-P318 VanDerWaalsContact O-CD 3.29Å; G314-P318 WeakPolarHBondContact O-CD 3.22Å; G314-P318 VanDerWaalsContact O-CG 3.23Å; G314-P318 WeakPolarHBondContact O-CG 3.46Å; P318-L322 WeakPolarHBondContact O-CB 3.38Å; P318-L322 PolarHBondContact O-N 3.28Å; P318-I352 HydrophobicContact CB-CD1 4.44Å
319	M	98.9	Very high	98.6	Very high	3 Å²	3	8.5 Å²	8.5	2%	0.015	6%	0.056	C	C	.	.	H	α-helix	trans	-71.5	-47.1	177.2	-175.3	-174.8	-64.9	0	0	111.7	H269 W270 Y273 F304 H315 D316 A317 A321 L322 D323	H269-M319 HydrophobicContact CB-CE 4.32Å; W270-M319 HydrophobicContact CD2-CE 3.95Å; W270-M319 HydrophobicContact CE3-CE 4.42Å; W270-M319 HydrophobicContact CG-CE 4.07Å; W270-M319 HydrophobicContact CH2-CB 3.88Å; W270-M319 HydrophobicContact CH2-CG 4.35Å; W270-M319 HydrophobicContact CZ2-CB 3.84Å; W270-M319 HydrophobicContact CZ3-CB 4.47Å; W270-M319 HydrophobicContact CZ3-CG 4.46Å; Y273-M319 WeakPolarHBondContact CB-SD 3.36Å; Y273-M319 HydrophobicContact CD1-CG 3.83Å; Y273-M319 HydrophobicContact CD1-SD 4.38Å; Y273-M319 HydrophobicContact CD2-CG 3.53Å; Y273-M319 HydrophobicContact CD2-SD 3.72Å; Y273-M319 HydrophobicContact CE1-CG 4.14Å; Y273-M319 HydrophobicContact CE2-CG 3.86Å; Y273-M319 HydrophobicContact CG-CE 4.25Å; Y273-M319 HydrophobicContact CG-CG 3.51Å; Y273-M319 HydrophobicContact CG-SD 3.6Å; Y273-M319 VanDerWaalsContact CG-SD 3.6Å; F304-M319 HydrophobicContact CB-SD 4.13Å; F304-M319 HydrophobicContact CD2-SD 4.22Å; F304-M319 HydrophobicContact CG-SD 4.09Å; H315-M319 WeakPolarHBondContact O-CB 3.48Å; D316-M319 WeakPolarHBondContact O-CB 3.17Å; D316-M319 PolarHBondContact O-N 3.49Å; A317-M319 VanDerWaalsContact C-N 3.25Å; A317-M319 PolarHBondContact O-N 3.49Å; M319-A321 VanDerWaalsContact C-N 3.29Å; M319-L322 PolarHBondContact O-N 3.22Å; M319-D323 WeakPolarHBondContact O-CB 3.49Å; M319-D323 PolarHBondContact O-N 3.44Å
320	I	98.9	Very high	98.5	Very high	0 Å²	0	9.8 Å²	9.8	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-65.6	-37.2	174.9	-66.9	167.5	0	0	0	109.9	Y301 F304 D316 A317 L322 D323 A324 T349	Y301-I320 HydrophobicContact CD1-CD1 4.12Å; Y301-I320 HydrophobicContact CD1-CG1 3.81Å; Y301-I320 HydrophobicContact CD1-CG2 4.27Å; Y301-I320 HydrophobicContact CD2-CD1 4.36Å; Y301-I320 HydrophobicContact CD2-CG2 4.14Å; Y301-I320 HydrophobicContact CE1-CG1 4.23Å; Y301-I320 HydrophobicContact CE1-CG2 4.02Å; Y301-I320 HydrophobicContact CE2-CG2 3.88Å; Y301-I320 HydrophobicContact CG-CD1 3.84Å; Y301-I320 HydrophobicContact CG-CG1 4.05Å; Y301-I320 HydrophobicContact CG-CG2 4.33Å; F304-I320 HydrophobicContact CD2-CG1 4.06Å; D316-I320 WeakPolarHBondContact O-CG1 3.45Å; D316-I320 PolarHBondContact O-N 2.85Å; A317-I320 PolarHBondContact O-N 3.33Å; I320-L322 PolarHBondContact O-N 3.18Å; I320-D323 WeakPolarHBondContact O-CB 3.31Å; I320-D323 PolarHBondContact O-N 2.97Å; I320-A324 WeakPolarHBondContact O-CB 3.29Å; I320-A324 PolarHBondContact O-N 3.44Å; I320-T349 HydrophobicContact CB-CG2 3.7Å; I320-T349 HydrophobicContact CD1-CG2 4.09Å; I320-T349 HydrophobicContact CG2-CG2 3.68Å
321	A	98.9	Very high	98.5	Very high	1 Å²	1	13.7 Å²	13.7	1%	0.008	10%	0.095	C	C	.	.	H	α-helix	trans	-60.2	-44.6	172.8	0	0	0	0	0	112.5	A317 M319 A324 L325 I352 A353	A317-A321 WeakPolarHBondContact O-CB 3.44Å; A317-A321 PolarHBondContact O-N 3.08Å; M319-A321 VanDerWaalsContact C-N 3.29Å; A321-A324 PolarHBondContact O-N 3.02Å; A321-L325 VanDerWaalsContact O-CG 3.3Å; A321-L325 WeakPolarHBondContact O-CG 3.27Å; A321-L325 PolarHBondContact O-N 3.36Å; A321-I352 HydrophobicContact CB-CB 3.86Å; A321-I352 HydrophobicContact CB-CG2 3.71Å; A321-A353 HydrophobicContact CB-CB 3.79Å
322	L	98.9	Very high	98.5	Very high	0 Å²	0	14 Å²	14	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-64.8	-41.6	174.4	179.6	60.7	0	0	0	111.9	F220 L230 W233 W270 Y273 P318 M319 I320 A324 L325 L326	F220-L322 HydrophobicContact CE2-CB 3.98Å; F220-L322 HydrophobicContact CE2-CD2 4.17Å; F220-L322 HydrophobicContact CZ-CD2 4.04Å; L230-L322 HydrophobicContact CD2-CD1 4.5Å; W233-L322 HydrophobicContact CB-CD1 4.23Å; W233-L322 HydrophobicContact CB-CD2 4.36Å; W233-L322 HydrophobicContact CD2-CD1 4.33Å; W233-L322 HydrophobicContact CE3-CD1 3.86Å; W270-L322 HydrophobicContact CH2-CD2 4.3Å; W270-L322 HydrophobicContact CZ3-CD2 3.91Å; Y273-L322 HydrophobicContact CE1-CD2 4.17Å; P318-L322 WeakPolarHBondContact O-CB 3.38Å; P318-L322 PolarHBondContact O-N 3.28Å; M319-L322 PolarHBondContact O-N 3.22Å; I320-L322 PolarHBondContact O-N 3.18Å; L322-A324 VanDerWaalsContact C-N 3.29Å; L322-A324 PolarHBondContact O-N 2.93Å; L322-L325 PolarHBondContact O-N 3.45Å; L322-L326 HydrophobicContact CD1-CD1 4.28Å; L322-L326 HydrophobicContact CD1-CG 4.18Å; L322-L326 HydrophobicContact CG-CD1 3.98Å; L322-L326 HydrophobicContact CG-CG 4.37Å; L322-L326 WeakPolarHBondContact O-CB 3.45Å; L322-L326 VanDerWaalsContact O-CG 3.31Å; L322-L326 WeakPolarHBondContact O-CG 3.45Å; L322-L326 PolarHBondContact O-N 3.26Å
323	D	98.9	Very high	98.5	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-58	-43.3	175.7	-166	73.5	0	0	0	111.6	Y273 R277 W288 M319 I320 G327	Y273-D323 HydrophobicContact CE2-CB 4.21Å; Y273-D323 WeakPolarHBondContact OH-CA 3.33Å; Y273-D323 PolarHBondContact OH-N 3.17Å; R277-D323 IonicContact CZ-OD1 3.11Å; R277-D323 IonicContact NE-OD1 2.69Å; R277-D323 PolarHBondContact NE-OD1 2.5Å; R277-D323 IonicContact NH2-OD1 2.69Å; R277-D323 PolarHBondContact NH2-OD1 3.15Å; R277-D323 IonicContact NH2-OD2 3.41Å; R277-D323 PolarHBondContact NH2-OD2 3.49Å; W288-D323 WeakPolarHBondContact CH2-O 3.5Å; W288-D323 WeakPolarHBondContact CZ3-OD1 3.49Å; M319-D323 WeakPolarHBondContact O-CB 3.49Å; M319-D323 PolarHBondContact O-N 3.44Å; I320-D323 WeakPolarHBondContact O-CB 3.31Å; I320-D323 PolarHBondContact O-N 2.97Å; D323-G327 PolarHBondContact O-N 3.32Å
324	A	98.9	Very high	98.5	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-64.5	-44.4	175.6	0	0	0	0	0	112.3	I320 A321 L322 G327 A328 L335 R338 A339	I320-A324 WeakPolarHBondContact O-CB 3.29Å; I320-A324 PolarHBondContact O-N 3.44Å; A321-A324 PolarHBondContact O-N 3.02Å; L322-A324 VanDerWaalsContact C-N 3.29Å; L322-A324 PolarHBondContact O-N 2.93Å; A324-G327 PolarHBondContact O-N 3.23Å; A324-A328 WeakPolarHBondContact O-CB 3.23Å; A324-A328 PolarHBondContact O-N 2.87Å; A324-L335 HydrophobicContact CB-CD1 4.14Å; A324-R338 HydrophobicContact CB-CB 3.61Å; A324-A339 HydrophobicContact CB-CB 3.63Å
325	L	98.9	Very high	98.5	Very high	2 Å²	2	17.7 Å²	17.7	1%	0.01	11%	0.11	C	C	.	.	H	α-helix	trans	-59.7	-46.6	176.7	-71.5	165.1	0	0	0	112	L230 W233 A321 L322 G327 A328 G329 L335 C356 W357	L230-L325 HydrophobicContact CD1-CB 4.24Å; L230-L325 HydrophobicContact CD2-CB 4.15Å; L230-L325 HydrophobicContact CD2-CD1 4.42Å; W233-L325 HydrophobicContact CH2-CD1 4.36Å; W233-L325 HydrophobicContact CZ3-CD1 3.77Å; A321-L325 VanDerWaalsContact O-CG 3.3Å; A321-L325 WeakPolarHBondContact O-CG 3.27Å; A321-L325 PolarHBondContact O-N 3.36Å; L322-L325 PolarHBondContact O-N 3.45Å; L325-G327 VanDerWaalsContact C-N 3.3Å; L325-G327 PolarHBondContact O-N 3.22Å; L325-A328 PolarHBondContact O-N 3.2Å; L325-G329 PolarHBondContact O-N 3.3Å; L325-G329 VanDerWaalsContact O-N 3.15Å; L325-L335 HydrophobicContact CD2-CD1 3.98Å; L325-L335 HydrophobicContact CG-CD1 4.34Å; L325-C356 HydrophobicContact CD1-CB 3.67Å; L325-C356 HydrophobicContact CD2-CB 4.3Å; L325-W357 HydrophobicContact CD2-CB 3.77Å; L325-W357 HydrophobicContact CD2-CG 4.36Å
