A0A5K4F1F5_SCHMA Loading...

Armadillo segment polarity protein

AlphaFold DB , UniProt , Accession A0A5K4F1F5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 692 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	26.5	Very low	31.2	Very low	245 Å²	245	115.5 Å²	115.5	100%	1.207	56%	0.56	S	S	*	*				0	129.5	0	-81.3	176.2	147.7	0	0	108.3	K3	M1-K3 PolarHBondContact O-N 2.88Å
2	K	24.4	Very low	31.6	Very low	189 Å²	189	110.9 Å²	110.9	82%	0.822	54%	0.541	S	S	*	.			trans	-54.4	129.8	-168.3	-71.4	175.3	174.6	177.9	0	112.2	H4	K2-H4 PolarHBondContact O-N 3.03Å
3	K	24.9	Very low	32.3	Very low	208 Å²	208	103.4 Å²	103.4	90%	0.904	51%	0.506	S	S	*	.			trans	-59.1	101.1	171.1	-75.4	-177.6	175.7	-176.8	0	108.8	M1	M1-K3 PolarHBondContact O-N 2.88Å
4	H	27	Very low	32.7	Very low	127 Å²	127	104.7 Å²	104.7	59%	0.588	51%	0.508	S	S	*	.			trans	-110.1	98.9	165.1	-79.8	-69.4	0	0	0	108	K2 H6	K2-H4 PolarHBondContact O-N 3.03Å; H4-H6 AromaticContact CG-NE2 4Å; H4-H6 AromaticContact ND1-NE2 3.57Å; H4-H6 PolarHBondContact O-N 3.4Å
5	S	26.5	Very low	33.1	Very low	83 Å²	83	106 Å²	106	58%	0.58	51%	0.513	S	S	*	.			trans	-70.6	91.8	160.5	47.2	0	0	0	0	108.2
6	H	31.8	Very low	33.6	Very low	149 Å²	149	100.8 Å²	100.8	69%	0.69	49%	0.487	S	S	*	.			trans	-113.6	78.4	167.6	-72.6	-51.7	0	0	0	108.8	H4	H4-H6 AromaticContact CG-NE2 4Å; H4-H6 AromaticContact ND1-NE2 3.57Å; H4-H6 PolarHBondContact O-N 3.4Å
7	V	39.3	Very low	33.8	Very low	34 Å²	34	100.3 Å²	100.3	21%	0.206	48%	0.483	C	S	.	.			trans	-98.2	-11.5	168.7	176.6	0	0	0	0	111	D9 Y177 W217	V7-D9 PolarHBondContact O-N 3.22Å; V7-Y177 HydrophobicContact CG1-CD2 3.5Å; V7-Y177 HydrophobicContact CG1-CE2 3.43Å; V7-Y177 VanDerWaalsContact CG1-CE2 3.43Å; V7-Y177 HydrophobicContact CG1-CG 4.29Å; V7-W217 HydrophobicContact CG1-CH2 4.04Å
8	Y	36.3	Very low	33.9	Very low	52 Å²	52	102.3 Å²	102.3	20%	0.204	49%	0.492	C	S	.	.			trans	-95.9	96	176.4	-161.3	-94.5	0	0	0	111.6	P10 I220	Y8-P10 HydrophobicContact CE1-CB 4.49Å; Y8-I220 HydrophobicContact CD2-CD1 4.22Å; Y8-I220 HydrophobicContact CD2-CG1 4.13Å; Y8-I220 HydrophobicContact CE2-CG1 4.26Å
9	D	36.3	Very low	34.1	Very low	74 Å²	74	99.2 Å²	99.2	40%	0.396	48%	0.481	S	S	.	.			trans	-88.5	125	161.4	-172.9	-5.3	0	0	0	108	V7 Q11 K143	V7-D9 PolarHBondContact O-N 3.22Å; D9-Q11 PolarHBondContact O-N 3.05Å; D9-K143 VanDerWaalsContact CB-NZ 3.27Å; D9-K143 IonicContact OD2-NZ 3.94Å; D9-K143 PolarHBondContact OD2-NZ 3Å
10	P	35.9	Very low	34.3	Very low	30 Å²	30	99 Å²	99	20%	0.195	49%	0.486	C	S	.	.	G	3₁₀ helix	trans	-65.9	10.9	-170.3	-17.9	32	0	0	0	115.9	Y8 N12 S13 Q17	Y8-P10 HydrophobicContact CE1-CB 4.49Å; P10-N12 PolarHBondContact O-N 3.01Å; P10-N12 VanDerWaalsContact O-N 3.09Å; P10-S13 CarbonylContact O-C 3.41Å; P10-S13 WeakPolarHBondContact O-CA 3.42Å; P10-S13 PolarHBondContact O-N 2.85Å; P10-S13 PolarHBondContact O-OG 2.99Å; P10-Q17 VanDerWaalsContact CB-CD 3.46Å; P10-Q17 HydrophobicContact CB-CG 4.44Å; P10-Q17 VanDerWaalsContact CB-NE2 3.33Å
11	Q	34.9	Very low	34.2	Very low	79 Å²	79	98.3 Å²	98.3	37%	0.369	49%	0.492	S	S	.	.	G	3₁₀ helix	trans	-56.7	-26.8	-177.6	-71.5	-171	-14.5	0	0	113.4	D9 S13	D9-Q11 PolarHBondContact O-N 3.05Å; Q11-S13 PolarHBondContact O-N 2.69Å
12	N	36.1	Very low	34.6	Very low	61 Å²	61	91.9 Å²	91.9	33%	0.326	47%	0.466	S	S	.	.	G	3₁₀ helix	trans	-79	0.3	172.9	-78.1	-8.7	0	0	0	114.5	P10	P10-N12 PolarHBondContact O-N 3.01Å; P10-N12 VanDerWaalsContact O-N 3.09Å
13	S	39.8	Very low	34.8	Very low	13 Å²	13	90.2 Å²	90.2	9%	0.091	47%	0.466	C	S	.	.	G	3₁₀ helix	trans	-126.2	28.5	176.9	66.9	0	0	0	0	112.4	P10 Q11 E15 F16 Q17	P10-S13 CarbonylContact O-C 3.41Å; P10-S13 WeakPolarHBondContact O-CA 3.42Å; P10-S13 PolarHBondContact O-N 2.85Å; P10-S13 PolarHBondContact O-OG 2.99Å; Q11-S13 PolarHBondContact O-N 2.69Å; S13-E15 PolarHBondContact O-N 3.15Å; S13-E15 VanDerWaalsContact O-N 3.07Å; S13-F16 WeakPolarHBondContact O-CA 3.34Å; S13-F16 PolarHBondContact O-N 3.32Å; S13-Q17 PolarHBondContact O-N 3.21Å; S13-Q17 VanDerWaalsContact O-N 3.08Å
14	K	39.1	Very low	35	Very low	122 Å²	122	84.8 Å²	84.8	53%	0.53	45%	0.454	S	S	.	.	H	α-helix	trans	-52.2	-31.2	175.2	-82.3	-176.2	178.2	-176.4	0	112.4	F16 H18	K14-F16 PolarHBondContact O-N 3.46Å; K14-H18 WeakPolarHBondContact O-CB 3.28Å; K14-H18 PolarHBondContact O-CD2 3.47Å; K14-H18 PolarHBondContact O-N 3.26Å; K14-H18 VanDerWaalsContact O-N 3.1Å
15	E	37.7	Very low	35.2	Very low	124 Å²	124	86.3 Å²	86.3	58%	0.579	47%	0.466	S	S	*	.	H	α-helix	trans	-64.4	-34.5	172.8	-70.9	176.5	157.9	0	0	113.7	S13 S19 Y288	S13-E15 PolarHBondContact O-N 3.15Å; S13-E15 VanDerWaalsContact O-N 3.07Å; E15-S19 PolarHBondContact O-OG 3.34Å; E15-S19 VanDerWaalsContact O-OG 3.14Å; E15-Y288 PolarHBondContact OE2-OH 2.95Å; E15-Y288 VanDerWaalsContact OE2-OH 3.08Å
16	F	40.8	Very low	35.3	Very low	22 Å²	22	92.1 Å²	92.1	10%	0.096	48%	0.481	C	S	.	.	H	α-helix	trans	-84.6	-30.4	-179.3	-166.2	-95.9	0	0	0	112.8	S13 K14 S19 M284 K285 Y288 N324	S13-F16 WeakPolarHBondContact O-CA 3.34Å; S13-F16 PolarHBondContact O-N 3.32Å; K14-F16 PolarHBondContact O-N 3.46Å; F16-S19 PolarHBondContact O-OG 3.31Å; F16-S19 VanDerWaalsContact O-OG 3.1Å; F16-M284 HydrophobicContact CZ-CB 4.03Å; F16-K285 HydrophobicContact CE1-CG 4.32Å; F16-Y288 HydrophobicContact CD2-CD2 4.49Å; F16-Y288 HydrophobicContact CD2-CG 4.4Å; F16-N324 WeakPolarHBondContact CE2-ND2 3.43Å; F16-N324 WeakPolarHBondContact CZ-ND2 3.26Å
17	Q	36.9	Very low	35.4	Very low	93 Å²	93	90.5 Å²	90.5	44%	0.435	49%	0.486	S	S	.	.	H	α-helix	trans	-84.5	-35.8	179.6	-73.7	-168	-30.2	0	0	113.6	P10 S13 S19 V20	P10-Q17 VanDerWaalsContact CB-CD 3.46Å; P10-Q17 HydrophobicContact CB-CG 4.44Å; P10-Q17 VanDerWaalsContact CB-NE2 3.33Å; S13-Q17 PolarHBondContact O-N 3.21Å; S13-Q17 VanDerWaalsContact O-N 3.08Å; Q17-S19 PolarHBondContact O-N 3.13Å; Q17-V20 PolarHBondContact O-N 3.15Å
18	H	36.6	Very low	34.9	Very low	137 Å²	137	96.8 Å²	96.8	63%	0.634	52%	0.518	S	S	*	.	H	α-helix	trans	-65.9	-22.6	178.3	-92.4	-67.9	0	0	0	113.4	K14 V22	K14-H18 WeakPolarHBondContact O-CB 3.28Å; K14-H18 PolarHBondContact O-CD2 3.47Å; K14-H18 PolarHBondContact O-N 3.26Å; K14-H18 VanDerWaalsContact O-N 3.1Å; H18-V22 VanDerWaalsContact O-CG2 3.26Å; H18-V22 WeakPolarHBondContact O-CG2 3.49Å
19	S	37.2	Very low	34.8	Very low	42 Å²	42	99 Å²	99	29%	0.294	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-22	178.8	43.4	0	0	0	0	113.8	E15 F16 Q17	E15-S19 PolarHBondContact O-OG 3.34Å; E15-S19 VanDerWaalsContact O-OG 3.14Å; F16-S19 PolarHBondContact O-OG 3.31Å; F16-S19 VanDerWaalsContact O-OG 3.1Å; Q17-S19 PolarHBondContact O-N 3.13Å
20	V	38.2	Very low	34.6	Very low	95 Å²	95	101.4 Å²	101.4	58%	0.576	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	-31.4	178.6	179.4	0	0	0	0	111.8	Q17	Q17-V20 PolarHBondContact O-N 3.15Å
21	S	33.1	Very low	34.6	Very low	86 Å²	86	104.7 Å²	104.7	60%	0.601	58%	0.584	S	S	*	*	S	Bend	trans	-86.8	-9.2	-173.2	-53.7	0	0	0	0	115.3
22	V	33.9	Very low	34.6	Very low	110 Å²	110	107.1 Å²	107.1	67%	0.667	61%	0.607	S	S	*	*	S	Bend	trans	-88.6	-13.8	-174.1	177.9	0	0	0	0	112.9	H18	H18-V22 VanDerWaalsContact O-CG2 3.26Å; H18-V22 WeakPolarHBondContact O-CG2 3.49Å
23	N	29.9	Very low	34.6	Very low	154 Å²	154	109.7 Å²	109.7	82%	0.824	62%	0.624	S	S	*	*	S	Bend	trans	-98	8.9	-174.4	-79	-19.5	0	0	0	115.8
24	S	28.9	Very low	34.6	Very low	94 Å²	94	118.4 Å²	118.4	66%	0.657	66%	0.661	S	S	*	*	S	Bend	trans	-108.8	17.4	-176.4	57.7	0	0	0	0	115.8
25	L	30.5	Very low	34.7	Very low	158 Å²	158	121.7 Å²	121.7	83%	0.827	68%	0.678	S	S	*	*			trans	-130.5	65	177.3	-74.2	163.1	0	0	0	112
26	K	27.8	Very low	35.3	Very low	206 Å²	206	122.4 Å²	122.4	90%	0.896	68%	0.681	S	S	*	*			trans	-144.1	87.3	156.6	-75.2	-167.9	179.4	-179.2	0	108.6
27	S	34.1	Very low	35.6	Very low	115 Å²	115	127.8 Å²	127.8	80%	0.804	72%	0.72	S	S	*	*			trans	-117.1	109	160.4	58	0	0	0	0	107.7
28	D	29	Very low	36.6	Very low	165 Å²	165	128.2 Å²	128.2	88%	0.882	72%	0.721	S	S	*	*			trans	-59.6	127.1	166.4	-67.2	-49.3	0	0	0	109.8
29	S	35.2	Very low	38.5	Very low	99 Å²	99	124.3 Å²	124.3	69%	0.692	71%	0.708	S	S	*	*			trans	-138.9	100	157.1	62.8	0	0	0	0	109	T31	S29-T31 PolarHBondContact O-N 3.17Å
30	S	32.2	Very low	40.3	Very low	125 Å²	125	126.6 Å²	126.6	87%	0.874	73%	0.725	S	S	*	*			trans	-72.6	91	167.1	38.8	0	0	0	0	109.8
31	T	35.1	Very low	42.1	Very low	98 Å²	98	127.4 Å²	127.4	60%	0.601	73%	0.73	S	S	*	*			trans	-129.2	133.8	162	40.8	0	0	0	0	108.6	S29 T33	S29-T31 PolarHBondContact O-N 3.17Å; T31-T33 PolarHBondContact O-N 3.37Å
32	P	33.7	Very low	44.3	Very low	131 Å²	131	128.3 Å²	128.3	85%	0.851	72%	0.724	S	S	*	*			trans	-74.9	92.3	-180	30.9	-30.2	0	0	0	108.3
33	T	37.6	Very low	46.5	Very low	114 Å²	114	129.3 Å²	129.3	70%	0.699	72%	0.722	S	S	*	*			trans	-79.5	124.4	171.8	44.4	0	0	0	0	108.9	T31 H35	T31-T33 PolarHBondContact O-N 3.37Å; T33-H35 PolarHBondContact O-N 3.23Å
34	F	39.1	Very low	49	Very low	197 Å²	197	127 Å²	127	86%	0.864	71%	0.709	S	S	*	*			trans	-42.9	123.8	167.3	-86.6	-101.9	0	0	0	109.7	E36	F34-E36 PolarHBondContact O-N 2.91Å
35	H	41.5	Very low	51.8	Low	190 Å²	190	126 Å²	126	88%	0.88	70%	0.702	S	S	*	*			trans	-66.6	87.9	170.1	-98.5	-71.7	0	0	0	108.4	T33 C37	T33-H35 PolarHBondContact O-N 3.23Å; H35-C37 PolarHBondContact O-N 2.84Å
36	E	49.7	Very low	54.5	Low	140 Å²	140	120.1 Å²	120.1	65%	0.654	68%	0.679	S	S	*	*			trans	-61.9	113.6	156.9	-79.6	-177.9	161.7	0	0	106.9	F34 F38	F34-E36 PolarHBondContact O-N 2.91Å; E36-F38 HydrophobicContact CB-CD2 4.35Å; E36-F38 HydrophobicContact CB-CE2 3.93Å; E36-F38 HydrophobicContact CB-CZ 4.22Å; E36-F38 WeakPolarHBondContact O-CD2 3.24Å; E36-F38 PolarHBondContact O-N 3.4Å
37	C	46.6	Very low	57.5	Low	134 Å²	134	114 Å²	114	91%	0.905	66%	0.66	S	S	*	*			trans	-74.3	78	178	-147.8	0	0	0	0	107.7	H35 S39	H35-C37 PolarHBondContact O-N 2.84Å; C37-S39 PolarHBondContact O-N 3.36Å
38	F	58.3	Low	60.2	Low	103 Å²	103	111.9 Å²	111.9	45%	0.452	64%	0.643	S	S	.	*			trans	-56.7	130	173	-72.2	-76.5	0	0	0	108.7	E36 E42 Q43	E36-F38 HydrophobicContact CB-CD2 4.35Å; E36-F38 HydrophobicContact CB-CE2 3.93Å; E36-F38 HydrophobicContact CB-CZ 4.22Å; E36-F38 WeakPolarHBondContact O-CD2 3.24Å; E36-F38 PolarHBondContact O-N 3.4Å; F38-E42 WeakPolarHBondContact CA-OE2 3.46Å; F38-E42 HydrophobicContact CB-CB 4.2Å; F38-E42 HydrophobicContact CD1-CB 3.95Å; F38-Q43 HydrophobicContact CB-CG 3.88Å
39	S	76.5	Confident	63.2	Low	54 Å²	54	107.9 Å²	107.9	38%	0.378	63%	0.628	S	S	.	*			trans	-59.2	151	172.5	66.8	0	0	0	0	109.5	C37 V41 E42 Q43	C37-S39 PolarHBondContact O-N 3.36Å; S39-V41 PolarHBondContact O-N 2.9Å; S39-E42 PolarHBondContact N-OE2 2.95Å; S39-E42 PolarHBondContact O-N 3.34Å; S39-E42 PolarHBondContact OG-N 2.73Å; S39-E42 PolarHBondContact OG-OE2 3.24Å; S39-Q43 PolarHBondContact O-N 3Å
40	S	75.1	Confident	65.9	Low	91 Å²	91	110.8 Å²	110.8	64%	0.636	63%	0.628	S	S	*	*	H	α-helix	trans	-52.1	-26.5	174.2	-51.8	0	0	0	0	112.3	L44	S40-L44 WeakPolarHBondContact O-CB 3.45Å; S40-L44 WeakPolarHBondContact O-CD1 3.23Å; S40-L44 WeakPolarHBondContact O-CG 3.34Å; S40-L44 PolarHBondContact O-N 2.88Å
41	V	77	Confident	68.7	Low	112 Å²	112	109.4 Å²	109.4	68%	0.679	61%	0.61	S	S	*	*	H	α-helix	trans	-67.9	-45.2	175.8	-178.6	0	0	0	0	111.9	S39 L44 S45	S39-V41 PolarHBondContact O-N 2.9Å; V41-L44 PolarHBondContact O-N 3.18Å; V41-S45 PolarHBondContact O-N 2.98Å
42	E	78.5	Confident	71.5	Confident	104 Å²	104	109.6 Å²	109.6	49%	0.486	61%	0.607	S	S	.	*	H	α-helix	trans	-67.6	-39.5	179.3	-73.4	162.3	144.8	0	0	111.6	F38 S39 L44 S45	F38-E42 WeakPolarHBondContact CA-OE2 3.46Å; F38-E42 HydrophobicContact CB-CB 4.2Å; F38-E42 HydrophobicContact CD1-CB 3.95Å; S39-E42 PolarHBondContact N-OE2 2.95Å; S39-E42 PolarHBondContact O-N 3.34Å; S39-E42 PolarHBondContact OG-N 2.73Å; S39-E42 PolarHBondContact OG-OE2 3.24Å; E42-L44 VanDerWaalsContact C-N 3.28Å; E42-L44 PolarHBondContact O-N 3.05Å; E42-S45 WeakPolarHBondContact O-CB 3.47Å; E42-S45 PolarHBondContact O-N 3.39Å; E42-S45 PolarHBondContact O-OG 3.4Å
43	Q	79.7	Confident	74.3	Confident	132 Å²	132	104.9 Å²	104.9	62%	0.617	58%	0.583	S	S	*	*	H	α-helix	trans	-63.8	-33.8	174.7	-64.2	-174.7	2.4	0	0	112.5	F38 S39 P47	F38-Q43 HydrophobicContact CB-CG 3.88Å; S39-Q43 PolarHBondContact O-N 3Å; Q43-P47 WeakPolarHBondContact O-CD 3.11Å
44	L	83.5	Confident	77	Confident	106 Å²	106	104.1 Å²	104.1	56%	0.555	57%	0.574	S	S	*	*	H	α-helix	trans	-82	-20.5	178.2	-73	171.9	0	0	0	113.9	S40 V41 E42 G46 P47 V48	S40-L44 WeakPolarHBondContact O-CB 3.45Å; S40-L44 WeakPolarHBondContact O-CD1 3.23Å; S40-L44 WeakPolarHBondContact O-CG 3.34Å; S40-L44 PolarHBondContact O-N 2.88Å; V41-L44 PolarHBondContact O-N 3.18Å; E42-L44 VanDerWaalsContact C-N 3.28Å; E42-L44 PolarHBondContact O-N 3.05Å; L44-G46 PolarHBondContact O-N 2.94Å; L44-P47 WeakPolarHBondContact O-CD 3.4Å; L44-V48 WeakPolarHBondContact O-CB 3.43Å; L44-V48 VanDerWaalsContact O-CG2 3.22Å; L44-V48 WeakPolarHBondContact O-CG2 3.35Å; L44-V48 PolarHBondContact O-N 3.01Å
45	S	87	Confident	79.6	Confident	72 Å²	72	98.5 Å²	98.5	50%	0.503	55%	0.552	S	S	.	*	H	α-helix	trans	-57	-45.4	-175.3	69.3	0	0	0	0	113.5	V41 E42 S49	V41-S45 PolarHBondContact O-N 2.98Å; E42-S45 WeakPolarHBondContact O-CB 3.47Å; E42-S45 PolarHBondContact O-N 3.39Å; E42-S45 PolarHBondContact O-OG 3.4Å; S45-S49 WeakPolarHBondContact O-CB 3.41Å; S45-S49 PolarHBondContact O-N 2.83Å
46	G	88	Confident	82.1	Confident	34 Å²	34	94 Å²	94	35%	0.351	53%	0.531	S	S	.	.	H	α-helix	trans	-64.2	-54.3	178.8	0	0	0	0	0	113.2	L44 V48 S49 K50	L44-G46 PolarHBondContact O-N 2.94Å; G46-V48 VanDerWaalsContact C-N 3.33Å; G46-V48 PolarHBondContact O-N 3.41Å; G46-S49 PolarHBondContact O-N 2.8Å; G46-K50 PolarHBondContact O-N 2.95Å
47	P	90.3	Very high	84.2	Confident	77 Å²	77	92.6 Å²	92.6	50%	0.5	53%	0.528	S	S	.	.	H	α-helix	trans	-55	-43.1	173.2	-28.6	35.2	0	0	0	113.9	Q43 L44 K50 L51	Q43-P47 WeakPolarHBondContact O-CD 3.11Å; L44-P47 WeakPolarHBondContact O-CD 3.4Å; P47-K50 PolarHBondContact O-N 2.94Å; P47-L51 PolarHBondContact O-N 2.95Å
48	V	91	Very high	86.4	Confident	72 Å²	72	91.8 Å²	91.8	44%	0.436	51%	0.514	S	S	.	.	H	α-helix	trans	-65.6	-41.8	178.5	170.8	0	0	0	0	111.4	L44 G46 K50 L51 N52	L44-V48 WeakPolarHBondContact O-CB 3.43Å; L44-V48 VanDerWaalsContact O-CG2 3.22Å; L44-V48 WeakPolarHBondContact O-CG2 3.35Å; L44-V48 PolarHBondContact O-N 3.01Å; G46-V48 VanDerWaalsContact C-N 3.33Å; G46-V48 PolarHBondContact O-N 3.41Å; V48-K50 PolarHBondContact O-N 3.38Å; V48-L51 PolarHBondContact O-N 3.37Å; V48-N52 PolarHBondContact O-N 2.93Å
49	S	91.2	Very high	88.1	Confident	81 Å²	81	90.5 Å²	90.5	57%	0.566	51%	0.511	S	S	*	.	H	α-helix	trans	-61.7	-42.5	175.3	178.2	0	0	0	0	112	S45 G46 L51 N52 G53	S45-S49 WeakPolarHBondContact O-CB 3.41Å; S45-S49 PolarHBondContact O-N 2.83Å; G46-S49 PolarHBondContact O-N 2.8Å; S49-L51 PolarHBondContact O-N 3.2Å; S49-N52 PolarHBondContact O-N 3.08Å; S49-G53 PolarHBondContact O-N 3.4Å
50	K	91.5	Very high	88.9	Confident	159 Å²	159	91.2 Å²	91.2	69%	0.691	51%	0.51	S	S	*	.	H	α-helix	trans	-61.9	-42.2	173.8	-72.5	179.1	-178.3	178.3	0	112	G46 P47 V48 G53 I54	G46-K50 PolarHBondContact O-N 2.95Å; P47-K50 PolarHBondContact O-N 2.94Å; V48-K50 PolarHBondContact O-N 3.38Å; K50-G53 PolarHBondContact O-N 3.14Å; K50-I54 WeakPolarHBondContact O-CG1 3.37Å; K50-I54 PolarHBondContact O-N 3.28Å
51	L	91.7	Very high	89.8	Confident	97 Å²	97	91.1 Å²	91.1	51%	0.508	50%	0.497	S	S	.	.	H	α-helix	trans	-62.3	-44.8	176.8	-179.7	61.8	0	0	0	111.5	P47 V48 S49 G53 I54 I55	P47-L51 PolarHBondContact O-N 2.95Å; V48-L51 PolarHBondContact O-N 3.37Å; S49-L51 PolarHBondContact O-N 3.2Å; L51-G53 VanDerWaalsContact C-N 3.3Å; L51-G53 PolarHBondContact O-N 3.49Å; L51-I54 PolarHBondContact O-N 3.02Å; L51-I55 HydrophobicContact CD1-CD1 4.28Å; L51-I55 HydrophobicContact CD1-CG1 4.46Å; L51-I55 HydrophobicContact CG-CD1 4.04Å; L51-I55 WeakPolarHBondContact O-CG1 3.24Å; L51-I55 PolarHBondContact O-N 2.88Å
52	N	93.1	Very high	90.6	Very high	101 Å²	101	91.6 Å²	91.6	54%	0.54	49%	0.49	S	S	.	.	H	α-helix	trans	-59.8	-40.9	175.2	-77.4	-11	0	0	0	111.8	V48 S49 I55 Q56	V48-N52 PolarHBondContact O-N 2.93Å; S49-N52 PolarHBondContact O-N 3.08Å; N52-I55 PolarHBondContact O-N 3.41Å; N52-Q56 PolarHBondContact O-N 3.46Å
53	G	93.7	Very high	91.3	Very high	33 Å²	33	90.5 Å²	90.5	34%	0.34	49%	0.487	S	S	.	.	H	α-helix	trans	-59	-48.8	173.7	0	0	0	0	0	112.6	S49 K50 L51 I55 Q56 D57	S49-G53 PolarHBondContact O-N 3.4Å; K50-G53 PolarHBondContact O-N 3.14Å; L51-G53 VanDerWaalsContact C-N 3.3Å; L51-G53 PolarHBondContact O-N 3.49Å; G53-I55 VanDerWaalsContact C-N 3.32Å; G53-I55 PolarHBondContact O-N 3.17Å; G53-Q56 PolarHBondContact O-N 3.34Å; G53-Q56 VanDerWaalsContact O-N 3.17Å; G53-D57 VanDerWaalsContact O-CG 3.32Å; G53-D57 PolarHBondContact O-N 3.42Å
54	I	93.9	Very high	92	Very high	98 Å²	98	88.1 Å²	88.1	50%	0.503	48%	0.479	S	S	.	.	H	α-helix	trans	-61	-40.4	177.9	-67	165.3	0	0	0	111.6	K50 L51 D57 L58	K50-I54 WeakPolarHBondContact O-CG1 3.37Å; K50-I54 PolarHBondContact O-N 3.28Å; L51-I54 PolarHBondContact O-N 3.02Å; I54-D57 PolarHBondContact O-N 2.96Å; I54-L58 HydrophobicContact CG2-CD1 4.28Å; I54-L58 WeakPolarHBondContact O-CG 3.21Å; I54-L58 PolarHBondContact O-N 3.21Å
55	I	94.5	Very high	92.4	Very high	79 Å²	79	84 Å²	84	41%	0.405	46%	0.46	S	S	.	.	H	α-helix	trans	-64.3	-42.8	177.3	-68.8	168.2	0	0	0	110.4	L51 N52 G53 L58 I59	L51-I55 HydrophobicContact CD1-CD1 4.28Å; L51-I55 HydrophobicContact CD1-CG1 4.46Å; L51-I55 HydrophobicContact CG-CD1 4.04Å; L51-I55 WeakPolarHBondContact O-CG1 3.24Å; L51-I55 PolarHBondContact O-N 2.88Å; N52-I55 PolarHBondContact O-N 3.41Å; G53-I55 VanDerWaalsContact C-N 3.32Å; G53-I55 PolarHBondContact O-N 3.17Å; I55-L58 PolarHBondContact O-N 3.09Å; I55-I59 HydrophobicContact CG2-CD1 4Å; I55-I59 WeakPolarHBondContact O-CG1 3.24Å; I55-I59 PolarHBondContact O-N 3.11Å
56	Q	94.1	Very high	92.8	Very high	95 Å²	95	85.3 Å²	85.3	44%	0.444	46%	0.458	S	S	.	.	H	α-helix	trans	-63.4	-45.5	177	-170.7	59.8	50.9	0	0	111.3	N52 G53 L58 I59 D60	N52-Q56 PolarHBondContact O-N 3.46Å; G53-Q56 PolarHBondContact O-N 3.34Å; G53-Q56 VanDerWaalsContact O-N 3.17Å; Q56-L58 PolarHBondContact O-N 3.36Å; Q56-I59 WeakPolarHBondContact O-CB 3.33Å; Q56-I59 PolarHBondContact O-N 3.13Å; Q56-I59 VanDerWaalsContact O-N 3.08Å; Q56-D60 PolarHBondContact NE2-OD1 3.06Å; Q56-D60 PolarHBondContact O-N 3Å
57	D	92.7	Very high	93.1	Very high	110 Å²	110	89.4 Å²	89.4	59%	0.588	47%	0.467	S	S	*	.	H	α-helix	trans	-57.5	-38.2	176.4	-68.8	-20.3	0	0	0	111.8	G53 I54 Y61	G53-D57 VanDerWaalsContact O-CG 3.32Å; G53-D57 PolarHBondContact O-N 3.42Å; I54-D57 PolarHBondContact O-N 2.96Å; D57-Y61 VanDerWaalsContact O-CB 3.23Å; D57-Y61 WeakPolarHBondContact O-CB 3.22Å; D57-Y61 PolarHBondContact O-N 3.06Å
58	L	93.6	Very high	93.3	Very high	118 Å²	118	85.8 Å²	85.8	62%	0.618	44%	0.443	S	S	*	.	H	α-helix	trans	-68.2	-39.7	176.1	-74.9	171.1	0	0	0	112.8	I54 I55 Q56 K62	I54-L58 HydrophobicContact CG2-CD1 4.28Å; I54-L58 WeakPolarHBondContact O-CG 3.21Å; I54-L58 PolarHBondContact O-N 3.21Å; I55-L58 PolarHBondContact O-N 3.09Å; Q56-L58 PolarHBondContact O-N 3.36Å; L58-K62 PolarHBondContact O-N 3.3Å; L58-K62 VanDerWaalsContact O-N 3.08Å
59	I	93.9	Very high	93.4	Very high	76 Å²	76	85 Å²	85	39%	0.39	44%	0.436	S	S	.	.	H	α-helix	trans	-64	-47.7	175.8	-69.6	166.9	0	0	0	109.6	I55 Q56 Y61 K62 N63	I55-I59 HydrophobicContact CG2-CD1 4Å; I55-I59 WeakPolarHBondContact O-CG1 3.24Å; I55-I59 PolarHBondContact O-N 3.11Å; Q56-I59 WeakPolarHBondContact O-CB 3.33Å; Q56-I59 PolarHBondContact O-N 3.13Å; Q56-I59 VanDerWaalsContact O-N 3.08Å; I59-Y61 PolarHBondContact O-N 3.15Å; I59-K62 PolarHBondContact O-N 2.92Å; I59-N63 WeakPolarHBondContact CG2-ND2 3.46Å; I59-N63 PolarHBondContact O-N 3.43Å; I59-N63 PolarHBondContact O-ND2 3.02Å
60	D	93	Very high	93.5	Very high	68 Å²	68	87.2 Å²	87.2	36%	0.364	44%	0.439	S	S	.	.	H	α-helix	trans	-63.6	-43.9	-179.7	-66.4	-14.2	0	0	0	110.8	Q56 K62 N63 D64	Q56-D60 PolarHBondContact NE2-OD1 3.06Å; Q56-D60 PolarHBondContact O-N 3Å; D60-K62 VanDerWaalsContact C-N 3.32Å; D60-K62 PolarHBondContact O-N 3.22Å; D60-N63 PolarHBondContact O-N 2.8Å; D60-D64 WeakPolarHBondContact O-CB 3.32Å; D60-D64 PolarHBondContact O-N 2.97Å
61	Y	94	Very high	93.7	Very high	90 Å²	90	81 Å²	81	35%	0.353	42%	0.415	S	S	.	.	H	α-helix	trans	-57.3	-43.7	174.8	-173.1	-78.8	0	0	0	112.2	D57 I59 A65 E102 A103 C106	D57-Y61 VanDerWaalsContact O-CB 3.23Å; D57-Y61 WeakPolarHBondContact O-CB 3.22Å; D57-Y61 PolarHBondContact O-N 3.06Å; I59-Y61 PolarHBondContact O-N 3.15Å; Y61-A65 WeakPolarHBondContact O-CB 3.5Å; Y61-A65 PolarHBondContact O-N 3.02Å; Y61-A65 VanDerWaalsContact O-N 3.14Å; Y61-E102 HydrophobicContact CE2-CB 4.13Å; Y61-E102 HydrophobicContact CE2-CG 4.04Å; Y61-E102 WeakPolarHBondContact OH-CG 3.21Å; Y61-A103 HydrophobicContact CD1-CB 4.13Å; Y61-A103 HydrophobicContact CD2-CB 3.7Å; Y61-A103 HydrophobicContact CE1-CB 4.21Å; Y61-A103 HydrophobicContact CE2-CB 3.79Å; Y61-A103 HydrophobicContact CG-CB 3.87Å; Y61-A103 VanDerWaalsContact O-CB 3.26Å; Y61-A103 WeakPolarHBondContact O-CB 3.48Å; Y61-C106 PolarHBondContact OH-SG 3.34Å; Y61-C106 VanDerWaalsContact OH-SG 3.42Å
62	K	93.6	Very high	93.9	Very high	122 Å²	122	76.4 Å²	76.4	53%	0.53	39%	0.39	S	S	.	.	H	α-helix	trans	-64.4	-48.9	177.5	-179.7	-173.9	168.5	-171.3	0	111.1	L58 I59 D60 D64 A65 E66	L58-K62 PolarHBondContact O-N 3.3Å; L58-K62 VanDerWaalsContact O-N 3.08Å; I59-K62 PolarHBondContact O-N 2.92Å; D60-K62 VanDerWaalsContact C-N 3.32Å; D60-K62 PolarHBondContact O-N 3.22Å; K62-D64 VanDerWaalsContact C-N 3.33Å; K62-D64 PolarHBondContact O-N 3.32Å; K62-A65 PolarHBondContact O-N 3.46Å; K62-E66 WeakPolarHBondContact CE-OE1 3.49Å; K62-E66 IonicContact NZ-OE1 3.44Å; K62-E66 PolarHBondContact O-N 3.26Å
63	N	94.1	Very high	93.8	Very high	80 Å²	80	73.7 Å²	73.7	43%	0.428	38%	0.379	S	S	.	.	H	α-helix	trans	-60.6	-43.2	-178.4	-67.6	-23.1	0	0	0	111.4	I59 D60 A65 E66 F67	I59-N63 WeakPolarHBondContact CG2-ND2 3.46Å; I59-N63 PolarHBondContact O-N 3.43Å; I59-N63 PolarHBondContact O-ND2 3.02Å; D60-N63 PolarHBondContact O-N 2.8Å; N63-A65 VanDerWaalsContact C-N 3.35Å; N63-A65 PolarHBondContact O-N 2.95Å; N63-E66 PolarHBondContact O-N 2.95Å; N63-F67 WeakPolarHBondContact O-CB 3.31Å; N63-F67 PolarHBondContact O-N 3.4Å
64	D	93.2	Very high	93.9	Very high	82 Å²	82	76.9 Å²	76.9	44%	0.439	39%	0.388	S	S	.	.	H	α-helix	trans	-62.6	-40.5	177.1	-79.6	-8.4	0	0	0	112.2	D60 K62 A68 A103	D60-D64 WeakPolarHBondContact O-CB 3.32Å; D60-D64 PolarHBondContact O-N 2.97Å; K62-D64 VanDerWaalsContact C-N 3.33Å; K62-D64 PolarHBondContact O-N 3.32Å; D64-A68 VanDerWaalsContact O-CB 3.26Å; D64-A68 WeakPolarHBondContact O-CB 3.42Å; D64-A68 PolarHBondContact O-N 2.93Å; D64-A103 HydrophobicContact CB-CB 3.59Å
65	A	93.3	Very high	94	Very high	19 Å²	19	73.1 Å²	73.1	16%	0.157	37%	0.369	C	S	.	.	H	α-helix	trans	-67	-42.5	177.2	0	0	0	0	0	112	Y61 K62 N63 A68 L69 A103 G107	Y61-A65 WeakPolarHBondContact O-CB 3.5Å; Y61-A65 PolarHBondContact O-N 3.02Å; Y61-A65 VanDerWaalsContact O-N 3.14Å; K62-A65 PolarHBondContact O-N 3.46Å; N63-A65 VanDerWaalsContact C-N 3.35Å; N63-A65 PolarHBondContact O-N 2.95Å; A65-A68 PolarHBondContact O-N 3.18Å; A65-L69 PolarHBondContact O-N 3.05Å; A65-A103 WeakPolarHBondContact CA-O 3.42Å; A65-A103 HydrophobicContact CB-CB 4.36Å; A65-A103 WeakPolarHBondContact CB-O 3.32Å; A65-G107 WeakPolarHBondContact O-CA 3.39Å
66	E	94.6	Very high	94.1	Very high	100 Å²	100	69.3 Å²	69.3	47%	0.467	35%	0.35	S	S	.	.	H	α-helix	trans	-66.1	-44.6	177	-73	179.1	175.3	0	0	111.6	K62 N63 A68 L69 M70	K62-E66 WeakPolarHBondContact CE-OE1 3.49Å; K62-E66 IonicContact NZ-OE1 3.44Å; K62-E66 PolarHBondContact O-N 3.26Å; N63-E66 PolarHBondContact O-N 2.95Å; E66-A68 VanDerWaalsContact C-N 3.32Å; E66-A68 PolarHBondContact O-N 3.31Å; E66-L69 WeakPolarHBondContact O-CB 3.27Å; E66-L69 PolarHBondContact O-N 3.49Å; E66-M70 WeakPolarHBondContact O-CG 3.39Å; E66-M70 PolarHBondContact O-N 3.44Å
67	F	94.3	Very high	94.1	Very high	121 Å²	121	70 Å²	70	53%	0.531	35%	0.351	S	S	.	.	H	α-helix	trans	-60.6	-42.7	176.1	177.7	-105.1	0	0	0	111.9	N63 L69 M70 T71 F98	N63-F67 WeakPolarHBondContact O-CB 3.31Å; N63-F67 PolarHBondContact O-N 3.4Å; F67-L69 PolarHBondContact O-N 2.97Å; F67-M70 PolarHBondContact O-N 2.84Å; F67-T71 PolarHBondContact O-N 2.78Å; F67-T71 PolarHBondContact O-OG1 2.99Å; F67-F98 AromaticContact CD1-CZ 3.84Å; F67-F98 HydrophobicContact CD1-CZ 3.84Å; F67-F98 HydrophobicContact CE1-CZ 4.05Å
68	A	94.9	Very high	94.2	Very high	0 Å²	0	70.7 Å²	70.7	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-63.8	-40	176.4	0	0	0	0	0	112.5	D64 A65 E66 T71 A72 F98 A104 L108	D64-A68 VanDerWaalsContact O-CB 3.26Å; D64-A68 WeakPolarHBondContact O-CB 3.42Å; D64-A68 PolarHBondContact O-N 2.93Å; A65-A68 PolarHBondContact O-N 3.18Å; E66-A68 VanDerWaalsContact C-N 3.32Å; E66-A68 PolarHBondContact O-N 3.31Å; A68-T71 PolarHBondContact O-N 3.08Å; A68-A72 WeakPolarHBondContact O-CB 3.47Å; A68-A72 PolarHBondContact O-N 3.1Å; A68-F98 HydrophobicContact CB-CE1 3.67Å; A68-F98 HydrophobicContact CB-CE2 4.36Å; A68-F98 HydrophobicContact CB-CZ 3.54Å; A68-A104 HydrophobicContact CB-CB 3.95Å; A68-A104 WeakPolarHBondContact CB-O 3.34Å; A68-L108 HydrophobicContact CB-CG 4.27Å
69	L	93.5	Very high	94.3	Very high	56 Å²	56	65.8 Å²	65.8	29%	0.293	32%	0.32	S	S	.	.	H	α-helix	trans	-61.8	-44.7	174.4	174.9	56.4	0	0	0	112	A65 E66 F67 T71 A72 N110 C111	A65-L69 PolarHBondContact O-N 3.05Å; E66-L69 WeakPolarHBondContact O-CB 3.27Å; E66-L69 PolarHBondContact O-N 3.49Å; F67-L69 PolarHBondContact O-N 2.97Å; L69-T71 VanDerWaalsContact C-N 3.32Å; L69-T71 PolarHBondContact O-N 3.23Å; L69-A72 WeakPolarHBondContact O-CB 3.35Å; L69-A72 PolarHBondContact O-N 3.37Å; L69-N110 HydrophobicContact CD1-CB 3.77Å; L69-N110 HydrophobicContact CD2-CB 4.49Å; L69-C111 HydrophobicContact CD1-CB 4.48Å
70	M	92.9	Very high	94.2	Very high	128 Å²	128	69.2 Å²	69.2	63%	0.631	33%	0.328	S	S	*	.	H	α-helix	trans	-61.9	-42.1	177.4	-66.9	-59.9	92.8	0	0	111.8	E66 F67 A72	E66-M70 WeakPolarHBondContact O-CG 3.39Å; E66-M70 PolarHBondContact O-N 3.44Å; F67-M70 PolarHBondContact O-N 2.84Å; M70-A72 VanDerWaalsContact C-N 3.32Å; M70-A72 PolarHBondContact O-N 2.98Å
71	T	94.4	Very high	94.2	Very high	29 Å²	29	69.4 Å²	69.4	18%	0.178	33%	0.334	C	S	.	.	H	α-helix	trans	-69.8	-29.8	179.1	-48.1	0	0	0	0	112.2	F67 A68 L69 S73 D74 L75	F67-T71 PolarHBondContact O-N 2.78Å; F67-T71 PolarHBondContact O-OG1 2.99Å; A68-T71 PolarHBondContact O-N 3.08Å; L69-T71 VanDerWaalsContact C-N 3.32Å; L69-T71 PolarHBondContact O-N 3.23Å; T71-S73 VanDerWaalsContact C-N 3.33Å; T71-S73 PolarHBondContact O-N 3Å; T71-D74 PolarHBondContact O-N 3.14Å; T71-L75 HydrophobicContact CG2-CD1 3.81Å; T71-L75 HydrophobicContact CG2-CG 4.12Å; T71-L75 WeakPolarHBondContact O-CG 3.38Å; T71-L75 PolarHBondContact O-N 3.15Å
72	A	95.6	Very high	93.8	Very high	0 Å²	0	73.5 Å²	73.5	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-59.9	-38.1	-174.3	0	0	0	0	0	113.6	A68 L69 M70 L75 A76 L108 C111 L114	A68-A72 WeakPolarHBondContact O-CB 3.47Å; A68-A72 PolarHBondContact O-N 3.1Å; L69-A72 WeakPolarHBondContact O-CB 3.35Å; L69-A72 PolarHBondContact O-N 3.37Å; M70-A72 VanDerWaalsContact C-N 3.32Å; M70-A72 PolarHBondContact O-N 2.98Å; A72-L75 PolarHBondContact O-N 2.85Å; A72-A76 VanDerWaalsContact O-CB 3.31Å; A72-A76 WeakPolarHBondContact O-CB 3.24Å; A72-A76 PolarHBondContact O-N 2.7Å; A72-L108 HydrophobicContact CB-CD2 4.07Å; A72-C111 HydrophobicContact CB-CB 3.44Å; A72-C111 VanDerWaalsContact CB-CB 3.44Å; A72-L114 HydrophobicContact CB-CD2 3.96Å
73	S	92.4	Very high	93.7	Very high	43 Å²	43	69.5 Å²	69.5	30%	0.301	35%	0.346	S	S	.	.	H	α-helix	trans	-63.9	-44	-178.8	-172	0	0	0	0	112	T71 A76 K77	T71-S73 VanDerWaalsContact C-N 3.33Å; T71-S73 PolarHBondContact O-N 3Å; S73-A76 PolarHBondContact O-N 3.39Å; S73-K77 WeakPolarHBondContact O-CG 3.29Å; S73-K77 PolarHBondContact O-N 3.49Å
74	D	94.8	Very high	93.8	Very high	100 Å²	100	68.7 Å²	68.7	54%	0.535	35%	0.347	S	S	.	.	H	α-helix	trans	-71.6	-37.3	-179	-68.6	-23.4	0	0	0	111.8	T71 K77 R78	T71-D74 PolarHBondContact O-N 3.14Å; D74-K77 PolarHBondContact O-N 3.26Å; D74-K77 IonicContact OD1-NZ 2.93Å; D74-K77 PolarHBondContact OD1-NZ 3.05Å; D74-R78 WeakPolarHBondContact O-CB 2.97Å; D74-R78 PolarHBondContact O-N 3.07Å
75	L	96.5	Very high	93.9	Very high	19 Å²	19	68 Å²	68	10%	0.099	35%	0.346	C	S	.	.	H	α-helix	trans	-62	-44	171.6	-65	170.7	0	0	0	111.3	T71 A72 K77 R78 L79 V91 Y94 I95 L114	T71-L75 HydrophobicContact CG2-CD1 3.81Å; T71-L75 HydrophobicContact CG2-CG 4.12Å; T71-L75 WeakPolarHBondContact O-CG 3.38Å; T71-L75 PolarHBondContact O-N 3.15Å; A72-L75 PolarHBondContact O-N 2.85Å; L75-K77 PolarHBondContact O-N 3.05Å; L75-R78 PolarHBondContact O-N 3.42Å; L75-L79 WeakPolarHBondContact O-CG 3.37Å; L75-L79 PolarHBondContact O-N 3.08Å; L75-V91 HydrophobicContact CD2-CG1 4.04Å; L75-Y94 HydrophobicContact CD1-CD1 4.04Å; L75-Y94 HydrophobicContact CD1-CE1 4.01Å; L75-Y94 HydrophobicContact CD2-CD1 3.97Å; L75-Y94 HydrophobicContact CD2-CE1 4.29Å; L75-I95 HydrophobicContact CB-CD1 4.32Å; L75-I95 HydrophobicContact CB-CG1 4.44Å; L75-I95 HydrophobicContact CD1-CG1 3.87Å; L75-L114 HydrophobicContact CB-CD1 3.91Å
76	A	95.6	Very high	94	Very high	0 Å²	0	72.3 Å²	72.3	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-64.9	-37	177.4	0	0	0	0	0	112.8	A72 S73 R80 E113 L114	A72-A76 VanDerWaalsContact O-CB 3.31Å; A72-A76 WeakPolarHBondContact O-CB 3.24Å; A72-A76 PolarHBondContact O-N 2.7Å; S73-A76 PolarHBondContact O-N 3.39Å; A76-R80 WeakPolarHBondContact O-CG 3.49Å; A76-R80 PolarHBondContact O-N 3.3Å; A76-R80 PolarHBondContact O-NE 3.23Å; A76-E113 HydrophobicContact CB-CB 4.09Å; A76-L114 HydrophobicContact CB-CB 3.97Å; A76-L114 HydrophobicContact CB-CD1 4.08Å
77	K	95.1	Very high	94.1	Very high	109 Å²	109	70.1 Å²	70.1	47%	0.474	36%	0.356	S	S	.	.	H	α-helix	trans	-65.1	-46.9	172.9	-72.8	170.3	-166.5	162.2	0	110.7	S73 D74 L75 L79 R80 S81	S73-K77 WeakPolarHBondContact O-CG 3.29Å; S73-K77 PolarHBondContact O-N 3.49Å; D74-K77 PolarHBondContact O-N 3.26Å; D74-K77 IonicContact OD1-NZ 2.93Å; D74-K77 PolarHBondContact OD1-NZ 3.05Å; L75-K77 PolarHBondContact O-N 3.05Å; K77-L79 VanDerWaalsContact C-N 3.35Å; K77-L79 PolarHBondContact O-N 2.73Å; K77-R80 PolarHBondContact O-N 2.89Å; K77-R80 VanDerWaalsContact O-N 3.13Å; K77-S81 PolarHBondContact O-N 2.66Å; K77-S81 VanDerWaalsContact O-N 3.12Å; K77-S81 PolarHBondContact O-OG 3.22Å
78	R	95.5	Very high	94.2	Very high	124 Å²	124	64.8 Å²	64.8	47%	0.468	33%	0.334	S	S	.	.	H	α-helix	trans	-60.3	-43.2	-179.7	-168.2	169.7	-176.2	178.4	0.7	112.1	D74 L75 R80 S81 E87 V91	D74-R78 WeakPolarHBondContact O-CB 2.97Å; D74-R78 PolarHBondContact O-N 3.07Å; L75-R78 PolarHBondContact O-N 3.42Å; R78-R80 VanDerWaalsContact C-N 3.28Å; R78-R80 PolarHBondContact O-N 3.08Å; R78-S81 WeakPolarHBondContact O-CB 3.43Å; R78-S81 PolarHBondContact O-N 3.21Å; R78-E87 IonicContact CZ-OE1 2.7Å; R78-E87 IonicContact NE-OE1 3.72Å; R78-E87 PolarHBondContact NE-OE1 2.89Å; R78-E87 IonicContact NH2-OE1 3.94Å; R78-E87 PolarHBondContact NH2-OE1 3.35Å; R78-V91 HydrophobicContact CG-CG2 4.24Å
79	L	95.6	Very high	94.3	Very high	16 Å²	16	66.8 Å²	66.8	8%	0.084	35%	0.345	C	S	.	.	H	α-helix	trans	-66	-26.5	177	-71.8	-179.3	0	0	0	114.1	L75 K77 I83 V91 V92 I95 L114 A117 I118 I121	L75-L79 WeakPolarHBondContact O-CG 3.37Å; L75-L79 PolarHBondContact O-N 3.08Å; K77-L79 VanDerWaalsContact C-N 3.35Å; K77-L79 PolarHBondContact O-N 2.73Å; L79-I83 HydrophobicContact CD2-CD1 4.32Å; L79-V91 HydrophobicContact CD1-CG1 4.32Å; L79-V91 HydrophobicContact CD2-CB 3.73Å; L79-V91 HydrophobicContact CD2-CG1 3.5Å; L79-V91 HydrophobicContact CG-CB 4.47Å; L79-V91 HydrophobicContact CG-CG1 3.7Å; L79-V92 HydrophobicContact CD1-CG2 4.3Å; L79-V92 HydrophobicContact CD2-CG2 3.88Å; L79-I95 HydrophobicContact CD1-CD1 3.67Å; L79-L114 HydrophobicContact CD1-CD1 4.41Å; L79-A117 HydrophobicContact CB-CB 4.09Å; L79-A117 HydrophobicContact CD1-CB 4.2Å; L79-I118 HydrophobicContact CD1-CD1 3.86Å; L79-I121 HydrophobicContact CB-CD1 4.32Å; L79-I121 HydrophobicContact CD1-CD1 4.13Å; L79-I121 HydrophobicContact CD2-CD1 3.86Å; L79-I121 HydrophobicContact CG-CD1 4.33Å
80	R	92.1	Very high	94.5	Very high	148 Å²	148	70.5 Å²	70.5	56%	0.558	36%	0.361	S	S	*	.	H	α-helix	trans	-86.3	-16.7	177.4	-73.8	-174.9	-70.3	173.8	-4.6	113.4	A76 K77 R78 A117	A76-R80 WeakPolarHBondContact O-CG 3.49Å; A76-R80 PolarHBondContact O-N 3.3Å; A76-R80 PolarHBondContact O-NE 3.23Å; K77-R80 PolarHBondContact O-N 2.89Å; K77-R80 VanDerWaalsContact O-N 3.13Å; R78-R80 VanDerWaalsContact C-N 3.28Å; R78-R80 PolarHBondContact O-N 3.08Å; R80-A117 HydrophobicContact CG-CB 4.42Å
81	S	91.6	Very high	94.8	Very high	71 Å²	71	64.8 Å²	64.8	50%	0.497	33%	0.333	S	S	.	.	S	Bend	trans	-69.9	159.5	172.4	-64.3	0	0	0	0	110.9	K77 R78 I83	K77-S81 PolarHBondContact O-N 2.66Å; K77-S81 VanDerWaalsContact O-N 3.12Å; K77-S81 PolarHBondContact O-OG 3.22Å; R78-S81 WeakPolarHBondContact O-CB 3.43Å; R78-S81 PolarHBondContact O-N 3.21Å; S81-I83 PolarHBondContact O-N 2.94Å
82	N	85.8	Confident	94.9	Very high	177 Å²	177	63.4 Å²	63.4	95%	0.947	32%	0.324	S	S	*	.			trans	-76.4	73.3	177.9	-163.7	14.4	0	0	0	110.9
83	I	92.6	Very high	95.1	Very high	37 Å²	37	64.7 Å²	64.7	19%	0.19	33%	0.334	C	S	.	.			trans	-94.1	160.4	179.4	60.7	174	0	0	0	111.3	L79 S81 E87 A88	L79-I83 HydrophobicContact CD2-CD1 4.32Å; S81-I83 PolarHBondContact O-N 2.94Å; I83-E87 HydrophobicContact CB-CB 4.23Å; I83-E87 HydrophobicContact CB-CG 4.23Å; I83-E87 HydrophobicContact CD1-CB 4.5Å; I83-E87 HydrophobicContact CD1-CG 4.28Å; I83-E87 HydrophobicContact CG2-CG 4.49Å; I83-A88 HydrophobicContact CD1-CB 3.73Å; I83-A88 HydrophobicContact CG1-CB 4.13Å
84	S	95.3	Very high	95.3	Very high	64 Å²	64	67.8 Å²	67.8	45%	0.448	34%	0.339	S	S	.	.			trans	-67.7	158.3	174.4	73.4	0	0	0	0	111.3	D86 E87 A88	S84-D86 PolarHBondContact O-N 2.93Å; S84-E87 PolarHBondContact O-N 3.25Å; S84-E87 WeakPolarHBondContact OG-CB 3.25Å; S84-E87 PolarHBondContact OG-N 3.07Å; S84-E87 VanDerWaalsContact OG-N 3.13Å; S84-A88 PolarHBondContact O-N 3.06Å
85	V	95.1	Very high	95.4	Very high	67 Å²	67	63 Å²	63	41%	0.406	31%	0.314	S	S	.	.	H	α-helix	trans	-58.3	-39.1	175.7	175.5	0	0	0	0	111.3	A88 L89 N127 L130	V85-A88 PolarHBondContact O-N 3.48Å; V85-L89 WeakPolarHBondContact O-CB 3.47Å; V85-L89 PolarHBondContact O-N 2.67Å; V85-N127 HydrophobicContact CG1-CB 3.54Å; V85-L130 HydrophobicContact CG1-CB 4.47Å; V85-L130 HydrophobicContact CG1-CD2 4.09Å
86	D	95.7	Very high	95.5	Very high	109 Å²	109	63 Å²	63	58%	0.583	31%	0.313	S	S	*	.	H	α-helix	trans	-66.9	-39.7	178.5	-63.7	-33.6	0	0	0	111.9	S84 L89 Q90	S84-D86 PolarHBondContact O-N 2.93Å; D86-L89 PolarHBondContact O-N 3.33Å; D86-Q90 WeakPolarHBondContact O-CG 3.11Å; D86-Q90 PolarHBondContact O-N 3.47Å
87	E	96.4	Very high	95.5	Very high	55 Å²	55	69.5 Å²	69.5	26%	0.257	34%	0.342	S	S	.	.	H	α-helix	trans	-67.8	-42.9	175.6	-174	177.2	-178.1	0	0	110.9	R78 I83 S84 L89 Q90 V91	R78-E87 IonicContact CZ-OE1 2.7Å; R78-E87 IonicContact NE-OE1 3.72Å; R78-E87 PolarHBondContact NE-OE1 2.89Å; R78-E87 IonicContact NH2-OE1 3.94Å; R78-E87 PolarHBondContact NH2-OE1 3.35Å; I83-E87 HydrophobicContact CB-CB 4.23Å; I83-E87 HydrophobicContact CB-CG 4.23Å; I83-E87 HydrophobicContact CD1-CB 4.5Å; I83-E87 HydrophobicContact CD1-CG 4.28Å; I83-E87 HydrophobicContact CG2-CG 4.49Å; S84-E87 PolarHBondContact O-N 3.25Å; S84-E87 WeakPolarHBondContact OG-CB 3.25Å; S84-E87 PolarHBondContact OG-N 3.07Å; S84-E87 VanDerWaalsContact OG-N 3.13Å; E87-L89 VanDerWaalsContact C-N 3.29Å; E87-L89 PolarHBondContact O-N 3.31Å; E87-Q90 PolarHBondContact O-N 2.99Å; E87-V91 WeakPolarHBondContact O-CG2 3.39Å; E87-V91 PolarHBondContact O-N 3.36Å
88	A	97.2	Very high	95.4	Very high	9 Å²	9	65.8 Å²	65.8	7%	0.074	33%	0.325	C	S	.	.	H	α-helix	trans	-58	-44.1	173.8	0	0	0	0	0	110.9	I83 S84 V85 Q90 V91 V92 L130	I83-A88 HydrophobicContact CD1-CB 3.73Å; I83-A88 HydrophobicContact CG1-CB 4.13Å; S84-A88 PolarHBondContact O-N 3.06Å; V85-A88 PolarHBondContact O-N 3.48Å; A88-Q90 VanDerWaalsContact C-N 3.35Å; A88-Q90 PolarHBondContact O-N 3.37Å; A88-V91 PolarHBondContact O-N 3.05Å; A88-V92 WeakPolarHBondContact O-CB 3.17Å; A88-V92 VanDerWaalsContact O-CG2 3.28Å; A88-V92 WeakPolarHBondContact O-CG2 3.48Å; A88-V92 PolarHBondContact O-N 3.41Å; A88-L130 HydrophobicContact CB-CD1 4.15Å; A88-L130 HydrophobicContact CB-CD2 3.8Å
89	L	97.6	Very high	95.5	Very high	42 Å²	42	59.9 Å²	59.9	22%	0.22	30%	0.303	C	S	.	.	H	α-helix	trans	-60.9	-41.9	176.9	179.5	62.2	0	0	0	112.1	V85 D86 E87 S93 D129 L130 E133	V85-L89 WeakPolarHBondContact O-CB 3.47Å; V85-L89 PolarHBondContact O-N 2.67Å; D86-L89 PolarHBondContact O-N 3.33Å; E87-L89 VanDerWaalsContact C-N 3.29Å; E87-L89 PolarHBondContact O-N 3.31Å; L89-S93 WeakPolarHBondContact O-CB 3.41Å; L89-S93 PolarHBondContact O-N 3.13Å; L89-S93 PolarHBondContact O-OG 2.81Å; L89-D129 HydrophobicContact CD2-CB 4.22Å; L89-L130 HydrophobicContact CB-CD1 4.25Å; L89-L130 HydrophobicContact CD1-CB 4.47Å; L89-L130 HydrophobicContact CD1-CD1 4.47Å; L89-E133 HydrophobicContact CD1-CB 3.77Å; L89-E133 HydrophobicContact CD1-CG 4.12Å
90	Q	97.6	Very high	95.4	Very high	134 Å²	134	66.1 Å²	66.1	63%	0.626	33%	0.325	S	S	*	.	H	α-helix	trans	-63.5	-43.3	175.9	-71.4	173	21.7	0	0	112.2	D86 E87 A88 S93 Y94	D86-Q90 WeakPolarHBondContact O-CG 3.11Å; D86-Q90 PolarHBondContact O-N 3.47Å; E87-Q90 PolarHBondContact O-N 2.99Å; A88-Q90 VanDerWaalsContact C-N 3.35Å; A88-Q90 PolarHBondContact O-N 3.37Å; Q90-S93 PolarHBondContact O-N 3.29Å; Q90-Y94 PolarHBondContact O-N 3.47Å
91	V	97.8	Very high	95.5	Very high	7 Å²	7	66.6 Å²	66.6	4%	0.042	33%	0.328	C	S	.	.	H	α-helix	trans	-66.9	-46.1	179.4	177.1	0	0	0	0	110.8	L75 R78 L79 E87 A88 S93 Y94 I95	L75-V91 HydrophobicContact CD2-CG1 4.04Å; R78-V91 HydrophobicContact CG-CG2 4.24Å; L79-V91 HydrophobicContact CD1-CG1 4.32Å; L79-V91 HydrophobicContact CD2-CB 3.73Å; L79-V91 HydrophobicContact CD2-CG1 3.5Å; L79-V91 HydrophobicContact CG-CB 4.47Å; L79-V91 HydrophobicContact CG-CG1 3.7Å; E87-V91 WeakPolarHBondContact O-CG2 3.39Å; E87-V91 PolarHBondContact O-N 3.36Å; A88-V91 PolarHBondContact O-N 3.05Å; V91-S93 VanDerWaalsContact C-N 3.33Å; V91-S93 PolarHBondContact O-N 2.93Å; V91-Y94 WeakPolarHBondContact O-CB 3.3Å; V91-Y94 PolarHBondContact O-N 3.39Å; V91-I95 HydrophobicContact CG1-CD1 4.08Å; V91-I95 WeakPolarHBondContact O-CG1 3.39Å; V91-I95 PolarHBondContact O-N 3.07Å
92	V	98.2	Very high	95.6	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-62.7	-41.2	175.8	179.9	0	0	0	0	110.8	L79 A88 Y94 I95 H96 I118 I121 L130 E133 A134 T137	L79-V92 HydrophobicContact CD1-CG2 4.3Å; L79-V92 HydrophobicContact CD2-CG2 3.88Å; A88-V92 WeakPolarHBondContact O-CB 3.17Å; A88-V92 VanDerWaalsContact O-CG2 3.28Å; A88-V92 WeakPolarHBondContact O-CG2 3.48Å; A88-V92 PolarHBondContact O-N 3.41Å; V92-Y94 VanDerWaalsContact C-N 3.28Å; V92-Y94 PolarHBondContact O-N 3.44Å; V92-I95 PolarHBondContact O-N 2.83Å; V92-I95 VanDerWaalsContact O-N 3.17Å; V92-H96 WeakPolarHBondContact O-CB 3.45Å; V92-H96 PolarHBondContact O-N 2.84Å; V92-I118 HydrophobicContact CB-CD1 4.45Å; V92-I118 HydrophobicContact CG1-CD1 4Å; V92-I118 HydrophobicContact CG2-CD1 3.86Å; V92-I121 HydrophobicContact CG2-CD1 4.01Å; V92-L130 HydrophobicContact CB-CD1 4.26Å; V92-L130 HydrophobicContact CG2-CD1 3.89Å; V92-E133 HydrophobicContact CB-CG 4.37Å; V92-E133 HydrophobicContact CG1-CB 4.13Å; V92-E133 HydrophobicContact CG1-CG 3.84Å; V92-A134 HydrophobicContact CG1-CB 4.31Å; V92-T137 WeakPolarHBondContact CG1-OG1 3.35Å
93	S	97.8	Very high	95.9	Very high	28 Å²	28	59.3 Å²	59.3	20%	0.196	28%	0.282	C	S	.	.	H	α-helix	trans	-61.8	-35.1	175.4	-62.3	0	0	0	0	113	L89 Q90 V91 K97 E133	L89-S93 WeakPolarHBondContact O-CB 3.41Å; L89-S93 PolarHBondContact O-N 3.13Å; L89-S93 PolarHBondContact O-OG 2.81Å; Q90-S93 PolarHBondContact O-N 3.29Å; V91-S93 VanDerWaalsContact C-N 3.33Å; V91-S93 PolarHBondContact O-N 2.93Å; S93-K97 WeakPolarHBondContact O-CG 3.17Å; S93-K97 PolarHBondContact O-N 3.44Å; S93-K97 VanDerWaalsContact O-N 3.1Å; S93-E133 WeakPolarHBondContact CA-OE1 3.38Å
94	Y	97.3	Very high	96.1	Very high	108 Å²	108	57.6 Å²	57.6	42%	0.424	27%	0.273	S	S	.	.	H	α-helix	trans	-66.3	-47.5	174	178.4	-97.1	0	0	0	110.9	L75 Q90 V91 V92 H96 K97 F98	L75-Y94 HydrophobicContact CD1-CD1 4.04Å; L75-Y94 HydrophobicContact CD1-CE1 4.01Å; L75-Y94 HydrophobicContact CD2-CD1 3.97Å; L75-Y94 HydrophobicContact CD2-CE1 4.29Å; Q90-Y94 PolarHBondContact O-N 3.47Å; V91-Y94 WeakPolarHBondContact O-CB 3.3Å; V91-Y94 PolarHBondContact O-N 3.39Å; V92-Y94 VanDerWaalsContact C-N 3.28Å; V92-Y94 PolarHBondContact O-N 3.44Å; Y94-H96 VanDerWaalsContact C-N 3.33Å; Y94-H96 PolarHBondContact O-N 3.46Å; Y94-K97 PolarHBondContact O-N 3.05Å; Y94-F98 HydrophobicContact CE1-CD1 4.33Å; Y94-F98 WeakPolarHBondContact O-CB 3.43Å; Y94-F98 PolarHBondContact O-N 3.48Å
95	I	97.9	Very high	96.1	Very high	0 Å²	0	55 Å²	55	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-59.6	-45	176.9	-62.4	157.1	0	0	0	110.4	L75 L79 V91 V92 K97 F98 A99 L108 L114 I118 T137	L75-I95 HydrophobicContact CB-CD1 4.32Å; L75-I95 HydrophobicContact CB-CG1 4.44Å; L75-I95 HydrophobicContact CD1-CG1 3.87Å; L79-I95 HydrophobicContact CD1-CD1 3.67Å; V91-I95 HydrophobicContact CG1-CD1 4.08Å; V91-I95 WeakPolarHBondContact O-CG1 3.39Å; V91-I95 PolarHBondContact O-N 3.07Å; V92-I95 PolarHBondContact O-N 2.83Å; V92-I95 VanDerWaalsContact O-N 3.17Å; I95-K97 PolarHBondContact O-N 3.4Å; I95-F98 PolarHBondContact O-N 3.42Å; I95-A99 WeakPolarHBondContact O-CB 3.29Å; I95-A99 PolarHBondContact O-N 2.95Å; I95-L108 HydrophobicContact CG2-CD1 4.3Å; I95-L114 HydrophobicContact CD1-CD1 3.69Å; I95-L114 HydrophobicContact CG1-CD1 4.37Å; I95-L114 HydrophobicContact CG2-CD2 4.32Å; I95-I118 HydrophobicContact CD1-CD1 4.06Å; I95-T137 HydrophobicContact CB-CG2 4.26Å; I95-T137 HydrophobicContact CG2-CG2 3.62Å
96	H	97	Very high	96	Very high	19 Å²	19	53.7 Å²	53.7	9%	0.088	25%	0.247	C	C	.	.	H	α-helix	trans	-54.2	-55.6	175.6	-177.1	-179.8	0	0	0	110.7	V92 Y94 F98 A99 R100 E133 T137 L140	V92-H96 WeakPolarHBondContact O-CB 3.45Å; V92-H96 PolarHBondContact O-N 2.84Å; Y94-H96 VanDerWaalsContact C-N 3.33Å; Y94-H96 PolarHBondContact O-N 3.46Å; H96-F98 PolarHBondContact O-N 3.3Å; H96-A99 PolarHBondContact O-N 2.96Å; H96-R100 PolarHBondContact NE2-NH2 2.94Å; H96-R100 PolarHBondContact O-N 2.7Å; H96-E133 WeakPolarHBondContact CB-OE1 3.42Å; H96-E133 IonicContact CE1-OE1 3.19Å; H96-E133 IonicContact CG-OE1 2.88Å; H96-E133 IonicContact ND1-OE1 3.79Å; H96-E133 PolarHBondContact ND1-OE1 3.36Å; H96-E133 IonicContact ND1-OE2 3.53Å; H96-T137 WeakPolarHBondContact CB-OG1 3.43Å; H96-L140 WeakPolarHBondContact CD2-CD1 3.21Å; H96-L140 WeakPolarHBondContact O-CD1 3.34Å
97	K	96.3	Very high	96	Very high	136 Å²	136	48.6 Å²	48.6	59%	0.591	22%	0.22	S	C	*	.	H	α-helix	trans	-56.9	-39.8	179.8	-73.1	172.2	-173.3	173.8	0	111.6	S93 Y94 I95 R100	S93-K97 WeakPolarHBondContact O-CG 3.17Å; S93-K97 PolarHBondContact O-N 3.44Å; S93-K97 VanDerWaalsContact O-N 3.1Å; Y94-K97 PolarHBondContact O-N 3.05Å; I95-K97 PolarHBondContact O-N 3.4Å; K97-R100 WeakPolarHBondContact O-CB 3.42Å; K97-R100 PolarHBondContact O-N 3.39Å
98	F	93.9	Very high	96	Very high	31 Å²	31	46 Å²	46	14%	0.136	21%	0.208	C	C	.	.	H	α-helix	trans	-70.8	-40.6	-178.7	-161	-165.3	0	0	0	112.2	F67 A68 Y94 I95 H96 R100 Y101 A104 L108	F67-F98 AromaticContact CD1-CZ 3.84Å; F67-F98 HydrophobicContact CD1-CZ 3.84Å; F67-F98 HydrophobicContact CE1-CZ 4.05Å; A68-F98 HydrophobicContact CB-CE1 3.67Å; A68-F98 HydrophobicContact CB-CE2 4.36Å; A68-F98 HydrophobicContact CB-CZ 3.54Å; Y94-F98 HydrophobicContact CE1-CD1 4.33Å; Y94-F98 WeakPolarHBondContact O-CB 3.43Å; Y94-F98 PolarHBondContact O-N 3.48Å; I95-F98 PolarHBondContact O-N 3.42Å; H96-F98 PolarHBondContact O-N 3.3Å; F98-R100 PolarHBondContact O-N 3.44Å; F98-Y101 PolarHBondContact O-N 3.46Å; F98-A104 HydrophobicContact CD2-CB 3.42Å; F98-A104 VanDerWaalsContact CD2-CB 3.42Å; F98-A104 HydrophobicContact CE2-CB 3.33Å; F98-A104 HydrophobicContact CG-CB 4.11Å; F98-A104 HydrophobicContact CZ-CB 3.95Å; F98-A104 WeakPolarHBondContact O-CB 3.49Å; F98-L108 HydrophobicContact CB-CD1 4.33Å; F98-L108 HydrophobicContact CD1-CD1 4.23Å; F98-L108 HydrophobicContact CD1-CD2 4.07Å; F98-L108 HydrophobicContact CD1-CG 4.45Å; F98-L108 HydrophobicContact CE1-CD2 4.4Å; F98-L108 HydrophobicContact CG-CD1 4.4Å
99	A	96.1	Very high	96	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-67.5	-5.9	178.6	0	0	0	0	0	114.6	I95 H96 Y101 R105 L108 L140 L141	I95-A99 WeakPolarHBondContact O-CB 3.29Å; I95-A99 PolarHBondContact O-N 2.95Å; H96-A99 PolarHBondContact O-N 2.96Å; A99-Y101 VanDerWaalsContact C-N 3.3Å; A99-R105 PolarHBondContact O-NH1 3.44Å; A99-R105 VanDerWaalsContact O-NH1 3.09Å; A99-L108 HydrophobicContact CB-CD1 3.91Å; A99-L140 HydrophobicContact CB-CB 3.9Å; A99-L140 HydrophobicContact CB-CD1 4.06Å; A99-L141 HydrophobicContact CB-CD2 4.12Å
100	R	95.2	Very high	95.9	Very high	146 Å²	146	48.2 Å²	48.2	55%	0.551	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-33.5	172.4	-67.9	-179.3	178.5	-167.8	-2.4	111.7	H96 K97 F98 L140	H96-R100 PolarHBondContact NE2-NH2 2.94Å; H96-R100 PolarHBondContact O-N 2.7Å; K97-R100 WeakPolarHBondContact O-CB 3.42Å; K97-R100 PolarHBondContact O-N 3.39Å; F98-R100 PolarHBondContact O-N 3.44Å; R100-L140 HydrophobicContact CG-CD1 3.72Å
101	Y	93.8	Very high	95.9	Very high	158 Å²	158	42.3 Å²	42.3	62%	0.62	19%	0.192	S	C	*	.	S	Bend	trans	-80.9	135.1	176.6	-56.6	-79.2	0	0	0	110.4	F98 A99 A104 R105	F98-Y101 PolarHBondContact O-N 3.46Å; A99-Y101 VanDerWaalsContact C-N 3.3Å; Y101-A104 PolarHBondContact O-N 2.95Å; Y101-R105 VanDerWaalsContact O-CB 3.28Å; Y101-R105 WeakPolarHBondContact O-CB 3.43Å; Y101-R105 PolarHBondContact O-N 3.33Å
102	E	93.1	Very high	95.8	Very high	90 Å²	90	43.5 Å²	43.5	42%	0.421	20%	0.201	S	C	.	.	H	α-helix	trans	-66	-44.6	-172.8	-174.5	173.9	-177.9	0	0	113.2	Y61 R105 C106	Y61-E102 HydrophobicContact CE2-CB 4.13Å; Y61-E102 HydrophobicContact CE2-CG 4.04Å; Y61-E102 WeakPolarHBondContact OH-CG 3.21Å; E102-R105 PolarHBondContact O-N 3.46Å; E102-C106 PolarHBondContact O-N 2.97Å; E102-C106 PolarHBondContact O-SG 3.01Å
103	A	93	Very high	95.7	Very high	5 Å²	5	47 Å²	47	4%	0.041	22%	0.217	C	C	.	.	H	α-helix	trans	-58	-53	174.6	0	0	0	0	0	111.6	Y61 D64 A65 R105 C106 G107	Y61-A103 HydrophobicContact CD1-CB 4.13Å; Y61-A103 HydrophobicContact CD2-CB 3.7Å; Y61-A103 HydrophobicContact CE1-CB 4.21Å; Y61-A103 HydrophobicContact CE2-CB 3.79Å; Y61-A103 HydrophobicContact CG-CB 3.87Å; Y61-A103 VanDerWaalsContact O-CB 3.26Å; Y61-A103 WeakPolarHBondContact O-CB 3.48Å; D64-A103 HydrophobicContact CB-CB 3.59Å; A65-A103 WeakPolarHBondContact CA-O 3.42Å; A65-A103 HydrophobicContact CB-CB 4.36Å; A65-A103 WeakPolarHBondContact CB-O 3.32Å; A103-R105 VanDerWaalsContact C-N 3.33Å; A103-R105 PolarHBondContact O-N 3.45Å; A103-C106 WeakPolarHBondContact O-CB 3.26Å; A103-C106 PolarHBondContact O-N 3.41Å; A103-C106 VanDerWaalsContact O-N 3.1Å; A103-G107 PolarHBondContact O-N 3.35Å
104	A	95	Very high	95.7	Very high	2 Å²	2	45.7 Å²	45.7	2%	0.017	21%	0.208	C	C	.	.	H	α-helix	trans	-59.6	-43.9	179.5	0	0	0	0	0	112	A68 F98 Y101 C106 G107 L108	A68-A104 HydrophobicContact CB-CB 3.95Å; A68-A104 WeakPolarHBondContact CB-O 3.34Å; F98-A104 HydrophobicContact CD2-CB 3.42Å; F98-A104 VanDerWaalsContact CD2-CB 3.42Å; F98-A104 HydrophobicContact CE2-CB 3.33Å; F98-A104 HydrophobicContact CG-CB 4.11Å; F98-A104 HydrophobicContact CZ-CB 3.95Å; F98-A104 WeakPolarHBondContact O-CB 3.49Å; Y101-A104 PolarHBondContact O-N 2.95Å; A104-C106 VanDerWaalsContact C-N 3.32Å; A104-C106 PolarHBondContact O-N 3.32Å; A104-G107 PolarHBondContact O-N 3.46Å; A104-G107 VanDerWaalsContact O-N 3.12Å; A104-L108 VanDerWaalsContact O-CG 3.26Å; A104-L108 WeakPolarHBondContact O-CG 3.32Å; A104-L108 PolarHBondContact O-N 3.22Å
105	R	95.7	Very high	95.7	Very high	9 Å²	9	40.6 Å²	40.6	3%	0.034	19%	0.188	C	C	.	.	H	α-helix	trans	-55.6	-46.5	174.2	175.1	174.9	52.9	-116.6	3.6	111.8	A99 Y101 E102 A103 G107 L108 V109 L140 A144	A99-R105 PolarHBondContact O-NH1 3.44Å; A99-R105 VanDerWaalsContact O-NH1 3.09Å; Y101-R105 VanDerWaalsContact O-CB 3.28Å; Y101-R105 WeakPolarHBondContact O-CB 3.43Å; Y101-R105 PolarHBondContact O-N 3.33Å; E102-R105 PolarHBondContact O-N 3.46Å; A103-R105 VanDerWaalsContact C-N 3.33Å; A103-R105 PolarHBondContact O-N 3.45Å; R105-G107 VanDerWaalsContact C-N 3.29Å; R105-G107 PolarHBondContact O-N 2.9Å; R105-L108 PolarHBondContact O-N 2.77Å; R105-V109 WeakPolarHBondContact O-CG1 3.49Å; R105-V109 WeakPolarHBondContact O-CG2 3.47Å; R105-V109 PolarHBondContact O-N 3.4Å; R105-L140 WeakPolarHBondContact CD-O 3.35Å; R105-A144 HydrophobicContact CG-CB 4.23Å
106	C	94	Very high	95.6	Very high	40 Å²	40	45 Å²	45	27%	0.27	21%	0.205	S	C	.	.	H	α-helix	trans	-62.4	-36.2	177.5	-67.9	0	0	0	0	112.4	Y61 E102 A103 A104 V109 N110	Y61-C106 PolarHBondContact OH-SG 3.34Å; Y61-C106 VanDerWaalsContact OH-SG 3.42Å; E102-C106 PolarHBondContact O-N 2.97Å; E102-C106 PolarHBondContact O-SG 3.01Å; A103-C106 WeakPolarHBondContact O-CB 3.26Å; A103-C106 PolarHBondContact O-N 3.41Å; A103-C106 VanDerWaalsContact O-N 3.1Å; A104-C106 VanDerWaalsContact C-N 3.32Å; A104-C106 PolarHBondContact O-N 3.32Å; C106-V109 WeakPolarHBondContact O-CG2 3.47Å; C106-N110 PolarHBondContact O-ND2 2.8Å
107	G	95.2	Very high	95.6	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.01	20%	0.204	C	C	.	.	H	α-helix	trans	-66.9	-49.1	172.9	0	0	0	0	0	113.3	A65 A103 A104 R105 V109 N110	A65-G107 WeakPolarHBondContact O-CA 3.39Å; A103-G107 PolarHBondContact O-N 3.35Å; A104-G107 PolarHBondContact O-N 3.46Å; A104-G107 VanDerWaalsContact O-N 3.12Å; R105-G107 VanDerWaalsContact C-N 3.29Å; R105-G107 PolarHBondContact O-N 2.9Å; G107-V109 PolarHBondContact O-N 2.89Å; G107-N110 WeakPolarHBondContact O-CB 3.38Å; G107-N110 PolarHBondContact O-N 3.06Å
108	L	97.3	Very high	95.7	Very high	0 Å²	0	38 Å²	38	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-58.9	-44.2	-177.3	-70	170	0	0	0	112.5	A68 A72 I95 F98 A99 A104 R105 N110 C111 L114 L141	A68-L108 HydrophobicContact CB-CG 4.27Å; A72-L108 HydrophobicContact CB-CD2 4.07Å; I95-L108 HydrophobicContact CG2-CD1 4.3Å; F98-L108 HydrophobicContact CB-CD1 4.33Å; F98-L108 HydrophobicContact CD1-CD1 4.23Å; F98-L108 HydrophobicContact CD1-CD2 4.07Å; F98-L108 HydrophobicContact CD1-CG 4.45Å; F98-L108 HydrophobicContact CE1-CD2 4.4Å; F98-L108 HydrophobicContact CG-CD1 4.4Å; A99-L108 HydrophobicContact CB-CD1 3.91Å; A104-L108 VanDerWaalsContact O-CG 3.26Å; A104-L108 WeakPolarHBondContact O-CG 3.32Å; A104-L108 PolarHBondContact O-N 3.22Å; R105-L108 PolarHBondContact O-N 2.77Å; L108-N110 PolarHBondContact O-N 3.01Å; L108-C111 PolarHBondContact O-N 3.42Å; L108-C111 VanDerWaalsContact O-N 3.14Å; L108-L114 HydrophobicContact CB-CD2 3.98Å; L108-L114 HydrophobicContact CD2-CD2 3.69Å; L108-L114 HydrophobicContact CG-CD2 4.37Å; L108-L141 HydrophobicContact CB-CD2 4.06Å; L108-L141 HydrophobicContact CD1-CD2 4.39Å
109	V	96.8	Very high	95.9	Very high	2 Å²	2	36.6 Å²	36.6	1%	0.012	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-14.9	-177.4	-62.9	0	0	0	0	114	R105 C106 G107 C111 L141 A144 T146	R105-V109 WeakPolarHBondContact O-CG1 3.49Å; R105-V109 WeakPolarHBondContact O-CG2 3.47Å; R105-V109 PolarHBondContact O-N 3.4Å; C106-V109 WeakPolarHBondContact O-CG2 3.47Å; G107-V109 PolarHBondContact O-N 2.89Å; V109-C111 PolarHBondContact O-N 2.83Å; V109-L141 HydrophobicContact CG1-CB 3.96Å; V109-L141 HydrophobicContact CG1-CD2 3.82Å; V109-L141 HydrophobicContact CG1-CG 4.45Å; V109-L141 WeakPolarHBondContact CG1-O 3.38Å; V109-A144 HydrophobicContact CG1-CB 4.37Å; V109-A144 HydrophobicContact CG2-CB 3.99Å; V109-T146 HydrophobicContact CB-CG2 4.46Å; V109-T146 HydrophobicContact CG2-CG2 4.3Å; V109-T146 WeakPolarHBondContact O-CG2 3.42Å
110	N	95.5	Very high	95.9	Very high	97 Å²	97	41.8 Å²	41.8	52%	0.519	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-12.3	174.5	-71.8	-22.3	0	0	0	112.4	L69 C106 G107 L108	L69-N110 HydrophobicContact CD1-CB 3.77Å; L69-N110 HydrophobicContact CD2-CB 4.49Å; C106-N110 PolarHBondContact O-ND2 2.8Å; G107-N110 WeakPolarHBondContact O-CB 3.38Å; G107-N110 PolarHBondContact O-N 3.06Å; L108-N110 PolarHBondContact O-N 3.01Å
111	C	96.1	Very high	95.9	Very high	9 Å²	9	35.7 Å²	35.7	6%	0.061	17%	0.171	C	C	.	.			trans	-93	96.7	165.2	-178.1	0	0	0	0	109.7	L69 A72 L108 V109 E113 L114 V115	L69-C111 HydrophobicContact CD1-CB 4.48Å; A72-C111 HydrophobicContact CB-CB 3.44Å; A72-C111 VanDerWaalsContact CB-CB 3.44Å; L108-C111 PolarHBondContact O-N 3.42Å; L108-C111 VanDerWaalsContact O-N 3.14Å; V109-C111 PolarHBondContact O-N 2.83Å; C111-E113 PolarHBondContact O-N 3Å; C111-L114 HydrophobicContact CB-CB 4.16Å; C111-L114 WeakPolarHBondContact O-CB 3.48Å; C111-L114 PolarHBondContact O-N 2.91Å; C111-L114 VanDerWaalsContact O-N 3.09Å; C111-V115 PolarHBondContact O-N 3.23Å
112	S	96.1	Very high	96	Very high	33 Å²	33	28.6 Å²	28.6	23%	0.231	14%	0.144	C	C	.	.	H	α-helix	trans	-58.6	-34	-177.8	69.4	0	0	0	0	112.9	L114 V115 R116	S112-L114 VanDerWaalsContact C-N 3.31Å; S112-L114 PolarHBondContact O-N 2.77Å; S112-V115 PolarHBondContact O-N 3.01Å; S112-R116 VanDerWaalsContact CB-NH1 3.32Å; S112-R116 WeakPolarHBondContact O-CG 3.44Å; S112-R116 PolarHBondContact O-N 2.84Å; S112-R116 PolarHBondContact OG-NH1 3.3Å
113	E	96	Very high	96.1	Very high	74 Å²	74	28.5 Å²	28.5	35%	0.346	14%	0.144	S	C	.	.	H	α-helix	trans	-65.5	-32.7	178.8	-59.6	97	127.9	0	0	112.7	A76 C111 A117	A76-E113 HydrophobicContact CB-CB 4.09Å; C111-E113 PolarHBondContact O-N 3Å; E113-A117 VanDerWaalsContact O-CB 3.32Å; E113-A117 WeakPolarHBondContact O-CB 3.36Å; E113-A117 PolarHBondContact O-N 2.95Å
114	L	97.7	Very high	96.1	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-65.5	-49.6	175.3	-175.9	70.3	0	0	0	110.3	A72 L75 A76 L79 I95 L108 C111 S112 R116 A117 I118	A72-L114 HydrophobicContact CB-CD2 3.96Å; L75-L114 HydrophobicContact CB-CD1 3.91Å; A76-L114 HydrophobicContact CB-CB 3.97Å; A76-L114 HydrophobicContact CB-CD1 4.08Å; L79-L114 HydrophobicContact CD1-CD1 4.41Å; I95-L114 HydrophobicContact CD1-CD1 3.69Å; I95-L114 HydrophobicContact CG1-CD1 4.37Å; I95-L114 HydrophobicContact CG2-CD2 4.32Å; L108-L114 HydrophobicContact CB-CD2 3.98Å; L108-L114 HydrophobicContact CD2-CD2 3.69Å; L108-L114 HydrophobicContact CG-CD2 4.37Å; C111-L114 HydrophobicContact CB-CB 4.16Å; C111-L114 WeakPolarHBondContact O-CB 3.48Å; C111-L114 PolarHBondContact O-N 2.91Å; C111-L114 VanDerWaalsContact O-N 3.09Å; S112-L114 VanDerWaalsContact C-N 3.31Å; S112-L114 PolarHBondContact O-N 2.77Å; L114-R116 VanDerWaalsContact C-N 3.34Å; L114-R116 PolarHBondContact O-N 3.05Å; L114-A117 PolarHBondContact O-N 2.9Å; L114-I118 WeakPolarHBondContact O-CG1 3.4Å; L114-I118 PolarHBondContact O-N 3.27Å
115	V	97.1	Very high	96.1	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.006	17%	0.172	C	C	.	.	H	α-helix	trans	-62	-44.3	-179.7	-174.4	0	0	0	0	110.3	C111 S112 A117 I118 I119 L141 L150	C111-V115 PolarHBondContact O-N 3.23Å; S112-V115 PolarHBondContact O-N 3.01Å; V115-A117 VanDerWaalsContact C-N 3.34Å; V115-A117 PolarHBondContact O-N 2.98Å; V115-I118 PolarHBondContact O-N 2.62Å; V115-I119 HydrophobicContact CG1-CD1 3.95Å; V115-I119 WeakPolarHBondContact O-CG1 3.48Å; V115-I119 PolarHBondContact O-N 3.1Å; V115-L141 HydrophobicContact CG2-CD1 4.41Å; V115-L150 HydrophobicContact CB-CB 4.39Å; V115-L150 HydrophobicContact CB-CD1 3.94Å; V115-L150 HydrophobicContact CG1-CB 3.88Å; V115-L150 HydrophobicContact CG1-CD1 4.27Å; V115-L150 HydrophobicContact CG2-CD1 3.73Å
