A0A3Q0KP15_SCHMA Loading...

polynucleotide adenylyltransferase

AlphaFold DB (A0A5K4ER93), UniProt , Accession A0A3Q0KP15, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 684 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	32.5	Very low	28.8	Very low	247 Å²	247	142.5 Å²	142.5	100%	1.217	82%	0.823	S	S	*	*				0	158.6	0	-65.8	179.3	-176.5	0	0	108.3
2	E	25.2	Very low	29.3	Very low	196 Å²	196	146.4 Å²	146.4	92%	0.916	82%	0.823	S	S	*	*			trans	-89.9	151.1	-155.4	-60.3	162.4	108.7	0	0	115.5
3	G	25	Very low	29.7	Very low	72 Å²	72	145.5 Å²	145.5	74%	0.742	82%	0.815	S	S	*	*			trans	82.2	148	147.4	0	0	0	0	0	117.5
4	V	28.8	Very low	29.9	Very low	119 Å²	119	151.1 Å²	151.1	72%	0.721	82%	0.817	S	S	*	*			cis	-143	131.8	-3.8	174.2	0	0	0	0	108.3
5	A	25.8	Very low	30	Very low	82 Å²	82	148.8 Å²	148.8	68%	0.678	81%	0.81	S	S	*	*			trans	-76	124.3	173.7	0	0	0	0	0	110.9
6	I	31.1	Very low	29.8	Very low	150 Å²	150	147.1 Å²	147.1	77%	0.769	81%	0.806	S	S	*	*			trans	-111.4	109.6	175.1	-60.2	179.8	0	0	0	109	A8	I6-A8 PolarHBondContact O-N 3.05Å
7	Q	27	Very low	29.8	Very low	199 Å²	199	144.3 Å²	144.3	93%	0.93	80%	0.8	S	S	*	*			trans	-76.2	116.8	166.9	-71.9	178	-42.1	0	0	109.8
8	A	33.7	Very low	30	Very low	89 Å²	89	143.6 Å²	143.6	74%	0.736	80%	0.799	S	S	*	*			trans	-132.3	121.3	161.6	0	0	0	0	0	107.9	I6 Y10	I6-A8 PolarHBondContact O-N 3.05Å; A8-Y10 PolarHBondContact O-N 3.26Å
9	G	26.2	Very low	30.4	Very low	88 Å²	88	138.4 Å²	138.4	91%	0.907	77%	0.77	S	S	*	*			trans	-73.9	120.1	-171	0	0	0	0	0	112.5
10	Y	29.3	Very low	30.5	Very low	209 Å²	209	138.9 Å²	138.9	82%	0.82	76%	0.763	S	S	*	*			trans	-107.3	121.4	166.3	-141.2	-96	0	0	0	109.7	A8 K12	A8-Y10 PolarHBondContact O-N 3.26Å; Y10-K12 PolarHBondContact O-N 2.94Å
11	N	32.5	Very low	30.7	Very low	116 Å²	116	136.8 Å²	136.8	62%	0.62	76%	0.757	S	S	*	*			trans	-74.5	113.6	-176.8	-173.5	-15	0	0	0	109.7	N13	N11-N13 PolarHBondContact O-N 3.05Å; N11-N13 VanDerWaalsContact O-N 3.09Å; N11-N13 PolarHBondContact OD1-N 3.46Å; N11-N13 VanDerWaalsContact OD1-N 3.17Å
12	K	34.9	Very low	31	Very low	190 Å²	190	129.7 Å²	129.7	83%	0.826	72%	0.724	S	S	*	*	G	3₁₀ helix	trans	-62	-16.6	-176.5	-72.7	-173.4	174	-177.2	0	114	Y10 R14	Y10-K12 PolarHBondContact O-N 2.94Å; K12-R14 PolarHBondContact O-N 3.14Å
13	N	34	Very low	31.8	Very low	134 Å²	134	124.2 Å²	124.2	72%	0.717	70%	0.698	S	S	*	*	G	3₁₀ helix	trans	-98.8	33.2	-169.5	-60.3	8.7	0	0	0	113.4	N11	N11-N13 PolarHBondContact O-N 3.05Å; N11-N13 VanDerWaalsContact O-N 3.09Å; N11-N13 PolarHBondContact OD1-N 3.46Å; N11-N13 VanDerWaalsContact OD1-N 3.17Å
14	R	33.1	Very low	32.6	Very low	224 Å²	224	126.6 Å²	126.6	85%	0.845	69%	0.685	S	S	*	*	G	3₁₀ helix	trans	-140.9	17.7	179.9	-139.1	-179.6	-172.4	178.6	3.8	116.9	K12	K12-R14 PolarHBondContact O-N 3.14Å
15	V	30.4	Very low	33	Very low	117 Å²	117	126.7 Å²	126.7	71%	0.709	68%	0.676	S	S	*	*			trans	-133.6	67.6	166.3	-170.5	0	0	0	0	108.6
16	T	26.8	Very low	33.8	Very low	122 Å²	122	129.5 Å²	129.5	75%	0.748	68%	0.68	S	S	*	*			trans	-128.1	52.1	-179.1	54.9	0	0	0	0	110.8
17	S	31.1	Very low	34.6	Very low	99 Å²	99	126.3 Å²	126.3	69%	0.692	66%	0.659	S	S	*	*			trans	-133.3	55.1	163.8	65.6	0	0	0	0	108.7	L19	S17-L19 PolarHBondContact O-N 3.26Å; S17-L19 VanDerWaalsContact O-N 3.15Å
18	V	33.1	Very low	35.5	Very low	131 Å²	131	119.3 Å²	119.3	79%	0.794	64%	0.64	S	S	*	*			trans	-64.8	107.9	155.4	178.2	0	0	0	0	104.5
19	L	37	Very low	36.2	Very low	45 Å²	45	117.4 Å²	117.4	24%	0.236	62%	0.615	C	S	.	*			trans	-57.8	140.7	176.9	-63.2	175.5	0	0	0	108.3	S17 E23 Y24	S17-L19 PolarHBondContact O-N 3.26Å; S17-L19 VanDerWaalsContact O-N 3.15Å; L19-E23 WeakPolarHBondContact CA-OE2 3.38Å; L19-E23 HydrophobicContact CB-CB 4.36Å; L19-Y24 HydrophobicContact CB-CE2 4.02Å
20	K	32.1	Very low	37.1	Very low	148 Å²	148	113.5 Å²	113.5	64%	0.643	57%	0.574	S	S	*	*			trans	-63.1	147.6	-177.6	-66.4	-177.5	-179.5	178.9	0	109.3	D22 E23	K20-D22 PolarHBondContact O-N 2.97Å; K20-E23 HydrophobicContact CB-CG 4.37Å; K20-E23 PolarHBondContact N-OE2 3.31Å; K20-E23 WeakPolarHBondContact O-CB 3.21Å; K20-E23 PolarHBondContact O-N 3.19Å
21	P	35.5	Very low	37.6	Very low	96 Å²	96	106.4 Å²	106.4	62%	0.623	55%	0.55	S	S	*	.	G	3₁₀ helix	trans	-50.5	-33.2	178.8	-30.1	36.8	0	0	0	114.1	E23 Y24	P21-E23 PolarHBondContact O-N 3.03Å; P21-Y24 PolarHBondContact O-N 3.14Å
22	D	38.8	Very low	37.9	Very low	98 Å²	98	103.3 Å²	103.3	52%	0.524	55%	0.545	S	S	.	.	G	3₁₀ helix	trans	-70.1	-25.5	177.8	-58.4	-69.6	0	0	0	114.8	K20 Y24 K25	K20-D22 PolarHBondContact O-N 2.97Å; D22-Y24 PolarHBondContact O-N 2.89Å; D22-K25 WeakPolarHBondContact O-CB 3.5Å; D22-K25 PolarHBondContact O-N 3.32Å; D22-K25 IonicContact OD1-NZ 3.71Å; D22-K25 PolarHBondContact OD1-NZ 3.28Å
23	E	41.3	Very low	38.5	Very low	80 Å²	80	100.6 Å²	100.6	37%	0.374	54%	0.535	S	S	.	.	G	3₁₀ helix	trans	-67.8	-28.4	177.2	-66	178.6	97.9	0	0	111.3	L19 K20 P21 K25 Y27	L19-E23 WeakPolarHBondContact CA-OE2 3.38Å; L19-E23 HydrophobicContact CB-CB 4.36Å; K20-E23 HydrophobicContact CB-CG 4.37Å; K20-E23 PolarHBondContact N-OE2 3.31Å; K20-E23 WeakPolarHBondContact O-CB 3.21Å; K20-E23 PolarHBondContact O-N 3.19Å; P21-E23 PolarHBondContact O-N 3.03Å; E23-K25 VanDerWaalsContact C-N 3.25Å; E23-K25 PolarHBondContact O-N 3.03Å; E23-Y27 WeakPolarHBondContact O-CD2 3.42Å; E23-Y27 WeakPolarHBondContact O-CE2 3.08Å
24	Y	43	Very low	39.3	Very low	122 Å²	122	98.9 Å²	98.9	48%	0.478	53%	0.534	S	S	.	.	G	3₁₀ helix	trans	-66.2	-23.8	179.1	-73.6	-87.7	0	0	0	113.9	L19 P21 D22 N26 Y27	L19-Y24 HydrophobicContact CB-CE2 4.02Å; P21-Y24 PolarHBondContact O-N 3.14Å; D22-Y24 PolarHBondContact O-N 2.89Å; Y24-N26 PolarHBondContact O-N 2.8Å; Y24-Y27 PolarHBondContact O-N 3.09Å
25	K	37.5	Very low	40.8	Very low	122 Å²	122	90.6 Å²	90.6	53%	0.53	50%	0.504	S	S	.	.	G	3₁₀ helix	trans	-62.7	-25.4	-176.7	-67	171.4	177.3	166.8	0	113.3	D22 E23	D22-K25 WeakPolarHBondContact O-CB 3.5Å; D22-K25 PolarHBondContact O-N 3.32Å; D22-K25 IonicContact OD1-NZ 3.71Å; D22-K25 PolarHBondContact OD1-NZ 3.28Å; E23-K25 VanDerWaalsContact C-N 3.25Å; E23-K25 PolarHBondContact O-N 3.03Å
26	N	42.5	Very low	42.7	Very low	140 Å²	140	90 Å²	90	75%	0.749	49%	0.492	S	S	*	.	G	3₁₀ helix	trans	-90	-6.6	-175	-72.1	-7.8	0	0	0	115	Y24	Y24-N26 PolarHBondContact O-N 2.8Å
27	Y	45.9	Very low	45	Very low	84 Å²	84	87.6 Å²	87.6	33%	0.329	47%	0.474	S	S	.	.	S	Bend	trans	-103.2	13.4	-166.7	-65.6	-64.6	0	0	0	115.9	E23 Y24 F29 Q313	E23-Y27 WeakPolarHBondContact O-CD2 3.42Å; E23-Y27 WeakPolarHBondContact O-CE2 3.08Å; Y24-Y27 PolarHBondContact O-N 3.09Å; Y27-F29 VanDerWaalsContact C-N 3.26Å; Y27-F29 VanDerWaalsContact CB-CE2 3.41Å; Y27-F29 HydrophobicContact CG-CE2 4.27Å; Y27-F29 PolarHBondContact O-N 2.9Å; Y27-F29 VanDerWaalsContact O-N 3.15Å; Y27-Q313 HydrophobicContact CE1-CG 4.44Å
28	G	46.9	Very low	47.5	Very low	52 Å²	52	87.6 Å²	87.6	54%	0.536	46%	0.463	S	S	.	.			trans	61.7	26.3	171	0	0	0	0	0	115.4
29	F	49.1	Very low	50	Low	48 Å²	48	82.5 Å²	82.5	21%	0.211	43%	0.431	C	S	.	.			trans	-72.3	128.4	176.6	-70.5	-72.3	0	0	0	110.6	Y27 L31 Y320	Y27-F29 VanDerWaalsContact C-N 3.26Å; Y27-F29 VanDerWaalsContact CB-CE2 3.41Å; Y27-F29 HydrophobicContact CG-CE2 4.27Å; Y27-F29 PolarHBondContact O-N 2.9Å; Y27-F29 VanDerWaalsContact O-N 3.15Å; F29-L31 PolarHBondContact O-N 3.09Å; F29-Y320 HydrophobicContact CB-CE2 4.2Å; F29-Y320 AromaticContact CD1-CD1 3.88Å; F29-Y320 HydrophobicContact CD1-CD1 3.88Å; F29-Y320 AromaticContact CD1-CD2 3.43Å; F29-Y320 HydrophobicContact CD1-CD2 3.43Å; F29-Y320 VanDerWaalsContact CD1-CD2 3.43Å; F29-Y320 HydrophobicContact CD1-CE1 4.06Å; F29-Y320 AromaticContact CD1-CE2 3.55Å; F29-Y320 HydrophobicContact CD1-CE2 3.55Å; F29-Y320 AromaticContact CD1-CG 3.62Å; F29-Y320 HydrophobicContact CD1-CG 3.62Å; F29-Y320 AromaticContact CD1-CZ 3.9Å; F29-Y320 AromaticContact CE1-CD1 3.87Å; F29-Y320 HydrophobicContact CE1-CD1 3.87Å; F29-Y320 AromaticContact CE1-CD2 3.64Å; F29-Y320 HydrophobicContact CE1-CD2 3.64Å; F29-Y320 HydrophobicContact CE1-CE1 4.5Å; F29-Y320 HydrophobicContact CE1-CE2 4.23Å; F29-Y320 AromaticContact CE1-CG 3.44Å; F29-Y320 HydrophobicContact CE1-CG 3.44Å; F29-Y320 VanDerWaalsContact CE1-CG 3.44Å; F29-Y320 HydrophobicContact CG-CD2 4.18Å; F29-Y320 HydrophobicContact CG-CE2 4.12Å; F29-Y320 HydrophobicContact CZ-CG 4.44Å
30	P	44.1	Very low	52.6	Low	7 Å²	7	80.4 Å²	80.4	5%	0.045	42%	0.42	C	S	.	.	S	Bend	trans	-76.9	17.5	-170.9	33.3	-39.3	0	0	0	115	R350	P30-R350 PolarHBondContact O-NH2 3.12Å; P30-R350 VanDerWaalsContact O-NH2 3.15Å
31	L	40.3	Very low	55.5	Low	60 Å²	60	75.5 Å²	75.5	31%	0.314	40%	0.404	S	S	.	.	S	Bend	trans	-105.8	92.6	179.7	-72.6	175	0	0	0	110	F29 Y320 V324 L529	F29-L31 PolarHBondContact O-N 3.09Å; L31-Y320 HydrophobicContact CD1-CE2 4.03Å; L31-Y320 WeakPolarHBondContact CD1-OH 3.25Å; L31-Y320 WeakPolarHBondContact CG-OH 3.26Å; L31-V324 HydrophobicContact CD1-CG2 4.23Å; L31-L529 HydrophobicContact CB-CD1 4.26Å; L31-L529 HydrophobicContact CB-CG 4.2Å; L31-L529 HydrophobicContact CD1-CD1 3.62Å; L31-L529 HydrophobicContact CD1-CD2 4.01Å; L31-L529 HydrophobicContact CD1-CG 3.71Å
32	G	38.4	Very low	58.3	Low	50 Å²	50	71.7 Å²	71.7	52%	0.515	38%	0.377	S	S	.	.	S	Bend	trans	152.8	-38.1	-169.2	0	0	0	0	0	109.4	S34	G32-S34 PolarHBondContact O-N 3.4Å
33	Q	48.2	Very low	60.8	Low	133 Å²	133	69.4 Å²	69.4	62%	0.621	36%	0.362	S	S	*	.	S	Bend	trans	-65.8	124.2	167.7	-72.4	179.4	-19.9	0	0	111.2	F35 R350	Q33-F35 PolarHBondContact O-N 3.23Å; Q33-R350 PolarHBondContact O-NH2 2.81Å
34	S	51.3	Low	62.8	Low	98 Å²	98	68.9 Å²	68.9	69%	0.685	37%	0.367	S	S	*	.			trans	-43.2	133.8	173.6	-174.5	0	0	0	0	111.3	G32 K36 R350	G32-S34 PolarHBondContact O-N 3.4Å; S34-K36 PolarHBondContact O-N 2.82Å; S34-R350 PolarHBondContact O-NH1 3.19Å
35	F	62.6	Low	64.6	Low	51 Å²	51	68.9 Å²	68.9	22%	0.224	38%	0.38	C	S	.	.			trans	-74.9	125.4	176.7	176.1	-101.2	0	0	0	109.6	Q33 I40 D341 V342	Q33-F35 PolarHBondContact O-N 3.23Å; F35-I40 HydrophobicContact CE2-CD1 3.56Å; F35-I40 HydrophobicContact CE2-CG1 4.26Å; F35-I40 HydrophobicContact CZ-CD1 4.05Å; F35-D341 HydrophobicContact CD1-CB 3.83Å; F35-D341 HydrophobicContact CE1-CB 3.61Å; F35-D341 WeakPolarHBondContact CZ-O 3.2Å; F35-V342 HydrophobicContact CB-CG2 4.26Å; F35-V342 HydrophobicContact CD1-CG2 4.44Å; F35-V342 HydrophobicContact CD2-CB 4.12Å; F35-V342 HydrophobicContact CD2-CG1 3.9Å; F35-V342 HydrophobicContact CD2-CG2 3.76Å; F35-V342 HydrophobicContact CE2-CB 4.09Å; F35-V342 HydrophobicContact CE2-CG1 3.85Å; F35-V342 HydrophobicContact CE2-CG2 4.22Å; F35-V342 HydrophobicContact CG-CG2 3.88Å
36	K	71.4	Confident	66.7	Low	104 Å²	104	72 Å²	72	45%	0.452	40%	0.397	S	S	.	.			trans	-123.7	138.9	169.7	-54.4	-174.9	179.3	177.6	0	110.1	S34 E38 D39	S34-K36 PolarHBondContact O-N 2.82Å; K36-E38 HydrophobicContact CB-CG 3.86Å; K36-E38 HydrophobicContact CD-CG 3.84Å; K36-E38 WeakPolarHBondContact CD-OE1 3.31Å; K36-E38 WeakPolarHBondContact CE-OE1 3.4Å; K36-E38 IonicContact NZ-OE1 2.67Å; K36-E38 PolarHBondContact NZ-OE1 3.42Å; K36-E38 PolarHBondContact O-N 3.43Å; K36-D39 WeakPolarHBondContact O-CB 3.42Å; K36-D39 PolarHBondContact O-N 3.44Å
37	L	75.2	Confident	68.8	Low	71 Å²	71	68.8 Å²	68.8	37%	0.372	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-65.7	-25.6	174.8	-167.9	62.2	0	0	0	112.2	D39 I40 T45	L37-D39 PolarHBondContact O-N 3.03Å; L37-I40 PolarHBondContact O-N 2.74Å; L37-T45 HydrophobicContact CD2-CG2 4.14Å
38	E	83.6	Confident	70.8	Confident	99 Å²	99	73.4 Å²	73.4	46%	0.463	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-62.8	-23.2	174.9	75	-175.6	179.3	0	0	113.6	K36 I40	K36-E38 HydrophobicContact CB-CG 3.86Å; K36-E38 HydrophobicContact CD-CG 3.84Å; K36-E38 WeakPolarHBondContact CD-OE1 3.31Å; K36-E38 WeakPolarHBondContact CE-OE1 3.4Å; K36-E38 IonicContact NZ-OE1 2.67Å; K36-E38 PolarHBondContact NZ-OE1 3.42Å; K36-E38 PolarHBondContact O-N 3.43Å; E38-I40 PolarHBondContact O-N 3.19Å
39	D	86.4	Confident	72.8	Confident	24 Å²	24	72.5 Å²	72.5	13%	0.128	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	-75	-10.6	175.6	-64.3	-19.3	0	0	0	112.8	K36 L37 P41 R350 I351	K36-D39 WeakPolarHBondContact O-CB 3.42Å; K36-D39 PolarHBondContact O-N 3.44Å; L37-D39 PolarHBondContact O-N 3.03Å; D39-P41 WeakPolarHBondContact O-CD 3.43Å; D39-R350 HydrophobicContact CB-CB 4.06Å; D39-R350 HydrophobicContact CB-CG 4.08Å; D39-R350 WeakPolarHBondContact OD2-CD 3.47Å; D39-R350 IonicContact OD2-CZ 3.02Å; D39-R350 IonicContact OD2-NE 3.31Å; D39-R350 IonicContact OD2-NH1 2.81Å; D39-R350 PolarHBondContact OD2-NH1 2.96Å; D39-I351 PolarHBondContact O-N 3.19Å
40	I	90.8	Very high	74.7	Confident	1 Å²	1	75.3 Å²	75.3	1%	0.005	40%	0.398	C	S	.	.			trans	-124	62	-174.5	-53.3	-161.9	0	0	0	110.7	F35 L37 E38 W42 K43 S343 G346	F35-I40 HydrophobicContact CE2-CD1 3.56Å; F35-I40 HydrophobicContact CE2-CG1 4.26Å; F35-I40 HydrophobicContact CZ-CD1 4.05Å; L37-I40 PolarHBondContact O-N 2.74Å; E38-I40 PolarHBondContact O-N 3.19Å; I40-W42 HydrophobicContact CB-CE3 4.47Å; I40-W42 HydrophobicContact CB-CH2 4.29Å; I40-W42 HydrophobicContact CB-CZ3 4.25Å; I40-W42 HydrophobicContact CD1-CH2 4.46Å; I40-W42 HydrophobicContact CG1-CH2 4.12Å; I40-W42 HydrophobicContact CG1-CZ3 4.39Å; I40-W42 HydrophobicContact CG2-CD2 3.74Å; I40-W42 HydrophobicContact CG2-CE3 3.99Å; I40-W42 HydrophobicContact CG2-CG 4.38Å; I40-W42 HydrophobicContact CG2-CH2 3.87Å; I40-W42 HydrophobicContact CG2-CZ2 3.62Å; I40-W42 HydrophobicContact CG2-CZ3 4.02Å; I40-W42 PolarHBondContact O-N 3.28Å; I40-K43 HydrophobicContact CG2-CB 3.76Å; I40-K43 PolarHBondContact O-N 3.49Å; I40-S343 WeakPolarHBondContact CD1-OG 3.29Å; I40-G346 VanDerWaalsContact CD1-CA 3.4Å
41	P	93.1	Very high	76.8	Confident	46 Å²	46	81.8 Å²	81.8	30%	0.299	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-1.1	-174.8	30.8	-39.1	0	0	0	114.8	D39 Y66 I351 V356	D39-P41 WeakPolarHBondContact O-CD 3.43Å; P41-Y66 HydrophobicContact CB-CD2 4.28Å; P41-Y66 HydrophobicContact CB-CE1 4.47Å; P41-Y66 HydrophobicContact CB-CE2 3.67Å; P41-Y66 HydrophobicContact CG-CD1 4.27Å; P41-Y66 HydrophobicContact CG-CD2 4.39Å; P41-Y66 HydrophobicContact CG-CE1 3.66Å; P41-Y66 HydrophobicContact CG-CE2 3.78Å; P41-I351 HydrophobicContact CG-CB 4.03Å; P41-I351 HydrophobicContact CG-CG1 4.07Å; P41-I351 HydrophobicContact CG-CG2 4.41Å; P41-V356 HydrophobicContact CG-CG2 4.3Å
42	W	94.1	Very high	79.2	Confident	16 Å²	16	79.6 Å²	79.6	6%	0.061	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-20.4	174.5	68.3	88.6	0	0	0	113.9	I40 E59 D62 F63 Y66 L345 I349 I351	I40-W42 HydrophobicContact CB-CE3 4.47Å; I40-W42 HydrophobicContact CB-CH2 4.29Å; I40-W42 HydrophobicContact CB-CZ3 4.25Å; I40-W42 HydrophobicContact CD1-CH2 4.46Å; I40-W42 HydrophobicContact CG1-CH2 4.12Å; I40-W42 HydrophobicContact CG1-CZ3 4.39Å; I40-W42 HydrophobicContact CG2-CD2 3.74Å; I40-W42 HydrophobicContact CG2-CE3 3.99Å; I40-W42 HydrophobicContact CG2-CG 4.38Å; I40-W42 HydrophobicContact CG2-CH2 3.87Å; I40-W42 HydrophobicContact CG2-CZ2 3.62Å; I40-W42 HydrophobicContact CG2-CZ3 4.02Å; I40-W42 PolarHBondContact O-N 3.28Å; W42-E59 VanDerWaalsContact NE1-CG 3.34Å; W42-E59 PolarHBondContact NE1-OE1 3.47Å; W42-E59 VanDerWaalsContact NE1-OE1 3.08Å; W42-D62 HydrophobicContact CB-CB 4.5Å; W42-F63 HydrophobicContact CB-CB 4.5Å; W42-F63 HydrophobicContact CD2-CB 4.14Å; W42-F63 AromaticContact CD2-CD2 3.73Å; W42-F63 HydrophobicContact CD2-CD2 3.73Å; W42-F63 HydrophobicContact CD2-CG 4.43Å; W42-F63 AromaticContact CE2-CD2 3.98Å; W42-F63 AromaticContact CE3-CD2 3.72Å; W42-F63 HydrophobicContact CE3-CD2 3.72Å; W42-F63 HydrophobicContact CE3-CE2 4.34Å; W42-F63 HydrophobicContact CG-CB 3.95Å; W42-F63 HydrophobicContact CG-CD2 4.3Å; W42-F63 HydrophobicContact CH2-CD2 4.21Å; W42-F63 HydrophobicContact CZ2-CD2 4.2Å; W42-F63 AromaticContact CZ3-CD2 3.98Å; W42-F63 HydrophobicContact CZ3-CD2 3.98Å; W42-F63 HydrophobicContact CZ3-CE2 4.29Å; W42-Y66 HydrophobicContact CB-CG 4.13Å; W42-L345 HydrophobicContact CZ2-CB 4.26Å; W42-L345 HydrophobicContact CZ2-CD2 4.16Å; W42-L345 HydrophobicContact CZ2-CG 4.36Å; W42-I349 HydrophobicContact CH2-CG2 3.92Å; W42-I349 HydrophobicContact CZ3-CG2 4.43Å; W42-I351 HydrophobicContact CE3-CG1 4.33Å; W42-I351 HydrophobicContact CZ3-CG1 4.01Å