326	L	98.7	Very high	98.5	Very high	24 Å²	24	17.7 Å²	17.7	13%	0.126	11%	0.11	C	C	.	.	H	α-helix	trans	-61.9	-38.1	177.6	-72.3	168	0	0	0	111.9	L230 E231 I279 V286 W288 L322	L230-L326 HydrophobicContact CB-CD2 3.46Å; L230-L326 VanDerWaalsContact CB-CD2 3.46Å; L230-L326 HydrophobicContact CB-CG 4.33Å; L230-L326 HydrophobicContact CD1-CD2 4.45Å; E231-L326 HydrophobicContact CG-CD2 4.07Å; I279-L326 HydrophobicContact CD1-CD1 3.93Å; V286-L326 HydrophobicContact CG2-CB 4.3Å; V286-L326 HydrophobicContact CG2-CD1 4.31Å; V286-L326 HydrophobicContact CG2-CD2 3.84Å; V286-L326 HydrophobicContact CG2-CG 4.38Å; W288-L326 HydrophobicContact CH2-CB 4.27Å; W288-L326 HydrophobicContact CZ2-CB 4Å; L322-L326 HydrophobicContact CD1-CD1 4.28Å; L322-L326 HydrophobicContact CD1-CG 4.18Å; L322-L326 HydrophobicContact CG-CD1 3.98Å; L322-L326 HydrophobicContact CG-CG 4.37Å; L322-L326 WeakPolarHBondContact O-CB 3.45Å; L322-L326 VanDerWaalsContact O-CG 3.31Å; L322-L326 WeakPolarHBondContact O-CG 3.45Å; L322-L326 PolarHBondContact O-N 3.26Å
327	G	98.3	Very high	98.5	Very high	21 Å²	21	19.2 Å²	19.2	22%	0.216	12%	0.119	C	C	.	.	H	α-helix	trans	-80.9	-27.9	-178	0	0	0	0	0	114.8	W288 D323 A324 L325	W288-G327 VanDerWaalsContact CZ2-CA 3.49Å; D323-G327 PolarHBondContact O-N 3.32Å; A324-G327 PolarHBondContact O-N 3.23Å; L325-G327 VanDerWaalsContact C-N 3.3Å; L325-G327 PolarHBondContact O-N 3.22Å
328	A	98.2	Very high	98.5	Very high	11 Å²	11	20.6 Å²	20.6	9%	0.091	12%	0.124	C	C	.	.	H	α-helix	trans	-95.5	-28.9	-173.2	0	0	0	0	0	114.2	A324 L325 S330 D331 E334 L335	A324-A328 WeakPolarHBondContact O-CB 3.23Å; A324-A328 PolarHBondContact O-N 2.87Å; L325-A328 PolarHBondContact O-N 3.2Å; A328-S330 PolarHBondContact O-N 3.46Å; A328-D331 WeakPolarHBondContact O-CB 3.45Å; A328-D331 PolarHBondContact O-N 3.47Å; A328-E334 HydrophobicContact CB-CB 4.07Å; A328-E334 HydrophobicContact CB-CG 4Å; A328-L335 VanDerWaalsContact CB-CA 3.47Å; A328-L335 HydrophobicContact CB-CB 3.78Å; A328-L335 HydrophobicContact CB-CD1 4.13Å; A328-L335 VanDerWaalsContact CB-N 3.3Å
329	G	95.4	Very high	98.5	Very high	27 Å²	27	20.6 Å²	20.6	28%	0.278	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.3	-129	-170.6	0	0	0	0	0	111.2	L325 D331 W357 Y361	L325-G329 PolarHBondContact O-N 3.3Å; L325-G329 VanDerWaalsContact O-N 3.15Å; G329-D331 VanDerWaalsContact C-N 3.32Å; G329-D331 PolarHBondContact O-N 3.33Å; G329-W357 PolarHBondContact O-NE1 3.49Å; G329-Y361 VanDerWaalsContact O-CE2 3.29Å; G329-Y361 WeakPolarHBondContact O-CE2 3.35Å
330	S	96.7	Very high	98.5	Very high	86 Å²	86	20.4 Å²	20.4	60%	0.601	12%	0.123	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.2	14.6	178.9	71	0	0	0	0	114.5	A328 W357	A328-S330 PolarHBondContact O-N 3.46Å; S330-W357 WeakPolarHBondContact O-CZ2 3.42Å
331	D	98.6	Very high	98.5	Very high	83 Å²	83	20.4 Å²	20.4	44%	0.444	12%	0.123	S	C	.	.			trans	-95.7	110.4	178	-168.7	-35.3	0	0	0	111	A328 G329 E333 E334 L335	A328-D331 WeakPolarHBondContact O-CB 3.45Å; A328-D331 PolarHBondContact O-N 3.47Å; G329-D331 VanDerWaalsContact C-N 3.32Å; G329-D331 PolarHBondContact O-N 3.33Å; D331-E333 PolarHBondContact OD1-N 3.48Å; D331-E334 HydrophobicContact CB-CB 3.91Å; D331-E334 PolarHBondContact OD1-N 3.41Å; D331-E334 VanDerWaalsContact OD1-N 3.09Å; D331-L335 WeakPolarHBondContact O-CB 3.49Å; D331-L335 PolarHBondContact O-N 2.98Å
332	W	98.8	Very high	98.5	Very high	6 Å²	6	20.4 Å²	20.4	2%	0.023	12%	0.123	C	C	.	.	H	α-helix	trans	-63.9	-38.1	178.8	173	-102.8	0	0	0	113	L53 L60 L335 M336 C354 W357 V366 N370	L53-W332 HydrophobicContact CB-CH2 4.24Å; L53-W332 HydrophobicContact CB-CZ3 4.24Å; L53-W332 HydrophobicContact CD1-CZ3 4.12Å; L53-W332 HydrophobicContact CD2-CH2 4.24Å; L53-W332 HydrophobicContact CD2-CZ3 4.49Å; L60-W332 HydrophobicContact CD1-CZ2 4.34Å; W332-L335 HydrophobicContact CE3-CD2 4Å; W332-L335 HydrophobicContact CZ3-CD2 3.95Å; W332-L335 PolarHBondContact O-N 3.33Å; W332-M336 HydrophobicContact CD2-CG 4.17Å; W332-M336 HydrophobicContact CH2-CG 4.35Å; W332-M336 HydrophobicContact CH2-SD 3.66Å; W332-M336 HydrophobicContact CZ2-CG 3.78Å; W332-M336 HydrophobicContact CZ2-SD 3.54Å; W332-M336 VanDerWaalsContact CZ2-SD 3.54Å; W332-M336 HydrophobicContact CZ3-SD 4.27Å; W332-M336 VanDerWaalsContact O-CG 3.32Å; W332-M336 WeakPolarHBondContact O-CG 3.2Å; W332-M336 PolarHBondContact O-N 3.44Å; W332-C354 HydrophobicContact CH2-CB 4.08Å; W332-C354 HydrophobicContact CZ3-CB 4.07Å; W332-W357 HydrophobicContact CB-CH2 3.97Å; W332-W357 HydrophobicContact CB-CZ2 3.99Å; W332-W357 HydrophobicContact CE3-CD2 4.14Å; W332-W357 AromaticContact CE3-CE3 3.79Å; W332-W357 HydrophobicContact CE3-CE3 3.79Å; W332-W357 HydrophobicContact CE3-CH2 4.33Å; W332-W357 AromaticContact CE3-CZ3 3.92Å; W332-W357 HydrophobicContact CE3-CZ3 3.92Å; W332-W357 HydrophobicContact CZ3-CE3 4.21Å; W332-V366 HydrophobicContact CB-CG2 4.24Å; W332-V366 HydrophobicContact CD2-CB 4.43Å; W332-V366 HydrophobicContact CD2-CG1 4.05Å; W332-V366 HydrophobicContact CD2-CG2 3.82Å; W332-V366 HydrophobicContact CE3-CG2 3.96Å; W332-V366 HydrophobicContact CG-CB 4.38Å; W332-V366 HydrophobicContact CG-CG1 4.29Å; W332-V366 HydrophobicContact CG-CG2 3.94Å; W332-V366 HydrophobicContact CZ2-CG1 4.23Å; W332-N370 PolarHBondContact NE1-ND2 2.91Å
333	E	98.7	Very high	98.5	Very high	55 Å²	55	20.8 Å²	20.8	26%	0.257	13%	0.127	S	C	.	.	H	α-helix	trans	-70.9	-40.7	-178.2	-174	161.2	-155.8	0	0	110.5	L86 K87 D331 M336 N337	L86-E333 HydrophobicContact CB-CG 4.48Å; L86-E333 HydrophobicContact CD2-CB 4.07Å; L86-E333 HydrophobicContact CD2-CG 4.06Å; K87-E333 IonicContact NZ-OE2 3.44Å; K87-E333 PolarHBondContact NZ-OE2 2.63Å; D331-E333 PolarHBondContact OD1-N 3.48Å; E333-M336 PolarHBondContact O-N 2.96Å; E333-N337 WeakPolarHBondContact O-CB 3.4Å; E333-N337 PolarHBondContact O-N 2.94Å; E333-N337 PolarHBondContact O-ND2 3.18Å
334	E	98.8	Very high	98.5	Very high	53 Å²	53	21 Å²	21	25%	0.248	13%	0.129	C	C	.	.	H	α-helix	trans	-65.9	-37.2	173.3	-173.8	61.3	-174	0	0	112.4	A328 D331 N337 R338	A328-E334 HydrophobicContact CB-CB 4.07Å; A328-E334 HydrophobicContact CB-CG 4Å; D331-E334 HydrophobicContact CB-CB 3.91Å; D331-E334 PolarHBondContact OD1-N 3.41Å; D331-E334 VanDerWaalsContact OD1-N 3.09Å; E334-N337 PolarHBondContact O-N 2.69Å; E334-R338 WeakPolarHBondContact O-CG 3.3Å; E334-R338 PolarHBondContact O-N 3.12Å; E334-R338 VanDerWaalsContact O-N 3.13Å; E334-R338 IonicContact OE1-CZ 3.18Å; E334-R338 IonicContact OE1-NE 3.38Å; E334-R338 PolarHBondContact OE1-NE 3.38Å; E334-R338 IonicContact OE1-NH2 2.79Å; E334-R338 PolarHBondContact OE1-NH2 2.96Å
335	L	98.9	Very high	98.4	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-59.1	-50.2	173.6	-176.2	79.1	0	0	0	110.6	A324 L325 A328 D331 W332 N337 R338 A339 A353 W357	A324-L335 HydrophobicContact CB-CD1 4.14Å; L325-L335 HydrophobicContact CD2-CD1 3.98Å; L325-L335 HydrophobicContact CG-CD1 4.34Å; A328-L335 VanDerWaalsContact CB-CA 3.47Å; A328-L335 HydrophobicContact CB-CB 3.78Å; A328-L335 HydrophobicContact CB-CD1 4.13Å; A328-L335 VanDerWaalsContact CB-N 3.3Å; D331-L335 WeakPolarHBondContact O-CB 3.49Å; D331-L335 PolarHBondContact O-N 2.98Å; W332-L335 HydrophobicContact CE3-CD2 4Å; W332-L335 HydrophobicContact CZ3-CD2 3.95Å; W332-L335 PolarHBondContact O-N 3.33Å; L335-N337 VanDerWaalsContact C-N 3.35Å; L335-N337 PolarHBondContact O-N 3.41Å; L335-R338 PolarHBondContact O-N 3.14Å; L335-R338 VanDerWaalsContact O-N 3.15Å; L335-A339 WeakPolarHBondContact O-CB 3.12Å; L335-A339 PolarHBondContact O-N 3.24Å; L335-A353 HydrophobicContact CD1-CB 4.34Å; L335-W357 HydrophobicContact CD1-CB 4.47Å; L335-W357 HydrophobicContact CD1-CG 4.41Å; L335-W357 HydrophobicContact CD2-CB 3.49Å; L335-W357 VanDerWaalsContact CD2-CB 3.49Å; L335-W357 HydrophobicContact CD2-CD2 4.06Å; L335-W357 HydrophobicContact CD2-CG 3.43Å; L335-W357 VanDerWaalsContact CD2-CG 3.43Å; L335-W357 HydrophobicContact CG-CG 4.41Å