116	R	97	Very high	96.1	Very high	93 Å²	93	43 Å²	43	35%	0.351	22%	0.215	S	C	.	.	H	α-helix	trans	-59.7	-41.7	174.1	-72	-172.3	-171.9	99.5	9.5	112.7	S112 L114 I119 H120 E154	S112-R116 VanDerWaalsContact CB-NH1 3.32Å; S112-R116 WeakPolarHBondContact O-CG 3.44Å; S112-R116 PolarHBondContact O-N 2.84Å; S112-R116 PolarHBondContact OG-NH1 3.3Å; L114-R116 VanDerWaalsContact C-N 3.34Å; L114-R116 PolarHBondContact O-N 3.05Å; R116-I119 PolarHBondContact O-N 3.27Å; R116-H120 VanDerWaalsContact O-CB 3.27Å; R116-H120 WeakPolarHBondContact O-CB 3.46Å; R116-H120 PolarHBondContact O-N 2.86Å; R116-E154 WeakPolarHBondContact CD-OE1 3.24Å; R116-E154 HydrophobicContact CG-CG 3.96Å; R116-E154 IonicContact CZ-OE1 3.41Å; R116-E154 IonicContact NE-OE1 2.69Å; R116-E154 PolarHBondContact NE-OE1 3.38Å; R116-E154 IonicContact NE-OE2 2.71Å; R116-E154 IonicContact NH2-OE1 3.2Å
117	A	97.1	Very high	96.2	Very high	7 Å²	7	43.5 Å²	43.5	6%	0.058	22%	0.215	C	C	.	.	H	α-helix	trans	-63	-42.5	177.4	0	0	0	0	0	111.7	L79 R80 E113 L114 V115 H120 I121	L79-A117 HydrophobicContact CB-CB 4.09Å; L79-A117 HydrophobicContact CD1-CB 4.2Å; R80-A117 HydrophobicContact CG-CB 4.42Å; E113-A117 VanDerWaalsContact O-CB 3.32Å; E113-A117 WeakPolarHBondContact O-CB 3.36Å; E113-A117 PolarHBondContact O-N 2.95Å; L114-A117 PolarHBondContact O-N 2.9Å; V115-A117 VanDerWaalsContact C-N 3.34Å; V115-A117 PolarHBondContact O-N 2.98Å; A117-H120 PolarHBondContact O-N 2.93Å; A117-I121 VanDerWaalsContact O-CG1 3.28Å; A117-I121 WeakPolarHBondContact O-CG1 3.44Å; A117-I121 PolarHBondContact O-N 3.1Å
118	I	98.2	Very high	96.1	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-62.5	-45.5	175.5	-65	-60.7	0	0	0	111.5	L79 V92 I95 L114 V115 I121 L122 A134 T137 L138 L141	L79-I118 HydrophobicContact CD1-CD1 3.86Å; V92-I118 HydrophobicContact CB-CD1 4.45Å; V92-I118 HydrophobicContact CG1-CD1 4Å; V92-I118 HydrophobicContact CG2-CD1 3.86Å; I95-I118 HydrophobicContact CD1-CD1 4.06Å; L114-I118 WeakPolarHBondContact O-CG1 3.4Å; L114-I118 PolarHBondContact O-N 3.27Å; V115-I118 PolarHBondContact O-N 2.62Å; I118-I121 PolarHBondContact O-N 2.91Å; I118-L122 WeakPolarHBondContact O-CB 3.4Å; I118-L122 PolarHBondContact O-N 3.33Å; I118-A134 HydrophobicContact CG2-CB 4.31Å; I118-A134 WeakPolarHBondContact CG2-O 3.4Å; I118-T137 HydrophobicContact CD1-CG2 4.19Å; I118-T137 HydrophobicContact CG1-CG2 4.31Å; I118-T137 HydrophobicContact CG2-CG2 4.37Å; I118-L138 HydrophobicContact CG2-CB 4.32Å; I118-L141 HydrophobicContact CG1-CD1 4.42Å
119	I	97	Very high	96.1	Very high	2 Å²	2	51.7 Å²	51.7	1%	0.01	27%	0.268	C	S	.	.	H	α-helix	trans	-64.7	-41.2	178	-67.1	172.1	0	0	0	110.9	V115 R116 I121 L122 Q123 L138 E154 I155	V115-I119 HydrophobicContact CG1-CD1 3.95Å; V115-I119 WeakPolarHBondContact O-CG1 3.48Å; V115-I119 PolarHBondContact O-N 3.1Å; R116-I119 PolarHBondContact O-N 3.27Å; I119-I121 PolarHBondContact O-N 3.15Å; I119-L122 WeakPolarHBondContact O-CB 3.39Å; I119-L122 PolarHBondContact O-N 3.44Å; I119-Q123 HydrophobicContact CG2-CG 4.43Å; I119-Q123 WeakPolarHBondContact O-CB 3.34Å; I119-Q123 WeakPolarHBondContact O-CG 3.49Å; I119-Q123 PolarHBondContact O-N 3.33Å; I119-L138 HydrophobicContact CD1-CD1 4.21Å; I119-L138 HydrophobicContact CG1-CD1 3.91Å; I119-L138 HydrophobicContact CG1-CD2 4.32Å; I119-E154 HydrophobicContact CD1-CB 3.75Å; I119-E154 HydrophobicContact CD1-CG 4.2Å; I119-E154 HydrophobicContact CG2-CB 4.24Å; I119-I155 HydrophobicContact CD1-CD1 4.2Å; I119-I155 HydrophobicContact CD1-CG1 4.17Å; I119-I155 HydrophobicContact CG1-CD1 4.18Å; I119-I155 HydrophobicContact CG1-CG1 4.42Å; I119-I155 HydrophobicContact CG2-CD1 4.06Å; I119-I155 HydrophobicContact CG2-CG1 3.61Å
120	H	96.1	Very high	96.1	Very high	109 Å²	109	51.9 Å²	51.9	51%	0.505	27%	0.268	S	S	.	.	H	α-helix	trans	-60.4	-47.4	176.1	-177.7	74.1	0	0	0	111.1	R116 A117 L122 Q123 T124	R116-H120 VanDerWaalsContact O-CB 3.27Å; R116-H120 WeakPolarHBondContact O-CB 3.46Å; R116-H120 PolarHBondContact O-N 2.86Å; A117-H120 PolarHBondContact O-N 2.93Å; H120-L122 VanDerWaalsContact C-N 3.35Å; H120-L122 PolarHBondContact O-N 3.22Å; H120-Q123 PolarHBondContact O-N 3.18Å; H120-Q123 VanDerWaalsContact O-N 3.15Å; H120-T124 VanDerWaalsContact CE1-CG2 3.44Å; H120-T124 WeakPolarHBondContact CE1-CG2 3.13Å; H120-T124 PolarHBondContact NE2-OG1 3.22Å; H120-T124 WeakPolarHBondContact O-CG2 3.3Å; H120-T124 PolarHBondContact O-N 3.3Å; H120-T124 PolarHBondContact O-OG1 2.95Å
121	I	97	Very high	96.2	Very high	17 Å²	17	49.5 Å²	49.5	9%	0.087	25%	0.254	C	S	.	.	H	α-helix	trans	-59	-46.5	176.5	-70.2	166.7	0	0	0	110.6	L79 V92 A117 I118 I119 Q123 T124 T125 L130 A134	L79-I121 HydrophobicContact CB-CD1 4.32Å; L79-I121 HydrophobicContact CD1-CD1 4.13Å; L79-I121 HydrophobicContact CD2-CD1 3.86Å; L79-I121 HydrophobicContact CG-CD1 4.33Å; V92-I121 HydrophobicContact CG2-CD1 4.01Å; A117-I121 VanDerWaalsContact O-CG1 3.28Å; A117-I121 WeakPolarHBondContact O-CG1 3.44Å; A117-I121 PolarHBondContact O-N 3.1Å; I118-I121 PolarHBondContact O-N 2.91Å; I119-I121 PolarHBondContact O-N 3.15Å; I121-Q123 PolarHBondContact O-N 3.31Å; I121-T124 PolarHBondContact O-N 3.46Å; I121-T125 HydrophobicContact CG2-CG2 4.26Å; I121-T125 VanDerWaalsContact O-CB 3.25Å; I121-T125 WeakPolarHBondContact O-CB 3.48Å; I121-T125 WeakPolarHBondContact O-CG2 3.44Å; I121-T125 PolarHBondContact O-N 3.05Å; I121-L130 HydrophobicContact CG2-CD1 3.85Å; I121-L130 HydrophobicContact CG2-CD2 3.96Å; I121-L130 HydrophobicContact CG2-CG 3.6Å; I121-A134 HydrophobicContact CB-CB 4.44Å; I121-A134 HydrophobicContact CG2-CB 3.94Å
122	L	95.9	Very high	96.2	Very high	9 Å²	9	50.4 Å²	50.4	5%	0.047	26%	0.261	C	S	.	.	H	α-helix	trans	-53.6	-43	176.1	-178.5	93.4	0	0	0	111.9	I118 I119 H120 Q131 A134 A135 L138 M171	I118-L122 WeakPolarHBondContact O-CB 3.4Å; I118-L122 PolarHBondContact O-N 3.33Å; I119-L122 WeakPolarHBondContact O-CB 3.39Å; I119-L122 PolarHBondContact O-N 3.44Å; H120-L122 VanDerWaalsContact C-N 3.35Å; H120-L122 PolarHBondContact O-N 3.22Å; L122-Q131 PolarHBondContact O-NE2 3.49Å; L122-A134 HydrophobicContact CB-CB 4.33Å; L122-A135 VanDerWaalsContact CD1-CA 3.48Å; L122-A135 HydrophobicContact CD1-CB 3.41Å; L122-A135 VanDerWaalsContact CD1-CB 3.41Å; L122-L138 HydrophobicContact CD2-CD2 4.16Å; L122-M171 HydrophobicContact CD1-CE 4.43Å; L122-M171 HydrophobicContact CD1-SD 3.99Å
123	Q	93.7	Very high	96.3	Very high	88 Å²	88	50.6 Å²	50.6	41%	0.411	26%	0.258	S	S	.	.	H	α-helix	trans	-81.4	-29.1	-175	-72.1	175.8	-26	0	0	114.1	I119 H120 I121	I119-Q123 HydrophobicContact CG2-CG 4.43Å; I119-Q123 WeakPolarHBondContact O-CB 3.34Å; I119-Q123 WeakPolarHBondContact O-CG 3.49Å; I119-Q123 PolarHBondContact O-N 3.33Å; H120-Q123 PolarHBondContact O-N 3.18Å; H120-Q123 VanDerWaalsContact O-N 3.15Å; I121-Q123 PolarHBondContact O-N 3.31Å
124	T	94.6	Very high	96.4	Very high	79 Å²	79	47 Å²	47	49%	0.485	24%	0.241	S	C	.	.	H	α-helix	trans	-113.1	-21.3	-169.6	65.1	0	0	0	0	115.1	H120 I121	H120-T124 VanDerWaalsContact CE1-CG2 3.44Å; H120-T124 WeakPolarHBondContact CE1-CG2 3.13Å; H120-T124 PolarHBondContact NE2-OG1 3.22Å; H120-T124 WeakPolarHBondContact O-CG2 3.3Å; H120-T124 PolarHBondContact O-N 3.3Å; H120-T124 PolarHBondContact O-OG1 2.95Å; I121-T124 PolarHBondContact O-N 3.46Å
125	T	94.8	Very high	96.4	Very high	28 Å²	28	47 Å²	47	17%	0.172	24%	0.241	C	C	.	.			trans	-68.9	142.4	-178.1	-167.9	0	0	0	0	111.9	I121 N127 L130 Q131	I121-T125 HydrophobicContact CG2-CG2 4.26Å; I121-T125 VanDerWaalsContact O-CB 3.25Å; I121-T125 WeakPolarHBondContact O-CB 3.48Å; I121-T125 WeakPolarHBondContact O-CG2 3.44Å; I121-T125 PolarHBondContact O-N 3.05Å; T125-N127 PolarHBondContact OG1-N 3.2Å; T125-L130 HydrophobicContact CG2-CG 4.4Å; T125-Q131 HydrophobicContact CG2-CB 3.55Å; T125-Q131 HydrophobicContact CG2-CG 3.9Å
126	K	94.3	Very high	96.4	Very high	213 Å²	213	49.4 Å²	49.4	93%	0.926	25%	0.254	S	S	*	.			trans	-97.2	-7.9	171.5	-62.4	-176.6	-178.8	179.2	0	112.8
127	N	96	Very high	96.5	Very high	52 Å²	52	45 Å²	45	28%	0.278	24%	0.237	S	C	.	.			trans	-86.6	120.3	179	178	-76.8	0	0	0	110	V85 T125 D129 L130 Q131	V85-N127 HydrophobicContact CG1-CB 3.54Å; T125-N127 PolarHBondContact OG1-N 3.2Å; N127-D129 PolarHBondContact O-N 2.98Å; N127-D129 PolarHBondContact OD1-N 3.44Å; N127-D129 VanDerWaalsContact OD1-N 3.1Å; N127-L130 HydrophobicContact CB-CB 4.18Å; N127-L130 PolarHBondContact O-N 3.19Å; N127-L130 WeakPolarHBondContact OD1-CB 3.06Å; N127-L130 PolarHBondContact OD1-N 3.3Å; N127-Q131 WeakPolarHBondContact O-CB 3.48Å; N127-Q131 PolarHBondContact O-N 2.75Å
128	A	94.9	Very high	96.5	Very high	65 Å²	65	44.7 Å²	44.7	54%	0.537	23%	0.234	S	C	.	.	H	α-helix	trans	-65	-35.4	-174	0	0	0	0	0	113.5	S132	A128-S132 VanDerWaalsContact O-CB 3.29Å; A128-S132 WeakPolarHBondContact O-CB 3.37Å; A128-S132 PolarHBondContact O-N 3.26Å; A128-S132 PolarHBondContact O-OG 3.04Å
129	D	96.4	Very high	96.5	Very high	108 Å²	108	44.7 Å²	44.7	58%	0.578	23%	0.234	S	C	*	.	H	α-helix	trans	-69.9	-46.4	179.9	-63.1	-41	0	0	0	110.8	L89 N127 Q131 S132 E133	L89-D129 HydrophobicContact CD2-CB 4.22Å; N127-D129 PolarHBondContact O-N 2.98Å; N127-D129 PolarHBondContact OD1-N 3.44Å; N127-D129 VanDerWaalsContact OD1-N 3.1Å; D129-Q131 PolarHBondContact O-N 3.19Å; D129-S132 PolarHBondContact O-N 3.16Å; D129-E133 WeakPolarHBondContact O-CB 3.29Å; D129-E133 PolarHBondContact O-N 3.02Å
130	L	97.4	Very high	96.5	Very high	6 Å²	6	45.5 Å²	45.5	3%	0.031	24%	0.239	C	C	.	.	H	α-helix	trans	-63.2	-41.3	175.1	179.1	57.4	0	0	0	111.7	V85 A88 L89 V92 I121 T125 N127 S132 E133 A134	V85-L130 HydrophobicContact CG1-CB 4.47Å; V85-L130 HydrophobicContact CG1-CD2 4.09Å; A88-L130 HydrophobicContact CB-CD1 4.15Å; A88-L130 HydrophobicContact CB-CD2 3.8Å; L89-L130 HydrophobicContact CB-CD1 4.25Å; L89-L130 HydrophobicContact CD1-CB 4.47Å; L89-L130 HydrophobicContact CD1-CD1 4.47Å; V92-L130 HydrophobicContact CB-CD1 4.26Å; V92-L130 HydrophobicContact CG2-CD1 3.89Å; I121-L130 HydrophobicContact CG2-CD1 3.85Å; I121-L130 HydrophobicContact CG2-CD2 3.96Å; I121-L130 HydrophobicContact CG2-CG 3.6Å; T125-L130 HydrophobicContact CG2-CG 4.4Å; N127-L130 HydrophobicContact CB-CB 4.18Å; N127-L130 PolarHBondContact O-N 3.19Å; N127-L130 WeakPolarHBondContact OD1-CB 3.06Å; N127-L130 PolarHBondContact OD1-N 3.3Å; L130-S132 VanDerWaalsContact C-N 3.33Å; L130-S132 PolarHBondContact O-N 2.95Å; L130-E133 PolarHBondContact O-N 3.03Å; L130-A134 VanDerWaalsContact O-CB 3.31Å; L130-A134 WeakPolarHBondContact O-CB 3.38Å; L130-A134 PolarHBondContact O-N 3.28Å
131	Q	97	Very high	96.6	Very high	47 Å²	47	40.3 Å²	40.3	22%	0.22	22%	0.215	C	C	.	.	H	α-helix	trans	-61	-45.9	175.5	-158.3	-178.3	36.1	0	0	110.8	L122 T125 N127 D129 A134 A135 M171	L122-Q131 PolarHBondContact O-NE2 3.49Å; T125-Q131 HydrophobicContact CG2-CB 3.55Å; T125-Q131 HydrophobicContact CG2-CG 3.9Å; N127-Q131 WeakPolarHBondContact O-CB 3.48Å; N127-Q131 PolarHBondContact O-N 2.75Å; D129-Q131 PolarHBondContact O-N 3.19Å; Q131-A134 PolarHBondContact O-N 3.43Å; Q131-A135 WeakPolarHBondContact O-CB 3.48Å; Q131-A135 PolarHBondContact O-N 2.86Å; Q131-M171 HydrophobicContact CB-CE 4.18Å; Q131-M171 HydrophobicContact CG-CE 3.68Å; Q131-M171 HydrophobicContact CG-SD 4.04Å
132	S	96.8	Very high	96.6	Very high	28 Å²	28	39.5 Å²	39.5	20%	0.196	21%	0.21	C	C	.	.	H	α-helix	trans	-64	-43.8	179.7	-61.4	0	0	0	0	111.7	A128 D129 L130 A135 L136	A128-S132 VanDerWaalsContact O-CB 3.29Å; A128-S132 WeakPolarHBondContact O-CB 3.37Å; A128-S132 PolarHBondContact O-N 3.26Å; A128-S132 PolarHBondContact O-OG 3.04Å; D129-S132 PolarHBondContact O-N 3.16Å; L130-S132 VanDerWaalsContact C-N 3.33Å; L130-S132 PolarHBondContact O-N 2.95Å; S132-A135 WeakPolarHBondContact O-CB 3.07Å; S132-A135 PolarHBondContact O-N 3.39Å; S132-L136 VanDerWaalsContact O-CG 3.31Å; S132-L136 WeakPolarHBondContact O-CG 3.37Å; S132-L136 PolarHBondContact O-N 3.13Å
133	E	97.7	Very high	96.5	Very high	36 Å²	36	40.9 Å²	40.9	17%	0.168	22%	0.216	C	C	.	.	H	α-helix	trans	-66.4	-39.1	178.7	-163.3	66.6	-167.8	0	0	111.6	L89 V92 S93 H96 D129 L130 A135 L136 T137	L89-E133 HydrophobicContact CD1-CB 3.77Å; L89-E133 HydrophobicContact CD1-CG 4.12Å; V92-E133 HydrophobicContact CB-CG 4.37Å; V92-E133 HydrophobicContact CG1-CB 4.13Å; V92-E133 HydrophobicContact CG1-CG 3.84Å; S93-E133 WeakPolarHBondContact CA-OE1 3.38Å; H96-E133 WeakPolarHBondContact CB-OE1 3.42Å; H96-E133 IonicContact CE1-OE1 3.19Å; H96-E133 IonicContact CG-OE1 2.88Å; H96-E133 IonicContact ND1-OE1 3.79Å; H96-E133 PolarHBondContact ND1-OE1 3.36Å; H96-E133 IonicContact ND1-OE2 3.53Å; D129-E133 WeakPolarHBondContact O-CB 3.29Å; D129-E133 PolarHBondContact O-N 3.02Å; L130-E133 PolarHBondContact O-N 3.03Å; E133-A135 VanDerWaalsContact C-N 3.34Å; E133-A135 PolarHBondContact O-N 3.22Å; E133-L136 PolarHBondContact O-N 3.27Å; E133-T137 WeakPolarHBondContact O-CB 3.38Å; E133-T137 PolarHBondContact O-N 2.76Å; E133-T137 PolarHBondContact O-OG1 2.75Å
134	A	98.1	Very high	96.5	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-63.1	-40.5	173.3	0	0	0	0	0	111.6	V92 I118 I121 L122 L130 Q131 T137 L138	V92-A134 HydrophobicContact CG1-CB 4.31Å; I118-A134 HydrophobicContact CG2-CB 4.31Å; I118-A134 WeakPolarHBondContact CG2-O 3.4Å; I121-A134 HydrophobicContact CB-CB 4.44Å; I121-A134 HydrophobicContact CG2-CB 3.94Å; L122-A134 HydrophobicContact CB-CB 4.33Å; L130-A134 VanDerWaalsContact O-CB 3.31Å; L130-A134 WeakPolarHBondContact O-CB 3.38Å; L130-A134 PolarHBondContact O-N 3.28Å; Q131-A134 PolarHBondContact O-N 3.43Å; A134-T137 PolarHBondContact O-N 3.39Å; A134-L138 WeakPolarHBondContact O-CB 3.44Å; A134-L138 PolarHBondContact O-N 3.47Å
135	A	97.8	Very high	96.5	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-63.6	-48.7	176.8	0	0	0	0	0	112.2	L122 Q131 S132 E133 T137 L138 Q139 V170 M171 T174	L122-A135 VanDerWaalsContact CD1-CA 3.48Å; L122-A135 HydrophobicContact CD1-CB 3.41Å; L122-A135 VanDerWaalsContact CD1-CB 3.41Å; Q131-A135 WeakPolarHBondContact O-CB 3.48Å; Q131-A135 PolarHBondContact O-N 2.86Å; S132-A135 WeakPolarHBondContact O-CB 3.07Å; S132-A135 PolarHBondContact O-N 3.39Å; E133-A135 VanDerWaalsContact C-N 3.34Å; E133-A135 PolarHBondContact O-N 3.22Å; A135-T137 VanDerWaalsContact C-N 3.3Å; A135-T137 PolarHBondContact O-N 2.91Å; A135-L138 WeakPolarHBondContact O-CB 3.4Å; A135-L138 PolarHBondContact O-N 2.97Å; A135-L138 VanDerWaalsContact O-N 3.15Å; A135-Q139 WeakPolarHBondContact O-CG 3.35Å; A135-Q139 PolarHBondContact O-N 3.19Å; A135-V170 HydrophobicContact CB-CG1 3.88Å; A135-M171 HydrophobicContact CB-CE 3.6Å; A135-M171 HydrophobicContact CB-SD 4.17Å; A135-T174 HydrophobicContact CB-CG2 4.03Å; A135-T174 WeakPolarHBondContact CB-OG1 3.37Å; A135-T174 WeakPolarHBondContact O-CG2 3.29Å
136	L	97.3	Very high	96.5	Very high	51 Å²	51	38.3 Å²	38.3	27%	0.267	21%	0.205	S	C	.	.	H	α-helix	trans	-62.4	-38.4	176.3	-66.5	173.5	0	0	0	111.9	S132 E133 Q139 L140 V170	S132-L136 VanDerWaalsContact O-CG 3.31Å; S132-L136 WeakPolarHBondContact O-CG 3.37Å; S132-L136 PolarHBondContact O-N 3.13Å; E133-L136 PolarHBondContact O-N 3.27Å; L136-Q139 WeakPolarHBondContact O-CB 3.17Å; L136-Q139 PolarHBondContact O-N 3.47Å; L136-L140 PolarHBondContact O-N 3.05Å; L136-V170 HydrophobicContact CD2-CG1 4.31Å; L136-V170 HydrophobicContact CG-CG1 4.22Å
137	T	98.3	Very high	96.6	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-61.3	-46.3	173.3	-56.7	0	0	0	0	110.8	V92 I95 H96 I118 E133 A134 A135 Q139 L140 L141	V92-T137 WeakPolarHBondContact CG1-OG1 3.35Å; I95-T137 HydrophobicContact CB-CG2 4.26Å; I95-T137 HydrophobicContact CG2-CG2 3.62Å; H96-T137 WeakPolarHBondContact CB-OG1 3.43Å; I118-T137 HydrophobicContact CD1-CG2 4.19Å; I118-T137 HydrophobicContact CG1-CG2 4.31Å; I118-T137 HydrophobicContact CG2-CG2 4.37Å; E133-T137 WeakPolarHBondContact O-CB 3.38Å; E133-T137 PolarHBondContact O-N 2.76Å; E133-T137 PolarHBondContact O-OG1 2.75Å; A134-T137 PolarHBondContact O-N 3.39Å; A135-T137 VanDerWaalsContact C-N 3.3Å; A135-T137 PolarHBondContact O-N 2.91Å; T137-Q139 VanDerWaalsContact C-N 3.33Å; T137-Q139 PolarHBondContact O-N 2.67Å; T137-L140 PolarHBondContact O-N 3.1Å; T137-L140 VanDerWaalsContact O-N 3.15Å; T137-L141 HydrophobicContact CG2-CD1 4.02Å; T137-L141 HydrophobicContact CG2-CG 4.29Å; T137-L141 WeakPolarHBondContact O-CG 3.08Å; T137-L141 PolarHBondContact O-N 3Å
138	L	98.2	Very high	96.6	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-61.7	-38.4	178.4	-176.4	64.1	0	0	0	112.4	I118 I119 L122 A134 A135 L140 L141 T142 A151 I155 T174 V178	I118-L138 HydrophobicContact CG2-CB 4.32Å; I119-L138 HydrophobicContact CD1-CD1 4.21Å; I119-L138 HydrophobicContact CG1-CD1 3.91Å; I119-L138 HydrophobicContact CG1-CD2 4.32Å; L122-L138 HydrophobicContact CD2-CD2 4.16Å; A134-L138 WeakPolarHBondContact O-CB 3.44Å; A134-L138 PolarHBondContact O-N 3.47Å; A135-L138 WeakPolarHBondContact O-CB 3.4Å; A135-L138 PolarHBondContact O-N 2.97Å; A135-L138 VanDerWaalsContact O-N 3.15Å; L138-L140 VanDerWaalsContact C-N 3.31Å; L138-L140 PolarHBondContact O-N 3.34Å; L138-L141 PolarHBondContact O-N 2.7Å; L138-T142 HydrophobicContact CD1-CG2 3.92Å; L138-T142 HydrophobicContact CG-CG2 4.22Å; L138-T142 WeakPolarHBondContact O-CB 3.41Å; L138-T142 WeakPolarHBondContact O-CG2 2.99Å; L138-T142 PolarHBondContact O-N 3.28Å; L138-T142 PolarHBondContact O-OG1 2.93Å; L138-A151 HydrophobicContact CD1-CB 4.37Å; L138-I155 HydrophobicContact CD2-CD1 3.78Å; L138-T174 HydrophobicContact CD2-CG2 4.45Å; L138-V178 HydrophobicContact CD2-CG2 4.29Å; L138-V178 HydrophobicContact CG-CG2 4.22Å
139	Q	97.5	Very high	96.7	Very high	1 Å²	1	27 Å²	27	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-55.9	-47.5	173.4	-66.1	179.6	10.6	0	0	111	A135 L136 T137 T142 K143 T174 Y177	A135-Q139 WeakPolarHBondContact O-CG 3.35Å; A135-Q139 PolarHBondContact O-N 3.19Å; L136-Q139 WeakPolarHBondContact O-CB 3.17Å; L136-Q139 PolarHBondContact O-N 3.47Å; T137-Q139 VanDerWaalsContact C-N 3.33Å; T137-Q139 PolarHBondContact O-N 2.67Å; Q139-T142 PolarHBondContact O-OG1 3.07Å; Q139-T142 VanDerWaalsContact O-OG1 3.06Å; Q139-K143 PolarHBondContact O-N 3.15Å; Q139-T174 HydrophobicContact CG-CG2 3.89Å; Q139-T174 VanDerWaalsContact NE2-CA 3.33Å; Q139-T174 PolarHBondContact NE2-OG1 2.86Å; Q139-Y177 HydrophobicContact CB-CD1 3.91Å; Q139-Y177 HydrophobicContact CB-CE1 4.34Å; Q139-Y177 HydrophobicContact CB-CG 4.29Å; Q139-Y177 HydrophobicContact CG-CD1 4.27Å; Q139-Y177 HydrophobicContact CG-CG 4.3Å; Q139-Y177 WeakPolarHBondContact O-CE1 3.28Å
140	L	97.3	Very high	96.7	Very high	19 Å²	19	22.7 Å²	22.7	10%	0.099	12%	0.117	C	C	.	.	H	α-helix	trans	-64.3	-49.9	177.7	-65.8	-178.4	0	0	0	111.4	H96 A99 R100 R105 L136 T137 L138 T142 K143	H96-L140 WeakPolarHBondContact CD2-CD1 3.21Å; H96-L140 WeakPolarHBondContact O-CD1 3.34Å; A99-L140 HydrophobicContact CB-CB 3.9Å; A99-L140 HydrophobicContact CB-CD1 4.06Å; R100-L140 HydrophobicContact CG-CD1 3.72Å; R105-L140 WeakPolarHBondContact CD-O 3.35Å; L136-L140 PolarHBondContact O-N 3.05Å; T137-L140 PolarHBondContact O-N 3.1Å; T137-L140 VanDerWaalsContact O-N 3.15Å; L138-L140 VanDerWaalsContact C-N 3.31Å; L138-L140 PolarHBondContact O-N 3.34Å; L140-T142 VanDerWaalsContact C-N 3.27Å; L140-T142 PolarHBondContact O-N 2.79Å; L140-K143 WeakPolarHBondContact O-CB 3.35Å; L140-K143 PolarHBondContact O-N 3Å
141	L	97.4	Very high	96.6	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-57.5	-40.1	-177.9	-65.5	177	0	0	0	112.3	A99 L108 V109 V115 I118 T137 L138 K143 A144	A99-L141 HydrophobicContact CB-CD2 4.12Å; L108-L141 HydrophobicContact CB-CD2 4.06Å; L108-L141 HydrophobicContact CD1-CD2 4.39Å; V109-L141 HydrophobicContact CG1-CB 3.96Å; V109-L141 HydrophobicContact CG1-CD2 3.82Å; V109-L141 HydrophobicContact CG1-CG 4.45Å; V109-L141 WeakPolarHBondContact CG1-O 3.38Å; V115-L141 HydrophobicContact CG2-CD1 4.41Å; I118-L141 HydrophobicContact CG1-CD1 4.42Å; T137-L141 HydrophobicContact CG2-CD1 4.02Å; T137-L141 HydrophobicContact CG2-CG 4.29Å; T137-L141 WeakPolarHBondContact O-CG 3.08Å; T137-L141 PolarHBondContact O-N 3Å; L138-L141 PolarHBondContact O-N 2.7Å; L141-K143 PolarHBondContact O-N 3.45Å; L141-A144 PolarHBondContact O-N 2.85Å
142	T	96.9	Very high	96.6	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-72.5	-8.5	179.6	54.5	0	0	0	0	114.7	L138 Q139 L140 A144 A151 V178 Q181	L138-T142 HydrophobicContact CD1-CG2 3.92Å; L138-T142 HydrophobicContact CG-CG2 4.22Å; L138-T142 WeakPolarHBondContact O-CB 3.41Å; L138-T142 WeakPolarHBondContact O-CG2 2.99Å; L138-T142 PolarHBondContact O-N 3.28Å; L138-T142 PolarHBondContact O-OG1 2.93Å; Q139-T142 PolarHBondContact O-OG1 3.07Å; Q139-T142 VanDerWaalsContact O-OG1 3.06Å; L140-T142 VanDerWaalsContact C-N 3.27Å; L140-T142 PolarHBondContact O-N 2.79Å; T142-A144 PolarHBondContact O-N 3.5Å; T142-A151 HydrophobicContact CG2-CB 3.62Å; T142-V178 HydrophobicContact CG2-CG1 4.17Å; T142-V178 HydrophobicContact CG2-CG2 4.02Å; T142-Q181 WeakPolarHBondContact O-CG 3.17Å
143	K	94.8	Very high	96.6	Very high	38 Å²	38	28.3 Å²	28.3	17%	0.165	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-29	168.2	-169.4	173.4	174.6	-168.6	0	111.8	D9 Q139 L140 L141 H185	D9-K143 VanDerWaalsContact CB-NZ 3.27Å; D9-K143 IonicContact OD2-NZ 3.94Å; D9-K143 PolarHBondContact OD2-NZ 3Å; Q139-K143 PolarHBondContact O-N 3.15Å; L140-K143 WeakPolarHBondContact O-CB 3.35Å; L140-K143 PolarHBondContact O-N 3Å; L141-K143 PolarHBondContact O-N 3.45Å; K143-H185 PolarHBondContact O-NE2 3.3Å
144	A	93.6	Very high	96.5	Very high	12 Å²	12	30 Å²	30	10%	0.099	15%	0.146	C	C	.	.	S	Bend	trans	-85.9	139.7	171.5	0	0	0	0	0	111	R105 V109 L141 T142 T146 G147 A148	R105-A144 HydrophobicContact CG-CB 4.23Å; V109-A144 HydrophobicContact CG1-CB 4.37Å; V109-A144 HydrophobicContact CG2-CB 3.99Å; L141-A144 PolarHBondContact O-N 2.85Å; T142-A144 PolarHBondContact O-N 3.5Å; A144-T146 VanDerWaalsContact C-N 3.28Å; A144-T146 PolarHBondContact O-N 3.32Å; A144-G147 PolarHBondContact O-N 3.18Å; A144-A148 PolarHBondContact O-N 2.56Å
145	L	93.9	Very high	96.4	Very high	72 Å²	72	30.8 Å²	30.8	38%	0.377	15%	0.15	S	C	.	.	H	α-helix	trans	-53.2	-42.6	-179.6	174.7	62.5	0	0	0	112.7	A148 K149 H185 L186	L145-A148 PolarHBondContact O-N 2.76Å; L145-K149 HydrophobicContact CD1-CD 4.49Å; L145-K149 HydrophobicContact CD1-CG 4.33Å; L145-K149 HydrophobicContact CG-CD 4.42Å; L145-K149 WeakPolarHBondContact O-CG 3.32Å; L145-K149 PolarHBondContact O-N 3.27Å; L145-H185 HydrophobicContact CD1-CB 3.63Å; L145-L186 HydrophobicContact CD1-CD2 4.06Å
146	T	95.6	Very high	96.3	Very high	57 Å²	57	31.8 Å²	31.8	35%	0.35	16%	0.16	S	C	.	.	H	α-helix	trans	-62.6	-44.2	178.4	-49.4	0	0	0	0	111.4	V109 A144 K149 L150	V109-T146 HydrophobicContact CB-CG2 4.46Å; V109-T146 HydrophobicContact CG2-CG2 4.3Å; V109-T146 WeakPolarHBondContact O-CG2 3.42Å; A144-T146 VanDerWaalsContact C-N 3.28Å; A144-T146 PolarHBondContact O-N 3.32Å; T146-K149 PolarHBondContact O-N 3.05Å; T146-L150 HydrophobicContact CG2-CD1 4.4Å; T146-L150 WeakPolarHBondContact O-CG 3.25Å; T146-L150 PolarHBondContact O-N 2.86Å
147	G	96.3	Very high	96.2	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-64.6	-39.8	175.9	0	0	0	0	0	112.3	A144 L150 A151	A144-G147 PolarHBondContact O-N 3.18Å; G147-L150 PolarHBondContact O-N 3Å; G147-A151 WeakPolarHBondContact O-CB 3.42Å; G147-A151 PolarHBondContact O-N 3.1Å
148	A	96	Very high	96.1	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-62.1	-45	174.5	0	0	0	0	0	111.9	A144 L145 L150 A151 Y152 L182	A144-A148 PolarHBondContact O-N 2.56Å; L145-A148 PolarHBondContact O-N 2.76Å; A148-L150 PolarHBondContact O-N 3.14Å; A148-A151 PolarHBondContact O-N 2.76Å; A148-Y152 PolarHBondContact O-N 3.45Å; A148-L182 HydrophobicContact CB-CD2 4.13Å; A148-L182 WeakPolarHBondContact O-CD2 3.24Å
149	K	96.3	Very high	96	Very high	93 Å²	93	36.6 Å²	36.6	40%	0.404	19%	0.187	S	C	.	.	H	α-helix	trans	-59.1	-46.3	176	-75.6	177	177.3	-178.4	0	112.2	L145 T146 A151 Y152 E153 L186	L145-K149 HydrophobicContact CD1-CD 4.49Å; L145-K149 HydrophobicContact CD1-CG 4.33Å; L145-K149 HydrophobicContact CG-CD 4.42Å; L145-K149 WeakPolarHBondContact O-CG 3.32Å; L145-K149 PolarHBondContact O-N 3.27Å; T146-K149 PolarHBondContact O-N 3.05Å; K149-A151 PolarHBondContact O-N 3.43Å; K149-Y152 WeakPolarHBondContact O-CB 3.49Å; K149-Y152 PolarHBondContact O-N 3.17Å; K149-Y152 VanDerWaalsContact O-N 3.17Å; K149-E153 WeakPolarHBondContact O-CG 3.43Å; K149-E153 PolarHBondContact O-N 2.89Å; K149-L186 HydrophobicContact CG-CD1 4.04Å; K149-L186 HydrophobicContact CG-CD2 4.2Å
150	L	96.8	Very high	96	Very high	16 Å²	16	36.6 Å²	36.6	8%	0.084	19%	0.187	C	C	.	.	H	α-helix	trans	-63	-42	177.2	-70.1	168.6	0	0	0	111.6	V115 T146 G147 A148 Y152 E153 E154	V115-L150 HydrophobicContact CB-CB 4.39Å; V115-L150 HydrophobicContact CB-CD1 3.94Å; V115-L150 HydrophobicContact CG1-CB 3.88Å; V115-L150 HydrophobicContact CG1-CD1 4.27Å; V115-L150 HydrophobicContact CG2-CD1 3.73Å; T146-L150 HydrophobicContact CG2-CD1 4.4Å; T146-L150 WeakPolarHBondContact O-CG 3.25Å; T146-L150 PolarHBondContact O-N 2.86Å; G147-L150 PolarHBondContact O-N 3Å; A148-L150 PolarHBondContact O-N 3.14Å; L150-Y152 VanDerWaalsContact C-N 3.3Å; L150-Y152 PolarHBondContact O-N 3.36Å; L150-E153 PolarHBondContact O-N 3.38Å; L150-E154 WeakPolarHBondContact O-CB 3.4Å; L150-E154 VanDerWaalsContact O-CG 3.25Å; L150-E154 WeakPolarHBondContact O-CG 3.49Å; L150-E154 PolarHBondContact O-N 2.86Å
151	A	96.1	Very high	95.9	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-62.5	-36.4	174.7	0	0	0	0	0	112.7	L138 T142 G147 A148 K149 I155 V178	L138-A151 HydrophobicContact CD1-CB 4.37Å; T142-A151 HydrophobicContact CG2-CB 3.62Å; G147-A151 WeakPolarHBondContact O-CB 3.42Å; G147-A151 PolarHBondContact O-N 3.1Å; A148-A151 PolarHBondContact O-N 2.76Å; K149-A151 PolarHBondContact O-N 3.43Å; A151-I155 WeakPolarHBondContact O-CB 3.41Å; A151-I155 PolarHBondContact O-N 3.34Å; A151-V178 HydrophobicContact CB-CG1 4.13Å
152	Y	96.3	Very high	95.8	Very high	75 Å²	75	42.1 Å²	42.1	29%	0.294	21%	0.213	S	C	.	.	H	α-helix	trans	-63.8	-43.1	173.8	175.8	-96.9	0	0	0	112.3	A148 K149 L150 G156 I157	A148-Y152 PolarHBondContact O-N 3.45Å; K149-Y152 WeakPolarHBondContact O-CB 3.49Å; K149-Y152 PolarHBondContact O-N 3.17Å; K149-Y152 VanDerWaalsContact O-N 3.17Å; L150-Y152 VanDerWaalsContact C-N 3.3Å; L150-Y152 PolarHBondContact O-N 3.36Å; Y152-G156 VanDerWaalsContact O-CA 3.25Å; Y152-G156 WeakPolarHBondContact O-CA 3.46Å; Y152-G156 PolarHBondContact O-N 3.32Å; Y152-G156 VanDerWaalsContact O-N 3.09Å; Y152-I157 HydrophobicContact CD2-CD1 4.16Å; Y152-I157 HydrophobicContact CD2-CG1 3.85Å; Y152-I157 HydrophobicContact CE2-CD1 4.36Å; Y152-I157 HydrophobicContact CE2-CG1 3.65Å
153	E	95.7	Very high	95.8	Very high	124 Å²	124	43.7 Å²	43.7	58%	0.579	22%	0.22	S	C	*	.	H	α-helix	trans	-69.5	-41.3	-179.5	-71.5	169.3	-172.4	0	0	112.4	K149 L150	K149-E153 WeakPolarHBondContact O-CG 3.43Å; K149-E153 PolarHBondContact O-N 2.89Å; L150-E153 PolarHBondContact O-N 3.38Å
154	E	95.9	Very high	95.8	Very high	72 Å²	72	41.9 Å²	41.9	34%	0.336	21%	0.213	S	C	.	.	H	α-helix	trans	-88.3	-32.2	-172.3	-60.7	-66.9	146	0	0	113.8	R116 I119 L150	R116-E154 WeakPolarHBondContact CD-OE1 3.24Å; R116-E154 HydrophobicContact CG-CG 3.96Å; R116-E154 IonicContact CZ-OE1 3.41Å; R116-E154 IonicContact NE-OE1 2.69Å; R116-E154 PolarHBondContact NE-OE1 3.38Å; R116-E154 IonicContact NE-OE2 2.71Å; R116-E154 IonicContact NH2-OE1 3.2Å; I119-E154 HydrophobicContact CD1-CB 3.75Å; I119-E154 HydrophobicContact CD1-CG 4.2Å; I119-E154 HydrophobicContact CG2-CB 4.24Å; L150-E154 WeakPolarHBondContact O-CB 3.4Å; L150-E154 VanDerWaalsContact O-CG 3.25Å; L150-E154 WeakPolarHBondContact O-CG 3.49Å; L150-E154 PolarHBondContact O-N 2.86Å
155	I	96.3	Very high	95.7	Very high	17 Å²	17	45.2 Å²	45.2	9%	0.087	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105	-43.6	-178.9	-51.8	173.7	0	0	0	111.1	I119 L138 A151 Q159 L160	I119-I155 HydrophobicContact CD1-CD1 4.2Å; I119-I155 HydrophobicContact CD1-CG1 4.17Å; I119-I155 HydrophobicContact CG1-CD1 4.18Å; I119-I155 HydrophobicContact CG1-CG1 4.42Å; I119-I155 HydrophobicContact CG2-CD1 4.06Å; I119-I155 HydrophobicContact CG2-CG1 3.61Å; L138-I155 HydrophobicContact CD2-CD1 3.78Å; A151-I155 WeakPolarHBondContact O-CB 3.41Å; A151-I155 PolarHBondContact O-N 3.34Å; I155-Q159 HydrophobicContact CG2-CB 4.06Å; I155-Q159 HydrophobicContact CG2-CG 4.27Å; I155-Q159 WeakPolarHBondContact O-CB 3.32Å; I155-L160 HydrophobicContact CB-CG 4.38Å; I155-L160 HydrophobicContact CD1-CD2 4.26Å; I155-L160 HydrophobicContact CG2-CD2 3.9Å; I155-L160 HydrophobicContact CG2-CG 3.77Å
156	G	95.4	Very high	95.7	Very high	21 Å²	21	45 Å²	45	22%	0.216	22%	0.219	C	C	.	.	H	α-helix	trans	74.6	155.2	-174.3	0	0	0	0	0	114.5	Y152 S158 L160	Y152-G156 VanDerWaalsContact O-CA 3.25Å; Y152-G156 WeakPolarHBondContact O-CA 3.46Å; Y152-G156 PolarHBondContact O-N 3.32Å; Y152-G156 VanDerWaalsContact O-N 3.09Å; G156-S158 VanDerWaalsContact C-N 3.34Å; G156-S158 PolarHBondContact O-N 2.96Å; G156-L160 WeakPolarHBondContact O-CG 3.4Å; G156-L160 PolarHBondContact O-N 3.22Å
157	I	96.7	Very high	95.5	Very high	3 Å²	3	48.1 Å²	48.1	2%	0.015	24%	0.241	C	C	.	.	H	α-helix	trans	-64	-36	-175.9	-64.9	-70.3	0	0	0	112.6	Y152 L160 V161 L179 L182 K193 F194	Y152-I157 HydrophobicContact CD2-CD1 4.16Å; Y152-I157 HydrophobicContact CD2-CG1 3.85Å; Y152-I157 HydrophobicContact CE2-CD1 4.36Å; Y152-I157 HydrophobicContact CE2-CG1 3.65Å; I157-L160 PolarHBondContact O-N 3.2Å; I157-V161 HydrophobicContact CG2-CG2 4.13Å; I157-V161 WeakPolarHBondContact O-CB 3.26Å; I157-V161 VanDerWaalsContact O-CG2 3.25Å; I157-V161 WeakPolarHBondContact O-CG2 3.27Å; I157-V161 PolarHBondContact O-N 3.08Å; I157-L179 HydrophobicContact CD1-CD2 3.89Å; I157-L179 HydrophobicContact CG2-CD2 4.4Å; I157-L182 HydrophobicContact CD1-CB 4.3Å; I157-L182 HydrophobicContact CD1-CD1 3.66Å; I157-K193 HydrophobicContact CB-CB 4.34Å; I157-K193 HydrophobicContact CB-CG 3.81Å; I157-K193 HydrophobicContact CG1-CB 4.32Å; I157-K193 HydrophobicContact CG1-CG 4.21Å; I157-K193 HydrophobicContact CG2-CB 4.38Å; I157-K193 HydrophobicContact CG2-CG 4.09Å; I157-F194 VanDerWaalsContact CG2-CA 3.47Å; I157-F194 HydrophobicContact CG2-CB 3.93Å; I157-F194 HydrophobicContact CG2-CD2 4.1Å
158	S	95.5	Very high	95.3	Very high	53 Å²	53	49.9 Å²	49.9	37%	0.371	25%	0.253	S	S	.	.	H	α-helix	trans	-62.2	-48	-177.1	-161.2	0	0	0	0	111.6	G156 V161 E162	G156-S158 VanDerWaalsContact C-N 3.34Å; G156-S158 PolarHBondContact O-N 2.96Å; S158-V161 WeakPolarHBondContact O-CB 3.36Å; S158-V161 PolarHBondContact O-N 3.4Å; S158-E162 PolarHBondContact O-N 3.1Å
159	Q	96	Very high	95.2	Very high	96 Å²	96	54.8 Å²	54.8	45%	0.449	28%	0.276	S	S	.	.	H	α-helix	trans	-70.8	-35.8	-178.1	-168.2	165	19.9	0	0	111.8	I155 V161 E162 M163	I155-Q159 HydrophobicContact CG2-CB 4.06Å; I155-Q159 HydrophobicContact CG2-CG 4.27Å; I155-Q159 WeakPolarHBondContact O-CB 3.32Å; Q159-V161 VanDerWaalsContact C-N 3.32Å; Q159-V161 PolarHBondContact O-N 3.21Å; Q159-E162 PolarHBondContact O-N 2.82Å; Q159-M163 WeakPolarHBondContact O-CB 3.47Å; Q159-M163 PolarHBondContact O-N 3.23Å
160	L	97.7	Very high	95.1	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-61.7	-39.9	170.6	-70.4	169.9	0	0	0	112	I155 G156 I157 M163 L164 V178 L179 L182	I155-L160 HydrophobicContact CB-CG 4.38Å; I155-L160 HydrophobicContact CD1-CD2 4.26Å; I155-L160 HydrophobicContact CG2-CD2 3.9Å; I155-L160 HydrophobicContact CG2-CG 3.77Å; G156-L160 WeakPolarHBondContact O-CG 3.4Å; G156-L160 PolarHBondContact O-N 3.22Å; I157-L160 PolarHBondContact O-N 3.2Å; L160-M163 HydrophobicContact CD2-CE 3.92Å; L160-M163 PolarHBondContact O-N 2.7Å; L160-L164 PolarHBondContact O-N 2.96Å; L160-V178 HydrophobicContact CD1-CG1 3.71Å; L160-V178 HydrophobicContact CD2-CB 4.19Å; L160-V178 HydrophobicContact CD2-CG1 3.98Å; L160-L179 HydrophobicContact CB-CD1 4.07Å; L160-L179 HydrophobicContact CB-CD2 3.74Å; L160-L179 HydrophobicContact CB-CG 3.81Å; L160-L179 HydrophobicContact CD1-CD2 4.08Å; L160-L179 HydrophobicContact CD1-CG 4.34Å; L160-L182 HydrophobicContact CD1-CD1 3.52Å
161	V	95.7	Very high	95.1	Very high	5 Å²	5	51.5 Å²	51.5	3%	0.03	26%	0.264	C	S	.	.	H	α-helix	trans	-64.7	-40.8	176.2	167.6	0	0	0	0	111.4	I157 S158 Q159 M163 L164 L179 F194 C197 N202	I157-V161 HydrophobicContact CG2-CG2 4.13Å; I157-V161 WeakPolarHBondContact O-CB 3.26Å; I157-V161 VanDerWaalsContact O-CG2 3.25Å; I157-V161 WeakPolarHBondContact O-CG2 3.27Å; I157-V161 PolarHBondContact O-N 3.08Å; S158-V161 WeakPolarHBondContact O-CB 3.36Å; S158-V161 PolarHBondContact O-N 3.4Å; Q159-V161 VanDerWaalsContact C-N 3.32Å; Q159-V161 PolarHBondContact O-N 3.21Å; V161-M163 VanDerWaalsContact C-N 3.32Å; V161-L164 WeakPolarHBondContact O-CB 3.5Å; V161-L164 PolarHBondContact O-N 3.47Å; V161-L179 HydrophobicContact CG2-CD1 4.46Å; V161-L179 HydrophobicContact CG2-CD2 4.47Å; V161-F194 HydrophobicContact CG2-CD2 3.55Å; V161-F194 HydrophobicContact CG2-CE2 3.55Å; V161-C197 HydrophobicContact CB-CB 4.33Å; V161-C197 HydrophobicContact CG1-CB 4.28Å; V161-C197 HydrophobicContact CG2-CB 4.15Å; V161-N202 VanDerWaalsContact CG1-ND2 3.28Å; V161-N202 WeakPolarHBondContact CG1-ND2 3.33Å
162	E	94.7	Very high	95	Very high	131 Å²	131	53.2 Å²	53.2	61%	0.612	27%	0.271	S	S	*	.	H	α-helix	trans	-62.8	-40.3	174.1	-72.2	168	-158.5	0	0	111.7	S158 Q159 L164 R165	S158-E162 PolarHBondContact O-N 3.1Å; Q159-E162 PolarHBondContact O-N 2.82Å; E162-L164 PolarHBondContact O-N 3.38Å; E162-L164 VanDerWaalsContact O-N 3.17Å; E162-R165 PolarHBondContact O-N 3.41Å
163	M	96	Very high	95.1	Very high	32 Å²	32	49.9 Å²	49.9	16%	0.158	26%	0.258	C	S	.	.	H	α-helix	trans	-64.5	-18.4	179.5	-165.8	167.6	73.4	0	0	113.5	Q159 L160 V161 R165 H166 M171 Y172 T174 A175	Q159-M163 WeakPolarHBondContact O-CB 3.47Å; Q159-M163 PolarHBondContact O-N 3.23Å; L160-M163 HydrophobicContact CD2-CE 3.92Å; L160-M163 PolarHBondContact O-N 2.7Å; V161-M163 VanDerWaalsContact C-N 3.32Å; M163-R165 PolarHBondContact O-N 2.96Å; M163-R165 VanDerWaalsContact O-N 3.15Å; M163-H166 HydrophobicContact CG-CB 4.29Å; M163-H166 WeakPolarHBondContact O-CB 3.49Å; M163-H166 PolarHBondContact O-N 2.97Å; M163-M171 HydrophobicContact CG-CB 4.21Å; M163-M171 HydrophobicContact SD-CB 4.47Å; M163-Y172 WeakPolarHBondContact O-CA 3.34Å; M163-T174 HydrophobicContact CE-CG2 4.44Å; M163-A175 HydrophobicContact CB-CB 3.78Å; M163-A175 VanDerWaalsContact CE-CA 3.46Å; M163-A175 HydrophobicContact CE-CB 3.41Å; M163-A175 VanDerWaalsContact CE-CB 3.41Å; M163-A175 HydrophobicContact CG-CB 3.91Å
164	L	95.6	Very high	95.1	Very high	1 Å²	1	44 Å²	44	1%	0.005	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-16.6	171.4	-66.6	173.2	0	0	0	113.5	L160 V161 E162 A175 L176 L179 N202 L203 L206	L160-L164 PolarHBondContact O-N 2.96Å; V161-L164 WeakPolarHBondContact O-CB 3.5Å; V161-L164 PolarHBondContact O-N 3.47Å; E162-L164 PolarHBondContact O-N 3.38Å; E162-L164 VanDerWaalsContact O-N 3.17Å; L164-A175 HydrophobicContact CD2-CB 3.88Å; L164-A175 HydrophobicContact CG-CB 4.25Å; L164-L176 HydrophobicContact CD2-CB 3.86Å; L164-L176 HydrophobicContact CD2-CD1 4.48Å; L164-L179 HydrophobicContact CD1-CD1 3.74Å; L164-L179 HydrophobicContact CD2-CD1 3.97Å; L164-L179 HydrophobicContact CG-CD1 3.88Å; L164-N202 HydrophobicContact CB-CB 3.92Å; L164-N202 HydrophobicContact CD1-CB 3.58Å; L164-N202 HydrophobicContact CG-CB 4.42Å; L164-L203 HydrophobicContact CD1-CD2 4.04Å; L164-L206 HydrophobicContact CB-CD1 4.35Å; L164-L206 HydrophobicContact CD2-CD1 3.83Å
165	R	92	Very high	95.2	Very high	81 Å²	81	40.5 Å²	40.5	31%	0.306	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.2	7.9	174.4	-65.5	-161	179.6	-79.5	-22.8	114	E162 M163 N202 Y205	E162-R165 PolarHBondContact O-N 3.41Å; M163-R165 PolarHBondContact O-N 2.96Å; M163-R165 VanDerWaalsContact O-N 3.15Å; R165-N202 PolarHBondContact NE-OD1 3.48Å; R165-N202 PolarHBondContact NH2-OD1 2.93Å; R165-Y205 VanDerWaalsContact NH1-CD1 3.34Å; R165-Y205 VanDerWaalsContact NH2-CB 3.32Å
166	H	93.4	Very high	95.3	Very high	67 Å²	67	39.7 Å²	39.7	31%	0.31	21%	0.211	S	C	.	.			trans	-62.5	142	179.6	-168.2	-87.2	0	0	0	110.7	M163 S168 M171 Y172	M163-H166 HydrophobicContact CG-CB 4.29Å; M163-H166 WeakPolarHBondContact O-CB 3.49Å; M163-H166 PolarHBondContact O-N 2.97Å; H166-S168 VanDerWaalsContact C-N 3.29Å; H166-S168 WeakPolarHBondContact ND1-CB 3.42Å; H166-S168 PolarHBondContact ND1-N 3.39Å; H166-S168 PolarHBondContact O-N 3.35Å; H166-M171 HydrophobicContact CB-CB 3.89Å; H166-M171 VanDerWaalsContact ND1-CB 3.33Å; H166-M171 WeakPolarHBondContact ND1-CB 3.42Å; H166-M171 WeakPolarHBondContact ND1-CG 3.36Å; H166-Y172 WeakPolarHBondContact O-CD1 3.3Å
167	P	91.6	Very high	95.4	Very high	123 Å²	123	39.4 Å²	39.4	80%	0.799	20%	0.203	S	C	*	.	S	Bend	trans	-68	-25.8	-178.5	24.9	-35.4	0	0	0	114
168	S	92.1	Very high	95.5	Very high	38 Å²	38	39.2 Å²	39.2	27%	0.266	20%	0.202	S	C	.	.	S	Bend	trans	-79.1	125.1	175	173.8	0	0	0	0	111.7	H166 V170 M171 Y172	H166-S168 VanDerWaalsContact C-N 3.29Å; H166-S168 WeakPolarHBondContact ND1-CB 3.42Å; H166-S168 PolarHBondContact ND1-N 3.39Å; H166-S168 PolarHBondContact O-N 3.35Å; S168-V170 VanDerWaalsContact C-N 3.31Å; S168-V170 PolarHBondContact O-N 3.19Å; S168-V170 PolarHBondContact OG-N 2.99Å; S168-M171 PolarHBondContact O-N 3.3Å; S168-M171 VanDerWaalsContact O-N 3.07Å; S168-Y172 WeakPolarHBondContact O-CD1 3.48Å; S168-Y172 PolarHBondContact O-N 3.2Å; S168-Y172 VanDerWaalsContact O-N 3.15Å
169	E	93.4	Very high	95.6	Very high	103 Å²	103	36.7 Å²	36.7	48%	0.481	19%	0.185	S	C	.	.	H	α-helix	trans	-52.9	-45.7	173.7	177.8	176.8	-176	0	0	113.3	M171 Y172 T173	E169-M171 PolarHBondContact O-N 3.25Å; E169-Y172 HydrophobicContact CB-CE1 3.91Å; E169-Y172 HydrophobicContact CG-CE1 4.35Å; E169-Y172 HydrophobicContact CG-CE2 4.13Å; E169-Y172 WeakPolarHBondContact CG-OH 3.48Å; E169-Y172 PolarHBondContact O-N 3.15Å; E169-T173 HydrophobicContact CG-CG2 4Å; E169-T173 VanDerWaalsContact O-CB 3.32Å; E169-T173 WeakPolarHBondContact O-CB 3.02Å; E169-T173 VanDerWaalsContact O-CG2 3.27Å; E169-T173 WeakPolarHBondContact O-CG2 3.49Å; E169-T173 PolarHBondContact O-N 2.88Å; E169-T173 PolarHBondContact O-OG1 3.3Å
170	V	94.7	Very high	95.7	Very high	37 Å²	37	32.3 Å²	32.3	22%	0.224	16%	0.164	C	C	.	.	H	α-helix	trans	-60.9	-36.6	-179.6	-177.3	0	0	0	0	110.5	A135 L136 S168 T173 T174	A135-V170 HydrophobicContact CB-CG1 3.88Å; L136-V170 HydrophobicContact CD2-CG1 4.31Å; L136-V170 HydrophobicContact CG-CG1 4.22Å; S168-V170 VanDerWaalsContact C-N 3.31Å; S168-V170 PolarHBondContact O-N 3.19Å; S168-V170 PolarHBondContact OG-N 2.99Å; V170-T173 WeakPolarHBondContact CA-OG1 3.37Å; V170-T173 PolarHBondContact O-OG1 3.39Å; V170-T174 WeakPolarHBondContact O-CB 3.39Å; V170-T174 PolarHBondContact O-N 3.47Å; V170-T174 PolarHBondContact O-OG1 3.43Å
171	M	95.5	Very high	95.6	Very high	2 Å²	2	32.9 Å²	32.9	1%	0.01	17%	0.167	C	C	.	.	H	α-helix	trans	-72.9	-49.4	180	-61.9	-57	124.5	0	0	112.8	L122 Q131 A135 M163 H166 S168 E169 T173 T174 A175	L122-M171 HydrophobicContact CD1-CE 4.43Å; L122-M171 HydrophobicContact CD1-SD 3.99Å; Q131-M171 HydrophobicContact CB-CE 4.18Å; Q131-M171 HydrophobicContact CG-CE 3.68Å; Q131-M171 HydrophobicContact CG-SD 4.04Å; A135-M171 HydrophobicContact CB-CE 3.6Å; A135-M171 HydrophobicContact CB-SD 4.17Å; M163-M171 HydrophobicContact CG-CB 4.21Å; M163-M171 HydrophobicContact SD-CB 4.47Å; H166-M171 HydrophobicContact CB-CB 3.89Å; H166-M171 VanDerWaalsContact ND1-CB 3.33Å; H166-M171 WeakPolarHBondContact ND1-CB 3.42Å; H166-M171 WeakPolarHBondContact ND1-CG 3.36Å; S168-M171 PolarHBondContact O-N 3.3Å; S168-M171 VanDerWaalsContact O-N 3.07Å; E169-M171 PolarHBondContact O-N 3.25Å; M171-T173 VanDerWaalsContact C-N 3.33Å; M171-T173 PolarHBondContact O-N 3.25Å; M171-T174 PolarHBondContact O-N 3.4Å; M171-A175 WeakPolarHBondContact O-CB 3.34Å; M171-A175 PolarHBondContact O-N 2.91Å
172	Y	95.8	Very high	95.7	Very high	36 Å²	36	32.6 Å²	32.6	14%	0.141	17%	0.165	C	C	.	.	H	α-helix	trans	-69.2	-32.6	-179.4	69.1	-115.2	0	0	0	112.2	M163 H166 S168 E169 A175 L176 L206 R211 L212	M163-Y172 WeakPolarHBondContact O-CA 3.34Å; H166-Y172 WeakPolarHBondContact O-CD1 3.3Å; S168-Y172 WeakPolarHBondContact O-CD1 3.48Å; S168-Y172 PolarHBondContact O-N 3.2Å; S168-Y172 VanDerWaalsContact O-N 3.15Å; E169-Y172 HydrophobicContact CB-CE1 3.91Å; E169-Y172 HydrophobicContact CG-CE1 4.35Å; E169-Y172 HydrophobicContact CG-CE2 4.13Å; E169-Y172 WeakPolarHBondContact CG-OH 3.48Å; E169-Y172 PolarHBondContact O-N 3.15Å; Y172-A175 WeakPolarHBondContact O-CB 3.49Å; Y172-A175 PolarHBondContact O-N 3.13Å; Y172-L176 VanDerWaalsContact O-CB 3.28Å; Y172-L176 WeakPolarHBondContact O-CB 3.48Å; Y172-L176 PolarHBondContact O-N 2.86Å; Y172-L206 HydrophobicContact CD2-CD2 4.09Å; Y172-L206 HydrophobicContact CE2-CD2 4.44Å; Y172-L206 HydrophobicContact CG-CD2 4.44Å; Y172-R211 PolarHBondContact OH-O 2.95Å; Y172-L212 HydrophobicContact CD2-CD2 4.42Å; Y172-L212 HydrophobicContact CE2-CD2 3.73Å
173	T	96.8	Very high	95.7	Very high	5 Å²	5	26.4 Å²	26.4	3%	0.031	14%	0.136	C	C	.	.	H	α-helix	trans	-70.9	-34.7	174.5	55.7	0	0	0	0	111.8	E169 V170 M171 L176 Y177 W217	E169-T173 HydrophobicContact CG-CG2 4Å; E169-T173 VanDerWaalsContact O-CB 3.32Å; E169-T173 WeakPolarHBondContact O-CB 3.02Å; E169-T173 VanDerWaalsContact O-CG2 3.27Å; E169-T173 WeakPolarHBondContact O-CG2 3.49Å; E169-T173 PolarHBondContact O-N 2.88Å; E169-T173 PolarHBondContact O-OG1 3.3Å; V170-T173 WeakPolarHBondContact CA-OG1 3.37Å; V170-T173 PolarHBondContact O-OG1 3.39Å; M171-T173 VanDerWaalsContact C-N 3.33Å; M171-T173 PolarHBondContact O-N 3.25Å; T173-L176 PolarHBondContact O-N 3.26Å; T173-Y177 WeakPolarHBondContact O-CB 3.45Å; T173-Y177 PolarHBondContact O-N 3.34Å; T173-W217 HydrophobicContact CG2-CD2 3.64Å; T173-W217 HydrophobicContact CG2-CE3 4.13Å; T173-W217 HydrophobicContact CG2-CG 3.9Å; T173-W217 HydrophobicContact CG2-CH2 4.5Å; T173-W217 HydrophobicContact CG2-CZ2 4.03Å; T173-W217 VanDerWaalsContact O-CZ3 3.32Å; T173-W217 WeakPolarHBondContact O-CZ3 3.46Å
174	T	97.1	Very high	95.5	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-64.6	-46.7	171	-60.8	0	0	0	0	111.1	A135 L138 Q139 M163 V170 M171 L176 Y177 V178	A135-T174 HydrophobicContact CB-CG2 4.03Å; A135-T174 WeakPolarHBondContact CB-OG1 3.37Å; A135-T174 WeakPolarHBondContact O-CG2 3.29Å; L138-T174 HydrophobicContact CD2-CG2 4.45Å; Q139-T174 HydrophobicContact CG-CG2 3.89Å; Q139-T174 VanDerWaalsContact NE2-CA 3.33Å; Q139-T174 PolarHBondContact NE2-OG1 2.86Å; M163-T174 HydrophobicContact CE-CG2 4.44Å; V170-T174 WeakPolarHBondContact O-CB 3.39Å; V170-T174 PolarHBondContact O-N 3.47Å; V170-T174 PolarHBondContact O-OG1 3.43Å; M171-T174 PolarHBondContact O-N 3.4Å; T174-L176 VanDerWaalsContact C-N 3.29Å; T174-L176 PolarHBondContact O-N 3.47Å; T174-Y177 PolarHBondContact O-N 2.86Å; T174-V178 HydrophobicContact CG2-CG2 4.21Å; T174-V178 WeakPolarHBondContact O-CB 3.5Å; T174-V178 VanDerWaalsContact O-CG2 3.25Å; T174-V178 WeakPolarHBondContact O-CG2 3.38Å; T174-V178 PolarHBondContact O-N 3Å
175	A	97.9	Very high	95.3	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-55.1	-49.4	174.8	0	0	0	0	0	110.6	M163 L164 M171 Y172 Y177 V178 L179	M163-A175 HydrophobicContact CB-CB 3.78Å; M163-A175 VanDerWaalsContact CE-CA 3.46Å; M163-A175 HydrophobicContact CE-CB 3.41Å; M163-A175 VanDerWaalsContact CE-CB 3.41Å; M163-A175 HydrophobicContact CG-CB 3.91Å; L164-A175 HydrophobicContact CD2-CB 3.88Å; L164-A175 HydrophobicContact CG-CB 4.25Å; M171-A175 WeakPolarHBondContact O-CB 3.34Å; M171-A175 PolarHBondContact O-N 2.91Å; Y172-A175 WeakPolarHBondContact O-CB 3.49Å; Y172-A175 PolarHBondContact O-N 3.13Å; A175-Y177 PolarHBondContact O-N 2.7Å; A175-V178 PolarHBondContact O-N 3.34Å; A175-L179 VanDerWaalsContact O-CB 3.25Å; A175-L179 WeakPolarHBondContact O-CB 3.42Å; A175-L179 WeakPolarHBondContact O-CD1 3.49Å; A175-L179 WeakPolarHBondContact O-CG 3.46Å; A175-L179 PolarHBondContact O-N 3.49Å
176	L	98.1	Very high	95.4	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-59.6	-47.1	179.1	176.8	59.1	0	0	0	112	L164 Y172 T173 T174 L179 N180 L203 L212 W217 I220 C221 T224	L164-L176 HydrophobicContact CD2-CB 3.86Å; L164-L176 HydrophobicContact CD2-CD1 4.48Å; Y172-L176 VanDerWaalsContact O-CB 3.28Å; Y172-L176 WeakPolarHBondContact O-CB 3.48Å; Y172-L176 PolarHBondContact O-N 2.86Å; T173-L176 PolarHBondContact O-N 3.26Å; T174-L176 VanDerWaalsContact C-N 3.29Å; T174-L176 PolarHBondContact O-N 3.47Å; L176-L179 PolarHBondContact O-N 3.03Å; L176-N180 WeakPolarHBondContact O-CB 3.47Å; L176-N180 PolarHBondContact O-N 2.81Å; L176-L203 HydrophobicContact CD1-CD2 3.51Å; L176-L212 HydrophobicContact CD2-CD1 4.42Å; L176-W217 HydrophobicContact CD2-CE3 4.2Å; L176-I220 HydrophobicContact CD1-CG2 4.34Å; L176-I220 HydrophobicContact CD2-CG2 4.29Å; L176-I220 HydrophobicContact CG-CG2 3.88Å; L176-C221 HydrophobicContact CD1-CB 4.32Å; L176-C221 HydrophobicContact CD2-CB 3.88Å; L176-T224 HydrophobicContact CD1-CG2 4.39Å
177	Y	97.9	Very high	95.2	Very high	14 Å²	14	28.9 Å²	28.9	6%	0.055	15%	0.15	C	C	.	.	H	α-helix	trans	-62.9	-49.7	178.9	-169.7	-88.4	0	0	0	111.6	V7 Q139 T173 T174 A175 L179 N180 Q181 W217 I220	V7-Y177 HydrophobicContact CG1-CD2 3.5Å; V7-Y177 HydrophobicContact CG1-CE2 3.43Å; V7-Y177 VanDerWaalsContact CG1-CE2 3.43Å; V7-Y177 HydrophobicContact CG1-CG 4.29Å; Q139-Y177 HydrophobicContact CB-CD1 3.91Å; Q139-Y177 HydrophobicContact CB-CE1 4.34Å; Q139-Y177 HydrophobicContact CB-CG 4.29Å; Q139-Y177 HydrophobicContact CG-CD1 4.27Å; Q139-Y177 HydrophobicContact CG-CG 4.3Å; Q139-Y177 WeakPolarHBondContact O-CE1 3.28Å; T173-Y177 WeakPolarHBondContact O-CB 3.45Å; T173-Y177 PolarHBondContact O-N 3.34Å; T174-Y177 PolarHBondContact O-N 2.86Å; A175-Y177 PolarHBondContact O-N 2.7Å; Y177-L179 VanDerWaalsContact C-N 3.32Å; Y177-L179 PolarHBondContact O-N 3.2Å; Y177-N180 WeakPolarHBondContact O-CB 3.46Å; Y177-N180 PolarHBondContact O-N 3.19Å; Y177-N180 VanDerWaalsContact O-N 3.13Å; Y177-Q181 HydrophobicContact CD1-CG 3.86Å; Y177-Q181 HydrophobicContact CE1-CG 3.49Å; Y177-Q181 VanDerWaalsContact CE1-CG 3.49Å; Y177-Q181 WeakPolarHBondContact O-CG 3.42Å; Y177-Q181 PolarHBondContact O-N 2.89Å; Y177-Q181 PolarHBondContact OH-NE2 3.45Å; Y177-W217 HydrophobicContact CD2-CH2 4.44Å; Y177-W217 HydrophobicContact CD2-CZ3 4.27Å; Y177-I220 HydrophobicContact CD2-CD1 4.03Å; Y177-I220 HydrophobicContact CE2-CD1 4.49Å
178	V	97.9	Very high	95	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-61.1	-44.5	-179.9	174.9	0	0	0	0	110.1	L138 T142 A151 L160 T174 A175 N180 Q181 L182	L138-V178 HydrophobicContact CD2-CG2 4.29Å; L138-V178 HydrophobicContact CG-CG2 4.22Å; T142-V178 HydrophobicContact CG2-CG1 4.17Å; T142-V178 HydrophobicContact CG2-CG2 4.02Å; A151-V178 HydrophobicContact CB-CG1 4.13Å; L160-V178 HydrophobicContact CD1-CG1 3.71Å; L160-V178 HydrophobicContact CD2-CB 4.19Å; L160-V178 HydrophobicContact CD2-CG1 3.98Å; T174-V178 HydrophobicContact CG2-CG2 4.21Å; T174-V178 WeakPolarHBondContact O-CB 3.5Å; T174-V178 VanDerWaalsContact O-CG2 3.25Å; T174-V178 WeakPolarHBondContact O-CG2 3.38Å; T174-V178 PolarHBondContact O-N 3Å; A175-V178 PolarHBondContact O-N 3.34Å; V178-N180 VanDerWaalsContact C-N 3.35Å; V178-N180 PolarHBondContact O-N 3.08Å; V178-Q181 PolarHBondContact O-N 2.89Å; V178-L182 HydrophobicContact CG1-CD1 3.97Å; V178-L182 HydrophobicContact CG1-CG 4.32Å; V178-L182 WeakPolarHBondContact O-CB 3.44Å; V178-L182 VanDerWaalsContact O-CG 3.23Å; V178-L182 WeakPolarHBondContact O-CG 3.09Å; V178-L182 PolarHBondContact O-N 3.39Å
179	L	98.1	Very high	94.9	Very high	0 Å²	0	35 Å²	35	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-60	-43	174.3	-74.9	165.7	0	0	0	112	I157 L160 V161 L164 A175 L176 Y177 Q181 L182 L183 F194	I157-L179 HydrophobicContact CD1-CD2 3.89Å; I157-L179 HydrophobicContact CG2-CD2 4.4Å; L160-L179 HydrophobicContact CB-CD1 4.07Å; L160-L179 HydrophobicContact CB-CD2 3.74Å; L160-L179 HydrophobicContact CB-CG 3.81Å; L160-L179 HydrophobicContact CD1-CD2 4.08Å; L160-L179 HydrophobicContact CD1-CG 4.34Å; V161-L179 HydrophobicContact CG2-CD1 4.46Å; V161-L179 HydrophobicContact CG2-CD2 4.47Å; L164-L179 HydrophobicContact CD1-CD1 3.74Å; L164-L179 HydrophobicContact CD2-CD1 3.97Å; L164-L179 HydrophobicContact CG-CD1 3.88Å; A175-L179 VanDerWaalsContact O-CB 3.25Å; A175-L179 WeakPolarHBondContact O-CB 3.42Å; A175-L179 WeakPolarHBondContact O-CD1 3.49Å; A175-L179 WeakPolarHBondContact O-CG 3.46Å; A175-L179 PolarHBondContact O-N 3.49Å; L176-L179 PolarHBondContact O-N 3.03Å; Y177-L179 VanDerWaalsContact C-N 3.32Å; Y177-L179 PolarHBondContact O-N 3.2Å; L179-Q181 PolarHBondContact O-N 3.41Å; L179-L182 PolarHBondContact O-N 3.16Å; L179-L183 WeakPolarHBondContact O-CB 3.49Å; L179-L183 WeakPolarHBondContact O-CD1 3.48Å; L179-L183 PolarHBondContact O-N 3.2Å; L179-F194 HydrophobicContact CD1-CE2 3.85Å; L179-F194 HydrophobicContact CD2-CD2 3.74Å; L179-F194 HydrophobicContact CD2-CE2 3.88Å; L179-F194 HydrophobicContact CG-CE2 4.32Å
180	N	97.6	Very high	94.9	Very high	4 Å²	4	30 Å²	30	2%	0.021	14%	0.139	C	C	.	.	H	α-helix	trans	-57	-49.1	175.2	-176.1	-102.5	0	0	0	111.4	L176 Y177 V178 L182 L183 W184 I220 T224 M227	L176-N180 WeakPolarHBondContact O-CB 3.47Å; L176-N180 PolarHBondContact O-N 2.81Å; Y177-N180 WeakPolarHBondContact O-CB 3.46Å; Y177-N180 PolarHBondContact O-N 3.19Å; Y177-N180 VanDerWaalsContact O-N 3.13Å; V178-N180 VanDerWaalsContact C-N 3.35Å; V178-N180 PolarHBondContact O-N 3.08Å; N180-L182 PolarHBondContact O-N 3.02Å; N180-L183 PolarHBondContact O-N 2.91Å; N180-W184 WeakPolarHBondContact O-CB 3.35Å; N180-W184 PolarHBondContact O-N 3.49Å; N180-I220 HydrophobicContact CB-CG2 3.74Å; N180-T224 VanDerWaalsContact CB-OG1 3.3Å; N180-T224 WeakPolarHBondContact CB-OG1 3.46Å; N180-T224 PolarHBondContact ND2-OG1 3.23Å; N180-M227 WeakPolarHBondContact ND2-CE 3.23Å
181	Q	96.7	Very high	94.6	Very high	11 Å²	11	29.9 Å²	29.9	5%	0.051	13%	0.134	C	C	.	.	H	α-helix	trans	-59.9	-45.4	176.7	-63.8	-54.6	-46.8	0	0	111.3	T142 Y177 V178 L179 L183 W184 H185	T142-Q181 WeakPolarHBondContact O-CG 3.17Å; Y177-Q181 HydrophobicContact CD1-CG 3.86Å; Y177-Q181 HydrophobicContact CE1-CG 3.49Å; Y177-Q181 VanDerWaalsContact CE1-CG 3.49Å; Y177-Q181 WeakPolarHBondContact O-CG 3.42Å; Y177-Q181 PolarHBondContact O-N 2.89Å; Y177-Q181 PolarHBondContact OH-NE2 3.45Å; V178-Q181 PolarHBondContact O-N 2.89Å; L179-Q181 PolarHBondContact O-N 3.41Å; Q181-L183 PolarHBondContact O-N 3.24Å; Q181-W184 PolarHBondContact O-N 3.07Å; Q181-H185 VanDerWaalsContact O-CB 3.31Å; Q181-H185 WeakPolarHBondContact O-CB 3.41Å; Q181-H185 PolarHBondContact O-CD2 3.26Å; Q181-H185 PolarHBondContact O-N 3.28Å; Q181-H185 PolarHBondContact OE1-NE2 2.89Å
182	L	96.7	Very high	94.3	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-62.8	-41.8	178.7	-69.9	176.1	0	0	0	112.8	A148 I157 L160 V178 L179 N180 W184 L186 S190	A148-L182 HydrophobicContact CB-CD2 4.13Å; A148-L182 WeakPolarHBondContact O-CD2 3.24Å; I157-L182 HydrophobicContact CD1-CB 4.3Å; I157-L182 HydrophobicContact CD1-CD1 3.66Å; L160-L182 HydrophobicContact CD1-CD1 3.52Å; V178-L182 HydrophobicContact CG1-CD1 3.97Å; V178-L182 HydrophobicContact CG1-CG 4.32Å; V178-L182 WeakPolarHBondContact O-CB 3.44Å; V178-L182 VanDerWaalsContact O-CG 3.23Å; V178-L182 WeakPolarHBondContact O-CG 3.09Å; V178-L182 PolarHBondContact O-N 3.39Å; L179-L182 PolarHBondContact O-N 3.16Å; N180-L182 PolarHBondContact O-N 3.02Å; L182-W184 PolarHBondContact O-N 3.41Å; L182-L186 HydrophobicContact CD2-CD1 4.06Å; L182-L186 CarbonylContact O-C 3.45Å; L182-L186 WeakPolarHBondContact O-CA 3.13Å; L182-L186 PolarHBondContact O-N 3.45Å; L182-S190 VanDerWaalsContact C-OG 3.26Å; L182-S190 WeakPolarHBondContact O-CB 3.28Å; L182-S190 PolarHBondContact O-OG 3.03Å
183	L	94.3	Very high	94.1	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-70.8	-23	179.5	-89.8	66.3	0	0	0	112.7	L179 N180 Q181 S190 R191 F194 T224 M227 A228	L179-L183 WeakPolarHBondContact O-CB 3.49Å; L179-L183 WeakPolarHBondContact O-CD1 3.48Å; L179-L183 PolarHBondContact O-N 3.2Å; N180-L183 PolarHBondContact O-N 2.91Å; Q181-L183 PolarHBondContact O-N 3.24Å; L183-S190 WeakPolarHBondContact CA-OG 3.23Å; L183-R191 HydrophobicContact CB-CG 4.39Å; L183-R191 HydrophobicContact CG-CG 3.96Å; L183-R191 PolarHBondContact O-NE 2.93Å; L183-R191 PolarHBondContact O-NH2 3.4Å; L183-R191 VanDerWaalsContact O-NH2 3.14Å; L183-F194 HydrophobicContact CD1-CB 4.18Å; L183-F194 HydrophobicContact CD1-CD2 4.21Å; L183-F194 HydrophobicContact CD1-CG 4.15Å; L183-F194 HydrophobicContact CD2-CD1 4.11Å; L183-F194 HydrophobicContact CD2-CE1 4.38Å; L183-F194 HydrophobicContact CD2-CG 4.27Å; L183-T224 HydrophobicContact CD2-CG2 3.92Å; L183-M227 HydrophobicContact CB-CB 4.25Å; L183-M227 HydrophobicContact CB-CE 4.05Å; L183-M227 HydrophobicContact CB-SD 4.3Å; L183-M227 HydrophobicContact CD2-CB 4.34Å; L183-A228 HydrophobicContact CD2-CB 4.05Å
184	W	92.7	Very high	93.8	Very high	130 Å²	130	34.3 Å²	34.3	49%	0.492	16%	0.159	S	C	.	.	H	α-helix	trans	-83.6	-55.2	173.4	-171.9	91.2	0	0	0	112.1	N180 Q181 L182 M227	N180-W184 WeakPolarHBondContact O-CB 3.35Å; N180-W184 PolarHBondContact O-N 3.49Å; Q181-W184 PolarHBondContact O-N 3.07Å; L182-W184 PolarHBondContact O-N 3.41Å; W184-M227 HydrophobicContact CB-CE 4.48Å; W184-M227 HydrophobicContact CB-SD 4.04Å
185	H	92.1	Very high	93.3	Very high	40 Å²	40	36.1 Å²	36.1	19%	0.185	17%	0.165	C	C	.	.	H	α-helix	trans	-72.4	-36.6	-174.2	-79.3	-67.1	0	0	0	113.5	K143 L145 Q181 P187	K143-H185 PolarHBondContact O-NE2 3.3Å; L145-H185 HydrophobicContact CD1-CB 3.63Å; Q181-H185 VanDerWaalsContact O-CB 3.31Å; Q181-H185 WeakPolarHBondContact O-CB 3.41Å; Q181-H185 PolarHBondContact O-CD2 3.26Å; Q181-H185 PolarHBondContact O-N 3.28Å; Q181-H185 PolarHBondContact OE1-NE2 2.89Å; H185-P187 VanDerWaalsContact C-CD 3.4Å; H185-P187 WeakPolarHBondContact O-CD 3.47Å
186	L	92.7	Very high	92.8	Very high	21 Å²	21	42.6 Å²	42.6	11%	0.11	20%	0.196	C	C	.	.			trans	-126.1	49.5	-169.5	-57.6	175.6	0	0	0	112.7	L145 K149 L182 N188 Y189 S190	L145-L186 HydrophobicContact CD1-CD2 4.06Å; K149-L186 HydrophobicContact CG-CD1 4.04Å; K149-L186 HydrophobicContact CG-CD2 4.2Å; L182-L186 HydrophobicContact CD2-CD1 4.06Å; L182-L186 CarbonylContact O-C 3.45Å; L182-L186 WeakPolarHBondContact O-CA 3.13Å; L182-L186 PolarHBondContact O-N 3.45Å; L186-N188 VanDerWaalsContact C-N 3.26Å; L186-N188 PolarHBondContact O-N 3.14Å; L186-N188 VanDerWaalsContact O-N 3.09Å; L186-Y189 PolarHBondContact O-N 3.33Å; L186-S190 PolarHBondContact O-N 3.48Å; L186-S190 PolarHBondContact O-OG 2.79Å
187	P	89	Confident	92.3	Very high	42 Å²	42	44 Å²	44	27%	0.273	21%	0.205	S	C	.	.	H	α-helix	trans	-59.1	-33.9	-164.8	25.5	-36	0	0	0	113.8	H185 Y189 R191	H185-P187 VanDerWaalsContact C-CD 3.4Å; H185-P187 WeakPolarHBondContact O-CD 3.47Å; P187-Y189 VanDerWaalsContact C-N 3.3Å; P187-Y189 PolarHBondContact O-N 3.07Å; P187-R191 HydrophobicContact CB-CG 4.49Å; P187-R191 VanDerWaalsContact O-CB 3.3Å; P187-R191 WeakPolarHBondContact O-CB 3.43Å; P187-R191 WeakPolarHBondContact O-CG 3.31Å; P187-R191 PolarHBondContact O-N 3.2Å
188	N	88.2	Confident	91.5	Very high	131 Å²	131	45.3 Å²	45.3	70%	0.701	21%	0.213	S	C	*	.	H	α-helix	trans	-71.9	-23.1	-178.4	-63.8	-22	0	0	0	113.3	L186 P192	L186-N188 VanDerWaalsContact C-N 3.26Å; L186-N188 PolarHBondContact O-N 3.14Å; L186-N188 VanDerWaalsContact O-N 3.09Å; N188-P192 WeakPolarHBondContact O-CG 3.47Å
189	Y	89.3	Confident	91.1	Very high	158 Å²	158	45.3 Å²	45.3	62%	0.62	21%	0.213	S	C	*	.	H	α-helix	trans	-106	-46.6	-177	-55.5	-76.6	0	0	0	111.5	L186 P187	L186-Y189 PolarHBondContact O-N 3.33Å; P187-Y189 VanDerWaalsContact C-N 3.3Å; P187-Y189 PolarHBondContact O-N 3.07Å
190	S	93.2	Very high	90.6	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-76.5	-43	-173.3	62.8	0	0	0	0	112.4	L182 L183 L186 K193 F194	L182-S190 VanDerWaalsContact C-OG 3.26Å; L182-S190 WeakPolarHBondContact O-CB 3.28Å; L182-S190 PolarHBondContact O-OG 3.03Å; L183-S190 WeakPolarHBondContact CA-OG 3.23Å; L186-S190 PolarHBondContact O-N 3.48Å; L186-S190 PolarHBondContact O-OG 2.79Å; S190-K193 PolarHBondContact O-N 2.97Å; S190-F194 WeakPolarHBondContact O-CB 3.37Å; S190-F194 PolarHBondContact O-N 2.69Å