43	K	91.2	Very high	81.8	Confident	49 Å²	49	79.2 Å²	79.2	21%	0.213	41%	0.406	C	S	.	.	S	Bend	trans	-96.3	110.4	174.8	-176.7	-168.2	175.6	-165.2	0	108.3	I40 K47 Y49	I40-K43 HydrophobicContact CG2-CB 3.76Å; I40-K43 PolarHBondContact O-N 3.49Å; K43-K47 WeakPolarHBondContact CE-O 3.35Å; K43-Y49 HydrophobicContact CB-CE2 4.31Å; K43-Y49 HydrophobicContact CD-CE2 4.1Å; K43-Y49 HydrophobicContact CG-CE2 3.88Å
44	S	84	Confident	84	Confident	69 Å²	69	77.7 Å²	77.7	48%	0.483	40%	0.401	S	S	.	.			trans	-67.9	150.8	169.7	56.5	0	0	0	0	110.8	E46 K47	S44-E46 PolarHBondContact O-N 2.95Å; S44-E46 VanDerWaalsContact O-N 3.08Å; S44-K47 PolarHBondContact O-N 3.21Å; S44-K47 WeakPolarHBondContact OG-CB 3.46Å
45	T	79.4	Confident	86	Confident	122 Å²	122	73 Å²	73	75%	0.748	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-30.8	-175.1	-39.9	0	0	0	0	113.6	L37	L37-T45 HydrophobicContact CD2-CG2 4.14Å
46	E	82.1	Confident	87.6	Confident	187 Å²	187	70.6 Å²	70.6	87%	0.874	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-7	-179.5	-59.2	176.9	169.7	0	0	113.7	S44 E48	S44-E46 PolarHBondContact O-N 2.95Å; S44-E46 VanDerWaalsContact O-N 3.08Å; E46-E48 PolarHBondContact O-N 2.72Å
47	K	86.5	Confident	88.7	Confident	73 Å²	73	67.3 Å²	67.3	32%	0.317	34%	0.344	S	S	.	.			trans	-94.1	105.5	-171.5	-168.9	166.3	-168.4	176.4	0	112.5	K43 S44 Y49 D62	K43-K47 WeakPolarHBondContact CE-O 3.35Å; S44-K47 PolarHBondContact O-N 3.21Å; S44-K47 WeakPolarHBondContact OG-CB 3.46Å; K47-Y49 HydrophobicContact CD-CE1 4.1Å; K47-Y49 HydrophobicContact CG-CE1 4.26Å; K47-D62 WeakPolarHBondContact CD-OD2 3.44Å; K47-D62 WeakPolarHBondContact CE-OD2 3.12Å; K47-D62 IonicContact NZ-OD1 2.8Å; K47-D62 PolarHBondContact NZ-OD1 2.81Å; K47-D62 IonicContact NZ-OD2 2.69Å; K47-D62 PolarHBondContact NZ-OD2 3.05Å
48	E	87.2	Confident	89.7	Confident	182 Å²	182	65.4 Å²	65.4	85%	0.85	34%	0.338	S	S	*	.			trans	-82.3	153.2	163.7	-61.5	-173.4	163.2	0	0	110.8	E46	E46-E48 PolarHBondContact O-N 2.72Å
49	Y	90.1	Very high	90.3	Very high	33 Å²	33	60.7 Å²	60.7	13%	0.129	32%	0.316	C	S	.	.			trans	-116.6	144.6	175.9	-67.8	-60.8	0	0	0	109.4	K43 K47 A58 E59 D62	K43-Y49 HydrophobicContact CB-CE2 4.31Å; K43-Y49 HydrophobicContact CD-CE2 4.1Å; K43-Y49 HydrophobicContact CG-CE2 3.88Å; K47-Y49 HydrophobicContact CD-CE1 4.1Å; K47-Y49 HydrophobicContact CG-CE1 4.26Å; Y49-A58 HydrophobicContact CD1-CB 3.93Å; Y49-A58 HydrophobicContact CE1-CB 4.24Å; Y49-E59 HydrophobicContact CD1-CB 4.25Å; Y49-E59 HydrophobicContact CD2-CB 4.09Å; Y49-E59 HydrophobicContact CD2-CG 4.3Å; Y49-E59 HydrophobicContact CE1-CB 3.94Å; Y49-E59 HydrophobicContact CE2-CB 3.77Å; Y49-E59 HydrophobicContact CE2-CG 3.65Å; Y49-E59 HydrophobicContact CG-CB 4.34Å; Y49-D62 WeakPolarHBondContact CE1-OD2 3.27Å; Y49-D62 VanDerWaalsContact CZ-OD2 3.3Å; Y49-D62 PolarHBondContact OH-OD2 2.88Å
50	D	89.2	Confident	90.8	Very high	106 Å²	106	59.6 Å²	59.6	57%	0.567	31%	0.31	S	S	*	.			trans	-53.6	160.8	169.7	-73.5	-51	0	0	0	111.9	I54 G55	D50-I54 HydrophobicContact CB-CB 4.09Å; D50-I54 HydrophobicContact CB-CG2 3.82Å; D50-I54 WeakPolarHBondContact OD2-CG2 3.41Å; D50-G55 WeakPolarHBondContact O-CA 3.29Å; D50-G55 PolarHBondContact O-N 3.5Å
51	F	87.7	Confident	91.1	Very high	143 Å²	143	64.3 Å²	64.3	63%	0.627	33%	0.331	S	S	*	.	S	Bend	trans	-76.7	154.5	175.7	-55.1	-57.6	0	0	0	112.7	H334	F51-H334 AromaticContact CD1-CD2 3.81Å; F51-H334 AromaticContact CD1-CE1 3.68Å; F51-H334 AromaticContact CD1-NE2 3.12Å; F51-H334 WeakPolarHBondContact CD1-NE2 3.21Å; F51-H334 AromaticContact CD2-CE1 3.56Å; F51-H334 AromaticContact CD2-NE2 3.9Å; F51-H334 AromaticContact CE1-CE1 3.76Å; F51-H334 AromaticContact CE1-NE2 3.15Å; F51-H334 WeakPolarHBondContact CE1-NE2 3.49Å; F51-H334 AromaticContact CE2-CE1 3.63Å; F51-H334 AromaticContact CE2-NE2 3.91Å; F51-H334 AromaticContact CG-CE1 3.58Å; F51-H334 AromaticContact CG-NE2 3.52Å; F51-H334 AromaticContact CZ-CE1 3.73Å; F51-H334 AromaticContact CZ-NE2 3.56Å
52	G	91.2	Very high	91.2	Very high	14 Å²	14	63.3 Å²	63.3	14%	0.144	32%	0.323	C	S	.	.	H	α-helix	trans	73	-152.4	173.3	0	0	0	0	0	115.2	I54 G55 L56 V329	G52-I54 PolarHBondContact O-N 2.93Å; G52-G55 PolarHBondContact O-N 2.76Å; G52-L56 PolarHBondContact O-N 3.12Å; G52-L56 VanDerWaalsContact O-N 3.15Å; G52-V329 WeakPolarHBondContact CA-O 3.14Å
53	V	93.5	Very high	91.3	Very high	43 Å²	43	62.6 Å²	62.6	26%	0.261	32%	0.32	S	S	.	.	H	α-helix	trans	-68.7	-9.6	-179.3	-61.8	0	0	0	0	113.9	H57 N242 I245 V329	V53-H57 VanDerWaalsContact O-CB 3.26Å; V53-H57 WeakPolarHBondContact O-CB 3.46Å; V53-H57 PolarHBondContact O-N 3.12Å; V53-N242 PolarHBondContact O-ND2 2.8Å; V53-N242 PolarHBondContact O-OD1 3.49Å; V53-I245 HydrophobicContact CB-CG1 3.92Å; V53-I245 HydrophobicContact CG1-CG1 4.02Å; V53-I245 HydrophobicContact CG2-CD1 4.2Å; V53-I245 HydrophobicContact CG2-CG1 3.84Å; V53-V329 HydrophobicContact CG1-CB 3.99Å; V53-V329 HydrophobicContact CG1-CG1 4.46Å; V53-V329 HydrophobicContact CG1-CG2 3.83Å
54	I	93.4	Very high	91.6	Very high	100 Å²	100	61.7 Å²	61.7	51%	0.513	32%	0.318	S	S	.	.	H	α-helix	trans	-77.5	-49.8	173.2	-58.4	177.8	0	0	0	109.2	D50 G52 L56 H57 A58	D50-I54 HydrophobicContact CB-CB 4.09Å; D50-I54 HydrophobicContact CB-CG2 3.82Å; D50-I54 WeakPolarHBondContact OD2-CG2 3.41Å; G52-I54 PolarHBondContact O-N 2.93Å; I54-L56 PolarHBondContact O-N 3.27Å; I54-H57 WeakPolarHBondContact O-CB 3.4Å; I54-H57 PolarHBondContact O-N 2.91Å; I54-A58 PolarHBondContact O-N 2.8Å
55	G	93.3	Very high	92.1	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-58.5	-47.6	172.1	0	0	0	0	0	113	D50 G52 H57 A58 E59	D50-G55 WeakPolarHBondContact O-CA 3.29Å; D50-G55 PolarHBondContact O-N 3.5Å; G52-G55 PolarHBondContact O-N 2.76Å; G55-H57 PolarHBondContact O-N 3.2Å; G55-A58 PolarHBondContact O-N 3.11Å; G55-E59 WeakPolarHBondContact O-CB 3.31Å; G55-E59 PolarHBondContact O-N 3.11Å
56	L	95.4	Very high	92.9	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-59.8	-35.8	177.6	-177.6	57.1	0	0	0	111.9	G52 I54 I60 L247 V248 L325 V329 I344 L345	G52-L56 PolarHBondContact O-N 3.12Å; G52-L56 VanDerWaalsContact O-N 3.15Å; I54-L56 PolarHBondContact O-N 3.27Å; L56-I60 HydrophobicContact CD1-CD1 3.98Å; L56-I60 HydrophobicContact CD1-CG1 4.1Å; L56-I60 HydrophobicContact CG-CD1 3.85Å; L56-I60 HydrophobicContact CG-CG1 4.43Å; L56-I60 WeakPolarHBondContact O-CB 3.5Å; L56-I60 WeakPolarHBondContact O-CD1 3.37Å; L56-I60 WeakPolarHBondContact O-CG1 3.41Å; L56-I60 PolarHBondContact O-N 3.32Å; L56-L247 HydrophobicContact CD1-CD2 4.49Å; L56-V248 HydrophobicContact CD2-CG2 4.08Å; L56-L325 HydrophobicContact CD1-CD2 4.29Å; L56-L325 HydrophobicContact CD2-CD1 4.29Å; L56-L325 HydrophobicContact CD2-CD2 4.28Å; L56-V329 HydrophobicContact CB-CG1 4.15Å; L56-V329 HydrophobicContact CD2-CG1 3.86Å; L56-I344 HydrophobicContact CB-CD1 4.49Å; L56-I344 HydrophobicContact CB-CG2 4.14Å; L56-I344 HydrophobicContact CD1-CB 4.3Å; L56-I344 HydrophobicContact CD1-CG2 3.92Å; L56-I344 HydrophobicContact CD2-CG2 4.45Å; L56-I344 HydrophobicContact CG-CG2 4.37Å; L56-L345 HydrophobicContact CD1-CB 4.21Å; L56-L345 HydrophobicContact CD1-CD1 4.11Å
57	H	96.3	Very high	93.6	Very high	35 Å²	35	52.1 Å²	52.1	16%	0.162	26%	0.259	C	S	.	.	H	α-helix	trans	-66.6	-39.9	174.4	174.9	89.8	0	0	0	112.8	V53 I54 G55 K61 L243	V53-H57 VanDerWaalsContact O-CB 3.26Å; V53-H57 WeakPolarHBondContact O-CB 3.46Å; V53-H57 PolarHBondContact O-N 3.12Å; I54-H57 WeakPolarHBondContact O-CB 3.4Å; I54-H57 PolarHBondContact O-N 2.91Å; G55-H57 PolarHBondContact O-N 3.2Å; H57-K61 VanDerWaalsContact NE2-CE 3.29Å; H57-K61 WeakPolarHBondContact NE2-CE 3.5Å; H57-K61 PolarHBondContact NE2-NZ 2.96Å; H57-K61 PolarHBondContact O-N 2.93Å; H57-L243 PolarHBondContact ND1-N 2.9Å
58	A	95.3	Very high	94	Very high	31 Å²	31	50.3 Å²	50.3	26%	0.256	26%	0.256	S	S	.	.	H	α-helix	trans	-67.8	-42.9	174.8	0	0	0	0	0	111.8	Y49 I54 G55 K61 D62	Y49-A58 HydrophobicContact CD1-CB 3.93Å; Y49-A58 HydrophobicContact CE1-CB 4.24Å; I54-A58 PolarHBondContact O-N 2.8Å; G55-A58 PolarHBondContact O-N 3.11Å; A58-K61 WeakPolarHBondContact O-CB 3.49Å; A58-K61 PolarHBondContact O-N 3.33Å; A58-K61 VanDerWaalsContact O-N 3.17Å; A58-D62 PolarHBondContact O-N 3.01Å; A58-D62 VanDerWaalsContact O-N 3.07Å
59	E	96.3	Very high	94.3	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-66.1	-40	178.3	-173.2	173.7	-176.8	0	0	112.3	W42 Y49 G55 K61 D62 F63 S343 I344 L345	W42-E59 VanDerWaalsContact NE1-CG 3.34Å; W42-E59 PolarHBondContact NE1-OE1 3.47Å; W42-E59 VanDerWaalsContact NE1-OE1 3.08Å; Y49-E59 HydrophobicContact CD1-CB 4.25Å; Y49-E59 HydrophobicContact CD2-CB 4.09Å; Y49-E59 HydrophobicContact CD2-CG 4.3Å; Y49-E59 HydrophobicContact CE1-CB 3.94Å; Y49-E59 HydrophobicContact CE2-CB 3.77Å; Y49-E59 HydrophobicContact CE2-CG 3.65Å; Y49-E59 HydrophobicContact CG-CB 4.34Å; G55-E59 WeakPolarHBondContact O-CB 3.31Å; G55-E59 PolarHBondContact O-N 3.11Å; E59-K61 PolarHBondContact O-N 3.24Å; E59-D62 PolarHBondContact O-N 3Å; E59-F63 WeakPolarHBondContact O-CB 3.41Å; E59-F63 PolarHBondContact O-N 2.75Å; E59-S343 WeakPolarHBondContact OE1-CB 3.39Å; E59-S343 PolarHBondContact OE1-OG 3.27Å; E59-I344 WeakPolarHBondContact OE2-CA 3.4Å; E59-I344 WeakPolarHBondContact OE2-CB 3.26Å; E59-I344 PolarHBondContact OE2-N 2.97Å; E59-L345 HydrophobicContact CG-CB 3.83Å; E59-L345 HydrophobicContact CG-CD2 4.46Å; E59-L345 WeakPolarHBondContact OE1-CB 3.38Å; E59-L345 PolarHBondContact OE1-N 3.15Å; E59-L345 PolarHBondContact OE2-N 3.24Å
60	I	97.2	Very high	94.5	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.01	23%	0.229	C	C	.	.	H	α-helix	trans	-61.3	-34.7	173.3	-70.2	163	0	0	0	111.2	L56 L64 C193 V197 L243 L247 L345	L56-I60 HydrophobicContact CD1-CD1 3.98Å; L56-I60 HydrophobicContact CD1-CG1 4.1Å; L56-I60 HydrophobicContact CG-CD1 3.85Å; L56-I60 HydrophobicContact CG-CG1 4.43Å; L56-I60 WeakPolarHBondContact O-CB 3.5Å; L56-I60 WeakPolarHBondContact O-CD1 3.37Å; L56-I60 WeakPolarHBondContact O-CG1 3.41Å; L56-I60 PolarHBondContact O-N 3.32Å; I60-L64 VanDerWaalsContact O-CB 3.28Å; I60-L64 WeakPolarHBondContact O-CB 3.35Å; I60-L64 PolarHBondContact O-N 3.21Å; I60-C193 HydrophobicContact CG2-CB 4.19Å; I60-V197 HydrophobicContact CG1-CG2 4.47Å; I60-V197 HydrophobicContact CG2-CG2 4.19Å; I60-L243 HydrophobicContact CD1-CB 4.19Å; I60-L243 HydrophobicContact CG2-CB 4.16Å; I60-L243 HydrophobicContact CG2-CD1 3.93Å; I60-L247 HydrophobicContact CD1-CB 4.09Å; I60-L247 HydrophobicContact CD1-CD2 3.69Å; I60-L247 HydrophobicContact CG1-CD2 4.28Å; I60-L345 HydrophobicContact CG1-CD1 4.2Å; I60-L345 HydrophobicContact CG1-CD2 4.32Å
61	K	95.9	Very high	94.8	Very high	99 Å²	99	43 Å²	43	43%	0.43	23%	0.234	S	C	.	.	H	α-helix	trans	-68.2	-43.2	175.4	-80.4	173.1	165.4	170.8	0	112	H57 A58 E59 L64 N65 L243	H57-K61 VanDerWaalsContact NE2-CE 3.29Å; H57-K61 WeakPolarHBondContact NE2-CE 3.5Å; H57-K61 PolarHBondContact NE2-NZ 2.96Å; H57-K61 PolarHBondContact O-N 2.93Å; A58-K61 WeakPolarHBondContact O-CB 3.49Å; A58-K61 PolarHBondContact O-N 3.33Å; A58-K61 VanDerWaalsContact O-N 3.17Å; E59-K61 PolarHBondContact O-N 3.24Å; K61-L64 PolarHBondContact O-N 3.48Å; K61-N65 WeakPolarHBondContact O-CB 3.37Å; K61-N65 PolarHBondContact O-N 3.26Å; K61-N65 PolarHBondContact O-ND2 2.75Å; K61-L243 HydrophobicContact CG-CD1 4.09Å
62	D	96.4	Very high	95.1	Very high	26 Å²	26	36.2 Å²	36.2	14%	0.139	21%	0.205	C	C	.	.	H	α-helix	trans	-65.9	-44.3	175.1	-68	-25.3	0	0	0	112	W42 K47 Y49 A58 E59 L64 N65 Y66	W42-D62 HydrophobicContact CB-CB 4.5Å; K47-D62 WeakPolarHBondContact CD-OD2 3.44Å; K47-D62 WeakPolarHBondContact CE-OD2 3.12Å; K47-D62 IonicContact NZ-OD1 2.8Å; K47-D62 PolarHBondContact NZ-OD1 2.81Å; K47-D62 IonicContact NZ-OD2 2.69Å; K47-D62 PolarHBondContact NZ-OD2 3.05Å; Y49-D62 WeakPolarHBondContact CE1-OD2 3.27Å; Y49-D62 VanDerWaalsContact CZ-OD2 3.3Å; Y49-D62 PolarHBondContact OH-OD2 2.88Å; A58-D62 PolarHBondContact O-N 3.01Å; A58-D62 VanDerWaalsContact O-N 3.07Å; E59-D62 PolarHBondContact O-N 3Å; D62-L64 VanDerWaalsContact C-N 3.29Å; D62-L64 PolarHBondContact O-N 3.26Å; D62-N65 PolarHBondContact O-N 3.02Å; D62-Y66 PolarHBondContact O-N 2.89Å
63	F	96.9	Very high	95.3	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-57.2	-43.9	174	173.5	-97.9	0	0	0	111.2	W42 E59 Y66 I67 F196 V197 Q200 L345 I349 I351	W42-F63 HydrophobicContact CB-CB 4.5Å; W42-F63 HydrophobicContact CD2-CB 4.14Å; W42-F63 AromaticContact CD2-CD2 3.73Å; W42-F63 HydrophobicContact CD2-CD2 3.73Å; W42-F63 HydrophobicContact CD2-CG 4.43Å; W42-F63 AromaticContact CE2-CD2 3.98Å; W42-F63 AromaticContact CE3-CD2 3.72Å; W42-F63 HydrophobicContact CE3-CD2 3.72Å; W42-F63 HydrophobicContact CE3-CE2 4.34Å; W42-F63 HydrophobicContact CG-CB 3.95Å; W42-F63 HydrophobicContact CG-CD2 4.3Å; W42-F63 HydrophobicContact CH2-CD2 4.21Å; W42-F63 HydrophobicContact CZ2-CD2 4.2Å; W42-F63 AromaticContact CZ3-CD2 3.98Å; W42-F63 HydrophobicContact CZ3-CD2 3.98Å; W42-F63 HydrophobicContact CZ3-CE2 4.29Å; E59-F63 WeakPolarHBondContact O-CB 3.41Å; E59-F63 PolarHBondContact O-N 2.75Å; F63-Y66 PolarHBondContact O-N 2.9Å; F63-I67 HydrophobicContact CD1-CG2 4.09Å; F63-I67 HydrophobicContact CE1-CB 4.27Å; F63-I67 HydrophobicContact CE1-CG2 3.72Å; F63-I67 HydrophobicContact CE2-CB 4.22Å; F63-I67 HydrophobicContact CE2-CG1 4.31Å; F63-I67 HydrophobicContact CZ-CB 4.02Å; F63-I67 HydrophobicContact CZ-CG1 3.95Å; F63-I67 HydrophobicContact CZ-CG2 3.96Å; F63-I67 VanDerWaalsContact O-CB 3.31Å; F63-I67 WeakPolarHBondContact O-CB 3.36Å; F63-I67 WeakPolarHBondContact O-CG2 3.42Å; F63-I67 PolarHBondContact O-N 2.92Å; F63-F196 HydrophobicContact CE1-CB 4.29Å; F63-V197 HydrophobicContact CD1-CG2 3.62Å; F63-V197 HydrophobicContact CE1-CB 4.34Å; F63-V197 HydrophobicContact CE1-CG2 3.7Å; F63-Q200 HydrophobicContact CE2-CG 4.44Å; F63-Q200 HydrophobicContact CZ-CB 3.88Å; F63-Q200 HydrophobicContact CZ-CG 4.19Å; F63-L345 HydrophobicContact CB-CD2 3.6Å; F63-L345 HydrophobicContact CD1-CD2 4.09Å; F63-L345 HydrophobicContact CD2-CD2 4.15Å; F63-L345 HydrophobicContact CG-CD2 3.66Å; F63-I349 HydrophobicContact CD2-CG2 4.46Å; F63-I349 HydrophobicContact CE2-CG2 3.79Å; F63-I349 HydrophobicContact CZ-CG2 4.22Å; F63-I351 HydrophobicContact CE2-CD1 4.28Å