336	M	98.9	Very high	98.4	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-63.9	-40.3	-179.7	-67.8	-52.8	-65.5	0	0	111.9	L60 L86 W332 E333 R338 A340 F341	L60-M336 HydrophobicContact CB-CE 3.46Å; L60-M336 VanDerWaalsContact CB-CE 3.46Å; L60-M336 HydrophobicContact CD1-CE 3.65Å; L60-M336 HydrophobicContact CG-CE 4.15Å; L86-M336 HydrophobicContact CD1-CG 4.47Å; L86-M336 HydrophobicContact CD2-CB 3.88Å; L86-M336 HydrophobicContact CD2-CG 3.82Å; W332-M336 HydrophobicContact CD2-CG 4.17Å; W332-M336 HydrophobicContact CH2-CG 4.35Å; W332-M336 HydrophobicContact CH2-SD 3.66Å; W332-M336 HydrophobicContact CZ2-CG 3.78Å; W332-M336 HydrophobicContact CZ2-SD 3.54Å; W332-M336 VanDerWaalsContact CZ2-SD 3.54Å; W332-M336 HydrophobicContact CZ3-SD 4.27Å; W332-M336 VanDerWaalsContact O-CG 3.32Å; W332-M336 WeakPolarHBondContact O-CG 3.2Å; W332-M336 PolarHBondContact O-N 3.44Å; E333-M336 PolarHBondContact O-N 2.96Å; M336-R338 PolarHBondContact O-N 2.7Å; M336-A340 HydrophobicContact CE-CB 3.23Å; M336-A340 PolarHBondContact O-N 3.27Å; M336-A340 HydrophobicContact SD-CB 4.19Å; M336-F341 HydrophobicContact CB-CD2 4.17Å; M336-F341 HydrophobicContact CB-CE2 3.59Å; M336-F341 HydrophobicContact CB-CZ 4Å; M336-F341 HydrophobicContact CE-CE1 4.26Å; M336-F341 HydrophobicContact CE-CZ 4.01Å; M336-F341 WeakPolarHBondContact O-CD2 3.11Å; M336-F341 PolarHBondContact O-N 2.92Å
337	N	98.8	Very high	98.4	Very high	32 Å²	32	20.1 Å²	20.1	17%	0.171	12%	0.124	C	C	.	.	H	α-helix	trans	-61.1	-26.2	175.7	-73	-24.2	0	0	0	113.6	H77 R297 E333 E334 L335	H77-N337 PolarHBondContact CE1-OD1 2.76Å; R297-N337 PolarHBondContact NH2-O 3.11Å; E333-N337 WeakPolarHBondContact O-CB 3.4Å; E333-N337 PolarHBondContact O-N 2.94Å; E333-N337 PolarHBondContact O-ND2 3.18Å; E334-N337 PolarHBondContact O-N 2.69Å; L335-N337 VanDerWaalsContact C-N 3.35Å; L335-N337 PolarHBondContact O-N 3.41Å
338	R	98.8	Very high	98.4	Very high	28 Å²	28	19.3 Å²	19.3	11%	0.106	12%	0.115	C	C	.	.	H	α-helix	trans	-94.8	-45.2	178.9	-69.8	177.4	-179.6	-101.1	-7.1	113	Y301 A324 E334 L335 M336 H342	Y301-R338 WeakPolarHBondContact CE2-O 3.35Å; Y301-R338 PolarHBondContact OH-O 3.44Å; A324-R338 HydrophobicContact CB-CB 3.61Å; E334-R338 WeakPolarHBondContact O-CG 3.3Å; E334-R338 PolarHBondContact O-N 3.12Å; E334-R338 VanDerWaalsContact O-N 3.13Å; E334-R338 IonicContact OE1-CZ 3.18Å; E334-R338 IonicContact OE1-NE 3.38Å; E334-R338 PolarHBondContact OE1-NE 3.38Å; E334-R338 IonicContact OE1-NH2 2.79Å; E334-R338 PolarHBondContact OE1-NH2 2.96Å; L335-R338 PolarHBondContact O-N 3.14Å; L335-R338 VanDerWaalsContact O-N 3.15Å; M336-R338 PolarHBondContact O-N 2.7Å; R338-H342 PolarHBondContact O-CD2 3.12Å
339	A	98.8	Very high	98.5	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-90.8	-34.9	-171.4	0	0	0	0	0	113.6	A324 L335 H342 T349 A353	A324-A339 HydrophobicContact CB-CB 3.63Å; L335-A339 WeakPolarHBondContact O-CB 3.12Å; L335-A339 PolarHBondContact O-N 3.24Å; A339-H342 PolarHBondContact O-CD2 3.39Å; A339-H342 PolarHBondContact O-NE2 3.23Å; A339-H342 VanDerWaalsContact O-NE2 3.15Å; A339-T349 PolarHBondContact O-OG1 3.4Å; A339-A353 HydrophobicContact CB-CB 3.6Å
340	A	98.6	Very high	98.6	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112	-26.3	-169.8	0	0	0	0	0	113.8	M336 N346 A350	M336-A340 HydrophobicContact CE-CB 3.23Å; M336-A340 PolarHBondContact O-N 3.27Å; M336-A340 HydrophobicContact SD-CB 4.19Å; A340-N346 WeakPolarHBondContact O-CB 3.43Å; A340-A350 HydrophobicContact CB-CB 3.62Å
341	F	98.8	Very high	98.7	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	7%	0.069	C	C	.	.	S	Bend	trans	-107.7	71.5	-174.7	-51.7	-34.2	0	0	0	110.3	L60 W67 I76 H77 L80 L86 M336	L60-F341 HydrophobicContact CB-CE1 4.35Å; W67-F341 HydrophobicContact CE3-CD1 4.1Å; W67-F341 HydrophobicContact CE3-CE1 4.04Å; W67-F341 AromaticContact CZ3-CD1 3.9Å; W67-F341 HydrophobicContact CZ3-CD1 3.9Å; W67-F341 AromaticContact CZ3-CE1 3.53Å; W67-F341 HydrophobicContact CZ3-CE1 3.53Å; W67-F341 HydrophobicContact CZ3-CZ 4.31Å; I76-F341 HydrophobicContact CG2-CB 4.04Å; I76-F341 HydrophobicContact CG2-CD1 4.19Å; I76-F341 HydrophobicContact CG2-CG 4.41Å; H77-F341 PolarHBondContact CD2-O 2.96Å; H77-F341 VanDerWaalsContact CD2-O 3.29Å; H77-F341 VanDerWaalsContact NE2-CB 3.29Å; H77-F341 WeakPolarHBondContact NE2-CB 3.33Å; H77-F341 PolarHBondContact NE2-O 3.12Å; L80-F341 HydrophobicContact CD1-CE2 4.34Å; L80-F341 HydrophobicContact CD1-CZ 4.45Å; L80-F341 HydrophobicContact CD2-CD2 3.55Å; L80-F341 HydrophobicContact CD2-CE2 3.58Å; L80-F341 HydrophobicContact CD2-CG 4.32Å; L80-F341 HydrophobicContact CD2-CZ 4.39Å; L86-F341 HydrophobicContact CD1-CE2 4.12Å; L86-F341 HydrophobicContact CD1-CZ 3.86Å; M336-F341 HydrophobicContact CB-CD2 4.17Å; M336-F341 HydrophobicContact CB-CE2 3.59Å; M336-F341 HydrophobicContact CB-CZ 4Å; M336-F341 HydrophobicContact CE-CE1 4.26Å; M336-F341 HydrophobicContact CE-CZ 4.01Å; M336-F341 WeakPolarHBondContact O-CD2 3.11Å; M336-F341 PolarHBondContact O-N 2.92Å
342	H	98.9	Very high	98.8	Very high	1 Å²	1	9.4 Å²	9.4	1%	0.005	5%	0.047	C	C	.	.	S	Bend	trans	-146	162.6	178.2	64.7	60.5	0	0	0	111.5	I76 Y301 R338 A339 G344 N346 T349	I76-H342 VanDerWaalsContact CD1-O 3.32Å; I76-H342 WeakPolarHBondContact CD1-O 3.31Å; Y301-H342 HydrophobicContact CD2-CB 4.01Å; Y301-H342 AromaticContact CD2-CD2 3.83Å; Y301-H342 AromaticContact CD2-CG 3.88Å; Y301-H342 HydrophobicContact CE2-CB 4.03Å; Y301-H342 AromaticContact CE2-CD2 3.63Å; Y301-H342 AromaticContact CE2-CG 4Å; R338-H342 PolarHBondContact O-CD2 3.12Å; A339-H342 PolarHBondContact O-CD2 3.39Å; A339-H342 PolarHBondContact O-NE2 3.23Å; A339-H342 VanDerWaalsContact O-NE2 3.15Å; H342-G344 VanDerWaalsContact C-N 3.26Å; H342-G344 VanDerWaalsContact ND1-CA 3.3Å; H342-G344 WeakPolarHBondContact ND1-CA 3.42Å; H342-G344 PolarHBondContact ND1-N 2.86Å; H342-G344 PolarHBondContact O-N 3.11Å; H342-N346 WeakPolarHBondContact CE1-CA 3.48Å; H342-N346 VanDerWaalsContact CE1-CB 3.44Å; H342-N346 WeakPolarHBondContact CE1-CB 3.44Å; H342-N346 WeakPolarHBondContact ND1-CB 3.32Å; H342-N346 PolarHBondContact O-ND2 2.88Å; H342-T349 PolarHBondContact CE1-OG1 3.03Å; H342-T349 PolarHBondContact NE2-OG1 3.2Å
343	G	98.6	Very high	98.8	Very high	8 Å²	8	9.1 Å²	9.1	8%	0.082	5%	0.046	C	C	.	.	S	Bend	trans	-78.4	-1.5	-178.1	0	0	0	0	0	115.9	N70 Y71 D298 W309	N70-G343 WeakPolarHBondContact O-CA 3.45Å; Y71-G343 WeakPolarHBondContact CA-O 3.38Å; D298-G343 PolarHBondContact OD1-N 3.45Å; W309-G343 PolarHBondContact NE1-O 2.9Å
344	G	98.6	Very high	98.8	Very high	4 Å²	4	6.5 Å²	6.5	4%	0.041	3%	0.034	C	C	.	.	S	Bend	trans	-75.1	-166.6	168.8	0	0	0	0	0	114.4	W309 G310 H342 N346	W309-G344 PolarHBondContact NE1-O 3.39Å; G310-G344 CarbonylContact O-C 3.59Å; G310-G344 WeakPolarHBondContact O-CA 3.32Å; H342-G344 VanDerWaalsContact C-N 3.26Å; H342-G344 VanDerWaalsContact ND1-CA 3.3Å; H342-G344 WeakPolarHBondContact ND1-CA 3.42Å; H342-G344 PolarHBondContact ND1-N 2.86Å; H342-G344 PolarHBondContact O-N 3.11Å; G344-N346 PolarHBondContact O-N 2.97Å; G344-N346 VanDerWaalsContact O-N 3.16Å