191	R	90.1	Very high	89.9	Confident	33 Å²	33	46.2 Å²	46.2	13%	0.125	22%	0.218	C	C	.	.	H	α-helix	trans	-64.3	-46.7	-176.9	-61.3	173.3	-176.8	-179	2.4	112.6	L183 P187 K193 F194 R195 M227	L183-R191 HydrophobicContact CB-CG 4.39Å; L183-R191 HydrophobicContact CG-CG 3.96Å; L183-R191 PolarHBondContact O-NE 2.93Å; L183-R191 PolarHBondContact O-NH2 3.4Å; L183-R191 VanDerWaalsContact O-NH2 3.14Å; P187-R191 HydrophobicContact CB-CG 4.49Å; P187-R191 VanDerWaalsContact O-CB 3.3Å; P187-R191 WeakPolarHBondContact O-CB 3.43Å; P187-R191 WeakPolarHBondContact O-CG 3.31Å; P187-R191 PolarHBondContact O-N 3.2Å; R191-K193 PolarHBondContact O-N 3.08Å; R191-F194 PolarHBondContact O-N 3.14Å; R191-R195 VanDerWaalsContact O-CG 3.28Å; R191-R195 WeakPolarHBondContact O-CG 3.49Å; R191-R195 PolarHBondContact O-N 3.08Å; R191-R195 PolarHBondContact O-NE 3.19Å; R191-M227 WeakPolarHBondContact CD-O 3.21Å
192	P	87.8	Confident	89.5	Confident	50 Å²	50	46.5 Å²	46.5	33%	0.325	22%	0.22	S	C	.	.	H	α-helix	trans	-59.7	-45.4	175.8	-24.3	35.8	0	0	0	112.4	N188 R195 Q196	N188-P192 WeakPolarHBondContact O-CG 3.47Å; P192-R195 PolarHBondContact O-N 3.17Å; P192-Q196 WeakPolarHBondContact O-CG 3.21Å; P192-Q196 PolarHBondContact O-N 2.92Å
193	K	91.3	Very high	89.3	Confident	86 Å²	86	46.5 Å²	46.5	37%	0.374	22%	0.22	S	C	.	.	H	α-helix	trans	-66.7	-40.3	-179.9	-172.3	62.2	178.9	179.2	0	112.2	I157 S190 R191 R195 Q196 C197	I157-K193 HydrophobicContact CB-CB 4.34Å; I157-K193 HydrophobicContact CB-CG 3.81Å; I157-K193 HydrophobicContact CG1-CB 4.32Å; I157-K193 HydrophobicContact CG1-CG 4.21Å; I157-K193 HydrophobicContact CG2-CB 4.38Å; I157-K193 HydrophobicContact CG2-CG 4.09Å; S190-K193 PolarHBondContact O-N 2.97Å; R191-K193 PolarHBondContact O-N 3.08Å; K193-R195 VanDerWaalsContact C-N 3.28Å; K193-R195 PolarHBondContact O-N 2.85Å; K193-Q196 WeakPolarHBondContact O-CB 3.37Å; K193-Q196 PolarHBondContact O-N 3Å; K193-C197 PolarHBondContact O-N 3.03Å; K193-C197 PolarHBondContact O-SG 3.36Å; K193-C197 VanDerWaalsContact O-SG 3.41Å
194	F	92.1	Very high	89.1	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-58.7	-43.3	176.2	-176.3	-98.5	0	0	0	111.6	I157 V161 L179 L183 S190 R191 C197 N198 G199 L203 A228	I157-F194 VanDerWaalsContact CG2-CA 3.47Å; I157-F194 HydrophobicContact CG2-CB 3.93Å; I157-F194 HydrophobicContact CG2-CD2 4.1Å; V161-F194 HydrophobicContact CG2-CD2 3.55Å; V161-F194 HydrophobicContact CG2-CE2 3.55Å; L179-F194 HydrophobicContact CD1-CE2 3.85Å; L179-F194 HydrophobicContact CD2-CD2 3.74Å; L179-F194 HydrophobicContact CD2-CE2 3.88Å; L179-F194 HydrophobicContact CG-CE2 4.32Å; L183-F194 HydrophobicContact CD1-CB 4.18Å; L183-F194 HydrophobicContact CD1-CD2 4.21Å; L183-F194 HydrophobicContact CD1-CG 4.15Å; L183-F194 HydrophobicContact CD2-CD1 4.11Å; L183-F194 HydrophobicContact CD2-CE1 4.38Å; L183-F194 HydrophobicContact CD2-CG 4.27Å; S190-F194 WeakPolarHBondContact O-CB 3.37Å; S190-F194 PolarHBondContact O-N 2.69Å; R191-F194 PolarHBondContact O-N 3.14Å; F194-C197 PolarHBondContact O-N 2.73Å; F194-N198 PolarHBondContact O-N 2.96Å; F194-G199 WeakPolarHBondContact CZ-O 3.3Å; F194-G199 PolarHBondContact O-N 2.97Å; F194-L203 HydrophobicContact CE1-CD1 3.79Å; F194-L203 HydrophobicContact CE1-CG 4.45Å; F194-L203 HydrophobicContact CZ-CD1 3.56Å; F194-L203 HydrophobicContact CZ-CD2 4.42Å; F194-L203 HydrophobicContact CZ-CG 3.85Å; F194-A228 HydrophobicContact CD1-CB 3.71Å; F194-A228 HydrophobicContact CE1-CB 3.67Å
195	R	86	Confident	88.9	Confident	38 Å²	38	43.3 Å²	43.3	14%	0.143	21%	0.209	C	C	.	.	H	α-helix	trans	-64.9	-41.9	175.2	-71.5	-178.5	-84.2	-135.1	17.1	112.7	R191 P192 K193 C197 N198 A228 Y230 Q235	R191-R195 VanDerWaalsContact O-CG 3.28Å; R191-R195 WeakPolarHBondContact O-CG 3.49Å; R191-R195 PolarHBondContact O-N 3.08Å; R191-R195 PolarHBondContact O-NE 3.19Å; P192-R195 PolarHBondContact O-N 3.17Å; K193-R195 VanDerWaalsContact C-N 3.28Å; K193-R195 PolarHBondContact O-N 2.85Å; R195-C197 PolarHBondContact O-N 3.36Å; R195-N198 PolarHBondContact O-N 2.97Å; R195-A228 WeakPolarHBondContact CD-O 3.48Å; R195-A228 PolarHBondContact NH1-O 3.09Å; R195-Y230 PolarHBondContact NH1-O 3.36Å; R195-Y230 VanDerWaalsContact NH1-O 3.08Å; R195-Q235 HydrophobicContact CG-CG 4.5Å
196	Q	86.1	Confident	88.9	Confident	137 Å²	137	41.5 Å²	41.5	64%	0.64	20%	0.201	S	C	*	.	H	α-helix	trans	-60.2	-35	175.3	-72.9	173.2	-0.8	0	0	112.4	P192 K193 N198	P192-Q196 WeakPolarHBondContact O-CG 3.21Å; P192-Q196 PolarHBondContact O-N 2.92Å; K193-Q196 WeakPolarHBondContact O-CB 3.37Å; K193-Q196 PolarHBondContact O-N 3Å; Q196-N198 PolarHBondContact O-N 3.29Å
197	C	87.8	Confident	88.9	Confident	28 Å²	28	40.7 Å²	40.7	19%	0.189	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	7.9	176.1	-64.5	0	0	0	0	113.4	V161 K193 F194 R195 G199	V161-C197 HydrophobicContact CB-CB 4.33Å; V161-C197 HydrophobicContact CG1-CB 4.28Å; V161-C197 HydrophobicContact CG2-CB 4.15Å; K193-C197 PolarHBondContact O-N 3.03Å; K193-C197 PolarHBondContact O-SG 3.36Å; K193-C197 VanDerWaalsContact O-SG 3.41Å; F194-C197 PolarHBondContact O-N 2.73Å; R195-C197 PolarHBondContact O-N 3.36Å; C197-G199 PolarHBondContact O-N 3.08Å
198	N	82.7	Confident	88.8	Confident	42 Å²	42	40.3 Å²	40.3	23%	0.225	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	54	32.5	-173.8	-60.5	-49.1	0	0	0	113.8	F194 R195 Q196 Q200 L201	F194-N198 PolarHBondContact O-N 2.96Å; R195-N198 PolarHBondContact O-N 2.97Å; Q196-N198 PolarHBondContact O-N 3.29Å; N198-Q200 PolarHBondContact O-N 3.37Å; N198-Q200 VanDerWaalsContact O-N 3.12Å; N198-L201 HydrophobicContact CB-CD1 3.9Å; N198-L201 HydrophobicContact CB-CG 4.28Å; N198-L201 WeakPolarHBondContact O-CB 3.5Å; N198-L201 PolarHBondContact O-N 3.15Å
199	G	89.6	Confident	88.6	Confident	0 Å²	0	40 Å²	40	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-56.5	-32.1	-176.6	0	0	0	0	0	113.5	F194 C197 L201 N202 L203	F194-G199 WeakPolarHBondContact CZ-O 3.3Å; F194-G199 PolarHBondContact O-N 2.97Å; C197-G199 PolarHBondContact O-N 3.08Å; G199-L201 PolarHBondContact O-N 3.16Å; G199-N202 PolarHBondContact O-N 2.9Å; G199-N202 VanDerWaalsContact O-N 3.09Å; G199-L203 PolarHBondContact O-N 3.44Å; G199-L203 VanDerWaalsContact O-N 3.11Å
200	Q	86.1	Confident	88.4	Confident	4 Å²	4	39.2 Å²	39.2	2%	0.019	19%	0.192	C	C	.	.	H	α-helix	trans	-55.2	-36.2	175.1	59.2	-81.4	3.5	0	0	113.5	N198 N202 L203 I204 L225 L239	N198-Q200 PolarHBondContact O-N 3.37Å; N198-Q200 VanDerWaalsContact O-N 3.12Å; Q200-N202 VanDerWaalsContact C-N 3.32Å; Q200-N202 PolarHBondContact O-N 2.86Å; Q200-L203 PolarHBondContact O-N 2.99Å; Q200-I204 VanDerWaalsContact O-CG1 3.23Å; Q200-I204 WeakPolarHBondContact O-CG1 3.17Å; Q200-I204 PolarHBondContact O-N 3.14Å; Q200-L225 HydrophobicContact CB-CD1 3.97Å; Q200-L239 HydrophobicContact CG-CD2 4.14Å
201	L	82.9	Confident	88.1	Confident	20 Å²	20	44.3 Å²	44.3	11%	0.105	21%	0.211	C	C	.	.	H	α-helix	trans	-69.4	-34.5	-179.7	-58.8	179.5	0	0	0	111.8	N198 G199 I204 Y205 Y242 L262	N198-L201 HydrophobicContact CB-CD1 3.9Å; N198-L201 HydrophobicContact CB-CG 4.28Å; N198-L201 WeakPolarHBondContact O-CB 3.5Å; N198-L201 PolarHBondContact O-N 3.15Å; G199-L201 PolarHBondContact O-N 3.16Å; L201-I204 PolarHBondContact O-N 3.48Å; L201-Y205 WeakPolarHBondContact O-CB 3.47Å; L201-Y205 PolarHBondContact O-N 3.22Å; L201-Y242 HydrophobicContact CD1-CD1 3.92Å; L201-Y242 HydrophobicContact CD1-CD2 4.42Å; L201-Y242 HydrophobicContact CD1-CE1 3.29Å; L201-Y242 HydrophobicContact CD1-CE2 3.85Å; L201-Y242 HydrophobicContact CD1-CG 4.43Å; L201-Y242 VanDerWaalsContact CD1-OH 3.28Å; L201-Y242 WeakPolarHBondContact CD1-OH 3.24Å; L201-Y242 HydrophobicContact CD2-CD1 3.77Å; L201-Y242 HydrophobicContact CD2-CE1 3.87Å; L201-Y242 HydrophobicContact CD2-CG 4.43Å; L201-Y242 HydrophobicContact CG-CE1 4.23Å; L201-L262 HydrophobicContact CD1-CD1 4.47Å
202	N	89	Confident	88.2	Confident	16 Å²	16	43.2 Å²	43.2	9%	0.086	21%	0.208	C	C	.	.	H	α-helix	trans	-70.8	-36.4	175.8	-66	-62.3	0	0	0	111.3	V161 L164 R165 G199 Q200 Y205 L206	V161-N202 VanDerWaalsContact CG1-ND2 3.28Å; V161-N202 WeakPolarHBondContact CG1-ND2 3.33Å; L164-N202 HydrophobicContact CB-CB 3.92Å; L164-N202 HydrophobicContact CD1-CB 3.58Å; L164-N202 HydrophobicContact CG-CB 4.42Å; R165-N202 PolarHBondContact NE-OD1 3.48Å; R165-N202 PolarHBondContact NH2-OD1 2.93Å; G199-N202 PolarHBondContact O-N 2.9Å; G199-N202 VanDerWaalsContact O-N 3.09Å; Q200-N202 VanDerWaalsContact C-N 3.32Å; Q200-N202 PolarHBondContact O-N 2.86Å; N202-Y205 WeakPolarHBondContact O-CB 3.35Å; N202-Y205 PolarHBondContact O-N 3.08Å; N202-L206 WeakPolarHBondContact O-CG 3.23Å; N202-L206 PolarHBondContact O-N 2.88Å; N202-L206 VanDerWaalsContact O-N 3.15Å
203	L	92.3	Very high	88.1	Confident	0 Å²	0	47 Å²	47	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-65	-44.7	171.2	-60.6	178.1	0	0	0	111.9	L164 L176 F194 G199 Q200 Y205 L206 L207 C221 T224 L225	L164-L203 HydrophobicContact CD1-CD2 4.04Å; L176-L203 HydrophobicContact CD1-CD2 3.51Å; F194-L203 HydrophobicContact CE1-CD1 3.79Å; F194-L203 HydrophobicContact CE1-CG 4.45Å; F194-L203 HydrophobicContact CZ-CD1 3.56Å; F194-L203 HydrophobicContact CZ-CD2 4.42Å; F194-L203 HydrophobicContact CZ-CG 3.85Å; G199-L203 PolarHBondContact O-N 3.44Å; G199-L203 VanDerWaalsContact O-N 3.11Å; Q200-L203 PolarHBondContact O-N 2.99Å; L203-Y205 VanDerWaalsContact C-N 3.26Å; L203-Y205 PolarHBondContact O-N 3.42Å; L203-L206 PolarHBondContact O-N 2.99Å; L203-L206 VanDerWaalsContact O-N 3.08Å; L203-L207 WeakPolarHBondContact O-CG 3.46Å; L203-L207 PolarHBondContact O-N 2.85Å; L203-L207 VanDerWaalsContact O-N 3.09Å; L203-C221 PolarHBondContact O-SG 2.95Å; L203-T224 HydrophobicContact CD1-CG2 3.73Å; L203-T224 HydrophobicContact CD2-CG2 4.15Å; L203-L225 HydrophobicContact CB-CB 4.43Å; L203-L225 HydrophobicContact CB-CD1 4.4Å; L203-L225 HydrophobicContact CD1-CB 3.99Å; L203-L225 HydrophobicContact CD1-CD1 4.3Å
204	I	89.7	Confident	88	Confident	16 Å²	16	45 Å²	45	8%	0.082	22%	0.218	C	C	.	.	H	α-helix	trans	-60.1	-39.8	177.8	-67.5	166	0	0	0	110.9	Q200 L201 L206 L207 L225 L239 I269 I272	Q200-I204 VanDerWaalsContact O-CG1 3.23Å; Q200-I204 WeakPolarHBondContact O-CG1 3.17Å; Q200-I204 PolarHBondContact O-N 3.14Å; L201-I204 PolarHBondContact O-N 3.48Å; I204-L206 VanDerWaalsContact C-N 3.35Å; I204-L206 PolarHBondContact O-N 3.34Å; I204-L207 PolarHBondContact O-N 3.32Å; I204-L207 VanDerWaalsContact O-N 3.15Å; I204-L225 HydrophobicContact CG1-CD1 4.43Å; I204-L225 HydrophobicContact CG1-CD2 4.17Å; I204-L239 HydrophobicContact CD1-CD2 3.8Å; I204-I269 HydrophobicContact CD1-CB 4.17Å; I204-I269 HydrophobicContact CD1-CG1 4.37Å; I204-I269 HydrophobicContact CG1-CB 4.38Å; I204-I269 HydrophobicContact CG1-CD1 4.02Å; I204-I269 HydrophobicContact CG1-CG1 4.26Å; I204-I269 HydrophobicContact CG2-CB 4.49Å; I204-I269 HydrophobicContact CG2-CD1 4.5Å; I204-I272 HydrophobicContact CG2-CD1 3.76Å
205	Y	87.9	Confident	88	Confident	47 Å²	47	46.9 Å²	46.9	18%	0.184	23%	0.231	C	C	.	.	H	α-helix	trans	-59.7	-42.7	173.5	167.8	-98.9	0	0	0	112.7	R165 L201 N202 L203 L207 Q208 R211	R165-Y205 VanDerWaalsContact NH1-CD1 3.34Å; R165-Y205 VanDerWaalsContact NH2-CB 3.32Å; L201-Y205 WeakPolarHBondContact O-CB 3.47Å; L201-Y205 PolarHBondContact O-N 3.22Å; N202-Y205 WeakPolarHBondContact O-CB 3.35Å; N202-Y205 PolarHBondContact O-N 3.08Å; L203-Y205 VanDerWaalsContact C-N 3.26Å; L203-Y205 PolarHBondContact O-N 3.42Å; Y205-L207 PolarHBondContact O-N 3.48Å; Y205-Q208 WeakPolarHBondContact O-CB 3.29Å; Y205-Q208 WeakPolarHBondContact O-CG 3.24Å; Y205-Q208 PolarHBondContact O-N 3.18Å; Y205-R211 PolarHBondContact OH-NH1 3.17Å; Y205-R211 VanDerWaalsContact OH-NH1 3.12Å; Y205-R211 PolarHBondContact OH-NH2 2.82Å; Y205-R211 VanDerWaalsContact OH-NH2 3.1Å
206	L	92.6	Very high	88.3	Confident	3 Å²	3	47.3 Å²	47.3	2%	0.016	24%	0.237	C	C	.	.	H	α-helix	trans	-68.1	-22	176.5	-68.3	177.8	0	0	0	113.2	L164 Y172 N202 L203 I204 Q208 R211 L212	L164-L206 HydrophobicContact CB-CD1 4.35Å; L164-L206 HydrophobicContact CD2-CD1 3.83Å; Y172-L206 HydrophobicContact CD2-CD2 4.09Å; Y172-L206 HydrophobicContact CE2-CD2 4.44Å; Y172-L206 HydrophobicContact CG-CD2 4.44Å; N202-L206 WeakPolarHBondContact O-CG 3.23Å; N202-L206 PolarHBondContact O-N 2.88Å; N202-L206 VanDerWaalsContact O-N 3.15Å; L203-L206 PolarHBondContact O-N 2.99Å; L203-L206 VanDerWaalsContact O-N 3.08Å; I204-L206 VanDerWaalsContact C-N 3.35Å; I204-L206 PolarHBondContact O-N 3.34Å; L206-Q208 VanDerWaalsContact C-N 3.29Å; L206-R211 WeakPolarHBondContact O-CB 3.4Å; L206-L212 HydrophobicContact CB-CD1 3.97Å; L206-L212 HydrophobicContact CB-CG 4.23Å; L206-L212 WeakPolarHBondContact O-CD1 3.37Å; L206-L212 WeakPolarHBondContact O-CG 3.26Å
207	L	92.2	Very high	88.8	Confident	4 Å²	4	41.9 Å²	41.9	2%	0.021	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-4.4	175.4	-64.6	175.6	0	0	0	113.7	L203 I204 Y205 L218 C221 L222 L225 I269 I272 L276	L203-L207 WeakPolarHBondContact O-CG 3.46Å; L203-L207 PolarHBondContact O-N 2.85Å; L203-L207 VanDerWaalsContact O-N 3.09Å; I204-L207 PolarHBondContact O-N 3.32Å; I204-L207 VanDerWaalsContact O-N 3.15Å; Y205-L207 PolarHBondContact O-N 3.48Å; L207-L218 HydrophobicContact CD2-CD1 3.53Å; L207-C221 HydrophobicContact CD2-CB 3.81Å; L207-L222 HydrophobicContact CD1-CD2 4.02Å; L207-L222 HydrophobicContact CD2-CD2 4Å; L207-L222 HydrophobicContact CD2-CG 4.04Å; L207-L225 HydrophobicContact CD1-CD2 3.72Å; L207-I269 HydrophobicContact CD1-CD1 4.11Å; L207-I272 HydrophobicContact CB-CG2 3.71Å; L207-I272 WeakPolarHBondContact O-CG2 3.28Å; L207-L276 HydrophobicContact CD2-CD1 4.31Å
208	Q	88.5	Confident	89.1	Confident	34 Å²	34	40.8 Å²	40.8	16%	0.159	20%	0.202	C	C	.	.	S	Bend	trans	-66.3	158.5	173.9	-67.1	173.2	-12.4	0	0	111.3	Y205 L206 N210 R211 T265 T267 I272	Y205-Q208 WeakPolarHBondContact O-CB 3.29Å; Y205-Q208 WeakPolarHBondContact O-CG 3.24Å; Y205-Q208 PolarHBondContact O-N 3.18Å; L206-Q208 VanDerWaalsContact C-N 3.29Å; Q208-N210 PolarHBondContact O-N 3.21Å; Q208-R211 HydrophobicContact CB-CG 4.1Å; Q208-R211 PolarHBondContact O-N 2.85Å; Q208-T265 PolarHBondContact NE2-O 3.23Å; Q208-T267 HydrophobicContact CG-CG2 4.42Å; Q208-T267 PolarHBondContact NE2-OG1 3.18Å; Q208-I272 HydrophobicContact CG-CD1 4.23Å
209	E	84.3	Confident	89.7	Confident	125 Å²	125	39 Å²	39	58%	0.584	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.8	138.4	177.6	-66.9	178.6	-163.4	0	0	111.9	R211 H275	E209-R211 VanDerWaalsContact C-N 3.27Å; E209-R211 PolarHBondContact O-N 3.42Å; E209-H275 IonicContact OE1-CD2 3.29Å; E209-H275 IonicContact OE1-CE1 2.81Å; E209-H275 PolarHBondContact OE1-CE1 3.16Å; E209-H275 IonicContact OE1-CG 3.67Å; E209-H275 IonicContact OE1-ND1 2.88Å; E209-H275 PolarHBondContact OE1-ND1 3.3Å; E209-H275 IonicContact OE1-NE2 2.63Å; E209-H275 PolarHBondContact OE1-NE2 2.96Å
210	N	83.5	Confident	90.1	Very high	141 Å²	141	39.4 Å²	39.4	75%	0.754	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	61	23.6	176.6	-46.9	-50.2	0	0	0	115.6	Q208	Q208-N210 PolarHBondContact O-N 3.21Å
211	R	88.1	Confident	90.6	Very high	107 Å²	107	39.2 Å²	39.2	40%	0.404	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.4	-36.8	174	-65	-63.4	-169.9	-175.3	-2	113.4	Y172 Y205 L206 Q208 E209	Y172-R211 PolarHBondContact OH-O 2.95Å; Y205-R211 PolarHBondContact OH-NH1 3.17Å; Y205-R211 VanDerWaalsContact OH-NH1 3.12Å; Y205-R211 PolarHBondContact OH-NH2 2.82Å; Y205-R211 VanDerWaalsContact OH-NH2 3.1Å; L206-R211 WeakPolarHBondContact O-CB 3.4Å; Q208-R211 HydrophobicContact CB-CG 4.1Å; Q208-R211 PolarHBondContact O-N 2.85Å; E209-R211 VanDerWaalsContact C-N 3.27Å; E209-R211 PolarHBondContact O-N 3.42Å
212	L	91.7	Very high	91.1	Very high	10 Å²	10	38.3 Å²	38.3	5%	0.052	19%	0.189	C	C	.	.			trans	-127.1	92.7	176.9	-69.1	-179.4	0	0	0	109	Y172 L176 L206 W217 C221	Y172-L212 HydrophobicContact CD2-CD2 4.42Å; Y172-L212 HydrophobicContact CE2-CD2 3.73Å; L176-L212 HydrophobicContact CD2-CD1 4.42Å; L206-L212 HydrophobicContact CB-CD1 3.97Å; L206-L212 HydrophobicContact CB-CG 4.23Å; L206-L212 WeakPolarHBondContact O-CD1 3.37Å; L206-L212 WeakPolarHBondContact O-CG 3.26Å; L212-W217 HydrophobicContact CD1-CB 4.39Å; L212-W217 HydrophobicContact CD2-CB 3.86Å; L212-W217 HydrophobicContact CG-CB 4.49Å; L212-C221 HydrophobicContact CD1-CB 3.65Å
213	D	84.9	Confident	91.4	Very high	128 Å²	128	38.1 Å²	38.1	68%	0.684	19%	0.189	S	C	*	.			trans	-77.9	-29.9	-177.6	-61	-24.2	0	0	0	112.3	S215	D213-S215 PolarHBondContact O-N 2.94Å
214	D	90.7	Very high	91.5	Very high	45 Å²	45	38.1 Å²	38.1	24%	0.241	19%	0.189	C	C	.	.	S	Bend	trans	-80	120.6	174.7	-168.9	-27.3	0	0	0	110.6	N216 W217 L218	D214-N216 PolarHBondContact O-N 3.29Å; D214-N216 VanDerWaalsContact O-N 3.09Å; D214-N216 WeakPolarHBondContact OD1-CB 3.36Å; D214-N216 PolarHBondContact OD1-N 3.21Å; D214-N216 PolarHBondContact OD1-ND2 3.45Å; D214-W217 HydrophobicContact CB-CG 4.42Å; D214-W217 PolarHBondContact O-N 2.99Å; D214-L218 PolarHBondContact O-N 3.47Å; D214-L218 VanDerWaalsContact O-N 3.13Å
215	S	91.3	Very high	91.7	Very high	39 Å²	39	37.5 Å²	37.5	27%	0.273	19%	0.185	S	C	.	.	H	α-helix	trans	-52.3	-30.9	174.5	65.4	0	0	0	0	113.9	D213 L218 L219	D213-S215 PolarHBondContact O-N 2.94Å; S215-L218 WeakPolarHBondContact O-CB 3.42Å; S215-L218 PolarHBondContact O-N 2.98Å; S215-L219 VanDerWaalsContact O-CG 3.24Å; S215-L219 WeakPolarHBondContact O-CG 3.48Å; S215-L219 PolarHBondContact O-N 3.46Å
216	N	92.8	Very high	91.8	Very high	48 Å²	48	36.7 Å²	36.7	26%	0.257	18%	0.182	S	C	.	.	H	α-helix	trans	-67.7	-40.5	177.1	-63.2	-57.2	0	0	0	111.7	D214 L218 L219 I220	D214-N216 PolarHBondContact O-N 3.29Å; D214-N216 VanDerWaalsContact O-N 3.09Å; D214-N216 WeakPolarHBondContact OD1-CB 3.36Å; D214-N216 PolarHBondContact OD1-N 3.21Å; D214-N216 PolarHBondContact OD1-ND2 3.45Å; N216-L218 VanDerWaalsContact C-N 3.34Å; N216-L219 WeakPolarHBondContact O-CB 3.42Å; N216-L219 PolarHBondContact O-N 2.99Å; N216-I220 WeakPolarHBondContact O-CG1 3.46Å; N216-I220 PolarHBondContact O-N 3.28Å
217	W	95.6	Very high	91.6	Very high	23 Å²	23	36.6 Å²	36.6	9%	0.087	18%	0.181	C	C	.	.	H	α-helix	trans	-68.3	-37.2	175.5	-70	128.3	0	0	0	111.5	V7 T173 L176 Y177 L212 D214 L219 I220 C221	V7-W217 HydrophobicContact CG1-CH2 4.04Å; T173-W217 HydrophobicContact CG2-CD2 3.64Å; T173-W217 HydrophobicContact CG2-CE3 4.13Å; T173-W217 HydrophobicContact CG2-CG 3.9Å; T173-W217 HydrophobicContact CG2-CH2 4.5Å; T173-W217 HydrophobicContact CG2-CZ2 4.03Å; T173-W217 VanDerWaalsContact O-CZ3 3.32Å; T173-W217 WeakPolarHBondContact O-CZ3 3.46Å; L176-W217 HydrophobicContact CD2-CE3 4.2Å; Y177-W217 HydrophobicContact CD2-CH2 4.44Å; Y177-W217 HydrophobicContact CD2-CZ3 4.27Å; L212-W217 HydrophobicContact CD1-CB 4.39Å; L212-W217 HydrophobicContact CD2-CB 3.86Å; L212-W217 HydrophobicContact CG-CB 4.49Å; D214-W217 HydrophobicContact CB-CG 4.42Å; D214-W217 PolarHBondContact O-N 2.99Å; W217-L219 VanDerWaalsContact C-N 3.33Å; W217-L219 PolarHBondContact O-N 3.45Å; W217-I220 HydrophobicContact CE3-CD1 3.74Å; W217-I220 HydrophobicContact CZ3-CD1 3.72Å; W217-I220 PolarHBondContact O-N 2.79Å; W217-C221 WeakPolarHBondContact O-CB 3.43Å; W217-C221 PolarHBondContact O-N 3.17Å
218	L	95.1	Very high	91.3	Very high	4 Å²	4	36.5 Å²	36.5	2%	0.021	18%	0.181	C	C	.	.	H	α-helix	trans	-59.5	-44.2	172.6	-170.8	74.3	0	0	0	111.6	L207 D214 S215 N216 I220 C221 L222 L276 Y280 I286	L207-L218 HydrophobicContact CD2-CD1 3.53Å; D214-L218 PolarHBondContact O-N 3.47Å; D214-L218 VanDerWaalsContact O-N 3.13Å; S215-L218 WeakPolarHBondContact O-CB 3.42Å; S215-L218 PolarHBondContact O-N 2.98Å; N216-L218 VanDerWaalsContact C-N 3.34Å; L218-I220 PolarHBondContact O-N 3.04Å; L218-C221 PolarHBondContact O-N 3.34Å; L218-L222 HydrophobicContact CG-CD1 4.16Å; L218-L222 WeakPolarHBondContact O-CB 3.41Å; L218-L222 VanDerWaalsContact O-CG 3.32Å; L218-L222 WeakPolarHBondContact O-CG 3.41Å; L218-L222 PolarHBondContact O-N 3.28Å; L218-L276 HydrophobicContact CD1-CD1 4.07Å; L218-L276 HydrophobicContact CD1-CD2 3.99Å; L218-L276 HydrophobicContact CD2-CD2 4.04Å; L218-Y280 HydrophobicContact CD2-CD2 4.12Å; L218-Y280 HydrophobicContact CD2-CE2 3.81Å; L218-I286 HydrophobicContact CD2-CD1 3.65Å; L218-I286 HydrophobicContact CD2-CG1 4.05Å; L218-I286 HydrophobicContact CD2-CG2 4.11Å
219	L	95.6	Very high	91.1	Very high	4 Å²	4	35 Å²	35	2%	0.021	17%	0.174	C	C	.	.	H	α-helix	trans	-60.4	-45.8	176.6	-70.4	170.2	0	0	0	112	S215 N216 W217 C221 L222 D223 K285 I286 N289	S215-L219 VanDerWaalsContact O-CG 3.24Å; S215-L219 WeakPolarHBondContact O-CG 3.48Å; S215-L219 PolarHBondContact O-N 3.46Å; N216-L219 WeakPolarHBondContact O-CB 3.42Å; N216-L219 PolarHBondContact O-N 2.99Å; W217-L219 VanDerWaalsContact C-N 3.33Å; W217-L219 PolarHBondContact O-N 3.45Å; L219-C221 VanDerWaalsContact C-N 3.33Å; L219-C221 PolarHBondContact O-N 2.87Å; L219-L222 PolarHBondContact O-N 2.79Å; L219-D223 PolarHBondContact O-N 3.26Å; L219-K285 HydrophobicContact CD1-CB 3.97Å; L219-K285 HydrophobicContact CD1-CD 4.14Å; L219-K285 VanDerWaalsContact CD2-C 3.42Å; L219-K285 HydrophobicContact CD2-CB 3.8Å; L219-K285 VanDerWaalsContact CD2-O 3.29Å; L219-K285 WeakPolarHBondContact CD2-O 3.48Å; L219-I286 HydrophobicContact CD2-CB 4.5Å; L219-I286 HydrophobicContact CD2-CG1 3.94Å; L219-I286 HydrophobicContact CG-CG1 4.36Å; L219-N289 HydrophobicContact CD2-CB 4.4Å; L219-N289 WeakPolarHBondContact CD2-ND2 3.38Å
220	I	96.3	Very high	90.7	Very high	9 Å²	9	33.2 Å²	33.2	5%	0.046	16%	0.163	C	C	.	.	H	α-helix	trans	-63.4	-42	177.2	-65.1	168.9	0	0	0	110	Y8 L176 Y177 N180 N216 W217 L218 D223 T224	Y8-I220 HydrophobicContact CD2-CD1 4.22Å; Y8-I220 HydrophobicContact CD2-CG1 4.13Å; Y8-I220 HydrophobicContact CE2-CG1 4.26Å; L176-I220 HydrophobicContact CD1-CG2 4.34Å; L176-I220 HydrophobicContact CD2-CG2 4.29Å; L176-I220 HydrophobicContact CG-CG2 3.88Å; Y177-I220 HydrophobicContact CD2-CD1 4.03Å; Y177-I220 HydrophobicContact CE2-CD1 4.49Å; N180-I220 HydrophobicContact CB-CG2 3.74Å; N216-I220 WeakPolarHBondContact O-CG1 3.46Å; N216-I220 PolarHBondContact O-N 3.28Å; W217-I220 HydrophobicContact CE3-CD1 3.74Å; W217-I220 HydrophobicContact CZ3-CD1 3.72Å; W217-I220 PolarHBondContact O-N 2.79Å; L218-I220 PolarHBondContact O-N 3.04Å; I220-D223 PolarHBondContact O-N 3.4Å; I220-T224 VanDerWaalsContact O-CB 3.28Å; I220-T224 WeakPolarHBondContact O-CB 3.42Å; I220-T224 PolarHBondContact O-N 3.17Å; I220-T224 PolarHBondContact O-OG1 3.1Å
221	C	97	Very high	89.8	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-62.2	-46.2	177.5	-163.5	0	0	0	0	112.5	L176 L203 L207 L212 W217 L218 L219 T224 L225	L176-C221 HydrophobicContact CD1-CB 4.32Å; L176-C221 HydrophobicContact CD2-CB 3.88Å; L203-C221 PolarHBondContact O-SG 2.95Å; L207-C221 HydrophobicContact CD2-CB 3.81Å; L212-C221 HydrophobicContact CD1-CB 3.65Å; W217-C221 WeakPolarHBondContact O-CB 3.43Å; W217-C221 PolarHBondContact O-N 3.17Å; L218-C221 PolarHBondContact O-N 3.34Å; L219-C221 VanDerWaalsContact C-N 3.33Å; L219-C221 PolarHBondContact O-N 2.87Å; C221-T224 PolarHBondContact O-N 3.4Å; C221-L225 WeakPolarHBondContact O-CB 3.14Å; C221-L225 PolarHBondContact O-N 2.69Å
222	L	94.8	Very high	88.3	Confident	1 Å²	1	29.3 Å²	29.3	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-62.2	-45.2	177	-72.5	168.2	0	0	0	112.3	L207 L218 L219 L225 R226 L276 I286 N289 I290 L293	L207-L222 HydrophobicContact CD1-CD2 4.02Å; L207-L222 HydrophobicContact CD2-CD2 4Å; L207-L222 HydrophobicContact CD2-CG 4.04Å; L218-L222 HydrophobicContact CG-CD1 4.16Å; L218-L222 WeakPolarHBondContact O-CB 3.41Å; L218-L222 VanDerWaalsContact O-CG 3.32Å; L218-L222 WeakPolarHBondContact O-CG 3.41Å; L218-L222 PolarHBondContact O-N 3.28Å; L219-L222 PolarHBondContact O-N 2.79Å; L222-L225 PolarHBondContact O-N 2.98Å; L222-R226 WeakPolarHBondContact O-CB 3.48Å; L222-R226 PolarHBondContact O-N 3.34Å; L222-L276 HydrophobicContact CD2-CD1 4.28Å; L222-I286 HydrophobicContact CD1-CG2 4.26Å; L222-N289 HydrophobicContact CB-CB 4.08Å; L222-N289 HydrophobicContact CD1-CB 4.25Å; L222-I290 HydrophobicContact CD1-CD1 4.38Å; L222-I290 HydrophobicContact CD1-CG1 3.77Å; L222-I290 HydrophobicContact CD2-CG1 4.03Å; L222-L293 HydrophobicContact CD2-CD2 4.13Å
223	D	94.1	Very high	86.4	Confident	13 Å²	13	37.6 Å²	37.6	7%	0.07	18%	0.177	C	C	.	.	H	α-helix	trans	-69	-37.3	179.1	-173.6	53.9	0	0	0	111.8	L219 I220 L225 R226 M227 R292	L219-D223 PolarHBondContact O-N 3.26Å; I220-D223 PolarHBondContact O-N 3.4Å; D223-L225 PolarHBondContact O-N 3.22Å; D223-R226 WeakPolarHBondContact O-CB 3.2Å; D223-R226 PolarHBondContact O-N 2.98Å; D223-R226 IonicContact OD1-CZ 3Å; D223-R226 VanDerWaalsContact OD1-CZ 3.29Å; D223-R226 IonicContact OD1-NE 2.84Å; D223-R226 PolarHBondContact OD1-NE 2.94Å; D223-R226 IonicContact OD1-NH2 2.77Å; D223-R226 PolarHBondContact OD1-NH2 3.27Å; D223-M227 WeakPolarHBondContact O-CG 3.48Å; D223-M227 PolarHBondContact O-N 3.28Å; D223-M227 WeakPolarHBondContact OD2-CE 3.33Å; D223-R292 IonicContact OD1-NH1 3.83Å; D223-R292 PolarHBondContact OD1-NH1 2.73Å
224	T	95.5	Very high	84.9	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-62.5	-44.2	174.4	-52.3	0	0	0	0	110.8	L176 N180 L183 L203 I220 C221 M227 A228	L176-T224 HydrophobicContact CD1-CG2 4.39Å; N180-T224 VanDerWaalsContact CB-OG1 3.3Å; N180-T224 WeakPolarHBondContact CB-OG1 3.46Å; N180-T224 PolarHBondContact ND2-OG1 3.23Å; L183-T224 HydrophobicContact CD2-CG2 3.92Å; L203-T224 HydrophobicContact CD1-CG2 3.73Å; L203-T224 HydrophobicContact CD2-CG2 4.15Å; I220-T224 VanDerWaalsContact O-CB 3.28Å; I220-T224 WeakPolarHBondContact O-CB 3.42Å; I220-T224 PolarHBondContact O-N 3.17Å; I220-T224 PolarHBondContact O-OG1 3.1Å; C221-T224 PolarHBondContact O-N 3.4Å; T224-M227 PolarHBondContact O-N 2.85Å; T224-A228 WeakPolarHBondContact O-CB 3.43Å; T224-A228 PolarHBondContact O-N 3.35Å
225	L	92.6	Very high	83.2	Confident	2 Å²	2	35 Å²	35	1%	0.01	17%	0.168	C	C	.	.	H	α-helix	trans	-63.3	-45.9	176.5	-178.9	59.1	0	0	0	110.9	Q200 L203 I204 L207 C221 L222 D223 M227 A228 V229 I269 L293	Q200-L225 HydrophobicContact CB-CD1 3.97Å; L203-L225 HydrophobicContact CB-CB 4.43Å; L203-L225 HydrophobicContact CB-CD1 4.4Å; L203-L225 HydrophobicContact CD1-CB 3.99Å; L203-L225 HydrophobicContact CD1-CD1 4.3Å; I204-L225 HydrophobicContact CG1-CD1 4.43Å; I204-L225 HydrophobicContact CG1-CD2 4.17Å; L207-L225 HydrophobicContact CD1-CD2 3.72Å; C221-L225 WeakPolarHBondContact O-CB 3.14Å; C221-L225 PolarHBondContact O-N 2.69Å; L222-L225 PolarHBondContact O-N 2.98Å; D223-L225 PolarHBondContact O-N 3.22Å; L225-M227 VanDerWaalsContact C-N 3.34Å; L225-M227 PolarHBondContact O-N 3.5Å; L225-A228 WeakPolarHBondContact O-CB 3.49Å; L225-A228 PolarHBondContact O-N 3.43Å; L225-A228 VanDerWaalsContact O-N 3.14Å; L225-V229 HydrophobicContact CD1-CG1 4.26Å; L225-V229 WeakPolarHBondContact O-CG2 3.27Å; L225-V229 PolarHBondContact O-N 3.24Å; L225-V229 VanDerWaalsContact O-N 3.07Å; L225-I269 HydrophobicContact CD2-CD1 3.87Å; L225-I269 HydrophobicContact CD2-CG1 4.38Å; L225-L293 HydrophobicContact CD2-CD1 4.45Å; L225-L293 HydrophobicContact CD2-CD2 3.9Å; L225-L293 HydrophobicContact CG-CD1 4.17Å; L225-L293 HydrophobicContact CG-CD2 4.43Å
226	R	89.6	Confident	81.4	Confident	31 Å²	31	33.4 Å²	33.4	12%	0.117	16%	0.157	C	C	.	.	H	α-helix	trans	-55.4	-47	175.3	-177.2	-160	64.8	79.6	-0	111.6	L222 D223 A228 V229 Y230 L293 V296	L222-R226 WeakPolarHBondContact O-CB 3.48Å; L222-R226 PolarHBondContact O-N 3.34Å; D223-R226 WeakPolarHBondContact O-CB 3.2Å; D223-R226 PolarHBondContact O-N 2.98Å; D223-R226 IonicContact OD1-CZ 3Å; D223-R226 VanDerWaalsContact OD1-CZ 3.29Å; D223-R226 IonicContact OD1-NE 2.84Å; D223-R226 PolarHBondContact OD1-NE 2.94Å; D223-R226 IonicContact OD1-NH2 2.77Å; D223-R226 PolarHBondContact OD1-NH2 3.27Å; R226-A228 VanDerWaalsContact C-N 3.33Å; R226-A228 PolarHBondContact O-N 3.44Å; R226-V229 WeakPolarHBondContact O-CG2 3.39Å; R226-V229 PolarHBondContact O-N 3.25Å; R226-Y230 WeakPolarHBondContact O-CB 3.15Å; R226-Y230 PolarHBondContact O-N 3.49Å; R226-Y230 VanDerWaalsContact O-N 3.09Å; R226-L293 HydrophobicContact CB-CD1 4.24Å; R226-V296 HydrophobicContact CG-CG2 4.13Å
227	M	89.7	Confident	79.4	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-64.1	-36.7	177.6	-72.3	-171.3	-71.6	0	0	112.6	N180 L183 W184 R191 D223 T224 L225	N180-M227 WeakPolarHBondContact ND2-CE 3.23Å; L183-M227 HydrophobicContact CB-CB 4.25Å; L183-M227 HydrophobicContact CB-CE 4.05Å; L183-M227 HydrophobicContact CB-SD 4.3Å; L183-M227 HydrophobicContact CD2-CB 4.34Å; W184-M227 HydrophobicContact CB-CE 4.48Å; W184-M227 HydrophobicContact CB-SD 4.04Å; R191-M227 WeakPolarHBondContact CD-O 3.21Å; D223-M227 WeakPolarHBondContact O-CG 3.48Å; D223-M227 PolarHBondContact O-N 3.28Å; D223-M227 WeakPolarHBondContact OD2-CE 3.33Å; T224-M227 PolarHBondContact O-N 2.85Å; L225-M227 VanDerWaalsContact C-N 3.34Å; L225-M227 PolarHBondContact O-N 3.5Å
228	A	86.6	Confident	77.6	Confident	1 Å²	1	35 Å²	35	1%	0.008	17%	0.166	C	C	.	.	H	α-helix	trans	-66.8	-38	178.6	0	0	0	0	0	112.6	L183 F194 R195 T224 L225 R226	L183-A228 HydrophobicContact CD2-CB 4.05Å; F194-A228 HydrophobicContact CD1-CB 3.71Å; F194-A228 HydrophobicContact CE1-CB 3.67Å; R195-A228 WeakPolarHBondContact CD-O 3.48Å; R195-A228 PolarHBondContact NH1-O 3.09Å; T224-A228 WeakPolarHBondContact O-CB 3.43Å; T224-A228 PolarHBondContact O-N 3.35Å; L225-A228 WeakPolarHBondContact O-CB 3.49Å; L225-A228 PolarHBondContact O-N 3.43Å; L225-A228 VanDerWaalsContact O-N 3.14Å; R226-A228 VanDerWaalsContact C-N 3.33Å; R226-A228 PolarHBondContact O-N 3.44Å
229	V	82.7	Confident	75.7	Confident	4 Å²	4	35 Å²	35	2%	0.024	17%	0.167	C	C	.	.	H	α-helix	trans	-85.9	-15.4	-179	-58.8	0	0	0	0	113.7	L225 R226 L239 L293 V296 L297	L225-V229 HydrophobicContact CD1-CG1 4.26Å; L225-V229 WeakPolarHBondContact O-CG2 3.27Å; L225-V229 PolarHBondContact O-N 3.24Å; L225-V229 VanDerWaalsContact O-N 3.07Å; R226-V229 WeakPolarHBondContact O-CG2 3.39Å; R226-V229 PolarHBondContact O-N 3.25Å; V229-L239 HydrophobicContact CG1-CD1 3.73Å; V229-L293 HydrophobicContact CG2-CD1 3.96Å; V229-V296 HydrophobicContact CG2-CB 4.35Å; V229-V296 HydrophobicContact CG2-CG1 3.75Å; V229-L297 HydrophobicContact CG1-CD2 4.49Å; V229-L297 HydrophobicContact CG2-CD2 4.3Å
230	Y	76	Confident	73.6	Confident	87 Å²	87	35.3 Å²	35.3	34%	0.341	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	141.8	179.4	-165.8	-103.9	0	0	0	112.7	R195 R226 S232 V296	R195-Y230 PolarHBondContact NH1-O 3.36Å; R195-Y230 VanDerWaalsContact NH1-O 3.08Å; R226-Y230 WeakPolarHBondContact O-CB 3.15Å; R226-Y230 PolarHBondContact O-N 3.49Å; R226-Y230 VanDerWaalsContact O-N 3.09Å; Y230-S232 PolarHBondContact O-N 3.41Å; Y230-S232 VanDerWaalsContact O-N 3.11Å; Y230-V296 HydrophobicContact CD2-CG1 4.22Å; Y230-V296 HydrophobicContact CD2-CG2 3.86Å; Y230-V296 HydrophobicContact CE2-CG2 4.47Å
231	E	64.2	Low	71.3	Confident	148 Å²	148	38.8 Å²	38.8	69%	0.692	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.3	11.1	175.4	-81	168.8	173.8	0	0	117.3
232	S	57.2	Low	69.1	Low	17 Å²	17	39.6 Å²	39.6	12%	0.119	19%	0.19	C	C	.	.			trans	-118.7	93.6	-179.6	-170.9	0	0	0	0	112.2	Y230 S234 Q235 S236	Y230-S232 PolarHBondContact O-N 3.41Å; Y230-S232 VanDerWaalsContact O-N 3.11Å; S232-S234 PolarHBondContact O-N 3.5Å; S232-S234 PolarHBondContact OG-OG 3.24Å; S232-Q235 PolarHBondContact O-N 3.25Å; S232-Q235 WeakPolarHBondContact OG-CB 3.16Å; S232-Q235 WeakPolarHBondContact OG-CG 3.39Å; S232-S236 PolarHBondContact O-N 3.05Å; S232-S236 PolarHBondContact O-OG 3.13Å
233	R	52.8	Low	67	Low	184 Å²	184	41.7 Å²	41.7	69%	0.694	20%	0.201	S	C	*	.	H	α-helix	trans	-54.6	-40.5	175.8	-144.6	178.1	-161.6	169.5	9.1	111.5	Q235 T237	R233-Q235 VanDerWaalsContact C-N 3.27Å; R233-Q235 PolarHBondContact O-N 3.11Å; R233-T237 PolarHBondContact O-N 2.87Å; R233-T237 PolarHBondContact O-OG1 2.93Å; R233-T237 VanDerWaalsContact O-OG1 3.08Å
234	S	52.6	Low	64.5	Low	81 Å²	81	43.9 Å²	43.9	57%	0.566	22%	0.217	S	C	*	.	H	α-helix	trans	-64.9	-27.5	176.5	54.3	0	0	0	0	113.5	S232 F238	S232-S234 PolarHBondContact O-N 3.5Å; S232-S234 PolarHBondContact OG-OG 3.24Å; S234-F238 WeakPolarHBondContact O-CB 3.35Å; S234-F238 PolarHBondContact O-N 3.09Å
235	Q	54.8	Low	61.9	Low	37 Å²	37	47.3 Å²	47.3	17%	0.173	24%	0.238	C	C	.	.	H	α-helix	trans	-91.2	-32.7	-175.2	-64.1	-78.2	-14.1	0	0	112.5	R195 S232 R233 T237 F238 L239	R195-Q235 HydrophobicContact CG-CG 4.5Å; S232-Q235 PolarHBondContact O-N 3.25Å; S232-Q235 WeakPolarHBondContact OG-CB 3.16Å; S232-Q235 WeakPolarHBondContact OG-CG 3.39Å; R233-Q235 VanDerWaalsContact C-N 3.27Å; R233-Q235 PolarHBondContact O-N 3.11Å; Q235-T237 PolarHBondContact O-N 3.43Å; Q235-F238 PolarHBondContact O-N 3.39Å; Q235-F238 VanDerWaalsContact O-N 3.12Å; Q235-L239 PolarHBondContact O-N 2.89Å
236	S	53	Low	59.6	Low	7 Å²	7	47.9 Å²	47.9	5%	0.049	24%	0.241	C	C	.	.	H	α-helix	trans	-54.4	-42.7	164.4	-62.3	0	0	0	0	110.4	S232 N303	S232-S236 PolarHBondContact O-N 3.05Å; S232-S236 PolarHBondContact O-OG 3.13Å; S236-N303 WeakPolarHBondContact CB-ND2 3.48Å; S236-N303 PolarHBondContact O-ND2 3.29Å; S236-N303 VanDerWaalsContact O-ND2 3.14Å; S236-N303 PolarHBondContact O-OD1 3.03Å
237	T	51.8	Low	57.3	Low	43 Å²	43	53 Å²	53	26%	0.264	27%	0.268	S	S	.	.	H	α-helix	trans	-75	-33.5	173.2	-43.2	0	0	0	0	112.8	R233 Q235 L239 V240 N241	R233-T237 PolarHBondContact O-N 2.87Å; R233-T237 PolarHBondContact O-OG1 2.93Å; R233-T237 VanDerWaalsContact O-OG1 3.08Å; Q235-T237 PolarHBondContact O-N 3.43Å; T237-L239 PolarHBondContact O-N 3.46Å; T237-V240 WeakPolarHBondContact O-CB 3.26Å; T237-V240 PolarHBondContact O-N 3.49Å; T237-V240 VanDerWaalsContact O-N 3.13Å; T237-N241 PolarHBondContact O-N 3.11Å
238	F	56.8	Low	54.9	Low	60 Å²	60	61.9 Å²	61.9	26%	0.263	30%	0.303	S	S	.	.	H	α-helix	trans	-62.8	-39.8	176.9	-178.2	-96.5	0	0	0	112.4	S234 Q235 V240 N241 Y242	S234-F238 WeakPolarHBondContact O-CB 3.35Å; S234-F238 PolarHBondContact O-N 3.09Å; Q235-F238 PolarHBondContact O-N 3.39Å; Q235-F238 VanDerWaalsContact O-N 3.12Å; F238-V240 PolarHBondContact O-N 3.28Å; F238-N241 PolarHBondContact O-N 3.09Å; F238-Y242 AromaticContact CE1-CD2 3.91Å; F238-Y242 HydrophobicContact CE1-CD2 3.91Å; F238-Y242 HydrophobicContact CE1-CG 4.14Å; F238-Y242 HydrophobicContact CE2-CD2 4.25Å; F238-Y242 AromaticContact CZ-CD2 3.5Å; F238-Y242 HydrophobicContact CZ-CD2 3.5Å; F238-Y242 VanDerWaalsContact CZ-CD2 3.5Å; F238-Y242 HydrophobicContact CZ-CE2 4.28Å; F238-Y242 HydrophobicContact CZ-CG 4.15Å; F238-Y242 VanDerWaalsContact O-CB 3.3Å; F238-Y242 WeakPolarHBondContact O-CB 3.23Å; F238-Y242 PolarHBondContact O-N 2.89Å
239	L	56.9	Low	52.7	Low	6 Å²	6	65.7 Å²	65.7	3%	0.031	32%	0.323	C	S	.	.	H	α-helix	trans	-56.7	-38.1	174.2	-77.5	171.7	0	0	0	111	Q200 I204 V229 Q235 T237 I243 L297	Q200-L239 HydrophobicContact CG-CD2 4.14Å; I204-L239 HydrophobicContact CD1-CD2 3.8Å; V229-L239 HydrophobicContact CG1-CD1 3.73Å; Q235-L239 PolarHBondContact O-N 2.89Å; T237-L239 PolarHBondContact O-N 3.46Å; L239-I243 WeakPolarHBondContact O-CD1 3.49Å; L239-I243 WeakPolarHBondContact O-CG1 3.27Å; L239-I243 PolarHBondContact O-N 3.43Å; L239-L297 HydrophobicContact CD1-CD2 3.78Å
240	V	51.4	Low	51	Low	10 Å²	10	74.6 Å²	74.6	6%	0.061	36%	0.361	C	S	.	.	H	α-helix	trans	-68.5	-50.9	173.5	-178.6	0	0	0	0	111.4	T237 F238 Y242 I243 S244 Y270 E302 N303	T237-V240 WeakPolarHBondContact O-CB 3.26Å; T237-V240 PolarHBondContact O-N 3.49Å; T237-V240 VanDerWaalsContact O-N 3.13Å; F238-V240 PolarHBondContact O-N 3.28Å; V240-Y242 PolarHBondContact O-N 3.2Å; V240-I243 PolarHBondContact O-N 3.33Å; V240-S244 PolarHBondContact O-N 2.99Å; V240-S244 PolarHBondContact O-OG 2.94Å; V240-Y270 WeakPolarHBondContact CG2-OH 3.3Å; V240-E302 HydrophobicContact CG1-CB 4.24Å; V240-E302 HydrophobicContact CG2-CB 3.9Å; V240-N303 WeakPolarHBondContact CG2-OD1 3.48Å
241	N	47.7	Very low	49.8	Very low	82 Å²	82	74.9 Å²	74.9	44%	0.439	37%	0.369	S	S	.	.	H	α-helix	trans	-67.3	-36.9	-175.2	-77	-11.4	0	0	0	112.3	T237 F238 I243 S244 T245	T237-N241 PolarHBondContact O-N 3.11Å; F238-N241 PolarHBondContact O-N 3.09Å; N241-I243 VanDerWaalsContact C-N 3.28Å; N241-I243 PolarHBondContact O-N 3.38Å; N241-S244 PolarHBondContact O-N 3.4Å; N241-T245 WeakPolarHBondContact O-CA 3.29Å; N241-T245 WeakPolarHBondContact O-CB 2.95Å; N241-T245 PolarHBondContact O-N 2.71Å; N241-T245 PolarHBondContact O-OG1 3.19Å
242	Y	50.1	Low	49.5	Very low	17 Å²	17	75.5 Å²	75.5	7%	0.067	37%	0.369	C	S	.	.	H	α-helix	trans	-66.3	-34	177	-165.9	-87.8	0	0	0	111.7	L201 F238 V240 N246 N259	L201-Y242 HydrophobicContact CD1-CD1 3.92Å; L201-Y242 HydrophobicContact CD1-CD2 4.42Å; L201-Y242 HydrophobicContact CD1-CE1 3.29Å; L201-Y242 HydrophobicContact CD1-CE2 3.85Å; L201-Y242 HydrophobicContact CD1-CG 4.43Å; L201-Y242 VanDerWaalsContact CD1-OH 3.28Å; L201-Y242 WeakPolarHBondContact CD1-OH 3.24Å; L201-Y242 HydrophobicContact CD2-CD1 3.77Å; L201-Y242 HydrophobicContact CD2-CE1 3.87Å; L201-Y242 HydrophobicContact CD2-CG 4.43Å; L201-Y242 HydrophobicContact CG-CE1 4.23Å; F238-Y242 AromaticContact CE1-CD2 3.91Å; F238-Y242 HydrophobicContact CE1-CD2 3.91Å; F238-Y242 HydrophobicContact CE1-CG 4.14Å; F238-Y242 HydrophobicContact CE2-CD2 4.25Å; F238-Y242 AromaticContact CZ-CD2 3.5Å; F238-Y242 HydrophobicContact CZ-CD2 3.5Å; F238-Y242 VanDerWaalsContact CZ-CD2 3.5Å; F238-Y242 HydrophobicContact CZ-CE2 4.28Å; F238-Y242 HydrophobicContact CZ-CG 4.15Å; F238-Y242 VanDerWaalsContact O-CB 3.3Å; F238-Y242 WeakPolarHBondContact O-CB 3.23Å; F238-Y242 PolarHBondContact O-N 2.89Å; V240-Y242 PolarHBondContact O-N 3.2Å; Y242-N246 WeakPolarHBondContact CD2-ND2 3.36Å; Y242-N246 VanDerWaalsContact CE2-ND2 3.33Å; Y242-N246 WeakPolarHBondContact CE2-ND2 3.46Å; Y242-N246 PolarHBondContact O-ND2 3.39Å; Y242-N246 VanDerWaalsContact O-ND2 3.13Å; Y242-N259 VanDerWaalsContact OH-CA 3.24Å; Y242-N259 WeakPolarHBondContact OH-CA 3.44Å; Y242-N259 WeakPolarHBondContact OH-CB 3.38Å; Y242-N259 VanDerWaalsContact OH-CG 3.27Å; Y242-N259 PolarHBondContact OH-O 2.86Å; Y242-N259 PolarHBondContact OH-OD1 2.95Å
243	I	50.1	Low	49.7	Very low	45 Å²	45	76.8 Å²	76.8	23%	0.231	38%	0.378	C	S	.	.	H	α-helix	trans	-68.8	-41.2	173.3	-66.1	167.9	0	0	0	111	L239 V240 N241 Y270	L239-I243 WeakPolarHBondContact O-CD1 3.49Å; L239-I243 WeakPolarHBondContact O-CG1 3.27Å; L239-I243 PolarHBondContact O-N 3.43Å; V240-I243 PolarHBondContact O-N 3.33Å; N241-I243 VanDerWaalsContact C-N 3.28Å; N241-I243 PolarHBondContact O-N 3.38Å; I243-Y270 HydrophobicContact CD1-CE2 4.42Å
244	S	43.1	Very low	49.6	Very low	58 Å²	58	73.3 Å²	73.3	41%	0.406	38%	0.379	S	S	.	.	H	α-helix	trans	-84.8	-32.2	-175.5	-57.3	0	0	0	0	114.4	V240 N241	V240-S244 PolarHBondContact O-N 2.99Å; V240-S244 PolarHBondContact O-OG 2.94Å; N241-S244 PolarHBondContact O-N 3.4Å
245	T	41.3	Very low	49.6	Very low	72 Å²	72	76 Å²	76	44%	0.442	38%	0.383	S	S	.	.	H	α-helix	trans	-89	-26.5	-167.2	-42	0	0	0	0	113	N241 M247 Y248	N241-T245 WeakPolarHBondContact O-CA 3.29Å; N241-T245 WeakPolarHBondContact O-CB 2.95Å; N241-T245 PolarHBondContact O-N 2.71Å; N241-T245 PolarHBondContact O-OG1 3.19Å; T245-M247 VanDerWaalsContact C-N 3.28Å; T245-M247 PolarHBondContact O-N 3.12Å; T245-Y248 PolarHBondContact O-N 3.46Å
246	N	42.4	Very low	49.4	Very low	14 Å²	14	74.9 Å²	74.9	8%	0.075	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-4.1	-178.7	-78.2	-61.2	0	0	0	114.8	Y242 Y248 S263	Y242-N246 WeakPolarHBondContact CD2-ND2 3.36Å; Y242-N246 VanDerWaalsContact CE2-ND2 3.33Å; Y242-N246 WeakPolarHBondContact CE2-ND2 3.46Å; Y242-N246 PolarHBondContact O-ND2 3.39Å; Y242-N246 VanDerWaalsContact O-ND2 3.13Å; N246-Y248 PolarHBondContact O-N 3.41Å; N246-S263 VanDerWaalsContact CB-CB 3.48Å; N246-S263 VanDerWaalsContact CB-OG 3.23Å; N246-S263 WeakPolarHBondContact CB-OG 3.28Å
247	M	42.8	Very low	49.3	Very low	139 Å²	139	78.8 Å²	78.8	69%	0.685	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-20.4	166	-109.3	-173.4	76.4	0	0	112.8	T245	T245-M247 VanDerWaalsContact C-N 3.28Å; T245-M247 PolarHBondContact O-N 3.12Å
248	Y	39.2	Very low	49.1	Very low	188 Å²	188	80.9 Å²	80.9	74%	0.737	41%	0.409	S	S	*	.	S	Bend	trans	-124.5	7	-168.5	-70.9	-79.3	0	0	0	116.3	T245 N246 K250	T245-Y248 PolarHBondContact O-N 3.46Å; N246-Y248 PolarHBondContact O-N 3.41Å; Y248-K250 PolarHBondContact O-N 3.48Å
249	L	40.6	Very low	48.6	Very low	81 Å²	81	79.7 Å²	79.7	42%	0.424	41%	0.405	S	S	.	.			trans	-79.6	120.2	174.5	-70.3	171.7	0	0	0	111.5	D251 K260	L249-D251 PolarHBondContact O-N 2.95Å; L249-K260 PolarHBondContact O-NZ 3.25Å
250	K	45.9	Very low	48	Very low	190 Å²	190	82.5 Å²	82.5	83%	0.826	42%	0.417	S	S	*	.			trans	-82.7	12.6	169.5	-72	-172.9	177.9	-179.3	0	113.1	Y248 F252	Y248-K250 PolarHBondContact O-N 3.48Å; K250-F252 VanDerWaalsContact O-CD2 3.27Å; K250-F252 WeakPolarHBondContact O-CD2 3.39Å; K250-F252 WeakPolarHBondContact O-CE2 3.43Å
251	D	50.4	Low	47.5	Very low	93 Å²	93	84.7 Å²	84.7	50%	0.497	43%	0.433	S	S	.	.			trans	-83.2	128.1	179.2	-165.5	-4	0	0	0	110.3	L249 S253 A256	L249-D251 PolarHBondContact O-N 2.95Å; D251-S253 PolarHBondContact OD1-N 3.44Å; D251-A256 HydrophobicContact CB-CB 4.07Å; D251-A256 WeakPolarHBondContact O-CB 3.49Å
252	F	59.3	Low	47.2	Very low	162 Å²	162	82 Å²	82	71%	0.711	42%	0.418	S	S	*	.			trans	-107.6	14.6	-175.1	-67.9	-82	0	0	0	112.9	K250 I257	K250-F252 VanDerWaalsContact O-CD2 3.27Å; K250-F252 WeakPolarHBondContact O-CD2 3.39Å; K250-F252 WeakPolarHBondContact O-CE2 3.43Å; F252-I257 VanDerWaalsContact O-CD1 3.32Å; F252-I257 WeakPolarHBondContact O-CD1 3.42Å
253	S	60.1	Low	46.8	Very low	44 Å²	44	82.1 Å²	82.1	31%	0.308	42%	0.422	S	S	.	.			trans	-60.2	148	172.7	67.7	0	0	0	0	111.3	D251 Q255 A256 I257	D251-S253 PolarHBondContact OD1-N 3.44Å; S253-Q255 PolarHBondContact O-N 3.15Å; S253-Q255 VanDerWaalsContact O-N 3.17Å; S253-A256 CarbonylContact O-C 3.59Å; S253-A256 WeakPolarHBondContact O-CA 3.33Å; S253-A256 WeakPolarHBondContact O-CB 3.1Å; S253-A256 PolarHBondContact O-N 3.41Å; S253-A256 WeakPolarHBondContact OG-CB 3.33Å; S253-A256 PolarHBondContact OG-N 3.37Å; S253-I257 WeakPolarHBondContact O-CG1 3.5Å; S253-I257 PolarHBondContact O-N 3.31Å
254	P	51.5	Low	46.3	Very low	110 Å²	110	86.5 Å²	86.5	71%	0.714	44%	0.444	S	S	*	.	H	α-helix	trans	-54.9	-35.6	178.6	-27.2	34.4	0	0	0	113.4	I257 L258	P254-I257 PolarHBondContact O-N 3.11Å; P254-L258 WeakPolarHBondContact O-CB 3.22Å; P254-L258 PolarHBondContact O-N 3.43Å
255	Q	52.3	Low	46.1	Very low	137 Å²	137	87.5 Å²	87.5	64%	0.64	45%	0.448	S	S	*	.	H	α-helix	trans	-66.6	-41.4	173.3	-144.9	86.3	12.6	0	0	111.6	S253 L258 N259	S253-Q255 PolarHBondContact O-N 3.15Å; S253-Q255 VanDerWaalsContact O-N 3.17Å; Q255-L258 PolarHBondContact O-N 3.22Å; Q255-N259 VanDerWaalsContact O-CB 3.25Å; Q255-N259 WeakPolarHBondContact O-CB 3.46Å; Q255-N259 PolarHBondContact O-N 3.32Å; Q255-N259 PolarHBondContact O-ND2 3.47Å; Q255-N259 VanDerWaalsContact O-ND2 3.09Å
256	A	51.2	Low	46.2	Very low	14 Å²	14	85.9 Å²	85.9	12%	0.116	44%	0.442	C	S	.	.	H	α-helix	trans	-68	-37.9	175.5	0	0	0	0	0	112	D251 S253 N259 K260	D251-A256 HydrophobicContact CB-CB 4.07Å; D251-A256 WeakPolarHBondContact O-CB 3.49Å; S253-A256 CarbonylContact O-C 3.59Å; S253-A256 WeakPolarHBondContact O-CA 3.33Å; S253-A256 WeakPolarHBondContact O-CB 3.1Å; S253-A256 PolarHBondContact O-N 3.41Å; S253-A256 WeakPolarHBondContact OG-CB 3.33Å; S253-A256 PolarHBondContact OG-N 3.37Å; A256-N259 CarbonylContact O-C 3.45Å; A256-N259 PolarHBondContact O-N 3.04Å; A256-K260 WeakPolarHBondContact O-CB 3.47Å; A256-K260 PolarHBondContact O-N 2.67Å
257	I	50.2	Low	46.8	Very low	89 Å²	89	88.1 Å²	88.1	46%	0.456	46%	0.456	S	S	.	.	H	α-helix	trans	-67.6	-41.3	174.4	-64.9	170.1	0	0	0	110.6	F252 S253 P254 K260 S261	F252-I257 VanDerWaalsContact O-CD1 3.32Å; F252-I257 WeakPolarHBondContact O-CD1 3.42Å; S253-I257 WeakPolarHBondContact O-CG1 3.5Å; S253-I257 PolarHBondContact O-N 3.31Å; P254-I257 PolarHBondContact O-N 3.11Å; I257-K260 CarbonylContact O-C 3.58Å; I257-K260 PolarHBondContact O-N 2.96Å; I257-S261 WeakPolarHBondContact O-CB 3.5Å; I257-S261 PolarHBondContact O-N 3.3Å
258	L	48.2	Very low	48.4	Very low	88 Å²	88	83.6 Å²	83.6	46%	0.461	44%	0.435	S	S	.	.	H	α-helix	trans	-61.5	-47.5	172.4	-174.6	69.3	0	0	0	110.5	P254 Q255 K260 S261 L262	P254-L258 WeakPolarHBondContact O-CB 3.22Å; P254-L258 PolarHBondContact O-N 3.43Å; Q255-L258 PolarHBondContact O-N 3.22Å; L258-K260 VanDerWaalsContact C-N 3.27Å; L258-K260 PolarHBondContact O-N 3.14Å; L258-S261 PolarHBondContact O-N 2.97Å; L258-S261 PolarHBondContact O-OG 3.09Å; L258-L262 HydrophobicContact CG-CD1 4.2Å; L258-L262 WeakPolarHBondContact O-CB 3.34Å; L258-L262 WeakPolarHBondContact O-CG 3.34Å; L258-L262 PolarHBondContact O-N 3.38Å
259	N	46.5	Very low	50.7	Low	34 Å²	34	74.8 Å²	74.8	18%	0.182	40%	0.4	C	S	.	.	H	α-helix	trans	-60.9	-33.9	174.1	-73.9	-30.3	0	0	0	112.9	Y242 Q255 A256 L262 S263	Y242-N259 VanDerWaalsContact OH-CA 3.24Å; Y242-N259 WeakPolarHBondContact OH-CA 3.44Å; Y242-N259 WeakPolarHBondContact OH-CB 3.38Å; Y242-N259 VanDerWaalsContact OH-CG 3.27Å; Y242-N259 PolarHBondContact OH-O 2.86Å; Y242-N259 PolarHBondContact OH-OD1 2.95Å; Q255-N259 VanDerWaalsContact O-CB 3.25Å; Q255-N259 WeakPolarHBondContact O-CB 3.46Å; Q255-N259 PolarHBondContact O-N 3.32Å; Q255-N259 PolarHBondContact O-ND2 3.47Å; Q255-N259 VanDerWaalsContact O-ND2 3.09Å; A256-N259 CarbonylContact O-C 3.45Å; A256-N259 PolarHBondContact O-N 3.04Å; N259-L262 WeakPolarHBondContact O-CB 3.45Å; N259-S263 VanDerWaalsContact O-CB 3.31Å; N259-S263 WeakPolarHBondContact O-CB 3.47Å; N259-S263 PolarHBondContact O-N 3.26Å
260	K	44.2	Very low	53	Low	66 Å²	66	70.9 Å²	70.9	29%	0.287	38%	0.38	S	S	.	.	H	α-helix	trans	-76.3	-35.2	176.1	-160.9	169.7	-171	166.8	0	111.6	L249 A256 I257 L258 S263 I264	L249-K260 PolarHBondContact O-NZ 3.25Å; A256-K260 WeakPolarHBondContact O-CB 3.47Å; A256-K260 PolarHBondContact O-N 2.67Å; I257-K260 CarbonylContact O-C 3.58Å; I257-K260 PolarHBondContact O-N 2.96Å; L258-K260 VanDerWaalsContact C-N 3.27Å; L258-K260 PolarHBondContact O-N 3.14Å; K260-S263 CarbonylContact O-C 3.54Å; K260-S263 WeakPolarHBondContact O-CA 3.29Å; K260-S263 VanDerWaalsContact O-CB 3.3Å; K260-S263 WeakPolarHBondContact O-CB 3.41Å; K260-S263 PolarHBondContact O-N 3.16Å; K260-S263 VanDerWaalsContact O-N 3.15Å; K260-I264 HydrophobicContact CG-CD1 4.18Å; K260-I264 WeakPolarHBondContact O-CB 3.39Å; K260-I264 WeakPolarHBondContact O-CD1 3.44Å; K260-I264 WeakPolarHBondContact O-CG1 3.27Å; K260-I264 PolarHBondContact O-N 3.26Å
261	S	40.7	Very low	55.2	Low	56 Å²	56	66 Å²	66	39%	0.392	36%	0.36	S	S	.	.	H	α-helix	trans	-67.1	-40.7	170.6	79.2	0	0	0	0	111	I257 L258 S263 I264 T265	I257-S261 WeakPolarHBondContact O-CB 3.5Å; I257-S261 PolarHBondContact O-N 3.3Å; L258-S261 PolarHBondContact O-N 2.97Å; L258-S261 PolarHBondContact O-OG 3.09Å; S261-S263 PolarHBondContact O-N 3.31Å; S261-I264 PolarHBondContact O-N 3.46Å; S261-T265 PolarHBondContact O-N 2.91Å; S261-T265 PolarHBondContact O-OG1 3.5Å
262	L	41.6	Very low	57.1	Low	24 Å²	24	61.9 Å²	61.9	13%	0.126	34%	0.338	C	S	.	.	H	α-helix	trans	-60.4	-32.3	169.6	-71.3	165.3	0	0	0	111.4	L201 L258 N259 T265 A266	L201-L262 HydrophobicContact CD1-CD1 4.47Å; L258-L262 HydrophobicContact CG-CD1 4.2Å; L258-L262 WeakPolarHBondContact O-CB 3.34Å; L258-L262 WeakPolarHBondContact O-CG 3.34Å; L258-L262 PolarHBondContact O-N 3.38Å; N259-L262 WeakPolarHBondContact O-CB 3.45Å; L262-T265 CarbonylContact O-C 3.51Å; L262-A266 VanDerWaalsContact O-CA 3.3Å; L262-A266 WeakPolarHBondContact O-CA 3.42Å; L262-A266 WeakPolarHBondContact O-CB 3.49Å; L262-A266 PolarHBondContact O-N 2.89Å
263	S	40.6	Very low	58.7	Low	20 Å²	20	54.2 Å²	54.2	14%	0.14	30%	0.304	C	S	.	.	H	α-helix	trans	-78.2	-35.5	174.2	-177.1	0	0	0	0	114.3	N246 N259 K260 S261 T265 A266	N246-S263 VanDerWaalsContact CB-CB 3.48Å; N246-S263 VanDerWaalsContact CB-OG 3.23Å; N246-S263 WeakPolarHBondContact CB-OG 3.28Å; N259-S263 VanDerWaalsContact O-CB 3.31Å; N259-S263 WeakPolarHBondContact O-CB 3.47Å; N259-S263 PolarHBondContact O-N 3.26Å; K260-S263 CarbonylContact O-C 3.54Å; K260-S263 WeakPolarHBondContact O-CA 3.29Å; K260-S263 VanDerWaalsContact O-CB 3.3Å; K260-S263 WeakPolarHBondContact O-CB 3.41Å; K260-S263 PolarHBondContact O-N 3.16Å; K260-S263 VanDerWaalsContact O-N 3.15Å; S261-S263 PolarHBondContact O-N 3.31Å; S263-T265 VanDerWaalsContact C-N 3.28Å; S263-A266 VanDerWaalsContact O-CB 3.28Å; S263-A266 WeakPolarHBondContact O-CB 3.49Å; S263-A266 PolarHBondContact O-N 2.83Å; S263-A266 VanDerWaalsContact O-N 3.07Å
264	I	39.4	Very low	60.4	Low	138 Å²	138	52.1 Å²	52.1	71%	0.708	29%	0.29	S	S	*	.	H	α-helix	trans	-73.5	-26.9	179.7	-70.2	160.4	0	0	0	110	K260 S261	K260-I264 HydrophobicContact CG-CD1 4.18Å; K260-I264 WeakPolarHBondContact O-CB 3.39Å; K260-I264 WeakPolarHBondContact O-CD1 3.44Å; K260-I264 WeakPolarHBondContact O-CG1 3.27Å; K260-I264 PolarHBondContact O-N 3.26Å; S261-I264 PolarHBondContact O-N 3.46Å
265	T	40.5	Very low	62.4	Low	79 Å²	79	49.9 Å²	49.9	49%	0.485	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.8	24.1	163.5	52.9	0	0	0	0	112.9	Q208 S261 L262 S263 T267	Q208-T265 PolarHBondContact NE2-O 3.23Å; S261-T265 PolarHBondContact O-N 2.91Å; S261-T265 PolarHBondContact O-OG1 3.5Å; L262-T265 CarbonylContact O-C 3.51Å; S263-T265 VanDerWaalsContact C-N 3.28Å; T265-T267 PolarHBondContact O-N 3.38Å; T265-T267 PolarHBondContact O-OG1 3.44Å
266	A	43.3	Very low	64.4	Low	38 Å²	38	43.8 Å²	43.8	31%	0.314	24%	0.241	S	C	.	.			trans	-71.9	74.3	173.7	0	0	0	0	0	109	L262 S263 N268	L262-A266 VanDerWaalsContact O-CA 3.3Å; L262-A266 WeakPolarHBondContact O-CA 3.42Å; L262-A266 WeakPolarHBondContact O-CB 3.49Å; L262-A266 PolarHBondContact O-N 2.89Å; S263-A266 VanDerWaalsContact O-CB 3.28Å; S263-A266 WeakPolarHBondContact O-CB 3.49Å; S263-A266 PolarHBondContact O-N 2.83Å; S263-A266 VanDerWaalsContact O-N 3.07Å; A266-N268 PolarHBondContact O-N 2.84Å; A266-N268 VanDerWaalsContact O-N 3.08Å
267	T	55.2	Low	66.5	Low	60 Å²	60	43.7 Å²	43.7	37%	0.368	24%	0.239	S	C	.	.			trans	-52.1	115.2	162.8	-44.4	0	0	0	0	106.2	Q208 T265 I269 I272	Q208-T267 HydrophobicContact CG-CG2 4.42Å; Q208-T267 PolarHBondContact NE2-OG1 3.18Å; T265-T267 PolarHBondContact O-N 3.38Å; T265-T267 PolarHBondContact O-OG1 3.44Å; T267-I269 PolarHBondContact O-N 3.06Å; T267-I269 VanDerWaalsContact O-N 3.11Å; T267-I272 HydrophobicContact CG2-CD1 3.65Å; T267-I272 HydrophobicContact CG2-CG1 3.53Å
268	N	76	Confident	68.6	Low	45 Å²	45	46.5 Å²	46.5	24%	0.241	24%	0.244	C	C	.	.			trans	-56.1	116.6	-177.2	176.8	-13.3	0	0	0	109.1	A266 Y270 Q271 I272	A266-N268 PolarHBondContact O-N 2.84Å; A266-N268 VanDerWaalsContact O-N 3.08Å; N268-Y270 PolarHBondContact O-N 3.36Å; N268-Y270 VanDerWaalsContact O-N 3.12Å; N268-Y270 WeakPolarHBondContact OD1-CB 3.45Å; N268-Y270 WeakPolarHBondContact OD1-CD2 3.43Å; N268-Y270 PolarHBondContact OD1-N 3.36Å; N268-Q271 HydrophobicContact CB-CB 4.13Å; N268-Q271 HydrophobicContact CB-CG 3.91Å; N268-Q271 WeakPolarHBondContact O-CA 3.28Å; N268-Q271 WeakPolarHBondContact O-CB 3.23Å; N268-Q271 PolarHBondContact O-N 2.87Å; N268-I272 PolarHBondContact O-N 3.13Å
269	I	86.2	Confident	70.7	Confident	2 Å²	2	45.5 Å²	45.5	1%	0.01	24%	0.241	C	C	.	.	H	α-helix	trans	-53.8	-33.7	-180	-176.6	50.3	0	0	0	112.2	I204 L207 L225 T267 Q271 I272 I273	I204-I269 HydrophobicContact CD1-CB 4.17Å; I204-I269 HydrophobicContact CD1-CG1 4.37Å; I204-I269 HydrophobicContact CG1-CB 4.38Å; I204-I269 HydrophobicContact CG1-CD1 4.02Å; I204-I269 HydrophobicContact CG1-CG1 4.26Å; I204-I269 HydrophobicContact CG2-CB 4.49Å; I204-I269 HydrophobicContact CG2-CD1 4.5Å; L207-I269 HydrophobicContact CD1-CD1 4.11Å; L225-I269 HydrophobicContact CD2-CD1 3.87Å; L225-I269 HydrophobicContact CD2-CG1 4.38Å; T267-I269 PolarHBondContact O-N 3.06Å; T267-I269 VanDerWaalsContact O-N 3.11Å; I269-Q271 VanDerWaalsContact C-N 3.33Å; I269-Q271 PolarHBondContact O-N 3.18Å; I269-I272 HydrophobicContact CD1-CB 4.38Å; I269-I272 HydrophobicContact CD1-CG2 4.47Å; I269-I272 PolarHBondContact O-N 3.48Å; I269-I273 HydrophobicContact CD1-CD1 4.3Å; I269-I273 HydrophobicContact CD1-CG1 4.19Å; I269-I273 HydrophobicContact CG1-CD1 4.05Å; I269-I273 HydrophobicContact CG1-CG1 4.45Å; I269-I273 WeakPolarHBondContact O-CB 3.44Å; I269-I273 VanDerWaalsContact O-CG1 3.26Å; I269-I273 WeakPolarHBondContact O-CG1 3.17Å; I269-I273 PolarHBondContact O-N 3.28Å
270	Y	90.3	Very high	73	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-66.7	-37	177.1	-42.7	-63.2	0	0	0	111.3	V240 I243 N268 V274 N303 K306 L307	V240-Y270 WeakPolarHBondContact CG2-OH 3.3Å; I243-Y270 HydrophobicContact CD1-CE2 4.42Å; N268-Y270 PolarHBondContact O-N 3.36Å; N268-Y270 VanDerWaalsContact O-N 3.12Å; N268-Y270 WeakPolarHBondContact OD1-CB 3.45Å; N268-Y270 WeakPolarHBondContact OD1-CD2 3.43Å; N268-Y270 PolarHBondContact OD1-N 3.36Å; Y270-V274 WeakPolarHBondContact O-CG2 3.35Å; Y270-V274 PolarHBondContact O-N 3.04Å; Y270-V274 VanDerWaalsContact O-N 3.15Å; Y270-N303 HydrophobicContact CE1-CB 4.46Å; Y270-N303 PolarHBondContact OH-OD1 3.22Å; Y270-K306 HydrophobicContact CD2-CB 3.36Å; Y270-K306 HydrophobicContact CD2-CD 4.21Å; Y270-K306 HydrophobicContact CD2-CG 4.31Å; Y270-K306 HydrophobicContact CE1-CB 4.36Å; Y270-K306 HydrophobicContact CE2-CB 3.27Å; Y270-K306 HydrophobicContact CE2-CD 3.8Å; Y270-K306 HydrophobicContact CE2-CG 3.88Å; Y270-K306 HydrophobicContact CG-CB 4.06Å; Y270-L307 HydrophobicContact CD1-CD2 3.62Å; Y270-L307 HydrophobicContact CD1-CG 3.7Å; Y270-L307 HydrophobicContact CE1-CD2 4.44Å; Y270-L307 HydrophobicContact CE1-CG 4.17Å; Y270-L307 HydrophobicContact CG-CD2 4.39Å
271	Q	90.7	Very high	75.1	Confident	87 Å²	87	48.1 Å²	48.1	41%	0.407	26%	0.259	S	S	.	.	H	α-helix	trans	-70.8	-39.8	173.9	-66.7	-66	-14.4	0	0	111.9	N268 I269 I273 V274 H275	N268-Q271 HydrophobicContact CB-CB 4.13Å; N268-Q271 HydrophobicContact CB-CG 3.91Å; N268-Q271 WeakPolarHBondContact O-CA 3.28Å; N268-Q271 WeakPolarHBondContact O-CB 3.23Å; N268-Q271 PolarHBondContact O-N 2.87Å; I269-Q271 VanDerWaalsContact C-N 3.33Å; I269-Q271 PolarHBondContact O-N 3.18Å; Q271-I273 VanDerWaalsContact C-N 3.34Å; Q271-I273 PolarHBondContact O-N 3.46Å; Q271-V274 PolarHBondContact O-N 2.81Å; Q271-H275 VanDerWaalsContact O-CB 3.28Å; Q271-H275 WeakPolarHBondContact O-CB 3.31Å; Q271-H275 PolarHBondContact O-N 3.33Å
272	I	91.4	Very high	77.6	Confident	7 Å²	7	51.7 Å²	51.7	4%	0.036	28%	0.278	C	S	.	.	H	α-helix	trans	-59.3	-46.9	173.7	-69.7	170.5	0	0	0	110.4	I204 L207 Q208 T267 N268 I269 V274 H275 L276	I204-I272 HydrophobicContact CG2-CD1 3.76Å; L207-I272 HydrophobicContact CB-CG2 3.71Å; L207-I272 WeakPolarHBondContact O-CG2 3.28Å; Q208-I272 HydrophobicContact CG-CD1 4.23Å; T267-I272 HydrophobicContact CG2-CD1 3.65Å; T267-I272 HydrophobicContact CG2-CG1 3.53Å; N268-I272 PolarHBondContact O-N 3.13Å; I269-I272 HydrophobicContact CD1-CB 4.38Å; I269-I272 HydrophobicContact CD1-CG2 4.47Å; I269-I272 PolarHBondContact O-N 3.48Å; I272-V274 VanDerWaalsContact C-N 3.33Å; I272-V274 PolarHBondContact O-N 2.86Å; I272-H275 PolarHBondContact O-N 2.84Å; I272-L276 HydrophobicContact CG2-CD1 3.79Å; I272-L276 HydrophobicContact CG2-CG 4.11Å; I272-L276 WeakPolarHBondContact O-CB 3.41Å; I272-L276 VanDerWaalsContact O-CG 3.28Å; I272-L276 WeakPolarHBondContact O-CG 3.14Å; I272-L276 PolarHBondContact O-N 3.27Å
273	I	92.7	Very high	80	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-55.1	-49.5	177.7	-80.4	169	0	0	0	110.9	I269 Q271 L276 L277 I290 L293 I294 L297	I269-I273 HydrophobicContact CD1-CD1 4.3Å; I269-I273 HydrophobicContact CD1-CG1 4.19Å; I269-I273 HydrophobicContact CG1-CD1 4.05Å; I269-I273 HydrophobicContact CG1-CG1 4.45Å; I269-I273 WeakPolarHBondContact O-CB 3.44Å; I269-I273 VanDerWaalsContact O-CG1 3.26Å; I269-I273 WeakPolarHBondContact O-CG1 3.17Å; I269-I273 PolarHBondContact O-N 3.28Å; Q271-I273 VanDerWaalsContact C-N 3.34Å; Q271-I273 PolarHBondContact O-N 3.46Å; I273-L276 PolarHBondContact O-N 2.97Å; I273-L277 WeakPolarHBondContact O-CG 3.31Å; I273-L277 PolarHBondContact O-N 3.15Å; I273-L277 VanDerWaalsContact O-N 3.13Å; I273-I290 HydrophobicContact CG2-CG2 3.68Å; I273-L293 HydrophobicContact CD1-CD2 3.85Å; I273-L293 HydrophobicContact CD1-CG 4.22Å; I273-L293 HydrophobicContact CG1-CD2 4.14Å; I273-I294 HydrophobicContact CD1-CG1 4.49Å; I273-I294 HydrophobicContact CG2-CD1 3.7Å; I273-I294 HydrophobicContact CG2-CG1 3.87Å; I273-L297 HydrophobicContact CD1-CD1 3.72Å