64	L	95.9	Very high	95.4	Very high	30 Å²	30	36.7 Å²	36.7	16%	0.157	20%	0.2	C	C	.	.	H	α-helix	trans	-61.8	-47.3	174.9	-179.2	65.8	0	0	0	111.9	I60 K61 D62 Y66 I67 S68 C193 F196	I60-L64 VanDerWaalsContact O-CB 3.28Å; I60-L64 WeakPolarHBondContact O-CB 3.35Å; I60-L64 PolarHBondContact O-N 3.21Å; K61-L64 PolarHBondContact O-N 3.48Å; D62-L64 VanDerWaalsContact C-N 3.29Å; D62-L64 PolarHBondContact O-N 3.26Å; L64-Y66 VanDerWaalsContact C-N 3.28Å; L64-Y66 PolarHBondContact O-N 2.9Å; L64-I67 PolarHBondContact O-N 2.68Å; L64-S68 VanDerWaalsContact O-CB 3.25Å; L64-S68 WeakPolarHBondContact O-CB 3.4Å; L64-S68 PolarHBondContact O-N 3.44Å; L64-S68 PolarHBondContact O-OG 3.16Å; L64-C193 HydrophobicContact CD2-CB 4.46Å; L64-F196 HydrophobicContact CD1-CB 4.3Å; L64-F196 HydrophobicContact CD1-CD2 3.38Å; L64-F196 HydrophobicContact CD1-CE2 3.97Å; L64-F196 HydrophobicContact CD1-CG 4.07Å
65	N	95.5	Very high	95.5	Very high	124 Å²	124	34 Å²	34	66%	0.663	19%	0.185	S	C	*	.	H	α-helix	trans	-59.7	-39.1	178.3	-69.7	-23.7	0	0	0	111.9	K61 D62	K61-N65 WeakPolarHBondContact O-CB 3.37Å; K61-N65 PolarHBondContact O-N 3.26Å; K61-N65 PolarHBondContact O-ND2 2.75Å; D62-N65 PolarHBondContact O-N 3.02Å
66	Y	96.1	Very high	95.6	Very high	51 Å²	51	34 Å²	34	20%	0.2	19%	0.185	C	C	.	.	H	α-helix	trans	-68.1	-62	172.6	176.7	-93.2	0	0	0	111.1	P41 W42 D62 F63 L64 S68 I351 R359	P41-Y66 HydrophobicContact CB-CD2 4.28Å; P41-Y66 HydrophobicContact CB-CE1 4.47Å; P41-Y66 HydrophobicContact CB-CE2 3.67Å; P41-Y66 HydrophobicContact CG-CD1 4.27Å; P41-Y66 HydrophobicContact CG-CD2 4.39Å; P41-Y66 HydrophobicContact CG-CE1 3.66Å; P41-Y66 HydrophobicContact CG-CE2 3.78Å; W42-Y66 HydrophobicContact CB-CG 4.13Å; D62-Y66 PolarHBondContact O-N 2.89Å; F63-Y66 PolarHBondContact O-N 2.9Å; L64-Y66 VanDerWaalsContact C-N 3.28Å; L64-Y66 PolarHBondContact O-N 2.9Å; Y66-S68 VanDerWaalsContact C-N 3.28Å; Y66-S68 PolarHBondContact O-N 3.2Å; Y66-I351 HydrophobicContact CE1-CG1 4.12Å; Y66-R359 PolarHBondContact O-NH1 3.02Å; Y66-R359 PolarHBondContact O-NH2 3.4Å
67	I	96.3	Very high	95.7	Very high	3 Å²	3	34.1 Å²	34.1	2%	0.015	19%	0.186	C	C	.	.	H	α-helix	trans	-72.9	-17.7	-163.6	-158.3	58.1	0	0	0	114.1	F63 L64 L109 P110 F196 I351	F63-I67 HydrophobicContact CD1-CG2 4.09Å; F63-I67 HydrophobicContact CE1-CB 4.27Å; F63-I67 HydrophobicContact CE1-CG2 3.72Å; F63-I67 HydrophobicContact CE2-CB 4.22Å; F63-I67 HydrophobicContact CE2-CG1 4.31Å; F63-I67 HydrophobicContact CZ-CB 4.02Å; F63-I67 HydrophobicContact CZ-CG1 3.95Å; F63-I67 HydrophobicContact CZ-CG2 3.96Å; F63-I67 VanDerWaalsContact O-CB 3.31Å; F63-I67 WeakPolarHBondContact O-CB 3.36Å; F63-I67 WeakPolarHBondContact O-CG2 3.42Å; F63-I67 PolarHBondContact O-N 2.92Å; L64-I67 PolarHBondContact O-N 2.68Å; I67-L109 HydrophobicContact CD1-CD2 4.19Å; I67-L109 HydrophobicContact CG1-CD2 3.63Å; I67-P110 HydrophobicContact CD1-CG 4.08Å; I67-F196 HydrophobicContact CG2-CB 3.89Å; I67-F196 HydrophobicContact CG2-CD1 3.77Å; I67-F196 HydrophobicContact CG2-CE1 4.5Å; I67-F196 HydrophobicContact CG2-CG 3.93Å; I67-I351 HydrophobicContact CD1-CD1 3.67Å
68	S	95.2	Very high	95.7	Very high	35 Å²	35	37 Å²	37	25%	0.245	20%	0.199	C	C	.	.	S	Bend	trans	-61.3	153.3	178.6	-67.4	0	0	0	0	112.2	L64 Y66 S70 R359	L64-S68 VanDerWaalsContact O-CB 3.25Å; L64-S68 WeakPolarHBondContact O-CB 3.4Å; L64-S68 PolarHBondContact O-N 3.44Å; L64-S68 PolarHBondContact O-OG 3.16Å; Y66-S68 VanDerWaalsContact C-N 3.28Å; Y66-S68 PolarHBondContact O-N 3.2Å; S68-S70 PolarHBondContact O-N 3.5Å; S68-R359 PolarHBondContact O-NH2 3.37Å
69	P	94	Very high	95.8	Very high	38 Å²	38	37.1 Å²	37.1	25%	0.247	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-47.2	124.2	170.7	-35.4	40.2	0	0	0	114.8	Y108	P69-Y108 HydrophobicContact CB-CE1 3.78Å; P69-Y108 HydrophobicContact CB-CE2 3.98Å; P69-Y108 VanDerWaalsContact CB-CZ 3.49Å; P69-Y108 HydrophobicContact CG-CD1 3.72Å; P69-Y108 HydrophobicContact CG-CD2 4.09Å; P69-Y108 HydrophobicContact CG-CE1 3.41Å; P69-Y108 VanDerWaalsContact CG-CE1 3.41Å; P69-Y108 HydrophobicContact CG-CE2 3.79Å; P69-Y108 HydrophobicContact CG-CG 4.09Å; P69-Y108 VanDerWaalsContact CG-CZ 3.49Å
70	S	94.6	Very high	95.8	Very high	25 Å²	25	37.1 Å²	37.1	18%	0.175	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-82.5	154.8	171.3	103.9	0	0	0	0	111.8	S68 A72 E73 Q74	S68-S70 PolarHBondContact O-N 3.5Å; S70-A72 PolarHBondContact O-N 2.87Å; S70-A72 VanDerWaalsContact O-N 3.09Å; S70-A72 WeakPolarHBondContact OG-CB 3.32Å; S70-A72 PolarHBondContact OG-N 3.28Å; S70-E73 PolarHBondContact N-OE2 2.84Å; S70-E73 PolarHBondContact O-N 3Å; S70-E73 VanDerWaalsContact O-N 3.09Å; S70-E73 PolarHBondContact OG-N 3.46Å; S70-Q74 PolarHBondContact O-N 2.89Å
71	P	94.4	Very high	95.9	Very high	104 Å²	104	37.7 Å²	37.7	68%	0.675	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-8.6	172.2	-22.6	34.3	0	0	0	115	R370	P71-R370 PolarHBondContact O-NH2 3.23Å
72	A	94.9	Very high	95.9	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.008	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-43.9	168.3	0	0	0	0	0	111.2	S70 Q74 F75 A76 A366	S70-A72 PolarHBondContact O-N 2.87Å; S70-A72 VanDerWaalsContact O-N 3.09Å; S70-A72 WeakPolarHBondContact OG-CB 3.32Å; S70-A72 PolarHBondContact OG-N 3.28Å; A72-Q74 PolarHBondContact O-N 3.08Å; A72-F75 PolarHBondContact O-N 2.99Å; A72-A76 PolarHBondContact O-N 2.93Å; A72-A366 HydrophobicContact CB-CB 3.54Å
73	E	95.3	Very high	96	Very high	5 Å²	5	35.5 Å²	35.5	2%	0.023	20%	0.197	C	C	.	.	H	α-helix	trans	-64.8	-38.8	178.7	-65	170.8	145	0	0	112.4	S70 R77 P110 R359 I362	S70-E73 PolarHBondContact N-OE2 2.84Å; S70-E73 PolarHBondContact O-N 3Å; S70-E73 VanDerWaalsContact O-N 3.09Å; S70-E73 PolarHBondContact OG-N 3.46Å; E73-R77 WeakPolarHBondContact O-CB 3.32Å; E73-R77 WeakPolarHBondContact O-CD 3.45Å; E73-R77 VanDerWaalsContact O-CG 3.25Å; E73-R77 WeakPolarHBondContact O-CG 3.36Å; E73-R77 PolarHBondContact O-N 3.42Å; E73-R77 VanDerWaalsContact O-N 3.15Å; E73-P110 WeakPolarHBondContact OE1-CB 3.45Å; E73-R359 IonicContact OE1-CZ 3.93Å; E73-R359 IonicContact OE1-NE 4Å; E73-R359 PolarHBondContact OE1-NE 2.92Å; E73-R359 IonicContact OE1-NH2 2.66Å; E73-R359 PolarHBondContact OE1-NH2 2.8Å; E73-R359 IonicContact OE2-CZ 2.64Å; E73-R359 IonicContact OE2-NE 3.98Å; E73-R359 IonicContact OE2-NH2 2.66Å; E73-R359 PolarHBondContact OE2-NH2 3.4Å; E73-I362 HydrophobicContact CB-CG2 4.18Å; E73-I362 HydrophobicContact CG-CB 4.48Å; E73-I362 HydrophobicContact CG-CG2 3.71Å
74	Q	95	Very high	96.1	Very high	62 Å²	62	35.5 Å²	35.5	29%	0.29	20%	0.198	S	C	.	.	H	α-helix	trans	-59.1	-49.1	172.1	-179.6	62.9	32.2	0	0	110.9	S70 A72 R77 E78 Y108	S70-Q74 PolarHBondContact O-N 2.89Å; A72-Q74 PolarHBondContact O-N 3.08Å; Q74-R77 PolarHBondContact O-N 3.4Å; Q74-E78 WeakPolarHBondContact CG-OE1 3.39Å; Q74-E78 PolarHBondContact NE2-OE1 3.15Å; Q74-E78 WeakPolarHBondContact O-CG 3.33Å; Q74-E78 PolarHBondContact O-N 3.33Å; Q74-Y108 WeakPolarHBondContact CA-OH 3.37Å; Q74-Y108 PolarHBondContact N-OH 2.94Å; Q74-Y108 PolarHBondContact OE1-OH 3.22Å
75	F	95.4	Very high	96.2	Very high	44 Å²	44	36.5 Å²	36.5	19%	0.193	20%	0.201	C	C	.	.	H	α-helix	trans	-66.7	-41.4	-178.5	175.1	-106.1	0	0	0	113	A72 R77 E78 V79 A366 L369 R370	A72-F75 PolarHBondContact O-N 2.99Å; F75-R77 VanDerWaalsContact C-N 3.32Å; F75-R77 PolarHBondContact O-N 3.27Å; F75-E78 PolarHBondContact O-N 2.79Å; F75-V79 HydrophobicContact CE1-CG2 4.24Å; F75-V79 HydrophobicContact CE2-CG2 4.19Å; F75-V79 HydrophobicContact CZ-CG2 4.03Å; F75-V79 WeakPolarHBondContact O-CG2 3.15Å; F75-V79 PolarHBondContact O-N 2.83Å; F75-A366 HydrophobicContact CD1-CB 3.97Å; F75-L369 HydrophobicContact CE1-CB 3.94Å; F75-L369 HydrophobicContact CE1-CD1 4.12Å; F75-L369 HydrophobicContact CZ-CB 4.44Å; F75-R370 HydrophobicContact CE1-CG 4.03Å; F75-R370 HydrophobicContact CZ-CG 4.25Å
76	A	95.9	Very high	96.3	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-61.2	-41.7	175.2	0	0	0	0	0	111.6	A72 V79 V80 L163 I362 Y365	A72-A76 PolarHBondContact O-N 2.93Å; A76-V79 PolarHBondContact O-N 2.66Å; A76-V80 WeakPolarHBondContact O-CG2 3.43Å; A76-V80 PolarHBondContact O-N 3.09Å; A76-L163 HydrophobicContact CB-CD1 4.36Å; A76-I362 HydrophobicContact CB-CD1 4.44Å; A76-I362 HydrophobicContact CB-CG2 3.76Å; A76-Y365 HydrophobicContact CB-CD1 4.02Å; A76-Y365 HydrophobicContact CB-CE1 4.22Å
77	R	97	Very high	96.4	Very high	2 Å²	2	34.3 Å²	34.3	1%	0.008	19%	0.192	C	C	.	.	H	α-helix	trans	-66.5	-38.7	175	-69.7	170	179.2	-92.7	-3.1	112.4	E73 Q74 F75 V79 V80 V81 F103 P110 S112 D113 I114 L163	E73-R77 WeakPolarHBondContact O-CB 3.32Å; E73-R77 WeakPolarHBondContact O-CD 3.45Å; E73-R77 VanDerWaalsContact O-CG 3.25Å; E73-R77 WeakPolarHBondContact O-CG 3.36Å; E73-R77 PolarHBondContact O-N 3.42Å; E73-R77 VanDerWaalsContact O-N 3.15Å; Q74-R77 PolarHBondContact O-N 3.4Å; F75-R77 VanDerWaalsContact C-N 3.32Å; F75-R77 PolarHBondContact O-N 3.27Å; R77-V79 VanDerWaalsContact C-N 3.35Å; R77-V80 PolarHBondContact O-N 2.85Å; R77-V81 WeakPolarHBondContact O-CB 3.43Å; R77-V81 WeakPolarHBondContact O-CG2 3.4Å; R77-V81 PolarHBondContact O-N 3.34Å; R77-F103 HydrophobicContact CB-CD2 4.19Å; R77-F103 HydrophobicContact CB-CE1 4.18Å; R77-F103 HydrophobicContact CB-CE2 3.47Å; R77-F103 VanDerWaalsContact CB-CE2 3.47Å; R77-F103 HydrophobicContact CB-CZ 3.47Å; R77-F103 VanDerWaalsContact CB-CZ 3.47Å; R77-F103 HydrophobicContact CG-CE2 4.19Å; R77-P110 PolarHBondContact NH2-O 2.68Å; R77-S112 VanDerWaalsContact CZ-O 3.24Å; R77-S112 PolarHBondContact NH1-O 2.98Å; R77-S112 PolarHBondContact NH2-O 2.95Å; R77-D113 PolarHBondContact NH1-O 3.14Å; R77-I114 HydrophobicContact CB-CD1 3.94Å; R77-I114 HydrophobicContact CG-CD1 3.87Å; R77-I114 HydrophobicContact CG-CG1 4.18Å; R77-L163 HydrophobicContact CG-CD1 3.82Å; R77-L163 HydrophobicContact CG-CD2 4.19Å
78	E	96.5	Very high	96.5	Very high	96 Å²	96	34.1 Å²	34.1	45%	0.449	19%	0.191	S	C	.	.	H	α-helix	trans	-61.7	-40.7	173.3	-74.4	166.6	176	0	0	112.2	Q74 F75 V81 A82 F103	Q74-E78 WeakPolarHBondContact CG-OE1 3.39Å; Q74-E78 PolarHBondContact NE2-OE1 3.15Å; Q74-E78 WeakPolarHBondContact O-CG 3.33Å; Q74-E78 PolarHBondContact O-N 3.33Å; F75-E78 PolarHBondContact O-N 2.79Å; E78-V81 PolarHBondContact O-N 3.43Å; E78-A82 PolarHBondContact O-N 3.46Å; E78-F103 HydrophobicContact CG-CZ 4.23Å
79	V	96.5	Very high	96.6	Very high	33 Å²	33	36.5 Å²	36.5	20%	0.2	20%	0.195	C	C	.	.	H	α-helix	trans	-63.9	-47	174.9	168.8	0	0	0	0	111.5	F75 A76 R77 V81 A82 K83 L369	F75-V79 HydrophobicContact CE1-CG2 4.24Å; F75-V79 HydrophobicContact CE2-CG2 4.19Å; F75-V79 HydrophobicContact CZ-CG2 4.03Å; F75-V79 WeakPolarHBondContact O-CG2 3.15Å; F75-V79 PolarHBondContact O-N 2.83Å; A76-V79 PolarHBondContact O-N 2.66Å; R77-V79 VanDerWaalsContact C-N 3.35Å; V79-V81 VanDerWaalsContact C-N 3.34Å; V79-V81 PolarHBondContact O-N 3.17Å; V79-A82 WeakPolarHBondContact O-CB 3.46Å; V79-A82 PolarHBondContact O-N 3.15Å; V79-A82 VanDerWaalsContact O-N 3.15Å; V79-K83 PolarHBondContact O-N 3.04Å; V79-L369 HydrophobicContact CG1-CD1 4.09Å; V79-L369 HydrophobicContact CG2-CD1 4.05Å
80	V	97.5	Very high	96.8	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-61.2	-42.5	176.2	174.1	0	0	0	0	111.4	A76 R77 A82 K83 V84 I114 D158 T161 L163 V165	A76-V80 WeakPolarHBondContact O-CG2 3.43Å; A76-V80 PolarHBondContact O-N 3.09Å; R77-V80 PolarHBondContact O-N 2.85Å; V80-A82 VanDerWaalsContact C-N 3.29Å; V80-A82 PolarHBondContact O-N 3.36Å; V80-K83 PolarHBondContact O-N 3.36Å; V80-V84 WeakPolarHBondContact O-CG2 3.49Å; V80-V84 PolarHBondContact O-N 2.85Å; V80-V84 VanDerWaalsContact O-N 3.1Å; V80-I114 HydrophobicContact CB-CD1 4.08Å; V80-I114 HydrophobicContact CG1-CD1 3.96Å; V80-D158 HydrophobicContact CG1-CB 3.93Å; V80-D158 HydrophobicContact CG2-CB 3.89Å; V80-T161 HydrophobicContact CG2-CG2 4.16Å; V80-T161 WeakPolarHBondContact CG2-OG1 3.31Å; V80-L163 HydrophobicContact CG2-CD1 4.05Å; V80-V165 HydrophobicContact CG1-CG2 3.69Å
81	V	97.9	Very high	96.9	Very high	13 Å²	13	40.4 Å²	40.4	8%	0.079	22%	0.219	C	C	.	.	H	α-helix	trans	-62.5	-35	175.5	167.7	0	0	0	0	111.9	R77 E78 V79 K85 V99 F103 I114 M116	R77-V81 WeakPolarHBondContact O-CB 3.43Å; R77-V81 WeakPolarHBondContact O-CG2 3.4Å; R77-V81 PolarHBondContact O-N 3.34Å; E78-V81 PolarHBondContact O-N 3.43Å; V79-V81 VanDerWaalsContact C-N 3.34Å; V79-V81 PolarHBondContact O-N 3.17Å; V81-K85 HydrophobicContact CG1-CD 4.04Å; V81-K85 HydrophobicContact CG1-CG 4.48Å; V81-K85 VanDerWaalsContact O-CB 3.31Å; V81-K85 WeakPolarHBondContact O-CB 3.49Å; V81-K85 VanDerWaalsContact O-CG 3.23Å; V81-K85 WeakPolarHBondContact O-CG 3.12Å; V81-K85 PolarHBondContact O-N 3.44Å; V81-V99 HydrophobicContact CB-CG1 4.42Å; V81-V99 HydrophobicContact CG1-CG1 3.7Å; V81-V99 HydrophobicContact CG2-CG1 3.75Å; V81-F103 HydrophobicContact CG2-CE1 4.11Å; V81-I114 HydrophobicContact CG2-CD1 4.48Å; V81-I114 HydrophobicContact CG2-CG2 3.66Å; V81-M116 HydrophobicContact CG1-CE 4.16Å; V81-M116 HydrophobicContact CG2-SD 4.04Å
82	A	97.6	Very high	97	Very high	45 Å²	45	37.6 Å²	37.6	37%	0.372	20%	0.195	S	C	.	.	H	α-helix	trans	-65	-51.5	173.7	0	0	0	0	0	111.5	E78 V79 V80 V84 K85 D86	E78-A82 PolarHBondContact O-N 3.46Å; V79-A82 WeakPolarHBondContact O-CB 3.46Å; V79-A82 PolarHBondContact O-N 3.15Å; V79-A82 VanDerWaalsContact O-N 3.15Å; V80-A82 VanDerWaalsContact C-N 3.29Å; V80-A82 PolarHBondContact O-N 3.36Å; A82-V84 VanDerWaalsContact C-N 3.3Å; A82-V84 PolarHBondContact O-N 3.27Å; A82-K85 WeakPolarHBondContact O-CA 3.36Å; A82-K85 WeakPolarHBondContact O-CB 3.37Å; A82-K85 PolarHBondContact O-N 2.86Å; A82-D86 PolarHBondContact O-N 2.92Å
83	K	97.6	Very high	97.1	Very high	34 Å²	34	42.2 Å²	42.2	15%	0.148	23%	0.225	C	C	.	.	H	α-helix	trans	-51.9	-47.4	177	-61.8	179.8	-165.3	177.8	0	112.2	V79 V80 D86 I87 I139 D158 E160	V79-K83 PolarHBondContact O-N 3.04Å; V80-K83 PolarHBondContact O-N 3.36Å; K83-D86 PolarHBondContact O-N 2.96Å; K83-I87 WeakPolarHBondContact O-CD1 3.41Å; K83-I87 WeakPolarHBondContact O-CG1 3.49Å; K83-I87 PolarHBondContact O-N 3.47Å; K83-I139 HydrophobicContact CB-CD1 3.84Å; K83-I139 HydrophobicContact CD-CB 4.41Å; K83-I139 HydrophobicContact CD-CG2 4.35Å; K83-D158 IonicContact NZ-OD1 3.83Å; K83-D158 PolarHBondContact NZ-OD1 3.48Å; K83-D158 IonicContact NZ-OD2 2.68Å; K83-E160 IonicContact NZ-OE1 2.77Å; K83-E160 PolarHBondContact NZ-OE1 3.1Å; K83-E160 IonicContact NZ-OE2 2.76Å; K83-E160 PolarHBondContact NZ-OE2 2.84Å
84	V	98.2	Very high	97.1	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.006	27%	0.265	C	S	.	.	H	α-helix	trans	-66.6	-39.8	179.2	175.3	0	0	0	0	111.3	V80 A82 I87 V88 M116 I139 M156 I167	V80-V84 WeakPolarHBondContact O-CG2 3.49Å; V80-V84 PolarHBondContact O-N 2.85Å; V80-V84 VanDerWaalsContact O-N 3.1Å; A82-V84 VanDerWaalsContact C-N 3.3Å; A82-V84 PolarHBondContact O-N 3.27Å; V84-I87 PolarHBondContact O-N 2.95Å; V84-V88 HydrophobicContact CG1-CG2 4.3Å; V84-V88 WeakPolarHBondContact O-CB 3.41Å; V84-V88 VanDerWaalsContact O-CG2 3.26Å; V84-V88 WeakPolarHBondContact O-CG2 3.38Å; V84-V88 PolarHBondContact O-N 3.47Å; V84-M116 HydrophobicContact CB-CE 4.06Å; V84-M116 HydrophobicContact CB-SD 4.06Å; V84-M116 HydrophobicContact CG1-CE 3.7Å; V84-M116 HydrophobicContact CG1-SD 3.83Å; V84-M116 HydrophobicContact CG2-SD 4.5Å; V84-I139 HydrophobicContact CG2-CD1 4.09Å; V84-M156 HydrophobicContact CG2-SD 3.81Å; V84-I167 HydrophobicContact CG1-CD1 3.68Å; V84-I167 HydrophobicContact CG1-CG1 4.46Å