345	D	98.7	Very high	98.8	Very high	8 Å²	8	4 Å²	4	4%	0.043	2%	0.022	C	C	.	.	S	Bend	trans	-76.7	91.2	171.7	-176.8	-14.4	0	0	0	108.3	C171 W309 G310 S312 S348 T349	C171-D345 PolarHBondContact SG-OD2 3.12Å; W309-D345 HydrophobicContact CD2-CB 4.03Å; W309-D345 HydrophobicContact CE3-CB 4.14Å; W309-D345 HydrophobicContact CH2-CB 3.81Å; W309-D345 HydrophobicContact CZ2-CB 3.73Å; W309-D345 HydrophobicContact CZ3-CB 4.02Å; G310-D345 PolarHBondContact O-N 3.46Å; S312-D345 VanDerWaalsContact CA-OD2 3.25Å; S312-D345 WeakPolarHBondContact CA-OD2 3.44Å; D345-S348 VanDerWaalsContact CG-OG 3.29Å; D345-S348 WeakPolarHBondContact OD1-CB 3.46Å; D345-S348 PolarHBondContact OD1-OG 2.81Å; D345-S348 PolarHBondContact OD2-OG 3.22Å; D345-T349 WeakPolarHBondContact O-CG2 3.41Å; D345-T349 PolarHBondContact O-N 3.49Å; D345-T349 PolarHBondContact O-OG1 3.36Å; D345-T349 VanDerWaalsContact O-OG1 3.11Å
346	N	98.2	Very high	98.8	Very high	0 Å²	0	4 Å²	4	0%	0	2%	0.023	C	C	.	.	H	α-helix	trans	-99.1	-23.5	-153.8	64.9	23.2	0	0	0	114.7	G61 W67 E68 A340 H342 G344 T349 A350	G61-N346 PolarHBondContact O-OD1 3.5Å; W67-N346 PolarHBondContact O-ND2 3.2Å; E68-N346 WeakPolarHBondContact CA-OD1 3.45Å; A340-N346 WeakPolarHBondContact O-CB 3.43Å; H342-N346 WeakPolarHBondContact CE1-CA 3.48Å; H342-N346 VanDerWaalsContact CE1-CB 3.44Å; H342-N346 WeakPolarHBondContact CE1-CB 3.44Å; H342-N346 WeakPolarHBondContact ND1-CB 3.32Å; H342-N346 PolarHBondContact O-ND2 2.88Å; G344-N346 PolarHBondContact O-N 2.97Å; G344-N346 VanDerWaalsContact O-N 3.16Å; N346-T349 WeakPolarHBondContact CA-OG1 3.29Å; N346-T349 PolarHBondContact O-OG1 3.35Å; N346-A350 WeakPolarHBondContact O-CB 3.45Å; N346-A350 PolarHBondContact O-N 3.35Å
347	D	98.7	Very high	98.8	Very high	0 Å²	0	4 Å²	4	0%	0	2%	0.023	C	C	.	.	H	α-helix	trans	-71.6	-40	165.4	54.6	-31.4	0	0	0	110.8	E68 S99 A350 V351	E68-D347 WeakPolarHBondContact CG-OD1 3.47Å; S99-D347 WeakPolarHBondContact CB-OD2 3.49Å; S99-D347 PolarHBondContact OG-OD2 3.36Å; D347-A350 PolarHBondContact O-N 3.4Å; D347-V351 WeakPolarHBondContact O-CB 3.3Å; D347-V351 PolarHBondContact O-N 2.96Å
348	S	98.9	Very high	98.8	Very high	3 Å²	3	2.5 Å²	2.5	2%	0.021	2%	0.015	C	C	.	.	H	α-helix	trans	-61.9	-43	175.7	-65.1	0	0	0	0	114.7	D101 C171 D345 V351 I352	D101-S348 WeakPolarHBondContact OD2-CA 3.32Å; D101-S348 PolarHBondContact OD2-OG 2.88Å; C171-S348 PolarHBondContact SG-OG 3.16Å; D345-S348 VanDerWaalsContact CG-OG 3.29Å; D345-S348 WeakPolarHBondContact OD1-CB 3.46Å; D345-S348 PolarHBondContact OD1-OG 2.81Å; D345-S348 PolarHBondContact OD2-OG 3.22Å; S348-V351 WeakPolarHBondContact O-CG1 3.4Å; S348-I352 WeakPolarHBondContact O-CD1 3.35Å; S348-I352 WeakPolarHBondContact O-CG1 3.41Å
349	T	98.9	Very high	98.8	Very high	0 Å²	0	1.2 Å²	1.2	0%	0	1%	0.009	C	C	.	.	H	α-helix	trans	-71.4	-38.8	175.4	47.7	0	0	0	0	110.7	I320 A339 H342 D345 N346 A353	I320-T349 HydrophobicContact CB-CG2 3.7Å; I320-T349 HydrophobicContact CD1-CG2 4.09Å; I320-T349 HydrophobicContact CG2-CG2 3.68Å; A339-T349 PolarHBondContact O-OG1 3.4Å; H342-T349 PolarHBondContact CE1-OG1 3.03Å; H342-T349 PolarHBondContact NE2-OG1 3.2Å; D345-T349 WeakPolarHBondContact O-CG2 3.41Å; D345-T349 PolarHBondContact O-N 3.49Å; D345-T349 PolarHBondContact O-OG1 3.36Å; D345-T349 VanDerWaalsContact O-OG1 3.11Å; N346-T349 WeakPolarHBondContact CA-OG1 3.29Å; N346-T349 PolarHBondContact O-OG1 3.35Å; T349-A353 VanDerWaalsContact O-CB 3.31Å; T349-A353 WeakPolarHBondContact O-CB 3.39Å; T349-A353 PolarHBondContact O-N 3.13Å
350	A	98.9	Very high	98.8	Very high	0 Å²	0	1.3 Å²	1.3	0%	0	1%	0.01	C	C	.	.	H	α-helix	trans	-66.4	-41.8	178.7	0	0	0	0	0	113.3	G57 A340 N346 D347 I352 A353 C354	G57-A350 WeakPolarHBondContact O-CB 3.34Å; A340-A350 HydrophobicContact CB-CB 3.62Å; N346-A350 WeakPolarHBondContact O-CB 3.45Å; N346-A350 PolarHBondContact O-N 3.35Å; D347-A350 PolarHBondContact O-N 3.4Å; A350-I352 VanDerWaalsContact C-N 3.25Å; A350-I352 PolarHBondContact O-N 3.21Å; A350-A353 PolarHBondContact O-N 2.81Å; A350-C354 WeakPolarHBondContact O-CB 3.48Å; A350-C354 PolarHBondContact O-N 3.03Å; A350-C354 PolarHBondContact O-SG 3.46Å
351	V	98.9	Very high	98.8	Very high	0 Å²	0	3.5 Å²	3.5	0%	0	2%	0.019	C	C	.	.	H	α-helix	trans	-61.4	-37.1	-178.2	76.1	0	0	0	0	111.2	S54 D58 D101 M175 M178 D347 S348 C355	S54-V351 WeakPolarHBondContact CB-O 3.42Å; S54-V351 WeakPolarHBondContact OG-CG2 3.48Å; S54-V351 PolarHBondContact OG-O 2.83Å; D58-V351 HydrophobicContact CB-CB 4.14Å; D58-V351 HydrophobicContact CB-CG2 4.15Å; D101-V351 HydrophobicContact CB-CB 4.27Å; D101-V351 HydrophobicContact CB-CG1 4.09Å; D101-V351 HydrophobicContact CB-CG2 4.18Å; D101-V351 VanDerWaalsContact OD2-CG1 3.26Å; D101-V351 WeakPolarHBondContact OD2-CG1 3.14Å; M175-V351 HydrophobicContact CB-CG1 3.85Å; M178-V351 HydrophobicContact CE-CG1 4.15Å; M178-V351 HydrophobicContact CE-CG2 4Å; M178-V351 WeakPolarHBondContact CE-O 3.38Å; D347-V351 WeakPolarHBondContact O-CB 3.3Å; D347-V351 PolarHBondContact O-N 2.96Å; S348-V351 WeakPolarHBondContact O-CG1 3.4Å; V351-C355 WeakPolarHBondContact O-CB 3.22Å; V351-C355 PolarHBondContact O-N 2.71Å
352	I	99	Very high	98.7	Very high	0 Å²	0	3.9 Å²	3.9	0%	0	2%	0.023	C	C	.	.	H	α-helix	trans	-74.2	-52	177.2	-57.7	167.6	0	0	0	110.3	A174 M178 A317 P318 A321 S348 A350 C354 C355 C356	A174-I352 HydrophobicContact CB-CD1 4.11Å; M178-I352 HydrophobicContact CE-CG1 4.32Å; M178-I352 HydrophobicContact CG-CG2 4.4Å; M178-I352 HydrophobicContact SD-CB 4.27Å; M178-I352 HydrophobicContact SD-CG1 3.76Å; M178-I352 HydrophobicContact SD-CG2 4.41Å; A317-I352 HydrophobicContact CB-CD1 3.87Å; P318-I352 HydrophobicContact CB-CD1 4.44Å; A321-I352 HydrophobicContact CB-CB 3.86Å; A321-I352 HydrophobicContact CB-CG2 3.71Å; S348-I352 WeakPolarHBondContact O-CD1 3.35Å; S348-I352 WeakPolarHBondContact O-CG1 3.41Å; A350-I352 VanDerWaalsContact C-N 3.25Å; A350-I352 PolarHBondContact O-N 3.21Å; I352-C354 PolarHBondContact O-N 2.85Å; I352-C355 PolarHBondContact O-N 2.79Å; I352-C356 PolarHBondContact O-N 3.41Å; I352-C356 VanDerWaalsContact O-N 3.17Å; I352-C356 PolarHBondContact O-SG 2.69Å; I352-C356 VanDerWaalsContact O-SG 3.39Å
353	A	98.9	Very high	98.7	Very high	0 Å²	0	6.7 Å²	6.7	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-61.1	-47.5	-176.2	0	0	0	0	0	111.6	A321 L335 A339 T349 A350 C355 C356 W357	A321-A353 HydrophobicContact CB-CB 3.79Å; L335-A353 HydrophobicContact CD1-CB 4.34Å; A339-A353 HydrophobicContact CB-CB 3.6Å; T349-A353 VanDerWaalsContact O-CB 3.31Å; T349-A353 WeakPolarHBondContact O-CB 3.39Å; T349-A353 PolarHBondContact O-N 3.13Å; A350-A353 PolarHBondContact O-N 2.81Å; A353-C355 VanDerWaalsContact C-N 3.32Å; A353-C355 PolarHBondContact O-N 2.8Å; A353-C356 PolarHBondContact O-N 2.69Å; A353-W357 VanDerWaalsContact O-CB 3.32Å; A353-W357 WeakPolarHBondContact O-CB 3.47Å; A353-W357 PolarHBondContact O-N 2.82Å
354	C	98.9	Very high	98.6	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-70.3	-29.3	-178	-60.6	0	0	0	0	112.2	L53 W332 A350 I352 G358	L53-C354 HydrophobicContact CB-CB 4.33Å; L53-C354 WeakPolarHBondContact O-CB 3.45Å; W332-C354 HydrophobicContact CH2-CB 4.08Å; W332-C354 HydrophobicContact CZ3-CB 4.07Å; A350-C354 WeakPolarHBondContact O-CB 3.48Å; A350-C354 PolarHBondContact O-N 3.03Å; A350-C354 PolarHBondContact O-SG 3.46Å; I352-C354 PolarHBondContact O-N 2.85Å; C354-G358 PolarHBondContact O-N 3.26Å