274	V	94.9	Very high	82.5	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.006	30%	0.297	C	S	.	.	H	α-helix	trans	-66.5	-41.2	179.6	168.7	0	0	0	0	111.3	Y270 Q271 I272 L277 R278 A310 A315	Y270-V274 WeakPolarHBondContact O-CG2 3.35Å; Y270-V274 PolarHBondContact O-N 3.04Å; Y270-V274 VanDerWaalsContact O-N 3.15Å; Q271-V274 PolarHBondContact O-N 2.81Å; I272-V274 VanDerWaalsContact C-N 3.33Å; I272-V274 PolarHBondContact O-N 2.86Å; V274-L277 PolarHBondContact O-N 2.95Å; V274-R278 VanDerWaalsContact CG1-CZ 3.43Å; V274-R278 WeakPolarHBondContact O-CG 3.49Å; V274-R278 PolarHBondContact O-N 2.82Å; V274-R278 VanDerWaalsContact O-N 3.14Å; V274-A310 HydrophobicContact CG2-CB 4.29Å; V274-A315 HydrophobicContact CG1-CB 4.14Å; V274-A315 HydrophobicContact CG2-CB 4.24Å
275	H	93.9	Very high	85.1	Confident	62 Å²	62	52.9 Å²	52.9	29%	0.287	28%	0.279	S	S	.	.	H	α-helix	trans	-59.9	-50.6	175.3	176.5	86.6	0	0	0	111.1	E209 Q271 I272 L277 R278 T279	E209-H275 IonicContact OE1-CD2 3.29Å; E209-H275 IonicContact OE1-CE1 2.81Å; E209-H275 PolarHBondContact OE1-CE1 3.16Å; E209-H275 IonicContact OE1-CG 3.67Å; E209-H275 IonicContact OE1-ND1 2.88Å; E209-H275 PolarHBondContact OE1-ND1 3.3Å; E209-H275 IonicContact OE1-NE2 2.63Å; E209-H275 PolarHBondContact OE1-NE2 2.96Å; Q271-H275 VanDerWaalsContact O-CB 3.28Å; Q271-H275 WeakPolarHBondContact O-CB 3.31Å; Q271-H275 PolarHBondContact O-N 3.33Å; I272-H275 PolarHBondContact O-N 2.84Å; H275-L277 VanDerWaalsContact C-N 3.31Å; H275-L277 PolarHBondContact O-N 3.43Å; H275-R278 CarbonylContact O-C 3.46Å; H275-R278 PolarHBondContact O-N 2.94Å; H275-T279 PolarHBondContact CD2-OG1 3.23Å; H275-T279 PolarHBondContact CE1-OG1 3.2Å; H275-T279 VanDerWaalsContact CE1-OG1 3.23Å; H275-T279 PolarHBondContact NE2-OG1 3.34Å; H275-T279 WeakPolarHBondContact O-CB 3.12Å; H275-T279 PolarHBondContact O-N 3.2Å; H275-T279 PolarHBondContact O-OG1 2.74Å
276	L	94.4	Very high	87.7	Confident	9 Å²	9	49.1 Å²	49.1	5%	0.047	26%	0.256	C	S	.	.	H	α-helix	trans	-60.5	-38.5	-179.5	-69.5	175.5	0	0	0	112.4	L207 L218 L222 I272 I273 R278 T279 Y280 I290	L207-L276 HydrophobicContact CD2-CD1 4.31Å; L218-L276 HydrophobicContact CD1-CD1 4.07Å; L218-L276 HydrophobicContact CD1-CD2 3.99Å; L218-L276 HydrophobicContact CD2-CD2 4.04Å; L222-L276 HydrophobicContact CD2-CD1 4.28Å; I272-L276 HydrophobicContact CG2-CD1 3.79Å; I272-L276 HydrophobicContact CG2-CG 4.11Å; I272-L276 WeakPolarHBondContact O-CB 3.41Å; I272-L276 VanDerWaalsContact O-CG 3.28Å; I272-L276 WeakPolarHBondContact O-CG 3.14Å; I272-L276 PolarHBondContact O-N 3.27Å; I273-L276 PolarHBondContact O-N 2.97Å; L276-R278 VanDerWaalsContact C-N 3.31Å; L276-R278 PolarHBondContact O-N 3.2Å; L276-T279 PolarHBondContact O-N 3.15Å; L276-Y280 HydrophobicContact CD2-CD2 4.33Å; L276-Y280 HydrophobicContact CD2-CE2 3.99Å; L276-Y280 WeakPolarHBondContact O-CD2 3.45Å; L276-Y280 PolarHBondContact O-N 3.44Å; L276-I290 HydrophobicContact CB-CD1 3.57Å; L276-I290 HydrophobicContact CD1-CD1 4.42Å
277	L	94.9	Very high	90.2	Very high	12 Å²	12	47.5 Å²	47.5	6%	0.063	24%	0.243	C	C	.	.	H	α-helix	trans	-62.3	-37.9	173.6	-75.7	173.2	0	0	0	112.5	I273 V274 H275 A287 I290 I294 A315 L316 L319	I273-L277 WeakPolarHBondContact O-CG 3.31Å; I273-L277 PolarHBondContact O-N 3.15Å; I273-L277 VanDerWaalsContact O-N 3.13Å; V274-L277 PolarHBondContact O-N 2.95Å; H275-L277 VanDerWaalsContact C-N 3.31Å; H275-L277 PolarHBondContact O-N 3.43Å; L277-A287 HydrophobicContact CD2-CB 4.25Å; L277-I290 HydrophobicContact CD1-CG2 3.82Å; L277-I290 HydrophobicContact CD2-CB 4.06Å; L277-I290 HydrophobicContact CD2-CD1 3.93Å; L277-I290 HydrophobicContact CD2-CG2 3.9Å; L277-I290 HydrophobicContact CG-CB 4.38Å; L277-I290 HydrophobicContact CG-CD1 3.91Å; L277-I290 HydrophobicContact CG-CG2 3.76Å; L277-I294 HydrophobicContact CD1-CD1 4.46Å; L277-A315 HydrophobicContact CB-CB 4.27Å; L277-A315 HydrophobicContact CD1-CB 3.81Å; L277-L316 HydrophobicContact CD1-CD2 3.79Å; L277-L316 HydrophobicContact CD1-CG 4.49Å; L277-L319 HydrophobicContact CD2-CD1 3.95Å
278	R	94.2	Very high	92.2	Very high	148 Å²	148	45.1 Å²	45.1	56%	0.558	23%	0.227	S	C	*	.	H	α-helix	trans	-77.9	-33	179.6	-70	174.8	-179	170.3	4.3	112.9	V274 H275 L276 P281	V274-R278 VanDerWaalsContact CG1-CZ 3.43Å; V274-R278 WeakPolarHBondContact O-CG 3.49Å; V274-R278 PolarHBondContact O-N 2.82Å; V274-R278 VanDerWaalsContact O-N 3.14Å; H275-R278 CarbonylContact O-C 3.46Å; H275-R278 PolarHBondContact O-N 2.94Å; L276-R278 VanDerWaalsContact C-N 3.31Å; L276-R278 PolarHBondContact O-N 3.2Å; R278-P281 WeakPolarHBondContact O-CD 3.35Å
279	T	93.7	Very high	93.1	Very high	67 Å²	67	43.7 Å²	43.7	41%	0.411	22%	0.22	S	C	.	.	H	α-helix	trans	-75.9	-33.2	179.1	-60.2	0	0	0	0	111.6	H275 L276 P281	H275-T279 PolarHBondContact CD2-OG1 3.23Å; H275-T279 PolarHBondContact CE1-OG1 3.2Å; H275-T279 VanDerWaalsContact CE1-OG1 3.23Å; H275-T279 PolarHBondContact NE2-OG1 3.34Å; H275-T279 WeakPolarHBondContact O-CB 3.12Å; H275-T279 PolarHBondContact O-N 3.2Å; H275-T279 PolarHBondContact O-OG1 2.74Å; L276-T279 PolarHBondContact O-N 3.15Å; T279-P281 VanDerWaalsContact O-CD 3.26Å; T279-P281 WeakPolarHBondContact O-CD 3.48Å
280	Y	93.2	Very high	93.5	Very high	67 Å²	67	43.6 Å²	43.6	26%	0.263	22%	0.219	S	C	.	.	S	Bend	trans	-118.7	55.3	-179.6	-58.3	-77.2	0	0	0	113.5	L218 L276 T282 N283 I286	L218-Y280 HydrophobicContact CD2-CD2 4.12Å; L218-Y280 HydrophobicContact CD2-CE2 3.81Å; L276-Y280 HydrophobicContact CD2-CD2 4.33Å; L276-Y280 HydrophobicContact CD2-CE2 3.99Å; L276-Y280 WeakPolarHBondContact O-CD2 3.45Å; L276-Y280 PolarHBondContact O-N 3.44Å; Y280-T282 PolarHBondContact O-N 3.21Å; Y280-N283 PolarHBondContact O-N 2.71Å; Y280-N283 VanDerWaalsContact O-N 3.11Å; Y280-I286 HydrophobicContact CD1-CD1 3.85Å; Y280-I286 HydrophobicContact CD2-CD1 3.89Å; Y280-I286 HydrophobicContact CD2-CG2 4.5Å; Y280-I286 HydrophobicContact CE1-CD1 4.38Å; Y280-I286 HydrophobicContact CE2-CD1 4.42Å; Y280-I286 HydrophobicContact CG-CD1 3.57Å
281	P	90.3	Very high	93.8	Very high	89 Å²	89	43.6 Å²	43.6	58%	0.578	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-23.4	-169.1	29	-35.5	0	0	0	113.5	R278 T279	R278-P281 WeakPolarHBondContact O-CD 3.35Å; T279-P281 VanDerWaalsContact O-CD 3.26Å; T279-P281 WeakPolarHBondContact O-CD 3.48Å
282	T	91.2	Very high	93.7	Very high	130 Å²	130	41.2 Å²	41.2	80%	0.798	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-9.7	179	58	0	0	0	0	113.1	Y280 M284	Y280-T282 PolarHBondContact O-N 3.21Å; T282-M284 PolarHBondContact O-N 3.01Å; T282-M284 VanDerWaalsContact O-N 3.16Å
283	N	93.5	Very high	93.8	Very high	42 Å²	42	40.9 Å²	40.9	23%	0.225	21%	0.205	C	C	.	.			trans	-87	91.3	-177.7	-167.2	-36.7	0	0	0	110.9	Y280 K285 I286 A287	Y280-N283 PolarHBondContact O-N 2.71Å; Y280-N283 VanDerWaalsContact O-N 3.11Å; N283-K285 PolarHBondContact O-N 2.79Å; N283-K285 PolarHBondContact OD1-N 2.96Å; N283-K285 VanDerWaalsContact OD1-N 3.14Å; N283-I286 HydrophobicContact CB-CB 4.19Å; N283-I286 HydrophobicContact CB-CD1 3.91Å; N283-I286 HydrophobicContact CB-CG1 4.21Å; N283-I286 VanDerWaalsContact ND2-CD1 3.32Å; N283-I286 WeakPolarHBondContact ND2-CD1 3.37Å; N283-I286 PolarHBondContact O-N 3Å; N283-I286 PolarHBondContact OD1-N 3.34Å; N283-I286 VanDerWaalsContact OD1-N 3.16Å; N283-A287 PolarHBondContact O-N 3.25Å
284	M	93.3	Very high	93.8	Very high	89 Å²	89	40.9 Å²	40.9	44%	0.438	21%	0.205	S	C	.	.	H	α-helix	trans	-59.1	-29.2	-179.4	-68.5	-173.6	-81.2	0	0	113.7	F16 T282 Y288 N324 L327	F16-M284 HydrophobicContact CZ-CB 4.03Å; T282-M284 PolarHBondContact O-N 3.01Å; T282-M284 VanDerWaalsContact O-N 3.16Å; M284-Y288 WeakPolarHBondContact O-CB 3.29Å; M284-Y288 PolarHBondContact O-N 2.76Å; M284-N324 HydrophobicContact SD-CB 4.31Å; M284-L327 HydrophobicContact CB-CD2 4.17Å; M284-L327 HydrophobicContact CG-CD2 4.1Å
285	K	93.8	Very high	93.4	Very high	76 Å²	76	42.9 Å²	42.9	33%	0.33	21%	0.213	S	C	.	.	H	α-helix	trans	-70.8	-41.5	178.5	-65	-178.5	-179.7	177.8	0	111.4	F16 L219 N283 N289	F16-K285 HydrophobicContact CE1-CG 4.32Å; L219-K285 HydrophobicContact CD1-CB 3.97Å; L219-K285 HydrophobicContact CD1-CD 4.14Å; L219-K285 VanDerWaalsContact CD2-C 3.42Å; L219-K285 HydrophobicContact CD2-CB 3.8Å; L219-K285 VanDerWaalsContact CD2-O 3.29Å; L219-K285 WeakPolarHBondContact CD2-O 3.48Å; N283-K285 PolarHBondContact O-N 2.79Å; N283-K285 PolarHBondContact OD1-N 2.96Å; N283-K285 VanDerWaalsContact OD1-N 3.14Å; K285-N289 PolarHBondContact O-N 2.96Å; K285-N289 VanDerWaalsContact O-N 3.11Å; K285-N289 PolarHBondContact O-ND2 3.26Å
286	I	95	Very high	93	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-65.6	-49.4	175.9	-68	171.4	0	0	0	108.7	L218 L219 L222 Y280 N283 Y288 N289 I290	L218-I286 HydrophobicContact CD2-CD1 3.65Å; L218-I286 HydrophobicContact CD2-CG1 4.05Å; L218-I286 HydrophobicContact CD2-CG2 4.11Å; L219-I286 HydrophobicContact CD2-CB 4.5Å; L219-I286 HydrophobicContact CD2-CG1 3.94Å; L219-I286 HydrophobicContact CG-CG1 4.36Å; L222-I286 HydrophobicContact CD1-CG2 4.26Å; Y280-I286 HydrophobicContact CD1-CD1 3.85Å; Y280-I286 HydrophobicContact CD2-CD1 3.89Å; Y280-I286 HydrophobicContact CD2-CG2 4.5Å; Y280-I286 HydrophobicContact CE1-CD1 4.38Å; Y280-I286 HydrophobicContact CE2-CD1 4.42Å; Y280-I286 HydrophobicContact CG-CD1 3.57Å; N283-I286 HydrophobicContact CB-CB 4.19Å; N283-I286 HydrophobicContact CB-CD1 3.91Å; N283-I286 HydrophobicContact CB-CG1 4.21Å; N283-I286 VanDerWaalsContact ND2-CD1 3.32Å; N283-I286 WeakPolarHBondContact ND2-CD1 3.37Å; N283-I286 PolarHBondContact O-N 3Å; N283-I286 PolarHBondContact OD1-N 3.34Å; N283-I286 VanDerWaalsContact OD1-N 3.16Å; I286-Y288 VanDerWaalsContact C-N 3.3Å; I286-Y288 PolarHBondContact O-N 2.96Å; I286-N289 PolarHBondContact O-N 3Å; I286-N289 VanDerWaalsContact O-N 3.16Å; I286-I290 HydrophobicContact CG2-CD1 3.62Å; I286-I290 HydrophobicContact CG2-CG1 4.27Å; I286-I290 WeakPolarHBondContact O-CG1 3.48Å; I286-I290 PolarHBondContact O-N 3.13Å
287	A	96.3	Very high	92.6	Very high	4 Å²	4	40.3 Å²	40.3	3%	0.033	20%	0.202	C	C	.	.	H	α-helix	trans	-55.1	-44.3	176.9	0	0	0	0	0	112.3	L277 N283 I290 A291 L319 L327	L277-A287 HydrophobicContact CD2-CB 4.25Å; N283-A287 PolarHBondContact O-N 3.25Å; A287-I290 PolarHBondContact O-N 2.57Å; A287-A291 WeakPolarHBondContact O-CB 3.37Å; A287-A291 PolarHBondContact O-N 3.48Å; A287-L319 HydrophobicContact CB-CD1 3.99Å; A287-L319 HydrophobicContact CB-CD2 3.87Å; A287-L327 HydrophobicContact CB-CD1 4.05Å; A287-L327 HydrophobicContact CB-CD2 4.2Å
288	Y	95.7	Very high	92.2	Very high	10 Å²	10	39.7 Å²	39.7	4%	0.039	20%	0.199	C	C	.	.	H	α-helix	trans	-59.5	-47.8	176.5	176.4	-106.1	0	0	0	112.5	E15 F16 M284 I286 I290 A291 R292 V326 E330	E15-Y288 PolarHBondContact OE2-OH 2.95Å; E15-Y288 VanDerWaalsContact OE2-OH 3.08Å; F16-Y288 HydrophobicContact CD2-CD2 4.49Å; F16-Y288 HydrophobicContact CD2-CG 4.4Å; M284-Y288 WeakPolarHBondContact O-CB 3.29Å; M284-Y288 PolarHBondContact O-N 2.76Å; I286-Y288 VanDerWaalsContact C-N 3.3Å; I286-Y288 PolarHBondContact O-N 2.96Å; Y288-I290 PolarHBondContact O-N 2.95Å; Y288-A291 PolarHBondContact O-N 2.88Å; Y288-R292 VanDerWaalsContact CE1-CD 3.44Å; Y288-R292 WeakPolarHBondContact O-CG 3.27Å; Y288-R292 PolarHBondContact O-N 3Å; Y288-V326 HydrophobicContact CD2-CG1 4.18Å; Y288-V326 HydrophobicContact CE2-CG1 3.5Å; Y288-V326 VanDerWaalsContact CE2-CG1 3.5Å; Y288-E330 HydrophobicContact CD2-CB 4.37Å; Y288-E330 HydrophobicContact CD2-CG 3.93Å; Y288-E330 HydrophobicContact CE2-CB 4.39Å; Y288-E330 HydrophobicContact CE2-CG 3.48Å; Y288-E330 VanDerWaalsContact CE2-CG 3.48Å
289	N	94.8	Very high	91.4	Very high	15 Å²	15	36.2 Å²	36.2	8%	0.08	19%	0.194	C	C	.	.	H	α-helix	trans	-69.1	-35.3	179.9	-79.9	-80.8	0	0	0	112.4	L219 L222 K285 I286 R292 L293	L219-N289 HydrophobicContact CD2-CB 4.4Å; L219-N289 WeakPolarHBondContact CD2-ND2 3.38Å; L222-N289 HydrophobicContact CB-CB 4.08Å; L222-N289 HydrophobicContact CD1-CB 4.25Å; K285-N289 PolarHBondContact O-N 2.96Å; K285-N289 VanDerWaalsContact O-N 3.11Å; K285-N289 PolarHBondContact O-ND2 3.26Å; I286-N289 PolarHBondContact O-N 3Å; I286-N289 VanDerWaalsContact O-N 3.16Å; N289-R292 PolarHBondContact O-N 2.7Å; N289-L293 WeakPolarHBondContact O-CB 3.42Å; N289-L293 PolarHBondContact O-N 3.22Å
290	I	96	Very high	90.6	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-66.1	-45	173.5	-68.6	174.9	0	0	0	111	L222 I273 L276 L277 I286 A287 Y288 R292 L293 I294	L222-I290 HydrophobicContact CD1-CD1 4.38Å; L222-I290 HydrophobicContact CD1-CG1 3.77Å; L222-I290 HydrophobicContact CD2-CG1 4.03Å; I273-I290 HydrophobicContact CG2-CG2 3.68Å; L276-I290 HydrophobicContact CB-CD1 3.57Å; L276-I290 HydrophobicContact CD1-CD1 4.42Å; L277-I290 HydrophobicContact CD1-CG2 3.82Å; L277-I290 HydrophobicContact CD2-CB 4.06Å; L277-I290 HydrophobicContact CD2-CD1 3.93Å; L277-I290 HydrophobicContact CD2-CG2 3.9Å; L277-I290 HydrophobicContact CG-CB 4.38Å; L277-I290 HydrophobicContact CG-CD1 3.91Å; L277-I290 HydrophobicContact CG-CG2 3.76Å; I286-I290 HydrophobicContact CG2-CD1 3.62Å; I286-I290 HydrophobicContact CG2-CG1 4.27Å; I286-I290 WeakPolarHBondContact O-CG1 3.48Å; I286-I290 PolarHBondContact O-N 3.13Å; A287-I290 PolarHBondContact O-N 2.57Å; Y288-I290 PolarHBondContact O-N 2.95Å; I290-R292 VanDerWaalsContact C-N 3.29Å; I290-R292 PolarHBondContact O-N 3.47Å; I290-L293 WeakPolarHBondContact O-CB 3.32Å; I290-L293 PolarHBondContact O-N 3.04Å; I290-L293 VanDerWaalsContact O-N 3.09Å; I290-I294 HydrophobicContact CG2-CD1 3.66Å; I290-I294 HydrophobicContact CG2-CG1 4.27Å; I290-I294 WeakPolarHBondContact O-CG1 3.37Å; I290-I294 PolarHBondContact O-N 3.04Å
291	A	94.9	Very high	90.1	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-57.8	-43	176.1	0	0	0	0	0	111.4	A287 Y288 L293 I294 K295 E330	A287-A291 WeakPolarHBondContact O-CB 3.37Å; A287-A291 PolarHBondContact O-N 3.48Å; Y288-A291 PolarHBondContact O-N 2.88Å; A291-L293 PolarHBondContact O-N 2.92Å; A291-I294 PolarHBondContact O-N 3.12Å; A291-K295 WeakPolarHBondContact O-CB 3.43Å; A291-K295 PolarHBondContact O-N 3.15Å; A291-E330 HydrophobicContact CB-CB 3.97Å
292	R	90.4	Very high	89.7	Confident	36 Å²	36	33 Å²	33	14%	0.136	17%	0.172	C	C	.	.	H	α-helix	trans	-62.9	-40.3	173.8	-70.1	175.1	84.1	-149.8	10.2	112.9	D223 Y288 N289 I290 K295 V296 E330	D223-R292 IonicContact OD1-NH1 3.83Å; D223-R292 PolarHBondContact OD1-NH1 2.73Å; Y288-R292 VanDerWaalsContact CE1-CD 3.44Å; Y288-R292 WeakPolarHBondContact O-CG 3.27Å; Y288-R292 PolarHBondContact O-N 3Å; N289-R292 PolarHBondContact O-N 2.7Å; I290-R292 VanDerWaalsContact C-N 3.29Å; I290-R292 PolarHBondContact O-N 3.47Å; R292-K295 WeakPolarHBondContact O-CB 3.3Å; R292-K295 PolarHBondContact O-N 3.49Å; R292-V296 WeakPolarHBondContact O-CG2 3.45Å; R292-V296 PolarHBondContact O-N 2.81Å; R292-E330 HydrophobicContact CG-CG 4Å; R292-E330 WeakPolarHBondContact CG-OE2 3.25Å
293	L	92.2	Very high	89.4	Confident	1 Å²	1	26.8 Å²	26.8	1%	0.005	13%	0.134	C	C	.	.	H	α-helix	trans	-63.9	-46.9	175.9	178.1	59.9	0	0	0	110.8	L222 L225 R226 V229 I273 N289 I290 A291 K295 V296 L297	L222-L293 HydrophobicContact CD2-CD2 4.13Å; L225-L293 HydrophobicContact CD2-CD1 4.45Å; L225-L293 HydrophobicContact CD2-CD2 3.9Å; L225-L293 HydrophobicContact CG-CD1 4.17Å; L225-L293 HydrophobicContact CG-CD2 4.43Å; R226-L293 HydrophobicContact CB-CD1 4.24Å; V229-L293 HydrophobicContact CG2-CD1 3.96Å; I273-L293 HydrophobicContact CD1-CD2 3.85Å; I273-L293 HydrophobicContact CD1-CG 4.22Å; I273-L293 HydrophobicContact CG1-CD2 4.14Å; N289-L293 WeakPolarHBondContact O-CB 3.42Å; N289-L293 PolarHBondContact O-N 3.22Å; I290-L293 WeakPolarHBondContact O-CB 3.32Å; I290-L293 PolarHBondContact O-N 3.04Å; I290-L293 VanDerWaalsContact O-N 3.09Å; A291-L293 PolarHBondContact O-N 2.92Å; L293-K295 VanDerWaalsContact C-N 3.31Å; L293-K295 PolarHBondContact O-N 2.99Å; L293-V296 PolarHBondContact O-N 3.27Å; L293-V296 VanDerWaalsContact O-N 3.16Å; L293-L297 HydrophobicContact CD1-CD1 4.11Å; L293-L297 HydrophobicContact CD1-CG 4.16Å; L293-L297 HydrophobicContact CG-CD1 3.93Å; L293-L297 HydrophobicContact CG-CG 4.4Å; L293-L297 WeakPolarHBondContact O-CG 3.46Å; L293-L297 PolarHBondContact O-N 2.78Å
294	I	92.4	Very high	89.1	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-59	-43	176.1	-67.9	162.8	0	0	0	110.7	I273 L277 I290 A291 V296 L297 S298 L307 T312 L316	I273-I294 HydrophobicContact CD1-CG1 4.49Å; I273-I294 HydrophobicContact CG2-CD1 3.7Å; I273-I294 HydrophobicContact CG2-CG1 3.87Å; L277-I294 HydrophobicContact CD1-CD1 4.46Å; I290-I294 HydrophobicContact CG2-CD1 3.66Å; I290-I294 HydrophobicContact CG2-CG1 4.27Å; I290-I294 WeakPolarHBondContact O-CG1 3.37Å; I290-I294 PolarHBondContact O-N 3.04Å; A291-I294 PolarHBondContact O-N 3.12Å; I294-V296 VanDerWaalsContact C-N 3.28Å; I294-V296 PolarHBondContact O-N 3.31Å; I294-L297 PolarHBondContact O-N 3.27Å; I294-S298 WeakPolarHBondContact O-CB 3.26Å; I294-S298 PolarHBondContact O-N 2.99Å; I294-S298 PolarHBondContact O-OG 3.11Å; I294-L307 HydrophobicContact CG1-CD2 4.28Å; I294-L307 HydrophobicContact CG2-CD1 4.22Å; I294-T312 HydrophobicContact CD1-CG2 3.72Å; I294-T312 HydrophobicContact CG1-CG2 4.33Å; I294-T312 HydrophobicContact CG2-CG2 4.27Å; I294-L316 HydrophobicContact CD1-CD1 4.03Å; I294-L316 HydrophobicContact CD1-CD2 3.81Å; I294-L316 HydrophobicContact CD1-CG 4.17Å; I294-L316 HydrophobicContact CG2-CD1 4.33Å
295	K	86.9	Confident	88.9	Confident	42 Å²	42	24.3 Å²	24.3	18%	0.183	12%	0.121	C	C	.	.	H	α-helix	trans	-54.2	-43.9	175.8	-177.9	176	75.3	-172.4	0	112.1	A291 R292 L293 S298 E330 W333 N337	A291-K295 WeakPolarHBondContact O-CB 3.43Å; A291-K295 PolarHBondContact O-N 3.15Å; R292-K295 WeakPolarHBondContact O-CB 3.3Å; R292-K295 PolarHBondContact O-N 3.49Å; L293-K295 VanDerWaalsContact C-N 3.31Å; L293-K295 PolarHBondContact O-N 2.99Å; K295-S298 PolarHBondContact O-OG 3.14Å; K295-S298 VanDerWaalsContact O-OG 3.05Å; K295-E330 WeakPolarHBondContact CD-OE2 3.43Å; K295-E330 VanDerWaalsContact CE-OE2 3.28Å; K295-E330 WeakPolarHBondContact CE-OE2 3.39Å; K295-E330 IonicContact NZ-OE1 3.55Å; K295-E330 PolarHBondContact NZ-OE1 2.89Å; K295-E330 IonicContact NZ-OE2 3.78Å; K295-E330 PolarHBondContact NZ-OE2 3.48Å; K295-W333 HydrophobicContact CD-CB 3.62Å; K295-W333 HydrophobicContact CD-CD2 4.09Å; K295-W333 HydrophobicContact CD-CE3 3.65Å; K295-W333 HydrophobicContact CD-CG 4.14Å; K295-W333 HydrophobicContact CG-CB 4.05Å; K295-W333 VanDerWaalsContact NZ-CE3 3.29Å; K295-N337 PolarHBondContact O-ND2 3.08Å
296	V	85.7	Confident	88.7	Confident	16 Å²	16	23 Å²	23	10%	0.097	12%	0.115	C	C	.	.	H	α-helix	trans	-73.7	-40.6	179.1	-179.4	0	0	0	0	111.8	R226 V229 Y230 R292 L293 I294 S298	R226-V296 HydrophobicContact CG-CG2 4.13Å; V229-V296 HydrophobicContact CG2-CB 4.35Å; V229-V296 HydrophobicContact CG2-CG1 3.75Å; Y230-V296 HydrophobicContact CD2-CG1 4.22Å; Y230-V296 HydrophobicContact CD2-CG2 3.86Å; Y230-V296 HydrophobicContact CE2-CG2 4.47Å; R292-V296 WeakPolarHBondContact O-CG2 3.45Å; R292-V296 PolarHBondContact O-N 2.81Å; L293-V296 PolarHBondContact O-N 3.27Å; L293-V296 VanDerWaalsContact O-N 3.16Å; I294-V296 VanDerWaalsContact C-N 3.28Å; I294-V296 PolarHBondContact O-N 3.31Å; V296-S298 PolarHBondContact O-N 3.31Å
297	L	86.6	Confident	88.5	Confident	1 Å²	1	22.9 Å²	22.9	1%	0.005	12%	0.115	C	C	.	.	H	α-helix	trans	-66.3	-38.2	179.7	-68.9	175.6	0	0	0	112.3	V229 L239 I273 L293 I294 V299 C300 N303 L307	V229-L297 HydrophobicContact CG1-CD2 4.49Å; V229-L297 HydrophobicContact CG2-CD2 4.3Å; L239-L297 HydrophobicContact CD1-CD2 3.78Å; I273-L297 HydrophobicContact CD1-CD1 3.72Å; L293-L297 HydrophobicContact CD1-CD1 4.11Å; L293-L297 HydrophobicContact CD1-CG 4.16Å; L293-L297 HydrophobicContact CG-CD1 3.93Å; L293-L297 HydrophobicContact CG-CG 4.4Å; L293-L297 WeakPolarHBondContact O-CG 3.46Å; L293-L297 PolarHBondContact O-N 2.78Å; I294-L297 PolarHBondContact O-N 3.27Å; L297-V299 PolarHBondContact O-N 3.36Å; L297-V299 VanDerWaalsContact O-N 3.13Å; L297-C300 PolarHBondContact O-N 2.67Å; L297-N303 WeakPolarHBondContact O-CB 3.5Å; L297-N303 PolarHBondContact O-ND2 2.67Å; L297-L307 HydrophobicContact CB-CD1 4.21Å
298	S	86.5	Confident	88.4	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	4.2	-173.7	58	0	0	0	0	115.5	I294 K295 V296 C300 K304 N337	I294-S298 WeakPolarHBondContact O-CB 3.26Å; I294-S298 PolarHBondContact O-N 2.99Å; I294-S298 PolarHBondContact O-OG 3.11Å; K295-S298 PolarHBondContact O-OG 3.14Å; K295-S298 VanDerWaalsContact O-OG 3.05Å; V296-S298 PolarHBondContact O-N 3.31Å; S298-C300 VanDerWaalsContact C-N 3.31Å; S298-K304 WeakPolarHBondContact O-CE 3.45Å; S298-K304 VanDerWaalsContact O-CG 3.26Å; S298-K304 WeakPolarHBondContact O-CG 3.34Å; S298-N337 VanDerWaalsContact CB-CB 3.5Å; S298-N337 WeakPolarHBondContact OG-CB 3.47Å; S298-N337 PolarHBondContact OG-ND2 3.45Å
299	V	76.5	Confident	88.3	Confident	75 Å²	75	29.2 Å²	29.2	46%	0.455	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-23.5	173.2	-178.3	0	0	0	0	112	L297	L297-V299 PolarHBondContact O-N 3.36Å; L297-V299 VanDerWaalsContact O-N 3.13Å
300	C	78.5	Confident	88.2	Confident	10 Å²	10	28.9 Å²	28.9	7%	0.068	14%	0.144	C	C	.	.	S	Bend	trans	-101.3	132.2	-178.8	161.2	0	0	0	0	110.7	L297 S298 E302 N303 K304	L297-C300 PolarHBondContact O-N 2.67Å; S298-C300 VanDerWaalsContact C-N 3.31Å; C300-E302 VanDerWaalsContact C-N 3.32Å; C300-E302 PolarHBondContact O-N 3.16Å; C300-E302 PolarHBondContact SG-OE2 3.46Å; C300-N303 HydrophobicContact CB-CB 4.32Å; C300-N303 WeakPolarHBondContact O-CB 3.34Å; C300-N303 PolarHBondContact O-N 3.46Å; C300-N303 VanDerWaalsContact O-N 3.16Å; C300-K304 WeakPolarHBondContact O-CG 3.48Å; C300-K304 PolarHBondContact O-N 2.96Å
301	N	81.3	Confident	88.3	Confident	50 Å²	50	29.3 Å²	29.3	27%	0.267	15%	0.149	S	C	.	.	H	α-helix	trans	-59.6	-41.3	-173.9	-80.9	0.9	0	0	0	112.6	N303 K304 I305 R680	N301-N303 VanDerWaalsContact C-N 3.32Å; N301-N303 PolarHBondContact O-N 3.05Å; N301-K304 WeakPolarHBondContact O-CB 3.34Å; N301-K304 PolarHBondContact O-N 2.94Å; N301-I305 WeakPolarHBondContact O-CG1 3.44Å; N301-I305 PolarHBondContact O-N 3.33Å; N301-I305 VanDerWaalsContact O-N 3.13Å; N301-R680 PolarHBondContact ND2-NH2 3.23Å
302	E	81.8	Confident	88.3	Confident	94 Å²	94	29.3 Å²	29.3	44%	0.439	15%	0.149	S	C	.	.	H	α-helix	trans	-62.6	-40.9	179.3	-62.7	75.6	-169.3	0	0	111.2	V240 C300 K306	V240-E302 HydrophobicContact CG1-CB 4.24Å; V240-E302 HydrophobicContact CG2-CB 3.9Å; C300-E302 VanDerWaalsContact C-N 3.32Å; C300-E302 PolarHBondContact O-N 3.16Å; C300-E302 PolarHBondContact SG-OE2 3.46Å; E302-K306 WeakPolarHBondContact O-CG 3.18Å; E302-K306 PolarHBondContact O-N 3.17Å
303	N	84.4	Confident	88.7	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-66.7	-38.8	174.4	-77.2	-17.9	0	0	0	112.3	S236 V240 Y270 L297 C300 N301 I305 K306 L307	S236-N303 WeakPolarHBondContact CB-ND2 3.48Å; S236-N303 PolarHBondContact O-ND2 3.29Å; S236-N303 VanDerWaalsContact O-ND2 3.14Å; S236-N303 PolarHBondContact O-OD1 3.03Å; V240-N303 WeakPolarHBondContact CG2-OD1 3.48Å; Y270-N303 HydrophobicContact CE1-CB 4.46Å; Y270-N303 PolarHBondContact OH-OD1 3.22Å; L297-N303 WeakPolarHBondContact O-CB 3.5Å; L297-N303 PolarHBondContact O-ND2 2.67Å; C300-N303 HydrophobicContact CB-CB 4.32Å; C300-N303 WeakPolarHBondContact O-CB 3.34Å; C300-N303 PolarHBondContact O-N 3.46Å; C300-N303 VanDerWaalsContact O-N 3.16Å; N301-N303 VanDerWaalsContact C-N 3.32Å; N301-N303 PolarHBondContact O-N 3.05Å; N303-I305 VanDerWaalsContact C-N 3.34Å; N303-I305 PolarHBondContact O-N 2.96Å; N303-K306 PolarHBondContact O-N 3.38Å; N303-L307 WeakPolarHBondContact O-CB 3.28Å; N303-L307 WeakPolarHBondContact O-CD1 3.19Å; N303-L307 VanDerWaalsContact O-CG 3.25Å; N303-L307 WeakPolarHBondContact O-CG 3.35Å; N303-L307 PolarHBondContact O-N 3.46Å
304	K	87.7	Confident	88.9	Confident	8 Å²	8	31.2 Å²	31.2	4%	0.035	16%	0.159	C	C	.	.	H	α-helix	trans	-57.9	-49.2	177.1	-64.4	177.9	-179.2	-155.7	0	110.7	S298 C300 N301 K306 L307 V308 N337 I338 D340 Q341	S298-K304 WeakPolarHBondContact O-CE 3.45Å; S298-K304 VanDerWaalsContact O-CG 3.26Å; S298-K304 WeakPolarHBondContact O-CG 3.34Å; C300-K304 WeakPolarHBondContact O-CG 3.48Å; C300-K304 PolarHBondContact O-N 2.96Å; N301-K304 WeakPolarHBondContact O-CB 3.34Å; N301-K304 PolarHBondContact O-N 2.94Å; K304-K306 PolarHBondContact O-N 3.25Å; K304-L307 PolarHBondContact O-N 3.28Å; K304-V308 WeakPolarHBondContact O-CG2 3.45Å; K304-V308 PolarHBondContact O-N 3.01Å; K304-N337 WeakPolarHBondContact CD-O 3.48Å; K304-N337 WeakPolarHBondContact CE-O 3.43Å; K304-N337 PolarHBondContact NZ-O 3.43Å; K304-I338 HydrophobicContact CB-CG2 4.3Å; K304-I338 HydrophobicContact CG-CG2 4.27Å; K304-D340 VanDerWaalsContact NZ-CG 3.25Å; K304-D340 IonicContact NZ-OD1 3.11Å; K304-D340 PolarHBondContact NZ-OD1 2.69Å; K304-D340 IonicContact NZ-OD2 3.17Å; K304-D340 PolarHBondContact NZ-OD2 2.98Å; K304-Q341 HydrophobicContact CB-CB 4.48Å; K304-Q341 HydrophobicContact CB-CG 3.77Å; K304-Q341 HydrophobicContact CD-CG 4.16Å
305	I	90.6	Very high	89.2	Confident	71 Å²	71	31.8 Å²	31.8	36%	0.364	16%	0.164	S	C	.	.	H	α-helix	trans	-57.4	-51.3	179.2	-65.3	166.6	0	0	0	109.6	N301 N303 L307 V308 E309 Q341	N301-I305 WeakPolarHBondContact O-CG1 3.44Å; N301-I305 PolarHBondContact O-N 3.33Å; N301-I305 VanDerWaalsContact O-N 3.13Å; N303-I305 VanDerWaalsContact C-N 3.34Å; N303-I305 PolarHBondContact O-N 2.96Å; I305-L307 VanDerWaalsContact C-N 3.33Å; I305-L307 PolarHBondContact O-N 2.86Å; I305-V308 WeakPolarHBondContact O-CB 3.43Å; I305-V308 PolarHBondContact O-N 3Å; I305-V308 VanDerWaalsContact O-N 3.14Å; I305-E309 HydrophobicContact CG2-CG 4.29Å; I305-E309 WeakPolarHBondContact O-CG 3.5Å; I305-E309 PolarHBondContact O-N 3.39Å; I305-Q341 HydrophobicContact CG1-CG 4.2Å
306	K	88.1	Confident	89.7	Confident	48 Å²	48	29.8 Å²	29.8	21%	0.209	16%	0.155	C	C	.	.	H	α-helix	trans	-66.1	-32.7	-178.3	-62.2	-117.1	-176.7	173.9	0	113.7	Y270 E302 N303 K304 A310	Y270-K306 HydrophobicContact CD2-CB 3.36Å; Y270-K306 HydrophobicContact CD2-CD 4.21Å; Y270-K306 HydrophobicContact CD2-CG 4.31Å; Y270-K306 HydrophobicContact CE1-CB 4.36Å; Y270-K306 HydrophobicContact CE2-CB 3.27Å; Y270-K306 HydrophobicContact CE2-CD 3.8Å; Y270-K306 HydrophobicContact CE2-CG 3.88Å; Y270-K306 HydrophobicContact CG-CB 4.06Å; E302-K306 WeakPolarHBondContact O-CG 3.18Å; E302-K306 PolarHBondContact O-N 3.17Å; N303-K306 PolarHBondContact O-N 3.38Å; K304-K306 PolarHBondContact O-N 3.25Å; K306-A310 WeakPolarHBondContact O-CB 3.43Å; K306-A310 PolarHBondContact O-N 2.86Å
307	L	90.8	Very high	90.2	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-64.9	-44.8	172.3	-78.2	164.1	0	0	0	111	Y270 I294 L297 N303 K304 I305 A310 T312 I338	Y270-L307 HydrophobicContact CD1-CD2 3.62Å; Y270-L307 HydrophobicContact CD1-CG 3.7Å; Y270-L307 HydrophobicContact CE1-CD2 4.44Å; Y270-L307 HydrophobicContact CE1-CG 4.17Å; Y270-L307 HydrophobicContact CG-CD2 4.39Å; I294-L307 HydrophobicContact CG1-CD2 4.28Å; I294-L307 HydrophobicContact CG2-CD1 4.22Å; L297-L307 HydrophobicContact CB-CD1 4.21Å; N303-L307 WeakPolarHBondContact O-CB 3.28Å; N303-L307 WeakPolarHBondContact O-CD1 3.19Å; N303-L307 VanDerWaalsContact O-CG 3.25Å; N303-L307 WeakPolarHBondContact O-CG 3.35Å; N303-L307 PolarHBondContact O-N 3.46Å; K304-L307 PolarHBondContact O-N 3.28Å; I305-L307 VanDerWaalsContact C-N 3.33Å; I305-L307 PolarHBondContact O-N 2.86Å; L307-A310 PolarHBondContact O-N 3.28Å; L307-T312 HydrophobicContact CD2-CG2 4.23Å; L307-T312 WeakPolarHBondContact O-CB 3.41Å; L307-T312 PolarHBondContact O-N 3.4Å; L307-T312 VanDerWaalsContact O-N 3.12Å; L307-T312 PolarHBondContact O-OG1 3.04Å; L307-I338 HydrophobicContact CB-CG2 4.35Å; L307-I338 HydrophobicContact CD1-CG2 4.03Å
308	V	95.2	Very high	90.7	Very high	8 Å²	8	33.5 Å²	33.5	5%	0.048	18%	0.179	C	C	.	.	H	α-helix	trans	-62.4	-49.2	176.4	171.6	0	0	0	0	110.4	K304 I305 A310 G311 V313 I338 Q341 A342 L345	K304-V308 WeakPolarHBondContact O-CG2 3.45Å; K304-V308 PolarHBondContact O-N 3.01Å; I305-V308 WeakPolarHBondContact O-CB 3.43Å; I305-V308 PolarHBondContact O-N 3Å; I305-V308 VanDerWaalsContact O-N 3.14Å; V308-A310 PolarHBondContact O-N 2.82Å; V308-G311 PolarHBondContact O-N 3.24Å; V308-V313 HydrophobicContact CG2-CG2 4.42Å; V308-I338 HydrophobicContact CG2-CB 4.08Å; V308-I338 HydrophobicContact CG2-CD1 4.47Å; V308-Q341 HydrophobicContact CG2-CB 3.97Å; V308-A342 HydrophobicContact CG1-CB 4.43Å; V308-A342 HydrophobicContact CG2-CB 4.13Å; V308-L345 HydrophobicContact CG1-CD1 3.75Å; V308-L345 HydrophobicContact CG1-CD2 4.2Å; V308-L345 HydrophobicContact CG1-CG 4.11Å
309	E	93.6	Very high	91.2	Very high	139 Å²	139	34.4 Å²	34.4	65%	0.65	18%	0.184	S	C	*	.	H	α-helix	trans	-58.4	-31.3	176.4	-71.8	174.3	167.8	0	0	113.1	I305 G311	I305-E309 HydrophobicContact CG2-CG 4.29Å; I305-E309 WeakPolarHBondContact O-CG 3.5Å; I305-E309 PolarHBondContact O-N 3.39Å; E309-G311 PolarHBondContact O-N 3.43Å
310	A	93	Very high	92.1	Very high	7 Å²	7	30.9 Å²	30.9	6%	0.058	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-8.3	177.5	0	0	0	0	0	114.2	V274 K306 L307 V308	V274-A310 HydrophobicContact CG2-CB 4.29Å; K306-A310 WeakPolarHBondContact O-CB 3.43Å; K306-A310 PolarHBondContact O-N 2.86Å; L307-A310 PolarHBondContact O-N 3.28Å; V308-A310 PolarHBondContact O-N 2.82Å
311	G	96.5	Very high	93	Very high	10 Å²	10	35.4 Å²	35.4	10%	0.103	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.1	30.4	-175.5	0	0	0	0	0	113.4	V308 E309 V313 E314 A315	V308-G311 PolarHBondContact O-N 3.24Å; E309-G311 PolarHBondContact O-N 3.43Å; G311-V313 VanDerWaalsContact C-N 3.29Å; G311-V313 PolarHBondContact O-N 3.33Å; G311-E314 VanDerWaalsContact C-OE2 3.3Å; G311-E314 VanDerWaalsContact CA-OE2 3.24Å; G311-E314 WeakPolarHBondContact CA-OE2 3.43Å; G311-A315 PolarHBondContact O-N 3.15Å; G311-A315 VanDerWaalsContact O-N 3.16Å
312	T	96.9	Very high	93.4	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-64.9	-33.8	179.2	-59.1	0	0	0	0	111.9	I294 L307 A315 L316 I338	I294-T312 HydrophobicContact CD1-CG2 3.72Å; I294-T312 HydrophobicContact CG1-CG2 4.33Å; I294-T312 HydrophobicContact CG2-CG2 4.27Å; L307-T312 HydrophobicContact CD2-CG2 4.23Å; L307-T312 WeakPolarHBondContact O-CB 3.41Å; L307-T312 PolarHBondContact O-N 3.4Å; L307-T312 VanDerWaalsContact O-N 3.12Å; L307-T312 PolarHBondContact O-OG1 3.04Å; T312-A315 PolarHBondContact O-N 3.48Å; T312-L316 HydrophobicContact CG2-CD1 3.87Å; T312-L316 HydrophobicContact CG2-CG 4.03Å; T312-L316 WeakPolarHBondContact O-CB 3.35Å; T312-L316 WeakPolarHBondContact O-CG 3.44Å; T312-L316 PolarHBondContact O-N 3.47Å; T312-I338 HydrophobicContact CG2-CD1 4.07Å
313	V	97.9	Very high	93.9	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.006	20%	0.203	C	C	.	.	H	α-helix	trans	-63.2	-47.6	-179.5	177.8	0	0	0	0	110.2	V308 G311 A315 L316 T317 L335 I338 A342 L345 L351	V308-V313 HydrophobicContact CG2-CG2 4.42Å; G311-V313 VanDerWaalsContact C-N 3.29Å; G311-V313 PolarHBondContact O-N 3.33Å; V313-A315 VanDerWaalsContact C-N 3.33Å; V313-A315 PolarHBondContact O-N 3.12Å; V313-L316 PolarHBondContact O-N 3.4Å; V313-T317 WeakPolarHBondContact O-CB 3.38Å; V313-T317 PolarHBondContact O-N 2.93Å; V313-T317 PolarHBondContact O-OG1 2.97Å; V313-L335 HydrophobicContact CG1-CD2 4.37Å; V313-I338 HydrophobicContact CG2-CD1 3.74Å; V313-I338 HydrophobicContact CG2-CG1 4.36Å; V313-A342 HydrophobicContact CG2-CB 3.76Å; V313-L345 HydrophobicContact CB-CD1 4.12Å; V313-L345 HydrophobicContact CG2-CD1 4.03Å; V313-L351 HydrophobicContact CG1-CD2 3.76Å
314	E	97.2	Very high	94.3	Very high	76 Å²	76	37.7 Å²	37.7	36%	0.355	21%	0.209	S	C	.	.	H	α-helix	trans	-59.9	-43.1	175.5	-67	82	164.4	0	0	111.3	G311 P318 A347	G311-E314 VanDerWaalsContact C-OE2 3.3Å; G311-E314 VanDerWaalsContact CA-OE2 3.24Å; G311-E314 WeakPolarHBondContact CA-OE2 3.43Å; E314-P318 WeakPolarHBondContact O-CD 3.45Å; E314-A347 HydrophobicContact CG-CB 3.45Å; E314-A347 VanDerWaalsContact CG-CB 3.45Å; E314-A347 WeakPolarHBondContact OE1-CB 3.36Å
315	A	97	Very high	94.6	Very high	12 Å²	12	41.4 Å²	41.4	10%	0.099	23%	0.226	C	C	.	.	H	α-helix	trans	-70.2	-34.6	-178.3	0	0	0	0	0	113.1	V274 L277 G311 T312 V313	V274-A315 HydrophobicContact CG1-CB 4.14Å; V274-A315 HydrophobicContact CG2-CB 4.24Å; L277-A315 HydrophobicContact CB-CB 4.27Å; L277-A315 HydrophobicContact CD1-CB 3.81Å; G311-A315 PolarHBondContact O-N 3.15Å; G311-A315 VanDerWaalsContact O-N 3.16Å; T312-A315 PolarHBondContact O-N 3.48Å; V313-A315 VanDerWaalsContact C-N 3.33Å; V313-A315 PolarHBondContact O-N 3.12Å
316	L	97.3	Very high	94.8	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-80.9	-26.8	178.2	-71.2	-175.4	0	0	0	113.3	L277 I294 T312 V313 L319 T331 L335	L277-L316 HydrophobicContact CD1-CD2 3.79Å; L277-L316 HydrophobicContact CD1-CG 4.49Å; I294-L316 HydrophobicContact CD1-CD1 4.03Å; I294-L316 HydrophobicContact CD1-CD2 3.81Å; I294-L316 HydrophobicContact CD1-CG 4.17Å; I294-L316 HydrophobicContact CG2-CD1 4.33Å; T312-L316 HydrophobicContact CG2-CD1 3.87Å; T312-L316 HydrophobicContact CG2-CG 4.03Å; T312-L316 WeakPolarHBondContact O-CB 3.35Å; T312-L316 WeakPolarHBondContact O-CG 3.44Å; T312-L316 PolarHBondContact O-N 3.47Å; V313-L316 PolarHBondContact O-N 3.4Å; L316-L319 HydrophobicContact CD2-CD1 3.78Å; L316-L319 WeakPolarHBondContact O-CB 3.39Å; L316-L319 PolarHBondContact O-N 2.93Å; L316-T331 HydrophobicContact CB-CG2 3.92Å; L316-T331 HydrophobicContact CD1-CG2 4.48Å; L316-T331 HydrophobicContact CD2-CG2 4.2Å; L316-T331 HydrophobicContact CG-CG2 4.42Å; L316-L335 HydrophobicContact CB-CD1 4.22Å; L316-L335 HydrophobicContact CB-CD2 3.99Å; L316-L335 HydrophobicContact CB-CG 4.08Å; L316-L335 HydrophobicContact CD1-CD2 3.98Å; L316-L335 HydrophobicContact CD1-CG 3.85Å
317	T	97.7	Very high	95.1	Very high	11 Å²	11	37.8 Å²	37.8	7%	0.067	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-53.9	-45.8	-174.3	-65.1	0	0	0	0	113.4	V313 L319 L320 L351 I354	V313-T317 WeakPolarHBondContact O-CB 3.38Å; V313-T317 PolarHBondContact O-N 2.93Å; V313-T317 PolarHBondContact O-OG1 2.97Å; T317-L319 VanDerWaalsContact C-N 3.27Å; T317-L319 PolarHBondContact O-N 3.25Å; T317-L320 WeakPolarHBondContact O-CB 3.49Å; T317-L320 PolarHBondContact O-N 3.27Å; T317-L351 HydrophobicContact CG2-CB 4.24Å; T317-L351 HydrophobicContact CG2-CD1 4.25Å; T317-I354 HydrophobicContact CG2-CD1 3.66Å
318	P	96.5	Very high	95.4	Very high	83 Å²	83	38.7 Å²	38.7	54%	0.539	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-63	-28.9	178.4	-24.4	34.8	0	0	0	114.3	E314 L320 N321	E314-P318 WeakPolarHBondContact O-CD 3.45Å; P318-L320 PolarHBondContact O-N 3.19Å; P318-N321 PolarHBondContact O-N 3.44Å
319	L	96.2	Very high	95.4	Very high	20 Å²	20	39.3 Å²	39.3	11%	0.105	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-66.6	-24.4	-178.5	-55.8	-178.2	0	0	0	112.3	L277 A287 L316 T317 N321 C322 T331	L277-L319 HydrophobicContact CD2-CD1 3.95Å; A287-L319 HydrophobicContact CB-CD1 3.99Å; A287-L319 HydrophobicContact CB-CD2 3.87Å; L316-L319 HydrophobicContact CD2-CD1 3.78Å; L316-L319 WeakPolarHBondContact O-CB 3.39Å; L316-L319 PolarHBondContact O-N 2.93Å; T317-L319 VanDerWaalsContact C-N 3.27Å; T317-L319 PolarHBondContact O-N 3.25Å; L319-N321 PolarHBondContact O-N 3.41Å; L319-C322 PolarHBondContact O-N 2.87Å; L319-C322 PolarHBondContact O-SG 3.45Å; L319-T331 HydrophobicContact CB-CG2 4.11Å; L319-T331 HydrophobicContact CD1-CG2 4.49Å
320	L	97.2	Very high	95.4	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.005	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-68	-17.8	176.8	-66.1	-175.2	0	0	0	113.5	T317 P318 C322 Q328 T331 L332 L335 L351 I354 L355 L358	T317-L320 WeakPolarHBondContact O-CB 3.49Å; T317-L320 PolarHBondContact O-N 3.27Å; P318-L320 PolarHBondContact O-N 3.19Å; L320-C322 VanDerWaalsContact C-N 3.33Å; L320-Q328 PolarHBondContact O-NE2 2.97Å; L320-T331 HydrophobicContact CD2-CG2 3.56Å; L320-T331 HydrophobicContact CG-CG2 4.05Å; L320-L332 HydrophobicContact CD1-CD2 4.26Å; L320-L332 HydrophobicContact CD2-CD2 3.77Å; L320-L332 HydrophobicContact CD2-CG 3.69Å; L320-L335 HydrophobicContact CD1-CD1 3.65Å; L320-L335 HydrophobicContact CD2-CD1 4.2Å; L320-L335 HydrophobicContact CG-CD1 4.08Å; L320-L351 HydrophobicContact CD1-CD1 3.53Å; L320-I354 HydrophobicContact CB-CG2 3.61Å; L320-I354 HydrophobicContact CD1-CG2 4.12Å; L320-L355 HydrophobicContact CD1-CD2 4.06Å; L320-L358 HydrophobicContact CB-CD1 4.13Å; L320-L358 HydrophobicContact CD1-CD1 4.28Å; L320-L358 HydrophobicContact CD2-CD1 4.25Å; L320-L358 HydrophobicContact CG-CD1 4.47Å
321	N	95.3	Very high	95.6	Very high	105 Å²	105	32.9 Å²	32.9	56%	0.561	19%	0.187	S	C	*	.	G	3₁₀ helix	trans	-85.1	-3.3	177.4	-67.6	-41.9	0	0	0	113.5	P318 L319	P318-N321 PolarHBondContact O-N 3.44Å; L319-N321 PolarHBondContact O-N 3.41Å
322	C	91.1	Very high	95.6	Very high	29 Å²	29	32.4 Å²	32.4	20%	0.196	18%	0.182	C	C	.	.	S	Bend	trans	-71.7	157	178.6	77.5	0	0	0	0	111.8	L319 L320 N324 Q328	L319-C322 PolarHBondContact O-N 2.87Å; L319-C322 PolarHBondContact O-SG 3.45Å; L320-C322 VanDerWaalsContact C-N 3.33Å; C322-N324 VanDerWaalsContact C-N 3.27Å; C322-N324 PolarHBondContact SG-O 3.49Å; C322-Q328 PolarHBondContact O-NE2 3.49Å
323	T	91.2	Very high	95.4	Very high	142 Å²	142	35.5 Å²	35.5	87%	0.871	19%	0.194	S	C	*	.	S	Bend	trans	-82	-7	175.9	54.2	0	0	0	0	113.1	E325	T323-E325 PolarHBondContact O-N 3.26Å
324	N	93	Very high	95.2	Very high	21 Å²	21	35.5 Å²	35.5	11%	0.112	19%	0.194	C	C	.	.			trans	-84.4	99.1	-178.4	-173.6	-53.9	0	0	0	110	F16 M284 C322 V326 L327 Q328	F16-N324 WeakPolarHBondContact CE2-ND2 3.43Å; F16-N324 WeakPolarHBondContact CZ-ND2 3.26Å; M284-N324 HydrophobicContact SD-CB 4.31Å; C322-N324 VanDerWaalsContact C-N 3.27Å; C322-N324 PolarHBondContact SG-O 3.49Å; N324-V326 PolarHBondContact O-N 2.91Å; N324-V326 WeakPolarHBondContact OD1-CB 3.38Å; N324-V326 PolarHBondContact OD1-N 3.09Å; N324-V326 VanDerWaalsContact OD1-N 3.1Å; N324-L327 HydrophobicContact CB-CB 4.18Å; N324-L327 PolarHBondContact O-N 3.23Å; N324-L327 VanDerWaalsContact O-N 3.13Å; N324-L327 PolarHBondContact OD1-N 3.38Å; N324-Q328 PolarHBondContact O-N 3.37Å
325	E	94.9	Very high	95.2	Very high	86 Å²	86	32 Å²	32	40%	0.402	18%	0.178	S	C	.	.	H	α-helix	trans	-58.5	-31.2	-178.7	-67.5	-167.7	164.7	0	0	113.5	T323 Q328 L329 N363 I366	T323-E325 PolarHBondContact O-N 3.26Å; E325-Q328 PolarHBondContact O-N 3.45Å; E325-L329 VanDerWaalsContact O-CB 3.25Å; E325-L329 WeakPolarHBondContact O-CB 3.47Å; E325-L329 PolarHBondContact O-N 3.47Å; E325-N363 WeakPolarHBondContact OE2-CB 3.34Å; E325-N363 PolarHBondContact OE2-ND2 2.84Å; E325-I366 HydrophobicContact CB-CD1 3.84Å; E325-I366 HydrophobicContact CG-CD1 3.94Å
326	V	93.4	Very high	95.1	Very high	40 Å²	40	34.1 Å²	34.1	24%	0.242	18%	0.183	C	C	.	.	H	α-helix	trans	-66.4	-44.6	178	174.7	0	0	0	0	110.5	Y288 N324 L329 E330	Y288-V326 HydrophobicContact CD2-CG1 4.18Å; Y288-V326 HydrophobicContact CE2-CG1 3.5Å; Y288-V326 VanDerWaalsContact CE2-CG1 3.5Å; N324-V326 PolarHBondContact O-N 2.91Å; N324-V326 WeakPolarHBondContact OD1-CB 3.38Å; N324-V326 PolarHBondContact OD1-N 3.09Å; N324-V326 VanDerWaalsContact OD1-N 3.1Å; V326-L329 PolarHBondContact O-N 2.9Å; V326-E330 PolarHBondContact O-N 3.33Å; V326-E330 VanDerWaalsContact O-N 3.07Å
327	L	95.3	Very high	94.8	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.01	19%	0.189	C	C	.	.	H	α-helix	trans	-67.3	-42.7	174.6	176.3	58.4	0	0	0	111.7	M284 A287 N324 L329 E330 T331	M284-L327 HydrophobicContact CB-CD2 4.17Å; M284-L327 HydrophobicContact CG-CD2 4.1Å; A287-L327 HydrophobicContact CB-CD1 4.05Å; A287-L327 HydrophobicContact CB-CD2 4.2Å; N324-L327 HydrophobicContact CB-CB 4.18Å; N324-L327 PolarHBondContact O-N 3.23Å; N324-L327 VanDerWaalsContact O-N 3.13Å; N324-L327 PolarHBondContact OD1-N 3.38Å; L327-L329 VanDerWaalsContact C-N 3.31Å; L327-L329 PolarHBondContact O-N 3.19Å; L327-E330 PolarHBondContact O-N 3.12Å; L327-T331 VanDerWaalsContact O-CB 3.28Å; L327-T331 WeakPolarHBondContact O-CB 3.45Å; L327-T331 PolarHBondContact O-N 2.88Å; L327-T331 PolarHBondContact O-OG1 3.41Å
328	Q	96.8	Very high	94.7	Very high	20 Å²	20	34.6 Å²	34.6	9%	0.093	19%	0.185	C	C	.	.	H	α-helix	trans	-57.5	-46.5	175.6	-71.8	-179.8	-50.3	0	0	111	L320 C322 N324 E325 T331 L332 I366	L320-Q328 PolarHBondContact O-NE2 2.97Å; C322-Q328 PolarHBondContact O-NE2 3.49Å; N324-Q328 PolarHBondContact O-N 3.37Å; E325-Q328 PolarHBondContact O-N 3.45Å; Q328-T331 WeakPolarHBondContact O-CB 3.47Å; Q328-T331 PolarHBondContact O-N 2.9Å; Q328-L332 WeakPolarHBondContact O-CB 3.45Å; Q328-L332 VanDerWaalsContact O-CG 3.29Å; Q328-L332 WeakPolarHBondContact O-CG 3.3Å; Q328-L332 PolarHBondContact O-N 2.89Å; Q328-I366 HydrophobicContact CB-CD1 3.99Å
329	L	94.8	Very high	94.7	Very high	21 Å²	21	30.9 Å²	30.9	11%	0.11	16%	0.161	C	C	.	.	H	α-helix	trans	-65.9	-45.2	-178.3	-176.8	58.3	0	0	0	112.4	E325 V326 L327 T331 L332 W333 H365 I366	E325-L329 VanDerWaalsContact O-CB 3.25Å; E325-L329 WeakPolarHBondContact O-CB 3.47Å; E325-L329 PolarHBondContact O-N 3.47Å; V326-L329 PolarHBondContact O-N 2.9Å; L327-L329 VanDerWaalsContact C-N 3.31Å; L327-L329 PolarHBondContact O-N 3.19Å; L329-T331 VanDerWaalsContact C-N 3.29Å; L329-T331 PolarHBondContact O-N 3.21Å; L329-L332 PolarHBondContact O-N 3.4Å; L329-W333 HydrophobicContact CD1-CD2 4.4Å; L329-W333 HydrophobicContact CD1-CZ2 4.03Å; L329-W333 HydrophobicContact CD2-CH2 3.81Å; L329-W333 HydrophobicContact CD2-CZ2 3.7Å; L329-W333 HydrophobicContact CD2-CZ3 4.49Å; L329-W333 HydrophobicContact CG-CD2 4.21Å; L329-W333 HydrophobicContact CG-CE3 4.39Å; L329-W333 HydrophobicContact CG-CH2 3.97Å; L329-W333 HydrophobicContact CG-CZ2 3.73Å; L329-W333 HydrophobicContact CG-CZ3 4.28Å; L329-W333 PolarHBondContact O-N 2.97Å; L329-H365 HydrophobicContact CD1-CB 3.73Å; L329-H365 HydrophobicContact CD2-CB 3.98Å; L329-I366 HydrophobicContact CB-CG1 4.34Å; L329-I366 HydrophobicContact CD1-CG1 4.49Å
330	E	93.3	Very high	94.6	Very high	11 Å²	11	31.6 Å²	31.6	5%	0.051	17%	0.165	C	C	.	.	H	α-helix	trans	-60.7	-40.7	174.3	-77.7	-65.5	172.6	0	0	112.1	Y288 A291 R292 K295 V326 L327 W333 G334	Y288-E330 HydrophobicContact CD2-CB 4.37Å; Y288-E330 HydrophobicContact CD2-CG 3.93Å; Y288-E330 HydrophobicContact CE2-CB 4.39Å; Y288-E330 HydrophobicContact CE2-CG 3.48Å; Y288-E330 VanDerWaalsContact CE2-CG 3.48Å; A291-E330 HydrophobicContact CB-CB 3.97Å; R292-E330 HydrophobicContact CG-CG 4Å; R292-E330 WeakPolarHBondContact CG-OE2 3.25Å; K295-E330 WeakPolarHBondContact CD-OE2 3.43Å; K295-E330 VanDerWaalsContact CE-OE2 3.28Å; K295-E330 WeakPolarHBondContact CE-OE2 3.39Å; K295-E330 IonicContact NZ-OE1 3.55Å; K295-E330 PolarHBondContact NZ-OE1 2.89Å; K295-E330 IonicContact NZ-OE2 3.78Å; K295-E330 PolarHBondContact NZ-OE2 3.48Å; V326-E330 PolarHBondContact O-N 3.33Å; V326-E330 VanDerWaalsContact O-N 3.07Å; L327-E330 PolarHBondContact O-N 3.12Å; E330-W333 HydrophobicContact CG-CE3 4.37Å; E330-W333 HydrophobicContact CG-CZ3 4.4Å; E330-W333 PolarHBondContact O-N 2.94Å; E330-W333 VanDerWaalsContact OE1-CZ3 3.29Å; E330-W333 WeakPolarHBondContact OE1-CZ3 2.84Å; E330-G334 PolarHBondContact O-N 2.86Å
331	T	97.3	Very high	94.5	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-62	-44.7	175.6	-58.7	0	0	0	0	110.9	L316 L319 L320 L327 Q328 L329 G334 L335	L316-T331 HydrophobicContact CB-CG2 3.92Å; L316-T331 HydrophobicContact CD1-CG2 4.48Å; L316-T331 HydrophobicContact CD2-CG2 4.2Å; L316-T331 HydrophobicContact CG-CG2 4.42Å; L319-T331 HydrophobicContact CB-CG2 4.11Å; L319-T331 HydrophobicContact CD1-CG2 4.49Å; L320-T331 HydrophobicContact CD2-CG2 3.56Å; L320-T331 HydrophobicContact CG-CG2 4.05Å; L327-T331 VanDerWaalsContact O-CB 3.28Å; L327-T331 WeakPolarHBondContact O-CB 3.45Å; L327-T331 PolarHBondContact O-N 2.88Å; L327-T331 PolarHBondContact O-OG1 3.41Å; Q328-T331 WeakPolarHBondContact O-CB 3.47Å; Q328-T331 PolarHBondContact O-N 2.9Å; L329-T331 VanDerWaalsContact C-N 3.29Å; L329-T331 PolarHBondContact O-N 3.21Å; T331-G334 PolarHBondContact O-N 3.27Å; T331-L335 HydrophobicContact CG2-CD1 3.96Å; T331-L335 HydrophobicContact CG2-CG 4.48Å; T331-L335 WeakPolarHBondContact O-CB 3.36Å; T331-L335 WeakPolarHBondContact O-CG 3.25Å; T331-L335 PolarHBondContact O-N 3.35Å
332	L	97.5	Very high	94.6	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-65.7	-37.4	178.6	-76.8	171	0	0	0	112.7	L320 Q328 L329 L335 R336 L355 L358 I366 C369	L320-L332 HydrophobicContact CD1-CD2 4.26Å; L320-L332 HydrophobicContact CD2-CD2 3.77Å; L320-L332 HydrophobicContact CD2-CG 3.69Å; Q328-L332 WeakPolarHBondContact O-CB 3.45Å; Q328-L332 VanDerWaalsContact O-CG 3.29Å; Q328-L332 WeakPolarHBondContact O-CG 3.3Å; Q328-L332 PolarHBondContact O-N 2.89Å; L329-L332 PolarHBondContact O-N 3.4Å; L332-L335 PolarHBondContact O-N 3.3Å; L332-R336 WeakPolarHBondContact O-CB 3.3Å; L332-R336 PolarHBondContact O-N 3.19Å; L332-L355 HydrophobicContact CD2-CD2 3.67Å; L332-L358 HydrophobicContact CD1-CD1 4.35Å; L332-L358 HydrophobicContact CD2-CD1 4.36Å; L332-I366 HydrophobicContact CD1-CB 4.17Å; L332-I366 HydrophobicContact CD1-CG1 4.3Å; L332-I366 HydrophobicContact CD1-CG2 3.79Å; L332-C369 HydrophobicContact CB-CB 3.8Å; L332-C369 HydrophobicContact CD1-CB 4.25Å
333	W	92.6	Very high	94.7	Very high	65 Å²	65	31.4 Å²	31.4	25%	0.246	16%	0.155	C	C	.	.	H	α-helix	trans	-62.3	-43.9	174.5	-74.2	-29	0	0	0	111.9	K295 L329 E330 N337 C369	K295-W333 HydrophobicContact CD-CB 3.62Å; K295-W333 HydrophobicContact CD-CD2 4.09Å; K295-W333 HydrophobicContact CD-CE3 3.65Å; K295-W333 HydrophobicContact CD-CG 4.14Å; K295-W333 HydrophobicContact CG-CB 4.05Å; K295-W333 VanDerWaalsContact NZ-CE3 3.29Å; L329-W333 HydrophobicContact CD1-CD2 4.4Å; L329-W333 HydrophobicContact CD1-CZ2 4.03Å; L329-W333 HydrophobicContact CD2-CH2 3.81Å; L329-W333 HydrophobicContact CD2-CZ2 3.7Å; L329-W333 HydrophobicContact CD2-CZ3 4.49Å; L329-W333 HydrophobicContact CG-CD2 4.21Å; L329-W333 HydrophobicContact CG-CE3 4.39Å; L329-W333 HydrophobicContact CG-CH2 3.97Å; L329-W333 HydrophobicContact CG-CZ2 3.73Å; L329-W333 HydrophobicContact CG-CZ3 4.28Å; L329-W333 PolarHBondContact O-N 2.97Å; E330-W333 HydrophobicContact CG-CE3 4.37Å; E330-W333 HydrophobicContact CG-CZ3 4.4Å; E330-W333 PolarHBondContact O-N 2.94Å; E330-W333 VanDerWaalsContact OE1-CZ3 3.29Å; E330-W333 WeakPolarHBondContact OE1-CZ3 2.84Å; W333-N337 VanDerWaalsContact O-CG 3.27Å; W333-N337 PolarHBondContact O-N 3.13Å; W333-N337 PolarHBondContact O-OD1 3.3Å; W333-C369 VanDerWaalsContact CD1-SG 3.53Å
334	G	92.9	Very high	94.9	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-61.5	-49.3	173.2	0	0	0	0	0	112.4	E330 T331 R336 N337 I338	E330-G334 PolarHBondContact O-N 2.86Å; T331-G334 PolarHBondContact O-N 3.27Å; G334-R336 PolarHBondContact O-N 2.66Å; G334-N337 PolarHBondContact O-N 3.44Å; G334-I338 PolarHBondContact O-N 3.21Å
335	L	97.5	Very high	95	Very high	4 Å²	4	30.5 Å²	30.5	2%	0.021	14%	0.141	C	C	.	.	H	α-helix	trans	-61.7	-43	179.1	-80.1	172.3	0	0	0	112.7	V313 L316 L320 T331 L332 N337 I338 S339 L351	V313-L335 HydrophobicContact CG1-CD2 4.37Å; L316-L335 HydrophobicContact CB-CD1 4.22Å; L316-L335 HydrophobicContact CB-CD2 3.99Å; L316-L335 HydrophobicContact CB-CG 4.08Å; L316-L335 HydrophobicContact CD1-CD2 3.98Å; L316-L335 HydrophobicContact CD1-CG 3.85Å; L320-L335 HydrophobicContact CD1-CD1 3.65Å; L320-L335 HydrophobicContact CD2-CD1 4.2Å; L320-L335 HydrophobicContact CG-CD1 4.08Å; T331-L335 HydrophobicContact CG2-CD1 3.96Å; T331-L335 HydrophobicContact CG2-CG 4.48Å; T331-L335 WeakPolarHBondContact O-CB 3.36Å; T331-L335 WeakPolarHBondContact O-CG 3.25Å; T331-L335 PolarHBondContact O-N 3.35Å; L332-L335 PolarHBondContact O-N 3.3Å; L335-N337 VanDerWaalsContact C-N 3.25Å; L335-N337 PolarHBondContact O-N 3.28Å; L335-I338 HydrophobicContact CD2-CD1 4.35Å; L335-I338 WeakPolarHBondContact O-CG1 3.26Å; L335-I338 PolarHBondContact O-N 3.19Å; L335-S339 VanDerWaalsContact O-CB 3.25Å; L335-S339 WeakPolarHBondContact O-CB 3.41Å; L335-S339 PolarHBondContact O-N 2.99Å; L335-S339 PolarHBondContact O-OG 3.35Å; L335-L351 HydrophobicContact CD1-CD1 4.18Å; L335-L351 HydrophobicContact CD2-CD2 4.4Å
336	R	95.4	Very high	95	Very high	55 Å²	55	33.2 Å²	33.2	21%	0.208	16%	0.158	C	C	.	.	H	α-helix	trans	-61.6	-37.2	178.6	-170.5	-172.7	70	173.7	3.8	111.5	L332 G334 S339 C373 N376	L332-R336 WeakPolarHBondContact O-CB 3.3Å; L332-R336 PolarHBondContact O-N 3.19Å; G334-R336 PolarHBondContact O-N 2.66Å; R336-S339 PolarHBondContact O-OG 3.23Å; R336-C373 WeakPolarHBondContact CA-SG 3.39Å; R336-C373 PolarHBondContact N-SG 3.17Å; R336-C373 VanDerWaalsContact N-SG 3.44Å; R336-N376 PolarHBondContact O-ND2 2.91Å
337	N	90.9	Very high	95	Very high	22 Å²	22	32 Å²	32	12%	0.118	15%	0.152	C	C	.	.	H	α-helix	trans	-70.6	-31.5	179.1	-73.6	-3.9	0	0	0	112.7	K295 S298 K304 W333 G334 L335	K295-N337 PolarHBondContact O-ND2 3.08Å; S298-N337 VanDerWaalsContact CB-CB 3.5Å; S298-N337 WeakPolarHBondContact OG-CB 3.47Å; S298-N337 PolarHBondContact OG-ND2 3.45Å; K304-N337 WeakPolarHBondContact CD-O 3.48Å; K304-N337 WeakPolarHBondContact CE-O 3.43Å; K304-N337 PolarHBondContact NZ-O 3.43Å; W333-N337 VanDerWaalsContact O-CG 3.27Å; W333-N337 PolarHBondContact O-N 3.13Å; W333-N337 PolarHBondContact O-OD1 3.3Å; G334-N337 PolarHBondContact O-N 3.44Å; L335-N337 VanDerWaalsContact C-N 3.25Å; L335-N337 PolarHBondContact O-N 3.28Å
338	I	95.5	Very high	95.1	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-96.7	-11.2	-179.2	67.3	177	0	0	0	113.7	K304 L307 V308 T312 V313 G334 L335 D340 Q341 A342	K304-I338 HydrophobicContact CB-CG2 4.3Å; K304-I338 HydrophobicContact CG-CG2 4.27Å; L307-I338 HydrophobicContact CB-CG2 4.35Å; L307-I338 HydrophobicContact CD1-CG2 4.03Å; V308-I338 HydrophobicContact CG2-CB 4.08Å; V308-I338 HydrophobicContact CG2-CD1 4.47Å; T312-I338 HydrophobicContact CG2-CD1 4.07Å; V313-I338 HydrophobicContact CG2-CD1 3.74Å; V313-I338 HydrophobicContact CG2-CG1 4.36Å; G334-I338 PolarHBondContact O-N 3.21Å; L335-I338 HydrophobicContact CD2-CD1 4.35Å; L335-I338 WeakPolarHBondContact O-CG1 3.26Å; L335-I338 PolarHBondContact O-N 3.19Å; I338-D340 VanDerWaalsContact C-N 3.26Å; I338-D340 PolarHBondContact O-N 2.76Å; I338-Q341 PolarHBondContact O-N 3.21Å; I338-A342 PolarHBondContact O-N 3.07Å
339	S	96.7	Very high	95.1	Very high	4 Å²	4	38.1 Å²	38.1	3%	0.028	18%	0.178	C	C	.	.	H	α-helix	trans	-66.1	-24.5	-171.9	56.1	0	0	0	0	114.2	L335 R336 Q341 A342 N376	L335-S339 VanDerWaalsContact O-CB 3.25Å; L335-S339 WeakPolarHBondContact O-CB 3.41Å; L335-S339 PolarHBondContact O-N 2.99Å; L335-S339 PolarHBondContact O-OG 3.35Å; R336-S339 PolarHBondContact O-OG 3.23Å; S339-Q341 PolarHBondContact O-N 3.07Å; S339-A342 PolarHBondContact O-N 3.25Å; S339-A342 VanDerWaalsContact O-N 3.16Å; S339-N376 VanDerWaalsContact OG-CB 3.22Å; S339-N376 WeakPolarHBondContact OG-CB 3.35Å; S339-N376 PolarHBondContact OG-ND2 3.42Å
340	D	94.8	Very high	95.2	Very high	35 Å²	35	42.6 Å²	42.6	19%	0.187	20%	0.202	C	C	.	.	H	α-helix	trans	-66.7	-18.3	172.2	64.2	-56.6	0	0	0	112.9	K304 I338 Y343	K304-D340 VanDerWaalsContact NZ-CG 3.25Å; K304-D340 IonicContact NZ-OD1 3.11Å; K304-D340 PolarHBondContact NZ-OD1 2.69Å; K304-D340 IonicContact NZ-OD2 3.17Å; K304-D340 PolarHBondContact NZ-OD2 2.98Å; I338-D340 VanDerWaalsContact C-N 3.26Å; I338-D340 PolarHBondContact O-N 2.76Å; D340-Y343 WeakPolarHBondContact O-CD1 3.11Å; D340-Y343 WeakPolarHBondContact O-CE1 3.35Å
341	Q	95.3	Very high	95.4	Very high	53 Å²	53	42.2 Å²	42.2	25%	0.248	20%	0.201	C	C	.	.	H	α-helix	trans	-102.7	-10	173.9	-56.2	-54.7	-48	0	0	112.5	K304 I305 V308 I338 S339 H344	K304-Q341 HydrophobicContact CB-CB 4.48Å; K304-Q341 HydrophobicContact CB-CG 3.77Å; K304-Q341 HydrophobicContact CD-CG 4.16Å; I305-Q341 HydrophobicContact CG1-CG 4.2Å; V308-Q341 HydrophobicContact CG2-CB 3.97Å; I338-Q341 PolarHBondContact O-N 3.21Å; S339-Q341 PolarHBondContact O-N 3.07Å; Q341-H344 PolarHBondContact O-CE1 3.18Å; Q341-H344 PolarHBondContact O-ND1 3.03Å
342	A	96.3	Very high	95.5	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.008	20%	0.201	C	C	.	.	H	α-helix	trans	-100.8	-4.2	-172.8	0	0	0	0	0	114.8	V308 V313 I338 S339 H344 L345 T348 L377	V308-A342 HydrophobicContact CG1-CB 4.43Å; V308-A342 HydrophobicContact CG2-CB 4.13Å; V313-A342 HydrophobicContact CG2-CB 3.76Å; I338-A342 PolarHBondContact O-N 3.07Å; S339-A342 PolarHBondContact O-N 3.25Å; S339-A342 VanDerWaalsContact O-N 3.16Å; A342-H344 PolarHBondContact O-N 3.08Å; A342-L345 HydrophobicContact CB-CD1 4.21Å; A342-L345 WeakPolarHBondContact O-CB 3.31Å; A342-L345 PolarHBondContact O-N 2.81Å; A342-T348 WeakPolarHBondContact O-CG2 2.89Å; A342-L377 HydrophobicContact CB-CD2 4.04Å
343	Y	92.8	Very high	95.5	Very high	77 Å²	77	44.3 Å²	44.3	30%	0.302	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-24	-171.6	66.4	-90	0	0	0	113.9	D340 N381 N384	D340-Y343 WeakPolarHBondContact O-CD1 3.11Å; D340-Y343 WeakPolarHBondContact O-CE1 3.35Å; Y343-N381 HydrophobicContact CD2-CB 4.49Å; Y343-N381 WeakPolarHBondContact O-CB 3.13Å; Y343-N381 PolarHBondContact O-ND2 3.11Å; Y343-N384 PolarHBondContact O-ND2 2.95Å
344	H	95.4	Very high	95.8	Very high	113 Å²	113	42.2 Å²	42.2	52%	0.523	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-7.9	-178.7	62.8	-89.6	0	0	0	114.3	Q341 A342	Q341-H344 PolarHBondContact O-CE1 3.18Å; Q341-H344 PolarHBondContact O-ND1 3.03Å; A342-H344 PolarHBondContact O-N 3.08Å
345	L	95.4	Very high	96.1	Very high	31 Å²	31	42.2 Å²	42.2	16%	0.162	21%	0.208	C	C	.	.			trans	-73.6	141.1	-175.2	-65.3	-175	0	0	0	112.4	V308 V313 A342 A347 T348	V308-L345 HydrophobicContact CG1-CD1 3.75Å; V308-L345 HydrophobicContact CG1-CD2 4.2Å; V308-L345 HydrophobicContact CG1-CG 4.11Å; V313-L345 HydrophobicContact CB-CD1 4.12Å; V313-L345 HydrophobicContact CG2-CD1 4.03Å; A342-L345 HydrophobicContact CB-CD1 4.21Å; A342-L345 WeakPolarHBondContact O-CB 3.31Å; A342-L345 PolarHBondContact O-N 2.81Å; L345-A347 HydrophobicContact CB-CB 4.39Å; L345-A347 PolarHBondContact O-N 2.84Å; L345-T348 HydrophobicContact CB-CG2 4.31Å; L345-T348 WeakPolarHBondContact O-CG2 3.46Å; L345-T348 PolarHBondContact O-N 2.77Å; L345-T348 PolarHBondContact O-OG1 2.88Å
346	L	95	Very high	96.1	Very high	144 Å²	144	42.7 Å²	42.7	75%	0.754	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-27.3	170.5	-68.5	174.5	0	0	0	112.6	T348 K349	L346-T348 PolarHBondContact O-N 3.34Å; L346-K349 WeakPolarHBondContact O-CB 3.39Å; L346-K349 PolarHBondContact O-N 3.47Å
347	A	93.7	Very high	96.2	Very high	15 Å²	15	43.6 Å²	43.6	12%	0.124	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-23	179.4	0	0	0	0	0	114.3	E314 L345 K349 N350	E314-A347 HydrophobicContact CG-CB 3.45Å; E314-A347 VanDerWaalsContact CG-CB 3.45Å; E314-A347 WeakPolarHBondContact OE1-CB 3.36Å; L345-A347 HydrophobicContact CB-CB 4.39Å; L345-A347 PolarHBondContact O-N 2.84Å; A347-K349 PolarHBondContact O-N 3.25Å; A347-K349 VanDerWaalsContact O-N 3.09Å; A347-N350 PolarHBondContact O-N 3.49Å; A347-N350 VanDerWaalsContact O-N 3.11Å
348	T	96.2	Very high	96.6	Very high	3 Å²	3	43.2 Å²	43.2	2%	0.018	22%	0.223	C	C	.	.	H	α-helix	trans	-59.7	-22.7	177.4	59.1	0	0	0	0	112.2	A342 L345 L346 N350 L351 I352 L377 N384	A342-T348 WeakPolarHBondContact O-CG2 2.89Å; L345-T348 HydrophobicContact CB-CG2 4.31Å; L345-T348 WeakPolarHBondContact O-CG2 3.46Å; L345-T348 PolarHBondContact O-N 2.77Å; L345-T348 PolarHBondContact O-OG1 2.88Å; L346-T348 PolarHBondContact O-N 3.34Å; T348-N350 PolarHBondContact O-N 3.27Å; T348-L351 PolarHBondContact O-N 3.13Å; T348-L351 VanDerWaalsContact O-N 3.11Å; T348-I352 WeakPolarHBondContact O-CG1 3.47Å; T348-I352 PolarHBondContact O-N 3.33Å; T348-L377 HydrophobicContact CG2-CD2 3.8Å; T348-N384 PolarHBondContact OG1-OD1 3.41Å