85	K	98.2	Very high	97.1	Very high	51 Å²	51	47.3 Å²	47.3	22%	0.222	26%	0.255	C	S	.	.	H	α-helix	trans	-62.3	-43.7	176.3	-82.8	-179.6	175.7	-162.1	0	112.6	V81 A82 I87 V88 Y89 V97 M116	V81-K85 HydrophobicContact CG1-CD 4.04Å; V81-K85 HydrophobicContact CG1-CG 4.48Å; V81-K85 VanDerWaalsContact O-CB 3.31Å; V81-K85 WeakPolarHBondContact O-CB 3.49Å; V81-K85 VanDerWaalsContact O-CG 3.23Å; V81-K85 WeakPolarHBondContact O-CG 3.12Å; V81-K85 PolarHBondContact O-N 3.44Å; A82-K85 WeakPolarHBondContact O-CA 3.36Å; A82-K85 WeakPolarHBondContact O-CB 3.37Å; A82-K85 PolarHBondContact O-N 2.86Å; K85-I87 VanDerWaalsContact C-N 3.33Å; K85-I87 PolarHBondContact O-N 3.08Å; K85-V88 PolarHBondContact O-N 2.84Å; K85-Y89 HydrophobicContact CB-CD2 4.18Å; K85-Y89 HydrophobicContact CB-CE2 3.94Å; K85-Y89 HydrophobicContact CD-CE2 4.44Å; K85-Y89 HydrophobicContact CG-CE2 4.25Å; K85-Y89 WeakPolarHBondContact O-CB 3.48Å; K85-Y89 WeakPolarHBondContact O-CD2 3.26Å; K85-Y89 PolarHBondContact O-N 3.2Å; K85-V97 HydrophobicContact CD-CB 4.4Å; K85-V97 HydrophobicContact CD-CG1 4.41Å; K85-V97 WeakPolarHBondContact CE-O 3.29Å; K85-V97 HydrophobicContact CG-CB 3.93Å; K85-V97 HydrophobicContact CG-CG1 3.74Å; K85-V97 PolarHBondContact NZ-O 2.69Å; K85-M116 HydrophobicContact CG-CE 4.26Å
86	D	97.8	Very high	97.2	Very high	110 Å²	110	51.9 Å²	51.9	59%	0.588	28%	0.277	S	S	*	.	H	α-helix	trans	-63.1	-41	-179.2	-63.5	-25.2	0	0	0	111.3	A82 K83 S90	A82-D86 PolarHBondContact O-N 2.92Å; K83-D86 PolarHBondContact O-N 2.96Å; D86-S90 WeakPolarHBondContact O-CB 3.46Å; D86-S90 PolarHBondContact O-N 3.45Å
87	I	98.2	Very high	97.2	Very high	18 Å²	18	52.4 Å²	52.4	9%	0.092	28%	0.28	C	S	.	.	H	α-helix	trans	-62.8	-48.4	172.9	-63.1	162.6	0	0	0	110.7	K83 V84 K85 Y89 S90 L91 A133 L134 S137 I139	K83-I87 WeakPolarHBondContact O-CD1 3.41Å; K83-I87 WeakPolarHBondContact O-CG1 3.49Å; K83-I87 PolarHBondContact O-N 3.47Å; V84-I87 PolarHBondContact O-N 2.95Å; K85-I87 VanDerWaalsContact C-N 3.33Å; K85-I87 PolarHBondContact O-N 3.08Å; I87-Y89 PolarHBondContact O-N 2.99Å; I87-S90 WeakPolarHBondContact O-CB 3.11Å; I87-S90 PolarHBondContact O-N 2.87Å; I87-S90 VanDerWaalsContact O-N 3.16Å; I87-S90 PolarHBondContact O-OG 2.88Å; I87-L91 PolarHBondContact O-N 2.66Å; I87-A133 HydrophobicContact CG2-CB 3.79Å; I87-L134 HydrophobicContact CD1-CD2 3.99Å; I87-L134 HydrophobicContact CG2-CD2 4.36Å; I87-S137 VanDerWaalsContact CD1-CB 3.48Å; I87-S137 VanDerWaalsContact CD1-OG 3.23Å; I87-S137 WeakPolarHBondContact CD1-OG 3.31Å; I87-I139 HydrophobicContact CD1-CD1 3.52Å; I87-I139 HydrophobicContact CD1-CG1 3.95Å; I87-I139 HydrophobicContact CD1-CG2 4.29Å
88	V	98.1	Very high	97.1	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-64.2	-40.4	-178.1	169.7	0	0	0	0	112.1	V84 K85 S90 L91 W92 C95 V97 I118 L130	V84-V88 HydrophobicContact CG1-CG2 4.3Å; V84-V88 WeakPolarHBondContact O-CB 3.41Å; V84-V88 VanDerWaalsContact O-CG2 3.26Å; V84-V88 WeakPolarHBondContact O-CG2 3.38Å; V84-V88 PolarHBondContact O-N 3.47Å; K85-V88 PolarHBondContact O-N 2.84Å; V88-S90 VanDerWaalsContact C-N 3.33Å; V88-L91 PolarHBondContact O-N 3.16Å; V88-W92 HydrophobicContact CG1-CE3 4.25Å; V88-W92 PolarHBondContact O-N 3.31Å; V88-C95 VanDerWaalsContact CG1-SG 3.6Å; V88-V97 HydrophobicContact CB-CG2 4.17Å; V88-V97 HydrophobicContact CG1-CG2 3.45Å; V88-V97 VanDerWaalsContact CG1-CG2 3.45Å; V88-I118 HydrophobicContact CB-CD1 4.41Å; V88-I118 HydrophobicContact CG1-CD1 3.75Å; V88-I118 HydrophobicContact CG1-CG1 4.13Å; V88-I118 HydrophobicContact CG1-CG2 3.92Å; V88-I118 HydrophobicContact CG2-CD1 3.66Å; V88-I118 HydrophobicContact CG2-CG1 4.48Å; V88-L130 HydrophobicContact CG2-CD1 3.76Å
89	Y	98.1	Very high	97.1	Very high	84 Å²	84	50.7 Å²	50.7	33%	0.329	28%	0.275	S	S	.	.	H	α-helix	trans	-71.6	-25.6	175	-65.7	-48.5	0	0	0	112.8	K85 I87 L91 P93 V97	K85-Y89 HydrophobicContact CB-CD2 4.18Å; K85-Y89 HydrophobicContact CB-CE2 3.94Å; K85-Y89 HydrophobicContact CD-CE2 4.44Å; K85-Y89 HydrophobicContact CG-CE2 4.25Å; K85-Y89 WeakPolarHBondContact O-CB 3.48Å; K85-Y89 WeakPolarHBondContact O-CD2 3.26Å; K85-Y89 PolarHBondContact O-N 3.2Å; I87-Y89 PolarHBondContact O-N 2.99Å; Y89-L91 VanDerWaalsContact C-N 3.29Å; Y89-L91 PolarHBondContact O-N 3.44Å; Y89-P93 WeakPolarHBondContact O-CA 3.46Å; Y89-P93 WeakPolarHBondContact O-CD 3.45Å; Y89-P93 WeakPolarHBondContact O-CG 3.47Å; Y89-V97 HydrophobicContact CE1-CG2 3.88Å; Y89-V97 PolarHBondContact OH-N 3.25Å
90	S	97.5	Very high	96.9	Very high	91 Å²	91	50.3 Å²	50.3	64%	0.636	27%	0.271	S	S	*	.	H	α-helix	trans	-67.3	-28.4	170.9	81.6	0	0	0	0	113.1	D86 I87 V88	D86-S90 WeakPolarHBondContact O-CB 3.46Å; D86-S90 PolarHBondContact O-N 3.45Å; I87-S90 WeakPolarHBondContact O-CB 3.11Å; I87-S90 PolarHBondContact O-N 2.87Å; I87-S90 VanDerWaalsContact O-N 3.16Å; I87-S90 PolarHBondContact O-OG 2.88Å; V88-S90 VanDerWaalsContact C-N 3.33Å
91	L	97.4	Very high	96.6	Very high	55 Å²	55	51.2 Å²	51.2	29%	0.288	28%	0.28	S	S	.	.	H	α-helix	trans	-83.1	-46.8	173.3	-63.8	178.9	0	0	0	112.4	I87 V88 Y89 L130 A133	I87-L91 PolarHBondContact O-N 2.66Å; V88-L91 PolarHBondContact O-N 3.16Å; Y89-L91 VanDerWaalsContact C-N 3.29Å; Y89-L91 PolarHBondContact O-N 3.44Å; L91-L130 HydrophobicContact CD1-CD1 4.47Å; L91-A133 HydrophobicContact CD1-CB 3.66Å; L91-A133 HydrophobicContact CD2-CB 3.91Å; L91-A133 HydrophobicContact CG-CB 4.04Å
92	W	97.3	Very high	96.4	Very high	45 Å²	45	51.2 Å²	51.2	17%	0.17	28%	0.281	C	S	.	.			trans	-135	79.1	-170.4	-55.1	-55.4	0	0	0	111	V88 N94 C95 I118 W122 P126 T129 L130 F169	V88-W92 HydrophobicContact CG1-CE3 4.25Å; V88-W92 PolarHBondContact O-N 3.31Å; W92-N94 PolarHBondContact O-N 3.47Å; W92-C95 HydrophobicContact CB-CB 3.93Å; W92-C95 WeakPolarHBondContact O-CB 3.39Å; W92-C95 PolarHBondContact O-N 3Å; W92-C95 PolarHBondContact O-SG 3.18Å; W92-I118 HydrophobicContact CZ3-CD1 4.45Å; W92-W122 AromaticContact CD1-NE1 3.65Å; W92-W122 AromaticContact CD2-CZ2 4Å; W92-W122 HydrophobicContact CD2-CZ2 4Å; W92-W122 AromaticContact CD2-NE1 3.77Å; W92-W122 AromaticContact CE2-NE1 3.55Å; W92-W122 HydrophobicContact CE3-CZ2 4.05Å; W92-W122 HydrophobicContact CG-CZ2 4.26Å; W92-W122 AromaticContact CG-NE1 3.87Å; W92-W122 AromaticContact NE1-NE1 3.42Å; W92-P126 HydrophobicContact CH2-CB 3.82Å; W92-P126 HydrophobicContact CH2-CG 3.51Å; W92-P126 HydrophobicContact CZ2-CB 3.54Å; W92-P126 HydrophobicContact CZ2-CG 3.51Å; W92-P126 HydrophobicContact CZ3-CG 4.26Å; W92-T129 HydrophobicContact CH2-CG2 4.44Å; W92-T129 HydrophobicContact CZ2-CG2 3.85Å; W92-L130 HydrophobicContact CH2-CB 4.16Å; W92-L130 HydrophobicContact CZ3-CB 4.44Å; W92-F169 HydrophobicContact CH2-CE1 4.35Å; W92-F169 HydrophobicContact CH2-CZ 4.31Å; W92-F169 HydrophobicContact CZ3-CE1 4.01Å; W92-F169 HydrophobicContact CZ3-CZ 4.12Å
93	P	96.1	Very high	96.2	Very high	97 Å²	97	49.9 Å²	49.9	63%	0.63	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-23.7	-177.8	-27.1	34.2	0	0	0	115	Y89	Y89-P93 WeakPolarHBondContact O-CA 3.46Å; Y89-P93 WeakPolarHBondContact O-CD 3.45Å; Y89-P93 WeakPolarHBondContact O-CG 3.47Å
94	N	95.2	Very high	96.1	Very high	163 Å²	163	50.6 Å²	50.6	87%	0.872	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	4.8	-178.9	-62.9	-36.6	0	0	0	114.1	W92	W92-N94 PolarHBondContact O-N 3.47Å
95	C	96.3	Very high	95.8	Very high	12 Å²	12	51 Å²	51	8%	0.081	27%	0.272	C	S	.	.			trans	-79.7	171.8	174.4	79.9	0	0	0	0	111.6	V88 W92 I118 F119	V88-C95 VanDerWaalsContact CG1-SG 3.6Å; W92-C95 HydrophobicContact CB-CB 3.93Å; W92-C95 WeakPolarHBondContact O-CB 3.39Å; W92-C95 PolarHBondContact O-N 3Å; W92-C95 PolarHBondContact O-SG 3.18Å; C95-I118 HydrophobicContact CB-CG2 4.01Å; C95-F119 VanDerWaalsContact CA-O 3.31Å; C95-F119 WeakPolarHBondContact CA-O 3.44Å; C95-F119 VanDerWaalsContact CB-O 3.29Å; C95-F119 WeakPolarHBondContact CB-O 3.19Å
96	Q	95.7	Very high	95.6	Very high	140 Å²	140	50.1 Å²	50.1	65%	0.654	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.8	132.1	169.3	-61.9	-179.5	-6.3	0	0	109.7	F119	Q96-F119 HydrophobicContact CB-CB 4.32Å; Q96-F119 PolarHBondContact N-O 3.38Å; Q96-F119 PolarHBondContact O-N 3.47Å
97	V	96.7	Very high	95.5	Very high	10 Å²	10	45 Å²	45	6%	0.061	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	120.4	-179.3	-171	0	0	0	0	110.7	K85 V88 Y89 M116 V117 I118	K85-V97 HydrophobicContact CD-CB 4.4Å; K85-V97 HydrophobicContact CD-CG1 4.41Å; K85-V97 WeakPolarHBondContact CE-O 3.29Å; K85-V97 HydrophobicContact CG-CB 3.93Å; K85-V97 HydrophobicContact CG-CG1 3.74Å; K85-V97 PolarHBondContact NZ-O 2.69Å; V88-V97 HydrophobicContact CB-CG2 4.17Å; V88-V97 HydrophobicContact CG1-CG2 3.45Å; V88-V97 VanDerWaalsContact CG1-CG2 3.45Å; Y89-V97 HydrophobicContact CE1-CG2 3.88Å; Y89-V97 PolarHBondContact OH-N 3.25Å; V97-M116 HydrophobicContact CG1-CE 3.56Å; V97-V117 WeakPolarHBondContact CA-O 3.05Å; V97-I118 HydrophobicContact CG2-CG1 4.41Å; V97-I118 HydrophobicContact CG2-CG2 4.32Å
98	D	95.2	Very high	95.4	Very high	46 Å²	46	44.1 Å²	44.1	25%	0.246	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	159.4	174.8	-159.7	9.4	0	0	0	111.8	K104 V117	D98-K104 IonicContact OD1-NZ 3.66Å; D98-K104 PolarHBondContact OD1-NZ 3.05Å; D98-K104 WeakPolarHBondContact OD2-CE 3.24Å; D98-K104 IonicContact OD2-NZ 3.99Å; D98-K104 PolarHBondContact OD2-NZ 3.25Å; D98-V117 HydrophobicContact CB-CG1 4.35Å; D98-V117 PolarHBondContact N-O 2.86Å; D98-V117 PolarHBondContact O-N 3.41Å
99	V	95.5	Very high	95.3	Very high	16 Å²	16	44.3 Å²	44.3	10%	0.097	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	146.3	171.6	-51.7	0	0	0	0	109.4	V81 F103 K104 D115 M116	V81-V99 HydrophobicContact CB-CG1 4.42Å; V81-V99 HydrophobicContact CG1-CG1 3.7Å; V81-V99 HydrophobicContact CG2-CG1 3.75Å; V99-F103 HydrophobicContact CB-CD1 3.97Å; V99-F103 HydrophobicContact CG1-CD1 4.17Å; V99-F103 HydrophobicContact CG1-CE1 4.33Å; V99-F103 HydrophobicContact CG2-CD1 3.78Å; V99-F103 HydrophobicContact CG2-CE1 4.16Å; V99-K104 HydrophobicContact CG2-CB 4.29Å; V99-K104 HydrophobicContact CG2-CD 3.95Å; V99-K104 WeakPolarHBondContact O-CD 3.29Å; V99-K104 WeakPolarHBondContact O-CE 3.33Å; V99-K104 WeakPolarHBondContact O-CG 3.39Å; V99-D115 CarbonylContact C-O 3.19Å; V99-D115 VanDerWaalsContact CA-O 3.29Å; V99-D115 WeakPolarHBondContact CA-O 3.21Å; V99-M116 HydrophobicContact CG1-CG 4.25Å
100	F	92.7	Very high	95.1	Very high	25 Å²	25	40.8 Å²	40.8	11%	0.11	23%	0.234	C	C	.	.			trans	-128.4	-160.8	179.1	67.2	-94.6	0	0	0	112.1	K104 D115 M116 V117 S168 V175	F100-K104 VanDerWaalsContact O-CB 3.25Å; F100-K104 WeakPolarHBondContact O-CB 3.4Å; F100-K104 PolarHBondContact O-N 2.92Å; F100-K104 VanDerWaalsContact O-N 3.09Å; F100-D115 HydrophobicContact CD1-CB 4.05Å; F100-D115 HydrophobicContact CD2-CB 3.58Å; F100-D115 HydrophobicContact CE1-CB 4.08Å; F100-D115 HydrophobicContact CE2-CB 3.62Å; F100-D115 HydrophobicContact CG-CB 3.81Å; F100-D115 HydrophobicContact CZ-CB 3.88Å; F100-D115 PolarHBondContact N-O 3.44Å; F100-M116 VanDerWaalsContact CE1-C 3.49Å; F100-M116 WeakPolarHBondContact CE1-O 3.41Å; F100-V117 HydrophobicContact CD1-CB 3.84Å; F100-V117 HydrophobicContact CD1-CG1 3.89Å; F100-V117 HydrophobicContact CE1-CB 3.88Å; F100-V117 HydrophobicContact CE1-CG1 4.45Å; F100-S168 WeakPolarHBondContact CE1-OG 3.49Å; F100-V175 HydrophobicContact CB-CG2 4.48Å
101	G	91.8	Very high	94.8	Very high	20 Å²	20	38.1 Å²	38.1	21%	0.206	21%	0.214	C	C	.	.	H	α-helix	trans	61.4	-134.9	162.9	0	0	0	0	0	114.4	T105 D115	G101-T105 WeakPolarHBondContact O-CG2 3.21Å; G101-T105 PolarHBondContact O-N 2.89Å; G101-T105 PolarHBondContact O-OG1 2.73Å; G101-D115 WeakPolarHBondContact CA-OD2 3.48Å
102	S	93	Very high	94.7	Very high	13 Å²	13	36.7 Å²	36.7	9%	0.091	21%	0.209	C	C	.	.	H	α-helix	trans	-72.3	-34.2	-170.9	69.9	0	0	0	0	112.6	T105 G106 L107 Y108 D115	S102-T105 PolarHBondContact O-OG1 2.66Å; S102-T105 VanDerWaalsContact O-OG1 3.13Å; S102-G106 PolarHBondContact O-N 2.96Å; S102-L107 PolarHBondContact O-N 3.38Å; S102-L107 VanDerWaalsContact O-N 3.08Å; S102-Y108 PolarHBondContact O-N 2.86Å; S102-Y108 WeakPolarHBondContact OG-CB 3.23Å; S102-D115 PolarHBondContact N-OD2 3.22Å
103	F	94.8	Very high	94.6	Very high	16 Å²	16	36.2 Å²	36.2	7%	0.07	21%	0.209	C	C	.	.	H	α-helix	trans	-69.2	-50.7	177.6	-174.5	-132.4	0	0	0	111.5	R77 E78 V81 V99 T105 G106 Y108 I114	R77-F103 HydrophobicContact CB-CD2 4.19Å; R77-F103 HydrophobicContact CB-CE1 4.18Å; R77-F103 HydrophobicContact CB-CE2 3.47Å; R77-F103 VanDerWaalsContact CB-CE2 3.47Å; R77-F103 HydrophobicContact CB-CZ 3.47Å; R77-F103 VanDerWaalsContact CB-CZ 3.47Å; R77-F103 HydrophobicContact CG-CE2 4.19Å; E78-F103 HydrophobicContact CG-CZ 4.23Å; V81-F103 HydrophobicContact CG2-CE1 4.11Å; V99-F103 HydrophobicContact CB-CD1 3.97Å; V99-F103 HydrophobicContact CG1-CD1 4.17Å; V99-F103 HydrophobicContact CG1-CE1 4.33Å; V99-F103 HydrophobicContact CG2-CD1 3.78Å; V99-F103 HydrophobicContact CG2-CE1 4.16Å; F103-T105 PolarHBondContact O-N 2.69Å; F103-T105 VanDerWaalsContact O-N 3.13Å; F103-G106 PolarHBondContact O-N 2.9Å; F103-G106 VanDerWaalsContact O-N 3.09Å; F103-Y108 AromaticContact CD2-CD1 3.95Å; F103-Y108 HydrophobicContact CD2-CD1 3.95Å; F103-Y108 AromaticContact CD2-CE1 3.55Å; F103-Y108 HydrophobicContact CD2-CE1 3.55Å; F103-Y108 HydrophobicContact CE2-CE1 4.04Å; F103-I114 HydrophobicContact CD1-CG2 4.13Å
104	K	93.4	Very high	94.7	Very high	49 Å²	49	31.6 Å²	31.6	21%	0.213	18%	0.179	C	C	.	.	H	α-helix	trans	-60.4	-25.2	178.9	-171.3	69.7	151.1	-162.8	0	114	D98 V99 F100 A178 R182	D98-K104 IonicContact OD1-NZ 3.66Å; D98-K104 PolarHBondContact OD1-NZ 3.05Å; D98-K104 WeakPolarHBondContact OD2-CE 3.24Å; D98-K104 IonicContact OD2-NZ 3.99Å; D98-K104 PolarHBondContact OD2-NZ 3.25Å; V99-K104 HydrophobicContact CG2-CB 4.29Å; V99-K104 HydrophobicContact CG2-CD 3.95Å; V99-K104 WeakPolarHBondContact O-CD 3.29Å; V99-K104 WeakPolarHBondContact O-CE 3.33Å; V99-K104 WeakPolarHBondContact O-CG 3.39Å; F100-K104 VanDerWaalsContact O-CB 3.25Å; F100-K104 WeakPolarHBondContact O-CB 3.4Å; F100-K104 PolarHBondContact O-N 2.92Å; F100-K104 VanDerWaalsContact O-N 3.09Å; K104-A178 HydrophobicContact CB-CB 4.01Å; K104-A178 HydrophobicContact CG-CB 3.65Å; K104-R182 PolarHBondContact O-NE 3.04Å; K104-R182 VanDerWaalsContact O-NE 3.16Å; K104-R182 PolarHBondContact O-NH2 3.06Å
105	T	93.3	Very high	94.7	Very high	10 Å²	10	25.5 Å²	25.5	6%	0.061	15%	0.147	C	C	.	.	H	α-helix	trans	-94.2	-12	178.9	51.6	0	0	0	0	114.1	G101 S102 F103 L107 A178 I181	G101-T105 WeakPolarHBondContact O-CG2 3.21Å; G101-T105 PolarHBondContact O-N 2.89Å; G101-T105 PolarHBondContact O-OG1 2.73Å; S102-T105 PolarHBondContact O-OG1 2.66Å; S102-T105 VanDerWaalsContact O-OG1 3.13Å; F103-T105 PolarHBondContact O-N 2.69Å; F103-T105 VanDerWaalsContact O-N 3.13Å; T105-L107 PolarHBondContact O-N 2.87Å; T105-A178 HydrophobicContact CG2-CB 3.92Å; T105-I181 HydrophobicContact CG2-CB 3.79Å; T105-I181 HydrophobicContact CG2-CD1 4.02Å; T105-I181 HydrophobicContact CG2-CG2 3.66Å
106	G	94	Very high	94.8	Very high	32 Å²	32	25 Å²	25	33%	0.33	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.2	16	-171.8	0	0	0	0	0	113.9	S102 F103	S102-G106 PolarHBondContact O-N 2.96Å; F103-G106 PolarHBondContact O-N 2.9Å; F103-G106 VanDerWaalsContact O-N 3.09Å