355	C	99	Very high	98.4	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-61.8	-54.2	171.2	-166	0	0	0	0	110.8	G50 M178 V351 I352 A353 W357 G358 L359	G50-C355 WeakPolarHBondContact CA-O 3.38Å; G50-C355 WeakPolarHBondContact O-CA 3.45Å; G50-C355 PolarHBondContact O-SG 3.27Å; M178-C355 HydrophobicContact CB-CB 4.13Å; M178-C355 VanDerWaalsContact CB-SG 3.6Å; M178-C355 HydrophobicContact CE-CB 4.25Å; M178-C355 HydrophobicContact CG-CB 4.03Å; V351-C355 WeakPolarHBondContact O-CB 3.22Å; V351-C355 PolarHBondContact O-N 2.71Å; I352-C355 PolarHBondContact O-N 2.79Å; A353-C355 VanDerWaalsContact C-N 3.32Å; A353-C355 PolarHBondContact O-N 2.8Å; C355-W357 VanDerWaalsContact C-N 3.34Å; C355-W357 PolarHBondContact O-N 2.75Å; C355-G358 PolarHBondContact O-N 3.28Å; C355-L359 VanDerWaalsContact O-CG 3.3Å; C355-L359 WeakPolarHBondContact O-CG 3.36Å; C355-L359 PolarHBondContact O-N 2.98Å
356	C	98.9	Very high	98.4	Very high	1 Å²	1	18 Å²	18	1%	0.007	11%	0.105	C	C	.	.	H	α-helix	trans	-61.5	-42.7	179.7	-62.7	0	0	0	0	111.7	W233 L325 I352 A353 L359 L360	W233-C356 HydrophobicContact CH2-CB 4.26Å; W233-C356 HydrophobicContact CZ3-CB 4.18Å; L325-C356 HydrophobicContact CD1-CB 3.67Å; L325-C356 HydrophobicContact CD2-CB 4.3Å; I352-C356 PolarHBondContact O-N 3.41Å; I352-C356 VanDerWaalsContact O-N 3.17Å; I352-C356 PolarHBondContact O-SG 2.69Å; I352-C356 VanDerWaalsContact O-SG 3.39Å; A353-C356 PolarHBondContact O-N 2.69Å; C356-L359 WeakPolarHBondContact O-CB 3.38Å; C356-L359 PolarHBondContact O-N 3.23Å; C356-L360 WeakPolarHBondContact O-CG 3.24Å; C356-L360 PolarHBondContact O-N 3.37Å
357	W	98.9	Very high	98.5	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-63.3	-43.2	177.8	-167.3	97.5	0	0	0	112	L53 L325 G329 S330 W332 L335 A353 C355 L359 L360 Y361 K364 V366	L53-W357 HydrophobicContact CD1-CE3 3.99Å; L53-W357 HydrophobicContact CD1-CZ3 4Å; L325-W357 HydrophobicContact CD2-CB 3.77Å; L325-W357 HydrophobicContact CD2-CG 4.36Å; G329-W357 PolarHBondContact O-NE1 3.49Å; S330-W357 WeakPolarHBondContact O-CZ2 3.42Å; W332-W357 HydrophobicContact CB-CH2 3.97Å; W332-W357 HydrophobicContact CB-CZ2 3.99Å; W332-W357 HydrophobicContact CE3-CD2 4.14Å; W332-W357 AromaticContact CE3-CE3 3.79Å; W332-W357 HydrophobicContact CE3-CE3 3.79Å; W332-W357 HydrophobicContact CE3-CH2 4.33Å; W332-W357 AromaticContact CE3-CZ3 3.92Å; W332-W357 HydrophobicContact CE3-CZ3 3.92Å; W332-W357 HydrophobicContact CZ3-CE3 4.21Å; L335-W357 HydrophobicContact CD1-CB 4.47Å; L335-W357 HydrophobicContact CD1-CG 4.41Å; L335-W357 HydrophobicContact CD2-CB 3.49Å; L335-W357 VanDerWaalsContact CD2-CB 3.49Å; L335-W357 HydrophobicContact CD2-CD2 4.06Å; L335-W357 HydrophobicContact CD2-CG 3.43Å; L335-W357 VanDerWaalsContact CD2-CG 3.43Å; L335-W357 HydrophobicContact CG-CG 4.41Å; A353-W357 VanDerWaalsContact O-CB 3.32Å; A353-W357 WeakPolarHBondContact O-CB 3.47Å; A353-W357 PolarHBondContact O-N 2.82Å; C355-W357 VanDerWaalsContact C-N 3.34Å; C355-W357 PolarHBondContact O-N 2.75Å; W357-L359 VanDerWaalsContact C-N 3.32Å; W357-L359 PolarHBondContact O-N 3.35Å; W357-L360 WeakPolarHBondContact O-CB 3.44Å; W357-L360 PolarHBondContact O-N 2.99Å; W357-L360 VanDerWaalsContact O-N 3.12Å; W357-Y361 AromaticContact CD1-CD2 3.54Å; W357-Y361 AromaticContact CD1-CE2 3.61Å; W357-Y361 AromaticContact CD2-CD2 3.6Å; W357-Y361 HydrophobicContact CD2-CD2 3.6Å; W357-Y361 HydrophobicContact CD2-CE2 4.43Å; W357-Y361 HydrophobicContact CD2-CG 4.4Å; W357-Y361 AromaticContact CE2-CD2 3.41Å; W357-Y361 VanDerWaalsContact CE2-CD2 3.41Å; W357-Y361 HydrophobicContact CE3-CD2 4.3Å; W357-Y361 AromaticContact CG-CD2 3.7Å; W357-Y361 HydrophobicContact CG-CD2 3.7Å; W357-Y361 HydrophobicContact CG-CE2 4.16Å; W357-Y361 AromaticContact CZ2-CD2 3.99Å; W357-Y361 HydrophobicContact CZ2-CD2 3.99Å; W357-Y361 HydrophobicContact CZ2-CG 4.24Å; W357-Y361 AromaticContact NE1-CD2 3.37Å; W357-Y361 AromaticContact NE1-CE2 3.57Å; W357-Y361 WeakPolarHBondContact O-CD2 3.5Å; W357-Y361 PolarHBondContact O-N 2.95Å; W357-K364 WeakPolarHBondContact CH2-O 3.46Å; W357-V366 HydrophobicContact CH2-CG2 3.83Å; W357-V366 HydrophobicContact CZ3-CG2 3.52Å
358	G	98.8	Very high	98.4	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-63.8	-36.3	176.2	0	0	0	0	0	113.1	A49 C354 C355 L360 G362	A49-G358 WeakPolarHBondContact CB-O 3.49Å; C354-G358 PolarHBondContact O-N 3.26Å; C355-G358 PolarHBondContact O-N 3.28Å; G358-L360 VanDerWaalsContact C-N 3.31Å; G358-L360 PolarHBondContact O-N 3.31Å; G358-G362 VanDerWaalsContact O-CA 3.24Å; G358-G362 WeakPolarHBondContact O-CA 3.43Å; G358-G362 PolarHBondContact O-N 3.25Å
359	L	98.8	Very high	98.4	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-63.9	-38	172.7	-65.9	166.6	0	0	0	111.6	H46 Y47 L182 A221 A224 I225 R227 C355 C356 W357	H46-L359 PolarHBondContact CD2-O 3.22Å; H46-L359 VanDerWaalsContact CD2-O 3.28Å; Y47-L359 HydrophobicContact CD2-CD2 4.32Å; L182-L359 HydrophobicContact CD1-CD1 3.6Å; L182-L359 HydrophobicContact CD1-CD2 3.92Å; L182-L359 HydrophobicContact CD1-CG 4.32Å; L182-L359 HydrophobicContact CD2-CD2 4.35Å; L182-L359 HydrophobicContact CG-CD2 4Å; A221-L359 HydrophobicContact CB-CD1 3.78Å; A224-L359 HydrophobicContact CB-CB 3.81Å; A224-L359 HydrophobicContact CB-CD1 4.1Å; I225-L359 HydrophobicContact CD1-CD1 4.33Å; I225-L359 HydrophobicContact CD1-CD2 4.2Å; I225-L359 HydrophobicContact CG1-CB 4.48Å; I225-L359 HydrophobicContact CG1-CD1 4.23Å; I225-L359 HydrophobicContact CG1-CD2 4Å; I225-L359 HydrophobicContact CG1-CG 4.46Å; R227-L359 PolarHBondContact NH1-O 3.46Å; C355-L359 VanDerWaalsContact O-CG 3.3Å; C355-L359 WeakPolarHBondContact O-CG 3.36Å; C355-L359 PolarHBondContact O-N 2.98Å; C356-L359 WeakPolarHBondContact O-CB 3.38Å; C356-L359 PolarHBondContact O-N 3.23Å; W357-L359 VanDerWaalsContact C-N 3.32Å; W357-L359 PolarHBondContact O-N 3.35Å
360	L	98.4	Very high	98.4	Very high	2 Å²	2	27.4 Å²	27.4	1%	0.01	15%	0.152	C	C	.	.	H	α-helix	trans	-72.8	-48.4	179.2	-71.7	172.4	0	0	0	113.2	M36 L39 A224 L230 W233 C356 W357 G358	M36-L360 HydrophobicContact CE-CD1 4.32Å; M36-L360 HydrophobicContact CE-CD2 3.31Å; M36-L360 HydrophobicContact CE-CG 4.44Å; L39-L360 HydrophobicContact CD1-CD2 4Å; A224-L360 HydrophobicContact CB-CD2 4.09Å; A224-L360 HydrophobicContact CB-CG 3.97Å; A224-L360 WeakPolarHBondContact O-CD2 3.48Å; L230-L360 HydrophobicContact CD2-CD1 4.13Å; W233-L360 HydrophobicContact CH2-CD1 4.29Å; C356-L360 WeakPolarHBondContact O-CG 3.24Å; C356-L360 PolarHBondContact O-N 3.37Å; W357-L360 WeakPolarHBondContact O-CB 3.44Å; W357-L360 PolarHBondContact O-N 2.99Å; W357-L360 VanDerWaalsContact O-N 3.12Å; G358-L360 VanDerWaalsContact C-N 3.31Å; G358-L360 PolarHBondContact O-N 3.31Å
361	Y	98	Very high	98.4	Very high	46 Å²	46	28.8 Å²	28.8	18%	0.18	16%	0.157	C	C	.	.	H	α-helix	trans	-119.1	-0.3	-163.6	-54.1	-68.4	0	0	0	114.2	L39 G329 W357 T363 K364	L39-Y361 HydrophobicContact CD2-CD1 3.97Å; L39-Y361 HydrophobicContact CD2-CE1 3.9Å; G329-Y361 VanDerWaalsContact O-CE2 3.29Å; G329-Y361 WeakPolarHBondContact O-CE2 3.35Å; W357-Y361 AromaticContact CD1-CD2 3.54Å; W357-Y361 AromaticContact CD1-CE2 3.61Å; W357-Y361 AromaticContact CD2-CD2 3.6Å; W357-Y361 HydrophobicContact CD2-CD2 3.6Å; W357-Y361 HydrophobicContact CD2-CE2 4.43Å; W357-Y361 HydrophobicContact CD2-CG 4.4Å; W357-Y361 AromaticContact CE2-CD2 3.41Å; W357-Y361 VanDerWaalsContact CE2-CD2 3.41Å; W357-Y361 HydrophobicContact CE3-CD2 4.3Å; W357-Y361 AromaticContact CG-CD2 3.7Å; W357-Y361 HydrophobicContact CG-CD2 3.7Å; W357-Y361 HydrophobicContact CG-CE2 4.16Å; W357-Y361 AromaticContact CZ2-CD2 3.99Å; W357-Y361 HydrophobicContact CZ2-CD2 3.99Å; W357-Y361 HydrophobicContact CZ2-CG 4.24Å; W357-Y361 AromaticContact NE1-CD2 3.37Å; W357-Y361 AromaticContact NE1-CE2 3.57Å; W357-Y361 WeakPolarHBondContact O-CD2 3.5Å; W357-Y361 PolarHBondContact O-N 2.95Å; Y361-T363 PolarHBondContact O-N 3.36Å; Y361-K364 PolarHBondContact O-N 2.81Å