349	K	97.1	Very high	96.6	Very high	146 Å²	146	43.5 Å²	43.5	64%	0.635	22%	0.224	S	C	*	.	H	α-helix	trans	-56.8	-34.3	175.6	-171.5	178	-179.2	179.8	0	113.1	L346 A347 P353 L387	L346-K349 WeakPolarHBondContact O-CB 3.39Å; L346-K349 PolarHBondContact O-N 3.47Å; A347-K349 PolarHBondContact O-N 3.25Å; A347-K349 VanDerWaalsContact O-N 3.09Å; K349-P353 WeakPolarHBondContact O-CD 3.15Å; K349-L387 HydrophobicContact CB-CD2 4.44Å; K349-L387 HydrophobicContact CG-CD2 4.18Å
350	N	97.5	Very high	96.5	Very high	115 Å²	115	46.8 Å²	46.8	62%	0.615	25%	0.251	S	S	*	.	H	α-helix	trans	-87.3	-29.9	177.1	-64.6	-28.4	0	0	0	112	A347 T348	A347-N350 PolarHBondContact O-N 3.49Å; A347-N350 VanDerWaalsContact O-N 3.11Å; T348-N350 PolarHBondContact O-N 3.27Å
351	L	98.3	Very high	96.6	Very high	4 Å²	4	46.5 Å²	46.5	2%	0.021	25%	0.252	C	S	.	.	H	α-helix	trans	-75.8	-43.9	-177.7	177.1	58.6	0	0	0	112.9	V313 T317 L320 L335 T348 I354 L355 L377	V313-L351 HydrophobicContact CG1-CD2 3.76Å; T317-L351 HydrophobicContact CG2-CB 4.24Å; T317-L351 HydrophobicContact CG2-CD1 4.25Å; L320-L351 HydrophobicContact CD1-CD1 3.53Å; L335-L351 HydrophobicContact CD1-CD1 4.18Å; L335-L351 HydrophobicContact CD2-CD2 4.4Å; T348-L351 PolarHBondContact O-N 3.13Å; T348-L351 VanDerWaalsContact O-N 3.11Å; L351-I354 WeakPolarHBondContact O-CB 3.11Å; L351-I354 PolarHBondContact O-N 2.98Å; L351-I354 VanDerWaalsContact O-N 3.11Å; L351-L355 HydrophobicContact CD1-CD1 4.07Å; L351-L355 HydrophobicContact CD1-CD2 4.15Å; L351-L355 HydrophobicContact CD1-CG 3.82Å; L351-L355 HydrophobicContact CD2-CD1 4.23Å; L351-L355 HydrophobicContact CG-CD1 3.73Å; L351-L355 HydrophobicContact CG-CG 3.99Å; L351-L355 WeakPolarHBondContact O-CG 3.46Å; L351-L355 PolarHBondContact O-N 2.96Å; L351-L377 HydrophobicContact CD2-CD1 3.8Å; L351-L377 HydrophobicContact CG-CD1 4.33Å
352	I	98.5	Very high	96.5	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-56.9	-47.3	-174.5	-73.8	168.9	0	0	0	112.7	T348 I354 L355 I356 L374 L377 N384 L387 L388	T348-I352 WeakPolarHBondContact O-CG1 3.47Å; T348-I352 PolarHBondContact O-N 3.33Å; I352-I354 VanDerWaalsContact C-N 3.27Å; I352-I354 PolarHBondContact O-N 3.16Å; I352-L355 PolarHBondContact O-N 3.49Å; I352-I356 HydrophobicContact CG2-CD1 3.76Å; I352-I356 HydrophobicContact CG2-CG1 4.4Å; I352-I356 WeakPolarHBondContact O-CG1 3.18Å; I352-I356 PolarHBondContact O-N 2.58Å; I352-L374 HydrophobicContact CB-CD2 4.43Å; I352-L374 HydrophobicContact CG1-CD2 4.2Å; I352-L374 HydrophobicContact CG2-CD2 4.09Å; I352-L377 HydrophobicContact CG1-CD1 4.36Å; I352-N384 HydrophobicContact CD1-CB 3.51Å; I352-N384 VanDerWaalsContact CD1-CG 3.47Å; I352-N384 WeakPolarHBondContact CD1-OD1 3.41Å; I352-L387 HydrophobicContact CB-CD2 3.97Å; I352-L387 HydrophobicContact CB-CG 4.46Å; I352-L387 HydrophobicContact CD1-CD2 4.23Å; I352-L387 HydrophobicContact CG2-CD2 4.13Å; I352-L387 HydrophobicContact CG2-CG 4.05Å; I352-L388 HydrophobicContact CG2-CB 4.47Å
353	P	98.3	Very high	96.4	Very high	43 Å²	43	55.7 Å²	55.7	28%	0.279	29%	0.293	S	S	.	.	H	α-helix	trans	-58.9	-37.7	177.1	-25	34.7	0	0	0	113.3	K349 I356 S357 K391	K349-P353 WeakPolarHBondContact O-CD 3.15Å; P353-I356 PolarHBondContact O-N 3.2Å; P353-S357 PolarHBondContact O-N 3.14Å; P353-S357 VanDerWaalsContact O-N 3.14Å; P353-K391 HydrophobicContact CG-CG 4.41Å
354	I	98.5	Very high	96.4	Very high	22 Å²	22	55.4 Å²	55.4	11%	0.113	30%	0.295	C	S	.	.	H	α-helix	trans	-67.4	-47	177.5	-61	169.1	0	0	0	109.8	T317 L320 L351 I352 I356 S357 L358	T317-I354 HydrophobicContact CG2-CD1 3.66Å; L320-I354 HydrophobicContact CB-CG2 3.61Å; L320-I354 HydrophobicContact CD1-CG2 4.12Å; L351-I354 WeakPolarHBondContact O-CB 3.11Å; L351-I354 PolarHBondContact O-N 2.98Å; L351-I354 VanDerWaalsContact O-N 3.11Å; I352-I354 VanDerWaalsContact C-N 3.27Å; I352-I354 PolarHBondContact O-N 3.16Å; I354-I356 VanDerWaalsContact C-N 3.28Å; I354-I356 PolarHBondContact O-N 2.91Å; I354-S357 WeakPolarHBondContact O-CB 3.46Å; I354-S357 PolarHBondContact O-N 2.88Å; I354-S357 VanDerWaalsContact O-N 3.09Å; I354-S357 PolarHBondContact O-OG 3.19Å; I354-L358 HydrophobicContact CG2-CD1 4.15Å; I354-L358 HydrophobicContact CG2-CG 4.49Å; I354-L358 WeakPolarHBondContact O-CG 3.22Å; I354-L358 PolarHBondContact O-N 3.21Å
355	L	98.6	Very high	96.3	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-58.6	-39.7	176.7	-67.7	175.5	0	0	0	112.3	L320 L332 L351 I352 S357 L358 L359 C373 L374 L377	L320-L355 HydrophobicContact CD1-CD2 4.06Å; L332-L355 HydrophobicContact CD2-CD2 3.67Å; L351-L355 HydrophobicContact CD1-CD1 4.07Å; L351-L355 HydrophobicContact CD1-CD2 4.15Å; L351-L355 HydrophobicContact CD1-CG 3.82Å; L351-L355 HydrophobicContact CD2-CD1 4.23Å; L351-L355 HydrophobicContact CG-CD1 3.73Å; L351-L355 HydrophobicContact CG-CG 3.99Å; L351-L355 WeakPolarHBondContact O-CG 3.46Å; L351-L355 PolarHBondContact O-N 2.96Å; I352-L355 PolarHBondContact O-N 3.49Å; L355-S357 VanDerWaalsContact C-N 3.35Å; L355-S357 PolarHBondContact O-N 3.45Å; L355-L358 PolarHBondContact O-N 2.74Å; L355-L359 PolarHBondContact O-N 3.36Å; L355-L359 VanDerWaalsContact O-N 3.13Å; L355-C373 HydrophobicContact CD1-CB 3.63Å; L355-C373 HydrophobicContact CD2-CB 3.99Å; L355-C373 HydrophobicContact CG-CB 4.46Å; L355-L374 HydrophobicContact CB-CD1 4.17Å; L355-L374 HydrophobicContact CB-CD2 3.77Å; L355-L374 HydrophobicContact CB-CG 3.85Å; L355-L374 HydrophobicContact CD1-CD2 3.9Å; L355-L374 HydrophobicContact CD1-CG 4.13Å; L355-L377 HydrophobicContact CD1-CD1 3.72Å
356	I	98.5	Very high	96.4	Very high	14 Å²	14	53.6 Å²	53.6	7%	0.072	29%	0.285	C	S	.	.	H	α-helix	trans	-61.8	-42.8	175.7	-69.3	166.6	0	0	0	111	I352 P353 I354 L358 L359 L374 L388 K391	I352-I356 HydrophobicContact CG2-CD1 3.76Å; I352-I356 HydrophobicContact CG2-CG1 4.4Å; I352-I356 WeakPolarHBondContact O-CG1 3.18Å; I352-I356 PolarHBondContact O-N 2.58Å; P353-I356 PolarHBondContact O-N 3.2Å; I354-I356 VanDerWaalsContact C-N 3.28Å; I354-I356 PolarHBondContact O-N 2.91Å; I356-L358 VanDerWaalsContact C-N 3.27Å; I356-L358 PolarHBondContact O-N 3.46Å; I356-L359 WeakPolarHBondContact O-CB 3.06Å; I356-L359 PolarHBondContact O-N 3.31Å; I356-L374 HydrophobicContact CG1-CD1 4.12Å; I356-L374 HydrophobicContact CG1-CD2 4.44Å; I356-L388 HydrophobicContact CD1-CG 4.26Å; I356-K391 HydrophobicContact CD1-CB 3.59Å
357	S	97.6	Very high	96.4	Very high	74 Å²	74	47 Å²	47	52%	0.517	25%	0.251	S	S	.	.	H	α-helix	trans	-61.6	-37.5	176.1	78.5	0	0	0	0	112.2	P353 I354 L355 L359 A360	P353-S357 PolarHBondContact O-N 3.14Å; P353-S357 VanDerWaalsContact O-N 3.14Å; I354-S357 WeakPolarHBondContact O-CB 3.46Å; I354-S357 PolarHBondContact O-N 2.88Å; I354-S357 VanDerWaalsContact O-N 3.09Å; I354-S357 PolarHBondContact O-OG 3.19Å; L355-S357 VanDerWaalsContact C-N 3.35Å; L355-S357 PolarHBondContact O-N 3.45Å; S357-L359 VanDerWaalsContact C-N 3.32Å; S357-L359 PolarHBondContact O-N 3.08Å; S357-A360 PolarHBondContact O-N 3.31Å
358	L	97.8	Very high	96.4	Very high	14 Å²	14	47.4 Å²	47.4	7%	0.073	25%	0.251	C	S	.	.	H	α-helix	trans	-74.7	-18	-179.5	-66.9	175.9	0	0	0	113.5	L320 L332 I354 L355 I356 A360 S361 I366 S367 S370	L320-L358 HydrophobicContact CB-CD1 4.13Å; L320-L358 HydrophobicContact CD1-CD1 4.28Å; L320-L358 HydrophobicContact CD2-CD1 4.25Å; L320-L358 HydrophobicContact CG-CD1 4.47Å; L332-L358 HydrophobicContact CD1-CD1 4.35Å; L332-L358 HydrophobicContact CD2-CD1 4.36Å; I354-L358 HydrophobicContact CG2-CD1 4.15Å; I354-L358 HydrophobicContact CG2-CG 4.49Å; I354-L358 WeakPolarHBondContact O-CG 3.22Å; I354-L358 PolarHBondContact O-N 3.21Å; L355-L358 PolarHBondContact O-N 2.74Å; I356-L358 VanDerWaalsContact C-N 3.27Å; I356-L358 PolarHBondContact O-N 3.46Å; L358-A360 PolarHBondContact O-N 3.24Å; L358-S361 WeakPolarHBondContact O-CB 3.24Å; L358-S361 PolarHBondContact O-N 2.73Å; L358-I366 HydrophobicContact CB-CG2 3.99Å; L358-I366 HydrophobicContact CD2-CG2 3.97Å; L358-I366 HydrophobicContact CG-CG2 4.4Å; L358-S367 WeakPolarHBondContact O-CA 3.44Å; L358-S370 VanDerWaalsContact CB-OG 3.22Å; L358-S370 WeakPolarHBondContact CB-OG 3.46Å
359	L	97.2	Very high	96.3	Very high	6 Å²	6	47.5 Å²	47.5	3%	0.031	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-26.5	170.8	-67.2	176.5	0	0	0	112.4	L355 I356 S357 S361 S367 A371 L374 V396 L397 L400	L355-L359 PolarHBondContact O-N 3.36Å; L355-L359 VanDerWaalsContact O-N 3.13Å; I356-L359 WeakPolarHBondContact O-CB 3.06Å; I356-L359 PolarHBondContact O-N 3.31Å; S357-L359 VanDerWaalsContact C-N 3.32Å; S357-L359 PolarHBondContact O-N 3.08Å; L359-S361 VanDerWaalsContact C-N 3.34Å; L359-S367 VanDerWaalsContact O-CB 3.28Å; L359-S367 WeakPolarHBondContact O-CB 3.25Å; L359-A371 HydrophobicContact CD2-CB 3.73Å; L359-L374 HydrophobicContact CD1-CD1 3.67Å; L359-L374 HydrophobicContact CD2-CD1 4.1Å; L359-L374 HydrophobicContact CG-CD1 3.99Å; L359-V396 HydrophobicContact CB-CB 4.4Å; L359-V396 HydrophobicContact CB-CG1 3.49Å; L359-V396 VanDerWaalsContact CB-CG1 3.49Å; L359-V396 HydrophobicContact CD1-CB 4.15Å; L359-V396 HydrophobicContact CD1-CG1 4.12Å; L359-V396 HydrophobicContact CG-CG1 4.48Å; L359-L397 HydrophobicContact CD1-CD2 3.85Å; L359-L397 HydrophobicContact CD1-CG 3.88Å; L359-L397 HydrophobicContact CD2-CD2 4.11Å; L359-L400 HydrophobicContact CD2-CD2 3.99Å
360	A	94.5	Very high	96.4	Very high	72 Å²	72	40.6 Å²	40.6	60%	0.595	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.1	8.2	177.9	0	0	0	0	0	113.7	S357 L358	S357-A360 PolarHBondContact O-N 3.31Å; L358-A360 PolarHBondContact O-N 3.24Å
361	S	95.4	Very high	96.4	Very high	30 Å²	30	35.1 Å²	35.1	21%	0.21	19%	0.193	C	C	.	.			trans	-58.5	142.1	177.7	-176.7	0	0	0	0	111.8	L358 L359 N363	L358-S361 WeakPolarHBondContact O-CB 3.24Å; L358-S361 PolarHBondContact O-N 2.73Å; L359-S361 VanDerWaalsContact C-N 3.34Å; S361-N363 PolarHBondContact OG-N 3.38Å; S361-N363 VanDerWaalsContact OG-N 3.09Å; S361-N363 PolarHBondContact OG-O 2.86Å
362	K	94.1	Very high	96.3	Very high	210 Å²	210	35.4 Å²	35.4	91%	0.913	20%	0.196	S	C	*	.	S	Bend	trans	-70	-26	170	-66	-176.8	-178.7	178.2	0	111.6	E364	K362-E364 PolarHBondContact O-N 3.48Å
363	N	94	Very high	96.3	Very high	37 Å²	37	35.4 Å²	35.4	20%	0.198	20%	0.196	C	C	.	.	S	Bend	trans	-79.3	107.3	171.9	-172.2	-39	0	0	0	108.9	E325 S361 H365 I366 S367	E325-N363 WeakPolarHBondContact OE2-CB 3.34Å; E325-N363 PolarHBondContact OE2-ND2 2.84Å; S361-N363 PolarHBondContact OG-N 3.38Å; S361-N363 VanDerWaalsContact OG-N 3.09Å; S361-N363 PolarHBondContact OG-O 2.86Å; N363-H365 VanDerWaalsContact C-N 3.26Å; N363-H365 PolarHBondContact O-N 2.89Å; N363-H365 WeakPolarHBondContact OD1-CB 3.3Å; N363-H365 PolarHBondContact OD1-N 2.76Å; N363-H365 VanDerWaalsContact OD1-N 3.11Å; N363-I366 HydrophobicContact CB-CB 4.25Å; N363-I366 HydrophobicContact CB-CD1 3.98Å; N363-I366 HydrophobicContact CB-CG1 4.1Å; N363-I366 WeakPolarHBondContact O-CB 3.33Å; N363-I366 PolarHBondContact O-N 2.89Å; N363-I366 VanDerWaalsContact O-N 3.08Å; N363-S367 PolarHBondContact O-N 3.47Å
364	E	93.7	Very high	96.3	Very high	71 Å²	71	33.4 Å²	33.4	33%	0.332	18%	0.183	S	C	.	.	H	α-helix	trans	-59.3	-35.7	-176	-162.1	-159.1	106.5	0	0	113	K362 I366 S367 I368 R407	K362-E364 PolarHBondContact O-N 3.48Å; E364-I366 VanDerWaalsContact C-N 3.28Å; E364-I366 PolarHBondContact O-N 2.92Å; E364-S367 WeakPolarHBondContact CA-OG 3.41Å; E364-S367 PolarHBondContact O-N 3.12Å; E364-S367 PolarHBondContact O-OG 2.82Å; E364-I368 HydrophobicContact CG-CD1 3.7Å; E364-I368 HydrophobicContact CG-CG1 4.34Å; E364-I368 WeakPolarHBondContact O-CB 3.28Å; E364-I368 WeakPolarHBondContact O-CD1 3.37Å; E364-I368 WeakPolarHBondContact O-CG1 3.33Å; E364-I368 PolarHBondContact O-N 3.08Å; E364-I368 WeakPolarHBondContact OE1-CD1 3.1Å; E364-R407 IonicContact OE1-CZ 2.83Å; E364-R407 IonicContact OE1-NH1 3.36Å; E364-R407 PolarHBondContact OE1-NH1 2.87Å; E364-R407 IonicContact OE1-NH2 3.97Å; E364-R407 PolarHBondContact OE1-NH2 3.43Å; E364-R407 VanDerWaalsContact OE1-NH2 3.11Å; E364-R407 IonicContact OE2-CZ 2.68Å; E364-R407 IonicContact OE2-NH1 3.82Å; E364-R407 PolarHBondContact OE2-NH1 3.35Å; E364-R407 VanDerWaalsContact OE2-NH1 3.08Å; E364-R407 IonicContact OE2-NH2 2.63Å; E364-R407 PolarHBondContact OE2-NH2 2.88Å
365	H	92.3	Very high	96.3	Very high	106 Å²	106	32.9 Å²	32.9	49%	0.491	18%	0.181	S	C	.	.	H	α-helix	trans	-65	-34.9	178.4	-65.1	-58	0	0	0	112	L329 N363 C369	L329-H365 HydrophobicContact CD1-CB 3.73Å; L329-H365 HydrophobicContact CD2-CB 3.98Å; N363-H365 VanDerWaalsContact C-N 3.26Å; N363-H365 PolarHBondContact O-N 2.89Å; N363-H365 WeakPolarHBondContact OD1-CB 3.3Å; N363-H365 PolarHBondContact OD1-N 2.76Å; N363-H365 VanDerWaalsContact OD1-N 3.11Å; H365-C369 WeakPolarHBondContact O-CB 3.48Å; H365-C369 PolarHBondContact O-N 3.38Å; H365-C369 PolarHBondContact O-SG 3.17Å
366	I	96.7	Very high	96.2	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-66.2	-47.4	174.9	-69.9	-178.2	0	0	0	110.4	E325 Q328 L329 L332 L358 N363 E364 C369 S370	E325-I366 HydrophobicContact CB-CD1 3.84Å; E325-I366 HydrophobicContact CG-CD1 3.94Å; Q328-I366 HydrophobicContact CB-CD1 3.99Å; L329-I366 HydrophobicContact CB-CG1 4.34Å; L329-I366 HydrophobicContact CD1-CG1 4.49Å; L332-I366 HydrophobicContact CD1-CB 4.17Å; L332-I366 HydrophobicContact CD1-CG1 4.3Å; L332-I366 HydrophobicContact CD1-CG2 3.79Å; L358-I366 HydrophobicContact CB-CG2 3.99Å; L358-I366 HydrophobicContact CD2-CG2 3.97Å; L358-I366 HydrophobicContact CG-CG2 4.4Å; N363-I366 HydrophobicContact CB-CB 4.25Å; N363-I366 HydrophobicContact CB-CD1 3.98Å; N363-I366 HydrophobicContact CB-CG1 4.1Å; N363-I366 WeakPolarHBondContact O-CB 3.33Å; N363-I366 PolarHBondContact O-N 2.89Å; N363-I366 VanDerWaalsContact O-N 3.08Å; E364-I366 VanDerWaalsContact C-N 3.28Å; E364-I366 PolarHBondContact O-N 2.92Å; I366-C369 PolarHBondContact O-N 3.34Å; I366-S370 WeakPolarHBondContact O-CB 3.48Å; I366-S370 PolarHBondContact O-N 3.15Å; I366-S370 PolarHBondContact O-OG 3.37Å
367	S	96.7	Very high	96.2	Very high	4 Å²	4	34 Å²	34	3%	0.028	19%	0.187	C	C	.	.	H	α-helix	trans	-65.3	-42.2	-178.8	59.2	0	0	0	0	112	L358 L359 N363 E364 S370 A371	L358-S367 WeakPolarHBondContact O-CA 3.44Å; L359-S367 VanDerWaalsContact O-CB 3.28Å; L359-S367 WeakPolarHBondContact O-CB 3.25Å; N363-S367 PolarHBondContact O-N 3.47Å; E364-S367 WeakPolarHBondContact CA-OG 3.41Å; E364-S367 PolarHBondContact O-N 3.12Å; E364-S367 PolarHBondContact O-OG 2.82Å; S367-S370 PolarHBondContact O-N 2.77Å; S367-A371 PolarHBondContact O-N 3.48Å
368	I	92.7	Very high	96.2	Very high	25 Å²	25	30.5 Å²	30.5	13%	0.128	16%	0.163	C	C	.	.	H	α-helix	trans	-64	-47	176.8	-66.3	162.5	0	0	0	111.6	E364 S370 A371 G372 I410	E364-I368 HydrophobicContact CG-CD1 3.7Å; E364-I368 HydrophobicContact CG-CG1 4.34Å; E364-I368 WeakPolarHBondContact O-CB 3.28Å; E364-I368 WeakPolarHBondContact O-CD1 3.37Å; E364-I368 WeakPolarHBondContact O-CG1 3.33Å; E364-I368 PolarHBondContact O-N 3.08Å; E364-I368 WeakPolarHBondContact OE1-CD1 3.1Å; I368-S370 VanDerWaalsContact C-N 3.26Å; I368-S370 PolarHBondContact O-N 2.95Å; I368-A371 PolarHBondContact O-N 2.8Å; I368-G372 PolarHBondContact O-N 3.2Å; I368-I410 HydrophobicContact CD1-CD1 3.31Å; I368-I410 HydrophobicContact CD1-CG1 3.66Å; I368-I410 HydrophobicContact CD1-CG2 4.42Å; I368-I410 HydrophobicContact CG1-CD1 4.01Å; I368-I410 HydrophobicContact CG1-CG1 3.93Å; I368-I410 HydrophobicContact CG1-CG2 3.89Å; I368-I410 HydrophobicContact CG2-CG1 4.05Å
369	C	95.3	Very high	96	Very high	5 Å²	5	31.5 Å²	31.5	3%	0.034	17%	0.171	C	C	.	.	H	α-helix	trans	-65.5	-34.7	179.5	-66.8	0	0	0	0	111.5	L332 W333 H365 I366 G372 C373	L332-C369 HydrophobicContact CB-CB 3.8Å; L332-C369 HydrophobicContact CD1-CB 4.25Å; W333-C369 VanDerWaalsContact CD1-SG 3.53Å; H365-C369 WeakPolarHBondContact O-CB 3.48Å; H365-C369 PolarHBondContact O-N 3.38Å; H365-C369 PolarHBondContact O-SG 3.17Å; I366-C369 PolarHBondContact O-N 3.34Å; C369-G372 PolarHBondContact O-N 3.27Å; C369-C373 PolarHBondContact O-N 3.27Å; C369-C373 PolarHBondContact O-SG 3.3Å
370	S	98.1	Very high	95.5	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-64.4	-42.9	174.3	-58	0	0	0	0	111.6	L358 I366 S367 I368 G372 C373 L374	L358-S370 VanDerWaalsContact CB-OG 3.22Å; L358-S370 WeakPolarHBondContact CB-OG 3.46Å; I366-S370 WeakPolarHBondContact O-CB 3.48Å; I366-S370 PolarHBondContact O-N 3.15Å; I366-S370 PolarHBondContact O-OG 3.37Å; S367-S370 PolarHBondContact O-N 2.77Å; I368-S370 VanDerWaalsContact C-N 3.26Å; I368-S370 PolarHBondContact O-N 2.95Å; S370-G372 PolarHBondContact O-N 3.12Å; S370-C373 WeakPolarHBondContact O-CB 3.16Å; S370-C373 PolarHBondContact O-N 3.27Å; S370-L374 WeakPolarHBondContact O-CG 3.42Å; S370-L374 PolarHBondContact O-N 2.67Å
371	A	97.7	Very high	95.6	Very high	1 Å²	1	35 Å²	35	1%	0.008	18%	0.175	C	C	.	.	H	α-helix	trans	-61.2	-43.5	173.8	0	0	0	0	0	112.1	L359 S367 I368 C373 L374 C375 L397 L400 I414	L359-A371 HydrophobicContact CD2-CB 3.73Å; S367-A371 PolarHBondContact O-N 3.48Å; I368-A371 PolarHBondContact O-N 2.8Å; A371-C373 VanDerWaalsContact C-N 3.34Å; A371-C373 PolarHBondContact O-N 2.9Å; A371-L374 PolarHBondContact O-N 3.3Å; A371-C375 WeakPolarHBondContact O-CB 3.42Å; A371-C375 PolarHBondContact O-N 3.09Å; A371-L397 HydrophobicContact CB-CD2 4.26Å; A371-L400 HydrophobicContact CB-CD2 3.88Å; A371-I414 HydrophobicContact CB-CG1 3.99Å
372	G	95.8	Very high	95.6	Very high	9 Å²	9	37 Å²	37	9%	0.093	19%	0.186	C	C	.	.	H	α-helix	trans	-61.2	-40	174.8	0	0	0	0	0	113.1	I368 C369 S370 C375 N376	I368-G372 PolarHBondContact O-N 3.2Å; C369-G372 PolarHBondContact O-N 3.27Å; S370-G372 PolarHBondContact O-N 3.12Å; G372-C375 PolarHBondContact O-N 3.25Å; G372-N376 PolarHBondContact O-N 3.39Å
373	C	97.9	Very high	95.8	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.007	17%	0.171	C	C	.	.	H	α-helix	trans	-62.5	-48.8	173.5	-65.8	0	0	0	0	111.5	R336 L355 C369 S370 A371 C375 N376 L377	R336-C373 WeakPolarHBondContact CA-SG 3.39Å; R336-C373 PolarHBondContact N-SG 3.17Å; R336-C373 VanDerWaalsContact N-SG 3.44Å; L355-C373 HydrophobicContact CD1-CB 3.63Å; L355-C373 HydrophobicContact CD2-CB 3.99Å; L355-C373 HydrophobicContact CG-CB 4.46Å; C369-C373 PolarHBondContact O-N 3.27Å; C369-C373 PolarHBondContact O-SG 3.3Å; S370-C373 WeakPolarHBondContact O-CB 3.16Å; S370-C373 PolarHBondContact O-N 3.27Å; A371-C373 VanDerWaalsContact C-N 3.34Å; A371-C373 PolarHBondContact O-N 2.9Å; C373-C375 VanDerWaalsContact C-N 3.32Å; C373-C375 PolarHBondContact O-N 3.09Å; C373-N376 PolarHBondContact O-N 3.17Å; C373-L377 WeakPolarHBondContact O-CB 3.45Å; C373-L377 VanDerWaalsContact O-CG 3.27Å; C373-L377 WeakPolarHBondContact O-CG 3.43Å; C373-L377 PolarHBondContact O-N 3.28Å
374	L	98.6	Very high	96	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-61.9	-38.7	179.2	-70.7	171.3	0	0	0	112.2	I352 L355 I356 L359 S370 A371 N376 L377 T378 L388	I352-L374 HydrophobicContact CB-CD2 4.43Å; I352-L374 HydrophobicContact CG1-CD2 4.2Å; I352-L374 HydrophobicContact CG2-CD2 4.09Å; L355-L374 HydrophobicContact CB-CD1 4.17Å; L355-L374 HydrophobicContact CB-CD2 3.77Å; L355-L374 HydrophobicContact CB-CG 3.85Å; L355-L374 HydrophobicContact CD1-CD2 3.9Å; L355-L374 HydrophobicContact CD1-CG 4.13Å; I356-L374 HydrophobicContact CG1-CD1 4.12Å; I356-L374 HydrophobicContact CG1-CD2 4.44Å; L359-L374 HydrophobicContact CD1-CD1 3.67Å; L359-L374 HydrophobicContact CD2-CD1 4.1Å; L359-L374 HydrophobicContact CG-CD1 3.99Å; S370-L374 WeakPolarHBondContact O-CG 3.42Å; S370-L374 PolarHBondContact O-N 2.67Å; A371-L374 PolarHBondContact O-N 3.3Å; L374-N376 PolarHBondContact O-N 3.43Å; L374-L377 PolarHBondContact O-N 3.49Å; L374-T378 WeakPolarHBondContact O-CB 3.35Å; L374-T378 VanDerWaalsContact O-CG2 3.29Å; L374-T378 WeakPolarHBondContact O-CG2 3.45Å; L374-T378 PolarHBondContact O-N 3.23Å; L374-T378 PolarHBondContact O-OG1 3.47Å; L374-L388 HydrophobicContact CB-CD1 4.18Å; L374-L388 HydrophobicContact CD1-CD1 4.34Å; L374-L388 HydrophobicContact CD2-CD1 4.11Å; L374-L388 HydrophobicContact CG-CD1 4.44Å
375	C	98.3	Very high	96.2	Very high	12 Å²	12	28.9 Å²	28.9	8%	0.081	15%	0.15	C	C	.	.	H	α-helix	trans	-54.8	-51.2	174.1	178.5	0	0	0	0	111.5	A371 G372 C373 T378 C379 P413 S416 A417 H420	A371-C375 WeakPolarHBondContact O-CB 3.42Å; A371-C375 PolarHBondContact O-N 3.09Å; G372-C375 PolarHBondContact O-N 3.25Å; C373-C375 VanDerWaalsContact C-N 3.32Å; C373-C375 PolarHBondContact O-N 3.09Å; C375-T378 PolarHBondContact O-OG1 2.81Å; C375-T378 VanDerWaalsContact O-OG1 3.12Å; C375-C379 PolarHBondContact O-N 3Å; C375-P413 HydrophobicContact CB-CB 4.16Å; C375-P413 WeakPolarHBondContact CB-O 3.26Å; C375-S416 WeakPolarHBondContact SG-CB 3.48Å; C375-A417 HydrophobicContact CB-CB 4.14Å; C375-H420 PolarHBondContact O-CE1 3.45Å; C375-H420 VanDerWaalsContact O-CE1 3.31Å; C375-H420 PolarHBondContact O-ND1 3.21Å; C375-H420 VanDerWaalsContact O-ND1 3.09Å
376	N	97	Very high	96.5	Very high	36 Å²	36	24.4 Å²	24.4	19%	0.193	13%	0.131	C	C	.	.	H	α-helix	trans	-67.2	-44.6	179.4	-70.9	-8.1	0	0	0	112.2	R336 S339 G372 C373 L374 T378 C379	R336-N376 PolarHBondContact O-ND2 2.91Å; S339-N376 VanDerWaalsContact OG-CB 3.22Å; S339-N376 WeakPolarHBondContact OG-CB 3.35Å; S339-N376 PolarHBondContact OG-ND2 3.42Å; G372-N376 PolarHBondContact O-N 3.39Å; C373-N376 PolarHBondContact O-N 3.17Å; L374-N376 PolarHBondContact O-N 3.43Å; N376-T378 VanDerWaalsContact C-N 3.32Å; N376-T378 PolarHBondContact O-N 3.03Å; N376-C379 WeakPolarHBondContact O-CB 3.41Å; N376-C379 PolarHBondContact O-N 3.14Å; N376-C379 VanDerWaalsContact O-N 3.15Å
377	L	98	Very high	96.5	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.005	14%	0.136	C	C	.	.	H	α-helix	trans	-68.7	-29	-177	-66.6	176.9	0	0	0	113.4	A342 T348 L351 I352 L355 C373 L374 C379 N384	A342-L377 HydrophobicContact CB-CD2 4.04Å; T348-L377 HydrophobicContact CG2-CD2 3.8Å; L351-L377 HydrophobicContact CD2-CD1 3.8Å; L351-L377 HydrophobicContact CG-CD1 4.33Å; I352-L377 HydrophobicContact CG1-CD1 4.36Å; L355-L377 HydrophobicContact CD1-CD1 3.72Å; C373-L377 WeakPolarHBondContact O-CB 3.45Å; C373-L377 VanDerWaalsContact O-CG 3.27Å; C373-L377 WeakPolarHBondContact O-CG 3.43Å; C373-L377 PolarHBondContact O-N 3.28Å; L374-L377 PolarHBondContact O-N 3.49Å; L377-C379 VanDerWaalsContact C-N 3.3Å; L377-N384 WeakPolarHBondContact O-CB 3.28Å; L377-N384 PolarHBondContact O-ND2 3.22Å
378	T	97.8	Very high	96.6	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-82.3	-10.8	175.6	54.2	0	0	0	0	113.1	L374 C375 N376 Q380 K385 L388 H420 V421	L374-T378 WeakPolarHBondContact O-CB 3.35Å; L374-T378 VanDerWaalsContact O-CG2 3.29Å; L374-T378 WeakPolarHBondContact O-CG2 3.45Å; L374-T378 PolarHBondContact O-N 3.23Å; L374-T378 PolarHBondContact O-OG1 3.47Å; C375-T378 PolarHBondContact O-OG1 2.81Å; C375-T378 VanDerWaalsContact O-OG1 3.12Å; N376-T378 VanDerWaalsContact C-N 3.32Å; N376-T378 PolarHBondContact O-N 3.03Å; T378-Q380 PolarHBondContact O-N 3.01Å; T378-K385 WeakPolarHBondContact O-CE 3.49Å; T378-L388 HydrophobicContact CG2-CB 4.38Å; T378-L388 HydrophobicContact CG2-CD1 3.68Å; T378-H420 PolarHBondContact OG1-ND1 3.46Å; T378-V421 HydrophobicContact CG2-CG1 4.06Å
379	C	94.2	Very high	96.9	Very high	35 Å²	35	24.3 Å²	24.3	24%	0.236	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	120.4	174.7	-165.4	0	0	0	0	109.2	C375 N376 L377 N381	C375-C379 PolarHBondContact O-N 3Å; N376-C379 WeakPolarHBondContact O-CB 3.41Å; N376-C379 PolarHBondContact O-N 3.14Å; N376-C379 VanDerWaalsContact O-N 3.15Å; L377-C379 VanDerWaalsContact C-N 3.3Å; C379-N381 PolarHBondContact O-N 3.28Å
380	Q	86.9	Confident	97	Very high	131 Å²	131	29.8 Å²	29.8	61%	0.612	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.7	18.2	174.7	-56.2	-179.6	24.2	0	0	116.9	T378	T378-Q380 PolarHBondContact O-N 3.01Å
381	N	95.7	Very high	97	Very high	20 Å²	20	35.6 Å²	35.6	11%	0.107	18%	0.18	C	C	.	.			trans	-120.6	111.2	173.6	-173.4	-45.5	0	0	0	111.7	Y343 C379 Q383 N384 K385	Y343-N381 HydrophobicContact CD2-CB 4.49Å; Y343-N381 WeakPolarHBondContact O-CB 3.13Å; Y343-N381 PolarHBondContact O-ND2 3.11Å; C379-N381 PolarHBondContact O-N 3.28Å; N381-Q383 PolarHBondContact O-N 3.05Å; N381-Q383 WeakPolarHBondContact OD1-CA 3.22Å; N381-Q383 WeakPolarHBondContact OD1-CB 3.44Å; N381-Q383 PolarHBondContact OD1-N 3.21Å; N381-N384 HydrophobicContact CB-CB 3.96Å; N381-N384 PolarHBondContact O-N 2.93Å; N381-N384 PolarHBondContact OD1-N 3.38Å; N381-K385 VanDerWaalsContact O-CG 3.23Å; N381-K385 WeakPolarHBondContact O-CG 3.46Å; N381-K385 PolarHBondContact O-N 3.11Å; N381-K385 VanDerWaalsContact O-N 3.08Å
382	V	96.7	Very high	97	Very high	72 Å²	72	36.9 Å²	36.9	44%	0.436	19%	0.194	S	C	.	.	H	α-helix	trans	-62.6	-41.5	-179.7	-180	0	0	0	0	112.1	K385 S386 N425	V382-K385 PolarHBondContact O-N 3.04Å; V382-S386 PolarHBondContact O-N 3.27Å; V382-S386 PolarHBondContact O-OG 3.49Å; V382-N425 HydrophobicContact CG1-CB 4.05Å
383	Q	97.3	Very high	97.1	Very high	130 Å²	130	36.5 Å²	36.5	61%	0.607	19%	0.19	S	C	*	.	H	α-helix	trans	-66	-42.8	-179.7	-63.7	177.2	-11.3	0	0	111.5	N381 S386 L387	N381-Q383 PolarHBondContact O-N 3.05Å; N381-Q383 WeakPolarHBondContact OD1-CA 3.22Å; N381-Q383 WeakPolarHBondContact OD1-CB 3.44Å; N381-Q383 PolarHBondContact OD1-N 3.21Å; Q383-S386 PolarHBondContact O-N 3.22Å; Q383-L387 VanDerWaalsContact O-CB 3.29Å; Q383-L387 WeakPolarHBondContact O-CB 3.41Å; Q383-L387 PolarHBondContact O-N 3.13Å
384	N	98.2	Very high	97.1	Very high	3 Å²	3	36.4 Å²	36.4	2%	0.016	19%	0.19	C	C	.	.	H	α-helix	trans	-65.4	-39.7	177.5	-69.8	-12.7	0	0	0	111.7	Y343 T348 I352 L377 N381 L388	Y343-N384 PolarHBondContact O-ND2 2.95Å; T348-N384 PolarHBondContact OG1-OD1 3.41Å; I352-N384 HydrophobicContact CD1-CB 3.51Å; I352-N384 VanDerWaalsContact CD1-CG 3.47Å; I352-N384 WeakPolarHBondContact CD1-OD1 3.41Å; L377-N384 WeakPolarHBondContact O-CB 3.28Å; L377-N384 PolarHBondContact O-ND2 3.22Å; N381-N384 HydrophobicContact CB-CB 3.96Å; N381-N384 PolarHBondContact O-N 2.93Å; N381-N384 PolarHBondContact OD1-N 3.38Å; N384-L388 WeakPolarHBondContact O-CB 3.36Å; N384-L388 PolarHBondContact O-N 3.36Å
385	K	98.3	Very high	97.1	Very high	15 Å²	15	43 Å²	43	7%	0.065	22%	0.218	C	C	.	.	H	α-helix	trans	-60.9	-52.7	173.4	-68.7	167.4	-179.6	-163.8	0	111.1	T378 N381 V382 L387 L388 V389 H420 V421 H423 N425	T378-K385 WeakPolarHBondContact O-CE 3.49Å; N381-K385 VanDerWaalsContact O-CG 3.23Å; N381-K385 WeakPolarHBondContact O-CG 3.46Å; N381-K385 PolarHBondContact O-N 3.11Å; N381-K385 VanDerWaalsContact O-N 3.08Å; V382-K385 PolarHBondContact O-N 3.04Å; K385-L387 VanDerWaalsContact C-N 3.33Å; K385-L387 PolarHBondContact O-N 3.31Å; K385-L388 PolarHBondContact O-N 3.35Å; K385-V389 WeakPolarHBondContact O-CG2 3.28Å; K385-V389 PolarHBondContact O-N 3.48Å; K385-V389 VanDerWaalsContact O-N 3.16Å; K385-H420 VanDerWaalsContact CD-O 3.24Å; K385-H420 WeakPolarHBondContact CD-O 3.48Å; K385-H420 WeakPolarHBondContact CE-O 3.47Å; K385-H420 PolarHBondContact NZ-O 2.99Å; K385-V421 HydrophobicContact CB-CG1 4.19Å; K385-V421 HydrophobicContact CG-CG1 4.25Å; K385-H423 PolarHBondContact NZ-O 3.15Å; K385-N425 HydrophobicContact CB-CB 3.88Å; K385-N425 HydrophobicContact CD-CB 4.11Å
386	S	97.8	Very high	97.1	Very high	13 Å²	13	44.3 Å²	44.3	9%	0.091	23%	0.226	C	C	.	.	H	α-helix	trans	-55.8	-48.8	178.5	-67.5	0	0	0	0	111.5	V382 Q383 L388 V389 E390 H427	V382-S386 PolarHBondContact O-N 3.27Å; V382-S386 PolarHBondContact O-OG 3.49Å; Q383-S386 PolarHBondContact O-N 3.22Å; S386-L388 VanDerWaalsContact C-N 3.3Å; S386-L388 PolarHBondContact O-N 3.29Å; S386-V389 PolarHBondContact O-N 3.27Å; S386-V389 VanDerWaalsContact O-N 3.13Å; S386-E390 WeakPolarHBondContact O-CB 3.29Å; S386-E390 WeakPolarHBondContact O-CG 3.34Å; S386-E390 PolarHBondContact O-N 3.45Å; S386-H427 PolarHBondContact OG-CD2 2.95Å
387	L	98.2	Very high	97.2	Very high	21 Å²	21	42.6 Å²	42.6	11%	0.11	22%	0.217	C	C	.	.	H	α-helix	trans	-62	-37.8	-179.4	-177.3	61.5	0	0	0	112.3	K349 I352 Q383 K385 V389 K391	K349-L387 HydrophobicContact CB-CD2 4.44Å; K349-L387 HydrophobicContact CG-CD2 4.18Å; I352-L387 HydrophobicContact CB-CD2 3.97Å; I352-L387 HydrophobicContact CB-CG 4.46Å; I352-L387 HydrophobicContact CD1-CD2 4.23Å; I352-L387 HydrophobicContact CG2-CD2 4.13Å; I352-L387 HydrophobicContact CG2-CG 4.05Å; Q383-L387 VanDerWaalsContact O-CB 3.29Å; Q383-L387 WeakPolarHBondContact O-CB 3.41Å; Q383-L387 PolarHBondContact O-N 3.13Å; K385-L387 VanDerWaalsContact C-N 3.33Å; K385-L387 PolarHBondContact O-N 3.31Å; L387-V389 VanDerWaalsContact C-N 3.34Å; L387-K391 HydrophobicContact CD1-CG 3.81Å; L387-K391 HydrophobicContact CG-CG 4.34Å; L387-K391 WeakPolarHBondContact O-CB 3.3Å; L387-K391 VanDerWaalsContact O-CG 3.23Å; L387-K391 WeakPolarHBondContact O-CG 3.32Å; L387-K391 PolarHBondContact O-N 2.82Å
388	L	98.5	Very high	97.2	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-61.3	-45.2	175.7	-172.2	156.4	0	0	0	111.1	I352 I356 L374 T378 N384 K385 S386 G393 V394 L397 V421	I352-L388 HydrophobicContact CG2-CB 4.47Å; I356-L388 HydrophobicContact CD1-CG 4.26Å; L374-L388 HydrophobicContact CB-CD1 4.18Å; L374-L388 HydrophobicContact CD1-CD1 4.34Å; L374-L388 HydrophobicContact CD2-CD1 4.11Å; L374-L388 HydrophobicContact CG-CD1 4.44Å; T378-L388 HydrophobicContact CG2-CB 4.38Å; T378-L388 HydrophobicContact CG2-CD1 3.68Å; N384-L388 WeakPolarHBondContact O-CB 3.36Å; N384-L388 PolarHBondContact O-N 3.36Å; K385-L388 PolarHBondContact O-N 3.35Å; S386-L388 VanDerWaalsContact C-N 3.3Å; S386-L388 PolarHBondContact O-N 3.29Å; L388-G393 WeakPolarHBondContact O-CA 3.33Å; L388-G393 PolarHBondContact O-N 3.13Å; L388-V394 HydrophobicContact CD2-CG2 3.98Å; L388-L397 HydrophobicContact CD1-CD1 4.06Å; L388-L397 HydrophobicContact CD2-CD1 4.03Å; L388-V421 HydrophobicContact CB-CG1 4.26Å; L388-V421 HydrophobicContact CD1-CG1 4.21Å; L388-V421 HydrophobicContact CD2-CG1 4.02Å; L388-V421 HydrophobicContact CG-CG1 4.39Å
389	V	98.5	Very high	97.2	Very high	5 Å²	5	51 Å²	51	3%	0.03	25%	0.248	C	C	.	.	H	α-helix	trans	-65.6	-51	178.5	-176.6	0	0	0	0	110.6	K385 S386 L387 K391 G392 V394 V421 H427 A431	K385-V389 WeakPolarHBondContact O-CG2 3.28Å; K385-V389 PolarHBondContact O-N 3.48Å; K385-V389 VanDerWaalsContact O-N 3.16Å; S386-V389 PolarHBondContact O-N 3.27Å; S386-V389 VanDerWaalsContact O-N 3.13Å; L387-V389 VanDerWaalsContact C-N 3.34Å; V389-K391 PolarHBondContact O-N 3.22Å; V389-K391 VanDerWaalsContact O-N 3.13Å; V389-G392 PolarHBondContact O-N 2.84Å; V389-V394 HydrophobicContact CB-CG2 4.42Å; V389-V394 HydrophobicContact CG1-CG2 4.43Å; V389-V394 HydrophobicContact CG2-CG2 3.92Å; V389-V421 HydrophobicContact CG2-CB 3.94Å; V389-V421 HydrophobicContact CG2-CG2 4.5Å; V389-H427 HydrophobicContact CB-CB 3.93Å; V389-H427 HydrophobicContact CG1-CB 3.72Å; V389-H427 HydrophobicContact CG2-CB 4.28Å; V389-A431 HydrophobicContact CG1-CB 4.39Å; V389-A431 HydrophobicContact CG2-CB 3.85Å
390	E	97.9	Very high	97.3	Very high	120 Å²	120	49.8 Å²	49.8	56%	0.561	24%	0.239	S	C	*	.	H	α-helix	trans	-57.8	-30	179.8	-72.5	173.2	-170.3	0	0	113.6	S386 G392 H427	S386-E390 WeakPolarHBondContact O-CB 3.29Å; S386-E390 WeakPolarHBondContact O-CG 3.34Å; S386-E390 PolarHBondContact O-N 3.45Å; E390-G392 VanDerWaalsContact C-N 3.32Å; E390-H427 IonicContact OE1-CD2 2.95Å; E390-H427 IonicContact OE1-CE1 3.15Å; E390-H427 IonicContact OE1-NE2 3.21Å; E390-H427 PolarHBondContact OE1-NE2 3.45Å
391	K	97.8	Very high	97.9	Very high	122 Å²	122	43.6 Å²	43.6	53%	0.53	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	10.5	178.1	-63.7	-64.2	177.9	-170.2	0	113.6	P353 I356 L387 V389 G393	P353-K391 HydrophobicContact CG-CG 4.41Å; I356-K391 HydrophobicContact CD1-CB 3.59Å; L387-K391 HydrophobicContact CD1-CG 3.81Å; L387-K391 HydrophobicContact CG-CG 4.34Å; L387-K391 WeakPolarHBondContact O-CB 3.3Å; L387-K391 VanDerWaalsContact O-CG 3.23Å; L387-K391 WeakPolarHBondContact O-CG 3.32Å; L387-K391 PolarHBondContact O-N 2.82Å; V389-K391 PolarHBondContact O-N 3.22Å; V389-K391 VanDerWaalsContact O-N 3.13Å; K391-G393 VanDerWaalsContact C-N 3.29Å; K391-G393 PolarHBondContact O-N 3.34Å
392	G	97.1	Very high	97.9	Very high	29 Å²	29	45 Å²	45	30%	0.299	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.1	21.6	177.5	0	0	0	0	0	113.9	V389 E390 V394	V389-G392 PolarHBondContact O-N 2.84Å; E390-G392 VanDerWaalsContact C-N 3.32Å; G392-V394 VanDerWaalsContact C-N 3.26Å; G392-V394 PolarHBondContact O-N 2.9Å
393	G	98.3	Very high	97.9	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-66.3	-26.6	-178	0	0	0	0	0	113.5	L388 K391 V396 L397	L388-G393 WeakPolarHBondContact O-CA 3.33Å; L388-G393 PolarHBondContact O-N 3.13Å; K391-G393 VanDerWaalsContact C-N 3.29Å; K391-G393 PolarHBondContact O-N 3.34Å; G393-V396 PolarHBondContact O-N 2.97Å; G393-L397 WeakPolarHBondContact O-CB 3.42Å; G393-L397 WeakPolarHBondContact O-CG 3.34Å; G393-L397 PolarHBondContact O-N 3.36Å
394	V	98.6	Very high	97.8	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-63.2	-52.4	-178.4	-179.3	0	0	0	0	110.7	L388 V389 G392 V396 L397 C398 L418 V421 A431 E434 V435	L388-V394 HydrophobicContact CD2-CG2 3.98Å; V389-V394 HydrophobicContact CB-CG2 4.42Å; V389-V394 HydrophobicContact CG1-CG2 4.43Å; V389-V394 HydrophobicContact CG2-CG2 3.92Å; G392-V394 VanDerWaalsContact C-N 3.26Å; G392-V394 PolarHBondContact O-N 2.9Å; V394-V396 VanDerWaalsContact C-N 3.26Å; V394-V396 PolarHBondContact O-N 3.39Å; V394-L397 PolarHBondContact O-N 2.95Å; V394-L397 VanDerWaalsContact O-N 3.17Å; V394-C398 WeakPolarHBondContact O-CB 3.36Å; V394-C398 PolarHBondContact O-N 3.47Å; V394-C398 PolarHBondContact O-SG 2.97Å; V394-L418 HydrophobicContact CG1-CD2 3.97Å; V394-V421 HydrophobicContact CG2-CG2 4.02Å; V394-A431 HydrophobicContact CG2-CB 4.03Å; V394-E434 HydrophobicContact CB-CB 4.06Å; V394-E434 HydrophobicContact CG1-CB 3.71Å; V394-V435 HydrophobicContact CG1-CG2 3.67Å
395	K	98	Very high	97.7	Very high	138 Å²	138	41.8 Å²	41.8	60%	0.6	21%	0.206	S	C	*	.	H	α-helix	trans	-57.2	-38.1	178.4	-173.1	171.9	-174.4	174	0	113	C398 R399	K395-C398 WeakPolarHBondContact O-CB 3.2Å; K395-R399 PolarHBondContact O-N 2.73Å
396	V	97.9	Very high	97.5	Very high	40 Å²	40	46.7 Å²	46.7	24%	0.242	23%	0.233	C	C	.	.	H	α-helix	trans	-73.2	-39.6	179.5	-167.3	0	0	0	0	111.3	L359 G393 V394 R399 L400	L359-V396 HydrophobicContact CB-CB 4.4Å; L359-V396 HydrophobicContact CB-CG1 3.49Å; L359-V396 VanDerWaalsContact CB-CG1 3.49Å; L359-V396 HydrophobicContact CD1-CB 4.15Å; L359-V396 HydrophobicContact CD1-CG1 4.12Å; L359-V396 HydrophobicContact CG-CG1 4.48Å; G393-V396 PolarHBondContact O-N 2.97Å; V394-V396 VanDerWaalsContact C-N 3.26Å; V394-V396 PolarHBondContact O-N 3.39Å; V396-R399 PolarHBondContact O-N 3.34Å; V396-L400 WeakPolarHBondContact O-CB 3.45Å; V396-L400 PolarHBondContact O-N 2.95Å
397	L	98.6	Very high	97.3	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-62.2	-43	172.2	-74.9	170	0	0	0	111.7	L359 A371 L388 G393 V394 L400 L401 I414 A417 L418	L359-L397 HydrophobicContact CD1-CD2 3.85Å; L359-L397 HydrophobicContact CD1-CG 3.88Å; L359-L397 HydrophobicContact CD2-CD2 4.11Å; A371-L397 HydrophobicContact CB-CD2 4.26Å; L388-L397 HydrophobicContact CD1-CD1 4.06Å; L388-L397 HydrophobicContact CD2-CD1 4.03Å; G393-L397 WeakPolarHBondContact O-CB 3.42Å; G393-L397 WeakPolarHBondContact O-CG 3.34Å; G393-L397 PolarHBondContact O-N 3.36Å; V394-L397 PolarHBondContact O-N 2.95Å; V394-L397 VanDerWaalsContact O-N 3.17Å; L397-L400 PolarHBondContact O-N 3.1Å; L397-L401 PolarHBondContact O-N 3.24Å; L397-I414 HydrophobicContact CB-CG2 4.17Å; L397-I414 HydrophobicContact CD2-CG2 4.18Å; L397-I414 WeakPolarHBondContact O-CG2 3.48Å; L397-A417 HydrophobicContact CD1-CB 3.97Å; L397-L418 HydrophobicContact CB-CD2 3.88Å; L397-L418 HydrophobicContact CB-CG 4.28Å; L397-L418 HydrophobicContact CD1-CD2 4.28Å
398	C	98.5	Very high	97.1	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-55.2	-52.1	173	-81.6	0	0	0	0	111.9	V394 K395 L400 L401 C402 T440	V394-C398 WeakPolarHBondContact O-CB 3.36Å; V394-C398 PolarHBondContact O-N 3.47Å; V394-C398 PolarHBondContact O-SG 2.97Å; K395-C398 WeakPolarHBondContact O-CB 3.2Å; C398-L400 VanDerWaalsContact C-N 3.3Å; C398-L400 PolarHBondContact O-N 3.12Å; C398-L401 WeakPolarHBondContact O-CB 3.47Å; C398-L401 PolarHBondContact O-N 3.03Å; C398-L401 VanDerWaalsContact O-N 3.15Å; C398-C402 PolarHBondContact O-N 3Å; C398-C402 PolarHBondContact O-SG 3.32Å; C398-T440 HydrophobicContact CB-CG2 4.25Å; C398-T440 WeakPolarHBondContact CB-OG1 3.28Å; C398-T440 PolarHBondContact SG-OG1 3.18Å
399	R	97.5	Very high	96.7	Very high	177 Å²	177	55.1 Å²	55.1	67%	0.668	27%	0.267	S	S	*	.	H	α-helix	trans	-58	-44	175.9	-177.8	-179.1	178.6	-174.3	0.4	111.8	K395 V396 L401 C402 L403	K395-R399 PolarHBondContact O-N 2.73Å; V396-R399 PolarHBondContact O-N 3.34Å; R399-L401 VanDerWaalsContact C-N 3.32Å; R399-L401 PolarHBondContact O-N 3.39Å; R399-C402 PolarHBondContact O-N 2.77Å; R399-L403 HydrophobicContact CG-CD1 4.22Å; R399-L403 WeakPolarHBondContact O-CG 3.32Å; R399-L403 PolarHBondContact O-N 3.28Å; R399-L403 VanDerWaalsContact O-N 3.11Å
400	L	97.4	Very high	96.4	Very high	10 Å²	10	55.3 Å²	55.3	5%	0.052	27%	0.268	C	S	.	.	H	α-helix	trans	-63.6	-39.3	178.8	-168.2	67	0	0	0	111.1	L359 A371 V396 L397 C398 L403 N404 I414	L359-L400 HydrophobicContact CD2-CD2 3.99Å; A371-L400 HydrophobicContact CB-CD2 3.88Å; V396-L400 WeakPolarHBondContact O-CB 3.45Å; V396-L400 PolarHBondContact O-N 2.95Å; L397-L400 PolarHBondContact O-N 3.1Å; C398-L400 VanDerWaalsContact C-N 3.3Å; C398-L400 PolarHBondContact O-N 3.12Å; L400-L403 PolarHBondContact O-N 3.21Å; L400-N404 WeakPolarHBondContact CD1-ND2 3.49Å; L400-N404 VanDerWaalsContact O-CB 3.32Å; L400-N404 WeakPolarHBondContact O-CB 3.48Å; L400-N404 PolarHBondContact O-N 2.86Å; L400-N404 PolarHBondContact O-ND2 3.34Å; L400-I414 HydrophobicContact CB-CD1 4.14Å; L400-I414 HydrophobicContact CD2-CD1 3.74Å; L400-I414 HydrophobicContact CD2-CG1 4.24Å; L400-I414 HydrophobicContact CG-CD1 3.68Å
401	L	98.2	Very high	96.4	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-61.4	-48.2	174.4	-176.5	59.9	0	0	0	111.6	L397 C398 R399 L403 N404 S405 A411 I414 L418 T440 T443 I444 L447	L397-L401 PolarHBondContact O-N 3.24Å; C398-L401 WeakPolarHBondContact O-CB 3.47Å; C398-L401 PolarHBondContact O-N 3.03Å; C398-L401 VanDerWaalsContact O-N 3.15Å; R399-L401 VanDerWaalsContact C-N 3.32Å; R399-L401 PolarHBondContact O-N 3.39Å; L401-L403 VanDerWaalsContact C-N 3.27Å; L401-L403 PolarHBondContact O-N 3.27Å; L401-N404 CarbonylContact O-C 3.56Å; L401-N404 PolarHBondContact O-N 3.23Å; L401-S405 PolarHBondContact O-N 3.49Å; L401-A411 HydrophobicContact CD1-CB 3.89Å; L401-I414 HydrophobicContact CB-CG2 3.8Å; L401-I414 HydrophobicContact CD1-CB 4.43Å; L401-I414 HydrophobicContact CD1-CG2 4.38Å; L401-L418 HydrophobicContact CD2-CD1 4.15Å; L401-T440 HydrophobicContact CD2-CG2 3.86Å; L401-T443 HydrophobicContact CD2-CG2 4.5Å; L401-T443 HydrophobicContact CG-CG2 4.12Å; L401-I444 HydrophobicContact CD2-CG1 4.33Å; L401-L447 HydrophobicContact CD1-CD1 4.31Å
402	C	96.9	Very high	96.3	Very high	49 Å²	49	45.9 Å²	45.9	33%	0.331	23%	0.226	S	C	.	.	H	α-helix	trans	-57.5	-40.7	178.7	-64	0	0	0	0	111.9	C398 R399 N404 T443	C398-C402 PolarHBondContact O-N 3Å; C398-C402 PolarHBondContact O-SG 3.32Å; R399-C402 PolarHBondContact O-N 2.77Å; C402-N404 VanDerWaalsContact C-N 3.27Å; C402-N404 PolarHBondContact O-N 2.8Å; C402-T443 PolarHBondContact SG-OG1 2.63Å
403	L	95.6	Very high	96.2	Very high	119 Å²	119	45.4 Å²	45.4	62%	0.623	22%	0.218	S	C	*	.	H	α-helix	trans	-71.5	-18.1	177.3	-68.4	172	0	0	0	114	R399 L400 L401	R399-L403 HydrophobicContact CG-CD1 4.22Å; R399-L403 WeakPolarHBondContact O-CG 3.32Å; R399-L403 PolarHBondContact O-N 3.28Å; R399-L403 VanDerWaalsContact O-N 3.11Å; L400-L403 PolarHBondContact O-N 3.21Å; L401-L403 VanDerWaalsContact C-N 3.27Å; L401-L403 PolarHBondContact O-N 3.27Å
404	N	95.5	Very high	96.3	Very high	5 Å²	5	45.4 Å²	45.4	3%	0.027	22%	0.218	C	C	.	.	H	α-helix	trans	-125	14.9	-169.5	-70.1	-80.9	0	0	0	113.9	L400 L401 C402 D406 R407 I410	L400-N404 WeakPolarHBondContact CD1-ND2 3.49Å; L400-N404 VanDerWaalsContact O-CB 3.32Å; L400-N404 WeakPolarHBondContact O-CB 3.48Å; L400-N404 PolarHBondContact O-N 2.86Å; L400-N404 PolarHBondContact O-ND2 3.34Å; L401-N404 CarbonylContact O-C 3.56Å; L401-N404 PolarHBondContact O-N 3.23Å; C402-N404 VanDerWaalsContact C-N 3.27Å; C402-N404 PolarHBondContact O-N 2.8Å; N404-D406 PolarHBondContact O-N 3.4Å; N404-R407 PolarHBondContact O-N 3.22Å; N404-R407 PolarHBondContact OD1-NE 3.47Å; N404-R407 PolarHBondContact OD1-NH2 3.4Å; N404-I410 HydrophobicContact CB-CB 4.21Å; N404-I410 HydrophobicContact CB-CG2 3.58Å
405	S	95.7	Very high	96.3	Very high	15 Å²	15	45.4 Å²	45.4	11%	0.105	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-10.3	-174.1	71.6	0	0	0	0	114.7	L401 K450 Y451	L401-S405 PolarHBondContact O-N 3.49Å; S405-K450 VanDerWaalsContact C-NZ 3.3Å; S405-K450 WeakPolarHBondContact O-CD 3.48Å; S405-K450 PolarHBondContact O-NZ 2.96Å; S405-K450 PolarHBondContact OG-NZ 3.24Å; S405-K450 VanDerWaalsContact OG-NZ 3.08Å; S405-Y451 PolarHBondContact O-OH 3.33Å
406	D	95.1	Very high	96.3	Very high	117 Å²	117	39 Å²	39	63%	0.626	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-6.7	174.2	-64.7	-54.6	0	0	0	113.5	N404 K450 Y451	N404-D406 PolarHBondContact O-N 3.4Å; D406-K450 WeakPolarHBondContact OD1-CD 3.23Å; D406-K450 WeakPolarHBondContact OD1-CE 3.46Å; D406-K450 IonicContact OD1-NZ 3.99Å; D406-K450 PolarHBondContact OD1-NZ 3.16Å; D406-K450 IonicContact OD2-NZ 2.73Å; D406-Y451 WeakPolarHBondContact CA-OH 3.48Å; D406-Y451 PolarHBondContact O-OH 3.11Å
407	R	94.2	Very high	96.3	Very high	78 Å²	78	37.1 Å²	37.1	29%	0.294	18%	0.179	S	C	.	.			trans	-118.9	99	-175	-62.6	-172.4	-74.9	-171.3	-10	111	E364 N404 E409 I410 A411 Y451	E364-R407 IonicContact OE1-CZ 2.83Å; E364-R407 IonicContact OE1-NH1 3.36Å; E364-R407 PolarHBondContact OE1-NH1 2.87Å; E364-R407 IonicContact OE1-NH2 3.97Å; E364-R407 PolarHBondContact OE1-NH2 3.43Å; E364-R407 VanDerWaalsContact OE1-NH2 3.11Å; E364-R407 IonicContact OE2-CZ 2.68Å; E364-R407 IonicContact OE2-NH1 3.82Å; E364-R407 PolarHBondContact OE2-NH1 3.35Å; E364-R407 VanDerWaalsContact OE2-NH1 3.08Å; E364-R407 IonicContact OE2-NH2 2.63Å; E364-R407 PolarHBondContact OE2-NH2 2.88Å; N404-R407 PolarHBondContact O-N 3.22Å; N404-R407 PolarHBondContact OD1-NE 3.47Å; N404-R407 PolarHBondContact OD1-NH2 3.4Å; R407-E409 VanDerWaalsContact C-N 3.27Å; R407-E409 PolarHBondContact O-N 3.44Å; R407-I410 HydrophobicContact CB-CB 4.26Å; R407-I410 HydrophobicContact CB-CD1 3.81Å; R407-I410 HydrophobicContact CB-CG1 4.32Å; R407-I410 HydrophobicContact CG-CD1 4.38Å; R407-I410 VanDerWaalsContact NE-CD1 3.29Å; R407-I410 PolarHBondContact O-N 3.01Å; R407-A411 WeakPolarHBondContact O-CB 3.36Å; R407-A411 PolarHBondContact O-N 3.16Å; R407-Y451 PolarHBondContact N-OH 2.93Å; R407-Y451 VanDerWaalsContact N-OH 3.11Å
408	Q	93.6	Very high	96.3	Very high	44 Å²	44	37.1 Å²	37.1	21%	0.206	18%	0.179	C	C	.	.	H	α-helix	trans	-56.6	-42.3	-172.9	-179.8	179.2	-45.9	0	0	112.1	I410 A411 E412 Y451 S455 A456 L459	Q408-I410 PolarHBondContact O-N 3.35Å; Q408-A411 PolarHBondContact O-N 2.95Å; Q408-E412 WeakPolarHBondContact O-CB 3.15Å; Q408-E412 PolarHBondContact O-N 3.4Å; Q408-Y451 HydrophobicContact CB-CD1 4.41Å; Q408-Y451 HydrophobicContact CB-CE1 3.76Å; Q408-Y451 PolarHBondContact N-OH 2.71Å; Q408-Y451 VanDerWaalsContact N-OH 3.16Å; Q408-S455 PolarHBondContact NE2-O 2.94Å; Q408-S455 VanDerWaalsContact NE2-O 3.09Å; Q408-S455 PolarHBondContact OE1-O 3.2Å; Q408-A456 VanDerWaalsContact OE1-CB 3.24Å; Q408-L459 HydrophobicContact CB-CD2 4.31Å; Q408-L459 HydrophobicContact CG-CB 3.78Å; Q408-L459 HydrophobicContact CG-CD2 3.84Å; Q408-L459 HydrophobicContact CG-CG 4.43Å
409	E	89.1	Confident	96.3	Very high	90 Å²	90	38.9 Å²	38.9	42%	0.421	19%	0.185	S	C	.	.	H	α-helix	trans	-65.3	-17.4	-179.1	69.4	-78.6	-171.7	0	0	113.9	R407 P413 L682	R407-E409 VanDerWaalsContact C-N 3.27Å; R407-E409 PolarHBondContact O-N 3.44Å; E409-P413 WeakPolarHBondContact O-CD 3.41Å; E409-L682 HydrophobicContact CB-CD2 3.84Å
410	I	93.4	Very high	96.3	Very high	8 Å²	8	31.4 Å²	31.4	4%	0.041	16%	0.158	C	C	.	.	H	α-helix	trans	-101.4	-42.3	174.5	-62.9	162.1	0	0	0	110.4	I368 N404 R407 Q408 E412 P413 I414	I368-I410 HydrophobicContact CD1-CD1 3.31Å; I368-I410 HydrophobicContact CD1-CG1 3.66Å; I368-I410 HydrophobicContact CD1-CG2 4.42Å; I368-I410 HydrophobicContact CG1-CD1 4.01Å; I368-I410 HydrophobicContact CG1-CG1 3.93Å; I368-I410 HydrophobicContact CG1-CG2 3.89Å; I368-I410 HydrophobicContact CG2-CG1 4.05Å; N404-I410 HydrophobicContact CB-CB 4.21Å; N404-I410 HydrophobicContact CB-CG2 3.58Å; R407-I410 HydrophobicContact CB-CB 4.26Å; R407-I410 HydrophobicContact CB-CD1 3.81Å; R407-I410 HydrophobicContact CB-CG1 4.32Å; R407-I410 HydrophobicContact CG-CD1 4.38Å; R407-I410 VanDerWaalsContact NE-CD1 3.29Å; R407-I410 PolarHBondContact O-N 3.01Å; Q408-I410 PolarHBondContact O-N 3.35Å; I410-E412 VanDerWaalsContact C-N 3.33Å; I410-E412 PolarHBondContact O-N 3.48Å; I410-P413 VanDerWaalsContact O-CD 3.28Å; I410-P413 WeakPolarHBondContact O-CD 3.23Å; I410-P413 WeakPolarHBondContact O-CG 3.18Å; I410-I414 HydrophobicContact CG2-CD1 3.72Å; I410-I414 WeakPolarHBondContact O-CD1 3.37Å; I410-I414 VanDerWaalsContact O-CG1 3.3Å; I410-I414 WeakPolarHBondContact O-CG1 3.2Å
411	A	97.2	Very high	96.4	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-62.5	-38.7	179.9	0	0	0	0	0	112	L401 R407 Q408 I414 C415 L447 L459	L401-A411 HydrophobicContact CD1-CB 3.89Å; R407-A411 WeakPolarHBondContact O-CB 3.36Å; R407-A411 PolarHBondContact O-N 3.16Å; Q408-A411 PolarHBondContact O-N 2.95Å; A411-I414 PolarHBondContact O-N 3.05Å; A411-C415 WeakPolarHBondContact O-CB 3.34Å; A411-C415 PolarHBondContact O-N 3.5Å; A411-C415 PolarHBondContact O-SG 3.41Å; A411-C415 VanDerWaalsContact O-SG 3.35Å; A411-L447 HydrophobicContact CB-CD2 4.46Å; A411-L459 HydrophobicContact CB-CD1 3.91Å; A411-L459 HydrophobicContact CB-CD2 4.36Å
412	E	96.1	Very high	96.4	Very high	45 Å²	45	31.1 Å²	31.1	21%	0.21	16%	0.156	C	C	.	.	H	α-helix	trans	-55.9	-58.4	-178.5	179.9	-156	166.6	0	0	113	Q408 I410 I414 C415 S416 P458 L459	Q408-E412 WeakPolarHBondContact O-CB 3.15Å; Q408-E412 PolarHBondContact O-N 3.4Å; I410-E412 VanDerWaalsContact C-N 3.33Å; I410-E412 PolarHBondContact O-N 3.48Å; E412-I414 VanDerWaalsContact C-N 3.25Å; E412-I414 PolarHBondContact O-N 2.71Å; E412-C415 PolarHBondContact O-N 3.23Å; E412-S416 WeakPolarHBondContact O-CB 3.33Å; E412-S416 PolarHBondContact O-N 3.44Å; E412-P458 HydrophobicContact CG-CB 4.44Å; E412-L459 HydrophobicContact CB-CB 4.3Å; E412-L459 HydrophobicContact CB-CD1 4.26Å
413	P	95.9	Very high	96.4	Very high	19 Å²	19	31.5 Å²	31.5	12%	0.123	15%	0.154	C	C	.	.	H	α-helix	trans	-63.8	-30.4	-179.7	23.2	-34	0	0	0	112.7	C375 E409 I410 S416 A417	C375-P413 HydrophobicContact CB-CB 4.16Å; C375-P413 WeakPolarHBondContact CB-O 3.26Å; E409-P413 WeakPolarHBondContact O-CD 3.41Å; I410-P413 VanDerWaalsContact O-CD 3.28Å; I410-P413 WeakPolarHBondContact O-CD 3.23Å; I410-P413 WeakPolarHBondContact O-CG 3.18Å; P413-S416 PolarHBondContact O-N 3.31Å; P413-A417 WeakPolarHBondContact O-CB 3.2Å; P413-A417 PolarHBondContact O-N 3.2Å
414	I	98.5	Very high	96.2	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-69.3	-48.4	176.8	-60	166.2	0	0	0	110.5	A371 L397 L400 L401 I410 A411 E412 S416 A417 L418	A371-I414 HydrophobicContact CB-CG1 3.99Å; L397-I414 HydrophobicContact CB-CG2 4.17Å; L397-I414 HydrophobicContact CD2-CG2 4.18Å; L397-I414 WeakPolarHBondContact O-CG2 3.48Å; L400-I414 HydrophobicContact CB-CD1 4.14Å; L400-I414 HydrophobicContact CD2-CD1 3.74Å; L400-I414 HydrophobicContact CD2-CG1 4.24Å; L400-I414 HydrophobicContact CG-CD1 3.68Å; L401-I414 HydrophobicContact CB-CG2 3.8Å; L401-I414 HydrophobicContact CD1-CB 4.43Å; L401-I414 HydrophobicContact CD1-CG2 4.38Å; I410-I414 HydrophobicContact CG2-CD1 3.72Å; I410-I414 WeakPolarHBondContact O-CD1 3.37Å; I410-I414 VanDerWaalsContact O-CG1 3.3Å; I410-I414 WeakPolarHBondContact O-CG1 3.2Å; A411-I414 PolarHBondContact O-N 3.05Å; E412-I414 VanDerWaalsContact C-N 3.25Å; E412-I414 PolarHBondContact O-N 2.71Å; I414-S416 VanDerWaalsContact C-N 3.28Å; I414-S416 PolarHBondContact O-N 3.05Å; I414-A417 PolarHBondContact O-N 2.86Å; I414-L418 HydrophobicContact CG2-CD1 4.26Å; I414-L418 WeakPolarHBondContact O-CG 3.37Å; I414-L418 PolarHBondContact O-N 3.43Å
415	C	98.6	Very high	96.2	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-58.5	-40.6	174.3	-73.9	0	0	0	0	111.5	A411 E412 L418 R419 L459 V463	A411-C415 WeakPolarHBondContact O-CB 3.34Å; A411-C415 PolarHBondContact O-N 3.5Å; A411-C415 PolarHBondContact O-SG 3.41Å; A411-C415 VanDerWaalsContact O-SG 3.35Å; E412-C415 PolarHBondContact O-N 3.23Å; C415-L418 PolarHBondContact O-N 2.92Å; C415-R419 VanDerWaalsContact O-CB 3.29Å; C415-R419 WeakPolarHBondContact O-CB 3.36Å; C415-R419 PolarHBondContact O-N 3.23Å; C415-L459 HydrophobicContact CB-CD1 4.45Å; C415-V463 HydrophobicContact CB-CG2 4.33Å
416	S	98.2	Very high	96.3	Very high	4 Å²	4	36.8 Å²	36.8	3%	0.028	18%	0.177	C	C	.	.	H	α-helix	trans	-64.9	-43.8	175.6	-85.2	0	0	0	0	112.6	C375 E412 P413 I414 L418 R419 H420 S462	C375-S416 WeakPolarHBondContact SG-CB 3.48Å; E412-S416 WeakPolarHBondContact O-CB 3.33Å; E412-S416 PolarHBondContact O-N 3.44Å; P413-S416 PolarHBondContact O-N 3.31Å; I414-S416 VanDerWaalsContact C-N 3.28Å; I414-S416 PolarHBondContact O-N 3.05Å; S416-L418 PolarHBondContact O-N 3.25Å; S416-R419 WeakPolarHBondContact O-CB 2.93Å; S416-R419 PolarHBondContact O-N 2.93Å; S416-R419 PolarHBondContact OG-NH2 3.45Å; S416-H420 PolarHBondContact O-CD2 3.5Å; S416-H420 PolarHBondContact O-N 3.13Å; S416-H420 PolarHBondContact O-ND1 3.29Å; S416-H420 PolarHBondContact O-NE2 3.09Å; S416-S462 WeakPolarHBondContact OG-CB 3.41Å; S416-S462 PolarHBondContact OG-OG 3.23Å
417	A	98.5	Very high	96.4	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-60.5	-45.4	174.5	0	0	0	0	0	111.7	C375 L397 P413 I414 R419 H420 V421	C375-A417 HydrophobicContact CB-CB 4.14Å; L397-A417 HydrophobicContact CD1-CB 3.97Å; P413-A417 WeakPolarHBondContact O-CB 3.2Å; P413-A417 PolarHBondContact O-N 3.2Å; I414-A417 PolarHBondContact O-N 2.86Å; A417-R419 VanDerWaalsContact C-N 3.34Å; A417-R419 PolarHBondContact O-N 3.03Å; A417-H420 WeakPolarHBondContact O-CB 3.45Å; A417-H420 PolarHBondContact O-N 3.26Å; A417-H420 VanDerWaalsContact O-N 3.15Å; A417-V421 PolarHBondContact O-N 3.06Å; A417-V421 VanDerWaalsContact O-N 3.14Å
418	L	98.8	Very high	96.5	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-61	-42.1	174.8	-69.8	174.8	0	0	0	111.5	V394 L397 L401 I414 C415 S416 H420 V421 T422 V435 L466	V394-L418 HydrophobicContact CG1-CD2 3.97Å; L397-L418 HydrophobicContact CB-CD2 3.88Å; L397-L418 HydrophobicContact CB-CG 4.28Å; L397-L418 HydrophobicContact CD1-CD2 4.28Å; L401-L418 HydrophobicContact CD2-CD1 4.15Å; I414-L418 HydrophobicContact CG2-CD1 4.26Å; I414-L418 WeakPolarHBondContact O-CG 3.37Å; I414-L418 PolarHBondContact O-N 3.43Å; C415-L418 PolarHBondContact O-N 2.92Å; S416-L418 PolarHBondContact O-N 3.25Å; L418-H420 VanDerWaalsContact C-N 3.3Å; L418-H420 PolarHBondContact O-N 2.97Å; L418-V421 WeakPolarHBondContact O-CG2 3.45Å; L418-V421 PolarHBondContact O-N 2.96Å; L418-T422 WeakPolarHBondContact O-CB 3.28Å; L418-T422 VanDerWaalsContact O-CG2 3.28Å; L418-T422 WeakPolarHBondContact O-CG2 3.4Å; L418-T422 PolarHBondContact O-N 3.36Å; L418-T422 VanDerWaalsContact O-N 3.08Å; L418-T422 PolarHBondContact O-OG1 3.28Å; L418-V435 HydrophobicContact CD2-CG2 4.07Å; L418-L466 HydrophobicContact CB-CD1 3.9Å; L418-L466 HydrophobicContact CB-CD2 3.89Å; L418-L466 HydrophobicContact CD1-CD2 4.22Å
419	R	98.6	Very high	96.7	Very high	36 Å²	36	34.4 Å²	34.4	14%	0.136	17%	0.171	C	C	.	.	H	α-helix	trans	-59.4	-40	173.6	178.1	-175.2	69.2	-178.5	0.9	111.4	C415 S416 A417 T422 L466 N469	C415-R419 VanDerWaalsContact O-CB 3.29Å; C415-R419 WeakPolarHBondContact O-CB 3.36Å; C415-R419 PolarHBondContact O-N 3.23Å; S416-R419 WeakPolarHBondContact O-CB 2.93Å; S416-R419 PolarHBondContact O-N 2.93Å; S416-R419 PolarHBondContact OG-NH2 3.45Å; A417-R419 VanDerWaalsContact C-N 3.34Å; A417-R419 PolarHBondContact O-N 3.03Å; R419-T422 WeakPolarHBondContact CA-OG1 3.35Å; R419-T422 PolarHBondContact O-OG1 3.27Å; R419-L466 HydrophobicContact CB-CB 4.17Å; R419-N469 PolarHBondContact O-ND2 3.01Å
420	H	98.3	Very high	97.2	Very high	21 Å²	21	32.6 Å²	32.6	10%	0.097	17%	0.168	C	C	.	.	H	α-helix	trans	-66.5	-43.8	-179.8	-61.5	161.4	0	0	0	112.3	C375 T378 K385 S416 A417 L418	C375-H420 PolarHBondContact O-CE1 3.45Å; C375-H420 VanDerWaalsContact O-CE1 3.31Å; C375-H420 PolarHBondContact O-ND1 3.21Å; C375-H420 VanDerWaalsContact O-ND1 3.09Å; T378-H420 PolarHBondContact OG1-ND1 3.46Å; K385-H420 VanDerWaalsContact CD-O 3.24Å; K385-H420 WeakPolarHBondContact CD-O 3.48Å; K385-H420 WeakPolarHBondContact CE-O 3.47Å; K385-H420 PolarHBondContact NZ-O 2.99Å; S416-H420 PolarHBondContact O-CD2 3.5Å; S416-H420 PolarHBondContact O-N 3.13Å; S416-H420 PolarHBondContact O-ND1 3.29Å; S416-H420 PolarHBondContact O-NE2 3.09Å; A417-H420 WeakPolarHBondContact O-CB 3.45Å; A417-H420 PolarHBondContact O-N 3.26Å; A417-H420 VanDerWaalsContact O-N 3.15Å; L418-H420 VanDerWaalsContact C-N 3.3Å; L418-H420 PolarHBondContact O-N 2.97Å
421	V	98.4	Very high	97.4	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-82.2	-15.7	-175.8	-57.7	0	0	0	0	114.2	T378 K385 L388 V389 V394 A417 L418 H423 N425 A431	T378-V421 HydrophobicContact CG2-CG1 4.06Å; K385-V421 HydrophobicContact CB-CG1 4.19Å; K385-V421 HydrophobicContact CG-CG1 4.25Å; L388-V421 HydrophobicContact CB-CG1 4.26Å; L388-V421 HydrophobicContact CD1-CG1 4.21Å; L388-V421 HydrophobicContact CD2-CG1 4.02Å; L388-V421 HydrophobicContact CG-CG1 4.39Å; V389-V421 HydrophobicContact CG2-CB 3.94Å; V389-V421 HydrophobicContact CG2-CG2 4.5Å; V394-V421 HydrophobicContact CG2-CG2 4.02Å; A417-V421 PolarHBondContact O-N 3.06Å; A417-V421 VanDerWaalsContact O-N 3.14Å; L418-V421 WeakPolarHBondContact O-CG2 3.45Å; L418-V421 PolarHBondContact O-N 2.96Å; V421-H423 VanDerWaalsContact C-N 3.26Å; V421-H423 PolarHBondContact O-N 3.18Å; V421-N425 PolarHBondContact O-ND2 3.01Å; V421-A431 HydrophobicContact CG2-CB 4.19Å; V421-A431 WeakPolarHBondContact O-CB 3.32Å
422	T	98.3	Very high	97.5	Very high	3 Å²	3	32.3 Å²	32.3	2%	0.018	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	5	172.8	49.3	0	0	0	0	113.3	L418 R419 A431 I432 V435 L466 N469 L470	L418-T422 WeakPolarHBondContact O-CB 3.28Å; L418-T422 VanDerWaalsContact O-CG2 3.28Å; L418-T422 WeakPolarHBondContact O-CG2 3.4Å; L418-T422 PolarHBondContact O-N 3.36Å; L418-T422 VanDerWaalsContact O-N 3.08Å; L418-T422 PolarHBondContact O-OG1 3.28Å; R419-T422 WeakPolarHBondContact CA-OG1 3.35Å; R419-T422 PolarHBondContact O-OG1 3.27Å; T422-A431 HydrophobicContact CG2-CB 4.11Å; T422-I432 HydrophobicContact CG2-CG1 3.87Å; T422-V435 HydrophobicContact CG2-CG2 4.43Å; T422-L466 HydrophobicContact CG2-CD1 4.06Å; T422-N469 WeakPolarHBondContact OG1-CB 3.47Å; T422-N469 PolarHBondContact OG1-ND2 3.33Å; T422-N469 VanDerWaalsContact OG1-ND2 3.08Å; T422-L470 HydrophobicContact CG2-CD2 4.23Å
423	H	96.3	Very high	97.6	Very high	58 Å²	58	36.8 Å²	36.8	27%	0.269	18%	0.183	S	C	.	.	S	Bend	trans	-146.6	144.6	-177.5	177.4	-109.9	0	0	0	113.9	K385 V421 N425 N469	K385-H423 PolarHBondContact NZ-O 3.15Å; V421-H423 VanDerWaalsContact C-N 3.26Å; V421-H423 PolarHBondContact O-N 3.18Å; H423-N425 PolarHBondContact O-N 3.11Å; H423-N425 PolarHBondContact O-ND2 3.17Å; H423-N469 VanDerWaalsContact CB-ND2 3.34Å; H423-N469 WeakPolarHBondContact CB-ND2 3.38Å