107	L	95.6	Very high	94.9	Very high	2 Å²	2	18.3 Å²	18.3	1%	0.01	11%	0.112	C	C	.	.			trans	-107.9	35.9	-179.5	-61	-179.1	0	0	0	111.5	S102 T105 I181 M185 P192 V195 F196 K199 I221	S102-L107 PolarHBondContact O-N 3.38Å; S102-L107 VanDerWaalsContact O-N 3.08Å; T105-L107 PolarHBondContact O-N 2.87Å; L107-I181 HydrophobicContact CD1-CG2 3.79Å; L107-M185 HydrophobicContact CD1-CG 4.41Å; L107-M185 HydrophobicContact CD1-SD 3.77Å; L107-M185 HydrophobicContact CD2-CE 3.98Å; L107-M185 HydrophobicContact CD2-SD 4.29Å; L107-M185 HydrophobicContact CG-CE 4.19Å; L107-M185 HydrophobicContact CG-SD 3.99Å; L107-P192 HydrophobicContact CD2-CB 3.82Å; L107-P192 HydrophobicContact CD2-CG 4.17Å; L107-V195 HydrophobicContact CD1-CG1 4.28Å; L107-F196 HydrophobicContact CD2-CD2 4.43Å; L107-F196 HydrophobicContact CD2-CE2 3.83Å; L107-F196 HydrophobicContact CD2-CZ 4.35Å; L107-K199 PolarHBondContact O-NZ 3.22Å; L107-I221 HydrophobicContact CD1-CD1 4.07Å
108	Y	96.3	Very high	94.9	Very high	1 Å²	1	17.9 Å²	17.9	0%	0.004	11%	0.109	C	C	.	.			trans	-93.5	136.6	178.7	65.4	-93.6	0	0	0	111.1	P69 Q74 S102 F103 F196	P69-Y108 HydrophobicContact CB-CE1 3.78Å; P69-Y108 HydrophobicContact CB-CE2 3.98Å; P69-Y108 VanDerWaalsContact CB-CZ 3.49Å; P69-Y108 HydrophobicContact CG-CD1 3.72Å; P69-Y108 HydrophobicContact CG-CD2 4.09Å; P69-Y108 HydrophobicContact CG-CE1 3.41Å; P69-Y108 VanDerWaalsContact CG-CE1 3.41Å; P69-Y108 HydrophobicContact CG-CE2 3.79Å; P69-Y108 HydrophobicContact CG-CG 4.09Å; P69-Y108 VanDerWaalsContact CG-CZ 3.49Å; Q74-Y108 WeakPolarHBondContact CA-OH 3.37Å; Q74-Y108 PolarHBondContact N-OH 2.94Å; Q74-Y108 PolarHBondContact OE1-OH 3.22Å; S102-Y108 PolarHBondContact O-N 2.86Å; S102-Y108 WeakPolarHBondContact OG-CB 3.23Å; F103-Y108 AromaticContact CD2-CD1 3.95Å; F103-Y108 HydrophobicContact CD2-CD1 3.95Å; F103-Y108 AromaticContact CD2-CE1 3.55Å; F103-Y108 HydrophobicContact CD2-CE1 3.55Å; F103-Y108 HydrophobicContact CE2-CE1 4.04Å; Y108-F196 WeakPolarHBondContact O-CE1 3.25Å
109	L	95.3	Very high	95	Very high	4 Å²	4	17.8 Å²	17.8	2%	0.021	11%	0.107	C	C	.	.			trans	-73.6	156	166	-66.1	173.8	0	0	0	108.4	I67 T111 S112 F196 K199 Q200 L203	I67-L109 HydrophobicContact CD1-CD2 4.19Å; I67-L109 HydrophobicContact CG1-CD2 3.63Å; L109-T111 PolarHBondContact O-N 3.42Å; L109-S112 PolarHBondContact N-OG 2.86Å; L109-S112 VanDerWaalsContact N-OG 3.1Å; L109-S112 VanDerWaalsContact O-CB 3.29Å; L109-S112 WeakPolarHBondContact O-CB 3.19Å; L109-S112 PolarHBondContact O-N 3.42Å; L109-S112 PolarHBondContact O-OG 3.32Å; L109-F196 HydrophobicContact CD2-CD1 3.99Å; L109-K199 HydrophobicContact CD1-CB 3.9Å; L109-K199 HydrophobicContact CD2-CB 4.5Å; L109-K199 HydrophobicContact CG-CB 4.23Å; L109-Q200 HydrophobicContact CD2-CB 4.47Å; L109-L203 HydrophobicContact CD1-CB 4.38Å; L109-L203 HydrophobicContact CD1-CD2 3.63Å
110	P	93.6	Very high	95	Very high	9 Å²	9	18.1 Å²	18.1	6%	0.058	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.7	-39.3	-175.7	-32.1	38.2	0	0	0	114.2	I67 E73 R77 F358 R359	I67-P110 HydrophobicContact CD1-CG 4.08Å; E73-P110 WeakPolarHBondContact OE1-CB 3.45Å; R77-P110 PolarHBondContact NH2-O 2.68Å; P110-F358 VanDerWaalsContact O-CE1 3.31Å; P110-F358 WeakPolarHBondContact O-CE1 3.45Å; P110-R359 HydrophobicContact CB-CG 3.79Å; P110-R359 HydrophobicContact CG-CG 4.21Å; P110-R359 VanDerWaalsContact CG-NE 3.3Å
111	T	91.8	Very high	95	Very high	35 Å²	35	26.7 Å²	26.7	22%	0.215	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	4.1	-179.2	52.5	0	0	0	0	115	L109 R164 F358	L109-T111 PolarHBondContact O-N 3.42Å; T111-R164 PolarHBondContact O-NH2 3.43Å; T111-F358 HydrophobicContact CG2-CD1 3.92Å; T111-F358 HydrophobicContact CG2-CE1 4.45Å; T111-F358 HydrophobicContact CG2-CG 4.27Å
112	S	95.2	Very high	95.1	Very high	26 Å²	26	28.5 Å²	28.5	18%	0.182	15%	0.151	C	C	.	.			trans	-70	149.3	178.5	-64.9	0	0	0	0	112.8	R77 L109	R77-S112 VanDerWaalsContact CZ-O 3.24Å; R77-S112 PolarHBondContact NH1-O 2.98Å; R77-S112 PolarHBondContact NH2-O 2.95Å; L109-S112 PolarHBondContact N-OG 2.86Å; L109-S112 VanDerWaalsContact N-OG 3.1Å; L109-S112 VanDerWaalsContact O-CB 3.29Å; L109-S112 WeakPolarHBondContact O-CB 3.19Å; L109-S112 PolarHBondContact O-N 3.42Å; L109-S112 PolarHBondContact O-OG 3.32Å
113	D	95.4	Very high	95	Very high	35 Å²	35	36.7 Å²	36.7	19%	0.187	19%	0.194	C	C	.	.			trans	-65.9	164.3	179.5	-54.2	41.8	0	0	0	111.6	R77 K155 R164	R77-D113 PolarHBondContact NH1-O 3.14Å; D113-K155 IonicContact OD2-NZ 3.73Å; D113-R164 CarbonylContact C-O 3.22Å; D113-R164 WeakPolarHBondContact CA-O 3.26Å; D113-R164 HydrophobicContact CB-CB 4.19Å; D113-R164 IonicContact OD1-CZ 3.88Å; D113-R164 VanDerWaalsContact OD1-CZ 3.31Å; D113-R164 IonicContact OD1-NE 3.7Å; D113-R164 PolarHBondContact OD1-NE 3.23Å; D113-R164 VanDerWaalsContact OD1-NE 3.15Å; D113-R164 IonicContact OD1-NH2 3.73Å; D113-R164 PolarHBondContact OD1-NH2 3.22Å; D113-R164 WeakPolarHBondContact OD2-CB 3.45Å; D113-R164 IonicContact OD2-CZ 2.85Å; D113-R164 IonicContact OD2-NE 3.72Å; D113-R164 PolarHBondContact OD2-NE 2.97Å; D113-R164 IonicContact OD2-NH2 3.91Å
114	I	97.3	Very high	94.9	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	110.1	172.1	-55.4	178.5	0	0	0	108.7	R77 V80 V81 F103 M116 L163 R164 V165 D166	R77-I114 HydrophobicContact CB-CD1 3.94Å; R77-I114 HydrophobicContact CG-CD1 3.87Å; R77-I114 HydrophobicContact CG-CG1 4.18Å; V80-I114 HydrophobicContact CB-CD1 4.08Å; V80-I114 HydrophobicContact CG1-CD1 3.96Å; V81-I114 HydrophobicContact CG2-CD1 4.48Å; V81-I114 HydrophobicContact CG2-CG2 3.66Å; F103-I114 HydrophobicContact CD1-CG2 4.13Å; I114-M116 HydrophobicContact CG2-CG 4.01Å; I114-M116 HydrophobicContact CG2-SD 4.47Å; I114-M116 PolarHBondContact O-N 3.27Å; I114-L163 HydrophobicContact CD1-CB 4.34Å; I114-L163 HydrophobicContact CD1-CD1 4.39Å; I114-R164 PolarHBondContact N-O 3.31Å; I114-V165 HydrophobicContact CB-CB 4.47Å; I114-V165 HydrophobicContact CB-CG1 4.19Å; I114-V165 HydrophobicContact CB-CG2 4.28Å; I114-V165 HydrophobicContact CD1-CG2 4.31Å; I114-V165 HydrophobicContact CG2-CG1 4.43Å; I114-V165 WeakPolarHBondContact O-CA 3.46Å; I114-V165 WeakPolarHBondContact O-CG1 3.44Å; I114-D166 PolarHBondContact O-N 2.8Å
115	D	96.8	Very high	95	Very high	34 Å²	34	41 Å²	41	18%	0.182	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	115.4	177.9	-52.8	-77.3	0	0	0	111.3	V99 F100 G101 S102	V99-D115 CarbonylContact C-O 3.19Å; V99-D115 VanDerWaalsContact CA-O 3.29Å; V99-D115 WeakPolarHBondContact CA-O 3.21Å; F100-D115 HydrophobicContact CD1-CB 4.05Å; F100-D115 HydrophobicContact CD2-CB 3.58Å; F100-D115 HydrophobicContact CE1-CB 4.08Å; F100-D115 HydrophobicContact CE2-CB 3.62Å; F100-D115 HydrophobicContact CG-CB 3.81Å; F100-D115 HydrophobicContact CZ-CB 3.88Å; F100-D115 PolarHBondContact N-O 3.44Å; G101-D115 WeakPolarHBondContact CA-OD2 3.48Å; S102-D115 PolarHBondContact N-OD2 3.22Å
116	M	97.7	Very high	95.1	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.005	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	140.7	-179.8	-66.6	-168.5	63.9	0	0	113.1	V81 V84 K85 V97 V99 F100 I114 V165 D166 I167 S168	V81-M116 HydrophobicContact CG1-CE 4.16Å; V81-M116 HydrophobicContact CG2-SD 4.04Å; V84-M116 HydrophobicContact CB-CE 4.06Å; V84-M116 HydrophobicContact CB-SD 4.06Å; V84-M116 HydrophobicContact CG1-CE 3.7Å; V84-M116 HydrophobicContact CG1-SD 3.83Å; V84-M116 HydrophobicContact CG2-SD 4.5Å; K85-M116 HydrophobicContact CG-CE 4.26Å; V97-M116 HydrophobicContact CG1-CE 3.56Å; V99-M116 HydrophobicContact CG1-CG 4.25Å; F100-M116 VanDerWaalsContact CE1-C 3.49Å; F100-M116 WeakPolarHBondContact CE1-O 3.41Å; I114-M116 HydrophobicContact CG2-CG 4.01Å; I114-M116 HydrophobicContact CG2-SD 4.47Å; I114-M116 PolarHBondContact O-N 3.27Å; M116-V165 HydrophobicContact CB-CG1 4.35Å; M116-V165 HydrophobicContact CG-CG1 3.79Å; M116-V165 HydrophobicContact SD-CG1 3.54Å; M116-V165 VanDerWaalsContact SD-CG1 3.54Å; M116-D166 PolarHBondContact N-O 2.81Å; M116-I167 HydrophobicContact CB-CG1 4.29Å; M116-I167 WeakPolarHBondContact O-CA 3.28Å; M116-S168 PolarHBondContact O-N 3.05Å; M116-S168 PolarHBondContact O-OG 3.38Å; M116-S168 VanDerWaalsContact O-OG 3.08Å
117	V	97.1	Very high	95.3	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	132.9	175.7	61.4	0	0	0	0	111.5	V97 D98 F100 F119 S168 M171 V175	V97-V117 WeakPolarHBondContact CA-O 3.05Å; D98-V117 HydrophobicContact CB-CG1 4.35Å; D98-V117 PolarHBondContact N-O 2.86Å; D98-V117 PolarHBondContact O-N 3.41Å; F100-V117 HydrophobicContact CD1-CB 3.84Å; F100-V117 HydrophobicContact CD1-CG1 3.89Å; F100-V117 HydrophobicContact CE1-CB 3.88Å; F100-V117 HydrophobicContact CE1-CG1 4.45Å; V117-F119 HydrophobicContact CB-CE2 4.3Å; V117-F119 HydrophobicContact CB-CZ 4.38Å; V117-F119 HydrophobicContact CG1-CD2 4.31Å; V117-F119 HydrophobicContact CG1-CE2 3.47Å; V117-F119 VanDerWaalsContact CG1-CE2 3.47Å; V117-F119 HydrophobicContact CG1-CZ 3.79Å; V117-F119 HydrophobicContact CG2-CD1 4.46Å; V117-F119 HydrophobicContact CG2-CD2 4.34Å; V117-F119 HydrophobicContact CG2-CE1 3.96Å; V117-F119 HydrophobicContact CG2-CE2 3.85Å; V117-F119 HydrophobicContact CG2-CZ 3.62Å; V117-S168 WeakPolarHBondContact CA-O 3.26Å; V117-M171 HydrophobicContact CG2-CB 4.02Å; V117-V175 HydrophobicContact CG1-CG2 3.83Å
118	I	97.6	Very high	95.3	Very high	1 Å²	1	45 Å²	45	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	123.7	172.7	-48.6	173.8	0	0	0	108.3	V88 W92 C95 V97 W122 L130 I167 S168 F169 N170	V88-I118 HydrophobicContact CB-CD1 4.41Å; V88-I118 HydrophobicContact CG1-CD1 3.75Å; V88-I118 HydrophobicContact CG1-CG1 4.13Å; V88-I118 HydrophobicContact CG1-CG2 3.92Å; V88-I118 HydrophobicContact CG2-CD1 3.66Å; V88-I118 HydrophobicContact CG2-CG1 4.48Å; W92-I118 HydrophobicContact CZ3-CD1 4.45Å; C95-I118 HydrophobicContact CB-CG2 4.01Å; V97-I118 HydrophobicContact CG2-CG1 4.41Å; V97-I118 HydrophobicContact CG2-CG2 4.32Å; I118-W122 HydrophobicContact CG2-CH2 3.8Å; I118-W122 HydrophobicContact CG2-CZ2 4.25Å; I118-L130 HydrophobicContact CD1-CD2 3.94Å; I118-I167 HydrophobicContact CD1-CG2 3.61Å; I118-I167 HydrophobicContact CG1-CG2 3.85Å; I118-S168 PolarHBondContact N-O 2.88Å; I118-F169 HydrophobicContact CB-CD1 4.05Å; I118-F169 HydrophobicContact CB-CE1 4.07Å; I118-F169 HydrophobicContact CD1-CE1 3.85Å; I118-F169 HydrophobicContact CD1-CE2 4.45Å; I118-F169 HydrophobicContact CD1-CZ 3.79Å; I118-F169 HydrophobicContact CG2-CD1 4.49Å; I118-F169 HydrophobicContact CG2-CE1 4.29Å; I118-F169 WeakPolarHBondContact O-CA 3.45Å; I118-N170 PolarHBondContact O-N 3.44Å
119	F	96.8	Very high	95.4	Very high	45 Å²	45	48.3 Å²	48.3	20%	0.197	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	133	174	-63.9	-76.7	0	0	0	111	C95 Q96 V117 N170 I172 V175	C95-F119 VanDerWaalsContact CA-O 3.31Å; C95-F119 WeakPolarHBondContact CA-O 3.44Å; C95-F119 VanDerWaalsContact CB-O 3.29Å; C95-F119 WeakPolarHBondContact CB-O 3.19Å; Q96-F119 HydrophobicContact CB-CB 4.32Å; Q96-F119 PolarHBondContact N-O 3.38Å; Q96-F119 PolarHBondContact O-N 3.47Å; V117-F119 HydrophobicContact CB-CE2 4.3Å; V117-F119 HydrophobicContact CB-CZ 4.38Å; V117-F119 HydrophobicContact CG1-CD2 4.31Å; V117-F119 HydrophobicContact CG1-CE2 3.47Å; V117-F119 VanDerWaalsContact CG1-CE2 3.47Å; V117-F119 HydrophobicContact CG1-CZ 3.79Å; V117-F119 HydrophobicContact CG2-CD1 4.46Å; V117-F119 HydrophobicContact CG2-CD2 4.34Å; V117-F119 HydrophobicContact CG2-CE1 3.96Å; V117-F119 HydrophobicContact CG2-CE2 3.85Å; V117-F119 HydrophobicContact CG2-CZ 3.62Å; F119-N170 VanDerWaalsContact CA-OD1 3.31Å; F119-N170 WeakPolarHBondContact CA-OD1 3.3Å; F119-I172 HydrophobicContact CE1-CB 4.03Å; F119-I172 HydrophobicContact CZ-CB 4.46Å; F119-V175 HydrophobicContact CE2-CG2 4.1Å; F119-V175 HydrophobicContact CZ-CG2 3.89Å
120	G	95.1	Very high	95.5	Very high	23 Å²	23	48.1 Å²	48.1	24%	0.237	26%	0.261	C	S	.	.			trans	178.1	-177.7	-178.8	0	0	0	0	0	113.3	W122 N170	G120-W122 VanDerWaalsContact CA-CH2 3.4Å; G120-W122 WeakPolarHBondContact O-CZ3 3.41Å; G120-N170 PolarHBondContact N-OD1 2.93Å; G120-N170 PolarHBondContact O-ND2 3.04Å; G120-N170 PolarHBondContact O-OD1 3.07Å
121	K	93.7	Very high	95.7	Very high	205 Å²	205	50.2 Å²	50.2	89%	0.891	27%	0.27	S	S	*	.			trans	-114	117.9	-177.9	-62.3	-177.8	-179.5	-177.9	0	109.4
122	W	93.5	Very high	96	Very high	58 Å²	58	53.6 Å²	53.6	22%	0.22	28%	0.283	C	S	.	.			trans	-147.6	142.9	174.4	-49	-89.8	0	0	0	107.8	W92 I118 G120 A124 P126 F169	W92-W122 AromaticContact CD1-NE1 3.65Å; W92-W122 AromaticContact CD2-CZ2 4Å; W92-W122 HydrophobicContact CD2-CZ2 4Å; W92-W122 AromaticContact CD2-NE1 3.77Å; W92-W122 AromaticContact CE2-NE1 3.55Å; W92-W122 HydrophobicContact CE3-CZ2 4.05Å; W92-W122 HydrophobicContact CG-CZ2 4.26Å; W92-W122 AromaticContact CG-NE1 3.87Å; W92-W122 AromaticContact NE1-NE1 3.42Å; I118-W122 HydrophobicContact CG2-CH2 3.8Å; I118-W122 HydrophobicContact CG2-CZ2 4.25Å; G120-W122 VanDerWaalsContact CA-CH2 3.4Å; G120-W122 WeakPolarHBondContact O-CZ3 3.41Å; W122-A124 VanDerWaalsContact C-N 3.27Å; W122-A124 WeakPolarHBondContact CB-O 3.27Å; W122-A124 PolarHBondContact O-N 3.36Å; W122-P126 HydrophobicContact CD2-CG 3.98Å; W122-P126 HydrophobicContact CG-CG 3.99Å; W122-P126 HydrophobicContact CZ2-CG 4.48Å; W122-F169 HydrophobicContact CE3-CD1 4.24Å; W122-F169 AromaticContact CH2-CD1 3.66Å; W122-F169 HydrophobicContact CH2-CD1 3.66Å; W122-F169 AromaticContact CH2-CE1 3.94Å; W122-F169 HydrophobicContact CH2-CE1 3.94Å; W122-F169 HydrophobicContact CZ2-CD1 4.29Å; W122-F169 HydrophobicContact CZ2-CE1 4.13Å; W122-F169 AromaticContact CZ3-CD1 3.64Å; W122-F169 HydrophobicContact CZ3-CD1 3.64Å; W122-F169 HydrophobicContact CZ3-CE1 4.3Å
123	D	90.5	Very high	96.1	Very high	184 Å²	184	53.1 Å²	53.1	98%	0.984	28%	0.281	S	S	*	.	S	Bend	trans	-71.8	-25	179.6	-50.5	-63.8	0	0	0	112.4
124	A	93	Very high	96.3	Very high	78 Å²	78	51.4 Å²	51.4	65%	0.645	27%	0.272	S	S	*	.	S	Bend	trans	-137.9	152.2	169	0	0	0	0	0	109.8	W122 P126	W122-A124 VanDerWaalsContact C-N 3.27Å; W122-A124 WeakPolarHBondContact CB-O 3.27Å; W122-A124 PolarHBondContact O-N 3.36Å; A124-P126 WeakPolarHBondContact O-CD 3.49Å
125	L	94.6	Very high	96.2	Very high	77 Å²	77	59 Å²	59	40%	0.403	31%	0.305	S	S	.	.			trans	-67.4	122.9	-177.6	-60.9	-175.9	0	0	0	111	L127 P152 F169	L125-L127 HydrophobicContact CB-CD2 4.46Å; L125-L127 HydrophobicContact CB-CG 4.18Å; L125-L127 PolarHBondContact O-N 2.87Å; L125-P152 HydrophobicContact CD1-CB 4.19Å; L125-P152 HydrophobicContact CD1-CG 4.08Å; L125-F169 HydrophobicContact CD2-CB 3.88Å
126	P	96.4	Very high	96.3	Very high	15 Å²	15	64.8 Å²	64.8	10%	0.097	33%	0.328	C	S	.	.			trans	-85.1	47	-168.7	37.6	-40.5	0	0	0	113	W92 W122 A124 H128 T129 L130 F169	W92-P126 HydrophobicContact CH2-CB 3.82Å; W92-P126 HydrophobicContact CH2-CG 3.51Å; W92-P126 HydrophobicContact CZ2-CB 3.54Å; W92-P126 HydrophobicContact CZ2-CG 3.51Å; W92-P126 HydrophobicContact CZ3-CG 4.26Å; W122-P126 HydrophobicContact CD2-CG 3.98Å; W122-P126 HydrophobicContact CG-CG 3.99Å; W122-P126 HydrophobicContact CZ2-CG 4.48Å; A124-P126 WeakPolarHBondContact O-CD 3.49Å; P126-H128 PolarHBondContact O-N 2.92Å; P126-T129 WeakPolarHBondContact O-CB 3.19Å; P126-T129 PolarHBondContact O-N 2.93Å; P126-T129 VanDerWaalsContact O-N 3.12Å; P126-L130 PolarHBondContact O-N 3.43Å; P126-L130 VanDerWaalsContact O-N 3.09Å; P126-F169 HydrophobicContact CG-CD1 4.27Å; P126-F169 HydrophobicContact CG-CE1 3.59Å; P126-F169 HydrophobicContact CG-CZ 3.93Å