362	G	98.4	Very high	98.4	Very high	9 Å²	9	30.4 Å²	30.4	9%	0.093	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.5	-134	-175.6	0	0	0	0	0	111.1	A49 L53 G358	A49-G362 VanDerWaalsContact CB-C 3.46Å; L53-G362 VanDerWaalsContact CD1-O 3.31Å; L53-G362 WeakPolarHBondContact CD1-O 3.27Å; G358-G362 VanDerWaalsContact O-CA 3.24Å; G358-G362 WeakPolarHBondContact O-CA 3.43Å; G358-G362 PolarHBondContact O-N 3.25Å
363	T	98.3	Very high	98.3	Very high	60 Å²	60	36.4 Å²	36.4	37%	0.368	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.2	12.8	176.6	55.1	0	0	0	0	112.9	A49 Y361 G365 V366 Y371	A49-T363 HydrophobicContact CB-CG2 3.96Å; Y361-T363 PolarHBondContact O-N 3.36Å; T363-G365 PolarHBondContact O-N 2.96Å; T363-V366 WeakPolarHBondContact O-CB 3.18Å; T363-V366 PolarHBondContact O-N 3.09Å; T363-V366 VanDerWaalsContact O-N 3.12Å; T363-Y371 HydrophobicContact CG2-CE1 4.45Å; T363-Y371 HydrophobicContact CG2-CE2 4.4Å
364	K	95.9	Very high	98.3	Very high	177 Å²	177	36.8 Å²	36.8	77%	0.77	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.8	123.4	-176.9	-175.8	-179.6	178.1	-177.3	0	110.1	W357 Y361 V366	W357-K364 WeakPolarHBondContact CH2-O 3.46Å; Y361-K364 PolarHBondContact O-N 2.81Å; K364-V366 PolarHBondContact O-N 3.1Å
365	G	95.9	Very high	98.3	Very high	67 Å²	67	37.8 Å²	37.8	69%	0.691	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.3	-5.5	-178.6	0	0	0	0	0	114.8	T363	T363-G365 PolarHBondContact O-N 2.96Å
366	V	98.6	Very high	98.3	Very high	12 Å²	12	40.7 Å²	40.7	7%	0.073	21%	0.213	C	C	.	.			trans	-81.5	123.7	176.1	-172.9	0	0	0	0	110	L53 W332 W357 T363 K364 K368 N370 Y371	L53-V366 HydrophobicContact CD1-CG2 3.94Å; L53-V366 HydrophobicContact CD2-CG1 3.89Å; L53-V366 HydrophobicContact CD2-CG2 4.36Å; W332-V366 HydrophobicContact CB-CG2 4.24Å; W332-V366 HydrophobicContact CD2-CB 4.43Å; W332-V366 HydrophobicContact CD2-CG1 4.05Å; W332-V366 HydrophobicContact CD2-CG2 3.82Å; W332-V366 HydrophobicContact CE3-CG2 3.96Å; W332-V366 HydrophobicContact CG-CB 4.38Å; W332-V366 HydrophobicContact CG-CG1 4.29Å; W332-V366 HydrophobicContact CG-CG2 3.94Å; W332-V366 HydrophobicContact CZ2-CG1 4.23Å; W357-V366 HydrophobicContact CH2-CG2 3.83Å; W357-V366 HydrophobicContact CZ3-CG2 3.52Å; T363-V366 WeakPolarHBondContact O-CB 3.18Å; T363-V366 PolarHBondContact O-N 3.09Å; T363-V366 VanDerWaalsContact O-N 3.12Å; K364-V366 PolarHBondContact O-N 3.1Å; V366-K368 PolarHBondContact O-N 3.43Å; V366-N370 HydrophobicContact CG1-CB 4.37Å; V366-Y371 HydrophobicContact CB-CD1 4.41Å; V366-Y371 HydrophobicContact CB-CE1 4.06Å; V366-Y371 HydrophobicContact CG1-CD1 3.62Å; V366-Y371 HydrophobicContact CG1-CE1 3.75Å
367	P	98.5	Very high	98.3	Very high	24 Å²	24	44 Å²	44	16%	0.156	23%	0.225	C	C	.	.			trans	-59.2	128.2	174.7	-22	33.4	0	0	0	110.7	K87 C369 N370	K87-P367 HydrophobicContact CB-CG 4.43Å; K87-P367 HydrophobicContact CG-CG 3.85Å; P367-C369 PolarHBondContact O-N 3.35Å; P367-C369 VanDerWaalsContact O-N 3.09Å; P367-N370 WeakPolarHBondContact O-CB 3.5Å; P367-N370 PolarHBondContact O-N 3.35Å
368	K	98.4	Very high	98.3	Very high	148 Å²	148	50.3 Å²	50.3	64%	0.643	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-58.3	-29.4	-176.1	-171.9	172	-179.4	177.9	0	112.9	V366 N370 Y371 S372	V366-K368 PolarHBondContact O-N 3.43Å; K368-N370 PolarHBondContact O-N 2.54Å; K368-Y371 PolarHBondContact O-N 3.06Å; K368-S372 WeakPolarHBondContact O-CB 3.29Å; K368-S372 PolarHBondContact O-N 2.91Å; K368-S372 PolarHBondContact O-OG 3.08Å
369	C	98.3	Very high	98.3	Very high	29 Å²	29	54.3 Å²	54.3	20%	0.196	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-64.4	-22.8	175.8	55	0	0	0	0	113.5	I89 T90 V91 P367 Y371	I89-C369 CarbonylContact O-C 3.58Å; I89-C369 WeakPolarHBondContact O-CB 3.49Å; I89-C369 PolarHBondContact O-SG 2.76Å; T90-C369 WeakPolarHBondContact CA-O 3.27Å; T90-C369 HydrophobicContact CG2-CB 4.49Å; V91-C369 PolarHBondContact N-O 2.85Å; P367-C369 PolarHBondContact O-N 3.35Å; P367-C369 VanDerWaalsContact O-N 3.09Å; C369-Y371 VanDerWaalsContact C-N 3.29Å; C369-Y371 PolarHBondContact O-N 3.11Å
370	N	98.8	Very high	98.3	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-74.6	-16.6	-178.9	-69.2	33	0	0	0	113.7	A56 L60 L86 I89 V91 W332 V366 P367 K368	A56-N370 WeakPolarHBondContact CB-O 3.47Å; L60-N370 HydrophobicContact CD1-CB 4.29Å; L86-N370 WeakPolarHBondContact CD1-ND2 3.32Å; L86-N370 WeakPolarHBondContact CG-ND2 3.39Å; L86-N370 PolarHBondContact O-OD1 3.14Å; I89-N370 PolarHBondContact O-OD1 3.02Å; V91-N370 VanDerWaalsContact CB-O 3.25Å; V91-N370 WeakPolarHBondContact CB-O 3.43Å; V91-N370 VanDerWaalsContact CG2-O 3.23Å; V91-N370 WeakPolarHBondContact CG2-O 3.37Å; W332-N370 PolarHBondContact NE1-ND2 2.91Å; V366-N370 HydrophobicContact CG1-CB 4.37Å; P367-N370 WeakPolarHBondContact O-CB 3.5Å; P367-N370 PolarHBondContact O-N 3.35Å; K368-N370 PolarHBondContact O-N 2.54Å
371	Y	98.6	Very high	98.3	Very high	30 Å²	30	55.5 Å²	55.5	12%	0.118	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-142.8	-17	-176	66.8	-92.3	0	0	0	114.8	V52 L53 T363 V366 K368 C369 K373 L374 R377	V52-Y371 HydrophobicContact CG1-CD2 4.02Å; V52-Y371 HydrophobicContact CG1-CG 4.25Å; L53-Y371 HydrophobicContact CD2-CD1 4.09Å; L53-Y371 HydrophobicContact CD2-CG 4.25Å; T363-Y371 HydrophobicContact CG2-CE1 4.45Å; T363-Y371 HydrophobicContact CG2-CE2 4.4Å; V366-Y371 HydrophobicContact CB-CD1 4.41Å; V366-Y371 HydrophobicContact CB-CE1 4.06Å; V366-Y371 HydrophobicContact CG1-CD1 3.62Å; V366-Y371 HydrophobicContact CG1-CE1 3.75Å; K368-Y371 PolarHBondContact O-N 3.06Å; C369-Y371 VanDerWaalsContact C-N 3.29Å; C369-Y371 PolarHBondContact O-N 3.11Å; Y371-K373 PolarHBondContact O-N 3.41Å; Y371-K373 VanDerWaalsContact O-N 3.15Å; Y371-L374 VanDerWaalsContact O-CB 3.28Å; Y371-L374 WeakPolarHBondContact O-CB 3.45Å; Y371-L374 PolarHBondContact O-N 3.45Å; Y371-R377 WeakPolarHBondContact O-CD 3.46Å
372	S	98.2	Very high	98.4	Very high	33 Å²	33	58 Å²	58	23%	0.231	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-25.3	-169.8	56.8	0	0	0	0	114.8	K368 R377	K368-S372 WeakPolarHBondContact O-CB 3.29Å; K368-S372 PolarHBondContact O-N 2.91Å; K368-S372 PolarHBondContact O-OG 3.08Å; S372-R377 VanDerWaalsContact CA-NH1 3.33Å; S372-R377 PolarHBondContact O-NH1 3.36Å
373	K	98.6	Very high	98.4	Very high	126 Å²	126	57.6 Å²	57.6	55%	0.548	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.1	20.1	178.6	-64.8	-178.8	177.8	-178.6	0	112.7	T90 V91 Q92 Y371	T90-K373 HydrophobicContact CG2-CD 4.38Å; V91-K373 CarbonylContact O-C 3.51Å; V91-K373 VanDerWaalsContact O-C 3.28Å; Q92-K373 HydrophobicContact CB-CB 3.85Å; Q92-K373 HydrophobicContact CB-CD 4.43Å; Q92-K373 VanDerWaalsContact OE1-NZ 3.1Å; Y371-K373 PolarHBondContact O-N 3.41Å; Y371-K373 VanDerWaalsContact O-N 3.15Å
374	L	98.9	Very high	98.4	Very high	8 Å²	8	54.8 Å²	54.8	4%	0.042	27%	0.271	C	S	.	.			trans	-55.8	138.9	178.3	177.9	67.4	0	0	0	110.7	V52 G55 A56 A59 V91 V98 Y371 Y376 R377 L380	V52-L374 HydrophobicContact CG1-CD2 4.2Å; V52-L374 WeakPolarHBondContact O-CD2 3.44Å; G55-L374 WeakPolarHBondContact O-CD1 3.42Å; A56-L374 HydrophobicContact CB-CD2 4.35Å; A59-L374 HydrophobicContact CB-CD1 4.09Å; V91-L374 HydrophobicContact CG1-CD1 3.58Å; V91-L374 PolarHBondContact O-N 2.86Å; V98-L374 HydrophobicContact CG1-CD1 3.83Å; Y371-L374 VanDerWaalsContact O-CB 3.28Å; Y371-L374 WeakPolarHBondContact O-CB 3.45Å; Y371-L374 PolarHBondContact O-N 3.45Å; L374-Y376 PolarHBondContact O-N 2.95Å; L374-R377 HydrophobicContact CB-CB 4.32Å; L374-R377 VanDerWaalsContact O-CB 3.31Å; L374-R377 WeakPolarHBondContact O-CB 3.47Å; L374-R377 PolarHBondContact O-N 3.32Å; L374-L380 HydrophobicContact CD2-CD1 3.85Å