424	R	92.7	Very high	97.7	Very high	130 Å²	130	37.6 Å²	37.6	49%	0.491	19%	0.185	S	C	.	.	S	Bend	trans	48.6	54.5	176.3	-74.6	176.7	-175.7	-177.1	0.4	112.7	D669	R424-D669 PolarHBondContact NH1-O 2.99Å; R424-D669 PolarHBondContact NH2-O 3.28Å
425	N	94.9	Very high	97.7	Very high	14 Å²	14	37.6 Å²	37.6	8%	0.075	19%	0.185	C	C	.	.	S	Bend	trans	-155.9	153.5	165.1	69.4	90.7	0	0	0	110.4	V382 K385 V421 H423 H427 S428	V382-N425 HydrophobicContact CG1-CB 4.05Å; K385-N425 HydrophobicContact CB-CB 3.88Å; K385-N425 HydrophobicContact CD-CB 4.11Å; V421-N425 PolarHBondContact O-ND2 3.01Å; H423-N425 PolarHBondContact O-N 3.11Å; H423-N425 PolarHBondContact O-ND2 3.17Å; N425-H427 PolarHBondContact O-N 3.1Å; N425-H427 VanDerWaalsContact OD1-C 3.27Å; N425-H427 WeakPolarHBondContact OD1-CA 3.45Å; N425-H427 PolarHBondContact OD1-N 3.5Å; N425-S428 PolarHBondContact N-OG 3.05Å; N425-S428 PolarHBondContact ND2-OG 3.38Å; N425-S428 WeakPolarHBondContact O-CB 3.21Å; N425-S428 PolarHBondContact O-N 3.09Å; N425-S428 PolarHBondContact O-OG 3.19Å; N425-S428 PolarHBondContact OD1-N 3.42Å; N425-S428 VanDerWaalsContact OD1-N 3.13Å
426	P	96.8	Very high	97.6	Very high	105 Å²	105	40.6 Å²	40.6	68%	0.682	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-26.4	-178.8	-28.4	34.7	0	0	0	115.1
427	H	97.7	Very high	97.6	Very high	60 Å²	60	43.5 Å²	43.5	28%	0.278	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	15.6	-177.8	-53.8	-77.7	0	0	0	113.6	S386 V389 E390 N425 N429 S430 A431	S386-H427 PolarHBondContact OG-CD2 2.95Å; V389-H427 HydrophobicContact CB-CB 3.93Å; V389-H427 HydrophobicContact CG1-CB 3.72Å; V389-H427 HydrophobicContact CG2-CB 4.28Å; E390-H427 IonicContact OE1-CD2 2.95Å; E390-H427 IonicContact OE1-CE1 3.15Å; E390-H427 IonicContact OE1-NE2 3.21Å; E390-H427 PolarHBondContact OE1-NE2 3.45Å; N425-H427 PolarHBondContact O-N 3.1Å; N425-H427 VanDerWaalsContact OD1-C 3.27Å; N425-H427 WeakPolarHBondContact OD1-CA 3.45Å; N425-H427 PolarHBondContact OD1-N 3.5Å; H427-N429 VanDerWaalsContact C-N 3.31Å; H427-N429 PolarHBondContact O-N 3.31Å; H427-S430 WeakPolarHBondContact O-CA 3.36Å; H427-S430 WeakPolarHBondContact O-CB 3.49Å; H427-S430 PolarHBondContact O-N 3.36Å; H427-A431 PolarHBondContact O-N 2.81Å
428	S	97.3	Very high	97.5	Very high	16 Å²	16	44.7 Å²	44.7	11%	0.112	22%	0.222	C	C	.	.	H	α-helix	trans	-56.5	-43.2	-177.7	-61.7	0	0	0	0	112.2	N425 S430 A431 I432	N425-S428 PolarHBondContact N-OG 3.05Å; N425-S428 PolarHBondContact ND2-OG 3.38Å; N425-S428 WeakPolarHBondContact O-CB 3.21Å; N425-S428 PolarHBondContact O-N 3.09Å; N425-S428 PolarHBondContact O-OG 3.19Å; N425-S428 PolarHBondContact OD1-N 3.42Å; N425-S428 VanDerWaalsContact OD1-N 3.13Å; S428-S430 VanDerWaalsContact C-N 3.34Å; S428-S430 PolarHBondContact O-N 3.16Å; S428-A431 WeakPolarHBondContact O-CB 3.48Å; S428-A431 PolarHBondContact O-N 3.3Å; S428-I432 VanDerWaalsContact O-CG1 3.28Å; S428-I432 WeakPolarHBondContact O-CG1 3.46Å; S428-I432 PolarHBondContact O-N 3.47Å
429	N	97.7	Very high	97.1	Very high	113 Å²	113	51.1 Å²	51.1	60%	0.604	26%	0.257	S	S	*	.	H	α-helix	trans	-66.3	-35.7	177.5	-70.6	-15.6	0	0	0	112.5	H427 I432 Y433	H427-N429 VanDerWaalsContact C-N 3.31Å; H427-N429 PolarHBondContact O-N 3.31Å; N429-I432 PolarHBondContact O-N 3.07Å; N429-Y433 WeakPolarHBondContact O-CB 3.5Å; N429-Y433 PolarHBondContact O-N 2.84Å
430	S	98.1	Very high	97.1	Very high	53 Å²	53	49.4 Å²	49.4	37%	0.371	25%	0.25	S	S	.	.	H	α-helix	trans	-64.9	-43.2	173.3	-167	0	0	0	0	110.7	H427 S428 I432 Y433 E434	H427-S430 WeakPolarHBondContact O-CA 3.36Å; H427-S430 WeakPolarHBondContact O-CB 3.49Å; H427-S430 PolarHBondContact O-N 3.36Å; S428-S430 VanDerWaalsContact C-N 3.34Å; S428-S430 PolarHBondContact O-N 3.16Å; S430-I432 PolarHBondContact O-N 2.9Å; S430-Y433 WeakPolarHBondContact O-CB 3.32Å; S430-Y433 PolarHBondContact O-N 2.72Å; S430-E434 WeakPolarHBondContact O-CG 3.43Å; S430-E434 PolarHBondContact O-N 3.41Å
431	A	98.6	Very high	97.1	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-62.4	-43.6	176.2	0	0	0	0	0	112	V389 V394 V421 T422 H427 S428 Y433 E434 V435	V389-A431 HydrophobicContact CG1-CB 4.39Å; V389-A431 HydrophobicContact CG2-CB 3.85Å; V394-A431 HydrophobicContact CG2-CB 4.03Å; V421-A431 HydrophobicContact CG2-CB 4.19Å; V421-A431 WeakPolarHBondContact O-CB 3.32Å; T422-A431 HydrophobicContact CG2-CB 4.11Å; H427-A431 PolarHBondContact O-N 2.81Å; S428-A431 WeakPolarHBondContact O-CB 3.48Å; S428-A431 PolarHBondContact O-N 3.3Å; A431-Y433 VanDerWaalsContact C-N 3.34Å; A431-Y433 PolarHBondContact O-N 3.49Å; A431-E434 PolarHBondContact O-N 3.36Å; A431-V435 WeakPolarHBondContact O-CG2 3.46Å; A431-V435 PolarHBondContact O-N 2.93Å
432	I	98.5	Very high	97.1	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-61.3	-44.4	175.5	-65.3	165.3	0	0	0	110.4	T422 S428 N429 S430 E434 V435 R436 N469 L470 T472 V473 T476	T422-I432 HydrophobicContact CG2-CG1 3.87Å; S428-I432 VanDerWaalsContact O-CG1 3.28Å; S428-I432 WeakPolarHBondContact O-CG1 3.46Å; S428-I432 PolarHBondContact O-N 3.47Å; N429-I432 PolarHBondContact O-N 3.07Å; S430-I432 PolarHBondContact O-N 2.9Å; I432-E434 PolarHBondContact O-N 3.08Å; I432-V435 PolarHBondContact O-N 2.93Å; I432-R436 WeakPolarHBondContact O-CB 3.46Å; I432-R436 PolarHBondContact O-N 3.43Å; I432-R436 VanDerWaalsContact O-N 3.07Å; I432-N469 WeakPolarHBondContact CD1-O 3.49Å; I432-L470 HydrophobicContact CB-CD2 4.3Å; I432-L470 HydrophobicContact CG1-CD2 4.18Å; I432-L470 HydrophobicContact CG2-CD2 3.95Å; I432-T472 WeakPolarHBondContact CD1-OG1 3.35Å; I432-V473 HydrophobicContact CB-CG2 4.34Å; I432-V473 HydrophobicContact CD1-CG2 3.96Å; I432-V473 HydrophobicContact CG2-CB 4.09Å; I432-V473 HydrophobicContact CG2-CG2 3.78Å; I432-T476 HydrophobicContact CG2-CG2 4.39Å
433	Y	98.2	Very high	97.1	Very high	139 Å²	139	53.1 Å²	53.1	55%	0.545	28%	0.277	S	S	.	.	H	α-helix	trans	-58.5	-46.9	175.1	176.2	-91.6	0	0	0	111.6	N429 S430 A431 R436 T437	N429-Y433 WeakPolarHBondContact O-CB 3.5Å; N429-Y433 PolarHBondContact O-N 2.84Å; S430-Y433 WeakPolarHBondContact O-CB 3.32Å; S430-Y433 PolarHBondContact O-N 2.72Å; A431-Y433 VanDerWaalsContact C-N 3.34Å; A431-Y433 PolarHBondContact O-N 3.49Å; Y433-R436 WeakPolarHBondContact O-CB 3.49Å; Y433-R436 PolarHBondContact O-N 2.87Å; Y433-T437 HydrophobicContact CD1-CG2 4.22Å; Y433-T437 HydrophobicContact CD2-CG2 4.29Å; Y433-T437 HydrophobicContact CE1-CG2 3.77Å; Y433-T437 HydrophobicContact CE2-CG2 3.86Å; Y433-T437 HydrophobicContact CG-CG2 4.46Å; Y433-T437 WeakPolarHBondContact O-CG2 3.2Å; Y433-T437 PolarHBondContact O-N 3.27Å; Y433-T437 PolarHBondContact O-OG1 3.27Å; Y433-T437 VanDerWaalsContact O-OG1 3.09Å
434	E	98.3	Very high	97.2	Very high	37 Å²	37	50.4 Å²	50.4	17%	0.173	26%	0.264	C	S	.	.	H	α-helix	trans	-64.4	-40.8	179.5	-78	-179.2	-121.1	0	0	113.1	V394 S430 A431 I432 R436 T437 S438	V394-E434 HydrophobicContact CB-CB 4.06Å; V394-E434 HydrophobicContact CG1-CB 3.71Å; S430-E434 WeakPolarHBondContact O-CG 3.43Å; S430-E434 PolarHBondContact O-N 3.41Å; A431-E434 PolarHBondContact O-N 3.36Å; I432-E434 PolarHBondContact O-N 3.08Å; E434-R436 VanDerWaalsContact C-N 3.27Å; E434-R436 PolarHBondContact O-N 3.15Å; E434-T437 PolarHBondContact O-N 3.22Å; E434-T437 PolarHBondContact O-OG1 2.6Å; E434-S438 VanDerWaalsContact O-CB 3.26Å; E434-S438 WeakPolarHBondContact O-CB 3.28Å; E434-S438 PolarHBondContact O-N 3.26Å; E434-S438 PolarHBondContact O-OG 3.36Å
435	V	98.6	Very high	97.4	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-58.7	-43.7	173.9	172.3	0	0	0	0	110.4	V394 L418 T422 A431 I432 S438 L441 I444 L470	V394-V435 HydrophobicContact CG1-CG2 3.67Å; L418-V435 HydrophobicContact CD2-CG2 4.07Å; T422-V435 HydrophobicContact CG2-CG2 4.43Å; A431-V435 WeakPolarHBondContact O-CG2 3.46Å; A431-V435 PolarHBondContact O-N 2.93Å; I432-V435 PolarHBondContact O-N 2.93Å; V435-S438 PolarHBondContact O-N 3.39Å; V435-L441 HydrophobicContact CG1-CD2 4.2Å; V435-I444 HydrophobicContact CG1-CD1 4.08Å; V435-L470 HydrophobicContact CB-CD2 3.99Å; V435-L470 HydrophobicContact CG1-CD1 4.15Å; V435-L470 HydrophobicContact CG1-CD2 3.84Å; V435-L470 HydrophobicContact CG2-CD2 4.4Å
436	R	97.5	Very high	97.6	Very high	63 Å²	63	45.5 Å²	45.5	24%	0.238	25%	0.251	C	S	.	.	H	α-helix	trans	-64.9	-50	179.7	-167.4	177.7	67.6	82.1	8.7	112.1	I432 Y433 E434 S438 D439 L441 E479	I432-R436 WeakPolarHBondContact O-CB 3.46Å; I432-R436 PolarHBondContact O-N 3.43Å; I432-R436 VanDerWaalsContact O-N 3.07Å; Y433-R436 WeakPolarHBondContact O-CB 3.49Å; Y433-R436 PolarHBondContact O-N 2.87Å; E434-R436 VanDerWaalsContact C-N 3.27Å; E434-R436 PolarHBondContact O-N 3.15Å; R436-S438 PolarHBondContact O-N 3.29Å; R436-D439 PolarHBondContact O-N 2.95Å; R436-L441 HydrophobicContact CG-CD1 4.13Å; R436-E479 WeakPolarHBondContact CD-OE1 3.47Å; R436-E479 WeakPolarHBondContact CD-OE2 3.16Å; R436-E479 WeakPolarHBondContact CG-OE2 3.45Å; R436-E479 IonicContact CZ-OE1 2.84Å; R436-E479 IonicContact NH1-OE1 2.78Å; R436-E479 PolarHBondContact NH1-OE1 2.92Å
437	T	97.1	Very high	97.6	Very high	65 Å²	65	40.5 Å²	40.5	40%	0.399	22%	0.219	S	C	.	.	H	α-helix	trans	-75.7	-3.1	-179	58.3	0	0	0	0	114.4	Y433 E434	Y433-T437 HydrophobicContact CD1-CG2 4.22Å; Y433-T437 HydrophobicContact CD2-CG2 4.29Å; Y433-T437 HydrophobicContact CE1-CG2 3.77Å; Y433-T437 HydrophobicContact CE2-CG2 3.86Å; Y433-T437 HydrophobicContact CG-CG2 4.46Å; Y433-T437 WeakPolarHBondContact O-CG2 3.2Å; Y433-T437 PolarHBondContact O-N 3.27Å; Y433-T437 PolarHBondContact O-OG1 3.27Å; Y433-T437 VanDerWaalsContact O-OG1 3.09Å; E434-T437 PolarHBondContact O-N 3.22Å; E434-T437 PolarHBondContact O-OG1 2.6Å
438	S	96.8	Very high	97.6	Very high	24 Å²	24	38.5 Å²	38.5	17%	0.168	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	16.9	173.9	-57.6	0	0	0	0	112.4	E434 V435 R436 T440	E434-S438 VanDerWaalsContact O-CB 3.26Å; E434-S438 WeakPolarHBondContact O-CB 3.28Å; E434-S438 PolarHBondContact O-N 3.26Å; E434-S438 PolarHBondContact O-OG 3.36Å; V435-S438 PolarHBondContact O-N 3.39Å; R436-S438 PolarHBondContact O-N 3.29Å; S438-T440 PolarHBondContact O-N 3.09Å; S438-T440 PolarHBondContact O-OG1 3.48Å
439	D	90.8	Very high	97.5	Very high	136 Å²	136	43.9 Å²	43.9	73%	0.727	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	51	29	-179.6	-57.8	-42.2	0	0	0	113.9	R436	R436-D439 PolarHBondContact O-N 2.95Å
440	T	98.3	Very high	97.3	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-86.6	-16	-171.9	-51.6	0	0	0	0	112.5	C398 L401 S438 S442 T443 I444	C398-T440 HydrophobicContact CB-CG2 4.25Å; C398-T440 WeakPolarHBondContact CB-OG1 3.28Å; C398-T440 PolarHBondContact SG-OG1 3.18Å; L401-T440 HydrophobicContact CD2-CG2 3.86Å; S438-T440 PolarHBondContact O-N 3.09Å; S438-T440 PolarHBondContact O-OG1 3.48Å; T440-S442 VanDerWaalsContact C-N 3.34Å; T440-S442 PolarHBondContact O-N 3.15Å; T440-T443 WeakPolarHBondContact O-CB 3.4Å; T440-T443 PolarHBondContact O-N 3.09Å; T440-T443 VanDerWaalsContact O-N 3.09Å; T440-I444 HydrophobicContact CG2-CD1 4.21Å; T440-I444 HydrophobicContact CG2-CG1 4.26Å; T440-I444 WeakPolarHBondContact O-CG1 3.28Å; T440-I444 PolarHBondContact O-N 2.96Å
441	L	98.4	Very high	97	Very high	9 Å²	9	41.4 Å²	41.4	5%	0.047	21%	0.213	C	C	.	.	H	α-helix	trans	-60.4	-41	-177.9	-60.1	-170.1	0	0	0	112.4	V435 R436 T443 I444 A445 L470 T476 E479 L480 L483	V435-L441 HydrophobicContact CG1-CD2 4.2Å; R436-L441 HydrophobicContact CG-CD1 4.13Å; L441-T443 VanDerWaalsContact C-N 3.32Å; L441-T443 PolarHBondContact O-N 2.75Å; L441-I444 HydrophobicContact CD2-CD1 4.35Å; L441-I444 WeakPolarHBondContact O-CB 3.45Å; L441-I444 PolarHBondContact O-N 3.37Å; L441-A445 PolarHBondContact O-N 3.36Å; L441-L470 HydrophobicContact CD2-CD1 3.92Å; L441-T476 HydrophobicContact CD1-CG2 4.31Å; L441-T476 HydrophobicContact CD2-CG2 4.43Å; L441-E479 HydrophobicContact CD1-CB 3.84Å; L441-E479 VanDerWaalsContact CD1-OE2 3.23Å; L441-E479 WeakPolarHBondContact CD1-OE2 3.28Å; L441-L480 HydrophobicContact CD2-CD2 4.19Å; L441-L483 HydrophobicContact CB-CD1 3.68Å
442	S	97.8	Very high	96.6	Very high	71 Å²	71	48.7 Å²	48.7	50%	0.497	25%	0.247	S	C	.	.	H	α-helix	trans	-64.6	-36.9	175.6	-54.5	0	0	0	0	112.1	T440 A445 S446	T440-S442 VanDerWaalsContact C-N 3.34Å; T440-S442 PolarHBondContact O-N 3.15Å; S442-A445 PolarHBondContact O-N 3.5Å; S442-S446 WeakPolarHBondContact O-CB 3.47Å; S442-S446 PolarHBondContact O-N 3.45Å
443	T	98.4	Very high	96.2	Very high	22 Å²	22	49.4 Å²	49.4	14%	0.135	25%	0.25	C	S	.	.	H	α-helix	trans	-63.5	-45.7	172.1	-56.6	0	0	0	0	110.8	L401 C402 T440 L441 A445 S446 L447	L401-T443 HydrophobicContact CD2-CG2 4.5Å; L401-T443 HydrophobicContact CG-CG2 4.12Å; C402-T443 PolarHBondContact SG-OG1 2.63Å; T440-T443 WeakPolarHBondContact O-CB 3.4Å; T440-T443 PolarHBondContact O-N 3.09Å; T440-T443 VanDerWaalsContact O-N 3.09Å; L441-T443 VanDerWaalsContact C-N 3.32Å; L441-T443 PolarHBondContact O-N 2.75Å; T443-A445 PolarHBondContact O-N 3.03Å; T443-S446 WeakPolarHBondContact O-CB 3.4Å; T443-S446 PolarHBondContact O-N 2.89Å; T443-S446 VanDerWaalsContact O-N 3.13Å; T443-S446 PolarHBondContact O-OG 2.98Å; T443-L447 WeakPolarHBondContact O-CG 3.44Å; T443-L447 PolarHBondContact O-N 3.04Å
444	I	98.5	Very high	95.6	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-57.6	-47	176.9	-70.4	168.2	0	0	0	110.9	L401 V435 T440 L441 S446 L447 V463 L466 V467 L470	L401-I444 HydrophobicContact CD2-CG1 4.33Å; V435-I444 HydrophobicContact CG1-CD1 4.08Å; T440-I444 HydrophobicContact CG2-CD1 4.21Å; T440-I444 HydrophobicContact CG2-CG1 4.26Å; T440-I444 WeakPolarHBondContact O-CG1 3.28Å; T440-I444 PolarHBondContact O-N 2.96Å; L441-I444 HydrophobicContact CD2-CD1 4.35Å; L441-I444 WeakPolarHBondContact O-CB 3.45Å; L441-I444 PolarHBondContact O-N 3.37Å; I444-S446 VanDerWaalsContact C-N 3.32Å; I444-S446 PolarHBondContact O-N 3.46Å; I444-L447 WeakPolarHBondContact O-CB 3.47Å; I444-L447 PolarHBondContact O-N 3.08Å; I444-V463 HydrophobicContact CG2-CG1 3.99Å; I444-L466 HydrophobicContact CD1-CD2 3.69Å; I444-L466 HydrophobicContact CD1-CG 4.32Å; I444-L466 HydrophobicContact CG1-CD2 4.24Å; I444-V467 HydrophobicContact CG2-CG2 3.78Å; I444-L470 HydrophobicContact CD1-CD1 3.74Å
445	A	98.2	Very high	95.1	Very high	6 Å²	6	47.9 Å²	47.9	5%	0.05	26%	0.26	C	S	.	.	H	α-helix	trans	-60	-42.2	175.8	0	0	0	0	0	111.7	L441 S442 T443 L447 F448 L483 V485	L441-A445 PolarHBondContact O-N 3.36Å; S442-A445 PolarHBondContact O-N 3.5Å; T443-A445 PolarHBondContact O-N 3.03Å; A445-L447 PolarHBondContact O-N 3.15Å; A445-F448 PolarHBondContact O-N 3.08Å; A445-L483 HydrophobicContact CB-CB 4.02Å; A445-L483 HydrophobicContact CB-CD1 4.39Å; A445-V485 HydrophobicContact CB-CG2 3.79Å
446	S	97.5	Very high	94.9	Very high	36 Å²	36	47.9 Å²	47.9	25%	0.252	26%	0.26	S	S	.	.	H	α-helix	trans	-61.9	-27.2	178.9	81.1	0	0	0	0	113.8	S442 T443 I444 F448 L449 K450	S442-S446 WeakPolarHBondContact O-CB 3.47Å; S442-S446 PolarHBondContact O-N 3.45Å; T443-S446 WeakPolarHBondContact O-CB 3.4Å; T443-S446 PolarHBondContact O-N 2.89Å; T443-S446 VanDerWaalsContact O-N 3.13Å; T443-S446 PolarHBondContact O-OG 2.98Å; I444-S446 VanDerWaalsContact C-N 3.32Å; I444-S446 PolarHBondContact O-N 3.46Å; S446-F448 VanDerWaalsContact C-N 3.33Å; S446-F448 PolarHBondContact O-N 3.47Å; S446-L449 PolarHBondContact O-N 3.33Å; S446-K450 VanDerWaalsContact O-CB 3.23Å; S446-K450 WeakPolarHBondContact O-CB 3.45Å; S446-K450 PolarHBondContact O-N 2.9Å
447	L	98	Very high	94.7	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-66.2	-34.7	178.6	-63.1	172.7	0	0	0	111.9	L401 A411 T443 I444 A445 L449 Y451 L459 V463	L401-L447 HydrophobicContact CD1-CD1 4.31Å; A411-L447 HydrophobicContact CB-CD2 4.46Å; T443-L447 WeakPolarHBondContact O-CG 3.44Å; T443-L447 PolarHBondContact O-N 3.04Å; I444-L447 WeakPolarHBondContact O-CB 3.47Å; I444-L447 PolarHBondContact O-N 3.08Å; A445-L447 PolarHBondContact O-N 3.15Å; L447-L449 VanDerWaalsContact C-N 3.33Å; L447-Y451 HydrophobicContact CD2-CD2 4.37Å; L447-Y451 HydrophobicContact CD2-CE2 3.87Å; L447-Y451 WeakPolarHBondContact O-CD2 3.49Å; L447-Y451 PolarHBondContact O-N 2.93Å; L447-L459 HydrophobicContact CD2-CD2 4.44Å; L447-V463 HydrophobicContact CB-CG2 4.23Å; L447-V463 HydrophobicContact CD1-CG2 3.67Å
448	F	97.3	Very high	94.6	Very high	17 Å²	17	42.4 Å²	42.4	8%	0.075	23%	0.234	C	C	.	.	H	α-helix	trans	-67.1	-36.6	174.8	-70.7	-79.2	0	0	0	112.3	A445 S446 L460 V463 V464 V467 V485 M488 V489 I492	A445-F448 PolarHBondContact O-N 3.08Å; S446-F448 VanDerWaalsContact C-N 3.33Å; S446-F448 PolarHBondContact O-N 3.47Å; F448-L460 HydrophobicContact CD1-CD2 4.01Å; F448-L460 HydrophobicContact CE1-CD2 4.47Å; F448-V463 HydrophobicContact CD2-CG1 4.05Å; F448-V463 HydrophobicContact CE1-CG1 4.2Å; F448-V463 HydrophobicContact CE2-CG1 3.36Å; F448-V463 HydrophobicContact CZ-CB 4.32Å; F448-V463 HydrophobicContact CZ-CG1 3.45Å; F448-V463 VanDerWaalsContact CZ-CG1 3.45Å; F448-V464 HydrophobicContact CE1-CG2 3.76Å; F448-V464 HydrophobicContact CZ-CG2 4.08Å; F448-V467 HydrophobicContact CE2-CG2 3.97Å; F448-V467 HydrophobicContact CZ-CG2 4.13Å; F448-V485 HydrophobicContact CE2-CG1 4.13Å; F448-M488 HydrophobicContact CB-CB 3.96Å; F448-M488 HydrophobicContact CB-CG 4.11Å; F448-M488 HydrophobicContact CB-SD 3.61Å; F448-M488 HydrophobicContact CD1-CB 4.23Å; F448-M488 HydrophobicContact CD2-CB 4.35Å; F448-M488 HydrophobicContact CD2-SD 4.09Å; F448-M488 HydrophobicContact CG-CB 3.95Å; F448-M488 HydrophobicContact CG-SD 4.12Å; F448-V489 HydrophobicContact CE1-CG2 4.31Å; F448-V489 HydrophobicContact CZ-CG2 3.97Å; F448-I492 HydrophobicContact CD1-CD1 4.44Å; F448-I492 HydrophobicContact CD1-CG1 3.89Å; F448-I492 HydrophobicContact CE1-CG1 4.05Å
449	L	95.1	Very high	94.6	Very high	130 Å²	130	41.3 Å²	41.3	68%	0.681	23%	0.226	S	C	*	.	H	α-helix	trans	-79	-35	-176.8	-64.4	177.1	0	0	0	112.4	S446 L447 M488	S446-L449 PolarHBondContact O-N 3.33Å; L447-L449 VanDerWaalsContact C-N 3.33Å; L449-M488 HydrophobicContact CD1-CE 3.86Å; L449-M488 HydrophobicContact CD2-CE 3.83Å; L449-M488 HydrophobicContact CD2-SD 4.26Å; L449-M488 HydrophobicContact CG-CE 3.81Å; L449-M488 HydrophobicContact CG-SD 4.16Å
450	K	93.9	Very high	94.9	Very high	81 Å²	81	34.8 Å²	34.8	35%	0.352	19%	0.191	S	C	.	.	H	α-helix	trans	-76.5	-37.2	-173.5	-172.2	179.1	-59.2	176.5	0	112.8	S405 D406 S446	S405-K450 VanDerWaalsContact C-NZ 3.3Å; S405-K450 WeakPolarHBondContact O-CD 3.48Å; S405-K450 PolarHBondContact O-NZ 2.96Å; S405-K450 PolarHBondContact OG-NZ 3.24Å; S405-K450 VanDerWaalsContact OG-NZ 3.08Å; D406-K450 WeakPolarHBondContact OD1-CD 3.23Å; D406-K450 WeakPolarHBondContact OD1-CE 3.46Å; D406-K450 IonicContact OD1-NZ 3.99Å; D406-K450 PolarHBondContact OD1-NZ 3.16Å; D406-K450 IonicContact OD2-NZ 2.73Å; S446-K450 VanDerWaalsContact O-CB 3.23Å; S446-K450 WeakPolarHBondContact O-CB 3.45Å; S446-K450 PolarHBondContact O-N 2.9Å
451	Y	92.4	Very high	94.9	Very high	32 Å²	32	35.5 Å²	35.5	13%	0.125	19%	0.194	C	C	.	.	S	Bend	trans	-103.7	131	-169.5	-70.1	-73.3	0	0	0	112.5	S405 D406 R407 Q408 L447 A456 L459	S405-Y451 PolarHBondContact O-OH 3.33Å; D406-Y451 WeakPolarHBondContact CA-OH 3.48Å; D406-Y451 PolarHBondContact O-OH 3.11Å; R407-Y451 PolarHBondContact N-OH 2.93Å; R407-Y451 VanDerWaalsContact N-OH 3.11Å; Q408-Y451 HydrophobicContact CB-CD1 4.41Å; Q408-Y451 HydrophobicContact CB-CE1 3.76Å; Q408-Y451 PolarHBondContact N-OH 2.71Å; Q408-Y451 VanDerWaalsContact N-OH 3.16Å; L447-Y451 HydrophobicContact CD2-CD2 4.37Å; L447-Y451 HydrophobicContact CD2-CE2 3.87Å; L447-Y451 WeakPolarHBondContact O-CD2 3.49Å; L447-Y451 PolarHBondContact O-N 2.93Å; Y451-A456 VanDerWaalsContact CB-CB 3.5Å; Y451-A456 HydrophobicContact CD1-CB 4.26Å; Y451-A456 HydrophobicContact CG-CB 4.09Å; Y451-L459 HydrophobicContact CD2-CD2 3.5Å; Y451-L459 VanDerWaalsContact CD2-CD2 3.5Å; Y451-L459 HydrophobicContact CE2-CD2 3.51Å; Y451-L459 HydrophobicContact CG-CD2 4.1Å
452	Q	89	Confident	94.9	Very high	154 Å²	154	35.2 Å²	35.2	72%	0.72	19%	0.193	S	C	*	.			trans	-70.1	137.2	174	-65.8	-178	-4.8	0	0	110.3	V454 S455 A456	Q452-V454 PolarHBondContact O-N 3.09Å; Q452-S455 PolarHBondContact O-N 3.3Å; Q452-S455 PolarHBondContact O-OG 3.11Å; Q452-A456 WeakPolarHBondContact O-CB 3.41Å; Q452-A456 PolarHBondContact O-N 3.12Å
453	F	89.5	Confident	94.9	Very high	16 Å²	16	31.9 Å²	31.9	7%	0.07	17%	0.17	C	C	.	.	H	α-helix	trans	-47	-55.8	-175.5	174.7	-105.5	0	0	0	114	S455 A456 L457 L460 I492 Q495 T496 L517	F453-S455 PolarHBondContact O-N 3.47Å; F453-A456 PolarHBondContact O-N 3.14Å; F453-L457 HydrophobicContact CD1-CD1 4.48Å; F453-L457 HydrophobicContact CE1-CD1 4.24Å; F453-L457 HydrophobicContact CE2-CD2 4.21Å; F453-L457 HydrophobicContact CE2-CG 4.2Å; F453-L457 HydrophobicContact CZ-CD1 4.29Å; F453-L457 HydrophobicContact CZ-CD2 3.93Å; F453-L457 HydrophobicContact CZ-CG 4.2Å; F453-L457 WeakPolarHBondContact O-CD1 3.49Å; F453-L457 PolarHBondContact O-N 3.41Å; F453-L460 HydrophobicContact CD2-CD1 4.26Å; F453-I492 HydrophobicContact CD2-CD1 4.15Å; F453-I492 HydrophobicContact CD2-CG2 4.42Å; F453-I492 HydrophobicContact CE2-CG2 4.21Å; F453-Q495 HydrophobicContact CD1-CB 4.07Å; F453-Q495 HydrophobicContact CD2-CB 4.01Å; F453-Q495 HydrophobicContact CE1-CB 4.26Å; F453-Q495 HydrophobicContact CE2-CB 4.2Å; F453-Q495 HydrophobicContact CG-CB 3.95Å; F453-Q495 HydrophobicContact CZ-CB 4.33Å; F453-T496 VanDerWaalsContact CE2-OG1 3.29Å; F453-T496 WeakPolarHBondContact CE2-OG1 3.32Å; F453-T496 WeakPolarHBondContact CZ-OG1 3.32Å; F453-L517 HydrophobicContact CE1-CD2 4.27Å
454	V	86.7	Confident	94.9	Very high	84 Å²	84	30.8 Å²	30.8	51%	0.509	16%	0.163	S	C	.	.	H	α-helix	trans	-64.4	-37	-170.8	177.2	0	0	0	0	112.6	Q452 L457 L517 E518	Q452-V454 PolarHBondContact O-N 3.09Å; V454-L457 WeakPolarHBondContact O-CD1 3.36Å; V454-L517 HydrophobicContact CG1-CD1 4.26Å; V454-L517 HydrophobicContact CG1-CD2 4.19Å; V454-L517 HydrophobicContact CG2-CD2 4.43Å; V454-E518 WeakPolarHBondContact O-CG 3.48Å
455	S	87.9	Confident	94.9	Very high	60 Å²	60	30.9 Å²	30.9	42%	0.42	16%	0.164	S	C	.	.	H	α-helix	trans	-86.8	-13.4	-177.5	53.2	0	0	0	0	113.7	Q408 Q452 F453	Q408-S455 PolarHBondContact NE2-O 2.94Å; Q408-S455 VanDerWaalsContact NE2-O 3.09Å; Q408-S455 PolarHBondContact OE1-O 3.2Å; Q452-S455 PolarHBondContact O-N 3.3Å; Q452-S455 PolarHBondContact O-OG 3.11Å; F453-S455 PolarHBondContact O-N 3.47Å
456	A	93.3	Very high	94.9	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-122.9	14.5	-169.6	0	0	0	0	0	115.6	Q408 Y451 Q452 F453 P458 L459 L460	Q408-A456 VanDerWaalsContact OE1-CB 3.24Å; Y451-A456 VanDerWaalsContact CB-CB 3.5Å; Y451-A456 HydrophobicContact CD1-CB 4.26Å; Y451-A456 HydrophobicContact CG-CB 4.09Å; Q452-A456 WeakPolarHBondContact O-CB 3.41Å; Q452-A456 PolarHBondContact O-N 3.12Å; F453-A456 PolarHBondContact O-N 3.14Å; A456-P458 VanDerWaalsContact C-CD 3.48Å; A456-L459 PolarHBondContact O-N 3.07Å; A456-L459 VanDerWaalsContact O-N 3.08Å; A456-L460 HydrophobicContact CB-CD1 4.22Å; A456-L460 HydrophobicContact CB-CG 4.27Å; A456-L460 WeakPolarHBondContact O-CG 3.38Å; A456-L460 PolarHBondContact O-N 3.48Å
457	L	94.2	Very high	95	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-49.8	-43.1	-177.9	-86.4	106.8	0	0	0	115	F453 V454 L459 L460 K461 L517 E518 V520 L522	F453-L457 HydrophobicContact CD1-CD1 4.48Å; F453-L457 HydrophobicContact CE1-CD1 4.24Å; F453-L457 HydrophobicContact CE2-CD2 4.21Å; F453-L457 HydrophobicContact CE2-CG 4.2Å; F453-L457 HydrophobicContact CZ-CD1 4.29Å; F453-L457 HydrophobicContact CZ-CD2 3.93Å; F453-L457 HydrophobicContact CZ-CG 4.2Å; F453-L457 WeakPolarHBondContact O-CD1 3.49Å; F453-L457 PolarHBondContact O-N 3.41Å; V454-L457 WeakPolarHBondContact O-CD1 3.36Å; L457-L459 PolarHBondContact O-N 3.09Å; L457-L460 PolarHBondContact O-N 3.2Å; L457-K461 VanDerWaalsContact O-CB 3.31Å; L457-K461 WeakPolarHBondContact O-CB 3.38Å; L457-K461 PolarHBondContact O-N 2.94Å; L457-L517 HydrophobicContact CD1-CB 4.29Å; L457-L517 HydrophobicContact CD1-CD2 3.48Å; L457-L517 VanDerWaalsContact CD1-CD2 3.48Å; L457-L517 HydrophobicContact CD1-CG 3.75Å; L457-E518 HydrophobicContact CB-CB 4.41Å; L457-V520 HydrophobicContact CB-CB 4.1Å; L457-V520 HydrophobicContact CB-CG2 3.96Å; L457-V520 HydrophobicContact CD2-CB 4.15Å; L457-V520 HydrophobicContact CD2-CG1 4.09Å; L457-L522 HydrophobicContact CD2-CD2 3.7Å
458	P	94.9	Very high	95	Very high	13 Å²	13	30.3 Å²	30.3	8%	0.084	16%	0.155	C	C	.	.	H	α-helix	trans	-60.7	-43.4	178.5	-25.5	35	0	0	0	113.3	E412 A456 S462 E518 V520	E412-P458 HydrophobicContact CG-CB 4.44Å; A456-P458 VanDerWaalsContact C-CD 3.48Å; P458-S462 PolarHBondContact O-N 3.36Å; P458-S462 VanDerWaalsContact O-N 3.15Å; P458-S462 PolarHBondContact O-OG 3.06Å; P458-E518 HydrophobicContact CG-CB 4.43Å; P458-V520 HydrophobicContact CB-CG2 4.42Å; P458-V520 HydrophobicContact CG-CG2 4.04Å
459	L	97.1	Very high	95.1	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-65.2	-49.7	174.3	171.8	62.4	0	0	0	110.3	Q408 A411 E412 C415 L447 Y451 A456 L457 K461 S462 V463	Q408-L459 HydrophobicContact CB-CD2 4.31Å; Q408-L459 HydrophobicContact CG-CB 3.78Å; Q408-L459 HydrophobicContact CG-CD2 3.84Å; Q408-L459 HydrophobicContact CG-CG 4.43Å; A411-L459 HydrophobicContact CB-CD1 3.91Å; A411-L459 HydrophobicContact CB-CD2 4.36Å; E412-L459 HydrophobicContact CB-CB 4.3Å; E412-L459 HydrophobicContact CB-CD1 4.26Å; C415-L459 HydrophobicContact CB-CD1 4.45Å; L447-L459 HydrophobicContact CD2-CD2 4.44Å; Y451-L459 HydrophobicContact CD2-CD2 3.5Å; Y451-L459 VanDerWaalsContact CD2-CD2 3.5Å; Y451-L459 HydrophobicContact CE2-CD2 3.51Å; Y451-L459 HydrophobicContact CG-CD2 4.1Å; A456-L459 PolarHBondContact O-N 3.07Å; A456-L459 VanDerWaalsContact O-N 3.08Å; L457-L459 PolarHBondContact O-N 3.09Å; L459-K461 VanDerWaalsContact C-N 3.31Å; L459-K461 PolarHBondContact O-N 3.42Å; L459-S462 CarbonylContact O-C 3.55Å; L459-S462 WeakPolarHBondContact O-CA 3.45Å; L459-S462 VanDerWaalsContact O-CB 3.28Å; L459-S462 WeakPolarHBondContact O-CB 3.32Å; L459-S462 PolarHBondContact O-N 3.02Å; L459-V463 HydrophobicContact CD1-CG2 3.77Å; L459-V463 HydrophobicContact CG-CG2 4.11Å; L459-V463 VanDerWaalsContact O-CG2 3.31Å; L459-V463 WeakPolarHBondContact O-CG2 3.28Å; L459-V463 PolarHBondContact O-N 3.33Å
460	L	97.8	Very high	95.3	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-61	-38.1	-179	-67.4	172.3	0	0	0	111.9	F448 F453 A456 L457 S462 V463 V464 I492 M525	F448-L460 HydrophobicContact CD1-CD2 4.01Å; F448-L460 HydrophobicContact CE1-CD2 4.47Å; F453-L460 HydrophobicContact CD2-CD1 4.26Å; A456-L460 HydrophobicContact CB-CD1 4.22Å; A456-L460 HydrophobicContact CB-CG 4.27Å; A456-L460 WeakPolarHBondContact O-CG 3.38Å; A456-L460 PolarHBondContact O-N 3.48Å; L457-L460 PolarHBondContact O-N 3.2Å; L460-S462 VanDerWaalsContact C-N 3.3Å; L460-S462 PolarHBondContact O-N 3.31Å; L460-V463 PolarHBondContact O-N 3.39Å; L460-V464 WeakPolarHBondContact O-CB 3.19Å; L460-V464 VanDerWaalsContact O-CG2 3.27Å; L460-V464 WeakPolarHBondContact O-CG2 3.45Å; L460-V464 PolarHBondContact O-N 3.08Å; L460-I492 HydrophobicContact CD1-CD1 3.98Å; L460-I492 HydrophobicContact CD2-CD1 4.4Å; L460-M525 HydrophobicContact CB-CE 4.31Å
461	K	97.1	Very high	95.5	Very high	14 Å²	14	19.8 Å²	19.8	6%	0.061	10%	0.104	C	C	.	.	H	α-helix	trans	-60.2	-40.9	171.6	-173.1	175.6	-172.8	170.7	0	111.3	L457 L459 G465 V520 D524 M525 L528	L457-K461 VanDerWaalsContact O-CB 3.31Å; L457-K461 WeakPolarHBondContact O-CB 3.38Å; L457-K461 PolarHBondContact O-N 2.94Å; L459-K461 VanDerWaalsContact C-N 3.31Å; L459-K461 PolarHBondContact O-N 3.42Å; K461-G465 PolarHBondContact O-N 3.11Å; K461-V520 HydrophobicContact CD-CG1 3.88Å; K461-V520 HydrophobicContact CD-CG2 4.37Å; K461-D524 IonicContact NZ-OD2 4Å; K461-D524 PolarHBondContact NZ-OD2 3.43Å; K461-M525 HydrophobicContact CB-SD 3.82Å; K461-M525 HydrophobicContact CG-SD 4.1Å; K461-L528 HydrophobicContact CG-CD2 3.71Å; K461-L528 VanDerWaalsContact O-CD2 3.23Å; K461-L528 WeakPolarHBondContact O-CD2 3.47Å
462	S	97.8	Very high	95.7	Very high	4 Å²	4	21.7 Å²	21.7	3%	0.028	12%	0.119	C	C	.	.	H	α-helix	trans	-65.8	-44.5	175.9	-56.8	0	0	0	0	111.7	S416 P458 L459 L460 G465 L466	S416-S462 WeakPolarHBondContact OG-CB 3.41Å; S416-S462 PolarHBondContact OG-OG 3.23Å; P458-S462 PolarHBondContact O-N 3.36Å; P458-S462 VanDerWaalsContact O-N 3.15Å; P458-S462 PolarHBondContact O-OG 3.06Å; L459-S462 CarbonylContact O-C 3.55Å; L459-S462 WeakPolarHBondContact O-CA 3.45Å; L459-S462 VanDerWaalsContact O-CB 3.28Å; L459-S462 WeakPolarHBondContact O-CB 3.32Å; L459-S462 PolarHBondContact O-N 3.02Å; L460-S462 VanDerWaalsContact C-N 3.3Å; L460-S462 PolarHBondContact O-N 3.31Å; S462-G465 PolarHBondContact O-N 2.86Å; S462-L466 PolarHBondContact O-N 3.03Å
463	V	98.5	Very high	96.1	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-68.1	-47.1	-179	179.7	0	0	0	0	111.6	C415 I444 L447 F448 L459 L460 G465 L466 V467	C415-V463 HydrophobicContact CB-CG2 4.33Å; I444-V463 HydrophobicContact CG2-CG1 3.99Å; L447-V463 HydrophobicContact CB-CG2 4.23Å; L447-V463 HydrophobicContact CD1-CG2 3.67Å; F448-V463 HydrophobicContact CD2-CG1 4.05Å; F448-V463 HydrophobicContact CE1-CG1 4.2Å; F448-V463 HydrophobicContact CE2-CG1 3.36Å; F448-V463 HydrophobicContact CZ-CB 4.32Å; F448-V463 HydrophobicContact CZ-CG1 3.45Å; F448-V463 VanDerWaalsContact CZ-CG1 3.45Å; L459-V463 HydrophobicContact CD1-CG2 3.77Å; L459-V463 HydrophobicContact CG-CG2 4.11Å; L459-V463 VanDerWaalsContact O-CG2 3.31Å; L459-V463 WeakPolarHBondContact O-CG2 3.28Å; L459-V463 PolarHBondContact O-N 3.33Å; L460-V463 PolarHBondContact O-N 3.39Å; V463-G465 VanDerWaalsContact C-N 3.29Å; V463-G465 PolarHBondContact O-N 3.18Å; V463-L466 WeakPolarHBondContact O-CB 3.24Å; V463-L466 PolarHBondContact O-N 3.18Å; V463-L466 VanDerWaalsContact O-N 3.14Å; V463-V467 HydrophobicContact CG1-CG2 4.45Å; V463-V467 WeakPolarHBondContact O-CG2 3.35Å; V463-V467 PolarHBondContact O-N 3.16Å
464	V	98.8	Very high	96.5	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-59.6	-42.5	176.4	174	0	0	0	0	110.6	F448 L460 L466 V467 R468 V489 I492 M525 L528 T529 A532	F448-V464 HydrophobicContact CE1-CG2 3.76Å; F448-V464 HydrophobicContact CZ-CG2 4.08Å; L460-V464 WeakPolarHBondContact O-CB 3.19Å; L460-V464 VanDerWaalsContact O-CG2 3.27Å; L460-V464 WeakPolarHBondContact O-CG2 3.45Å; L460-V464 PolarHBondContact O-N 3.08Å; V464-L466 VanDerWaalsContact C-N 3.35Å; V464-L466 PolarHBondContact O-N 3Å; V464-V467 PolarHBondContact O-N 3.27Å; V464-R468 PolarHBondContact O-N 3.16Å; V464-V489 HydrophobicContact CG1-CG1 4.46Å; V464-I492 HydrophobicContact CG2-CG2 4.38Å; V464-M525 HydrophobicContact CB-CE 4.5Å; V464-M525 HydrophobicContact CG2-CE 3.93Å; V464-L528 HydrophobicContact CB-CD2 4.26Å; V464-L528 HydrophobicContact CB-CG 4.46Å; V464-L528 HydrophobicContact CG1-CD2 4.23Å; V464-L528 HydrophobicContact CG1-CG 3.89Å; V464-T529 HydrophobicContact CG1-CG2 3.91Å; V464-T529 HydrophobicContact CG2-CG2 4.3Å; V464-A532 HydrophobicContact CG1-CB 3.9Å
465	G	98.5	Very high	97	Very high	2 Å²	2	21.2 Å²	21.2	2%	0.021	12%	0.12	C	C	.	.	H	α-helix	trans	-65.1	-36.8	176.4	0	0	0	0	0	113.4	K461 S462 V463 N469	K461-G465 PolarHBondContact O-N 3.11Å; S462-G465 PolarHBondContact O-N 2.86Å; V463-G465 VanDerWaalsContact C-N 3.29Å; V463-G465 PolarHBondContact O-N 3.18Å; G465-N469 VanDerWaalsContact O-CG 3.28Å; G465-N469 PolarHBondContact O-N 3.36Å; G465-N469 PolarHBondContact O-ND2 2.94Å; G465-N469 PolarHBondContact O-OD1 3.13Å
466	L	98.7	Very high	97.5	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-64.8	-48.1	172.3	176.4	56.9	0	0	0	111	L418 R419 T422 I444 S462 V463 V464 R468 N469 L470	L418-L466 HydrophobicContact CB-CD1 3.9Å; L418-L466 HydrophobicContact CB-CD2 3.89Å; L418-L466 HydrophobicContact CD1-CD2 4.22Å; R419-L466 HydrophobicContact CB-CB 4.17Å; T422-L466 HydrophobicContact CG2-CD1 4.06Å; I444-L466 HydrophobicContact CD1-CD2 3.69Å; I444-L466 HydrophobicContact CD1-CG 4.32Å; I444-L466 HydrophobicContact CG1-CD2 4.24Å; S462-L466 PolarHBondContact O-N 3.03Å; V463-L466 WeakPolarHBondContact O-CB 3.24Å; V463-L466 PolarHBondContact O-N 3.18Å; V463-L466 VanDerWaalsContact O-N 3.14Å; V464-L466 VanDerWaalsContact C-N 3.35Å; V464-L466 PolarHBondContact O-N 3Å; L466-R468 PolarHBondContact O-N 3.14Å; L466-N469 WeakPolarHBondContact O-CB 3.46Å; L466-N469 PolarHBondContact O-N 2.87Å; L466-N469 VanDerWaalsContact O-N 3.08Å; L466-L470 HydrophobicContact CD1-CD1 4.07Å; L466-L470 HydrophobicContact CD1-CD2 4.31Å; L466-L470 HydrophobicContact CD1-CG 3.96Å; L466-L470 HydrophobicContact CG-CD1 3.87Å; L466-L470 HydrophobicContact CG-CG 4.23Å; L466-L470 VanDerWaalsContact O-CG 3.31Å; L466-L470 WeakPolarHBondContact O-CG 3.29Å; L466-L470 PolarHBondContact O-N 2.86Å
467	V	98.8	Very high	97.7	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-57	-46.7	177.4	167.8	0	0	0	0	111.2	I444 F448 V463 V464 N469 L470 S471 L480 V485 V489 M536	I444-V467 HydrophobicContact CG2-CG2 3.78Å; F448-V467 HydrophobicContact CE2-CG2 3.97Å; F448-V467 HydrophobicContact CZ-CG2 4.13Å; V463-V467 HydrophobicContact CG1-CG2 4.45Å; V463-V467 WeakPolarHBondContact O-CG2 3.35Å; V463-V467 PolarHBondContact O-N 3.16Å; V464-V467 PolarHBondContact O-N 3.27Å; V467-N469 PolarHBondContact O-N 3.1Å; V467-L470 PolarHBondContact O-N 3.3Å; V467-S471 WeakPolarHBondContact O-CB 3.49Å; V467-S471 PolarHBondContact O-N 2.98Å; V467-S471 PolarHBondContact O-OG 3.48Å; V467-L480 HydrophobicContact CG1-CD1 4.38Å; V467-V485 HydrophobicContact CB-CG1 4.46Å; V467-V485 HydrophobicContact CG1-CG1 3.67Å; V467-V485 HydrophobicContact CG2-CG1 3.91Å; V467-V489 HydrophobicContact CG1-CG2 4.15Å; V467-M536 HydrophobicContact CG1-CE 4.37Å; V467-M536 HydrophobicContact CG1-SD 3.94Å
468	R	98.7	Very high	97.9	Very high	29 Å²	29	23.3 Å²	23.3	11%	0.109	12%	0.122	C	C	.	.	H	α-helix	trans	-49.7	-47.8	174.4	178.4	-167.8	177.4	-141.3	10.9	111.5	V464 L466 A532 I535 D669	V464-R468 PolarHBondContact O-N 3.16Å; L466-R468 PolarHBondContact O-N 3.14Å; R468-A532 HydrophobicContact CB-CB 3.82Å; R468-A532 HydrophobicContact CG-CB 4.39Å; R468-I535 HydrophobicContact CG-CG1 4.38Å; R468-D669 IonicContact CZ-OD2 3.39Å; R468-D669 IonicContact NH1-OD2 2.86Å; R468-D669 IonicContact NH2-OD2 3.98Å; R468-D669 PolarHBondContact NH2-OD2 2.94Å
469	N	98.5	Very high	98.1	Very high	8 Å²	8	25.5 Å²	25.5	4%	0.043	13%	0.131	C	C	.	.	H	α-helix	trans	-69.6	-45.3	-177.9	-62.8	-15.7	0	0	0	111.7	R419 T422 H423 I432 G465 L466 V467 S471 T472	R419-N469 PolarHBondContact O-ND2 3.01Å; T422-N469 WeakPolarHBondContact OG1-CB 3.47Å; T422-N469 PolarHBondContact OG1-ND2 3.33Å; T422-N469 VanDerWaalsContact OG1-ND2 3.08Å; H423-N469 VanDerWaalsContact CB-ND2 3.34Å; H423-N469 WeakPolarHBondContact CB-ND2 3.38Å; I432-N469 WeakPolarHBondContact CD1-O 3.49Å; G465-N469 VanDerWaalsContact O-CG 3.28Å; G465-N469 PolarHBondContact O-N 3.36Å; G465-N469 PolarHBondContact O-ND2 2.94Å; G465-N469 PolarHBondContact O-OD1 3.13Å; L466-N469 WeakPolarHBondContact O-CB 3.46Å; L466-N469 PolarHBondContact O-N 2.87Å; L466-N469 VanDerWaalsContact O-N 3.08Å; V467-N469 PolarHBondContact O-N 3.1Å; N469-S471 PolarHBondContact O-N 3.2Å; N469-T472 WeakPolarHBondContact O-CB 3.49Å; N469-T472 WeakPolarHBondContact O-CG2 3.37Å; N469-T472 PolarHBondContact O-N 3.4Å; N469-T472 PolarHBondContact O-OG1 3.13Å
470	L	98.7	Very high	98.1	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-58	-40	176.5	-67.8	176.1	0	0	0	111.3	T422 I432 V435 L441 I444 L466 V467 T472 V473 T476 L480	T422-L470 HydrophobicContact CG2-CD2 4.23Å; I432-L470 HydrophobicContact CB-CD2 4.3Å; I432-L470 HydrophobicContact CG1-CD2 4.18Å; I432-L470 HydrophobicContact CG2-CD2 3.95Å; V435-L470 HydrophobicContact CB-CD2 3.99Å; V435-L470 HydrophobicContact CG1-CD1 4.15Å; V435-L470 HydrophobicContact CG1-CD2 3.84Å; V435-L470 HydrophobicContact CG2-CD2 4.4Å; L441-L470 HydrophobicContact CD2-CD1 3.92Å; I444-L470 HydrophobicContact CD1-CD1 3.74Å; L466-L470 HydrophobicContact CD1-CD1 4.07Å; L466-L470 HydrophobicContact CD1-CD2 4.31Å; L466-L470 HydrophobicContact CD1-CG 3.96Å; L466-L470 HydrophobicContact CG-CD1 3.87Å; L466-L470 HydrophobicContact CG-CG 4.23Å; L466-L470 VanDerWaalsContact O-CG 3.31Å; L466-L470 WeakPolarHBondContact O-CG 3.29Å; L466-L470 PolarHBondContact O-N 2.86Å; V467-L470 PolarHBondContact O-N 3.3Å; L470-T472 PolarHBondContact O-N 2.98Å; L470-T472 VanDerWaalsContact O-N 3.1Å; L470-V473 PolarHBondContact O-N 3.11Å; L470-T476 HydrophobicContact CB-CG2 3.83Å; L470-T476 WeakPolarHBondContact O-CB 3.24Å; L470-T476 WeakPolarHBondContact O-CG2 3.46Å; L470-L480 HydrophobicContact CB-CD1 4.06Å
471	S	98.4	Very high	98.1	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-2.6	177.6	-61.7	0	0	0	0	114.4	V467 N469 V473 R477 L480 I535 M536	V467-S471 WeakPolarHBondContact O-CB 3.49Å; V467-S471 PolarHBondContact O-N 2.98Å; V467-S471 PolarHBondContact O-OG 3.48Å; N469-S471 PolarHBondContact O-N 3.2Å; S471-V473 PolarHBondContact O-N 2.9Å; S471-R477 WeakPolarHBondContact O-CD 3.46Å; S471-R477 WeakPolarHBondContact O-CG 3.32Å; S471-R477 PolarHBondContact O-NH1 3.42Å; S471-L480 WeakPolarHBondContact OG-CD1 3.28Å; S471-I535 VanDerWaalsContact C-CG2 3.42Å; S471-I535 WeakPolarHBondContact O-CG2 3.25Å; S471-M536 WeakPolarHBondContact OG-CG 3.45Å
472	T	97.7	Very high	98.2	Very high	72 Å²	72	34.2 Å²	34.2	44%	0.442	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-27.6	171.3	61.3	0	0	0	0	112.1	I432 N469 L470 R477 I535	I432-T472 WeakPolarHBondContact CD1-OG1 3.35Å; N469-T472 WeakPolarHBondContact O-CB 3.49Å; N469-T472 WeakPolarHBondContact O-CG2 3.37Å; N469-T472 PolarHBondContact O-N 3.4Å; N469-T472 PolarHBondContact O-OG1 3.13Å; L470-T472 PolarHBondContact O-N 2.98Å; L470-T472 VanDerWaalsContact O-N 3.1Å; T472-R477 PolarHBondContact O-NH1 3.09Å; T472-R477 VanDerWaalsContact O-NH1 3.07Å; T472-I535 HydrophobicContact CG2-CG2 4.29Å
473	V	97.7	Very high	98.2	Very high	42 Å²	42	36.5 Å²	36.5	26%	0.255	19%	0.187	S	C	.	.	S	Bend	trans	-91.6	129.2	176.2	176.6	0	0	0	0	110.2	I432 L470 S471 T476 R477	I432-V473 HydrophobicContact CB-CG2 4.34Å; I432-V473 HydrophobicContact CD1-CG2 3.96Å; I432-V473 HydrophobicContact CG2-CB 4.09Å; I432-V473 HydrophobicContact CG2-CG2 3.78Å; L470-V473 PolarHBondContact O-N 3.11Å; S471-V473 PolarHBondContact O-N 2.9Å; V473-T476 PolarHBondContact O-N 3.46Å; V473-R477 PolarHBondContact O-N 3.11Å
474	E	97.7	Very high	98.1	Very high	123 Å²	123	40.7 Å²	40.7	58%	0.575	21%	0.209	S	C	*	.	H	α-helix	trans	-60.1	-50.2	-174.9	-175.5	173.9	-174.2	0	0	113.8	T476 R477 H478	E474-T476 PolarHBondContact O-N 3.31Å; E474-R477 WeakPolarHBondContact O-CB 3.29Å; E474-R477 PolarHBondContact O-N 2.81Å; E474-H478 PolarHBondContact O-N 3.08Å; E474-H478 VanDerWaalsContact O-N 3.15Å; E474-H478 IonicContact OE1-NE2 2.81Å
475	V	97.4	Very high	98.1	Very high	79 Å²	79	40.7 Å²	40.7	48%	0.479	21%	0.209	S	C	.	.	H	α-helix	trans	-56.7	-42.3	178.1	-178.8	0	0	0	0	111	R477 H478 E479	V475-R477 PolarHBondContact O-N 3.26Å; V475-H478 PolarHBondContact O-N 2.86Å; V475-E479 PolarHBondContact O-N 3.5Å; V475-E479 VanDerWaalsContact O-N 3.14Å
476	T	97.6	Very high	98.1	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.006	21%	0.208	C	C	.	.	H	α-helix	trans	-67.7	-33.2	177.7	-49.4	0	0	0	0	112.3	I432 L441 L470 V473 E474 L480	I432-T476 HydrophobicContact CG2-CG2 4.39Å; L441-T476 HydrophobicContact CD1-CG2 4.31Å; L441-T476 HydrophobicContact CD2-CG2 4.43Å; L470-T476 HydrophobicContact CB-CG2 3.83Å; L470-T476 WeakPolarHBondContact O-CB 3.24Å; L470-T476 WeakPolarHBondContact O-CG2 3.46Å; V473-T476 PolarHBondContact O-N 3.46Å; E474-T476 PolarHBondContact O-N 3.31Å; T476-L480 HydrophobicContact CG2-CD1 4.09Å; T476-L480 HydrophobicContact CG2-CG 4.4Å; T476-L480 WeakPolarHBondContact O-CB 3.3Å; T476-L480 WeakPolarHBondContact O-CD1 3.36Å; T476-L480 WeakPolarHBondContact O-CG 3.35Å; T476-L480 PolarHBondContact O-N 2.89Å
477	R	97.9	Very high	98.1	Very high	24 Å²	24	41.4 Å²	41.4	9%	0.091	22%	0.217	C	C	.	.	H	α-helix	trans	-60.9	-45.9	172.6	-74.7	-168.1	-64.3	-86	2.2	111.8	S471 T472 V473 E474 V475 L480 K481 I535	S471-R477 WeakPolarHBondContact O-CD 3.46Å; S471-R477 WeakPolarHBondContact O-CG 3.32Å; S471-R477 PolarHBondContact O-NH1 3.42Å; T472-R477 PolarHBondContact O-NH1 3.09Å; T472-R477 VanDerWaalsContact O-NH1 3.07Å; V473-R477 PolarHBondContact O-N 3.11Å; E474-R477 WeakPolarHBondContact O-CB 3.29Å; E474-R477 PolarHBondContact O-N 2.81Å; V475-R477 PolarHBondContact O-N 3.26Å; R477-L480 PolarHBondContact O-N 3.5Å; R477-K481 PolarHBondContact O-N 3.31Å; R477-I535 WeakPolarHBondContact CD-O 3.33Å
478	H	97.9	Very high	98.1	Very high	79 Å²	79	42.4 Å²	42.4	37%	0.366	22%	0.221	S	C	.	.	H	α-helix	trans	-62.4	-46.9	178.8	-65.9	-46.7	0	0	0	111.7	E474 V475 L480 K481 D482 D539	E474-H478 PolarHBondContact O-N 3.08Å; E474-H478 VanDerWaalsContact O-N 3.15Å; E474-H478 IonicContact OE1-NE2 2.81Å; V475-H478 PolarHBondContact O-N 2.86Å; H478-L480 VanDerWaalsContact C-N 3.31Å; H478-L480 PolarHBondContact O-N 3.05Å; H478-K481 VanDerWaalsContact O-CB 3.3Å; H478-K481 WeakPolarHBondContact O-CB 3.35Å; H478-K481 PolarHBondContact O-N 2.98Å; H478-K481 VanDerWaalsContact O-N 3.08Å; H478-D482 PolarHBondContact O-N 3.46Å; H478-D539 IonicContact CE1-OD2 2.63Å; H478-D539 PolarHBondContact CE1-OD2 2.8Å; H478-D539 IonicContact CG-OD2 4Å; H478-D539 IonicContact ND1-OD2 2.75Å; H478-D539 PolarHBondContact ND1-OD2 2.74Å
479	E	98.1	Very high	98.1	Very high	58 Å²	58	41 Å²	41	27%	0.271	22%	0.216	S	C	.	.	H	α-helix	trans	-63	-36.9	177.9	-68.3	174.4	-170.7	0	0	112.4	R436 L441 V475 K481 D482 L483	R436-E479 WeakPolarHBondContact CD-OE1 3.47Å; R436-E479 WeakPolarHBondContact CD-OE2 3.16Å; R436-E479 WeakPolarHBondContact CG-OE2 3.45Å; R436-E479 IonicContact CZ-OE1 2.84Å; R436-E479 IonicContact NH1-OE1 2.78Å; R436-E479 PolarHBondContact NH1-OE1 2.92Å; L441-E479 HydrophobicContact CD1-CB 3.84Å; L441-E479 VanDerWaalsContact CD1-OE2 3.23Å; L441-E479 WeakPolarHBondContact CD1-OE2 3.28Å; V475-E479 PolarHBondContact O-N 3.5Å; V475-E479 VanDerWaalsContact O-N 3.14Å; E479-K481 VanDerWaalsContact C-N 3.34Å; E479-D482 PolarHBondContact O-N 3.08Å; E479-L483 WeakPolarHBondContact O-CG 3.36Å; E479-L483 PolarHBondContact O-N 2.82Å
480	L	98.3	Very high	98.1	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-67.1	-34.5	174	-74.3	169.4	0	0	0	112.3	L441 V467 L470 S471 T476 R477 H478 L483 N484 V485	L441-L480 HydrophobicContact CD2-CD2 4.19Å; V467-L480 HydrophobicContact CG1-CD1 4.38Å; L470-L480 HydrophobicContact CB-CD1 4.06Å; S471-L480 WeakPolarHBondContact OG-CD1 3.28Å; T476-L480 HydrophobicContact CG2-CD1 4.09Å; T476-L480 HydrophobicContact CG2-CG 4.4Å; T476-L480 WeakPolarHBondContact O-CB 3.3Å; T476-L480 WeakPolarHBondContact O-CD1 3.36Å; T476-L480 WeakPolarHBondContact O-CG 3.35Å; T476-L480 PolarHBondContact O-N 2.89Å; R477-L480 PolarHBondContact O-N 3.5Å; H478-L480 VanDerWaalsContact C-N 3.31Å; H478-L480 PolarHBondContact O-N 3.05Å; L480-L483 PolarHBondContact O-N 3.11Å; L480-N484 PolarHBondContact O-N 3.15Å; L480-V485 HydrophobicContact CB-CB 4.19Å; L480-V485 HydrophobicContact CB-CG2 4.45Å; L480-V485 HydrophobicContact CD2-CB 4.24Å; L480-V485 HydrophobicContact CD2-CG1 4.29Å; L480-V485 HydrophobicContact CD2-CG2 3.86Å; L480-V485 WeakPolarHBondContact O-CB 3.38Å; L480-V485 WeakPolarHBondContact O-CG2 3.36Å; L480-V485 PolarHBondContact O-N 3.04Å
481	K	98.1	Very high	98	Very high	65 Å²	65	44.2 Å²	44.2	28%	0.283	23%	0.234	S	C	.	.	H	α-helix	trans	-63.9	-45	173.9	-178.2	-163	172.1	-160	0	111.3	R477 H478 E479 L483 N484 P486 S541 I542	R477-K481 PolarHBondContact O-N 3.31Å; H478-K481 VanDerWaalsContact O-CB 3.3Å; H478-K481 WeakPolarHBondContact O-CB 3.35Å; H478-K481 PolarHBondContact O-N 2.98Å; H478-K481 VanDerWaalsContact O-N 3.08Å; E479-K481 VanDerWaalsContact C-N 3.34Å; K481-L483 PolarHBondContact O-N 2.63Å; K481-L483 VanDerWaalsContact O-N 3.11Å; K481-N484 WeakPolarHBondContact O-CA 3.39Å; K481-N484 PolarHBondContact O-N 3.07Å; K481-P486 HydrophobicContact CB-CG 4.19Å; K481-P486 HydrophobicContact CG-CG 4.31Å; K481-S541 WeakPolarHBondContact CD-OG 3.49Å; K481-S541 VanDerWaalsContact CE-OG 3.25Å; K481-S541 WeakPolarHBondContact CE-OG 3.31Å; K481-S541 PolarHBondContact NZ-OG 2.93Å; K481-I542 HydrophobicContact CB-CD1 3.93Å; K481-I542 HydrophobicContact CB-CG1 4.01Å; K481-I542 HydrophobicContact CD-CG1 3.81Å; K481-I542 HydrophobicContact CG-CD1 4.33Å; K481-I542 HydrophobicContact CG-CG1 3.84Å
482	D	97.7	Very high	98	Very high	133 Å²	133	44.5 Å²	44.5	71%	0.711	24%	0.235	S	C	*	.	H	α-helix	trans	-61.2	-23.3	178.2	-65.6	-21.5	0	0	0	112.3	H478 E479	H478-D482 PolarHBondContact O-N 3.46Å; E479-D482 PolarHBondContact O-N 3.08Å
483	L	97.9	Very high	98	Very high	52 Å²	52	41.1 Å²	41.1	27%	0.272	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	7.6	173.7	-63.8	172.2	0	0	0	114.1	L441 A445 E479 L480 K481 V485 M488	L441-L483 HydrophobicContact CB-CD1 3.68Å; A445-L483 HydrophobicContact CB-CB 4.02Å; A445-L483 HydrophobicContact CB-CD1 4.39Å; E479-L483 WeakPolarHBondContact O-CG 3.36Å; E479-L483 PolarHBondContact O-N 2.82Å; L480-L483 PolarHBondContact O-N 3.11Å; K481-L483 PolarHBondContact O-N 2.63Å; K481-L483 VanDerWaalsContact O-N 3.11Å; L483-V485 HydrophobicContact CB-CG2 4.05Å; L483-V485 PolarHBondContact O-N 3.37Å; L483-M488 VanDerWaalsContact O-CE 3.3Å; L483-M488 WeakPolarHBondContact O-CE 3.49Å
484	N	98.1	Very high	98.1	Very high	87 Å²	87	40.3 Å²	40.3	47%	0.465	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	57	24.7	-177.1	-169.9	44.3	0	0	0	114.2	L480 K481 M488	L480-N484 PolarHBondContact O-N 3.15Å; K481-N484 WeakPolarHBondContact O-CA 3.39Å; K481-N484 PolarHBondContact O-N 3.07Å; N484-M488 HydrophobicContact CB-CE 4.13Å; N484-M488 VanDerWaalsContact O-CG 3.28Å; N484-M488 WeakPolarHBondContact O-CG 3.2Å; N484-M488 PolarHBondContact O-N 2.9Å
485	V	98.5	Very high	98	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-61.9	-36.2	175.7	178.4	0	0	0	0	113	A445 F448 V467 L480 L483 M488 V489 M536	A445-V485 HydrophobicContact CB-CG2 3.79Å; F448-V485 HydrophobicContact CE2-CG1 4.13Å; V467-V485 HydrophobicContact CB-CG1 4.46Å; V467-V485 HydrophobicContact CG1-CG1 3.67Å; V467-V485 HydrophobicContact CG2-CG1 3.91Å; L480-V485 HydrophobicContact CB-CB 4.19Å; L480-V485 HydrophobicContact CB-CG2 4.45Å; L480-V485 HydrophobicContact CD2-CB 4.24Å; L480-V485 HydrophobicContact CD2-CG1 4.29Å; L480-V485 HydrophobicContact CD2-CG2 3.86Å; L480-V485 WeakPolarHBondContact O-CB 3.38Å; L480-V485 WeakPolarHBondContact O-CG2 3.36Å; L480-V485 PolarHBondContact O-N 3.04Å; L483-V485 HydrophobicContact CB-CG2 4.05Å; L483-V485 PolarHBondContact O-N 3.37Å; V485-M488 WeakPolarHBondContact O-CB 3.38Å; V485-M488 PolarHBondContact O-N 3.5Å; V485-V489 HydrophobicContact CG1-CG2 4.11Å; V485-V489 WeakPolarHBondContact O-CG2 3.25Å; V485-V489 PolarHBondContact O-N 2.89Å; V485-M536 HydrophobicContact CG1-CE 4.24Å
486	P	98.7	Very high	97.9	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-56.5	-53.9	176.3	-15.6	21.6	0	0	0	112.5	K481 M488 V489 A490 M536 I542 F546	K481-P486 HydrophobicContact CB-CG 4.19Å; K481-P486 HydrophobicContact CG-CG 4.31Å; P486-M488 VanDerWaalsContact C-N 3.27Å; P486-M488 PolarHBondContact O-N 3.38Å; P486-V489 PolarHBondContact O-N 2.92Å; P486-V489 VanDerWaalsContact O-N 3.16Å; P486-A490 PolarHBondContact O-N 2.61Å; P486-M536 VanDerWaalsContact CA-CE 3.44Å; P486-M536 HydrophobicContact CB-CE 3.68Å; P486-M536 HydrophobicContact CG-CE 3.5Å; P486-M536 VanDerWaalsContact CG-CE 3.5Å; P486-I542 HydrophobicContact CB-CG2 3.63Å; P486-I542 HydrophobicContact CG-CD1 4.03Å; P486-I542 HydrophobicContact CG-CG1 4.1Å; P486-I542 HydrophobicContact CG-CG2 3.93Å; P486-F546 HydrophobicContact CB-CE1 3.53Å; P486-F546 HydrophobicContact CB-CZ 3.66Å
487	G	98.2	Very high	97.8	Very high	18 Å²	18	34.1 Å²	34.1	19%	0.186	17%	0.174	C	C	.	.	H	α-helix	trans	-56.7	-37.8	175.3	0	0	0	0	0	113.4	A490 N491 E545	G487-A490 PolarHBondContact O-N 2.81Å; G487-N491 WeakPolarHBondContact O-CB 3.15Å; G487-N491 PolarHBondContact O-N 3.04Å; G487-E545 PolarHBondContact N-OE1 3.41Å
488	M	98.2	Very high	97.7	Very high	20 Å²	20	36.8 Å²	36.8	10%	0.099	19%	0.19	C	C	.	.	H	α-helix	trans	-64	-45.9	175.3	-65.9	172	-158.6	0	0	112.2	F448 L449 L483 N484 V485 P486 N491 I492	F448-M488 HydrophobicContact CB-CB 3.96Å; F448-M488 HydrophobicContact CB-CG 4.11Å; F448-M488 HydrophobicContact CB-SD 3.61Å; F448-M488 HydrophobicContact CD1-CB 4.23Å; F448-M488 HydrophobicContact CD2-CB 4.35Å; F448-M488 HydrophobicContact CD2-SD 4.09Å; F448-M488 HydrophobicContact CG-CB 3.95Å; F448-M488 HydrophobicContact CG-SD 4.12Å; L449-M488 HydrophobicContact CD1-CE 3.86Å; L449-M488 HydrophobicContact CD2-CE 3.83Å; L449-M488 HydrophobicContact CD2-SD 4.26Å; L449-M488 HydrophobicContact CG-CE 3.81Å; L449-M488 HydrophobicContact CG-SD 4.16Å; L483-M488 VanDerWaalsContact O-CE 3.3Å; L483-M488 WeakPolarHBondContact O-CE 3.49Å; N484-M488 HydrophobicContact CB-CE 4.13Å; N484-M488 VanDerWaalsContact O-CG 3.28Å; N484-M488 WeakPolarHBondContact O-CG 3.2Å; N484-M488 PolarHBondContact O-N 2.9Å; V485-M488 WeakPolarHBondContact O-CB 3.38Å; V485-M488 PolarHBondContact O-N 3.5Å; P486-M488 VanDerWaalsContact C-N 3.27Å; P486-M488 PolarHBondContact O-N 3.38Å; M488-N491 PolarHBondContact O-N 3.4Å; M488-I492 WeakPolarHBondContact O-CG1 3.3Å; M488-I492 PolarHBondContact O-N 3.06Å
489	V	98.6	Very high	97.4	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-63.9	-41.2	177.5	174.3	0	0	0	0	111.1	F448 V464 V467 V485 P486 N491 I492 F493 A532 L533 M536	F448-V489 HydrophobicContact CE1-CG2 4.31Å; F448-V489 HydrophobicContact CZ-CG2 3.97Å; V464-V489 HydrophobicContact CG1-CG1 4.46Å; V467-V489 HydrophobicContact CG1-CG2 4.15Å; V485-V489 HydrophobicContact CG1-CG2 4.11Å; V485-V489 WeakPolarHBondContact O-CG2 3.25Å; V485-V489 PolarHBondContact O-N 2.89Å; P486-V489 PolarHBondContact O-N 2.92Å; P486-V489 VanDerWaalsContact O-N 3.16Å; V489-N491 VanDerWaalsContact C-N 3.32Å; V489-N491 PolarHBondContact O-N 2.91Å; V489-I492 PolarHBondContact O-N 3.46Å; V489-F493 PolarHBondContact O-N 3.17Å; V489-A532 HydrophobicContact CG1-CB 4.06Å; V489-L533 HydrophobicContact CB-CD2 4.31Å; V489-L533 HydrophobicContact CG1-CD2 3.83Å; V489-L533 HydrophobicContact CG1-CG 4.05Å; V489-M536 HydrophobicContact CG2-SD 4.34Å
490	A	98.5	Very high	97	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-60.9	-40.9	175	0	0	0	0	0	111.7	P486 G487 F493 L494 L533 F546 T549 L552	P486-A490 PolarHBondContact O-N 2.61Å; G487-A490 PolarHBondContact O-N 2.81Å; A490-F493 WeakPolarHBondContact O-CB 3.47Å; A490-F493 PolarHBondContact O-N 3.33Å; A490-L494 WeakPolarHBondContact O-CG 3.46Å; A490-L494 PolarHBondContact O-N 2.88Å; A490-L533 HydrophobicContact CB-CD2 4.1Å; A490-F546 HydrophobicContact CB-CD1 4.39Å; A490-F546 HydrophobicContact CB-CE1 4.29Å; A490-T549 HydrophobicContact CB-CG2 4.27Å; A490-L552 HydrophobicContact CB-CD1 4.37Å; A490-L552 HydrophobicContact CB-CD2 3.97Å
491	N	97.8	Very high	96.5	Very high	76 Å²	76	33.9 Å²	33.9	41%	0.406	18%	0.181	S	C	.	.	H	α-helix	trans	-64.7	-39.9	174.9	-177.7	51.7	0	0	0	112.2	G487 M488 V489 F493 L494 Q495	G487-N491 WeakPolarHBondContact O-CB 3.15Å; G487-N491 PolarHBondContact O-N 3.04Å; M488-N491 PolarHBondContact O-N 3.4Å; V489-N491 VanDerWaalsContact C-N 3.32Å; V489-N491 PolarHBondContact O-N 2.91Å; N491-F493 VanDerWaalsContact C-N 3.33Å; N491-F493 PolarHBondContact O-N 3.35Å; N491-L494 PolarHBondContact O-N 3.36Å; N491-Q495 PolarHBondContact ND2-NE2 3.15Å; N491-Q495 VanDerWaalsContact ND2-NE2 3.19Å; N491-Q495 WeakPolarHBondContact O-CB 3.49Å; N491-Q495 VanDerWaalsContact O-CG 3.27Å; N491-Q495 WeakPolarHBondContact O-CG 3.5Å; N491-Q495 PolarHBondContact O-N 3.01Å
492	I	97.9	Very high	95.8	Very high	6 Å²	6	38 Å²	38	3%	0.031	20%	0.199	C	C	.	.	H	α-helix	trans	-62.3	-41	174.2	-63.6	-53.8	0	0	0	111.3	F448 F453 L460 V464 M488 V489 Q495 T496 M525 T529	F448-I492 HydrophobicContact CD1-CD1 4.44Å; F448-I492 HydrophobicContact CD1-CG1 3.89Å; F448-I492 HydrophobicContact CE1-CG1 4.05Å; F453-I492 HydrophobicContact CD2-CD1 4.15Å; F453-I492 HydrophobicContact CD2-CG2 4.42Å; F453-I492 HydrophobicContact CE2-CG2 4.21Å; L460-I492 HydrophobicContact CD1-CD1 3.98Å; L460-I492 HydrophobicContact CD2-CD1 4.4Å; V464-I492 HydrophobicContact CG2-CG2 4.38Å; M488-I492 WeakPolarHBondContact O-CG1 3.3Å; M488-I492 PolarHBondContact O-N 3.06Å; V489-I492 PolarHBondContact O-N 3.46Å; I492-Q495 PolarHBondContact O-N 3.47Å; I492-T496 WeakPolarHBondContact O-CB 3.27Å; I492-T496 PolarHBondContact O-N 3.19Å; I492-T496 PolarHBondContact O-OG1 2.92Å; I492-M525 HydrophobicContact CG2-CE 3.29Å; I492-T529 HydrophobicContact CB-CG2 4.44Å; I492-T529 HydrophobicContact CG2-CG2 3.92Å
493	F	98.3	Very high	94.6	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-57.8	-51.9	172.8	169.8	-93.4	0	0	0	111.1	V489 A490 N491 Q495 T496 F497 L526 T529 L530 L533 L552 V556 V559	V489-F493 PolarHBondContact O-N 3.17Å; A490-F493 WeakPolarHBondContact O-CB 3.47Å; A490-F493 PolarHBondContact O-N 3.33Å; N491-F493 VanDerWaalsContact C-N 3.33Å; N491-F493 PolarHBondContact O-N 3.35Å; F493-Q495 PolarHBondContact O-N 2.95Å; F493-T496 WeakPolarHBondContact O-CB 3.41Å; F493-T496 PolarHBondContact O-N 3.3Å; F493-T496 VanDerWaalsContact O-N 3.17Å; F493-F497 WeakPolarHBondContact O-CB 3.4Å; F493-F497 PolarHBondContact O-N 3Å; F493-L526 HydrophobicContact CD2-CD2 3.67Å; F493-L526 HydrophobicContact CE2-CD2 3.65Å; F493-L526 HydrophobicContact CG-CD2 4.48Å; F493-L526 HydrophobicContact CZ-CD2 4.45Å; F493-T529 HydrophobicContact CB-CG2 4.45Å; F493-T529 WeakPolarHBondContact CD2-OG1 3.38Å; F493-L530 HydrophobicContact CD2-CD2 4.18Å; F493-L530 HydrophobicContact CD2-CG 4.03Å; F493-L530 HydrophobicContact CE2-CD1 4.08Å; F493-L530 HydrophobicContact CE2-CD2 3.65Å; F493-L530 HydrophobicContact CE2-CG 3.67Å; F493-L530 HydrophobicContact CZ-CD2 4.21Å; F493-L533 HydrophobicContact CB-CD1 4.22Å; F493-L533 HydrophobicContact CG-CD1 4.32Å; F493-L552 HydrophobicContact CD1-CD1 3.46Å; F493-L552 VanDerWaalsContact CD1-CD1 3.46Å; F493-L552 HydrophobicContact CE1-CD1 3.86Å; F493-L552 HydrophobicContact CG-CD1 4.32Å; F493-V556 HydrophobicContact CE1-CG2 3.66Å; F493-V556 HydrophobicContact CE2-CG2 4.3Å; F493-V556 HydrophobicContact CZ-CB 4.4Å; F493-V556 HydrophobicContact CZ-CG2 3.51Å; F493-V559 HydrophobicContact CE2-CG2 4.46Å; F493-V559 HydrophobicContact CZ-CG2 4.1Å
494	L	97.9	Very high	93	Very high	26 Å²	26	38.5 Å²	38.5	14%	0.136	20%	0.196	C	C	.	.	H	α-helix	trans	-60.4	-42.2	-179.6	-72.1	171.7	0	0	0	112.3	A490 N491 F497 N498 T549 S555	A490-L494 WeakPolarHBondContact O-CG 3.46Å; A490-L494 PolarHBondContact O-N 2.88Å; N491-L494 PolarHBondContact O-N 3.36Å; L494-F497 PolarHBondContact O-N 3.45Å; L494-N498 VanDerWaalsContact O-CB 3.3Å; L494-N498 WeakPolarHBondContact O-CB 3.25Å; L494-N498 PolarHBondContact O-N 3.38Å; L494-N498 PolarHBondContact O-ND2 3.32Å; L494-T549 HydrophobicContact CD1-CG2 4.5Å; L494-S555 WeakPolarHBondContact CD2-OG 3.34Å
495	Q	96.2	Very high	91.2	Very high	62 Å²	62	43.7 Å²	43.7	29%	0.29	21%	0.21	S	C	.	.	H	α-helix	trans	-64.6	-40	176.3	-72.4	175.1	-14.6	0	0	112.2	F453 N491 I492 F493 S499	F453-Q495 HydrophobicContact CD1-CB 4.07Å; F453-Q495 HydrophobicContact CD2-CB 4.01Å; F453-Q495 HydrophobicContact CE1-CB 4.26Å; F453-Q495 HydrophobicContact CE2-CB 4.2Å; F453-Q495 HydrophobicContact CG-CB 3.95Å; F453-Q495 HydrophobicContact CZ-CB 4.33Å; N491-Q495 PolarHBondContact ND2-NE2 3.15Å; N491-Q495 VanDerWaalsContact ND2-NE2 3.19Å; N491-Q495 WeakPolarHBondContact O-CB 3.49Å; N491-Q495 VanDerWaalsContact O-CG 3.27Å; N491-Q495 WeakPolarHBondContact O-CG 3.5Å; N491-Q495 PolarHBondContact O-N 3.01Å; I492-Q495 PolarHBondContact O-N 3.47Å; F493-Q495 PolarHBondContact O-N 2.95Å; Q495-S499 WeakPolarHBondContact O-CB 3.46Å; Q495-S499 PolarHBondContact O-N 2.81Å; Q495-S499 PolarHBondContact O-OG 3.1Å