127	L	97.2	Very high	96.2	Very high	12 Å²	12	67 Å²	67	6%	0.063	35%	0.345	C	S	.	.	H	α-helix	trans	-55.9	-50.4	-173.4	-57.5	172.2	0	0	0	111.9	L125 T129 L130 E131 V145 D147 P152 V154 F169	L125-L127 HydrophobicContact CB-CD2 4.46Å; L125-L127 HydrophobicContact CB-CG 4.18Å; L125-L127 PolarHBondContact O-N 2.87Å; L127-T129 VanDerWaalsContact C-N 3.32Å; L127-T129 PolarHBondContact O-N 3.03Å; L127-L130 PolarHBondContact O-N 3.3Å; L127-E131 PolarHBondContact O-N 3.08Å; L127-V145 HydrophobicContact CB-CG1 3.89Å; L127-V145 HydrophobicContact CB-CG2 4.43Å; L127-V145 HydrophobicContact CD1-CG1 4.02Å; L127-D147 HydrophobicContact CD1-CB 3.88Å; L127-P152 HydrophobicContact CD1-CB 3.73Å; L127-P152 HydrophobicContact CD2-CB 4.29Å; L127-V154 HydrophobicContact CB-CG2 4.05Å; L127-V154 HydrophobicContact CD2-CG2 3.86Å; L127-F169 HydrophobicContact CD2-CD2 3.77Å; L127-F169 HydrophobicContact CD2-CE2 3.79Å
128	H	97.3	Very high	96.2	Very high	101 Å²	101	69 Å²	69	47%	0.468	37%	0.365	S	S	.	.	H	α-helix	trans	-70.6	-25.1	179.6	-65	-62.2	0	0	0	113.3	P126 E131 Q132	P126-H128 PolarHBondContact O-N 2.92Å; H128-E131 IonicContact CE1-OE2 3.73Å; H128-E131 IonicContact CG-OE2 3.68Å; H128-E131 IonicContact ND1-OE2 2.67Å; H128-E131 PolarHBondContact ND1-OE2 2.89Å; H128-Q132 WeakPolarHBondContact O-CB 3.38Å; H128-Q132 VanDerWaalsContact O-CG 3.29Å; H128-Q132 WeakPolarHBondContact O-CG 3.33Å; H128-Q132 PolarHBondContact O-N 2.78Å
129	T	97.3	Very high	96.2	Very high	71 Å²	71	70.2 Å²	70.2	44%	0.436	37%	0.371	S	S	.	.	H	α-helix	trans	-68.7	-41.4	172.9	-46.3	0	0	0	0	110.7	W92 P126 L127 A133	W92-T129 HydrophobicContact CH2-CG2 4.44Å; W92-T129 HydrophobicContact CZ2-CG2 3.85Å; P126-T129 WeakPolarHBondContact O-CB 3.19Å; P126-T129 PolarHBondContact O-N 2.93Å; P126-T129 VanDerWaalsContact O-N 3.12Å; L127-T129 VanDerWaalsContact C-N 3.32Å; L127-T129 PolarHBondContact O-N 3.03Å; T129-A133 PolarHBondContact O-N 3.48Å
130	L	98	Very high	96.1	Very high	0 Å²	0	69 Å²	69	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-66.5	-47.3	174.4	178	60.7	0	0	0	111.5	V88 L91 W92 I118 P126 L127 Q132 A133 L134 V154 I167 F169	V88-L130 HydrophobicContact CG2-CD1 3.76Å; L91-L130 HydrophobicContact CD1-CD1 4.47Å; W92-L130 HydrophobicContact CH2-CB 4.16Å; W92-L130 HydrophobicContact CZ3-CB 4.44Å; I118-L130 HydrophobicContact CD1-CD2 3.94Å; P126-L130 PolarHBondContact O-N 3.43Å; P126-L130 VanDerWaalsContact O-N 3.09Å; L127-L130 PolarHBondContact O-N 3.3Å; L130-Q132 PolarHBondContact O-N 2.88Å; L130-A133 PolarHBondContact O-N 3.41Å; L130-A133 VanDerWaalsContact O-N 3.08Å; L130-L134 HydrophobicContact CD1-CD1 4.07Å; L130-L134 HydrophobicContact CD1-CD2 4.45Å; L130-L134 HydrophobicContact CD1-CG 3.99Å; L130-L134 HydrophobicContact CG-CD1 3.87Å; L130-L134 HydrophobicContact CG-CG 4.26Å; L130-L134 WeakPolarHBondContact O-CG 3.46Å; L130-L134 PolarHBondContact O-N 2.98Å; L130-V154 HydrophobicContact CD2-CB 4.11Å; L130-V154 HydrophobicContact CD2-CG2 3.98Å; L130-I167 HydrophobicContact CD2-CB 4.08Å; L130-I167 HydrophobicContact CD2-CD1 4.07Å; L130-I167 HydrophobicContact CD2-CG2 3.66Å; L130-F169 HydrophobicContact CB-CZ 4.32Å; L130-F169 HydrophobicContact CD2-CE2 3.97Å; L130-F169 HydrophobicContact CD2-CZ 3.86Å
131	E	98.1	Very high	96.2	Very high	54 Å²	54	71.8 Å²	71.8	25%	0.252	38%	0.384	S	S	.	.	H	α-helix	trans	-51.1	-51.1	174.6	173	179.8	-121.4	0	0	112	L127 H128 A133 L134 F135 I143 V145	L127-E131 PolarHBondContact O-N 3.08Å; H128-E131 IonicContact CE1-OE2 3.73Å; H128-E131 IonicContact CG-OE2 3.68Å; H128-E131 IonicContact ND1-OE2 2.67Å; H128-E131 PolarHBondContact ND1-OE2 2.89Å; E131-A133 VanDerWaalsContact C-N 3.29Å; E131-A133 PolarHBondContact O-N 3.32Å; E131-L134 PolarHBondContact O-N 3.09Å; E131-F135 WeakPolarHBondContact O-CB 3.41Å; E131-F135 PolarHBondContact O-N 3.24Å; E131-I143 HydrophobicContact CB-CG2 4.3Å; E131-I143 HydrophobicContact CG-CG2 3.92Å; E131-V145 HydrophobicContact CB-CG2 3.9Å; E131-V145 VanDerWaalsContact CD-CG2 3.47Å; E131-V145 HydrophobicContact CG-CG2 4.16Å; E131-V145 VanDerWaalsContact OE1-CG2 3.32Å; E131-V145 WeakPolarHBondContact OE1-CG2 3.36Å
132	Q	97.7	Very high	96.4	Very high	105 Å²	105	67.4 Å²	67.4	49%	0.491	37%	0.366	S	S	.	.	H	α-helix	trans	-62.7	-33.2	178.1	-74.2	-178.6	24.3	0	0	113.3	H128 L130 K136	H128-Q132 WeakPolarHBondContact O-CB 3.38Å; H128-Q132 VanDerWaalsContact O-CG 3.29Å; H128-Q132 WeakPolarHBondContact O-CG 3.33Å; H128-Q132 PolarHBondContact O-N 2.78Å; L130-Q132 PolarHBondContact O-N 2.88Å; Q132-K136 WeakPolarHBondContact O-CB 3.16Å; Q132-K136 WeakPolarHBondContact O-CD 3.41Å; Q132-K136 WeakPolarHBondContact O-CG 3.35Å; Q132-K136 PolarHBondContact O-N 2.98Å
133	A	98	Very high	96.6	Very high	16 Å²	16	66.5 Å²	66.5	13%	0.132	37%	0.366	C	S	.	.	H	α-helix	trans	-75.8	-43.7	179.1	0	0	0	0	0	112.1	I87 L91 T129 L130 E131 F135 K136 S137	I87-A133 HydrophobicContact CG2-CB 3.79Å; L91-A133 HydrophobicContact CD1-CB 3.66Å; L91-A133 HydrophobicContact CD2-CB 3.91Å; L91-A133 HydrophobicContact CG-CB 4.04Å; T129-A133 PolarHBondContact O-N 3.48Å; L130-A133 PolarHBondContact O-N 3.41Å; L130-A133 VanDerWaalsContact O-N 3.08Å; E131-A133 VanDerWaalsContact C-N 3.29Å; E131-A133 PolarHBondContact O-N 3.32Å; A133-F135 VanDerWaalsContact C-N 3.28Å; A133-F135 PolarHBondContact O-N 2.66Å; A133-K136 PolarHBondContact O-N 3.49Å; A133-S137 WeakPolarHBondContact O-CB 3.35Å; A133-S137 PolarHBondContact O-N 3.3Å
134	L	97.9	Very high	96.9	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-57.9	-43.6	172	-68	172.4	0	0	0	110.4	I87 L130 E131 S137 I139 I143 V154 M156 I167	I87-L134 HydrophobicContact CD1-CD2 3.99Å; I87-L134 HydrophobicContact CG2-CD2 4.36Å; L130-L134 HydrophobicContact CD1-CD1 4.07Å; L130-L134 HydrophobicContact CD1-CD2 4.45Å; L130-L134 HydrophobicContact CD1-CG 3.99Å; L130-L134 HydrophobicContact CG-CD1 3.87Å; L130-L134 HydrophobicContact CG-CG 4.26Å; L130-L134 WeakPolarHBondContact O-CG 3.46Å; L130-L134 PolarHBondContact O-N 2.98Å; E131-L134 PolarHBondContact O-N 3.09Å; L134-S137 PolarHBondContact O-N 3.19Å; L134-S137 PolarHBondContact O-OG 3.49Å; L134-I139 HydrophobicContact CD2-CD1 4.42Å; L134-I143 HydrophobicContact CB-CD1 3.68Å; L134-I143 HydrophobicContact CB-CG1 4.42Å; L134-V154 HydrophobicContact CD1-CG1 4.15Å; L134-M156 HydrophobicContact CD1-CB 4.46Å; L134-M156 HydrophobicContact CD1-CG 4.44Å; L134-M156 HydrophobicContact CD1-SD 4.21Å; L134-M156 HydrophobicContact CD2-SD 3.88Å; L134-I167 HydrophobicContact CD1-CD1 3.92Å
135	F	96.9	Very high	97.1	Very high	158 Å²	158	60.5 Å²	60.5	69%	0.693	32%	0.318	S	S	*	.	H	α-helix	trans	-62	-51.7	175.3	-176.3	-97.4	0	0	0	112.1	E131 A133 S137 G138 I143	E131-F135 WeakPolarHBondContact O-CB 3.41Å; E131-F135 PolarHBondContact O-N 3.24Å; A133-F135 VanDerWaalsContact C-N 3.28Å; A133-F135 PolarHBondContact O-N 2.66Å; F135-S137 PolarHBondContact O-N 2.66Å; F135-G138 PolarHBondContact O-N 2.91Å; F135-G138 VanDerWaalsContact O-N 3.14Å; F135-I143 HydrophobicContact CB-CD1 3.86Å; F135-I143 VanDerWaalsContact N-CD1 3.3Å
136	K	97.5	Very high	97.1	Very high	156 Å²	156	59.5 Å²	59.5	68%	0.678	31%	0.313	S	S	*	.	H	α-helix	trans	-61.8	-27	179.7	-74.9	165.7	-173.7	167.7	0	113.6	Q132 A133 G138	Q132-K136 WeakPolarHBondContact O-CB 3.16Å; Q132-K136 WeakPolarHBondContact O-CD 3.41Å; Q132-K136 WeakPolarHBondContact O-CG 3.35Å; Q132-K136 PolarHBondContact O-N 2.98Å; A133-K136 PolarHBondContact O-N 3.49Å; K136-G138 VanDerWaalsContact C-N 3.34Å
137	S	96.9	Very high	97	Very high	49 Å²	49	62 Å²	62	34%	0.343	33%	0.325	S	S	.	.	H	α-helix	trans	-74.7	-20.6	177.8	76.7	0	0	0	0	114.3	I87 A133 L134 F135 I139	I87-S137 VanDerWaalsContact CD1-CB 3.48Å; I87-S137 VanDerWaalsContact CD1-OG 3.23Å; I87-S137 WeakPolarHBondContact CD1-OG 3.31Å; A133-S137 WeakPolarHBondContact O-CB 3.35Å; A133-S137 PolarHBondContact O-N 3.3Å; L134-S137 PolarHBondContact O-N 3.19Å; L134-S137 PolarHBondContact O-OG 3.49Å; F135-S137 PolarHBondContact O-N 2.66Å; S137-I139 PolarHBondContact O-N 3.49Å; S137-I139 PolarHBondContact OG-N 3.27Å
138	G	96.7	Very high	96.8	Very high	41 Å²	41	70 Å²	70	42%	0.423	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.8	2.4	-178.2	0	0	0	0	0	116.3	F135 K136 S140	F135-G138 PolarHBondContact O-N 2.91Å; F135-G138 VanDerWaalsContact O-N 3.14Å; K136-G138 VanDerWaalsContact C-N 3.34Å; G138-S140 PolarHBondContact O-N 3.46Å
139	I	96.5	Very high	96.3	Very high	26 Å²	26	67.2 Å²	67.2	13%	0.133	35%	0.354	C	S	.	.			trans	-70.8	-13.8	-177.6	74	164.3	0	0	0	114	K83 V84 I87 L134 S137 M156 K159	K83-I139 HydrophobicContact CB-CD1 3.84Å; K83-I139 HydrophobicContact CD-CB 4.41Å; K83-I139 HydrophobicContact CD-CG2 4.35Å; V84-I139 HydrophobicContact CG2-CD1 4.09Å; I87-I139 HydrophobicContact CD1-CD1 3.52Å; I87-I139 HydrophobicContact CD1-CG1 3.95Å; I87-I139 HydrophobicContact CD1-CG2 4.29Å; L134-I139 HydrophobicContact CD2-CD1 4.42Å; S137-I139 PolarHBondContact O-N 3.49Å; S137-I139 PolarHBondContact OG-N 3.27Å; I139-M156 HydrophobicContact CD1-CE 4.19Å; I139-M156 HydrophobicContact CD1-SD 4.36Å; I139-M156 HydrophobicContact CG1-CE 4.37Å; I139-K159 VanDerWaalsContact O-CB 3.26Å; I139-K159 WeakPolarHBondContact O-CB 3.36Å; I139-K159 PolarHBondContact O-N 2.94Å
140	S	96.5	Very high	95.6	Very high	20 Å²	20	68.7 Å²	68.7	14%	0.14	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	145.7	-168.9	-170	0	0	0	0	113	G138 E142 T157	G138-S140 PolarHBondContact O-N 3.46Å; S140-E142 PolarHBondContact OG-O 3.22Å; S140-T157 CarbonylContact C-O 3.56Å; S140-T157 WeakPolarHBondContact CA-O 3.49Å; S140-T157 WeakPolarHBondContact CB-O 3.33Å; S140-T157 PolarHBondContact OG-N 3.36Å; S140-T157 PolarHBondContact OG-O 2.93Å
141	S	96.5	Very high	95.2	Very high	81 Å²	81	71.1 Å²	71.1	57%	0.566	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.1	-28.8	174.5	50.2	0	0	0	0	113.5	T157	S141-T157 PolarHBondContact N-O 2.96Å; S141-T157 PolarHBondContact OG-O 3.16Å
142	E	97	Very high	95	Very high	113 Å²	113	70.1 Å²	70.1	53%	0.528	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	134.9	178.1	-175.9	-167.4	175	0	0	108.7	S140 M156 T157	S140-E142 PolarHBondContact OG-O 3.22Å; E142-M156 CarbonylContact O-C 3.58Å; E142-M156 WeakPolarHBondContact O-CA 3.44Å; E142-T157 PolarHBondContact O-N 3.08Å
143	I	97.9	Very high	94.9	Very high	40 Å²	40	66.7 Å²	66.7	21%	0.205	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	138.3	172.8	-55.8	163.5	0	0	0	108.1	E131 L134 F135 V154 K155 M156	E131-I143 HydrophobicContact CB-CG2 4.3Å; E131-I143 HydrophobicContact CG-CG2 3.92Å; L134-I143 HydrophobicContact CB-CD1 3.68Å; L134-I143 HydrophobicContact CB-CG1 4.42Å; F135-I143 HydrophobicContact CB-CD1 3.86Å; F135-I143 VanDerWaalsContact N-CD1 3.3Å; I143-V154 HydrophobicContact CG2-CG1 4.04Å; I143-K155 CarbonylContact C-O 3.57Å; I143-K155 WeakPolarHBondContact CA-O 3.31Å; I143-M156 HydrophobicContact CG1-CB 4.21Å
144	K	97.4	Very high	94.9	Very high	112 Å²	112	66 Å²	66	49%	0.487	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	117	-178.5	-173.2	173.6	-170.8	168.4	0	112.1	L146 K155	K144-L146 HydrophobicContact CD-CD2 4.3Å; K144-L146 HydrophobicContact CG-CD2 4.22Å; K144-K155 HydrophobicContact CB-CB 4.44Å; K144-K155 PolarHBondContact N-O 3.25Å; K144-K155 PolarHBondContact O-N 3.49Å
145	V	97.5	Very high	94.9	Very high	23 Å²	23	69 Å²	69	14%	0.139	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	132.7	170.4	176.3	0	0	0	0	110.5	L127 E131 D147 V154	L127-V145 HydrophobicContact CB-CG1 3.89Å; L127-V145 HydrophobicContact CB-CG2 4.43Å; L127-V145 HydrophobicContact CD1-CG1 4.02Å; E131-V145 HydrophobicContact CB-CG2 3.9Å; E131-V145 VanDerWaalsContact CD-CG2 3.47Å; E131-V145 HydrophobicContact CG-CG2 4.16Å; E131-V145 VanDerWaalsContact OE1-CG2 3.32Å; E131-V145 WeakPolarHBondContact OE1-CG2 3.36Å; V145-D147 HydrophobicContact CG1-CB 4.01Å; V145-V154 HydrophobicContact CG2-CG1 4.29Å; V145-V154 HydrophobicContact CG2-CG2 4.2Å
146	L	94.9	Very high	94.9	Very high	57 Å²	57	61.6 Å²	61.6	30%	0.298	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	71.7	174.6	-62.5	179.9	0	0	0	109.5	K144 A149 P152 I153 K155	K144-L146 HydrophobicContact CD-CD2 4.3Å; K144-L146 HydrophobicContact CG-CD2 4.22Å; L146-A149 HydrophobicContact CB-CB 4.37Å; L146-P152 WeakPolarHBondContact O-CA 3.23Å; L146-I153 PolarHBondContact N-O 2.93Å; L146-I153 PolarHBondContact O-N 3.33Å; L146-K155 HydrophobicContact CD1-CD 3.88Å; L146-K155 HydrophobicContact CD1-CG 4.16Å
147	D	93.6	Very high	95	Very high	66 Å²	66	55.2 Å²	55.2	35%	0.353	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-30.3	-172.1	76.9	-38.3	0	0	0	114	L127 V145 A149	L127-D147 HydrophobicContact CD1-CB 3.88Å; V145-D147 HydrophobicContact CG1-CB 4.01Å; D147-A149 VanDerWaalsContact C-N 3.26Å; D147-A149 PolarHBondContact O-N 2.9Å
148	K	92.3	Very high	95	Very high	180 Å²	180	52.9 Å²	52.9	78%	0.783	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-3.6	177.7	-46.6	-47.9	176.9	-160	0	113.9
149	A	86.3	Confident	95	Very high	44 Å²	44	57.8 Å²	57.8	36%	0.364	30%	0.303	S	S	.	.	S	Bend	trans	-72.3	147.1	175	0	0	0	0	0	110.7	L146 D147 V151	L146-A149 HydrophobicContact CB-CB 4.37Å; D147-A149 VanDerWaalsContact C-N 3.26Å; D147-A149 PolarHBondContact O-N 2.9Å; A149-V151 WeakPolarHBondContact CB-O 3.29Å; A149-V151 CarbonylContact O-C 3.53Å; A149-V151 PolarHBondContact O-N 3.01Å; A149-V151 VanDerWaalsContact O-N 3.09Å
150	T	84.5	Confident	94.9	Very high	102 Å²	102	61.7 Å²	61.7	63%	0.626	32%	0.321	S	S	*	.	S	Bend	trans	-61.8	-20.9	-179.6	-41.3	0	0	0	0	113.5	R307	T150-R307 PolarHBondContact OG1-NH1 3.09Å; T150-R307 PolarHBondContact OG1-NH2 3.34Å
151	V	88.1	Confident	94.9	Very high	51 Å²	51	61 Å²	61	31%	0.309	32%	0.316	S	S	.	.	S	Bend	trans	-118	108.9	159.2	178.9	0	0	0	0	105.6	A149 I153 M171	A149-V151 WeakPolarHBondContact CB-O 3.29Å; A149-V151 CarbonylContact O-C 3.53Å; A149-V151 PolarHBondContact O-N 3.01Å; A149-V151 VanDerWaalsContact O-N 3.09Å; V151-I153 HydrophobicContact CG1-CD1 4.34Å; V151-I153 HydrophobicContact CG1-CG1 4.12Å; V151-I153 PolarHBondContact O-N 3.02Å; V151-M171 HydrophobicContact CB-CE 4.42Å; V151-M171 HydrophobicContact CG1-CE 3.89Å; V151-M171 HydrophobicContact CG1-CG 3.88Å; V151-M171 HydrophobicContact CG1-SD 3.73Å; V151-M171 HydrophobicContact CG2-CE 3.58Å; V151-M171 HydrophobicContact CG2-SD 4.18Å
152	P	93.6	Very high	94.9	Very high	32 Å²	32	61.7 Å²	61.7	21%	0.208	31%	0.31	C	S	.	.			trans	-66.2	129.3	176.3	-24.7	36.1	0	0	0	111.2	L125 L127 L146	L125-P152 HydrophobicContact CD1-CB 4.19Å; L125-P152 HydrophobicContact CD1-CG 4.08Å; L127-P152 HydrophobicContact CD1-CB 3.73Å; L127-P152 HydrophobicContact CD2-CB 4.29Å; L146-P152 WeakPolarHBondContact O-CA 3.23Å
153	I	95.9	Very high	94.8	Very high	34 Å²	34	56.5 Å²	56.5	17%	0.174	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	141	-172.9	-69.2	168.7	0	0	0	109.7	L146 V151 K155 D166 I167	L146-I153 PolarHBondContact N-O 2.93Å; L146-I153 PolarHBondContact O-N 3.33Å; V151-I153 HydrophobicContact CG1-CD1 4.34Å; V151-I153 HydrophobicContact CG1-CG1 4.12Å; V151-I153 PolarHBondContact O-N 3.02Å; I153-K155 HydrophobicContact CG2-CG 3.97Å; I153-D166 HydrophobicContact CG2-CB 4Å; I153-I167 WeakPolarHBondContact CA-O 3.33Å