375	E	98.8	Very high	98.6	Very high	22 Å²	22	51 Å²	51	10%	0.103	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	136.8	171	-173.7	178.2	-162.5	0	0	110.5	L93 V98 R139 R377	L93-E375 HydrophobicContact CD1-CB 4.47Å; L93-E375 HydrophobicContact CD1-CG 4.06Å; L93-E375 HydrophobicContact CG-CB 4.33Å; L93-E375 HydrophobicContact CG-CG 4.39Å; V98-E375 HydrophobicContact CG1-CB 4.35Å; V98-E375 HydrophobicContact CG2-CG 4.46Å; V98-E375 WeakPolarHBondContact CG2-OE2 3.21Å; V98-E375 PolarHBondContact N-OE2 3.28Å; V98-E375 VanDerWaalsContact N-OE2 3.07Å; R139-E375 IonicContact CZ-OE1 2.69Å; R139-E375 IonicContact CZ-OE2 2.71Å; R139-E375 IonicContact NH1-OE1 3.98Å; R139-E375 PolarHBondContact NH1-OE1 2.99Å; R139-E375 IonicContact NH1-OE2 2.7Å; R139-E375 PolarHBondContact NH1-OE2 3.48Å; R139-E375 IonicContact NH2-OE1 2.69Å; R139-E375 PolarHBondContact NH2-OE1 3.48Å; R139-E375 IonicContact NH2-OE2 2.83Å; E375-R377 PolarHBondContact O-N 3.18Å
376	Y	98.8	Very high	98.7	Very high	61 Å²	61	52.9 Å²	52.9	24%	0.239	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.8	14.2	-178.2	-52	-40.4	0	0	0	117	V98 V103 L106 D135 R139 L374 D378 R379 L380	V98-Y376 HydrophobicContact CG2-CD2 4.01Å; V98-Y376 HydrophobicContact CG2-CE2 4.19Å; V103-Y376 HydrophobicContact CG2-CE2 4.28Å; L106-Y376 HydrophobicContact CD1-CD2 4.05Å; L106-Y376 HydrophobicContact CD1-CG 4.16Å; D135-Y376 VanDerWaalsContact CG-OH 3.23Å; D135-Y376 PolarHBondContact OD1-OH 3.41Å; D135-Y376 WeakPolarHBondContact OD2-CE2 3.48Å; D135-Y376 VanDerWaalsContact OD2-CZ 3.27Å; D135-Y376 PolarHBondContact OD2-OH 3.06Å; R139-Y376 PolarHBondContact NH2-OH 3.39Å; R139-Y376 VanDerWaalsContact NH2-OH 3.14Å; L374-Y376 PolarHBondContact O-N 2.95Å; Y376-D378 VanDerWaalsContact C-N 3.27Å; Y376-D378 PolarHBondContact O-N 3.33Å; Y376-D378 VanDerWaalsContact O-N 3.14Å; Y376-R379 WeakPolarHBondContact O-CA 3.47Å; Y376-R379 WeakPolarHBondContact O-CB 3.34Å; Y376-R379 PolarHBondContact O-N 2.72Å; Y376-L380 PolarHBondContact O-N 2.96Å
377	R	98.8	Very high	98.7	Very high	70 Å²	70	52.3 Å²	52.3	26%	0.264	24%	0.24	S	C	.	.	H	α-helix	trans	-47.4	-46.7	177.7	-177.5	-178.7	174.1	-163.7	-6.9	113.7	V52 Y371 S372 L374 E375 R379 L380 E381	V52-R377 HydrophobicContact CG1-CG 4.47Å; V52-R377 HydrophobicContact CG2-CG 4.26Å; Y371-R377 WeakPolarHBondContact O-CD 3.46Å; S372-R377 VanDerWaalsContact CA-NH1 3.33Å; S372-R377 PolarHBondContact O-NH1 3.36Å; L374-R377 HydrophobicContact CB-CB 4.32Å; L374-R377 VanDerWaalsContact O-CB 3.31Å; L374-R377 WeakPolarHBondContact O-CB 3.47Å; L374-R377 PolarHBondContact O-N 3.32Å; E375-R377 PolarHBondContact O-N 3.18Å; R377-R379 VanDerWaalsContact C-N 3.31Å; R377-R379 PolarHBondContact O-N 2.89Å; R377-L380 PolarHBondContact O-N 3.3Å; R377-E381 HydrophobicContact CG-CG 4.39Å; R377-E381 IonicContact CZ-OE1 3.47Å; R377-E381 VanDerWaalsContact CZ-OE1 3.28Å; R377-E381 IonicContact NE-OE1 3.64Å; R377-E381 PolarHBondContact NE-OE1 3.43Å; R377-E381 IonicContact NH2-OE1 3.84Å; R377-E381 PolarHBondContact NH2-OE1 2.85Å; R377-E381 WeakPolarHBondContact O-CG 3.29Å; R377-E381 PolarHBondContact O-N 2.86Å
378	D	98.8	Very high	98.7	Very high	133 Å²	133	54.1 Å²	54.1	71%	0.711	25%	0.245	S	C	*	.	H	α-helix	trans	-64.3	-35.8	-178.8	-68.7	-21.6	0	0	0	112.4	Y376 H382	Y376-D378 VanDerWaalsContact C-N 3.27Å; Y376-D378 PolarHBondContact O-N 3.33Å; Y376-D378 VanDerWaalsContact O-N 3.14Å; D378-H382 VanDerWaalsContact O-CB 3.26Å; D378-H382 WeakPolarHBondContact O-CB 3.47Å; D378-H382 PolarHBondContact O-N 3.05Å
379	R	98.8	Very high	98.7	Very high	83 Å²	83	50.1 Å²	50.1	31%	0.313	24%	0.239	S	C	.	.	H	α-helix	trans	-68.1	-44.4	174.5	-69.8	170.9	62.8	-158.4	1.4	110.8	L106 E110 Y376 R377 H382 C383	L106-R379 HydrophobicContact CD1-CB 4.48Å; L106-R379 HydrophobicContact CD2-CB 4.08Å; E110-R379 IonicContact OE1-CZ 2.63Å; E110-R379 IonicContact OE1-NE 2.84Å; E110-R379 PolarHBondContact OE1-NE 3.29Å; E110-R379 VanDerWaalsContact OE1-NE 3.12Å; E110-R379 IonicContact OE1-NH2 3.12Å; E110-R379 PolarHBondContact OE1-NH2 3.45Å; E110-R379 IonicContact OE2-NH2 3.89Å; Y376-R379 WeakPolarHBondContact O-CA 3.47Å; Y376-R379 WeakPolarHBondContact O-CB 3.34Å; Y376-R379 PolarHBondContact O-N 2.72Å; R377-R379 VanDerWaalsContact C-N 3.31Å; R377-R379 PolarHBondContact O-N 2.89Å; R379-H382 WeakPolarHBondContact O-CB 3.38Å; R379-H382 PolarHBondContact O-N 2.87Å; R379-C383 PolarHBondContact O-N 3.37Å; R379-C383 PolarHBondContact O-SG 2.81Å
380	L	98.9	Very high	98.7	Very high	1 Å²	1	51.9 Å²	51.9	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-59.9	-47.8	176.4	-70.2	165.5	0	0	0	111.3	M51 V52 T102 L106 L374 Y376 R377 H382 C383 A384	M51-L380 HydrophobicContact CB-CB 4.2Å; M51-L380 HydrophobicContact CB-CD2 4.27Å; M51-L380 HydrophobicContact CE-CD2 3.99Å; V52-L380 HydrophobicContact CG2-CB 4.12Å; T102-L380 HydrophobicContact CG2-CD1 4.23Å; T102-L380 HydrophobicContact CG2-CD2 4.17Å; L106-L380 HydrophobicContact CD1-CD2 4.08Å; L106-L380 HydrophobicContact CD1-CG 4.22Å; L106-L380 HydrophobicContact CD2-CD2 3.57Å; L106-L380 HydrophobicContact CD2-CG 3.99Å; L106-L380 HydrophobicContact CG-CD2 3.62Å; L106-L380 HydrophobicContact CG-CG 4.22Å; L374-L380 HydrophobicContact CD2-CD1 3.85Å; Y376-L380 PolarHBondContact O-N 2.96Å; R377-L380 PolarHBondContact O-N 3.3Å; L380-H382 VanDerWaalsContact C-N 3.34Å; L380-H382 PolarHBondContact O-N 3.27Å; L380-C383 PolarHBondContact O-N 3.29Å; L380-A384 WeakPolarHBondContact O-CB 3.3Å; L380-A384 PolarHBondContact O-N 3.02Å
381	E	98.9	Very high	98.5	Very high	26 Å²	26	52.4 Å²	52.4	12%	0.121	25%	0.25	C	C	.	.	H	α-helix	trans	-65.4	-35.7	176.8	-72	-167.2	-167.2	0	0	112.4	K48 V52 R377 K385	K48-E381 WeakPolarHBondContact CE-OE2 3.33Å; K48-E381 IonicContact NZ-OE2 2.76Å; V52-E381 HydrophobicContact CG2-CG 3.6Å; R377-E381 HydrophobicContact CG-CG 4.39Å; R377-E381 IonicContact CZ-OE1 3.47Å; R377-E381 VanDerWaalsContact CZ-OE1 3.28Å; R377-E381 IonicContact NE-OE1 3.64Å; R377-E381 PolarHBondContact NE-OE1 3.43Å; R377-E381 IonicContact NH2-OE1 3.84Å; R377-E381 PolarHBondContact NH2-OE1 2.85Å; R377-E381 WeakPolarHBondContact O-CG 3.29Å; R377-E381 PolarHBondContact O-N 2.86Å; E381-K385 VanDerWaalsContact O-CG 3.29Å; E381-K385 WeakPolarHBondContact O-CG 3.47Å; E381-K385 PolarHBondContact O-N 3.07Å; E381-K385 VanDerWaalsContact O-N 3.12Å
382	H	98.9	Very high	98.1	Very high	98 Å²	98	57 Å²	57	45%	0.454	27%	0.272	S	S	.	.	H	α-helix	trans	-63.7	-51.2	175.2	-179.7	81.9	0	0	0	111.5	D378 R379 L380 A384 K385 K386	D378-H382 VanDerWaalsContact O-CB 3.26Å; D378-H382 WeakPolarHBondContact O-CB 3.47Å; D378-H382 PolarHBondContact O-N 3.05Å; R379-H382 WeakPolarHBondContact O-CB 3.38Å; R379-H382 PolarHBondContact O-N 2.87Å; L380-H382 VanDerWaalsContact C-N 3.34Å; L380-H382 PolarHBondContact O-N 3.27Å; H382-A384 VanDerWaalsContact C-N 3.33Å; H382-A384 PolarHBondContact O-N 3.3Å; H382-K385 PolarHBondContact O-N 2.8Å; H382-K386 WeakPolarHBondContact O-CG 3.49Å; H382-K386 PolarHBondContact O-N 3.34Å; H382-K386 VanDerWaalsContact O-N 3.11Å