496	T	96	Very high	89.2	Confident	0 Å²	0	51 Å²	51	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-64.8	-47.5	175.6	-53.3	0	0	0	0	110.8	F453 I492 F493 S499 L500 L522 M525 L526	F453-T496 VanDerWaalsContact CE2-OG1 3.29Å; F453-T496 WeakPolarHBondContact CE2-OG1 3.32Å; F453-T496 WeakPolarHBondContact CZ-OG1 3.32Å; I492-T496 WeakPolarHBondContact O-CB 3.27Å; I492-T496 PolarHBondContact O-N 3.19Å; I492-T496 PolarHBondContact O-OG1 2.92Å; F493-T496 WeakPolarHBondContact O-CB 3.41Å; F493-T496 PolarHBondContact O-N 3.3Å; F493-T496 VanDerWaalsContact O-N 3.17Å; T496-S499 PolarHBondContact O-N 3.41Å; T496-L500 PolarHBondContact O-N 3.14Å; T496-L522 HydrophobicContact CG2-CB 4.22Å; T496-L522 HydrophobicContact CG2-CD2 4.12Å; T496-L522 WeakPolarHBondContact CG2-O 3.15Å; T496-M525 HydrophobicContact CG2-CB 3.85Å; T496-M525 HydrophobicContact CG2-CG 3.93Å; T496-L526 HydrophobicContact CG2-CD2 3.75Å; T496-L526 HydrophobicContact CG2-CG 3.7Å
497	F	95.9	Very high	86.7	Confident	10 Å²	10	54.1 Å²	54.1	4%	0.044	28%	0.276	C	S	.	.	H	α-helix	trans	-60.8	-48.2	179.4	177	-107.9	0	0	0	111.7	F493 L494 S499 L500 N501 L526 Q558 V559	F493-F497 WeakPolarHBondContact O-CB 3.4Å; F493-F497 PolarHBondContact O-N 3Å; L494-F497 PolarHBondContact O-N 3.45Å; F497-S499 VanDerWaalsContact C-N 3.27Å; F497-S499 PolarHBondContact O-N 3.48Å; F497-L500 PolarHBondContact O-N 3.44Å; F497-N501 WeakPolarHBondContact CE1-ND2 3.35Å; F497-N501 WeakPolarHBondContact CE2-ND2 3.5Å; F497-N501 WeakPolarHBondContact CZ-ND2 3.19Å; F497-N501 PolarHBondContact O-N 3.38Å; F497-L526 HydrophobicContact CB-CD2 4.02Å; F497-Q558 HydrophobicContact CE2-CB 4.21Å; F497-Q558 HydrophobicContact CZ-CB 3.74Å; F497-Q558 HydrophobicContact CZ-CG 4.5Å; F497-V559 HydrophobicContact CD2-CG2 3.56Å; F497-V559 HydrophobicContact CE2-CG2 3.6Å
498	N	94.2	Very high	84.3	Confident	80 Å²	80	58.7 Å²	58.7	43%	0.428	30%	0.295	S	S	.	.	H	α-helix	trans	-62.7	-35.1	177.4	-73.6	-36.8	0	0	0	112.4	L494 K502	L494-N498 VanDerWaalsContact O-CB 3.3Å; L494-N498 WeakPolarHBondContact O-CB 3.25Å; L494-N498 PolarHBondContact O-N 3.38Å; L494-N498 PolarHBondContact O-ND2 3.32Å; N498-K502 WeakPolarHBondContact O-CB 3.34Å; N498-K502 VanDerWaalsContact O-CG 3.26Å; N498-K502 WeakPolarHBondContact O-CG 3.38Å; N498-K502 PolarHBondContact O-N 3.49Å; N498-K502 VanDerWaalsContact O-N 3.08Å
499	S	91.9	Very high	81.5	Confident	29 Å²	29	63.6 Å²	63.6	20%	0.203	33%	0.327	C	S	.	.	H	α-helix	trans	-68	-42.5	177	-60.1	0	0	0	0	111.5	Q495 T496 F497 K502 Q503	Q495-S499 WeakPolarHBondContact O-CB 3.46Å; Q495-S499 PolarHBondContact O-N 2.81Å; Q495-S499 PolarHBondContact O-OG 3.1Å; T496-S499 PolarHBondContact O-N 3.41Å; F497-S499 VanDerWaalsContact C-N 3.27Å; F497-S499 PolarHBondContact O-N 3.48Å; S499-K502 PolarHBondContact O-N 3.38Å; S499-Q503 WeakPolarHBondContact O-CG 3.4Å; S499-Q503 PolarHBondContact O-N 2.94Å
500	L	89.5	Confident	78.7	Confident	12 Å²	12	73 Å²	73	6%	0.063	37%	0.371	C	S	.	.	H	α-helix	trans	-64.7	-44.7	177.4	-170.6	67.7	0	0	0	111.6	T496 F497 K502 Q503 Q504 H515 L522 E523 L526	T496-L500 PolarHBondContact O-N 3.14Å; F497-L500 PolarHBondContact O-N 3.44Å; L500-K502 PolarHBondContact O-N 2.99Å; L500-Q503 PolarHBondContact O-N 2.78Å; L500-Q504 PolarHBondContact O-N 3.48Å; L500-H515 VanDerWaalsContact CD1-CD2 3.46Å; L500-H515 WeakPolarHBondContact CD1-CD2 3.41Å; L500-L522 HydrophobicContact CB-CD1 4.42Å; L500-L522 HydrophobicContact CD1-CB 4.15Å; L500-L522 HydrophobicContact CD1-CD1 4.32Å; L500-E523 HydrophobicContact CD2-CG 4.48Å; L500-L526 HydrophobicContact CD2-CD1 3.73Å
501	N	88	Confident	75.9	Confident	36 Å²	36	81.6 Å²	81.6	19%	0.193	41%	0.411	C	S	.	.	H	α-helix	trans	-64.6	-41.4	178.2	-75	-12	0	0	0	112.3	F497 Q503 Q504 Y505	F497-N501 WeakPolarHBondContact CE1-ND2 3.35Å; F497-N501 WeakPolarHBondContact CE2-ND2 3.5Å; F497-N501 WeakPolarHBondContact CZ-ND2 3.19Å; F497-N501 PolarHBondContact O-N 3.38Å; N501-Q503 PolarHBondContact O-N 2.82Å; N501-Q504 PolarHBondContact O-N 2.66Å; N501-Q504 VanDerWaalsContact O-N 3.09Å; N501-Y505 WeakPolarHBondContact O-CD2 3.48Å; N501-Y505 PolarHBondContact O-N 3.18Å
502	K	84	Confident	73.3	Confident	150 Å²	150	84.9 Å²	84.9	65%	0.652	43%	0.428	S	S	*	.	H	α-helix	trans	-57.6	-37.3	176.1	-78.8	176.1	-177.1	-177.9	0	112.4	N498 S499 L500 Q504 Y505	N498-K502 WeakPolarHBondContact O-CB 3.34Å; N498-K502 VanDerWaalsContact O-CG 3.26Å; N498-K502 WeakPolarHBondContact O-CG 3.38Å; N498-K502 PolarHBondContact O-N 3.49Å; N498-K502 VanDerWaalsContact O-N 3.08Å; S499-K502 PolarHBondContact O-N 3.38Å; L500-K502 PolarHBondContact O-N 2.99Å; K502-Q504 VanDerWaalsContact C-N 3.33Å; K502-Y505 PolarHBondContact O-N 3.25Å
503	Q	72.3	Confident	71.2	Confident	65 Å²	65	88.9 Å²	88.9	30%	0.304	46%	0.457	S	S	.	.	H	α-helix	trans	-66.6	-34.3	177.8	-71.3	178.3	-26.8	0	0	112.5	S499 L500 N501 N514	S499-Q503 WeakPolarHBondContact O-CG 3.4Å; S499-Q503 PolarHBondContact O-N 2.94Å; L500-Q503 PolarHBondContact O-N 2.78Å; N501-Q503 PolarHBondContact O-N 2.82Å; Q503-N514 PolarHBondContact NE2-O 2.86Å; Q503-N514 VanDerWaalsContact NE2-O 3.12Å; Q503-N514 PolarHBondContact OE1-O 3.49Å
504	Q	65.4	Low	69.2	Low	131 Å²	131	92.5 Å²	92.5	61%	0.612	48%	0.476	S	S	*	.	H	α-helix	trans	-67.9	-33.5	177.3	-68.5	-177.5	-9.9	0	0	112.8	L500 N501 K502 H506	L500-Q504 PolarHBondContact O-N 3.48Å; N501-Q504 PolarHBondContact O-N 2.66Å; N501-Q504 VanDerWaalsContact O-N 3.09Å; K502-Q504 VanDerWaalsContact C-N 3.33Å; Q504-H506 PolarHBondContact O-N 3.42Å
505	Y	59.4	Low	68.3	Low	197 Å²	197	94 Å²	94	77%	0.773	48%	0.482	S	S	*	.	H	α-helix	trans	-77	-16.7	-179.8	-74.6	-73.6	0	0	0	114.8	N501 K502	N501-Y505 WeakPolarHBondContact O-CD2 3.48Å; N501-Y505 PolarHBondContact O-N 3.18Å; K502-Y505 PolarHBondContact O-N 3.25Å
506	H	56.3	Low	67.7	Low	153 Å²	153	97.3 Å²	97.3	71%	0.708	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	13.7	-175	-84.7	29	0	0	0	115.2	Q504 I508	Q504-H506 PolarHBondContact O-N 3.42Å; H506-I508 WeakPolarHBondContact O-CG1 3.14Å; H506-I508 PolarHBondContact O-N 3.45Å
507	G	46.4	Very low	67.1	Low	66 Å²	66	99.4 Å²	99.4	68%	0.68	50%	0.504	S	S	*	.			trans	52.7	34.5	162.8	0	0	0	0	0	115.3	T509	G507-T509 PolarHBondContact O-N 2.87Å
508	I	47.6	Very low	66.5	Low	113 Å²	113	103.1 Å²	103.1	58%	0.579	52%	0.522	S	S	*	.			trans	-78.4	114	-178.1	-55.2	178.7	0	0	0	108.7	H506 E510	H506-I508 WeakPolarHBondContact O-CG1 3.14Å; H506-I508 PolarHBondContact O-N 3.45Å; I508-E510 PolarHBondContact O-N 3.27Å
509	T	40.5	Very low	65.9	Low	124 Å²	124	101.1 Å²	101.1	76%	0.761	52%	0.519	S	S	*	.			trans	-50.7	109.9	177.3	44.7	0	0	0	0	113.7	G507 Q511	G507-T509 PolarHBondContact O-N 2.87Å; T509-Q511 VanDerWaalsContact C-N 3.34Å; T509-Q511 PolarHBondContact O-N 2.58Å
510	E	38.8	Very low	65.9	Low	198 Å²	198	100.1 Å²	100.1	93%	0.925	51%	0.512	S	S	*	.	S	Bend	trans	39.4	9.6	136.6	-95.9	-174	-176.5	0	0	124.2	I508	I508-E510 PolarHBondContact O-N 3.27Å
511	Q	40.4	Very low	66	Low	180 Å²	180	100.8 Å²	100.8	84%	0.841	52%	0.516	S	S	*	.	S	Bend	trans	-124.3	5.4	-177.3	-78.7	-166.1	-13.6	0	0	119.9	T509	T509-Q511 VanDerWaalsContact C-N 3.34Å; T509-Q511 PolarHBondContact O-N 2.58Å
512	D	43.1	Very low	66.3	Low	144 Å²	144	99.1 Å²	99.1	77%	0.77	51%	0.507	S	S	*	.	S	Bend	trans	-159.5	132.5	154.7	-94.7	-40.1	0	0	0	108.2	N514	D512-N514 PolarHBondContact O-N 3.27Å
513	S	52.3	Low	66.8	Low	90 Å²	90	94.1 Å²	94.1	63%	0.629	49%	0.486	S	S	*	.			trans	-56.2	94.4	179	49.3	0	0	0	0	110.9	H515	S513-H515 PolarHBondContact O-N 3.02Å
514	N	57.8	Low	67.9	Low	77 Å²	77	92.6 Å²	92.6	41%	0.412	48%	0.48	S	S	.	.			trans	-71.5	16.4	-167.2	-96.2	-23.5	0	0	0	115.6	Q503 D512 Y516	Q503-N514 PolarHBondContact NE2-O 2.86Å; Q503-N514 VanDerWaalsContact NE2-O 3.12Å; Q503-N514 PolarHBondContact OE1-O 3.49Å; D512-N514 PolarHBondContact O-N 3.27Å; N514-Y516 PolarHBondContact O-N 3.39Å; N514-Y516 VanDerWaalsContact O-N 3.15Å
515	H	78.1	Confident	69.4	Low	56 Å²	56	86.4 Å²	86.4	26%	0.259	45%	0.451	S	S	.	.			trans	-76.5	7.4	179.2	-60.2	155.4	0	0	0	114.2	L500 S513 N521 L522 E523	L500-H515 VanDerWaalsContact CD1-CD2 3.46Å; L500-H515 WeakPolarHBondContact CD1-CD2 3.41Å; S513-H515 PolarHBondContact O-N 3.02Å; H515-N521 CarbonylContact O-C 3.54Å; H515-N521 WeakPolarHBondContact O-CA 3.25Å; H515-L522 WeakPolarHBondContact O-CG 3.34Å; H515-L522 PolarHBondContact O-N 3.13Å; H515-E523 IonicContact CE1-OE1 3.46Å; H515-E523 PolarHBondContact CE1-OE1 3.25Å; H515-E523 VanDerWaalsContact CE1-OE1 3.3Å; H515-E523 IonicContact ND1-OE1 2.82Å; H515-E523 PolarHBondContact ND1-OE1 3.45Å
516	Y	84.1	Confident	71.2	Confident	133 Å²	133	77 Å²	77	52%	0.522	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	125.1	-179.5	-73.6	-92.8	0	0	0	111.5	N514 V520 N521	N514-Y516 PolarHBondContact O-N 3.39Å; N514-Y516 VanDerWaalsContact O-N 3.15Å; Y516-V520 WeakPolarHBondContact CA-O 3.18Å; Y516-N521 HydrophobicContact CD1-CB 4.17Å; Y516-N521 HydrophobicContact CE1-CB 3.73Å; Y516-N521 HydrophobicContact CE2-CB 4.47Å
517	L	83.6	Confident	73.1	Confident	43 Å²	43	70.6 Å²	70.6	23%	0.225	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	126.5	169	-174.8	64.6	0	0	0	108.4	F453 V454 L457 G519 V520 L522	F453-L517 HydrophobicContact CE1-CD2 4.27Å; V454-L517 HydrophobicContact CG1-CD1 4.26Å; V454-L517 HydrophobicContact CG1-CD2 4.19Å; V454-L517 HydrophobicContact CG2-CD2 4.43Å; L457-L517 HydrophobicContact CD1-CB 4.29Å; L457-L517 HydrophobicContact CD1-CD2 3.48Å; L457-L517 VanDerWaalsContact CD1-CD2 3.48Å; L457-L517 HydrophobicContact CD1-CG 3.75Å; L517-G519 PolarHBondContact O-N 3.41Å; L517-G519 VanDerWaalsContact O-N 3.12Å; L517-V520 PolarHBondContact N-O 2.89Å; L517-V520 WeakPolarHBondContact O-CB 3.43Å; L517-V520 PolarHBondContact O-N 2.91Å; L517-L522 HydrophobicContact CB-CD2 3.93Å; L517-L522 HydrophobicContact CB-CG 4.35Å; L517-L522 HydrophobicContact CD2-CD2 4.48Å
518	E	82	Confident	75.6	Confident	89 Å²	89	68.9 Å²	68.9	42%	0.416	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.5	43.5	-169.8	-76.8	-59.9	156.1	0	0	112.1	V454 L457 P458 V520 R678	V454-E518 WeakPolarHBondContact O-CG 3.48Å; L457-E518 HydrophobicContact CB-CB 4.41Å; P458-E518 HydrophobicContact CG-CB 4.43Å; E518-V520 PolarHBondContact O-N 3.44Å; E518-R678 PolarHBondContact O-NE 3.44Å; E518-R678 PolarHBondContact O-NH1 3.15Å; E518-R678 PolarHBondContact O-NH2 3.34Å; E518-R678 IonicContact OE2-CZ 2.85Å; E518-R678 IonicContact OE2-NH1 3.74Å; E518-R678 PolarHBondContact OE2-NH1 2.88Å; E518-R678 IonicContact OE2-NH2 2.7Å; E518-R678 PolarHBondContact OE2-NH2 3.31Å; E518-R678 VanDerWaalsContact OE2-NH2 3.15Å
519	G	83.3	Confident	78	Confident	37 Å²	37	63.5 Å²	63.5	38%	0.381	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.6	13.4	179.3	0	0	0	0	0	115.3	L517 R678	L517-G519 PolarHBondContact O-N 3.41Å; L517-G519 VanDerWaalsContact O-N 3.12Å; G519-R678 VanDerWaalsContact N-NH2 3.11Å
520	V	90.3	Very high	80.8	Confident	9 Å²	9	57.6 Å²	57.6	6%	0.055	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	126.1	167.4	172.9	0	0	0	0	107.9	L457 P458 K461 Y516 L517 E518 L522 M525	L457-V520 HydrophobicContact CB-CB 4.1Å; L457-V520 HydrophobicContact CB-CG2 3.96Å; L457-V520 HydrophobicContact CD2-CB 4.15Å; L457-V520 HydrophobicContact CD2-CG1 4.09Å; P458-V520 HydrophobicContact CB-CG2 4.42Å; P458-V520 HydrophobicContact CG-CG2 4.04Å; K461-V520 HydrophobicContact CD-CG1 3.88Å; K461-V520 HydrophobicContact CD-CG2 4.37Å; Y516-V520 WeakPolarHBondContact CA-O 3.18Å; L517-V520 PolarHBondContact N-O 2.89Å; L517-V520 WeakPolarHBondContact O-CB 3.43Å; L517-V520 PolarHBondContact O-N 2.91Å; E518-V520 PolarHBondContact O-N 3.44Å; V520-L522 PolarHBondContact O-N 3.42Å; V520-M525 HydrophobicContact CG1-CB 4.26Å
521	N	93	Very high	83.7	Confident	26 Å²	26	48.8 Å²	48.8	14%	0.139	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	124	168.5	-173.6	-32.8	0	0	0	109	H515 Y516 E523 D524 M525	H515-N521 CarbonylContact O-C 3.54Å; H515-N521 WeakPolarHBondContact O-CA 3.25Å; Y516-N521 HydrophobicContact CD1-CB 4.17Å; Y516-N521 HydrophobicContact CE1-CB 3.73Å; Y516-N521 HydrophobicContact CE2-CB 4.47Å; N521-E523 VanDerWaalsContact C-N 3.33Å; N521-E523 WeakPolarHBondContact OD1-CB 3.44Å; N521-E523 PolarHBondContact OD1-N 2.87Å; N521-D524 HydrophobicContact CB-CB 4.22Å; N521-D524 WeakPolarHBondContact O-CB 3.5Å; N521-D524 PolarHBondContact O-N 3.46Å; N521-M525 PolarHBondContact O-N 2.87Å
522	L	93.7	Very high	86.4	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-67.7	-30.7	-178.6	-65.6	-177.1	0	0	0	112.3	L457 T496 L500 H515 L517 V520 M525 L526	L457-L522 HydrophobicContact CD2-CD2 3.7Å; T496-L522 HydrophobicContact CG2-CB 4.22Å; T496-L522 HydrophobicContact CG2-CD2 4.12Å; T496-L522 WeakPolarHBondContact CG2-O 3.15Å; L500-L522 HydrophobicContact CB-CD1 4.42Å; L500-L522 HydrophobicContact CD1-CB 4.15Å; L500-L522 HydrophobicContact CD1-CD1 4.32Å; H515-L522 WeakPolarHBondContact O-CG 3.34Å; H515-L522 PolarHBondContact O-N 3.13Å; L517-L522 HydrophobicContact CB-CD2 3.93Å; L517-L522 HydrophobicContact CB-CG 4.35Å; L517-L522 HydrophobicContact CD2-CD2 4.48Å; V520-L522 PolarHBondContact O-N 3.42Å; L522-M525 PolarHBondContact O-N 3.05Å; L522-L526 WeakPolarHBondContact O-CG 3.39Å; L522-L526 PolarHBondContact O-N 2.95Å
523	E	94.3	Very high	89.1	Confident	45 Å²	45	33.4 Å²	33.4	21%	0.21	18%	0.18	C	C	.	.	H	α-helix	trans	-65.6	-44.6	173	-64.6	-168.4	-167.7	0	0	111.2	L500 H515 N521 M525 L526 E527 S564 L567	L500-E523 HydrophobicContact CD2-CG 4.48Å; H515-E523 IonicContact CE1-OE1 3.46Å; H515-E523 PolarHBondContact CE1-OE1 3.25Å; H515-E523 VanDerWaalsContact CE1-OE1 3.3Å; H515-E523 IonicContact ND1-OE1 2.82Å; H515-E523 PolarHBondContact ND1-OE1 3.45Å; N521-E523 VanDerWaalsContact C-N 3.33Å; N521-E523 WeakPolarHBondContact OD1-CB 3.44Å; N521-E523 PolarHBondContact OD1-N 2.87Å; E523-M525 PolarHBondContact O-N 3.49Å; E523-L526 PolarHBondContact O-N 2.87Å; E523-L526 VanDerWaalsContact O-N 3.15Å; E523-E527 PolarHBondContact O-N 3.43Å; E523-S564 PolarHBondContact OE2-OG 3.32Å; E523-L567 HydrophobicContact CB-CD1 4.16Å; E523-L567 HydrophobicContact CG-CD1 4Å; E523-L567 WeakPolarHBondContact O-CD2 3.47Å
524	D	94.8	Very high	91.3	Very high	34 Å²	34	30.7 Å²	30.7	18%	0.182	16%	0.158	C	C	.	.	H	α-helix	trans	-58.8	-35.7	174.5	-66.3	-2.5	0	0	0	111.5	K461 N521 L528	K461-D524 IonicContact NZ-OD2 4Å; K461-D524 PolarHBondContact NZ-OD2 3.43Å; N521-D524 HydrophobicContact CB-CB 4.22Å; N521-D524 WeakPolarHBondContact O-CB 3.5Å; N521-D524 PolarHBondContact O-N 3.46Å; D524-L528 VanDerWaalsContact O-CB 3.24Å; D524-L528 WeakPolarHBondContact O-CB 3.39Å; D524-L528 PolarHBondContact O-N 3.33Å
525	M	96.6	Very high	93.2	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-70.9	-39.5	179	-170.1	65.2	-174.1	0	0	111.4	L460 K461 V464 I492 T496 V520 N521 L522 E523 L528 T529	L460-M525 HydrophobicContact CB-CE 4.31Å; K461-M525 HydrophobicContact CB-SD 3.82Å; K461-M525 HydrophobicContact CG-SD 4.1Å; V464-M525 HydrophobicContact CB-CE 4.5Å; V464-M525 HydrophobicContact CG2-CE 3.93Å; I492-M525 HydrophobicContact CG2-CE 3.29Å; T496-M525 HydrophobicContact CG2-CB 3.85Å; T496-M525 HydrophobicContact CG2-CG 3.93Å; V520-M525 HydrophobicContact CG1-CB 4.26Å; N521-M525 PolarHBondContact O-N 2.87Å; L522-M525 PolarHBondContact O-N 3.05Å; E523-M525 PolarHBondContact O-N 3.49Å; M525-L528 PolarHBondContact O-N 3.46Å; M525-T529 HydrophobicContact CE-CG2 4.08Å; M525-T529 WeakPolarHBondContact O-CB 3.45Å; M525-T529 WeakPolarHBondContact O-CG2 3.26Å; M525-T529 PolarHBondContact O-N 2.99Å; M525-T529 PolarHBondContact O-OG1 3.28Å
526	L	97.4	Very high	94.2	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.005	13%	0.128	C	C	.	.	H	α-helix	trans	-62.9	-47.7	171.6	-72.6	177.1	0	0	0	111.5	F493 T496 F497 L500 L522 E523 L528 T529 L530 L567	F493-L526 HydrophobicContact CD2-CD2 3.67Å; F493-L526 HydrophobicContact CE2-CD2 3.65Å; F493-L526 HydrophobicContact CG-CD2 4.48Å; F493-L526 HydrophobicContact CZ-CD2 4.45Å; T496-L526 HydrophobicContact CG2-CD2 3.75Å; T496-L526 HydrophobicContact CG2-CG 3.7Å; F497-L526 HydrophobicContact CB-CD2 4.02Å; L500-L526 HydrophobicContact CD2-CD1 3.73Å; L522-L526 WeakPolarHBondContact O-CG 3.39Å; L522-L526 PolarHBondContact O-N 2.95Å; E523-L526 PolarHBondContact O-N 2.87Å; E523-L526 VanDerWaalsContact O-N 3.15Å; L526-L528 VanDerWaalsContact C-N 3.31Å; L526-L528 PolarHBondContact O-N 3.46Å; L526-T529 WeakPolarHBondContact CA-OG1 3.4Å; L526-T529 PolarHBondContact O-N 3.26Å; L526-T529 PolarHBondContact O-OG1 3.44Å; L526-L530 WeakPolarHBondContact O-CB 3.29Å; L526-L530 WeakPolarHBondContact O-CD1 3.42Å; L526-L530 VanDerWaalsContact O-CG 3.26Å; L526-L530 WeakPolarHBondContact O-CG 3.31Å; L526-L530 PolarHBondContact O-N 3.37Å; L526-L567 HydrophobicContact CB-CD2 3.7Å; L526-L567 HydrophobicContact CD1-CD1 4.47Å
527	E	97.7	Very high	94.9	Very high	18 Å²	18	18.5 Å²	18.5	8%	0.084	10%	0.103	C	C	.	.	H	α-helix	trans	-57	-46.6	176.4	-178.1	176.8	-176.1	0	0	111	E523 L530 A531 L567 R569 A570	E523-E527 PolarHBondContact O-N 3.43Å; E527-L530 PolarHBondContact O-N 2.87Å; E527-A531 WeakPolarHBondContact O-CB 3.42Å; E527-A531 PolarHBondContact O-N 2.68Å; E527-L567 HydrophobicContact CB-CD2 4.15Å; E527-R569 IonicContact OE1-NH2 2.88Å; E527-R569 PolarHBondContact OE1-NH2 3.29Å; E527-A570 HydrophobicContact CG-CB 4.08Å
528	L	98.2	Very high	95.5	Very high	29 Å²	29	22 Å²	22	15%	0.152	12%	0.117	C	C	.	.	H	α-helix	trans	-64.6	-44	-179.1	-178.8	62.3	0	0	0	112.6	K461 V464 D524 M525 L526 A531 A532	K461-L528 HydrophobicContact CG-CD2 3.71Å; K461-L528 VanDerWaalsContact O-CD2 3.23Å; K461-L528 WeakPolarHBondContact O-CD2 3.47Å; V464-L528 HydrophobicContact CB-CD2 4.26Å; V464-L528 HydrophobicContact CB-CG 4.46Å; V464-L528 HydrophobicContact CG1-CD2 4.23Å; V464-L528 HydrophobicContact CG1-CG 3.89Å; D524-L528 VanDerWaalsContact O-CB 3.24Å; D524-L528 WeakPolarHBondContact O-CB 3.39Å; D524-L528 PolarHBondContact O-N 3.33Å; M525-L528 PolarHBondContact O-N 3.46Å; L526-L528 VanDerWaalsContact C-N 3.31Å; L526-L528 PolarHBondContact O-N 3.46Å; L528-A531 PolarHBondContact O-N 3.14Å; L528-A532 PolarHBondContact O-N 3.09Å
529	T	98.6	Very high	96.3	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-66.3	-43.7	178.4	46.8	0	0	0	0	111.2	V464 I492 F493 M525 L526 A531 A532 L533	V464-T529 HydrophobicContact CG1-CG2 3.91Å; V464-T529 HydrophobicContact CG2-CG2 4.3Å; I492-T529 HydrophobicContact CB-CG2 4.44Å; I492-T529 HydrophobicContact CG2-CG2 3.92Å; F493-T529 HydrophobicContact CB-CG2 4.45Å; F493-T529 WeakPolarHBondContact CD2-OG1 3.38Å; M525-T529 HydrophobicContact CE-CG2 4.08Å; M525-T529 WeakPolarHBondContact O-CB 3.45Å; M525-T529 WeakPolarHBondContact O-CG2 3.26Å; M525-T529 PolarHBondContact O-N 2.99Å; M525-T529 PolarHBondContact O-OG1 3.28Å; L526-T529 WeakPolarHBondContact CA-OG1 3.4Å; L526-T529 PolarHBondContact O-N 3.26Å; L526-T529 PolarHBondContact O-OG1 3.44Å; T529-A531 VanDerWaalsContact C-N 3.33Å; T529-A531 PolarHBondContact O-N 2.92Å; T529-A532 WeakPolarHBondContact O-CB 3.42Å; T529-A532 PolarHBondContact O-N 2.96Å; T529-A532 VanDerWaalsContact O-N 3.1Å; T529-L533 VanDerWaalsContact O-CG 3.27Å; T529-L533 WeakPolarHBondContact O-CG 3.25Å; T529-L533 PolarHBondContact O-N 3.09Å
530	L	98.8	Very high	96.9	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-57.8	-44	173.5	-74.9	165.9	0	0	0	112.3	F493 L526 E527 A532 L533 Q534 V556 V559 A570 S571 F574	F493-L530 HydrophobicContact CD2-CD2 4.18Å; F493-L530 HydrophobicContact CD2-CG 4.03Å; F493-L530 HydrophobicContact CE2-CD1 4.08Å; F493-L530 HydrophobicContact CE2-CD2 3.65Å; F493-L530 HydrophobicContact CE2-CG 3.67Å; F493-L530 HydrophobicContact CZ-CD2 4.21Å; L526-L530 WeakPolarHBondContact O-CB 3.29Å; L526-L530 WeakPolarHBondContact O-CD1 3.42Å; L526-L530 VanDerWaalsContact O-CG 3.26Å; L526-L530 WeakPolarHBondContact O-CG 3.31Å; L526-L530 PolarHBondContact O-N 3.37Å; E527-L530 PolarHBondContact O-N 2.87Å; L530-A532 VanDerWaalsContact C-N 3.3Å; L530-A532 PolarHBondContact O-N 3.43Å; L530-L533 PolarHBondContact O-N 3.3Å; L530-Q534 WeakPolarHBondContact O-CB 3.5Å; L530-Q534 PolarHBondContact O-N 3.25Å; L530-V556 HydrophobicContact CD2-CG1 4.03Å; L530-V556 HydrophobicContact CD2-CG2 3.86Å; L530-V559 HydrophobicContact CD1-CG1 4.4Å; L530-A570 HydrophobicContact CB-CB 3.85Å; L530-A570 HydrophobicContact CD1-CB 3.83Å; L530-S571 VanDerWaalsContact CD1-OG 3.3Å; L530-S571 WeakPolarHBondContact CD1-OG 3.44Å; L530-F574 HydrophobicContact CD2-CB 4.25Å; L530-F574 HydrophobicContact CD2-CD1 4Å; L530-F574 HydrophobicContact CD2-CG 4.45Å
531	A	98.5	Very high	97.2	Very high	14 Å²	14	25.4 Å²	25.4	12%	0.116	13%	0.128	C	C	.	.	H	α-helix	trans	-65	-34.2	176.4	0	0	0	0	0	112.5	E527 L528 T529 I535	E527-A531 WeakPolarHBondContact O-CB 3.42Å; E527-A531 PolarHBondContact O-N 2.68Å; L528-A531 PolarHBondContact O-N 3.14Å; T529-A531 VanDerWaalsContact C-N 3.33Å; T529-A531 PolarHBondContact O-N 2.92Å; A531-I535 WeakPolarHBondContact O-CG1 3.45Å; A531-I535 PolarHBondContact O-N 3Å
532	A	98.8	Very high	97.5	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-69.3	-48.5	174.3	0	0	0	0	0	111.2	V464 R468 V489 L528 T529 L530 Q534 I535 M536	V464-A532 HydrophobicContact CG1-CB 3.9Å; R468-A532 HydrophobicContact CB-CB 3.82Å; R468-A532 HydrophobicContact CG-CB 4.39Å; V489-A532 HydrophobicContact CG1-CB 4.06Å; L528-A532 PolarHBondContact O-N 3.09Å; T529-A532 WeakPolarHBondContact O-CB 3.42Å; T529-A532 PolarHBondContact O-N 2.96Å; T529-A532 VanDerWaalsContact O-N 3.1Å; L530-A532 VanDerWaalsContact C-N 3.3Å; L530-A532 PolarHBondContact O-N 3.43Å; A532-Q534 VanDerWaalsContact C-N 3.31Å; A532-Q534 PolarHBondContact O-N 3.18Å; A532-I535 PolarHBondContact O-N 3.46Å; A532-M536 VanDerWaalsContact O-CG 3.26Å; A532-M536 WeakPolarHBondContact O-CG 3.49Å; A532-M536 PolarHBondContact O-N 2.79Å
533	L	98.8	Very high	97.7	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-56.6	-43.6	176.3	-67.3	173.1	0	0	0	111.6	V489 A490 F493 T529 L530 I535 M536 A537 F546 L552 F574	V489-L533 HydrophobicContact CB-CD2 4.31Å; V489-L533 HydrophobicContact CG1-CD2 3.83Å; V489-L533 HydrophobicContact CG1-CG 4.05Å; A490-L533 HydrophobicContact CB-CD2 4.1Å; F493-L533 HydrophobicContact CB-CD1 4.22Å; F493-L533 HydrophobicContact CG-CD1 4.32Å; T529-L533 VanDerWaalsContact O-CG 3.27Å; T529-L533 WeakPolarHBondContact O-CG 3.25Å; T529-L533 PolarHBondContact O-N 3.09Å; L530-L533 PolarHBondContact O-N 3.3Å; L533-I535 PolarHBondContact O-N 2.81Å; L533-M536 PolarHBondContact O-N 3.09Å; L533-A537 VanDerWaalsContact O-CB 3.24Å; L533-A537 WeakPolarHBondContact O-CB 3.37Å; L533-A537 PolarHBondContact O-N 3.1Å; L533-F546 HydrophobicContact CB-CE2 4.28Å; L533-F546 HydrophobicContact CD2-CD1 4.25Å; L533-F546 HydrophobicContact CD2-CD2 4.5Å; L533-F546 HydrophobicContact CD2-CE1 3.57Å; L533-F546 HydrophobicContact CD2-CE2 3.85Å; L533-F546 HydrophobicContact CD2-CZ 3.34Å; L533-F546 WeakPolarHBondContact O-CE2 3.37Å; L533-L552 HydrophobicContact CD1-CD1 4.15Å; L533-F574 HydrophobicContact CB-CD2 3.87Å; L533-F574 HydrophobicContact CB-CE1 4.42Å; L533-F574 HydrophobicContact CB-CE2 3.66Å; L533-F574 HydrophobicContact CB-CG 4.34Å; L533-F574 HydrophobicContact CB-CZ 3.95Å; L533-F574 HydrophobicContact CD1-CE1 4.26Å; L533-F574 HydrophobicContact CD1-CZ 4.35Å
534	Q	98.5	Very high	97.8	Very high	34 Å²	34	25.5 Å²	25.5	16%	0.159	13%	0.127	C	C	.	.	H	α-helix	trans	-57.2	-47.7	175.8	-174.6	-160.4	7.6	0	0	112.6	L530 A532 M536 A537 F574 Q577	L530-Q534 WeakPolarHBondContact O-CB 3.5Å; L530-Q534 PolarHBondContact O-N 3.25Å; A532-Q534 VanDerWaalsContact C-N 3.31Å; A532-Q534 PolarHBondContact O-N 3.18Å; Q534-M536 VanDerWaalsContact C-N 3.35Å; Q534-A537 PolarHBondContact O-N 3.08Å; Q534-F574 HydrophobicContact CB-CB 4.34Å; Q534-F574 HydrophobicContact CB-CD2 4.37Å; Q534-Q577 HydrophobicContact CG-CB 4.12Å
535	I	98.3	Very high	98	Very high	9 Å²	9	26.3 Å²	26.3	5%	0.046	13%	0.13	C	C	.	.	H	α-helix	trans	-68.1	-38.5	-178.9	-65.8	-63	0	0	0	110.9	R468 S471 T472 R477 A531 A532 L533 K538	R468-I535 HydrophobicContact CG-CG1 4.38Å; S471-I535 VanDerWaalsContact C-CG2 3.42Å; S471-I535 WeakPolarHBondContact O-CG2 3.25Å; T472-I535 HydrophobicContact CG2-CG2 4.29Å; R477-I535 WeakPolarHBondContact CD-O 3.33Å; A531-I535 WeakPolarHBondContact O-CG1 3.45Å; A531-I535 PolarHBondContact O-N 3Å; A532-I535 PolarHBondContact O-N 3.46Å; L533-I535 PolarHBondContact O-N 2.81Å; I535-K538 WeakPolarHBondContact O-CB 3.04Å; I535-K538 PolarHBondContact O-N 3.48Å
536	M	98.7	Very high	98.1	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-67.5	-40	178	-65.5	178.2	81	0	0	112	V467 S471 V485 P486 V489 A532 L533 Q534 K538 D539 I542 F546	V467-M536 HydrophobicContact CG1-CE 4.37Å; V467-M536 HydrophobicContact CG1-SD 3.94Å; S471-M536 WeakPolarHBondContact OG-CG 3.45Å; V485-M536 HydrophobicContact CG1-CE 4.24Å; P486-M536 VanDerWaalsContact CA-CE 3.44Å; P486-M536 HydrophobicContact CB-CE 3.68Å; P486-M536 HydrophobicContact CG-CE 3.5Å; P486-M536 VanDerWaalsContact CG-CE 3.5Å; V489-M536 HydrophobicContact CG2-SD 4.34Å; A532-M536 VanDerWaalsContact O-CG 3.26Å; A532-M536 WeakPolarHBondContact O-CG 3.49Å; A532-M536 PolarHBondContact O-N 2.79Å; L533-M536 PolarHBondContact O-N 3.09Å; Q534-M536 VanDerWaalsContact C-N 3.35Å; M536-K538 PolarHBondContact O-N 3.07Å; M536-D539 PolarHBondContact O-N 3.1Å; M536-I542 HydrophobicContact CB-CD1 4.48Å; M536-I542 HydrophobicContact CB-CG2 4.11Å; M536-F546 HydrophobicContact CB-CE2 4.1Å; M536-F546 HydrophobicContact CB-CZ 4.13Å
537	A	98.3	Very high	98.1	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	2.7	178.3	0	0	0	0	0	114.7	L533 Q534 Q543 F546 F574 Q577 L578	L533-A537 VanDerWaalsContact O-CB 3.24Å; L533-A537 WeakPolarHBondContact O-CB 3.37Å; L533-A537 PolarHBondContact O-N 3.1Å; Q534-A537 PolarHBondContact O-N 3.08Å; A537-Q543 HydrophobicContact CB-CB 4.38Å; A537-F546 HydrophobicContact CB-CD2 3.91Å; A537-F546 HydrophobicContact CB-CE2 4.02Å; A537-F574 HydrophobicContact CB-CE2 4Å; A537-Q577 HydrophobicContact CB-CG 3.66Å; A537-Q577 WeakPolarHBondContact O-CG 3.49Å; A537-Q577 PolarHBondContact O-NE2 3.48Å; A537-L578 HydrophobicContact CB-CD2 4.24Å
538	K	97.7	Very high	98.1	Very high	116 Å²	116	33 Å²	33	50%	0.504	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-24.6	163.9	-68.8	-173.1	175.1	-172	0	112.3	I535 M536	I535-K538 WeakPolarHBondContact O-CB 3.04Å; I535-K538 PolarHBondContact O-N 3.48Å; M536-K538 PolarHBondContact O-N 3.07Å
539	D	97.6	Very high	98	Very high	14 Å²	14	33.2 Å²	33.2	8%	0.075	16%	0.164	C	C	.	.	S	Bend	trans	-80.4	121.8	167.5	-179.7	-39.5	0	0	0	109	H478 M536 S541 I542 Q543	H478-D539 IonicContact CE1-OD2 2.63Å; H478-D539 PolarHBondContact CE1-OD2 2.8Å; H478-D539 IonicContact CG-OD2 4Å; H478-D539 IonicContact ND1-OD2 2.75Å; H478-D539 PolarHBondContact ND1-OD2 2.74Å; M536-D539 PolarHBondContact O-N 3.1Å; D539-S541 PolarHBondContact O-N 3.27Å; D539-S541 WeakPolarHBondContact OD1-CA 3.37Å; D539-S541 WeakPolarHBondContact OD1-CB 3.23Å; D539-S541 PolarHBondContact OD1-N 2.93Å; D539-S541 PolarHBondContact OD1-OG 3.47Å; D539-I542 HydrophobicContact CB-CB 4.09Å; D539-I542 HydrophobicContact CB-CD1 3.74Å; D539-I542 HydrophobicContact CB-CG1 3.86Å; D539-I542 PolarHBondContact O-N 3.24Å; D539-I542 PolarHBondContact OD1-N 2.94Å; D539-Q543 WeakPolarHBondContact O-CB 3.04Å; D539-Q543 PolarHBondContact O-N 3.43Å
540	Q	96.5	Very high	98	Very high	146 Å²	146	37.5 Å²	37.5	68%	0.682	20%	0.2	S	C	*	.	H	α-helix	trans	-60.6	-32.7	-177	-172.2	175.1	6.8	0	0	113	Q543 E544	Q540-Q543 WeakPolarHBondContact O-CB 3.5Å; Q540-E544 PolarHBondContact O-N 3.34Å
541	S	97.1	Very high	97.9	Very high	48 Å²	48	39.5 Å²	39.5	34%	0.336	22%	0.22	S	C	.	.	H	α-helix	trans	-74.4	-35.2	179	71.5	0	0	0	0	112.4	K481 D539 E545	K481-S541 WeakPolarHBondContact CD-OG 3.49Å; K481-S541 VanDerWaalsContact CE-OG 3.25Å; K481-S541 WeakPolarHBondContact CE-OG 3.31Å; K481-S541 PolarHBondContact NZ-OG 2.93Å; D539-S541 PolarHBondContact O-N 3.27Å; D539-S541 WeakPolarHBondContact OD1-CA 3.37Å; D539-S541 WeakPolarHBondContact OD1-CB 3.23Å; D539-S541 PolarHBondContact OD1-N 2.93Å; D539-S541 PolarHBondContact OD1-OG 3.47Å; S541-E545 PolarHBondContact O-N 3.49Å; S541-E545 VanDerWaalsContact O-N 3.14Å
542	I	98.2	Very high	97.9	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-71.3	-40	172.5	-59.7	176.8	0	0	0	110.5	K481 P486 M536 D539 E544 E545 F546	K481-I542 HydrophobicContact CB-CD1 3.93Å; K481-I542 HydrophobicContact CB-CG1 4.01Å; K481-I542 HydrophobicContact CD-CG1 3.81Å; K481-I542 HydrophobicContact CG-CD1 4.33Å; K481-I542 HydrophobicContact CG-CG1 3.84Å; P486-I542 HydrophobicContact CB-CG2 3.63Å; P486-I542 HydrophobicContact CG-CD1 4.03Å; P486-I542 HydrophobicContact CG-CG1 4.1Å; P486-I542 HydrophobicContact CG-CG2 3.93Å; M536-I542 HydrophobicContact CB-CD1 4.48Å; M536-I542 HydrophobicContact CB-CG2 4.11Å; D539-I542 HydrophobicContact CB-CB 4.09Å; D539-I542 HydrophobicContact CB-CD1 3.74Å; D539-I542 HydrophobicContact CB-CG1 3.86Å; D539-I542 PolarHBondContact O-N 3.24Å; D539-I542 PolarHBondContact OD1-N 2.94Å; I542-E544 VanDerWaalsContact C-N 3.28Å; I542-E544 PolarHBondContact O-N 3.27Å; I542-E545 WeakPolarHBondContact O-CB 3.44Å; I542-E545 PolarHBondContact O-N 3.15Å; I542-F546 HydrophobicContact CG2-CD2 3.97Å; I542-F546 HydrophobicContact CG2-CE1 4Å; I542-F546 HydrophobicContact CG2-CE2 3.41Å; I542-F546 VanDerWaalsContact CG2-CE2 3.41Å; I542-F546 HydrophobicContact CG2-CG 4.49Å; I542-F546 HydrophobicContact CG2-CZ 3.42Å; I542-F546 VanDerWaalsContact CG2-CZ 3.42Å; I542-F546 WeakPolarHBondContact O-CG 3.49Å; I542-F546 PolarHBondContact O-N 2.99Å
543	Q	98	Very high	97.8	Very high	7 Å²	7	39.1 Å²	39.1	3%	0.033	22%	0.217	C	C	.	.	H	α-helix	trans	-54.8	-46.5	173.6	176.2	178.6	30.6	0	0	111.1	A537 D539 Q540 F546 I547 Q577 L578 T580	A537-Q543 HydrophobicContact CB-CB 4.38Å; D539-Q543 WeakPolarHBondContact O-CB 3.04Å; D539-Q543 PolarHBondContact O-N 3.43Å; Q540-Q543 WeakPolarHBondContact O-CB 3.5Å; Q543-F546 PolarHBondContact O-N 3.42Å; Q543-I547 HydrophobicContact CG-CD1 4.1Å; Q543-I547 WeakPolarHBondContact O-CD1 3.36Å; Q543-I547 WeakPolarHBondContact O-CG1 3.48Å; Q543-I547 PolarHBondContact O-N 3.49Å; Q543-I547 VanDerWaalsContact O-N 3.1Å; Q543-Q577 PolarHBondContact NE2-O 3.27Å; Q543-L578 HydrophobicContact CG-CD2 3.89Å; Q543-L578 VanDerWaalsContact NE2-C 3.35Å; Q543-L578 PolarHBondContact NE2-O 3.06Å; Q543-T580 PolarHBondContact NE2-OG1 2.7Å
544	E	97.8	Very high	97.8	Very high	65 Å²	65	40.7 Å²	40.7	30%	0.304	23%	0.227	S	C	.	.	H	α-helix	trans	-64.7	-41.6	177.5	-160.8	62.4	-158.2	0	0	111.7	Q540 I542 F546 I547 H548 S583	Q540-E544 PolarHBondContact O-N 3.34Å; I542-E544 VanDerWaalsContact C-N 3.28Å; I542-E544 PolarHBondContact O-N 3.27Å; E544-F546 VanDerWaalsContact C-N 3.32Å; E544-F546 PolarHBondContact O-N 3.37Å; E544-I547 PolarHBondContact O-N 3.4Å; E544-H548 PolarHBondContact O-CD2 2.8Å; E544-H548 PolarHBondContact O-N 2.94Å; E544-H548 IonicContact OE1-CD2 3.08Å; E544-H548 IonicContact OE1-CE1 2.81Å; E544-H548 IonicContact OE1-NE2 3.42Å; E544-H548 PolarHBondContact OE1-NE2 3.48Å; E544-S583 WeakPolarHBondContact OE2-CB 3.5Å; E544-S583 PolarHBondContact OE2-OG 3.01Å
545	E	97.6	Very high	97.8	Very high	52 Å²	52	39.6 Å²	39.6	24%	0.243	22%	0.223	C	C	.	.	H	α-helix	trans	-56.7	-43.7	173.4	-174.6	-173.8	141.3	0	0	112.3	G487 S541 I542 H548 T549	G487-E545 PolarHBondContact N-OE1 3.41Å; S541-E545 PolarHBondContact O-N 3.49Å; S541-E545 VanDerWaalsContact O-N 3.14Å; I542-E545 WeakPolarHBondContact O-CB 3.44Å; I542-E545 PolarHBondContact O-N 3.15Å; E545-H548 PolarHBondContact O-N 3.04Å; E545-T549 PolarHBondContact O-N 2.87Å; E545-T549 PolarHBondContact O-OG1 3.19Å
546	F	98.5	Very high	97.8	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-66.2	-37.5	177.7	-67.5	-26.2	0	0	0	113.2	P486 A490 L533 M536 A537 I542 Q543 E544 H548 T549 L552 F574 L578	P486-F546 HydrophobicContact CB-CE1 3.53Å; P486-F546 HydrophobicContact CB-CZ 3.66Å; A490-F546 HydrophobicContact CB-CD1 4.39Å; A490-F546 HydrophobicContact CB-CE1 4.29Å; L533-F546 HydrophobicContact CB-CE2 4.28Å; L533-F546 HydrophobicContact CD2-CD1 4.25Å; L533-F546 HydrophobicContact CD2-CD2 4.5Å; L533-F546 HydrophobicContact CD2-CE1 3.57Å; L533-F546 HydrophobicContact CD2-CE2 3.85Å; L533-F546 HydrophobicContact CD2-CZ 3.34Å; L533-F546 WeakPolarHBondContact O-CE2 3.37Å; M536-F546 HydrophobicContact CB-CE2 4.1Å; M536-F546 HydrophobicContact CB-CZ 4.13Å; A537-F546 HydrophobicContact CB-CD2 3.91Å; A537-F546 HydrophobicContact CB-CE2 4.02Å; I542-F546 HydrophobicContact CG2-CD2 3.97Å; I542-F546 HydrophobicContact CG2-CE1 4Å; I542-F546 HydrophobicContact CG2-CE2 3.41Å; I542-F546 VanDerWaalsContact CG2-CE2 3.41Å; I542-F546 HydrophobicContact CG2-CG 4.49Å; I542-F546 HydrophobicContact CG2-CZ 3.42Å; I542-F546 VanDerWaalsContact CG2-CZ 3.42Å; I542-F546 WeakPolarHBondContact O-CG 3.49Å; I542-F546 PolarHBondContact O-N 2.99Å; Q543-F546 PolarHBondContact O-N 3.42Å; E544-F546 VanDerWaalsContact C-N 3.32Å; E544-F546 PolarHBondContact O-N 3.37Å; F546-H548 PolarHBondContact O-N 2.89Å; F546-T549 WeakPolarHBondContact O-CB 3.37Å; F546-T549 PolarHBondContact O-N 2.98Å; F546-L552 HydrophobicContact CB-CD2 3.82Å; F546-L552 HydrophobicContact CD1-CD2 4.04Å; F546-L552 HydrophobicContact CG-CD2 4.1Å; F546-F574 HydrophobicContact CB-CZ 4.26Å; F546-F574 AromaticContact CD2-CE2 3.89Å; F546-F574 HydrophobicContact CD2-CE2 3.89Å; F546-F574 AromaticContact CD2-CZ 3.96Å; F546-F574 HydrophobicContact CD2-CZ 3.96Å; F546-F574 HydrophobicContact CE2-CE2 4.35Å; F546-F574 HydrophobicContact CG-CZ 4.31Å; F546-L578 HydrophobicContact CB-CD2 4.3Å
547	I	97.9	Very high	97.7	Very high	22 Å²	22	39.6 Å²	39.6	11%	0.113	22%	0.224	C	C	.	.	H	α-helix	trans	-60.9	-38.2	176.4	-69.9	160.2	0	0	0	110.7	Q543 E544 L578 S583 G584 A587	Q543-I547 HydrophobicContact CG-CD1 4.1Å; Q543-I547 WeakPolarHBondContact O-CD1 3.36Å; Q543-I547 WeakPolarHBondContact O-CG1 3.48Å; Q543-I547 PolarHBondContact O-N 3.49Å; Q543-I547 VanDerWaalsContact O-N 3.1Å; E544-I547 PolarHBondContact O-N 3.4Å; I547-L578 HydrophobicContact CG1-CD2 4.38Å; I547-S583 WeakPolarHBondContact CD1-OG 3.28Å; I547-G584 VanDerWaalsContact CD1-CA 3.49Å; I547-A587 HydrophobicContact CG2-CB 3.85Å
548	H	96.8	Very high	97.6	Very high	136 Å²	136	44.2 Å²	44.2	63%	0.63	25%	0.245	S	C	*	.	H	α-helix	trans	-89	-1.8	179.3	-63	-62.5	0	0	0	114.1	E544 E545 F546 A550	E544-H548 PolarHBondContact O-CD2 2.8Å; E544-H548 PolarHBondContact O-N 2.94Å; E544-H548 IonicContact OE1-CD2 3.08Å; E544-H548 IonicContact OE1-CE1 2.81Å; E544-H548 IonicContact OE1-NE2 3.42Å; E544-H548 PolarHBondContact OE1-NE2 3.48Å; E545-H548 PolarHBondContact O-N 3.04Å; F546-H548 PolarHBondContact O-N 2.89Å; H548-A550 PolarHBondContact O-N 3.27Å
549	T	97.7	Very high	97.5	Very high	35 Å²	35	39 Å²	39	22%	0.215	22%	0.223	C	C	.	.	S	Bend	trans	-73.8	115	176.9	-62.7	0	0	0	0	110.2	A490 L494 E545 F546 G551 L552	A490-T549 HydrophobicContact CB-CG2 4.27Å; L494-T549 HydrophobicContact CD1-CG2 4.5Å; E545-T549 PolarHBondContact O-N 2.87Å; E545-T549 PolarHBondContact O-OG1 3.19Å; F546-T549 WeakPolarHBondContact O-CB 3.37Å; F546-T549 PolarHBondContact O-N 2.98Å; T549-G551 PolarHBondContact O-N 2.82Å; T549-L552 HydrophobicContact CG2-CB 3.98Å; T549-L552 HydrophobicContact CG2-CD2 4.31Å; T549-L552 WeakPolarHBondContact O-CB 3.37Å; T549-L552 PolarHBondContact O-N 3Å; T549-L552 VanDerWaalsContact O-N 3.1Å
550	A	97.3	Very high	97.4	Very high	89 Å²	89	38.4 Å²	38.4	74%	0.736	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.8	123.4	-174.2	0	0	0	0	0	112.8	H548 L552	H548-A550 PolarHBondContact O-N 3.27Å; A550-L552 PolarHBondContact O-N 3.02Å
551	G	96.6	Very high	97.3	Very high	42 Å²	42	37.5 Å²	37.5	43%	0.433	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.9	-4.1	176.4	0	0	0	0	0	115.7	T549 S555	T549-G551 PolarHBondContact O-N 2.82Å; G551-S555 WeakPolarHBondContact O-CB 3.22Å; G551-S555 PolarHBondContact O-N 2.91Å; G551-S555 PolarHBondContact O-OG 3.15Å
552	L	98.4	Very high	97	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-65	-57.4	-177.8	-179.2	60.7	0	0	0	111.5	A490 F493 L533 F546 T549 A550 S554 S555 V556 F574	A490-L552 HydrophobicContact CB-CD1 4.37Å; A490-L552 HydrophobicContact CB-CD2 3.97Å; F493-L552 HydrophobicContact CD1-CD1 3.46Å; F493-L552 VanDerWaalsContact CD1-CD1 3.46Å; F493-L552 HydrophobicContact CE1-CD1 3.86Å; F493-L552 HydrophobicContact CG-CD1 4.32Å; L533-L552 HydrophobicContact CD1-CD1 4.15Å; F546-L552 HydrophobicContact CB-CD2 3.82Å; F546-L552 HydrophobicContact CD1-CD2 4.04Å; F546-L552 HydrophobicContact CG-CD2 4.1Å; T549-L552 HydrophobicContact CG2-CB 3.98Å; T549-L552 HydrophobicContact CG2-CD2 4.31Å; T549-L552 WeakPolarHBondContact O-CB 3.37Å; T549-L552 PolarHBondContact O-N 3Å; T549-L552 VanDerWaalsContact O-N 3.1Å; A550-L552 PolarHBondContact O-N 3.02Å; L552-S554 PolarHBondContact O-N 3.48Å; L552-S555 PolarHBondContact O-N 2.94Å; L552-V556 HydrophobicContact CD1-CG2 4.31Å; L552-V556 VanDerWaalsContact O-CG2 3.3Å; L552-V556 WeakPolarHBondContact O-CG2 3.35Å; L552-V556 PolarHBondContact O-N 3.28Å; L552-F574 HydrophobicContact CD2-CZ 4.37Å
553	V	98.1	Very high	96.7	Very high	7 Å²	7	42.2 Å²	42.2	4%	0.042	24%	0.242	C	C	.	.	H	α-helix	trans	-60.1	-46.9	-178	-173	0	0	0	0	110.7	S555 V556 V557 L575 L578 I588 E591	V553-S555 PolarHBondContact O-N 3.17Å; V553-V556 PolarHBondContact O-N 2.94Å; V553-V557 WeakPolarHBondContact O-CG2 3.5Å; V553-V557 PolarHBondContact O-N 3.39Å; V553-L575 HydrophobicContact CG1-CD2 4.39Å; V553-L578 HydrophobicContact CG2-CD1 4.25Å; V553-I588 HydrophobicContact CG1-CG1 4.38Å; V553-E591 HydrophobicContact CB-CG 4.47Å; V553-E591 HydrophobicContact CG1-CG 3.95Å
554	S	97.6	Very high	96.5	Very high	32 Å²	32	43 Å²	43	22%	0.224	25%	0.248	C	C	.	.	H	α-helix	trans	-56.8	-46	176.7	-161	0	0	0	0	113	L552 V556 V557 Q558 E591	L552-S554 PolarHBondContact O-N 3.48Å; S554-V556 PolarHBondContact O-N 3.23Å; S554-V557 PolarHBondContact O-N 2.68Å; S554-Q558 WeakPolarHBondContact O-CG 3.42Å; S554-Q558 PolarHBondContact O-N 2.86Å; S554-E591 VanDerWaalsContact CA-OE2 3.29Å; S554-E591 WeakPolarHBondContact CA-OE2 3.32Å; S554-E591 VanDerWaalsContact CB-CD 3.49Å; S554-E591 WeakPolarHBondContact CB-OE2 3.37Å; S554-E591 PolarHBondContact OG-OE2 3.37Å
555	S	98.1	Very high	96.3	Very high	11 Å²	11	43.4 Å²	43.4	8%	0.077	25%	0.254	C	S	.	.	H	α-helix	trans	-64	-41	178	-60.9	0	0	0	0	111.6	L494 G551 L552 V553 Q558 V559	L494-S555 WeakPolarHBondContact CD2-OG 3.34Å; G551-S555 WeakPolarHBondContact O-CB 3.22Å; G551-S555 PolarHBondContact O-N 2.91Å; G551-S555 PolarHBondContact O-OG 3.15Å; L552-S555 PolarHBondContact O-N 2.94Å; V553-S555 PolarHBondContact O-N 3.17Å; S555-Q558 WeakPolarHBondContact O-CB 3.44Å; S555-Q558 PolarHBondContact O-N 2.93Å; S555-V559 WeakPolarHBondContact O-CG2 3.22Å; S555-V559 PolarHBondContact O-N 3.44Å
556	V	98.3	Very high	96.2	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-64.6	-41.2	176.3	176.6	0	0	0	0	111.5	F493 L530 L552 V553 S554 Q558 V559 I560 F574 L575	F493-V556 HydrophobicContact CE1-CG2 3.66Å; F493-V556 HydrophobicContact CE2-CG2 4.3Å; F493-V556 HydrophobicContact CZ-CB 4.4Å; F493-V556 HydrophobicContact CZ-CG2 3.51Å; L530-V556 HydrophobicContact CD2-CG1 4.03Å; L530-V556 HydrophobicContact CD2-CG2 3.86Å; L552-V556 HydrophobicContact CD1-CG2 4.31Å; L552-V556 VanDerWaalsContact O-CG2 3.3Å; L552-V556 WeakPolarHBondContact O-CG2 3.35Å; L552-V556 PolarHBondContact O-N 3.28Å; V553-V556 PolarHBondContact O-N 2.94Å; S554-V556 PolarHBondContact O-N 3.23Å; V556-Q558 VanDerWaalsContact C-N 3.31Å; V556-Q558 PolarHBondContact O-N 3Å; V556-V559 WeakPolarHBondContact O-CB 3.31Å; V556-V559 PolarHBondContact O-N 3.47Å; V556-V559 VanDerWaalsContact O-N 3.15Å; V556-I560 PolarHBondContact O-N 3.02Å; V556-F574 HydrophobicContact CG1-CD1 4.03Å; V556-F574 HydrophobicContact CG2-CD1 3.89Å; V556-F574 HydrophobicContact CG2-CE1 3.95Å; V556-L575 HydrophobicContact CB-CD2 4.22Å; V556-L575 HydrophobicContact CG1-CD1 4.15Å; V556-L575 HydrophobicContact CG1-CD2 3.68Å; V556-L575 HydrophobicContact CG1-CG 3.7Å
557	V	97.3	Very high	96.1	Very high	9 Å²	9	43.4 Å²	43.4	6%	0.055	26%	0.259	C	S	.	.	H	α-helix	trans	-59.6	-42.6	174.2	168.2	0	0	0	0	110.8	V553 S554 V559 I560 Y561 L575 E591 A593	V553-V557 WeakPolarHBondContact O-CG2 3.5Å; V553-V557 PolarHBondContact O-N 3.39Å; S554-V557 PolarHBondContact O-N 2.68Å; V557-V559 VanDerWaalsContact C-N 3.34Å; V557-V559 PolarHBondContact O-N 2.63Å; V557-I560 WeakPolarHBondContact O-CB 2.84Å; V557-I560 PolarHBondContact O-N 2.9Å; V557-Y561 HydrophobicContact CG1-CE2 4.45Å; V557-Y561 WeakPolarHBondContact O-CD2 3.42Å; V557-L575 HydrophobicContact CG2-CD1 3.89Å; V557-E591 HydrophobicContact CB-CB 4.36Å; V557-E591 HydrophobicContact CG1-CB 4.35Å; V557-E591 HydrophobicContact CG2-CB 3.92Å; V557-E591 HydrophobicContact CG2-CG 4.37Å; V557-A593 HydrophobicContact CG1-CB 3.72Å; V557-A593 HydrophobicContact CG2-CB 3.96Å
558	Q	96.3	Very high	96	Very high	97 Å²	97	43.2 Å²	43.2	45%	0.453	26%	0.258	S	S	.	.	H	α-helix	trans	-62.2	-39.1	174.3	-70	175.7	40	0	0	112.5	F497 S554 S555 V556 I560 Y561	F497-Q558 HydrophobicContact CE2-CB 4.21Å; F497-Q558 HydrophobicContact CZ-CB 3.74Å; F497-Q558 HydrophobicContact CZ-CG 4.5Å; S554-Q558 WeakPolarHBondContact O-CG 3.42Å; S554-Q558 PolarHBondContact O-N 2.86Å; S555-Q558 WeakPolarHBondContact O-CB 3.44Å; S555-Q558 PolarHBondContact O-N 2.93Å; V556-Q558 VanDerWaalsContact C-N 3.31Å; V556-Q558 PolarHBondContact O-N 3Å; Q558-I560 PolarHBondContact O-N 3.4Å; Q558-Y561 WeakPolarHBondContact O-CB 3.37Å; Q558-Y561 PolarHBondContact O-N 2.92Å
559	V	96.1	Very high	96	Very high	7 Å²	7	38 Å²	38	4%	0.042	23%	0.233	C	C	.	.	H	α-helix	trans	-60.6	-27.8	177	175.8	0	0	0	0	112.3	F493 F497 L530 S555 V556 V557 Y561 S562 L567 S571	F493-V559 HydrophobicContact CE2-CG2 4.46Å; F493-V559 HydrophobicContact CZ-CG2 4.1Å; F497-V559 HydrophobicContact CD2-CG2 3.56Å; F497-V559 HydrophobicContact CE2-CG2 3.6Å; L530-V559 HydrophobicContact CD1-CG1 4.4Å; S555-V559 WeakPolarHBondContact O-CG2 3.22Å; S555-V559 PolarHBondContact O-N 3.44Å; V556-V559 WeakPolarHBondContact O-CB 3.31Å; V556-V559 PolarHBondContact O-N 3.47Å; V556-V559 VanDerWaalsContact O-N 3.15Å; V557-V559 VanDerWaalsContact C-N 3.34Å; V557-V559 PolarHBondContact O-N 2.63Å; V559-Y561 PolarHBondContact O-N 2.85Å; V559-S562 WeakPolarHBondContact O-CB 3.25Å; V559-S562 PolarHBondContact O-N 3.5Å; V559-L567 HydrophobicContact CG1-CB 3.83Å; V559-L567 HydrophobicContact CG1-CD1 4.32Å; V559-L567 HydrophobicContact CG1-CD2 4.48Å; V559-L567 HydrophobicContact CG1-CG 4.45Å; V559-S571 WeakPolarHBondContact CB-OG 3.39Å; V559-S571 WeakPolarHBondContact CG1-OG 3.41Å
560	I	95.6	Very high	96	Very high	2 Å²	2	36.7 Å²	36.7	1%	0.01	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-23.1	176.8	-65.6	166.1	0	0	0	112.6	V556 V557 Q558 S562 T572 L575 R596 F597 L600	V556-I560 PolarHBondContact O-N 3.02Å; V557-I560 WeakPolarHBondContact O-CB 2.84Å; V557-I560 PolarHBondContact O-N 2.9Å; Q558-I560 PolarHBondContact O-N 3.4Å; I560-S562 VanDerWaalsContact C-N 3.26Å; I560-T572 HydrophobicContact CD1-CG2 4.3Å; I560-T572 HydrophobicContact CG1-CG2 4.33Å; I560-L575 HydrophobicContact CD1-CD1 3.34Å; I560-L575 HydrophobicContact CD1-CG 4.43Å; I560-R596 HydrophobicContact CG2-CG 3.81Å; I560-F597 HydrophobicContact CD1-CE1 3.56Å; I560-F597 HydrophobicContact CD1-CZ 4.08Å; I560-L600 HydrophobicContact CG2-CD1 3.27Å
561	Y	94.3	Very high	96	Very high	127 Å²	127	32.4 Å²	32.4	50%	0.498	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-5.6	174.4	-67.1	-94	0	0	0	113	V557 Q558 V559 R596	V557-Y561 HydrophobicContact CG1-CE2 4.45Å; V557-Y561 WeakPolarHBondContact O-CD2 3.42Å; Q558-Y561 WeakPolarHBondContact O-CB 3.37Å; Q558-Y561 PolarHBondContact O-N 2.92Å; V559-Y561 PolarHBondContact O-N 2.85Å; Y561-R596 HydrophobicContact CD1-CG 4.31Å; Y561-R596 HydrophobicContact CE1-CB 4.05Å; Y561-R596 HydrophobicContact CE1-CG 3.87Å; Y561-R596 HydrophobicContact CE2-CB 4.29Å; Y561-R596 HydrophobicContact CE2-CG 4.16Å; Y561-R596 WeakPolarHBondContact OH-CB 3.33Å
562	S	91.5	Very high	96.1	Very high	25 Å²	25	30.4 Å²	30.4	18%	0.175	17%	0.17	C	C	.	.	S	Bend	trans	-58.9	142.6	172.6	179	0	0	0	0	111	V559 I560 S564 Q568	V559-S562 WeakPolarHBondContact O-CB 3.25Å; V559-S562 PolarHBondContact O-N 3.5Å; I560-S562 VanDerWaalsContact C-N 3.26Å; S562-S564 PolarHBondContact O-N 2.7Å; S562-S564 WeakPolarHBondContact OG-CB 3.28Å; S562-S564 PolarHBondContact OG-N 2.97Å; S562-Q568 WeakPolarHBondContact O-CG 3.35Å; S562-Q568 PolarHBondContact O-NE2 3.26Å
563	P	91.5	Very high	96.1	Very high	122 Å²	122	30.6 Å²	30.6	79%	0.792	17%	0.171	S	C	*	.	S	Bend	trans	-68.3	-15.1	171.7	29.5	-36	0	0	0	112.9	V565	P563-V565 PolarHBondContact O-N 3.15Å
564	S	93.1	Very high	96.1	Very high	24 Å²	24	30.3 Å²	30.3	17%	0.168	17%	0.169	C	C	.	.			trans	-71.8	111.2	-178.7	-179.4	0	0	0	0	111.1	E523 S562 C566 L567 Q568	E523-S564 PolarHBondContact OE2-OG 3.32Å; S562-S564 PolarHBondContact O-N 2.7Å; S562-S564 WeakPolarHBondContact OG-CB 3.28Å; S562-S564 PolarHBondContact OG-N 2.97Å; S564-C566 PolarHBondContact O-N 3.41Å; S564-L567 PolarHBondContact O-N 3.37Å; S564-L567 VanDerWaalsContact O-N 3.1Å; S564-Q568 WeakPolarHBondContact O-CG 3.42Å; S564-Q568 PolarHBondContact O-N 3.48Å
565	V	94.1	Very high	96.1	Very high	72 Å²	72	28.8 Å²	28.8	44%	0.436	16%	0.159	S	C	.	.	H	α-helix	trans	-57.8	-35.8	176.8	179	0	0	0	0	111.1	P563 Q568 R569 N605 I608	P563-V565 PolarHBondContact O-N 3.15Å; V565-Q568 PolarHBondContact O-N 3.29Å; V565-R569 VanDerWaalsContact O-CB 3.32Å; V565-R569 WeakPolarHBondContact O-CB 3.41Å; V565-R569 PolarHBondContact O-N 3.41Å; V565-N605 HydrophobicContact CG1-CB 4.26Å; V565-I608 HydrophobicContact CG1-CD1 3.91Å
566	C	94.7	Very high	96.1	Very high	49 Å²	49	28.7 Å²	28.7	33%	0.331	16%	0.158	S	C	.	.	H	α-helix	trans	-62.4	-44.8	176.4	-63.6	0	0	0	0	111.6	S564 R569 A570	S564-C566 PolarHBondContact O-N 3.41Å; C566-R569 PolarHBondContact O-N 3.06Å; C566-A570 WeakPolarHBondContact O-CB 3.25Å; C566-A570 PolarHBondContact O-N 3.3Å
567	L	96.3	Very high	96.1	Very high	3 Å²	3	30.4 Å²	30.4	2%	0.016	17%	0.166	C	C	.	.	H	α-helix	trans	-68.8	-41.9	177.2	-67.9	-177.7	0	0	0	112.2	E523 L526 E527 V559 S564 R569 A570 S571	E523-L567 HydrophobicContact CB-CD1 4.16Å; E523-L567 HydrophobicContact CG-CD1 4Å; E523-L567 WeakPolarHBondContact O-CD2 3.47Å; L526-L567 HydrophobicContact CB-CD2 3.7Å; L526-L567 HydrophobicContact CD1-CD1 4.47Å; E527-L567 HydrophobicContact CB-CD2 4.15Å; V559-L567 HydrophobicContact CG1-CB 3.83Å; V559-L567 HydrophobicContact CG1-CD1 4.32Å; V559-L567 HydrophobicContact CG1-CD2 4.48Å; V559-L567 HydrophobicContact CG1-CG 4.45Å; S564-L567 PolarHBondContact O-N 3.37Å; S564-L567 VanDerWaalsContact O-N 3.1Å; L567-R569 VanDerWaalsContact C-N 3.3Å; L567-R569 PolarHBondContact O-N 3.41Å; L567-A570 PolarHBondContact O-N 3.4Å; L567-S571 WeakPolarHBondContact O-CB 3.34Å; L567-S571 PolarHBondContact O-N 2.94Å; L567-S571 PolarHBondContact O-OG 3.03Å; L567-S571 VanDerWaalsContact O-OG 3.1Å
568	Q	96.9	Very high	96.2	Very high	18 Å²	18	30 Å²	30	8%	0.084	16%	0.163	C	C	.	.	H	α-helix	trans	-57.4	-45.6	174.3	-69.8	178.6	0.8	0	0	111.3	S562 S564 V565 T572 I608	S562-Q568 WeakPolarHBondContact O-CG 3.35Å; S562-Q568 PolarHBondContact O-NE2 3.26Å; S564-Q568 WeakPolarHBondContact O-CG 3.42Å; S564-Q568 PolarHBondContact O-N 3.48Å; V565-Q568 PolarHBondContact O-N 3.29Å; Q568-T572 WeakPolarHBondContact O-CB 3.49Å; Q568-T572 VanDerWaalsContact O-CG2 3.26Å; Q568-T572 WeakPolarHBondContact O-CG2 3.27Å; Q568-T572 PolarHBondContact O-N 3.26Å; Q568-T572 PolarHBondContact O-OG1 2.93Å; Q568-I608 HydrophobicContact CB-CD1 3.72Å
569	R	96.6	Very high	96.2	Very high	27 Å²	27	25.4 Å²	25.4	10%	0.102	14%	0.142	C	C	.	.	H	α-helix	trans	-61.7	-48.9	176.5	-176.4	-173.5	66.6	103	-1.8	111.9	E527 V565 C566 L567 T572 A573 I608 D669	E527-R569 IonicContact OE1-NH2 2.88Å; E527-R569 PolarHBondContact OE1-NH2 3.29Å; V565-R569 VanDerWaalsContact O-CB 3.32Å; V565-R569 WeakPolarHBondContact O-CB 3.41Å; V565-R569 PolarHBondContact O-N 3.41Å; C566-R569 PolarHBondContact O-N 3.06Å; L567-R569 VanDerWaalsContact C-N 3.3Å; L567-R569 PolarHBondContact O-N 3.41Å; R569-T572 PolarHBondContact O-OG1 2.97Å; R569-T572 VanDerWaalsContact O-OG1 3.13Å; R569-A573 WeakPolarHBondContact O-CB 3.47Å; R569-A573 PolarHBondContact O-N 3.45Å; R569-I608 HydrophobicContact CB-CD1 4.22Å; R569-I608 HydrophobicContact CB-CG1 3.88Å; R569-I608 HydrophobicContact CG-CG1 4.45Å; R569-D669 IonicContact CZ-OD1 3.28Å; R569-D669 IonicContact NH1-OD1 3.55Å; R569-D669 PolarHBondContact NH1-OD1 2.96Å; R569-D669 IonicContact NH2-OD1 3.95Å; R569-D669 PolarHBondContact NH2-OD1 3.23Å
570	A	97.4	Very high	96.2	Very high	7 Å²	7	28.6 Å²	28.6	6%	0.058	16%	0.162	C	C	.	.	H	α-helix	trans	-64.8	-42.3	-179.2	0	0	0	0	0	112.3	E527 L530 C566 L567 A573 F574	E527-A570 HydrophobicContact CG-CB 4.08Å; L530-A570 HydrophobicContact CB-CB 3.85Å; L530-A570 HydrophobicContact CD1-CB 3.83Å; C566-A570 WeakPolarHBondContact O-CB 3.25Å; C566-A570 PolarHBondContact O-N 3.3Å; L567-A570 PolarHBondContact O-N 3.4Å; A570-A573 PolarHBondContact O-N 3.04Å; A570-F574 PolarHBondContact O-N 3.36Å
571	S	98.2	Very high	96.2	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-66.6	-46.8	178.1	-65.6	0	0	0	0	112	L530 V559 L567 A573 F574 L575	L530-S571 VanDerWaalsContact CD1-OG 3.3Å; L530-S571 WeakPolarHBondContact CD1-OG 3.44Å; V559-S571 WeakPolarHBondContact CB-OG 3.39Å; V559-S571 WeakPolarHBondContact CG1-OG 3.41Å; L567-S571 WeakPolarHBondContact O-CB 3.34Å; L567-S571 PolarHBondContact O-N 2.94Å; L567-S571 PolarHBondContact O-OG 3.03Å; L567-S571 VanDerWaalsContact O-OG 3.1Å; S571-A573 VanDerWaalsContact C-N 3.31Å; S571-A573 PolarHBondContact O-N 3.22Å; S571-F574 PolarHBondContact O-N 3.37Å; S571-L575 WeakPolarHBondContact O-CG 3.42Å; S571-L575 PolarHBondContact O-N 3.19Å
572	T	97.9	Very high	96.2	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-65.6	-34.8	177.5	53	0	0	0	0	111.9	I560 Q568 R569 S576 L600 T612	I560-T572 HydrophobicContact CD1-CG2 4.3Å; I560-T572 HydrophobicContact CG1-CG2 4.33Å; Q568-T572 WeakPolarHBondContact O-CB 3.49Å; Q568-T572 VanDerWaalsContact O-CG2 3.26Å; Q568-T572 WeakPolarHBondContact O-CG2 3.27Å; Q568-T572 PolarHBondContact O-N 3.26Å; Q568-T572 PolarHBondContact O-OG1 2.93Å; R569-T572 PolarHBondContact O-OG1 2.97Å; R569-T572 VanDerWaalsContact O-OG1 3.13Å; T572-S576 WeakPolarHBondContact O-CB 3.33Å; T572-S576 PolarHBondContact O-N 3.46Å; T572-L600 HydrophobicContact CG2-CD1 4.39Å; T572-T612 HydrophobicContact CG2-CG2 3.58Å
573	A	98	Very high	96.4	Very high	4 Å²	4	31.2 Å²	31.2	3%	0.033	17%	0.174	C	C	.	.	H	α-helix	trans	-62.6	-45.1	173.1	0	0	0	0	0	112.2	R569 A570 S571 S576 Q577 Y611	R569-A573 WeakPolarHBondContact O-CB 3.47Å; R569-A573 PolarHBondContact O-N 3.45Å; A570-A573 PolarHBondContact O-N 3.04Å; S571-A573 VanDerWaalsContact C-N 3.31Å; S571-A573 PolarHBondContact O-N 3.22Å; A573-S576 PolarHBondContact O-N 2.9Å; A573-Q577 PolarHBondContact O-N 2.82Å; A573-Y611 HydrophobicContact CB-CD2 3.85Å; A573-Y611 HydrophobicContact CB-CE1 4.35Å; A573-Y611 HydrophobicContact CB-CE2 3.49Å; A573-Y611 VanDerWaalsContact CB-CE2 3.49Å; A573-Y611 HydrophobicContact CB-CG 4.44Å
574	F	98.6	Very high	96.6	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-66.1	-46.8	176.4	176.3	-129.1	0	0	0	112.3	L530 L533 Q534 A537 F546 L552 V556 A570 S571 S576 Q577 L578	L530-F574 HydrophobicContact CD2-CB 4.25Å; L530-F574 HydrophobicContact CD2-CD1 4Å; L530-F574 HydrophobicContact CD2-CG 4.45Å; L533-F574 HydrophobicContact CB-CD2 3.87Å; L533-F574 HydrophobicContact CB-CE1 4.42Å; L533-F574 HydrophobicContact CB-CE2 3.66Å; L533-F574 HydrophobicContact CB-CG 4.34Å; L533-F574 HydrophobicContact CB-CZ 3.95Å; L533-F574 HydrophobicContact CD1-CE1 4.26Å; L533-F574 HydrophobicContact CD1-CZ 4.35Å; Q534-F574 HydrophobicContact CB-CB 4.34Å; Q534-F574 HydrophobicContact CB-CD2 4.37Å; A537-F574 HydrophobicContact CB-CE2 4Å; F546-F574 HydrophobicContact CB-CZ 4.26Å; F546-F574 AromaticContact CD2-CE2 3.89Å; F546-F574 HydrophobicContact CD2-CE2 3.89Å; F546-F574 AromaticContact CD2-CZ 3.96Å; F546-F574 HydrophobicContact CD2-CZ 3.96Å; F546-F574 HydrophobicContact CE2-CE2 4.35Å; F546-F574 HydrophobicContact CG-CZ 4.31Å; L552-F574 HydrophobicContact CD2-CZ 4.37Å; V556-F574 HydrophobicContact CG1-CD1 4.03Å; V556-F574 HydrophobicContact CG2-CD1 3.89Å; V556-F574 HydrophobicContact CG2-CE1 3.95Å; A570-F574 PolarHBondContact O-N 3.36Å; S571-F574 PolarHBondContact O-N 3.37Å; F574-S576 VanDerWaalsContact C-N 3.29Å; F574-S576 PolarHBondContact O-N 3.49Å; F574-Q577 WeakPolarHBondContact O-CA 3.39Å; F574-Q577 WeakPolarHBondContact O-CB 3.37Å; F574-Q577 PolarHBondContact O-N 3.36Å; F574-L578 HydrophobicContact CD2-CG 4.34Å; F574-L578 HydrophobicContact CE1-CD1 3.87Å; F574-L578 HydrophobicContact CE1-CG 4.35Å; F574-L578 HydrophobicContact CE2-CD1 4.25Å; F574-L578 HydrophobicContact CE2-CD2 3.79Å; F574-L578 HydrophobicContact CE2-CG 3.89Å; F574-L578 HydrophobicContact CZ-CD1 3.74Å; F574-L578 HydrophobicContact CZ-CD2 3.91Å; F574-L578 HydrophobicContact CZ-CG 3.9Å; F574-L578 PolarHBondContact O-N 2.97Å
575	L	98.5	Very high	96.8	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-64.8	-33.7	176.7	-66.2	-170.7	0	0	0	112.3	V553 V556 V557 I560 S571 Q577 L578 S579 I588 F597 I615	V553-L575 HydrophobicContact CG1-CD2 4.39Å; V556-L575 HydrophobicContact CB-CD2 4.22Å; V556-L575 HydrophobicContact CG1-CD1 4.15Å; V556-L575 HydrophobicContact CG1-CD2 3.68Å; V556-L575 HydrophobicContact CG1-CG 3.7Å; V557-L575 HydrophobicContact CG2-CD1 3.89Å; I560-L575 HydrophobicContact CD1-CD1 3.34Å; I560-L575 HydrophobicContact CD1-CG 4.43Å; S571-L575 WeakPolarHBondContact O-CG 3.42Å; S571-L575 PolarHBondContact O-N 3.19Å; L575-Q577 VanDerWaalsContact C-N 3.3Å; L575-Q577 PolarHBondContact O-N 2.98Å; L575-L578 HydrophobicContact CD2-CD1 4.13Å; L575-L578 PolarHBondContact O-N 3.43Å; L575-S579 WeakPolarHBondContact O-CB 3.47Å; L575-S579 PolarHBondContact O-N 2.91Å; L575-S579 PolarHBondContact O-OG 2.71Å; L575-I588 HydrophobicContact CB-CD1 4.09Å; L575-I588 HydrophobicContact CD2-CD1 4.39Å; L575-I588 HydrophobicContact CD2-CG1 4.19Å; L575-I588 VanDerWaalsContact O-CD1 3.29Å; L575-I588 WeakPolarHBondContact O-CD1 3.41Å; L575-F597 HydrophobicContact CD1-CE1 4.23Å; L575-F597 HydrophobicContact CD1-CZ 3.76Å; L575-I615 HydrophobicContact CB-CD1 3.86Å
576	S	98	Very high	96.8	Very high	9 Å²	9	26 Å²	26	6%	0.063	13%	0.133	C	C	.	.	H	α-helix	trans	-62	-41.8	171.7	-168.6	0	0	0	0	110.5	T572 A573 F574 S579 R618	T572-S576 WeakPolarHBondContact O-CB 3.33Å; T572-S576 PolarHBondContact O-N 3.46Å; A573-S576 PolarHBondContact O-N 2.9Å; F574-S576 VanDerWaalsContact C-N 3.29Å; F574-S576 PolarHBondContact O-N 3.49Å; S576-S579 WeakPolarHBondContact CA-OG 3.21Å; S576-S579 PolarHBondContact O-N 2.96Å; S576-S579 PolarHBondContact O-OG 3.39Å; S576-R618 PolarHBondContact O-NH1 3.09Å; S576-R618 PolarHBondContact OG-NH1 3.34Å
577	Q	97.9	Very high	96.9	Very high	36 Å²	36	24.6 Å²	24.6	17%	0.168	13%	0.125	C	C	.	.	H	α-helix	trans	-62.6	-44.6	172.5	-175	59.1	45.1	0	0	111.7	Q534 A537 Q543 A573 F574 L575 S579 T580	Q534-Q577 HydrophobicContact CG-CB 4.12Å; A537-Q577 HydrophobicContact CB-CG 3.66Å; A537-Q577 WeakPolarHBondContact O-CG 3.49Å; A537-Q577 PolarHBondContact O-NE2 3.48Å; Q543-Q577 PolarHBondContact NE2-O 3.27Å; A573-Q577 PolarHBondContact O-N 2.82Å; F574-Q577 WeakPolarHBondContact O-CA 3.39Å; F574-Q577 WeakPolarHBondContact O-CB 3.37Å; F574-Q577 PolarHBondContact O-N 3.36Å; L575-Q577 VanDerWaalsContact C-N 3.3Å; L575-Q577 PolarHBondContact O-N 2.98Å; Q577-S579 VanDerWaalsContact C-N 3.3Å; Q577-S579 PolarHBondContact O-N 3.44Å; Q577-T580 WeakPolarHBondContact O-CG2 3.43Å; Q577-T580 PolarHBondContact O-N 3.19Å; Q577-T580 PolarHBondContact O-OG1 3.1Å