154	V	98	Very high	94.8	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	110.5	161.3	-171.3	0	0	0	0	107.3	L127 L130 L134 I143 V145 I167	L127-V154 HydrophobicContact CB-CG2 4.05Å; L127-V154 HydrophobicContact CD2-CG2 3.86Å; L130-V154 HydrophobicContact CD2-CB 4.11Å; L130-V154 HydrophobicContact CD2-CG2 3.98Å; L134-V154 HydrophobicContact CD1-CG1 4.15Å; I143-V154 HydrophobicContact CG2-CG1 4.04Å; V145-V154 HydrophobicContact CG2-CG1 4.29Å; V145-V154 HydrophobicContact CG2-CG2 4.2Å; V154-I167 PolarHBondContact N-O 2.86Å; V154-I167 PolarHBondContact O-N 3.23Å
155	K	97.9	Very high	94.8	Very high	64 Å²	64	54.2 Å²	54.2	28%	0.278	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	142.6	171.1	-68.5	-167.2	161	-79.9	0	109.5	D113 I143 K144 L146 I153 V165 D166	D113-K155 IonicContact OD2-NZ 3.73Å; I143-K155 CarbonylContact C-O 3.57Å; I143-K155 WeakPolarHBondContact CA-O 3.31Å; K144-K155 HydrophobicContact CB-CB 4.44Å; K144-K155 PolarHBondContact N-O 3.25Å; K144-K155 PolarHBondContact O-N 3.49Å; L146-K155 HydrophobicContact CD1-CD 3.88Å; L146-K155 HydrophobicContact CD1-CG 4.16Å; I153-K155 HydrophobicContact CG2-CG 3.97Å; K155-V165 WeakPolarHBondContact CA-O 3.34Å; K155-D166 WeakPolarHBondContact CE-OD2 3.44Å; K155-D166 WeakPolarHBondContact CG-OD1 3.38Å; K155-D166 IonicContact NZ-OD1 2.7Å; K155-D166 PolarHBondContact NZ-OD1 2.89Å; K155-D166 IonicContact NZ-OD2 2.66Å; K155-D166 PolarHBondContact NZ-OD2 2.89Å
156	M	98	Very high	94.8	Very high	3 Å²	3	54.2 Å²	54.2	2%	0.015	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	161.7	166.4	65.1	152.4	-79.4	0	0	112	V84 L134 I139 E142 I143 D158 R164 V165 I167	V84-M156 HydrophobicContact CG2-SD 3.81Å; L134-M156 HydrophobicContact CD1-CB 4.46Å; L134-M156 HydrophobicContact CD1-CG 4.44Å; L134-M156 HydrophobicContact CD1-SD 4.21Å; L134-M156 HydrophobicContact CD2-SD 3.88Å; I139-M156 HydrophobicContact CD1-CE 4.19Å; I139-M156 HydrophobicContact CD1-SD 4.36Å; I139-M156 HydrophobicContact CG1-CE 4.37Å; E142-M156 CarbonylContact O-C 3.58Å; E142-M156 WeakPolarHBondContact O-CA 3.44Å; I143-M156 HydrophobicContact CG1-CB 4.21Å; M156-D158 HydrophobicContact CE-CB 4.07Å; M156-R164 CarbonylContact O-C 3.55Å; M156-R164 WeakPolarHBondContact O-CA 3.46Å; M156-V165 HydrophobicContact CE-CG2 4.28Å; M156-V165 HydrophobicContact CG-CB 3.77Å; M156-V165 HydrophobicContact CG-CG2 4.17Å; M156-V165 PolarHBondContact N-O 3.15Å; M156-V165 PolarHBondContact O-N 2.67Å; M156-V165 HydrophobicContact SD-CB 4.45Å; M156-V165 HydrophobicContact SD-CG2 4.39Å; M156-I167 HydrophobicContact CG-CD1 4.4Å
157	T	98.2	Very high	95	Very high	21 Å²	21	51.5 Å²	51.5	13%	0.129	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	124.5	169.6	-58.2	0	0	0	0	109.4	S140 S141 E142	S140-T157 CarbonylContact C-O 3.56Å; S140-T157 WeakPolarHBondContact CA-O 3.49Å; S140-T157 WeakPolarHBondContact CB-O 3.33Å; S140-T157 PolarHBondContact OG-N 3.36Å; S140-T157 PolarHBondContact OG-O 2.93Å; S141-T157 PolarHBondContact N-O 2.96Å; S141-T157 PolarHBondContact OG-O 3.16Å; E142-T157 PolarHBondContact O-N 3.08Å
158	D	97.8	Very high	95.1	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	133	175.1	170.8	97.4	0	0	0	110.6	V80 K83 M156 E160 T161 E162 L163	V80-D158 HydrophobicContact CG1-CB 3.93Å; V80-D158 HydrophobicContact CG2-CB 3.89Å; K83-D158 IonicContact NZ-OD1 3.83Å; K83-D158 PolarHBondContact NZ-OD1 3.48Å; K83-D158 IonicContact NZ-OD2 2.68Å; M156-D158 HydrophobicContact CE-CB 4.07Å; D158-E160 PolarHBondContact O-N 3.14Å; D158-E160 PolarHBondContact OD2-N 2.92Å; D158-T161 WeakPolarHBondContact CB-OG1 3.3Å; D158-T161 VanDerWaalsContact CG-OG1 3.3Å; D158-T161 WeakPolarHBondContact OD2-CB 3.38Å; D158-T161 PolarHBondContact OD2-N 2.81Å; D158-T161 PolarHBondContact OD2-OG1 3.31Å; D158-E162 WeakPolarHBondContact O-CA 3.41Å; D158-E162 PolarHBondContact O-N 3.05Å; D158-L163 PolarHBondContact N-O 3.49Å
159	K	96.9	Very high	95.3	Very high	144 Å²	144	40.4 Å²	40.4	63%	0.626	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-21.7	-168.8	-174.7	176.8	175.2	-177.1	0	114.2	I139	I139-K159 VanDerWaalsContact O-CB 3.26Å; I139-K159 WeakPolarHBondContact O-CB 3.36Å; I139-K159 PolarHBondContact O-N 2.94Å
160	E	95.1	Very high	95.7	Very high	108 Å²	108	41.7 Å²	41.7	51%	0.505	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-32.9	-178.8	-70	157.9	-132.3	0	0	112.3	K83 D158 Y365	K83-E160 IonicContact NZ-OE1 2.77Å; K83-E160 PolarHBondContact NZ-OE1 3.1Å; K83-E160 IonicContact NZ-OE2 2.76Å; K83-E160 PolarHBondContact NZ-OE2 2.84Å; D158-E160 PolarHBondContact O-N 3.14Å; D158-E160 PolarHBondContact OD2-N 2.92Å; E160-Y365 HydrophobicContact CB-CD2 4.49Å; E160-Y365 HydrophobicContact CB-CE2 3.7Å; E160-Y365 HydrophobicContact CG-CE2 4.4Å; E160-Y365 WeakPolarHBondContact OE2-CE2 3.48Å; E160-Y365 PolarHBondContact OE2-OH 3.08Å
161	T	95.2	Very high	96	Very high	6 Å²	6	39.5 Å²	39.5	4%	0.037	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.6	-10.9	-169.8	59.4	0	0	0	0	114.3	V80 D158 L163 F358 I362 Y365	V80-T161 HydrophobicContact CG2-CG2 4.16Å; V80-T161 WeakPolarHBondContact CG2-OG1 3.31Å; D158-T161 WeakPolarHBondContact CB-OG1 3.3Å; D158-T161 VanDerWaalsContact CG-OG1 3.3Å; D158-T161 WeakPolarHBondContact OD2-CB 3.38Å; D158-T161 PolarHBondContact OD2-N 2.81Å; D158-T161 PolarHBondContact OD2-OG1 3.31Å; T161-L163 HydrophobicContact CG2-CD1 4.35Å; T161-L163 PolarHBondContact O-N 3.13Å; T161-L163 VanDerWaalsContact O-N 3.08Å; T161-L163 WeakPolarHBondContact OG1-CB 3.44Å; T161-L163 PolarHBondContact OG1-N 2.82Å; T161-F358 WeakPolarHBondContact O-CE2 3.36Å; T161-I362 HydrophobicContact CG2-CD1 4.32Å; T161-I362 WeakPolarHBondContact O-CD1 3.42Å; T161-Y365 HydrophobicContact CG2-CD1 3.65Å; T161-Y365 HydrophobicContact CG2-CD2 4.32Å; T161-Y365 HydrophobicContact CG2-CE1 3.28Å; T161-Y365 HydrophobicContact CG2-CE2 4.03Å; T161-Y365 HydrophobicContact CG2-CG 4.14Å; T161-Y365 VanDerWaalsContact CG2-CZ 3.48Å
162	E	95.8	Very high	96	Very high	96 Å²	96	41.6 Å²	41.6	45%	0.449	20%	0.198	S	C	.	.			trans	58.3	13.6	-170.5	-49.3	173.2	133.5	0	0	113.6	D158 R164 F358 R361	D158-E162 WeakPolarHBondContact O-CA 3.41Å; D158-E162 PolarHBondContact O-N 3.05Å; E162-R164 PolarHBondContact O-N 3.02Å; E162-F358 HydrophobicContact CB-CE2 4.17Å; E162-R361 IonicContact OE1-NH2 3.75Å; E162-R361 IonicContact OE2-CZ 3.36Å; E162-R361 VanDerWaalsContact OE2-CZ 3.26Å; E162-R361 IonicContact OE2-NE 2.66Å; E162-R361 PolarHBondContact OE2-NE 3.14Å; E162-R361 IonicContact OE2-NH2 2.71Å; E162-R361 PolarHBondContact OE2-NH2 2.93Å
163	L	96.6	Very high	95.9	Very high	4 Å²	4	43 Å²	43	2%	0.021	20%	0.204	C	C	.	.			trans	-73.5	122.4	177.3	-75.8	165.1	0	0	0	110.3	A76 R77 V80 I114 D158 T161 F358 I362	A76-L163 HydrophobicContact CB-CD1 4.36Å; R77-L163 HydrophobicContact CG-CD1 3.82Å; R77-L163 HydrophobicContact CG-CD2 4.19Å; V80-L163 HydrophobicContact CG2-CD1 4.05Å; I114-L163 HydrophobicContact CD1-CB 4.34Å; I114-L163 HydrophobicContact CD1-CD1 4.39Å; D158-L163 PolarHBondContact N-O 3.49Å; T161-L163 HydrophobicContact CG2-CD1 4.35Å; T161-L163 PolarHBondContact O-N 3.13Å; T161-L163 VanDerWaalsContact O-N 3.08Å; T161-L163 WeakPolarHBondContact OG1-CB 3.44Å; T161-L163 PolarHBondContact OG1-N 2.82Å; L163-F358 HydrophobicContact CD2-CZ 3.82Å; L163-F358 HydrophobicContact CG-CZ 4.23Å; L163-I362 HydrophobicContact CD1-CD1 4.17Å; L163-I362 HydrophobicContact CG-CD1 4.23Å
164	R	97.4	Very high	95.5	Very high	104 Å²	104	42.6 Å²	42.6	39%	0.392	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	143.6	171.4	-65.5	-177.6	-54.9	-70.8	-4.4	111	T111 D113 I114 M156 E162	T111-R164 PolarHBondContact O-NH2 3.43Å; D113-R164 CarbonylContact C-O 3.22Å; D113-R164 WeakPolarHBondContact CA-O 3.26Å; D113-R164 HydrophobicContact CB-CB 4.19Å; D113-R164 IonicContact OD1-CZ 3.88Å; D113-R164 VanDerWaalsContact OD1-CZ 3.31Å; D113-R164 IonicContact OD1-NE 3.7Å; D113-R164 PolarHBondContact OD1-NE 3.23Å; D113-R164 VanDerWaalsContact OD1-NE 3.15Å; D113-R164 IonicContact OD1-NH2 3.73Å; D113-R164 PolarHBondContact OD1-NH2 3.22Å; D113-R164 WeakPolarHBondContact OD2-CB 3.45Å; D113-R164 IonicContact OD2-CZ 2.85Å; D113-R164 IonicContact OD2-NE 3.72Å; D113-R164 PolarHBondContact OD2-NE 2.97Å; D113-R164 IonicContact OD2-NH2 3.91Å; I114-R164 PolarHBondContact N-O 3.31Å; M156-R164 CarbonylContact O-C 3.55Å; M156-R164 WeakPolarHBondContact O-CA 3.46Å; E162-R164 PolarHBondContact O-N 3.02Å
165	V	98.2	Very high	95.2	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	128.6	178.4	-167.6	0	0	0	0	109.2	V80 I114 M116 K155 M156 I167	V80-V165 HydrophobicContact CG1-CG2 3.69Å; I114-V165 HydrophobicContact CB-CB 4.47Å; I114-V165 HydrophobicContact CB-CG1 4.19Å; I114-V165 HydrophobicContact CB-CG2 4.28Å; I114-V165 HydrophobicContact CD1-CG2 4.31Å; I114-V165 HydrophobicContact CG2-CG1 4.43Å; I114-V165 WeakPolarHBondContact O-CA 3.46Å; I114-V165 WeakPolarHBondContact O-CG1 3.44Å; M116-V165 HydrophobicContact CB-CG1 4.35Å; M116-V165 HydrophobicContact CG-CG1 3.79Å; M116-V165 HydrophobicContact SD-CG1 3.54Å; M116-V165 VanDerWaalsContact SD-CG1 3.54Å; K155-V165 WeakPolarHBondContact CA-O 3.34Å; M156-V165 HydrophobicContact CE-CG2 4.28Å; M156-V165 HydrophobicContact CG-CB 3.77Å; M156-V165 HydrophobicContact CG-CG2 4.17Å; M156-V165 PolarHBondContact N-O 3.15Å; M156-V165 PolarHBondContact O-N 2.67Å; M156-V165 HydrophobicContact SD-CB 4.45Å; M156-V165 HydrophobicContact SD-CG2 4.39Å; V165-I167 HydrophobicContact CG1-CD1 4.42Å; V165-I167 HydrophobicContact CG1-CG1 3.85Å
166	D	97.5	Very high	95	Very high	23 Å²	23	45.6 Å²	45.6	12%	0.123	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	107.6	176	-86.2	31.6	0	0	0	109.2	I114 M116 I153 K155	I114-D166 PolarHBondContact O-N 2.8Å; M116-D166 PolarHBondContact N-O 2.81Å; I153-D166 HydrophobicContact CG2-CB 4Å; K155-D166 WeakPolarHBondContact CE-OD2 3.44Å; K155-D166 WeakPolarHBondContact CG-OD1 3.38Å; K155-D166 IonicContact NZ-OD1 2.7Å; K155-D166 PolarHBondContact NZ-OD1 2.89Å; K155-D166 IonicContact NZ-OD2 2.66Å; K155-D166 PolarHBondContact NZ-OD2 2.89Å
167	I	98	Very high	94.8	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	117.8	-176.1	-48	169.2	0	0	0	109.6	V84 M116 I118 L130 L134 I153 V154 M156 V165	V84-I167 HydrophobicContact CG1-CD1 3.68Å; V84-I167 HydrophobicContact CG1-CG1 4.46Å; M116-I167 HydrophobicContact CB-CG1 4.29Å; M116-I167 WeakPolarHBondContact O-CA 3.28Å; I118-I167 HydrophobicContact CD1-CG2 3.61Å; I118-I167 HydrophobicContact CG1-CG2 3.85Å; L130-I167 HydrophobicContact CD2-CB 4.08Å; L130-I167 HydrophobicContact CD2-CD1 4.07Å; L130-I167 HydrophobicContact CD2-CG2 3.66Å; L134-I167 HydrophobicContact CD1-CD1 3.92Å; I153-I167 WeakPolarHBondContact CA-O 3.33Å; V154-I167 PolarHBondContact N-O 2.86Å; V154-I167 PolarHBondContact O-N 3.23Å; M156-I167 HydrophobicContact CG-CD1 4.4Å; V165-I167 HydrophobicContact CG1-CD1 4.42Å; V165-I167 HydrophobicContact CG1-CG1 3.85Å
168	S	96.6	Very high	94.6	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.014	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	163.6	-179.7	64.3	0	0	0	0	111.6	F100 M116 V117 I118	F100-S168 WeakPolarHBondContact CE1-OG 3.49Å; M116-S168 PolarHBondContact O-N 3.05Å; M116-S168 PolarHBondContact O-OG 3.38Å; M116-S168 VanDerWaalsContact O-OG 3.08Å; V117-S168 WeakPolarHBondContact CA-O 3.26Å; I118-S168 PolarHBondContact N-O 2.88Å
169	F	96.5	Very high	94.5	Very high	10 Å²	10	49 Å²	49	4%	0.044	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	135	-178.1	-72.3	-97	0	0	0	111.5	W92 I118 W122 L125 P126 L127 L130 M171	W92-F169 HydrophobicContact CH2-CE1 4.35Å; W92-F169 HydrophobicContact CH2-CZ 4.31Å; W92-F169 HydrophobicContact CZ3-CE1 4.01Å; W92-F169 HydrophobicContact CZ3-CZ 4.12Å; I118-F169 HydrophobicContact CB-CD1 4.05Å; I118-F169 HydrophobicContact CB-CE1 4.07Å; I118-F169 HydrophobicContact CD1-CE1 3.85Å; I118-F169 HydrophobicContact CD1-CE2 4.45Å; I118-F169 HydrophobicContact CD1-CZ 3.79Å; I118-F169 HydrophobicContact CG2-CD1 4.49Å; I118-F169 HydrophobicContact CG2-CE1 4.29Å; I118-F169 WeakPolarHBondContact O-CA 3.45Å; W122-F169 HydrophobicContact CE3-CD1 4.24Å; W122-F169 AromaticContact CH2-CD1 3.66Å; W122-F169 HydrophobicContact CH2-CD1 3.66Å; W122-F169 AromaticContact CH2-CE1 3.94Å; W122-F169 HydrophobicContact CH2-CE1 3.94Å; W122-F169 HydrophobicContact CZ2-CD1 4.29Å; W122-F169 HydrophobicContact CZ2-CE1 4.13Å; W122-F169 AromaticContact CZ3-CD1 3.64Å; W122-F169 HydrophobicContact CZ3-CD1 3.64Å; W122-F169 HydrophobicContact CZ3-CE1 4.3Å; L125-F169 HydrophobicContact CD2-CB 3.88Å; P126-F169 HydrophobicContact CG-CD1 4.27Å; P126-F169 HydrophobicContact CG-CE1 3.59Å; P126-F169 HydrophobicContact CG-CZ 3.93Å; L127-F169 HydrophobicContact CD2-CD2 3.77Å; L127-F169 HydrophobicContact CD2-CE2 3.79Å; L130-F169 HydrophobicContact CB-CZ 4.32Å; L130-F169 HydrophobicContact CD2-CE2 3.97Å; L130-F169 HydrophobicContact CD2-CZ 3.86Å; F169-M171 PolarHBondContact O-N 3.43Å
170	N	93.3	Very high	94.4	Very high	71 Å²	71	43.2 Å²	43.2	38%	0.38	21%	0.213	S	C	.	.	S	Bend	trans	56	18.5	174	-69.9	-26.7	0	0	0	117	I118 F119 G120 I172	I118-N170 PolarHBondContact O-N 3.44Å; F119-N170 VanDerWaalsContact CA-OD1 3.31Å; F119-N170 WeakPolarHBondContact CA-OD1 3.3Å; G120-N170 PolarHBondContact N-OD1 2.93Å; G120-N170 PolarHBondContact O-ND2 3.04Å; G120-N170 PolarHBondContact O-OD1 3.07Å; N170-I172 VanDerWaalsContact C-N 3.34Å; N170-I172 PolarHBondContact O-N 3Å
171	M	90.6	Very high	94.5	Very high	56 Å²	56	38.5 Å²	38.5	28%	0.276	19%	0.191	S	C	.	.			trans	-77.5	67	-177.2	-68.5	-58.9	-66	0	0	114.5	V117 V151 F169 N173 S174	V117-M171 HydrophobicContact CG2-CB 4.02Å; V151-M171 HydrophobicContact CB-CE 4.42Å; V151-M171 HydrophobicContact CG1-CE 3.89Å; V151-M171 HydrophobicContact CG1-CG 3.88Å; V151-M171 HydrophobicContact CG1-SD 3.73Å; V151-M171 HydrophobicContact CG2-CE 3.58Å; V151-M171 HydrophobicContact CG2-SD 4.18Å; F169-M171 PolarHBondContact O-N 3.43Å; M171-N173 PolarHBondContact O-N 2.67Å; M171-S174 WeakPolarHBondContact O-CB 3.47Å; M171-S174 PolarHBondContact O-N 3.38Å
172	I	89.4	Confident	94.5	Very high	96 Å²	96	42 Å²	42	49%	0.492	20%	0.203	S	C	.	.	H	α-helix	trans	-60.7	-36.2	-175.1	-168.8	167	0	0	0	114.5	F119 N170 S174 V175 K176	F119-I172 HydrophobicContact CE1-CB 4.03Å; F119-I172 HydrophobicContact CZ-CB 4.46Å; N170-I172 VanDerWaalsContact C-N 3.34Å; N170-I172 PolarHBondContact O-N 3Å; I172-S174 PolarHBondContact O-N 3.26Å; I172-V175 PolarHBondContact O-N 3.42Å; I172-V175 VanDerWaalsContact O-N 3.15Å; I172-K176 PolarHBondContact O-N 2.75Å
173	N	90.7	Very high	94.4	Very high	60 Å²	60	40.3 Å²	40.3	32%	0.321	20%	0.2	S	C	.	.	H	α-helix	trans	-65.1	-27	-179.8	-76.5	-1	0	0	0	112.6	M171 V175 K176 A177	M171-N173 PolarHBondContact O-N 2.67Å; N173-V175 VanDerWaalsContact C-N 3.32Å; N173-V175 PolarHBondContact O-N 3.09Å; N173-K176 PolarHBondContact O-N 3.11Å; N173-A177 WeakPolarHBondContact O-CB 3.39Å; N173-A177 PolarHBondContact O-N 3.06Å
174	S	88.1	Confident	94.4	Very high	26 Å²	26	41.4 Å²	41.4	18%	0.182	20%	0.204	C	C	.	.	H	α-helix	trans	-67.1	-33	175.8	-52	0	0	0	0	112.7	M171 I172 A178	M171-S174 WeakPolarHBondContact O-CB 3.47Å; M171-S174 PolarHBondContact O-N 3.38Å; I172-S174 PolarHBondContact O-N 3.26Å; S174-A178 PolarHBondContact O-N 3.17Å