383	C	98.9	Very high	98.1	Very high	2 Å²	2	58.2 Å²	58.2	1%	0.014	27%	0.274	C	S	.	.	H	α-helix	trans	-59.1	-45	177.1	-71.9	0	0	0	0	111.1	A109 R379 L380 K385 K386 L387	A109-C383 HydrophobicContact CB-CB 3.95Å; R379-C383 PolarHBondContact O-N 3.37Å; R379-C383 PolarHBondContact O-SG 2.81Å; L380-C383 PolarHBondContact O-N 3.29Å; C383-K385 PolarHBondContact O-N 2.95Å; C383-K386 PolarHBondContact O-N 3.09Å; C383-L387 WeakPolarHBondContact O-CB 3.34Å; C383-L387 VanDerWaalsContact O-CG 3.27Å; C383-L387 WeakPolarHBondContact O-CG 3.47Å; C383-L387 PolarHBondContact O-N 3.4Å
384	A	98.9	Very high	98.1	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-55.2	-47.9	176.9	0	0	0	0	0	113.1	Y47 K48 M51 L380 H382 K386 L387 Y388	Y47-A384 WeakPolarHBondContact O-CB 3.38Å; K48-A384 HydrophobicContact CB-CB 4.33Å; K48-A384 HydrophobicContact CG-CB 3.91Å; M51-A384 HydrophobicContact CB-CB 4.12Å; M51-A384 HydrophobicContact CG-CB 3.76Å; L380-A384 WeakPolarHBondContact O-CB 3.3Å; L380-A384 PolarHBondContact O-N 3.02Å; H382-A384 VanDerWaalsContact C-N 3.33Å; H382-A384 PolarHBondContact O-N 3.3Å; A384-K386 VanDerWaalsContact C-N 3.34Å; A384-K386 PolarHBondContact O-N 3.07Å; A384-L387 PolarHBondContact O-N 3.4Å; A384-Y388 WeakPolarHBondContact O-CB 3.4Å; A384-Y388 PolarHBondContact O-N 3.07Å
385	K	98.9	Very high	98	Very high	99 Å²	99	57.2 Å²	57.2	43%	0.43	27%	0.272	S	S	.	.	H	α-helix	trans	-62	-41.6	178.6	-72.3	167.1	-174.5	168.4	0	112	V44 K48 E381 H382 C383 A389	V44-K385 HydrophobicContact CG2-CB 4.39Å; V44-K385 HydrophobicContact CG2-CG 3.91Å; K48-K385 HydrophobicContact CD-CG 4.23Å; K48-K385 HydrophobicContact CG-CG 4.33Å; E381-K385 VanDerWaalsContact O-CG 3.29Å; E381-K385 WeakPolarHBondContact O-CG 3.47Å; E381-K385 PolarHBondContact O-N 3.07Å; E381-K385 VanDerWaalsContact O-N 3.12Å; H382-K385 PolarHBondContact O-N 2.8Å; C383-K385 PolarHBondContact O-N 2.95Å; K385-A389 PolarHBondContact O-N 2.9Å; K385-A389 VanDerWaalsContact O-N 3.16Å
386	K	98.8	Very high	98	Very high	105 Å²	105	59.3 Å²	59.3	46%	0.457	28%	0.282	S	S	.	.	H	α-helix	trans	-71.5	-40.5	179.9	-70.8	-68.3	-173.2	175.8	0	112.4	I113 H382 C383 A384 A389 L390	I113-K386 HydrophobicContact CB-CB 3.74Å; I113-K386 HydrophobicContact CD1-CB 4.35Å; I113-K386 HydrophobicContact CD1-CG 4.39Å; I113-K386 HydrophobicContact CG2-CB 3.47Å; I113-K386 VanDerWaalsContact CG2-CB 3.47Å; H382-K386 WeakPolarHBondContact O-CG 3.49Å; H382-K386 PolarHBondContact O-N 3.34Å; H382-K386 VanDerWaalsContact O-N 3.11Å; C383-K386 PolarHBondContact O-N 3.09Å; A384-K386 VanDerWaalsContact C-N 3.34Å; A384-K386 PolarHBondContact O-N 3.07Å; K386-A389 PolarHBondContact O-N 3.18Å; K386-L390 WeakPolarHBondContact O-CG 3.33Å; K386-L390 PolarHBondContact O-N 2.68Å; K386-L390 VanDerWaalsContact O-N 3.13Å
387	L	98.8	Very high	97.9	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-59.2	-48.2	172.5	-72.5	168.4	0	0	0	110.3	Y47 M51 A109 L112 I113 C179 L182 R183 C383 A384 A389 L390 S391	Y47-L387 HydrophobicContact CD1-CB 4.21Å; Y47-L387 HydrophobicContact CE1-CB 4.3Å; M51-L387 HydrophobicContact SD-CD1 4.4Å; A109-L387 HydrophobicContact CB-CD1 4.26Å; L112-L387 HydrophobicContact CB-CD2 3.81Å; L112-L387 HydrophobicContact CD1-CD2 4.26Å; I113-L387 HydrophobicContact CG2-CD2 3.94Å; I113-L387 HydrophobicContact CG2-CG 3.74Å; C179-L387 HydrophobicContact CB-CD1 3.91Å; L182-L387 HydrophobicContact CB-CB 4.42Å; L182-L387 HydrophobicContact CB-CD1 4.17Å; L182-L387 HydrophobicContact CD2-CD1 4.04Å; R183-L387 HydrophobicContact CB-CD2 4.02Å; C383-L387 WeakPolarHBondContact O-CB 3.34Å; C383-L387 VanDerWaalsContact O-CG 3.27Å; C383-L387 WeakPolarHBondContact O-CG 3.47Å; C383-L387 PolarHBondContact O-N 3.4Å; A384-L387 PolarHBondContact O-N 3.4Å; L387-A389 VanDerWaalsContact C-N 3.33Å; L387-A389 PolarHBondContact O-N 2.63Å; L387-L390 PolarHBondContact O-N 3.27Å; L387-L390 VanDerWaalsContact O-N 3.1Å; L387-S391 WeakPolarHBondContact O-CB 3.26Å; L387-S391 PolarHBondContact O-N 3.33Å; L387-S391 PolarHBondContact O-OG 2.97Å
388	Y	98.6	Very high	97.9	Very high	63 Å²	63	58.5 Å²	58.5	25%	0.247	29%	0.286	C	S	.	.	H	α-helix	trans	-55.1	-48	177.9	-176	-98.3	0	0	0	112.2	V44 Y47 A384 L390 S391 H392	V44-Y388 HydrophobicContact CB-CD1 3.76Å; V44-Y388 HydrophobicContact CB-CD2 4.34Å; V44-Y388 HydrophobicContact CB-CE1 4.05Å; V44-Y388 HydrophobicContact CB-CG 3.91Å; V44-Y388 HydrophobicContact CG2-CD1 4.09Å; V44-Y388 HydrophobicContact CG2-CG 4.1Å; Y47-Y388 HydrophobicContact CD1-CD2 4.2Å; Y47-Y388 HydrophobicContact CD1-CG 4.49Å; Y47-Y388 AromaticContact CD2-CD2 3.69Å; Y47-Y388 HydrophobicContact CD2-CD2 3.69Å; Y47-Y388 HydrophobicContact CD2-CE2 4.43Å; Y47-Y388 HydrophobicContact CE1-CD2 4.29Å; Y47-Y388 AromaticContact CE2-CD2 3.79Å; Y47-Y388 HydrophobicContact CE2-CD2 3.79Å; Y47-Y388 HydrophobicContact CE2-CE2 4.4Å; Y47-Y388 AromaticContact CG-CD2 3.91Å; Y47-Y388 HydrophobicContact CG-CD2 3.91Å; Y47-Y388 HydrophobicContact CG-CG 4.45Å; A384-Y388 WeakPolarHBondContact O-CB 3.4Å; A384-Y388 PolarHBondContact O-N 3.07Å; Y388-L390 VanDerWaalsContact C-N 3.27Å; Y388-L390 PolarHBondContact O-N 2.92Å; Y388-S391 PolarHBondContact O-N 2.93Å; Y388-S391 VanDerWaalsContact O-N 3.15Å; Y388-H392 AromaticContact CD2-CE1 3.72Å; Y388-H392 AromaticContact CD2-ND1 3.59Å; Y388-H392 AromaticContact CE2-CE1 3.51Å; Y388-H392 AromaticContact CE2-CG 3.98Å; Y388-H392 AromaticContact CE2-ND1 3.52Å; Y388-H392 AromaticContact CE2-NE2 3.92Å; Y388-H392 PolarHBondContact O-N 3.12Å; Y388-H392 VanDerWaalsContact O-N 3.1Å; Y388-H392 PolarHBondContact O-ND1 3.4Å
389	A	98.4	Very high	97.8	Very high	64 Å²	64	53.1 Å²	53.1	53%	0.529	26%	0.255	S	S	.	.	H	α-helix	trans	-70.1	-15.5	-179.9	0	0	0	0	0	115	K385 K386 L387	K385-A389 PolarHBondContact O-N 2.9Å; K385-A389 VanDerWaalsContact O-N 3.16Å; K386-A389 PolarHBondContact O-N 3.18Å; L387-A389 VanDerWaalsContact C-N 3.33Å; L387-A389 PolarHBondContact O-N 2.63Å
390	L	97.6	Very high	97.7	Very high	66 Å²	66	50.8 Å²	50.8	35%	0.346	25%	0.251	S	S	.	.	H	α-helix	trans	-92.6	-10.5	173.6	-73.4	171.2	0	0	0	112.5	R183 K386 L387 Y388	R183-L390 PolarHBondContact NH1-O 3.34Å; K386-L390 WeakPolarHBondContact O-CG 3.33Å; K386-L390 PolarHBondContact O-N 2.68Å; K386-L390 VanDerWaalsContact O-N 3.13Å; L387-L390 PolarHBondContact O-N 3.27Å; L387-L390 VanDerWaalsContact O-N 3.1Å; Y388-L390 VanDerWaalsContact C-N 3.27Å; Y388-L390 PolarHBondContact O-N 2.92Å
391	S	95.4	Very high	97.6	Very high	10 Å²	10	55 Å²	55	7%	0.07	27%	0.271	C	S	.	.	H	α-helix	trans	-111.8	-14.2	-173.7	-61.4	0	0	0	0	113.6	L182 R183 L387 Y388	L182-S391 PolarHBondContact O-OG 3.44Å; R183-S391 VanDerWaalsContact C-OG 3.23Å; R183-S391 VanDerWaalsContact CA-OG 3.29Å; R183-S391 WeakPolarHBondContact CA-OG 3.47Å; R183-S391 PolarHBondContact O-OG 3.14Å; L387-S391 WeakPolarHBondContact O-CB 3.26Å; L387-S391 PolarHBondContact O-N 3.33Å; L387-S391 PolarHBondContact O-OG 2.97Å; Y388-S391 PolarHBondContact O-N 2.93Å; Y388-S391 VanDerWaalsContact O-N 3.15Å
392	H	89.4	Confident	97.5	Very high	127 Å²	127	57.6 Å²	57.6	59%	0.588	29%	0.285	S	S	*	.			trans	-135.8	0	176.5	-55	77.2	0	0	0	108.1	Y47 Y388	Y47-H392 AromaticContact CZ-CE1 3.94Å; Y47-H392 PolarHBondContact OH-CE1 3.3Å; Y388-H392 AromaticContact CD2-CE1 3.72Å; Y388-H392 AromaticContact CD2-ND1 3.59Å; Y388-H392 AromaticContact CE2-CE1 3.51Å; Y388-H392 AromaticContact CE2-CG 3.98Å; Y388-H392 AromaticContact CE2-ND1 3.52Å; Y388-H392 AromaticContact CE2-NE2 3.92Å; Y388-H392 PolarHBondContact O-N 3.12Å; Y388-H392 VanDerWaalsContact O-N 3.1Å; Y388-H392 PolarHBondContact O-ND1 3.4Å

Retrieved 392 of 392 residues in 132.8 ms (Link to these results)

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