578	L	98	Very high	96.9	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-61.8	-36.8	176.6	-66.5	-171.9	0	0	0	112.6	A537 Q543 F546 I547 V553 F574 L575 T580 S581 G584 I588	A537-L578 HydrophobicContact CB-CD2 4.24Å; Q543-L578 HydrophobicContact CG-CD2 3.89Å; Q543-L578 VanDerWaalsContact NE2-C 3.35Å; Q543-L578 PolarHBondContact NE2-O 3.06Å; F546-L578 HydrophobicContact CB-CD2 4.3Å; I547-L578 HydrophobicContact CG1-CD2 4.38Å; V553-L578 HydrophobicContact CG2-CD1 4.25Å; F574-L578 HydrophobicContact CD2-CG 4.34Å; F574-L578 HydrophobicContact CE1-CD1 3.87Å; F574-L578 HydrophobicContact CE1-CG 4.35Å; F574-L578 HydrophobicContact CE2-CD1 4.25Å; F574-L578 HydrophobicContact CE2-CD2 3.79Å; F574-L578 HydrophobicContact CE2-CG 3.89Å; F574-L578 HydrophobicContact CZ-CD1 3.74Å; F574-L578 HydrophobicContact CZ-CD2 3.91Å; F574-L578 HydrophobicContact CZ-CG 3.9Å; F574-L578 PolarHBondContact O-N 2.97Å; L575-L578 HydrophobicContact CD2-CD1 4.13Å; L575-L578 PolarHBondContact O-N 3.43Å; L578-T580 PolarHBondContact O-N 3.47Å; L578-T580 VanDerWaalsContact O-N 3.07Å; L578-S581 PolarHBondContact O-N 3.27Å; L578-S581 PolarHBondContact O-OG 3.34Å; L578-G584 WeakPolarHBondContact O-CA 3.49Å; L578-I588 HydrophobicContact CB-CD1 4.16Å
579	S	97	Very high	96.8	Very high	2 Å²	2	26.7 Å²	26.7	1%	0.014	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-6	-179.9	71.3	0	0	0	0	114.5	L575 S576 Q577 S581 C585 R618	L575-S579 WeakPolarHBondContact O-CB 3.47Å; L575-S579 PolarHBondContact O-N 2.91Å; L575-S579 PolarHBondContact O-OG 2.71Å; S576-S579 WeakPolarHBondContact CA-OG 3.21Å; S576-S579 PolarHBondContact O-N 2.96Å; S576-S579 PolarHBondContact O-OG 3.39Å; Q577-S579 VanDerWaalsContact C-N 3.3Å; Q577-S579 PolarHBondContact O-N 3.44Å; S579-S581 PolarHBondContact O-N 3.48Å; S579-C585 PolarHBondContact O-SG 3.32Å; S579-R618 WeakPolarHBondContact O-CD 3.38Å; S579-R618 VanDerWaalsContact OG-CD 3.27Å; S579-R618 WeakPolarHBondContact OG-CD 3.38Å; S579-R618 PolarHBondContact OG-NH1 3.22Å
580	T	96.7	Very high	96.7	Very high	73 Å²	73	31.8 Å²	31.8	45%	0.448	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-18.5	174.3	65.8	0	0	0	0	112.7	Q543 Q577 L578	Q543-T580 PolarHBondContact NE2-OG1 2.7Å; Q577-T580 WeakPolarHBondContact O-CG2 3.43Å; Q577-T580 PolarHBondContact O-N 3.19Å; Q577-T580 PolarHBondContact O-OG1 3.1Å; L578-T580 PolarHBondContact O-N 3.47Å; L578-T580 VanDerWaalsContact O-N 3.07Å
581	S	95.1	Very high	96.7	Very high	16 Å²	16	35.2 Å²	35.2	11%	0.112	18%	0.179	C	C	.	.	S	Bend	trans	-102.1	154.2	171.8	77.4	0	0	0	0	111.5	L578 S579 S583 G584 C585	L578-S581 PolarHBondContact O-N 3.27Å; L578-S581 PolarHBondContact O-OG 3.34Å; S579-S581 PolarHBondContact O-N 3.48Å; S581-S583 PolarHBondContact OG-OG 3.25Å; S581-G584 PolarHBondContact O-N 3.43Å; S581-G584 PolarHBondContact OG-N 3.22Å; S581-C585 PolarHBondContact O-N 3.07Å; S581-C585 PolarHBondContact O-SG 3.48Å
582	R	94.2	Very high	96.4	Very high	163 Å²	163	37.3 Å²	37.3	62%	0.615	20%	0.201	S	C	*	.	H	α-helix	trans	-64.8	-42.8	176	-170.4	-179.5	-167.5	-172.2	2.4	111.9	G584 C585 Q586 D622	R582-G584 VanDerWaalsContact C-N 3.27Å; R582-G584 PolarHBondContact O-N 3.09Å; R582-C585 PolarHBondContact O-N 2.88Å; R582-Q586 WeakPolarHBondContact O-CG 3.49Å; R582-Q586 PolarHBondContact O-N 3.39Å; R582-D622 IonicContact CZ-OD2 3.3Å; R582-D622 IonicContact NE-OD2 3.82Å; R582-D622 PolarHBondContact NE-OD2 3.5Å; R582-D622 IonicContact NH2-OD1 2.81Å; R582-D622 IonicContact NH2-OD2 3.39Å; R582-D622 PolarHBondContact NH2-OD2 2.9Å
583	S	95.6	Very high	96.1	Very high	30 Å²	30	37.4 Å²	37.4	21%	0.21	20%	0.201	C	C	.	.	H	α-helix	trans	-56.7	-42.6	173.9	46.4	0	0	0	0	111	E544 I547 S581 Q586 A587	E544-S583 WeakPolarHBondContact OE2-CB 3.5Å; E544-S583 PolarHBondContact OE2-OG 3.01Å; I547-S583 WeakPolarHBondContact CD1-OG 3.28Å; S581-S583 PolarHBondContact OG-OG 3.25Å; S583-Q586 PolarHBondContact O-N 2.89Å; S583-A587 WeakPolarHBondContact O-CB 3.39Å; S583-A587 PolarHBondContact O-N 3.33Å
584	G	96.6	Very high	95.9	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-68.2	-41.6	177.9	0	0	0	0	0	113.2	I547 L578 S581 R582 Q586 A587 I588	I547-G584 VanDerWaalsContact CD1-CA 3.49Å; L578-G584 WeakPolarHBondContact O-CA 3.49Å; S581-G584 PolarHBondContact O-N 3.43Å; S581-G584 PolarHBondContact OG-N 3.22Å; R582-G584 VanDerWaalsContact C-N 3.27Å; R582-G584 PolarHBondContact O-N 3.09Å; G584-Q586 VanDerWaalsContact C-N 3.33Å; G584-Q586 PolarHBondContact O-N 3.19Å; G584-A587 PolarHBondContact O-N 3.43Å; G584-I588 WeakPolarHBondContact O-CB 3.47Å; G584-I588 WeakPolarHBondContact O-CD1 3.37Å; G584-I588 WeakPolarHBondContact O-CG1 3.49Å; G584-I588 PolarHBondContact O-N 3.39Å
585	C	95.7	Very high	95.6	Very high	17 Å²	17	42.6 Å²	42.6	12%	0.115	24%	0.235	C	C	.	.	H	α-helix	trans	-56.9	-47	172.5	-73.9	0	0	0	0	112	S579 S581 R582 I588 E589 I619	S579-C585 PolarHBondContact O-SG 3.32Å; S581-C585 PolarHBondContact O-N 3.07Å; S581-C585 PolarHBondContact O-SG 3.48Å; R582-C585 PolarHBondContact O-N 2.88Å; C585-I588 PolarHBondContact O-N 3.39Å; C585-E589 WeakPolarHBondContact O-CB 3.48Å; C585-E589 PolarHBondContact O-N 3.26Å; C585-I619 HydrophobicContact CB-CG1 4.1Å
586	Q	95.5	Very high	95.4	Very high	91 Å²	91	45 Å²	45	43%	0.425	24%	0.244	S	C	.	.	H	α-helix	trans	-64.8	-44.5	178.8	-70.8	174.9	-12.1	0	0	111.7	R582 S583 G584 I588 E589 N590	R582-Q586 WeakPolarHBondContact O-CG 3.49Å; R582-Q586 PolarHBondContact O-N 3.39Å; S583-Q586 PolarHBondContact O-N 2.89Å; G584-Q586 VanDerWaalsContact C-N 3.33Å; G584-Q586 PolarHBondContact O-N 3.19Å; Q586-I588 VanDerWaalsContact C-N 3.35Å; Q586-I588 PolarHBondContact O-N 2.86Å; Q586-E589 PolarHBondContact O-N 3.42Å; Q586-N590 VanDerWaalsContact O-CB 3.32Å; Q586-N590 WeakPolarHBondContact O-CB 3.33Å; Q586-N590 PolarHBondContact O-N 3.46Å; Q586-N590 PolarHBondContact O-ND2 2.86Å; Q586-N590 PolarHBondContact O-OD1 3.25Å
587	A	96.4	Very high	95.2	Very high	20 Å²	20	44.6 Å²	44.6	17%	0.165	24%	0.241	C	C	.	.	H	α-helix	trans	-59.9	-44.6	177.5	0	0	0	0	0	111.8	I547 S583 G584 N590 E591	I547-A587 HydrophobicContact CG2-CB 3.85Å; S583-A587 WeakPolarHBondContact O-CB 3.39Å; S583-A587 PolarHBondContact O-N 3.33Å; G584-A587 PolarHBondContact O-N 3.43Å; A587-N590 PolarHBondContact O-N 2.83Å; A587-E591 WeakPolarHBondContact O-CG 3.43Å; A587-E591 PolarHBondContact O-N 3.17Å
588	I	96.5	Very high	94.9	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-65.9	-43.2	177.8	-65.8	164.2	0	0	0	111.5	V553 L575 L578 G584 C585 Q586 N590 E591 A593 F597 I615 I619	V553-I588 HydrophobicContact CG1-CG1 4.38Å; L575-I588 HydrophobicContact CB-CD1 4.09Å; L575-I588 HydrophobicContact CD2-CD1 4.39Å; L575-I588 HydrophobicContact CD2-CG1 4.19Å; L575-I588 VanDerWaalsContact O-CD1 3.29Å; L575-I588 WeakPolarHBondContact O-CD1 3.41Å; L578-I588 HydrophobicContact CB-CD1 4.16Å; G584-I588 WeakPolarHBondContact O-CB 3.47Å; G584-I588 WeakPolarHBondContact O-CD1 3.37Å; G584-I588 WeakPolarHBondContact O-CG1 3.49Å; G584-I588 PolarHBondContact O-N 3.39Å; C585-I588 PolarHBondContact O-N 3.39Å; Q586-I588 VanDerWaalsContact C-N 3.35Å; Q586-I588 PolarHBondContact O-N 2.86Å; I588-N590 VanDerWaalsContact C-N 3.33Å; I588-E591 PolarHBondContact O-N 2.84Å; I588-A593 HydrophobicContact CG2-CB 4.45Å; I588-F597 HydrophobicContact CG2-CE2 3.53Å; I588-F597 HydrophobicContact CG2-CZ 3.9Å; I588-I615 HydrophobicContact CG2-CG2 4.2Å; I588-I619 HydrophobicContact CB-CD1 4.37Å; I588-I619 HydrophobicContact CG2-CD1 3.93Å
589	E	94.2	Very high	94.6	Very high	65 Å²	65	51.9 Å²	51.9	30%	0.304	28%	0.28	S	S	.	.	H	α-helix	trans	-63.5	-40.4	178.5	-174.6	172.5	-147.2	0	0	111.4	C585 Q586 E591 G592 I619 K623	C585-E589 WeakPolarHBondContact O-CB 3.48Å; C585-E589 PolarHBondContact O-N 3.26Å; Q586-E589 PolarHBondContact O-N 3.42Å; E589-E591 VanDerWaalsContact C-N 3.26Å; E589-E591 PolarHBondContact O-N 3.18Å; E589-G592 PolarHBondContact O-N 3.44Å; E589-I619 HydrophobicContact CB-CD1 4.49Å; E589-I619 HydrophobicContact CB-CG2 4.14Å; E589-I619 HydrophobicContact CG-CG2 4.2Å; E589-K623 WeakPolarHBondContact OE1-CE 3.44Å; E589-K623 IonicContact OE1-NZ 3.58Å; E589-K623 PolarHBondContact OE1-NZ 2.89Å; E589-K623 IonicContact OE2-NZ 3.37Å; E589-K623 PolarHBondContact OE2-NZ 3.34Å
590	N	95.5	Very high	94.4	Very high	134 Å²	134	52.2 Å²	52.2	72%	0.717	28%	0.282	S	S	*	.	H	α-helix	trans	-64.9	-26.4	179.4	-70.8	-17.7	0	0	0	113.4	Q586 A587 I588 G592	Q586-N590 VanDerWaalsContact O-CB 3.32Å; Q586-N590 WeakPolarHBondContact O-CB 3.33Å; Q586-N590 PolarHBondContact O-N 3.46Å; Q586-N590 PolarHBondContact O-ND2 2.86Å; Q586-N590 PolarHBondContact O-OD1 3.25Å; A587-N590 PolarHBondContact O-N 2.83Å; I588-N590 VanDerWaalsContact C-N 3.33Å; N590-G592 PolarHBondContact O-N 3.02Å
591	E	95.9	Very high	94.1	Very high	79 Å²	79	49.1 Å²	49.1	37%	0.369	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-2.7	173.1	-64.6	-66.1	160.9	0	0	113	V553 S554 V557 A587 I588 E589 A593	V553-E591 HydrophobicContact CB-CG 4.47Å; V553-E591 HydrophobicContact CG1-CG 3.95Å; S554-E591 VanDerWaalsContact CA-OE2 3.29Å; S554-E591 WeakPolarHBondContact CA-OE2 3.32Å; S554-E591 VanDerWaalsContact CB-CD 3.49Å; S554-E591 WeakPolarHBondContact CB-OE2 3.37Å; S554-E591 PolarHBondContact OG-OE2 3.37Å; V557-E591 HydrophobicContact CB-CB 4.36Å; V557-E591 HydrophobicContact CG1-CB 4.35Å; V557-E591 HydrophobicContact CG2-CB 3.92Å; V557-E591 HydrophobicContact CG2-CG 4.37Å; A587-E591 WeakPolarHBondContact O-CG 3.43Å; A587-E591 PolarHBondContact O-N 3.17Å; I588-E591 PolarHBondContact O-N 2.84Å; E589-E591 VanDerWaalsContact C-N 3.26Å; E589-E591 PolarHBondContact O-N 3.18Å; E591-A593 PolarHBondContact O-N 3.18Å
592	G	93.5	Very high	93.7	Very high	44 Å²	44	55.3 Å²	55.3	45%	0.454	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.9	21.9	174	0	0	0	0	0	115	E589 N590 C594 P595	E589-G592 PolarHBondContact O-N 3.44Å; N590-G592 PolarHBondContact O-N 3.02Å; G592-C594 VanDerWaalsContact C-N 3.33Å; G592-C594 PolarHBondContact O-N 2.93Å; G592-P595 VanDerWaalsContact O-CD 3.3Å; G592-P595 WeakPolarHBondContact O-CD 3.48Å
593	A	91.7	Very high	93.5	Very high	2 Å²	2	49 Å²	49	2%	0.017	27%	0.271	C	S	.	.			trans	-76.1	-13.4	-174.2	0	0	0	0	0	114.9	V557 I588 E591 R596 F597	V557-A593 HydrophobicContact CG1-CB 3.72Å; V557-A593 HydrophobicContact CG2-CB 3.96Å; I588-A593 HydrophobicContact CG2-CB 4.45Å; E591-A593 PolarHBondContact O-N 3.18Å; A593-R596 PolarHBondContact O-N 3.46Å; A593-R596 VanDerWaalsContact O-N 3.08Å; A593-F597 HydrophobicContact CB-CD2 4.1Å; A593-F597 HydrophobicContact CB-CE1 4.37Å; A593-F597 HydrophobicContact CB-CE2 3.37Å; A593-F597 HydrophobicContact CB-CZ 3.53Å; A593-F597 WeakPolarHBondContact O-CD2 3.42Å; A593-F597 PolarHBondContact O-N 3.5Å; A593-F597 VanDerWaalsContact O-N 3.08Å
594	C	92	Very high	93.2	Very high	26 Å²	26	55.8 Å²	55.8	18%	0.176	30%	0.304	C	S	.	.	H	α-helix	trans	-52.3	-46	-174	-67.7	0	0	0	0	114.8	G592 R596 F597 T598 L616	G592-C594 VanDerWaalsContact C-N 3.33Å; G592-C594 PolarHBondContact O-N 2.93Å; C594-R596 VanDerWaalsContact C-N 3.29Å; C594-R596 PolarHBondContact O-N 2.98Å; C594-F597 PolarHBondContact O-N 3.33Å; C594-T598 PolarHBondContact O-N 3.42Å; C594-T598 PolarHBondContact O-OG1 2.93Å; C594-T598 VanDerWaalsContact O-OG1 3.13Å; C594-L616 HydrophobicContact CB-CD2 4.24Å
595	P	92.6	Very high	92.8	Very high	88 Å²	88	57.6 Å²	57.6	57%	0.571	31%	0.314	S	S	*	.	H	α-helix	trans	-60	-39.6	178.4	-23.9	35.4	0	0	0	112.8	G592 T598 E599	G592-P595 VanDerWaalsContact O-CD 3.3Å; G592-P595 WeakPolarHBondContact O-CD 3.48Å; P595-T598 WeakPolarHBondContact O-CB 3.43Å; P595-T598 PolarHBondContact O-N 3.49Å; P595-E599 PolarHBondContact O-N 2.96Å
596	R	94.7	Very high	92.6	Very high	51 Å²	51	62.2 Å²	62.2	19%	0.192	33%	0.334	C	S	.	.	H	α-helix	trans	-69.4	-36.1	178.9	-175.9	56.4	175.1	176.9	0	111.9	I560 Y561 A593 C594 T598 E599 L600	I560-R596 HydrophobicContact CG2-CG 3.81Å; Y561-R596 HydrophobicContact CD1-CG 4.31Å; Y561-R596 HydrophobicContact CE1-CB 4.05Å; Y561-R596 HydrophobicContact CE1-CG 3.87Å; Y561-R596 HydrophobicContact CE2-CB 4.29Å; Y561-R596 HydrophobicContact CE2-CG 4.16Å; Y561-R596 WeakPolarHBondContact OH-CB 3.33Å; A593-R596 PolarHBondContact O-N 3.46Å; A593-R596 VanDerWaalsContact O-N 3.08Å; C594-R596 VanDerWaalsContact C-N 3.29Å; C594-R596 PolarHBondContact O-N 2.98Å; R596-T598 VanDerWaalsContact C-N 3.3Å; R596-T598 PolarHBondContact O-N 2.83Å; R596-E599 WeakPolarHBondContact CD-OE2 3.36Å; R596-E599 IonicContact CZ-OE2 3.17Å; R596-E599 IonicContact NH1-OE2 3.04Å; R596-E599 PolarHBondContact NH1-OE2 3.42Å; R596-E599 PolarHBondContact O-N 3.19Å; R596-L600 HydrophobicContact CG-CD1 4.16Å; R596-L600 WeakPolarHBondContact O-CB 3.28Å; R596-L600 WeakPolarHBondContact O-CG 3.39Å; R596-L600 PolarHBondContact O-N 3.43Å
597	F	94.7	Very high	92.4	Very high	0 Å²	0	61 Å²	61	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-62.7	-38.8	171.7	-61.3	-41.1	0	0	0	112	I560 L575 I588 A593 C594 E599 L600 I601 T612 I615 L616	I560-F597 HydrophobicContact CD1-CE1 3.56Å; I560-F597 HydrophobicContact CD1-CZ 4.08Å; L575-F597 HydrophobicContact CD1-CE1 4.23Å; L575-F597 HydrophobicContact CD1-CZ 3.76Å; I588-F597 HydrophobicContact CG2-CE2 3.53Å; I588-F597 HydrophobicContact CG2-CZ 3.9Å; A593-F597 HydrophobicContact CB-CD2 4.1Å; A593-F597 HydrophobicContact CB-CE1 4.37Å; A593-F597 HydrophobicContact CB-CE2 3.37Å; A593-F597 HydrophobicContact CB-CZ 3.53Å; A593-F597 WeakPolarHBondContact O-CD2 3.42Å; A593-F597 PolarHBondContact O-N 3.5Å; A593-F597 VanDerWaalsContact O-N 3.08Å; C594-F597 PolarHBondContact O-N 3.33Å; F597-E599 VanDerWaalsContact C-N 3.32Å; F597-E599 PolarHBondContact O-N 3.34Å; F597-L600 PolarHBondContact O-N 2.97Å; F597-L600 VanDerWaalsContact O-N 3.15Å; F597-I601 WeakPolarHBondContact O-CG1 3.34Å; F597-I601 PolarHBondContact O-N 2.9Å; F597-T612 HydrophobicContact CB-CG2 4.43Å; F597-T612 HydrophobicContact CD1-CG2 3.75Å; F597-T612 HydrophobicContact CG-CG2 4.47Å; F597-I615 HydrophobicContact CD2-CG2 3.89Å; F597-I615 HydrophobicContact CE1-CD1 4.08Å; F597-I615 HydrophobicContact CE2-CG2 3.64Å; F597-I615 HydrophobicContact CZ-CD1 4.18Å; F597-I615 HydrophobicContact CZ-CG2 4.15Å; F597-L616 HydrophobicContact CB-CD1 3.67Å; F597-L616 HydrophobicContact CB-CD2 4.13Å; F597-L616 HydrophobicContact CB-CG 3.79Å; F597-L616 HydrophobicContact CD2-CD2 4.49Å
598	T	91.1	Very high	92.3	Very high	70 Å²	70	60 Å²	60	43%	0.429	32%	0.318	S	S	.	.	H	α-helix	trans	-59.6	-42.1	176.9	-54	0	0	0	0	112.1	C594 P595 R596	C594-T598 PolarHBondContact O-N 3.42Å; C594-T598 PolarHBondContact O-OG1 2.93Å; C594-T598 VanDerWaalsContact O-OG1 3.13Å; P595-T598 WeakPolarHBondContact O-CB 3.43Å; P595-T598 PolarHBondContact O-N 3.49Å; R596-T598 VanDerWaalsContact C-N 3.3Å; R596-T598 PolarHBondContact O-N 2.83Å
599	E	91.6	Very high	92.1	Very high	118 Å²	118	60.2 Å²	60.2	55%	0.551	32%	0.319	S	S	*	.	H	α-helix	trans	-63.7	-45.6	172.7	-69.9	179.8	161.1	0	0	112	P595 R596 F597 I601 Q602	P595-E599 PolarHBondContact O-N 2.96Å; R596-E599 WeakPolarHBondContact CD-OE2 3.36Å; R596-E599 IonicContact CZ-OE2 3.17Å; R596-E599 IonicContact NH1-OE2 3.04Å; R596-E599 PolarHBondContact NH1-OE2 3.42Å; R596-E599 PolarHBondContact O-N 3.19Å; F597-E599 VanDerWaalsContact C-N 3.32Å; F597-E599 PolarHBondContact O-N 3.34Å; E599-I601 PolarHBondContact O-N 3.48Å; E599-Q602 PolarHBondContact O-N 3.2Å; E599-Q602 VanDerWaalsContact O-N 3.11Å
600	L	93.2	Very high	92	Very high	10 Å²	10	58.2 Å²	58.2	5%	0.052	31%	0.314	C	S	.	.	H	α-helix	trans	-72.6	-12.4	-173.7	-74.1	176.8	0	0	0	114.5	I560 T572 R596 F597 Q602 S603 I608 T612	I560-L600 HydrophobicContact CG2-CD1 3.27Å; T572-L600 HydrophobicContact CG2-CD1 4.39Å; R596-L600 HydrophobicContact CG-CD1 4.16Å; R596-L600 WeakPolarHBondContact O-CB 3.28Å; R596-L600 WeakPolarHBondContact O-CG 3.39Å; R596-L600 PolarHBondContact O-N 3.43Å; F597-L600 PolarHBondContact O-N 2.97Å; F597-L600 VanDerWaalsContact O-N 3.15Å; L600-Q602 PolarHBondContact O-N 3.22Å; L600-S603 WeakPolarHBondContact O-CB 3.26Å; L600-S603 PolarHBondContact O-N 3.19Å; L600-S603 VanDerWaalsContact O-N 3.1Å; L600-I608 HydrophobicContact CB-CG2 4Å; L600-I608 HydrophobicContact CD1-CG2 4.42Å; L600-I608 HydrophobicContact CD2-CG2 4.15Å; L600-I608 HydrophobicContact CG-CG2 4.43Å; L600-T612 HydrophobicContact CB-CG2 3.77Å; L600-T612 HydrophobicContact CD1-CG2 4.3Å
601	I	89.2	Confident	92.1	Very high	8 Å²	8	53.7 Å²	53.7	4%	0.041	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-31	169	-67.8	159.8	0	0	0	110.7	F597 E599 S603 A609 T612 A613 L616 L635	F597-I601 WeakPolarHBondContact O-CG1 3.34Å; F597-I601 PolarHBondContact O-N 2.9Å; E599-I601 PolarHBondContact O-N 3.48Å; I601-S603 PolarHBondContact O-N 3.13Å; I601-A609 WeakPolarHBondContact O-CB 3.26Å; I601-T612 WeakPolarHBondContact CG1-OG1 3.35Å; I601-A613 HydrophobicContact CG1-CB 4.4Å; I601-L616 HydrophobicContact CD1-CD1 3.32Å; I601-L616 HydrophobicContact CG1-CD1 4.19Å; I601-L635 HydrophobicContact CD1-CD2 3.27Å; I601-L635 HydrophobicContact CG1-CD2 4.17Å
602	Q	87.9	Confident	92	Very high	146 Å²	146	49.9 Å²	49.9	68%	0.682	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	13.3	176.8	-60	-178.1	-12.5	0	0	112.7	E599 L600	E599-Q602 PolarHBondContact O-N 3.2Å; E599-Q602 VanDerWaalsContact O-N 3.11Å; L600-Q602 PolarHBondContact O-N 3.22Å
603	S	89.2	Confident	92	Very high	30 Å²	30	48.2 Å²	48.2	21%	0.21	25%	0.251	C	S	.	.			trans	-64.3	138.2	177.3	-176.4	0	0	0	0	111	L600 I601 N605	L600-S603 WeakPolarHBondContact O-CB 3.26Å; L600-S603 PolarHBondContact O-N 3.19Å; L600-S603 VanDerWaalsContact O-N 3.1Å; I601-S603 PolarHBondContact O-N 3.13Å; S603-N605 PolarHBondContact O-N 2.97Å; S603-N605 VanDerWaalsContact O-N 3.09Å; S603-N605 PolarHBondContact OG-N 3.03Å
604	N	88.6	Confident	92.1	Very high	172 Å²	172	49.3 Å²	49.3	92%	0.92	26%	0.26	S	S	*	.	S	Bend	trans	-64.7	-9.9	171.2	-65.1	-27.1	0	0	0	113
605	N	90.1	Very high	92.3	Very high	39 Å²	39	48 Å²	48	21%	0.209	25%	0.252	C	S	.	.	S	Bend	trans	-92.8	109.8	172.8	-170.9	-59.4	0	0	0	110	V565 S603 Y607 I608 A609	V565-N605 HydrophobicContact CG1-CB 4.26Å; S603-N605 PolarHBondContact O-N 2.97Å; S603-N605 VanDerWaalsContact O-N 3.09Å; S603-N605 PolarHBondContact OG-N 3.03Å; N605-Y607 PolarHBondContact O-N 3.02Å; N605-Y607 VanDerWaalsContact O-N 3.15Å; N605-Y607 WeakPolarHBondContact OD1-CB 3.34Å; N605-Y607 PolarHBondContact OD1-N 3.37Å; N605-I608 HydrophobicContact CB-CB 4.15Å; N605-I608 HydrophobicContact CB-CD1 3.79Å; N605-I608 HydrophobicContact CB-CG1 3.91Å; N605-I608 PolarHBondContact O-N 2.84Å; N605-I608 PolarHBondContact OD1-N 3.1Å; N605-A609 PolarHBondContact O-N 3.39Å; N605-A609 VanDerWaalsContact O-N 3.08Å
606	E	90.3	Very high	92.4	Very high	113 Å²	113	44 Å²	44	53%	0.528	23%	0.226	S	C	.	.	H	α-helix	trans	-52.9	-37.2	-178.2	-72	178.1	-161.2	0	0	113.7	A610 L644	E606-A610 VanDerWaalsContact O-CB 3.29Å; E606-A610 WeakPolarHBondContact O-CB 3.46Å; E606-A610 PolarHBondContact O-N 3.28Å; E606-L644 HydrophobicContact CB-CD1 4.22Å; E606-L644 HydrophobicContact CB-CD2 4Å; E606-L644 HydrophobicContact CB-CG 4.23Å; E606-L644 HydrophobicContact CG-CD1 4.39Å; E606-L644 HydrophobicContact CG-CD2 4.25Å; E606-L644 HydrophobicContact CG-CG 4.11Å
607	Y	91.5	Very high	92.3	Very high	66 Å²	66	46 Å²	46	26%	0.259	24%	0.237	S	C	.	.	H	α-helix	trans	-69.8	-41.7	178.9	-62.1	-74.6	0	0	0	111.8	N605 A610 Y611 P667 N668	N605-Y607 PolarHBondContact O-N 3.02Å; N605-Y607 VanDerWaalsContact O-N 3.15Å; N605-Y607 WeakPolarHBondContact OD1-CB 3.34Å; N605-Y607 PolarHBondContact OD1-N 3.37Å; Y607-A610 PolarHBondContact O-N 3.38Å; Y607-Y611 WeakPolarHBondContact O-CB 3.38Å; Y607-Y611 WeakPolarHBondContact O-CD2 3.38Å; Y607-Y611 VanDerWaalsContact O-CG 3.27Å; Y607-Y611 PolarHBondContact O-N 3.41Å; Y607-P667 HydrophobicContact CD1-CB 4.06Å; Y607-P667 HydrophobicContact CD2-CB 4.44Å; Y607-P667 HydrophobicContact CE1-CB 3.85Å; Y607-P667 HydrophobicContact CE2-CB 4.23Å; Y607-P667 HydrophobicContact CG-CB 4.34Å; Y607-N668 PolarHBondContact OH-N 3.4Å
608	I	94.7	Very high	92.3	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-60.6	-50.7	176.6	-64.5	178.4	0	0	0	109.1	V565 Q568 R569 L600 N605 A610 Y611 T612	V565-I608 HydrophobicContact CG1-CD1 3.91Å; Q568-I608 HydrophobicContact CB-CD1 3.72Å; R569-I608 HydrophobicContact CB-CD1 4.22Å; R569-I608 HydrophobicContact CB-CG1 3.88Å; R569-I608 HydrophobicContact CG-CG1 4.45Å; L600-I608 HydrophobicContact CB-CG2 4Å; L600-I608 HydrophobicContact CD1-CG2 4.42Å; L600-I608 HydrophobicContact CD2-CG2 4.15Å; L600-I608 HydrophobicContact CG-CG2 4.43Å; N605-I608 HydrophobicContact CB-CB 4.15Å; N605-I608 HydrophobicContact CB-CD1 3.79Å; N605-I608 HydrophobicContact CB-CG1 3.91Å; N605-I608 PolarHBondContact O-N 2.84Å; N605-I608 PolarHBondContact OD1-N 3.1Å; I608-A610 VanDerWaalsContact C-N 3.34Å; I608-A610 PolarHBondContact O-N 2.98Å; I608-Y611 PolarHBondContact O-N 3.28Å; I608-T612 HydrophobicContact CG2-CG2 4.33Å; I608-T612 WeakPolarHBondContact O-CG2 3.44Å; I608-T612 PolarHBondContact O-N 3.47Å; I608-T612 PolarHBondContact O-OG1 3.12Å
609	A	92.9	Very high	92.4	Very high	3 Å²	3	46.4 Å²	46.4	3%	0.025	23%	0.231	C	C	.	.	H	α-helix	trans	-58.1	-44.4	179.5	0	0	0	0	0	112.3	I601 N605 T612 A613 L639 L644	I601-A609 WeakPolarHBondContact O-CB 3.26Å; N605-A609 PolarHBondContact O-N 3.39Å; N605-A609 VanDerWaalsContact O-N 3.08Å; A609-T612 PolarHBondContact O-OG1 2.99Å; A609-A613 WeakPolarHBondContact O-CB 3.41Å; A609-A613 PolarHBondContact O-N 2.84Å; A609-L639 HydrophobicContact CB-CD2 4.38Å; A609-L644 HydrophobicContact CB-CD1 3.84Å
610	A	91.7	Very high	92.5	Very high	24 Å²	24	40.9 Å²	40.9	20%	0.198	21%	0.206	C	C	.	.	H	α-helix	trans	-65.3	-43.7	177.5	0	0	0	0	0	112.6	E606 Y607 I608 A614	E606-A610 VanDerWaalsContact O-CB 3.29Å; E606-A610 WeakPolarHBondContact O-CB 3.46Å; E606-A610 PolarHBondContact O-N 3.28Å; Y607-A610 PolarHBondContact O-N 3.38Å; I608-A610 VanDerWaalsContact C-N 3.34Å; I608-A610 PolarHBondContact O-N 2.98Å; A610-A614 WeakPolarHBondContact O-CB 3.38Å; A610-A614 PolarHBondContact O-N 3.24Å
611	Y	96.4	Very high	92.2	Very high	38 Å²	38	45.9 Å²	45.9	15%	0.149	23%	0.229	C	C	.	.	H	α-helix	trans	-65.8	-44.1	179.3	-70	-44.4	0	0	0	112.1	A573 Y607 I608 A614 I615	A573-Y611 HydrophobicContact CB-CD2 3.85Å; A573-Y611 HydrophobicContact CB-CE1 4.35Å; A573-Y611 HydrophobicContact CB-CE2 3.49Å; A573-Y611 VanDerWaalsContact CB-CE2 3.49Å; A573-Y611 HydrophobicContact CB-CG 4.44Å; Y607-Y611 WeakPolarHBondContact O-CB 3.38Å; Y607-Y611 WeakPolarHBondContact O-CD2 3.38Å; Y607-Y611 VanDerWaalsContact O-CG 3.27Å; Y607-Y611 PolarHBondContact O-N 3.41Å; I608-Y611 PolarHBondContact O-N 3.28Å; Y611-A614 PolarHBondContact O-N 3.39Å; Y611-I615 WeakPolarHBondContact O-CD1 3.31Å; Y611-I615 VanDerWaalsContact O-CG1 3.25Å; Y611-I615 WeakPolarHBondContact O-CG1 3.43Å; Y611-I615 PolarHBondContact O-N 3.48Å
612	T	95.7	Very high	91.9	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-68.8	-39.6	179.9	55.3	0	0	0	0	112.1	T572 F597 L600 I601 I608 A609 A614 I615 L616	T572-T612 HydrophobicContact CG2-CG2 3.58Å; F597-T612 HydrophobicContact CB-CG2 4.43Å; F597-T612 HydrophobicContact CD1-CG2 3.75Å; F597-T612 HydrophobicContact CG-CG2 4.47Å; L600-T612 HydrophobicContact CB-CG2 3.77Å; L600-T612 HydrophobicContact CD1-CG2 4.3Å; I601-T612 WeakPolarHBondContact CG1-OG1 3.35Å; I608-T612 HydrophobicContact CG2-CG2 4.33Å; I608-T612 WeakPolarHBondContact O-CG2 3.44Å; I608-T612 PolarHBondContact O-N 3.47Å; I608-T612 PolarHBondContact O-OG1 3.12Å; A609-T612 PolarHBondContact O-OG1 2.99Å; T612-A614 VanDerWaalsContact C-N 3.33Å; T612-A614 PolarHBondContact O-N 3.21Å; T612-I615 PolarHBondContact O-N 3.12Å; T612-L616 PolarHBondContact O-N 2.91Å
613	A	92.9	Very high	91.9	Very high	8 Å²	8	46.4 Å²	46.4	7%	0.066	23%	0.234	C	C	.	.	H	α-helix	trans	-59.3	-44.1	171.8	0	0	0	0	0	111.8	I601 A609 L616 H617 L635 L639	I601-A613 HydrophobicContact CG1-CB 4.4Å; A609-A613 WeakPolarHBondContact O-CB 3.41Å; A609-A613 PolarHBondContact O-N 2.84Å; A613-L616 PolarHBondContact O-N 3.14Å; A613-H617 WeakPolarHBondContact O-CB 3.39Å; A613-H617 PolarHBondContact O-N 3.21Å; A613-L635 HydrophobicContact CB-CD2 3.86Å; A613-L639 HydrophobicContact CB-CD1 4.04Å; A613-L639 HydrophobicContact CB-CD2 4.24Å; A613-L639 HydrophobicContact CB-CG 4.44Å
614	A	93.5	Very high	91.8	Very high	25 Å²	25	49.6 Å²	49.6	21%	0.207	25%	0.254	C	S	.	.	H	α-helix	trans	-63.9	-41.7	177.3	0	0	0	0	0	112.5	A610 Y611 T612 R618	A610-A614 WeakPolarHBondContact O-CB 3.38Å; A610-A614 PolarHBondContact O-N 3.24Å; Y611-A614 PolarHBondContact O-N 3.39Å; T612-A614 VanDerWaalsContact C-N 3.33Å; T612-A614 PolarHBondContact O-N 3.21Å; A614-R618 WeakPolarHBondContact O-CB 3.49Å; A614-R618 WeakPolarHBondContact O-CD 3.23Å; A614-R618 VanDerWaalsContact O-CG 3.24Å; A614-R618 WeakPolarHBondContact O-CG 3.4Å; A614-R618 PolarHBondContact O-N 3.23Å
615	I	96	Very high	91.7	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-60.4	-52.4	176.2	-68.3	161	0	0	0	110.1	L575 I588 F597 Y611 T612 H617 R618 I619	L575-I615 HydrophobicContact CB-CD1 3.86Å; I588-I615 HydrophobicContact CG2-CG2 4.2Å; F597-I615 HydrophobicContact CD2-CG2 3.89Å; F597-I615 HydrophobicContact CE1-CD1 4.08Å; F597-I615 HydrophobicContact CE2-CG2 3.64Å; F597-I615 HydrophobicContact CZ-CD1 4.18Å; F597-I615 HydrophobicContact CZ-CG2 4.15Å; Y611-I615 WeakPolarHBondContact O-CD1 3.31Å; Y611-I615 VanDerWaalsContact O-CG1 3.25Å; Y611-I615 WeakPolarHBondContact O-CG1 3.43Å; Y611-I615 PolarHBondContact O-N 3.48Å; T612-I615 PolarHBondContact O-N 3.12Å; I615-H617 VanDerWaalsContact C-N 3.34Å; I615-H617 PolarHBondContact O-N 2.92Å; I615-R618 PolarHBondContact O-N 3.13Å; I615-I619 HydrophobicContact CG2-CD1 3.66Å; I615-I619 HydrophobicContact CG2-CG1 4.36Å; I615-I619 WeakPolarHBondContact O-CG1 3.2Å; I615-I619 PolarHBondContact O-N 3.32Å
616	L	94.6	Very high	91.4	Very high	4 Å²	4	48.2 Å²	48.2	2%	0.021	25%	0.254	C	S	.	.	H	α-helix	trans	-61.6	-41.9	-178.9	-77	167.6	0	0	0	111.9	C594 F597 I601 T612 A613 R618 I619 A620 L631	C594-L616 HydrophobicContact CB-CD2 4.24Å; F597-L616 HydrophobicContact CB-CD1 3.67Å; F597-L616 HydrophobicContact CB-CD2 4.13Å; F597-L616 HydrophobicContact CB-CG 3.79Å; F597-L616 HydrophobicContact CD2-CD2 4.49Å; I601-L616 HydrophobicContact CD1-CD1 3.32Å; I601-L616 HydrophobicContact CG1-CD1 4.19Å; T612-L616 PolarHBondContact O-N 2.91Å; A613-L616 PolarHBondContact O-N 3.14Å; L616-R618 VanDerWaalsContact C-N 3.33Å; L616-R618 PolarHBondContact O-N 3.23Å; L616-I619 PolarHBondContact O-N 3.22Å; L616-A620 VanDerWaalsContact O-CB 3.31Å; L616-A620 WeakPolarHBondContact O-CB 3.33Å; L616-A620 PolarHBondContact O-N 2.85Å; L616-L631 HydrophobicContact CB-CD2 4.31Å; L616-L631 WeakPolarHBondContact O-CD2 3.41Å
617	H	92.8	Very high	91.2	Very high	91 Å²	91	48.1 Å²	48.1	42%	0.421	25%	0.249	S	C	.	.	H	α-helix	trans	-60.4	-42.2	176	-177.1	76.4	0	0	0	112.2	A613 I615 A620 Q621 L635	A613-H617 WeakPolarHBondContact O-CB 3.39Å; A613-H617 PolarHBondContact O-N 3.21Å; I615-H617 VanDerWaalsContact C-N 3.34Å; I615-H617 PolarHBondContact O-N 2.92Å; H617-A620 PolarHBondContact O-N 3.23Å; H617-Q621 PolarHBondContact O-N 3.17Å; H617-L635 HydrophobicContact CB-CD1 4.07Å
618	R	94.5	Very high	91	Very high	67 Å²	67	50 Å²	50	25%	0.253	26%	0.256	S	S	.	.	H	α-helix	trans	-70.4	-43.6	179.7	-70.2	168	-172.7	153	0.4	112.2	S576 S579 A614 I615 L616 A620 Q621	S576-R618 PolarHBondContact O-NH1 3.09Å; S576-R618 PolarHBondContact OG-NH1 3.34Å; S579-R618 WeakPolarHBondContact O-CD 3.38Å; S579-R618 VanDerWaalsContact OG-CD 3.27Å; S579-R618 WeakPolarHBondContact OG-CD 3.38Å; S579-R618 PolarHBondContact OG-NH1 3.22Å; A614-R618 WeakPolarHBondContact O-CB 3.49Å; A614-R618 WeakPolarHBondContact O-CD 3.23Å; A614-R618 VanDerWaalsContact O-CG 3.24Å; A614-R618 WeakPolarHBondContact O-CG 3.4Å; A614-R618 PolarHBondContact O-N 3.23Å; I615-R618 PolarHBondContact O-N 3.13Å; L616-R618 VanDerWaalsContact C-N 3.33Å; L616-R618 PolarHBondContact O-N 3.23Å; R618-A620 PolarHBondContact O-N 3Å; R618-Q621 WeakPolarHBondContact O-CB 3.45Å; R618-Q621 PolarHBondContact O-N 3.37Å; R618-Q621 VanDerWaalsContact O-N 3.17Å
619	I	93.8	Very high	90.5	Very high	12 Å²	12	57.8 Å²	57.8	6%	0.062	29%	0.285	C	S	.	.	H	α-helix	trans	-58.7	-36.8	174.1	-68.8	172.6	0	0	0	111	C585 I588 E589 I615 L616 Q621	C585-I619 HydrophobicContact CB-CG1 4.1Å; I588-I619 HydrophobicContact CB-CD1 4.37Å; I588-I619 HydrophobicContact CG2-CD1 3.93Å; E589-I619 HydrophobicContact CB-CD1 4.49Å; E589-I619 HydrophobicContact CB-CG2 4.14Å; E589-I619 HydrophobicContact CG-CG2 4.2Å; I615-I619 HydrophobicContact CG2-CD1 3.66Å; I615-I619 HydrophobicContact CG2-CG1 4.36Å; I615-I619 WeakPolarHBondContact O-CG1 3.2Å; I615-I619 PolarHBondContact O-N 3.32Å; L616-I619 PolarHBondContact O-N 3.22Å; I619-Q621 VanDerWaalsContact C-N 3.29Å; I619-Q621 PolarHBondContact O-N 2.9Å
620	A	92.3	Very high	90.2	Very high	3 Å²	3	65.5 Å²	65.5	3%	0.025	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-73.7	-12.2	-178.4	0	0	0	0	0	114.7	L616 H617 R618 D622 K623 Y627 R628 L631	L616-A620 VanDerWaalsContact O-CB 3.31Å; L616-A620 WeakPolarHBondContact O-CB 3.33Å; L616-A620 PolarHBondContact O-N 2.85Å; H617-A620 PolarHBondContact O-N 3.23Å; R618-A620 PolarHBondContact O-N 3Å; A620-D622 PolarHBondContact O-N 3.28Å; A620-K623 VanDerWaalsContact O-CB 3.32Å; A620-K623 WeakPolarHBondContact O-CB 3.26Å; A620-K623 PolarHBondContact O-N 3.24Å; A620-Y627 HydrophobicContact CB-CD1 4.21Å; A620-Y627 HydrophobicContact CB-CE1 3.91Å; A620-R628 HydrophobicContact CB-CG 4.38Å; A620-R628 VanDerWaalsContact O-CD 3.23Å; A620-R628 WeakPolarHBondContact O-CD 3.41Å; A620-R628 WeakPolarHBondContact O-CG 3.48Å; A620-L631 HydrophobicContact CB-CD2 3.44Å; A620-L631 VanDerWaalsContact CB-CD2 3.44Å
621	Q	88.4	Confident	89.9	Confident	114 Å²	114	64.9 Å²	64.9	53%	0.533	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-59.7	-34.3	-173.1	-73.7	-173.5	-8.4	0	0	113.5	H617 R618 I619 K623	H617-Q621 PolarHBondContact O-N 3.17Å; R618-Q621 WeakPolarHBondContact O-CB 3.45Å; R618-Q621 PolarHBondContact O-N 3.37Å; R618-Q621 VanDerWaalsContact O-N 3.17Å; I619-Q621 VanDerWaalsContact C-N 3.29Å; I619-Q621 PolarHBondContact O-N 2.9Å; Q621-K623 VanDerWaalsContact C-N 3.31Å
622	D	82.8	Confident	89.3	Confident	99 Å²	99	65.6 Å²	65.6	53%	0.529	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-86.5	2	178.6	-75.8	-7.1	0	0	0	113.3	R582 A620	R582-D622 IonicContact CZ-OD2 3.3Å; R582-D622 IonicContact NE-OD2 3.82Å; R582-D622 PolarHBondContact NE-OD2 3.5Å; R582-D622 IonicContact NH2-OD1 2.81Å; R582-D622 IonicContact NH2-OD2 3.39Å; R582-D622 PolarHBondContact NH2-OD2 2.9Å; A620-D622 PolarHBondContact O-N 3.28Å
623	K	86.4	Confident	88.7	Confident	67 Å²	67	71.5 Å²	71.5	29%	0.291	35%	0.349	S	S	.	.	S	Bend	trans	-92.6	159.7	-177.1	-52.8	-62.5	-176.4	-174.9	0	111.8	E589 A620 Q621 Y627 R628	E589-K623 WeakPolarHBondContact OE1-CE 3.44Å; E589-K623 IonicContact OE1-NZ 3.58Å; E589-K623 PolarHBondContact OE1-NZ 2.89Å; E589-K623 IonicContact OE2-NZ 3.37Å; E589-K623 PolarHBondContact OE2-NZ 3.34Å; A620-K623 VanDerWaalsContact O-CB 3.32Å; A620-K623 WeakPolarHBondContact O-CB 3.26Å; A620-K623 PolarHBondContact O-N 3.24Å; Q621-K623 VanDerWaalsContact C-N 3.31Å; K623-Y627 HydrophobicContact CB-CD1 3.66Å; K623-Y627 HydrophobicContact CB-CE1 4.34Å; K623-Y627 HydrophobicContact CB-CG 4.27Å; K623-Y627 HydrophobicContact CG-CD1 4Å; K623-Y627 HydrophobicContact CG-CE1 4.17Å; K623-R628 PolarHBondContact O-NE 2.98Å
624	P	87.8	Confident	88.3	Confident	97 Å²	97	74.8 Å²	74.8	63%	0.63	36%	0.362	S	S	*	.			trans	-53.1	146.4	178.7	-26.6	34.9	0	0	0	112.9	A626 Y627 R628	P624-A626 VanDerWaalsContact C-N 3.25Å; P624-A626 PolarHBondContact O-N 3.45Å; P624-A626 VanDerWaalsContact O-N 3.17Å; P624-Y627 WeakPolarHBondContact O-CB 3.37Å; P624-Y627 PolarHBondContact O-N 2.69Å; P624-R628 PolarHBondContact O-N 2.81Å; P624-R628 VanDerWaalsContact O-N 3.14Å
625	E	86.2	Confident	87.8	Confident	102 Å²	102	74.2 Å²	74.2	48%	0.477	36%	0.356	S	S	.	.	H	α-helix	trans	-56.6	-37.3	-174.5	-169.6	-178.2	167.3	0	0	113.4	Y627 R628 R629	E625-Y627 VanDerWaalsContact C-N 3.29Å; E625-Y627 PolarHBondContact O-N 3.26Å; E625-R628 PolarHBondContact O-N 3.3Å; E625-R629 HydrophobicContact CG-CG 4.48Å; E625-R629 WeakPolarHBondContact O-CG 3.32Å; E625-R629 PolarHBondContact O-N 3.04Å; E625-R629 IonicContact OE1-CZ 3.3Å; E625-R629 VanDerWaalsContact OE1-CZ 3.3Å; E625-R629 IonicContact OE1-NE 3.15Å; E625-R629 PolarHBondContact OE1-NE 3.47Å; E625-R629 VanDerWaalsContact OE1-NE 3.15Å; E625-R629 IonicContact OE1-NH2 2.69Å; E625-R629 PolarHBondContact OE1-NH2 3.22Å
626	A	84.7	Confident	87.1	Confident	79 Å²	79	81.3 Å²	81.3	65%	0.653	38%	0.383	S	S	*	.	H	α-helix	trans	-58.6	-40.7	175.9	0	0	0	0	0	112.4	P624 R630	P624-A626 VanDerWaalsContact C-N 3.25Å; P624-A626 PolarHBondContact O-N 3.45Å; P624-A626 VanDerWaalsContact O-N 3.17Å; A626-R630 PolarHBondContact O-N 3.14Å; A626-R630 VanDerWaalsContact O-N 3.15Å
627	Y	85.9	Confident	86.4	Confident	112 Å²	112	87.1 Å²	87.1	44%	0.439	41%	0.41	S	S	.	.	H	α-helix	trans	-67.2	-46.2	176.1	-178.6	-92.4	0	0	0	111.1	A620 K623 P624 E625 R629 R630 L631	A620-Y627 HydrophobicContact CB-CD1 4.21Å; A620-Y627 HydrophobicContact CB-CE1 3.91Å; K623-Y627 HydrophobicContact CB-CD1 3.66Å; K623-Y627 HydrophobicContact CB-CE1 4.34Å; K623-Y627 HydrophobicContact CB-CG 4.27Å; K623-Y627 HydrophobicContact CG-CD1 4Å; K623-Y627 HydrophobicContact CG-CE1 4.17Å; P624-Y627 WeakPolarHBondContact O-CB 3.37Å; P624-Y627 PolarHBondContact O-N 2.69Å; E625-Y627 VanDerWaalsContact C-N 3.29Å; E625-Y627 PolarHBondContact O-N 3.26Å; Y627-R629 VanDerWaalsContact C-N 3.33Å; Y627-R629 PolarHBondContact O-N 3.43Å; Y627-R630 PolarHBondContact O-N 3.44Å; Y627-L631 HydrophobicContact CE1-CD2 4.3Å; Y627-L631 PolarHBondContact O-N 2.99Å
628	R	86.9	Confident	85.8	Confident	104 Å²	104	83.9 Å²	83.9	39%	0.392	40%	0.397	S	S	.	.	H	α-helix	trans	-58.8	-42.6	177.9	-69.5	-170.1	-67.1	135.6	1.2	112.4	A620 K623 P624 E625 S632	A620-R628 HydrophobicContact CB-CG 4.38Å; A620-R628 VanDerWaalsContact O-CD 3.23Å; A620-R628 WeakPolarHBondContact O-CD 3.41Å; A620-R628 WeakPolarHBondContact O-CG 3.48Å; K623-R628 PolarHBondContact O-NE 2.98Å; P624-R628 PolarHBondContact O-N 2.81Å; P624-R628 VanDerWaalsContact O-N 3.14Å; E625-R628 PolarHBondContact O-N 3.3Å; R628-S632 WeakPolarHBondContact O-CB 3.49Å; R628-S632 PolarHBondContact O-N 3.23Å; R628-S632 PolarHBondContact O-OG 2.92Å
629	R	83.9	Confident	84.9	Confident	164 Å²	164	81.9 Å²	81.9	62%	0.619	39%	0.391	S	S	*	.	H	α-helix	trans	-63.8	-46.8	177.1	-74.4	-173.2	-171.2	-172.2	2.8	111.6	E625 Y627 S632 L633	E625-R629 HydrophobicContact CG-CG 4.48Å; E625-R629 WeakPolarHBondContact O-CG 3.32Å; E625-R629 PolarHBondContact O-N 3.04Å; E625-R629 IonicContact OE1-CZ 3.3Å; E625-R629 VanDerWaalsContact OE1-CZ 3.3Å; E625-R629 IonicContact OE1-NE 3.15Å; E625-R629 PolarHBondContact OE1-NE 3.47Å; E625-R629 VanDerWaalsContact OE1-NE 3.15Å; E625-R629 IonicContact OE1-NH2 2.69Å; E625-R629 PolarHBondContact OE1-NH2 3.22Å; Y627-R629 VanDerWaalsContact C-N 3.33Å; Y627-R629 PolarHBondContact O-N 3.43Å; R629-S632 PolarHBondContact O-N 3.47Å; R629-L633 WeakPolarHBondContact O-CG 3.36Å; R629-L633 PolarHBondContact O-N 3.36Å; R629-L633 VanDerWaalsContact O-N 3.13Å
630	R	86.5	Confident	84.1	Confident	166 Å²	166	84.7 Å²	84.7	63%	0.626	40%	0.404	S	S	*	.	H	α-helix	trans	-59.2	-51	177.9	-180	179.7	168.8	174.6	-0.9	111.5	A626 Y627 S632 L633 E634	A626-R630 PolarHBondContact O-N 3.14Å; A626-R630 VanDerWaalsContact O-N 3.15Å; Y627-R630 PolarHBondContact O-N 3.44Å; R630-S632 VanDerWaalsContact C-N 3.32Å; R630-S632 PolarHBondContact O-N 3.08Å; R630-L633 PolarHBondContact O-N 3.2Å; R630-E634 IonicContact CZ-OE1 3.84Å; R630-E634 IonicContact NE-OE1 3.65Å; R630-E634 PolarHBondContact NE-OE1 3.38Å; R630-E634 IonicContact NH2-OE1 2.82Å; R630-E634 PolarHBondContact NH2-OE1 3.01Å; R630-E634 PolarHBondContact O-N 3.26Å; R630-E634 VanDerWaalsContact O-N 3.08Å
631	L	85.4	Confident	83.2	Confident	11 Å²	11	90.1 Å²	90.1	6%	0.058	43%	0.432	C	S	.	.	H	α-helix	trans	-60.4	-42.7	178.6	179.6	65.3	0	0	0	111.4	L616 A620 Y627 L633 E634 L635	L616-L631 HydrophobicContact CB-CD2 4.31Å; L616-L631 WeakPolarHBondContact O-CD2 3.41Å; A620-L631 HydrophobicContact CB-CD2 3.44Å; A620-L631 VanDerWaalsContact CB-CD2 3.44Å; Y627-L631 HydrophobicContact CE1-CD2 4.3Å; Y627-L631 PolarHBondContact O-N 2.99Å; L631-L633 VanDerWaalsContact C-N 3.27Å; L631-L633 PolarHBondContact O-N 3.34Å; L631-E634 PolarHBondContact O-N 2.94Å; L631-L635 HydrophobicContact CD1-CD1 4.38Å; L631-L635 HydrophobicContact CD1-CD2 4.34Å; L631-L635 HydrophobicContact CD1-CG 4.05Å; L631-L635 HydrophobicContact CD2-CD1 4.44Å; L631-L635 HydrophobicContact CG-CD1 3.96Å; L631-L635 HydrophobicContact CG-CG 4.07Å; L631-L635 WeakPolarHBondContact O-CB 3.35Å; L631-L635 VanDerWaalsContact O-CG 3.24Å; L631-L635 WeakPolarHBondContact O-CG 3.37Å; L631-L635 PolarHBondContact O-N 3.33Å
632	S	84.8	Confident	82.3	Confident	53 Å²	53	86.8 Å²	86.8	37%	0.371	43%	0.429	S	S	.	.	H	α-helix	trans	-61.5	-35.2	179.6	-59.3	0	0	0	0	112.8	R628 R629 R630 R636	R628-S632 WeakPolarHBondContact O-CB 3.49Å; R628-S632 PolarHBondContact O-N 3.23Å; R628-S632 PolarHBondContact O-OG 2.92Å; R629-S632 PolarHBondContact O-N 3.47Å; R630-S632 VanDerWaalsContact C-N 3.32Å; R630-S632 PolarHBondContact O-N 3.08Å; S632-R636 WeakPolarHBondContact O-CB 3.32Å; S632-R636 PolarHBondContact O-N 2.88Å
633	L	83.5	Confident	81.7	Confident	124 Å²	124	84.8 Å²	84.8	65%	0.649	43%	0.431	S	S	*	.	H	α-helix	trans	-68.5	-46.8	173.9	-69.7	168.8	0	0	0	111.4	R629 R630 L631 L635 R636 Q637	R629-L633 WeakPolarHBondContact O-CG 3.36Å; R629-L633 PolarHBondContact O-N 3.36Å; R629-L633 VanDerWaalsContact O-N 3.13Å; R630-L633 PolarHBondContact O-N 3.2Å; L631-L633 VanDerWaalsContact C-N 3.27Å; L631-L633 PolarHBondContact O-N 3.34Å; L633-L635 VanDerWaalsContact C-N 3.35Å; L633-L635 PolarHBondContact O-N 3.3Å; L633-R636 PolarHBondContact O-N 3.45Å; L633-Q637 WeakPolarHBondContact O-CB 3.22Å; L633-Q637 PolarHBondContact O-N 2.99Å
634	E	82.6	Confident	80.8	Confident	76 Å²	76	84.4 Å²	84.4	36%	0.355	43%	0.432	S	S	.	.	H	α-helix	trans	-60.2	-42.7	177.3	-71.7	173.8	-172.8	0	0	111.8	R630 L631 S638	R630-E634 IonicContact CZ-OE1 3.84Å; R630-E634 IonicContact NE-OE1 3.65Å; R630-E634 PolarHBondContact NE-OE1 3.38Å; R630-E634 IonicContact NH2-OE1 2.82Å; R630-E634 PolarHBondContact NH2-OE1 3.01Å; R630-E634 PolarHBondContact O-N 3.26Å; R630-E634 VanDerWaalsContact O-N 3.08Å; L631-E634 PolarHBondContact O-N 2.94Å; E634-S638 WeakPolarHBondContact O-CB 3.37Å; E634-S638 PolarHBondContact O-N 3.22Å; E634-S638 PolarHBondContact O-OG 3.45Å
635	L	82.9	Confident	79.6	Confident	13 Å²	13	82.9 Å²	82.9	7%	0.068	42%	0.418	C	S	.	.	H	α-helix	trans	-63.2	-47.8	175.7	-70.4	-179.8	0	0	0	111.8	I601 A613 H617 L631 L633 Q637 S638 L639	I601-L635 HydrophobicContact CD1-CD2 3.27Å; I601-L635 HydrophobicContact CG1-CD2 4.17Å; A613-L635 HydrophobicContact CB-CD2 3.86Å; H617-L635 HydrophobicContact CB-CD1 4.07Å; L631-L635 HydrophobicContact CD1-CD1 4.38Å; L631-L635 HydrophobicContact CD1-CD2 4.34Å; L631-L635 HydrophobicContact CD1-CG 4.05Å; L631-L635 HydrophobicContact CD2-CD1 4.44Å; L631-L635 HydrophobicContact CG-CD1 3.96Å; L631-L635 HydrophobicContact CG-CG 4.07Å; L631-L635 WeakPolarHBondContact O-CB 3.35Å; L631-L635 VanDerWaalsContact O-CG 3.24Å; L631-L635 WeakPolarHBondContact O-CG 3.37Å; L631-L635 PolarHBondContact O-N 3.33Å; L633-L635 VanDerWaalsContact C-N 3.35Å; L633-L635 PolarHBondContact O-N 3.3Å; L635-Q637 VanDerWaalsContact C-N 3.33Å; L635-Q637 PolarHBondContact O-N 3.49Å; L635-S638 PolarHBondContact O-N 3.02Å; L635-L639 WeakPolarHBondContact O-CB 3.43Å; L635-L639 VanDerWaalsContact O-CG 3.24Å; L635-L639 WeakPolarHBondContact O-CG 3.4Å; L635-L639 PolarHBondContact O-N 3.19Å
636	R	81.6	Confident	78.1	Confident	149 Å²	149	84.4 Å²	84.4	56%	0.562	43%	0.43	S	S	*	.	H	α-helix	trans	-62.5	-43	-179	-173.9	177.8	-178.8	138.4	1.2	111.4	S632 L633 F640 L645	S632-R636 WeakPolarHBondContact O-CB 3.32Å; S632-R636 PolarHBondContact O-N 2.88Å; L633-R636 PolarHBondContact O-N 3.45Å; R636-F640 VanDerWaalsContact O-CB 3.24Å; R636-F640 WeakPolarHBondContact O-CB 3.36Å; R636-F640 PolarHBondContact O-N 3.3Å; R636-L645 HydrophobicContact CG-CD1 3.96Å
637	Q	81.2	Confident	76.6	Confident	126 Å²	126	83.7 Å²	83.7	59%	0.589	42%	0.415	S	S	*	.	H	α-helix	trans	-64.3	-48.7	178.1	-175.3	166.8	6	0	0	111	L633 L635 L639 F640 D641	L633-Q637 WeakPolarHBondContact O-CB 3.22Å; L633-Q637 PolarHBondContact O-N 2.99Å; L635-Q637 VanDerWaalsContact C-N 3.33Å; L635-Q637 PolarHBondContact O-N 3.49Å; Q637-L639 PolarHBondContact O-N 2.85Å; Q637-F640 WeakPolarHBondContact O-CB 3.48Å; Q637-F640 PolarHBondContact O-N 3.4Å; Q637-D641 VanDerWaalsContact O-CG 3.26Å; Q637-D641 PolarHBondContact O-N 3.21Å
638	S	78.8	Confident	74.9	Confident	23 Å²	23	82.3 Å²	82.3	16%	0.161	42%	0.419	C	S	.	.	H	α-helix	trans	-65.7	-37.1	-178.2	-52.3	0	0	0	0	113	E634 L635 G642	E634-S638 WeakPolarHBondContact O-CB 3.37Å; E634-S638 PolarHBondContact O-N 3.22Å; E634-S638 PolarHBondContact O-OG 3.45Å; L635-S638 PolarHBondContact O-N 3.02Å; S638-G642 PolarHBondContact O-N 3.03Å
639	L	76.5	Confident	73.1	Confident	25 Å²	25	83.7 Å²	83.7	13%	0.131	44%	0.435	C	S	.	.	H	α-helix	trans	-72.4	-31.1	175.2	-68.4	171.1	0	0	0	112.5	A609 A613 L635 Q637 G643 L644 L645	A609-L639 HydrophobicContact CB-CD2 4.38Å; A613-L639 HydrophobicContact CB-CD1 4.04Å; A613-L639 HydrophobicContact CB-CD2 4.24Å; A613-L639 HydrophobicContact CB-CG 4.44Å; L635-L639 WeakPolarHBondContact O-CB 3.43Å; L635-L639 VanDerWaalsContact O-CG 3.24Å; L635-L639 WeakPolarHBondContact O-CG 3.4Å; L635-L639 PolarHBondContact O-N 3.19Å; Q637-L639 PolarHBondContact O-N 2.85Å; L639-G643 PolarHBondContact O-N 2.68Å; L639-L644 HydrophobicContact CB-CB 4.3Å; L639-L644 HydrophobicContact CD2-CB 4.25Å; L639-L644 HydrophobicContact CD2-CD1 3.67Å; L639-L644 WeakPolarHBondContact O-CB 3.21Å; L639-L644 PolarHBondContact O-N 3.34Å; L639-L645 HydrophobicContact CB-CD1 3.67Å; L639-L645 HydrophobicContact CB-CG 3.92Å; L639-L645 HydrophobicContact CD1-CD1 4.32Å; L639-L645 PolarHBondContact O-N 2.99Å
640	F	77.6	Confident	71.2	Confident	72 Å²	72	82.9 Å²	82.9	32%	0.316	44%	0.438	S	S	.	.	H	α-helix	trans	-67.3	-49.7	172	177.3	-104	0	0	0	111	R636 Q637 G642 G643 L645 D647	R636-F640 VanDerWaalsContact O-CB 3.24Å; R636-F640 WeakPolarHBondContact O-CB 3.36Å; R636-F640 PolarHBondContact O-N 3.3Å; Q637-F640 WeakPolarHBondContact O-CB 3.48Å; Q637-F640 PolarHBondContact O-N 3.4Å; F640-G642 PolarHBondContact O-N 3.48Å; F640-G643 PolarHBondContact O-N 3.36Å; F640-L645 HydrophobicContact CB-CB 4.41Å; F640-L645 VanDerWaalsContact CD2-O 3.28Å; F640-L645 WeakPolarHBondContact CD2-O 3.5Å; F640-D647 HydrophobicContact CE2-CB 3.71Å; F640-D647 HydrophobicContact CZ-CB 3.87Å
641	D	73.6	Confident	68.6	Low	116 Å²	116	83 Å²	83	62%	0.62	45%	0.45	S	S	*	.	H	α-helix	trans	-60.8	-31.6	177.4	-65.6	-18.8	0	0	0	111.6	Q637 G643	Q637-D641 VanDerWaalsContact O-CG 3.26Å; Q637-D641 PolarHBondContact O-N 3.21Å; D641-G643 VanDerWaalsContact C-N 3.33Å
642	G	68.9	Low	66.2	Low	45 Å²	45	85 Å²	85	46%	0.464	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	2.5	173.9	0	0	0	0	0	115.8	S638 F640 L644	S638-G642 PolarHBondContact O-N 3.03Å; F640-G642 PolarHBondContact O-N 3.48Å; G642-L644 VanDerWaalsContact C-N 3.32Å; G642-L644 PolarHBondContact O-N 3.49Å
643	G	69.8	Low	63.7	Low	57 Å²	57	88 Å²	88	59%	0.588	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	76	9.8	177.2	0	0	0	0	0	116	L639 F640 D641	L639-G643 PolarHBondContact O-N 2.68Å; F640-G643 PolarHBondContact O-N 3.36Å; D641-G643 VanDerWaalsContact C-N 3.33Å
644	L	67.7	Low	61.4	Low	58 Å²	58	92.1 Å²	92.1	30%	0.304	50%	0.499	S	S	.	.	S	Bend	trans	-86.9	-15.1	179.5	-85.9	155.1	0	0	0	113.6	E606 A609 L639 G642	E606-L644 HydrophobicContact CB-CD1 4.22Å; E606-L644 HydrophobicContact CB-CD2 4Å; E606-L644 HydrophobicContact CB-CG 4.23Å; E606-L644 HydrophobicContact CG-CD1 4.39Å; E606-L644 HydrophobicContact CG-CD2 4.25Å; E606-L644 HydrophobicContact CG-CG 4.11Å; A609-L644 HydrophobicContact CB-CD1 3.84Å; L639-L644 HydrophobicContact CB-CB 4.3Å; L639-L644 HydrophobicContact CD2-CB 4.25Å; L639-L644 HydrophobicContact CD2-CD1 3.67Å; L639-L644 WeakPolarHBondContact O-CB 3.21Å; L639-L644 PolarHBondContact O-N 3.34Å; G642-L644 VanDerWaalsContact C-N 3.32Å; G642-L644 PolarHBondContact O-N 3.49Å
645	L	62.7	Low	58.8	Low	65 Å²	65	94.9 Å²	94.9	34%	0.34	52%	0.524	S	S	.	.	S	Bend	trans	-125.9	142.5	176.3	-65.3	175.4	0	0	0	109.8	R636 L639 F640	R636-L645 HydrophobicContact CG-CD1 3.96Å; L639-L645 HydrophobicContact CB-CD1 3.67Å; L639-L645 HydrophobicContact CB-CG 3.92Å; L639-L645 HydrophobicContact CD1-CD1 4.32Å; L639-L645 PolarHBondContact O-N 2.99Å; F640-L645 HydrophobicContact CB-CB 4.41Å; F640-L645 VanDerWaalsContact CD2-O 3.28Å; F640-L645 WeakPolarHBondContact CD2-O 3.5Å
646	N	55.2	Low	56.2	Low	134 Å²	134	99.1 Å²	99.1	72%	0.717	55%	0.554	S	S	*	*			trans	-76.5	157.7	175.9	-66.5	0.8	0	0	0	111.7
647	D	52.4	Low	53.5	Low	65 Å²	65	96.5 Å²	96.5	35%	0.348	56%	0.559	S	S	.	*			trans	-62.2	123.1	-179.4	-169	-25.8	0	0	0	110.2	F640 N649 E650	F640-D647 HydrophobicContact CE2-CB 3.71Å; F640-D647 HydrophobicContact CZ-CB 3.87Å; D647-N649 PolarHBondContact O-N 3.31Å; D647-N649 WeakPolarHBondContact OD1-CB 3.36Å; D647-N649 PolarHBondContact OD1-N 2.93Å; D647-E650 HydrophobicContact CB-CG 4.48Å; D647-E650 PolarHBondContact O-N 3.43Å
648	P	51.3	Low	51	Low	82 Å²	82	97.4 Å²	97.4	53%	0.532	58%	0.575	S	S	.	*	T	Hydrogen-bonded Turn	trans	-58.2	-13.8	175.2	21.3	-30.4	0	0	0	114.1
649	N	48.3	Very low	48.6	Very low	134 Å²	134	99.8 Å²	99.8	72%	0.717	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.9	-1.7	176.2	-62.7	-48	0	0	0	115	D647 I651	D647-N649 PolarHBondContact O-N 3.31Å; D647-N649 WeakPolarHBondContact OD1-CB 3.36Å; D647-N649 PolarHBondContact OD1-N 2.93Å; N649-I651 PolarHBondContact O-N 2.96Å
650	E	43.1	Very low	46.3	Very low	146 Å²	146	108.2 Å²	108.2	68%	0.682	63%	0.628	S	S	*	*			trans	-76.3	90.1	166.6	-85.3	-170	152.9	0	0	109.6	D647 G652	D647-E650 HydrophobicContact CB-CG 4.48Å; D647-E650 PolarHBondContact O-N 3.43Å; E650-G652 VanDerWaalsContact C-N 3.26Å; E650-G652 PolarHBondContact O-N 3.35Å
651	I	33.5	Very low	44	Very low	170 Å²	170	111.5 Å²	111.5	87%	0.872	65%	0.648	S	S	*	*			trans	-70.8	83.9	171.7	-56.1	172.5	0	0	0	108.7	N649	N649-I651 PolarHBondContact O-N 2.96Å
652	G	34.8	Very low	41.7	Very low	51 Å²	51	111.3 Å²	111.3	53%	0.526	65%	0.651	S	S	.	*			trans	-92.2	145.3	155.7	0	0	0	0	0	109.9	E650 Y654	E650-G652 VanDerWaalsContact C-N 3.26Å; E650-G652 PolarHBondContact O-N 3.35Å; G652-Y654 PolarHBondContact O-N 3Å
653	P	32.4	Very low	39.7	Very low	117 Å²	117	115.7 Å²	115.7	76%	0.76	66%	0.664	S	S	*	*	S	Bend	trans	-72.3	119.1	179.5	30.9	-29.3	0	0	0	108
654	Y	34.6	Very low	37.6	Very low	210 Å²	210	116.8 Å²	116.8	82%	0.824	68%	0.676	S	S	*	*			trans	150.5	124.5	149.2	-78.7	-61.4	0	0	0	110.3	G652 S656	G652-Y654 PolarHBondContact O-N 3Å; Y654-S656 PolarHBondContact O-N 3.28Å
655	P	28.6	Very low	35.6	Very low	135 Å²	135	120.1 Å²	120.1	88%	0.877	69%	0.692	S	S	*	*			trans	-85.6	103.8	167.8	32.8	-25	0	0	0	108.1
656	S	27.4	Very low	33.9	Very low	101 Å²	101	123.1 Å²	123.1	71%	0.706	71%	0.708	S	S	*	*			trans	-126.6	111.2	170.1	54	0	0	0	0	110.5	Y654	Y654-S656 PolarHBondContact O-N 3.28Å
657	S	26	Very low	32.5	Very low	94 Å²	94	117.6 Å²	117.6	66%	0.657	68%	0.679	S	S	*	*			trans	16.4	133.5	152.1	-49.8	0	0	0	0	119.1	S659	S657-S659 PolarHBondContact O-N 3.17Å
658	P	27.5	Very low	31.2	Very low	145 Å²	145	121.1 Å²	121.1	94%	0.942	70%	0.698	S	S	*	*	S	Bend	trans	-74.7	74.7	163.7	33.2	-30.6	0	0	0	109.2
659	S	27.7	Very low	30.3	Very low	74 Å²	74	117.9 Å²	117.9	52%	0.517	68%	0.677	S	S	.	*			trans	-118.7	17.7	177.5	61.1	0	0	0	0	113.7	S657	S657-S659 PolarHBondContact O-N 3.17Å
660	K	28.3	Very low	29.2	Very low	201 Å²	201	118.6 Å²	118.6	87%	0.874	68%	0.68	S	S	*	*	S	Bend	trans	-91.8	8	175.7	-77.2	-168.3	177.8	-179.4	0	115.6
661	L	29.8	Very low	28.4	Very low	141 Å²	141	114.5 Å²	114.5	74%	0.738	67%	0.668	S	S	*	*	S	Bend	trans	-109	5.8	-178.4	-87.9	157.7	0	0	0	115
662	T	26.5	Very low	28.1	Very low	112 Å²	112	108.6 Å²	108.6	69%	0.687	64%	0.641	S	S	*	*	S	Bend	trans	-121.3	-4.3	-174.5	46	0	0	0	0	116.3
663	D	25.2	Very low	27.8	Very low	137 Å²	137	114.3 Å²	114.3	73%	0.733	65%	0.653	S	S	*	*	S	Bend	trans	-114.6	103.3	178.5	-73.9	-35.9	0	0	0	112.3	I665	D663-I665 PolarHBondContact O-N 2.98Å
664	G	26.6	Very low	27.7	Very low	81 Å²	81	111.7 Å²	111.7	84%	0.835	63%	0.632	S	S	*	*			trans	61.7	26	132.9	0	0	0	0	0	120	L666	G664-L666 PolarHBondContact O-N 3.41Å
665	I	26.4	Very low	27.5	Very low	127 Å²	127	106.4 Å²	106.4	65%	0.651	62%	0.622	S	S	*	*			trans	-90.6	92.2	170.9	-54.7	179.3	0	0	0	108.7	D663	D663-I665 PolarHBondContact O-N 2.98Å
666	L	25.4	Very low	27.6	Very low	128 Å²	128	104.1 Å²	104.1	67%	0.67	60%	0.602	S	S	*	*			trans	-49.9	129.5	159.2	-77.3	159.8	0	0	0	107.6	G664	G664-L666 PolarHBondContact O-N 3.41Å
667	P	27.6	Very low	27.7	Very low	18 Å²	18	108 Å²	108	12%	0.117	60%	0.601	C	S	.	*			trans	-60.8	150.1	179.2	23.9	-28.5	0	0	0	109	Y607 D669	Y607-P667 HydrophobicContact CD1-CB 4.06Å; Y607-P667 HydrophobicContact CD2-CB 4.44Å; Y607-P667 HydrophobicContact CE1-CB 3.85Å; Y607-P667 HydrophobicContact CE2-CB 4.23Å; Y607-P667 HydrophobicContact CG-CB 4.34Å; P667-D669 PolarHBondContact O-N 3.36Å
668	N	25.3	Very low	28.1	Very low	139 Å²	139	107.5 Å²	107.5	74%	0.743	59%	0.585	S	S	*	*			trans	-54.5	82.9	160.5	-110.2	-18.4	0	0	0	108.1	Y607 N670	Y607-N668 PolarHBondContact OH-N 3.4Å; N668-N670 PolarHBondContact O-N 2.9Å
669	D	31.3	Very low	28.5	Very low	15 Å²	15	103 Å²	103	8%	0.08	56%	0.557	C	S	.	*			trans	-76.2	79.7	174.2	-94.5	-11.6	0	0	0	105.9	R424 R468 R569 P667 S671	R424-D669 PolarHBondContact NH1-O 2.99Å; R424-D669 PolarHBondContact NH2-O 3.28Å; R468-D669 IonicContact CZ-OD2 3.39Å; R468-D669 IonicContact NH1-OD2 2.86Å; R468-D669 IonicContact NH2-OD2 3.98Å; R468-D669 PolarHBondContact NH2-OD2 2.94Å; R569-D669 IonicContact CZ-OD1 3.28Å; R569-D669 IonicContact NH1-OD1 3.55Å; R569-D669 PolarHBondContact NH1-OD1 2.96Å; R569-D669 IonicContact NH2-OD1 3.95Å; R569-D669 PolarHBondContact NH2-OD1 3.23Å; P667-D669 PolarHBondContact O-N 3.36Å; D669-S671 PolarHBondContact O-N 2.88Å
670	N	25.9	Very low	28.8	Very low	148 Å²	148	104.5 Å²	104.5	79%	0.791	55%	0.551	S	S	*	*			trans	-59.2	75.3	138.2	-77.5	-18.6	0	0	0	106.1	N668	N668-N670 PolarHBondContact O-N 2.9Å
671	S	25.2	Very low	29	Very low	60 Å²	60	99.5 Å²	99.5	42%	0.42	53%	0.534	S	S	.	.			trans	-50.5	131.9	161.4	-76.1	0	0	0	0	106.1	D669 H673	D669-S671 PolarHBondContact O-N 2.88Å; S671-H673 PolarHBondContact O-N 3.08Å
672	P	27	Very low	29.1	Very low	47 Å²	47	96.6 Å²	96.6	31%	0.305	52%	0.519	S	S	.	.			trans	-53.5	135.5	175.6	23.9	-30.9	0	0	0	106.8	I674	P672-I674 VanDerWaalsContact C-N 3.29Å; P672-I674 PolarHBondContact O-N 2.88Å
673	H	28.6	Very low	29.6	Very low	171 Å²	171	92.5 Å²	92.5	79%	0.792	50%	0.495	S	S	*	.			trans	-47.4	93.3	176.4	-69.2	-81.9	0	0	0	110	S671 T675	S671-H673 PolarHBondContact O-N 3.08Å; H673-T675 PolarHBondContact O-N 2.89Å
674	I	31.7	Very low	30	Very low	61 Å²	61	90.8 Å²	90.8	31%	0.313	49%	0.486	S	S	.	.			trans	-75.6	83.1	167	-58.4	175.2	0	0	0	104.6	P672 D676	P672-I674 VanDerWaalsContact C-N 3.29Å; P672-I674 PolarHBondContact O-N 2.88Å; I674-D676 HydrophobicContact CG2-CB 4.37Å; I674-D676 VanDerWaalsContact CG2-OD1 3.29Å; I674-D676 WeakPolarHBondContact CG2-OD1 3.34Å; I674-D676 PolarHBondContact O-N 3.05Å
675	T	28.6	Very low	30.2	Very low	99 Å²	99	90.8 Å²	90.8	61%	0.607	47%	0.473	S	S	*	.			trans	-62	94.2	148.7	55.8	0	0	0	0	105	H673 R677	H673-T675 PolarHBondContact O-N 2.89Å; T675-R677 PolarHBondContact O-N 3.28Å
676	D	31	Very low	30.5	Very low	88 Å²	88	90.8 Å²	90.8	47%	0.471	48%	0.475	S	S	.	.			trans	-62.3	80.7	165	-90.9	-33.7	0	0	0	106.9	I674 R678	I674-D676 HydrophobicContact CG2-CB 4.37Å; I674-D676 VanDerWaalsContact CG2-OD1 3.29Å; I674-D676 WeakPolarHBondContact CG2-OD1 3.34Å; I674-D676 PolarHBondContact O-N 3.05Å; D676-R678 PolarHBondContact O-N 3.35Å
677	R	29.3	Very low	30.8	Very low	182 Å²	182	89.8 Å²	89.8	69%	0.687	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	6.8	176.7	-81.5	-174.1	174.4	-172.3	-0.1	111.9	T675 R680	T675-R677 PolarHBondContact O-N 3.28Å; R677-R680 WeakPolarHBondContact O-CG 2.87Å
678	R	35.2	Very low	31	Very low	83 Å²	83	99.5 Å²	99.5	31%	0.313	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	7.3	-173.6	-89.3	-167.1	166.9	-148.3	-1.5	116.7	E518 G519 D676 R680 N681	E518-R678 PolarHBondContact O-NE 3.44Å; E518-R678 PolarHBondContact O-NH1 3.15Å; E518-R678 PolarHBondContact O-NH2 3.34Å; E518-R678 IonicContact OE2-CZ 2.85Å; E518-R678 IonicContact OE2-NH1 3.74Å; E518-R678 PolarHBondContact OE2-NH1 2.88Å; E518-R678 IonicContact OE2-NH2 2.7Å; E518-R678 PolarHBondContact OE2-NH2 3.31Å; E518-R678 VanDerWaalsContact OE2-NH2 3.15Å; G519-R678 VanDerWaalsContact N-NH2 3.11Å; D676-R678 PolarHBondContact O-N 3.35Å; R678-R680 PolarHBondContact O-N 2.93Å; R678-N681 PolarHBondContact O-N 2.96Å
679	S	35	Very low	31.1	Very low	50 Å²	50	101.3 Å²	101.3	35%	0.35	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-0.5	156.9	78.5	0	0	0	0	113
680	R	34.6	Very low	30.8	Very low	107 Å²	107	111.9 Å²	111.9	40%	0.404	55%	0.546	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-15.8	-179.6	-71	-178.5	179.9	-177.8	0.1	115.4	N301 R677 R678	N301-R680 PolarHBondContact ND2-NH2 3.23Å; R677-R680 WeakPolarHBondContact O-CG 2.87Å; R678-R680 PolarHBondContact O-N 2.93Å
681	N	31.9	Very low	30.8	Very low	96 Å²	96	110 Å²	110	51%	0.513	55%	0.545	S	S	.	.	S	Bend	trans	-114.5	-8.3	-170.4	-73.5	-3	0	0	0	115.8	R678 S683	R678-N681 PolarHBondContact O-N 2.96Å; N681-S683 VanDerWaalsContact C-N 3.33Å; N681-S683 PolarHBondContact O-N 2.95Å
682	L	33.3	Very low	30.9	Very low	79 Å²	79	120.6 Å²	120.6	41%	0.414	58%	0.584	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.7	-1.8	178.7	-74.9	162.5	0	0	0	113.9	E409	E409-L682 HydrophobicContact CB-CD2 3.84Å
683	S	36.2	Very low	31.1	Very low	27 Å²	27	124.3 Å²	124.3	19%	0.189	60%	0.597	C	S	.	*	T	Hydrogen-bonded Turn	trans	-94.8	-23.4	173.1	57.1	0	0	0	0	114	N681	N681-S683 VanDerWaalsContact C-N 3.33Å; N681-S683 PolarHBondContact O-N 2.95Å
684	D	33.2	Very low	31.2	Very low	100 Å²	100	121.8 Å²	121.8	54%	0.535	59%	0.587	S	S	.	*	T	Hydrogen-bonded Turn	trans	-101	-20.6	-159.3	-76	9.9	0	0	0	114.5
685	S	31.1	Very low	31.2	Very low	82 Å²	82	125.2 Å²	125.2	57%	0.573	60%	0.602	S	S	*	*	S	Bend	trans	-91.8	-23.3	-174	51.7	0	0	0	0	115.3
686	N	32.2	Very low	31.3	Very low	127 Å²	127	126.8 Å²	126.8	68%	0.679	60%	0.602	S	S	*	*	S	Bend	trans	-108.9	-4	-174.6	-75.6	-25	0	0	0	115.7
687	L	32.9	Very low	31.3	Very low	107 Å²	107	129.2 Å²	129.2	56%	0.56	61%	0.61	S	S	*	*	S	Bend	trans	-88	-9.3	174.4	-81.9	165.2	0	0	0	113.7
688	R	30.5	Very low	31.5	Very low	222 Å²	222	125.7 Å²	125.7	84%	0.838	61%	0.605	S	S	*	*	S	Bend	trans	-85.8	-2.4	-177.4	-76	-174.1	174.6	-168.8	-0.6	115.4
689	Q	27.8	Very low	31.2	Very low	176 Å²	176	128.7 Å²	128.7	82%	0.822	63%	0.626	S	S	*	*	S	Bend	trans	-121.4	6.6	-172	-85.7	-170.6	-11	0	0	117.2
690	R	25.4	Very low	30.9	Very low	237 Å²	237	134.8 Å²	134.8	89%	0.894	65%	0.647	S	S	*	*	S	Bend	trans	-140	64.8	174.8	-69.3	-172.8	179.6	179	0.1	112.4
691	S	25.2	Very low	30.6	Very low	110 Å²	110	137.1 Å²	137.1	77%	0.769	67%	0.668	S	S	*	*			trans	-153	50.8	163.4	73.1	0	0	0	0	111
692	K	27.4	Very low	30.5	Very low	282 Å²	282	140.8 Å²	140.8	100%	1.226	68%	0.682	S	S	*	*			trans	-121.1	0	157.8	-88.2	-169.5	176.9	-177.6	0	108.2

Retrieved 692 of 692 residues in 162.8 ms (Link to these results)

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