175	V	90.9	Very high	94.2	Very high	34 Å²	34	38.6 Å²	38.6	21%	0.206	20%	0.196	C	C	.	.	H	α-helix	trans	-73.7	-44	173.7	-174.5	0	0	0	0	110.3	F100 V117 F119 I172 N173 A177 A178 E179	F100-V175 HydrophobicContact CB-CG2 4.48Å; V117-V175 HydrophobicContact CG1-CG2 3.83Å; F119-V175 HydrophobicContact CE2-CG2 4.1Å; F119-V175 HydrophobicContact CZ-CG2 3.89Å; I172-V175 PolarHBondContact O-N 3.42Å; I172-V175 VanDerWaalsContact O-N 3.15Å; N173-V175 VanDerWaalsContact C-N 3.32Å; N173-V175 PolarHBondContact O-N 3.09Å; V175-A177 VanDerWaalsContact C-N 3.28Å; V175-A177 PolarHBondContact O-N 3.29Å; V175-A178 PolarHBondContact O-N 3.03Å; V175-E179 PolarHBondContact O-N 2.97Å
176	K	94.2	Very high	94	Very high	94 Å²	94	46.2 Å²	46.2	41%	0.409	23%	0.229	S	C	.	.	H	α-helix	trans	-58.4	-38.8	173.9	-67.3	-177.7	177.2	-178.4	0	111.9	I172 N173 A178 E179 L180 L298	I172-K176 PolarHBondContact O-N 2.75Å; N173-K176 PolarHBondContact O-N 3.11Å; K176-A178 PolarHBondContact O-N 3.44Å; K176-E179 PolarHBondContact O-N 2.89Å; K176-L180 WeakPolarHBondContact O-CB 3.46Å; K176-L180 PolarHBondContact O-N 3.46Å; K176-L298 HydrophobicContact CB-CD1 3.86Å; K176-L298 HydrophobicContact CB-CD2 4.15Å
177	A	94.7	Very high	93.7	Very high	14 Å²	14	51.9 Å²	51.9	12%	0.116	25%	0.249	C	C	.	.	H	α-helix	trans	-62.4	-40.9	176.8	0	0	0	0	0	112.4	N173 V175 E179 L180 I181 Y218 L298	N173-A177 WeakPolarHBondContact O-CB 3.39Å; N173-A177 PolarHBondContact O-N 3.06Å; V175-A177 VanDerWaalsContact C-N 3.28Å; V175-A177 PolarHBondContact O-N 3.29Å; A177-E179 PolarHBondContact O-N 3.17Å; A177-L180 PolarHBondContact O-N 2.98Å; A177-I181 WeakPolarHBondContact O-CD1 3.4Å; A177-I181 WeakPolarHBondContact O-CG1 3.34Å; A177-I181 PolarHBondContact O-N 3.48Å; A177-Y218 HydrophobicContact CB-CD2 4.42Å; A177-Y218 HydrophobicContact CB-CE2 3.97Å; A177-L298 VanDerWaalsContact CA-CD1 3.49Å; A177-L298 HydrophobicContact CB-CD1 3.86Å; A177-L298 VanDerWaalsContact N-CD1 3.35Å
178	A	93.9	Very high	93.5	Very high	2 Å²	2	53.2 Å²	53.2	2%	0.017	25%	0.254	C	S	.	.	H	α-helix	trans	-63.3	-39.4	176.6	0	0	0	0	0	112.5	K104 T105 S174 V175 K176 R182	K104-A178 HydrophobicContact CB-CB 4.01Å; K104-A178 HydrophobicContact CG-CB 3.65Å; T105-A178 HydrophobicContact CG2-CB 3.92Å; S174-A178 PolarHBondContact O-N 3.17Å; V175-A178 PolarHBondContact O-N 3.03Å; K176-A178 PolarHBondContact O-N 3.44Å; A178-R182 WeakPolarHBondContact O-CG 3.34Å; A178-R182 PolarHBondContact O-N 3.36Å
179	E	94.4	Very high	93.3	Very high	80 Å²	80	56.7 Å²	56.7	37%	0.374	28%	0.277	S	S	.	.	H	α-helix	trans	-72.5	-39.2	176.4	-165	55.9	-141.7	0	0	112.6	V175 K176 A177 I181 R182 V183	V175-E179 PolarHBondContact O-N 2.97Å; K176-E179 PolarHBondContact O-N 2.89Å; A177-E179 PolarHBondContact O-N 3.17Å; E179-I181 VanDerWaalsContact C-N 3.3Å; E179-I181 PolarHBondContact O-N 3.34Å; E179-R182 WeakPolarHBondContact O-CB 3.18Å; E179-R182 PolarHBondContact O-N 3.26Å; E179-R182 VanDerWaalsContact O-N 3.09Å; E179-R182 WeakPolarHBondContact OE2-CD 3.3Å; E179-R182 IonicContact OE2-CZ 3.01Å; E179-R182 IonicContact OE2-NE 2.85Å; E179-R182 IonicContact OE2-NH1 3.26Å; E179-R182 PolarHBondContact OE2-NH1 2.99Å; E179-V183 PolarHBondContact O-N 2.77Å
180	L	95.9	Very high	93.1	Very high	21 Å²	21	56.5 Å²	56.5	11%	0.11	28%	0.277	C	S	.	.	H	α-helix	trans	-58.8	-41.2	173	179.6	61.9	0	0	0	112	K176 A177 R182 V183 F184 P297 L298	K176-L180 WeakPolarHBondContact O-CB 3.46Å; K176-L180 PolarHBondContact O-N 3.46Å; A177-L180 PolarHBondContact O-N 2.98Å; L180-R182 VanDerWaalsContact C-N 3.34Å; L180-R182 PolarHBondContact O-N 3.38Å; L180-V183 PolarHBondContact O-N 3.46Å; L180-F184 HydrophobicContact CD1-CD2 4.23Å; L180-F184 HydrophobicContact CD1-CE2 3.63Å; L180-F184 HydrophobicContact CD1-CZ 3.91Å; L180-F184 HydrophobicContact CD2-CE2 4.03Å; L180-F184 HydrophobicContact CG-CD2 4.03Å; L180-F184 HydrophobicContact CG-CE2 3.57Å; L180-F184 HydrophobicContact CG-CZ 4.32Å; L180-F184 VanDerWaalsContact O-CD2 3.3Å; L180-F184 WeakPolarHBondContact O-CD2 3.42Å; L180-F184 PolarHBondContact O-N 3.43Å; L180-P297 HydrophobicContact CD2-CB 4.07Å; L180-P297 HydrophobicContact CD2-CG 3.43Å; L180-P297 VanDerWaalsContact CD2-CG 3.43Å; L180-L298 HydrophobicContact CD2-CD1 4.22Å; L180-L298 HydrophobicContact CD2-CD2 4.23Å; L180-L298 HydrophobicContact CD2-CG 4.05Å
181	I	96.4	Very high	93.3	Very high	9 Å²	9	53.1 Å²	53.1	5%	0.046	26%	0.259	C	S	.	.	H	α-helix	trans	-62	-41.2	174.7	-68.5	162.6	0	0	0	110.9	T105 L107 A177 E179 V183 F184 M185 Y218 I221	T105-I181 HydrophobicContact CG2-CB 3.79Å; T105-I181 HydrophobicContact CG2-CD1 4.02Å; T105-I181 HydrophobicContact CG2-CG2 3.66Å; L107-I181 HydrophobicContact CD1-CG2 3.79Å; A177-I181 WeakPolarHBondContact O-CD1 3.4Å; A177-I181 WeakPolarHBondContact O-CG1 3.34Å; A177-I181 PolarHBondContact O-N 3.48Å; E179-I181 VanDerWaalsContact C-N 3.3Å; E179-I181 PolarHBondContact O-N 3.34Å; I181-V183 VanDerWaalsContact C-N 3.34Å; I181-V183 PolarHBondContact O-N 3.31Å; I181-F184 CarbonylContact O-C 3.57Å; I181-F184 PolarHBondContact O-N 3.3Å; I181-F184 VanDerWaalsContact O-N 3.17Å; I181-M185 HydrophobicContact CG2-CG 4.34Å; I181-M185 HydrophobicContact CG2-SD 3.89Å; I181-M185 WeakPolarHBondContact O-CG 3.28Å; I181-M185 PolarHBondContact O-N 3.09Å; I181-Y218 HydrophobicContact CD1-CD2 4.14Å; I181-Y218 HydrophobicContact CD1-CE2 4.46Å; I181-I221 HydrophobicContact CD1-CD1 3.95Å; I181-I221 HydrophobicContact CG1-CD1 4.41Å; I181-I221 HydrophobicContact CG1-CG2 4.17Å; I181-I221 HydrophobicContact CG2-CD1 4.37Å; I181-I221 HydrophobicContact CG2-CG2 4.47Å
182	R	95.3	Very high	93.5	Very high	80 Å²	80	51.5 Å²	51.5	30%	0.302	25%	0.252	S	S	.	.	H	α-helix	trans	-63.6	-37.1	175.7	-69.2	160	172.3	-171.4	-7.6	112.5	K104 A178 E179 L180 M185 K186	K104-R182 PolarHBondContact O-NE 3.04Å; K104-R182 VanDerWaalsContact O-NE 3.16Å; K104-R182 PolarHBondContact O-NH2 3.06Å; A178-R182 WeakPolarHBondContact O-CG 3.34Å; A178-R182 PolarHBondContact O-N 3.36Å; E179-R182 WeakPolarHBondContact O-CB 3.18Å; E179-R182 PolarHBondContact O-N 3.26Å; E179-R182 VanDerWaalsContact O-N 3.09Å; E179-R182 WeakPolarHBondContact OE2-CD 3.3Å; E179-R182 IonicContact OE2-CZ 3.01Å; E179-R182 IonicContact OE2-NE 2.85Å; E179-R182 IonicContact OE2-NH1 3.26Å; E179-R182 PolarHBondContact OE2-NH1 2.99Å; L180-R182 VanDerWaalsContact C-N 3.34Å; L180-R182 PolarHBondContact O-N 3.38Å; R182-M185 PolarHBondContact O-N 2.72Å; R182-K186 WeakPolarHBondContact O-CG 3.31Å; R182-K186 PolarHBondContact O-N 3.38Å
183	V	94.9	Very high	93.8	Very high	61 Å²	61	47.5 Å²	47.5	37%	0.37	23%	0.232	S	C	.	.	H	α-helix	trans	-62.5	-43.8	172	175.1	0	0	0	0	110.6	E179 L180 I181 K186 R187	E179-V183 PolarHBondContact O-N 2.77Å; L180-V183 PolarHBondContact O-N 3.46Å; I181-V183 VanDerWaalsContact C-N 3.34Å; I181-V183 PolarHBondContact O-N 3.31Å; V183-K186 PolarHBondContact O-N 3.5Å; V183-R187 PolarHBondContact O-N 3.05Å
184	F	95.2	Very high	94.1	Very high	26 Å²	26	44.8 Å²	44.8	11%	0.114	22%	0.218	C	C	.	.	H	α-helix	trans	-66.4	-36.2	174.8	-69	-49.6	0	0	0	113.5	L180 I181 R187 Y188 L191 V225 I267	L180-F184 HydrophobicContact CD1-CD2 4.23Å; L180-F184 HydrophobicContact CD1-CE2 3.63Å; L180-F184 HydrophobicContact CD1-CZ 3.91Å; L180-F184 HydrophobicContact CD2-CE2 4.03Å; L180-F184 HydrophobicContact CG-CD2 4.03Å; L180-F184 HydrophobicContact CG-CE2 3.57Å; L180-F184 HydrophobicContact CG-CZ 4.32Å; L180-F184 VanDerWaalsContact O-CD2 3.3Å; L180-F184 WeakPolarHBondContact O-CD2 3.42Å; L180-F184 PolarHBondContact O-N 3.43Å; I181-F184 CarbonylContact O-C 3.57Å; I181-F184 PolarHBondContact O-N 3.3Å; I181-F184 VanDerWaalsContact O-N 3.17Å; F184-R187 PolarHBondContact O-N 2.87Å; F184-Y188 WeakPolarHBondContact O-CB 3.42Å; F184-Y188 PolarHBondContact O-N 3.48Å; F184-L191 HydrophobicContact CB-CD2 3.88Å; F184-V225 HydrophobicContact CB-CG2 3.8Å; F184-V225 HydrophobicContact CD1-CG1 3.72Å; F184-V225 HydrophobicContact CD1-CG2 4.18Å; F184-V225 HydrophobicContact CD2-CG1 4.27Å; F184-V225 HydrophobicContact CD2-CG2 3.83Å; F184-V225 HydrophobicContact CE1-CG1 3.66Å; F184-V225 HydrophobicContact CE2-CG1 4.18Å; F184-V225 HydrophobicContact CE2-CG2 4.43Å; F184-V225 HydrophobicContact CG-CG1 4.05Å; F184-V225 HydrophobicContact CG-CG2 3.7Å; F184-V225 HydrophobicContact CZ-CG1 3.9Å; F184-I267 HydrophobicContact CE2-CD1 3.9Å; F184-I267 HydrophobicContact CZ-CD1 3.92Å
185	M	94.1	Very high	94.6	Very high	46 Å²	46	43.6 Å²	43.6	23%	0.227	21%	0.209	C	C	.	.	H	α-helix	trans	-64.8	-39	173.5	-69.6	164.8	67.8	0	0	112.1	L107 I181 R182 Y188 L191 P192	L107-M185 HydrophobicContact CD1-CG 4.41Å; L107-M185 HydrophobicContact CD1-SD 3.77Å; L107-M185 HydrophobicContact CD2-CE 3.98Å; L107-M185 HydrophobicContact CD2-SD 4.29Å; L107-M185 HydrophobicContact CG-CE 4.19Å; L107-M185 HydrophobicContact CG-SD 3.99Å; I181-M185 HydrophobicContact CG2-CG 4.34Å; I181-M185 HydrophobicContact CG2-SD 3.89Å; I181-M185 WeakPolarHBondContact O-CG 3.28Å; I181-M185 PolarHBondContact O-N 3.09Å; R182-M185 PolarHBondContact O-N 2.72Å; M185-Y188 CarbonylContact O-C 3.57Å; M185-Y188 VanDerWaalsContact O-C 3.22Å; M185-Y188 PolarHBondContact O-N 3.49Å; M185-L191 HydrophobicContact CG-CD2 4.28Å; M185-P192 HydrophobicContact CE-CG 4.19Å; M185-P192 HydrophobicContact CG-CG 4.44Å
186	K	93	Very high	94.9	Very high	159 Å²	159	42.2 Å²	42.2	69%	0.691	20%	0.201	S	C	*	.	H	α-helix	trans	-65.7	-38	173	-71.7	168.1	-177.2	168.9	0	112.1	R182 V183	R182-K186 WeakPolarHBondContact O-CG 3.31Å; R182-K186 PolarHBondContact O-N 3.38Å; V183-K186 PolarHBondContact O-N 3.5Å
187	R	91.6	Very high	95.1	Very high	143 Å²	143	37.8 Å²	37.8	54%	0.54	18%	0.182	S	C	.	.	H	α-helix	trans	-74.2	-32.2	177.3	-177.4	59.4	179.8	-175.2	3.8	112.8	V183 F184	V183-R187 PolarHBondContact O-N 3.05Å; F184-R187 PolarHBondContact O-N 2.87Å
188	Y	93.2	Very high	95.3	Very high	27 Å²	27	37.1 Å²	37.1	11%	0.106	18%	0.176	C	C	.	.			trans	-132.6	78.9	-177.1	-58.3	-70.7	0	0	0	111.2	F184 M185 C190 L191 L228 Q229 L232	F184-Y188 WeakPolarHBondContact O-CB 3.42Å; F184-Y188 PolarHBondContact O-N 3.48Å; M185-Y188 CarbonylContact O-C 3.57Å; M185-Y188 VanDerWaalsContact O-C 3.22Å; M185-Y188 PolarHBondContact O-N 3.49Å; Y188-C190 PolarHBondContact O-N 2.89Å; Y188-L191 WeakPolarHBondContact O-CB 3.43Å; Y188-L191 PolarHBondContact O-N 3.26Å; Y188-L228 HydrophobicContact CD1-CB 3.97Å; Y188-L228 HydrophobicContact CD1-CD1 4.34Å; Y188-L228 HydrophobicContact CE1-CB 4.01Å; Y188-L228 HydrophobicContact CG-CB 4.27Å; Y188-L228 HydrophobicContact CG-CD1 4.07Å; Y188-Q229 HydrophobicContact CE2-CG 4.46Å; Y188-Q229 VanDerWaalsContact OH-CG 3.31Å; Y188-Q229 WeakPolarHBondContact OH-CG 3.09Å; Y188-L232 HydrophobicContact CD1-CD1 3.96Å; Y188-L232 HydrophobicContact CE1-CD1 4.33Å
189	P	92.8	Very high	95.4	Very high	76 Å²	76	37.5 Å²	37.5	49%	0.494	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-18.1	176.6	-29.1	32.2	0	0	0	116.3	P192 V238	P189-P192 WeakPolarHBondContact O-CD 3.43Å; P189-V238 HydrophobicContact CB-CG1 3.96Å; P189-V238 HydrophobicContact CG-CG1 4.06Å
190	C	93.5	Very high	95.6	Very high	6 Å²	6	34.2 Å²	34.2	4%	0.041	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-9.2	172.7	62.8	0	0	0	0	114.7	Y188 C193 L194 L243	Y188-C190 PolarHBondContact O-N 2.89Å; C190-C193 WeakPolarHBondContact O-CB 3.34Å; C190-C193 PolarHBondContact O-N 2.82Å; C190-L194 PolarHBondContact O-N 3.27Å; C190-L243 HydrophobicContact CB-CD2 3.77Å
191	L	95.7	Very high	95.6	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-58.9	-43.1	-179.9	177.4	64.2	0	0	0	113.2	F184 M185 Y188 C193 L194 V195 I221 C224 V225 L228	F184-L191 HydrophobicContact CB-CD2 3.88Å; M185-L191 HydrophobicContact CG-CD2 4.28Å; Y188-L191 WeakPolarHBondContact O-CB 3.43Å; Y188-L191 PolarHBondContact O-N 3.26Å; L191-C193 VanDerWaalsContact C-N 3.29Å; L191-C193 PolarHBondContact O-N 3.43Å; L191-L194 PolarHBondContact O-N 3.18Å; L191-V195 HydrophobicContact CD1-CG2 3.74Å; L191-V195 HydrophobicContact CG-CG2 4.09Å; L191-V195 WeakPolarHBondContact O-CB 3.33Å; L191-V195 VanDerWaalsContact O-CG2 3.27Å; L191-V195 WeakPolarHBondContact O-CG2 3.38Å; L191-V195 PolarHBondContact O-N 2.83Å; L191-I221 HydrophobicContact CD2-CG2 4.44Å; L191-C224 HydrophobicContact CD1-CB 3.47Å; L191-C224 VanDerWaalsContact CD1-CB 3.47Å; L191-V225 HydrophobicContact CD1-CG2 4.17Å; L191-V225 HydrophobicContact CD2-CG2 3.84Å; L191-L228 HydrophobicContact CB-CD1 4.03Å; L191-L228 HydrophobicContact CD1-CD1 4.02Å
192	P	95.9	Very high	95.6	Very high	22 Å²	22	32.9 Å²	32.9	14%	0.143	16%	0.155	C	C	.	.	H	α-helix	trans	-57.1	-41.9	176.2	-25.1	36.2	0	0	0	112.4	L107 M185 P189 L194 V195 F196	L107-P192 HydrophobicContact CD2-CB 3.82Å; L107-P192 HydrophobicContact CD2-CG 4.17Å; M185-P192 HydrophobicContact CE-CG 4.19Å; M185-P192 HydrophobicContact CG-CG 4.44Å; P189-P192 WeakPolarHBondContact O-CD 3.43Å; P192-L194 PolarHBondContact O-N 2.95Å; P192-V195 PolarHBondContact O-N 3.16Å; P192-F196 HydrophobicContact CB-CD2 4.26Å; P192-F196 HydrophobicContact CB-CE2 4.33Å; P192-F196 VanDerWaalsContact O-CD2 3.24Å; P192-F196 WeakPolarHBondContact O-CD2 3.29Å; P192-F196 PolarHBondContact O-N 2.79Å
193	C	95.6	Very high	95.5	Very high	11 Å²	11	31.7 Å²	31.7	7%	0.074	15%	0.154	C	C	.	.	H	α-helix	trans	-55.5	-49.4	179.8	-44.8	0	0	0	0	111.7	I60 L64 C190 L191 V197 L243	I60-C193 HydrophobicContact CG2-CB 4.19Å; L64-C193 HydrophobicContact CD2-CB 4.46Å; C190-C193 WeakPolarHBondContact O-CB 3.34Å; C190-C193 PolarHBondContact O-N 2.82Å; L191-C193 VanDerWaalsContact C-N 3.29Å; L191-C193 PolarHBondContact O-N 3.43Å; C193-V197 WeakPolarHBondContact O-CB 3.45Å; C193-V197 VanDerWaalsContact O-CG2 3.25Å; C193-V197 WeakPolarHBondContact O-CG2 3.23Å; C193-V197 PolarHBondContact O-N 3.49Å; C193-L243 HydrophobicContact CB-CD1 4.01Å; C193-L243 HydrophobicContact CB-CD2 3.81Å; C193-L243 HydrophobicContact CB-CG 4.48Å
194	L	97.1	Very high	95.4	Very high	3 Å²	3	31.2 Å²	31.2	2%	0.016	15%	0.148	C	C	.	.	H	α-helix	trans	-66.6	-45	176.8	-66.9	-179.9	0	0	0	111.4	C190 L191 P192 V197 L198 F227 L228 L246 L247	C190-L194 PolarHBondContact O-N 3.27Å; L191-L194 PolarHBondContact O-N 3.18Å; P192-L194 PolarHBondContact O-N 2.95Å; L194-V197 PolarHBondContact O-N 2.85Å; L194-L198 HydrophobicContact CB-CD1 4.29Å; L194-L198 VanDerWaalsContact O-CB 3.29Å; L194-L198 WeakPolarHBondContact O-CB 3.35Å; L194-L198 WeakPolarHBondContact O-CD1 3.39Å; L194-L198 WeakPolarHBondContact O-CG 3.21Å; L194-L198 PolarHBondContact O-N 3.15Å; L194-F227 HydrophobicContact CD1-CD1 4.15Å; L194-F227 HydrophobicContact CD1-CE1 4.14Å; L194-L228 HydrophobicContact CD1-CD1 4.39Å; L194-L228 HydrophobicContact CD1-CD2 3.9Å; L194-L228 HydrophobicContact CD1-CG 4.29Å; L194-L246 HydrophobicContact CD1-CB 4.46Å; L194-L246 HydrophobicContact CD1-CD1 4.39Å; L194-L246 HydrophobicContact CD2-CB 4.19Å; L194-L247 HydrophobicContact CD2-CB 4.26Å; L194-L247 HydrophobicContact CD2-CD1 4.26Å
195	V	98.1	Very high	95.3	Very high	1 Å²	1	31 Å²	31	1%	0.006	15%	0.146	C	C	.	.	H	α-helix	trans	-64.2	-43.7	-176.4	171.9	0	0	0	0	111.8	L107 L191 P192 L198 K199 I221 C224	L107-V195 HydrophobicContact CD1-CG1 4.28Å; L191-V195 HydrophobicContact CD1-CG2 3.74Å; L191-V195 HydrophobicContact CG-CG2 4.09Å; L191-V195 WeakPolarHBondContact O-CB 3.33Å; L191-V195 VanDerWaalsContact O-CG2 3.27Å; L191-V195 WeakPolarHBondContact O-CG2 3.38Å; L191-V195 PolarHBondContact O-N 2.83Å; P192-V195 PolarHBondContact O-N 3.16Å; V195-L198 PolarHBondContact O-N 2.94Å; V195-K199 HydrophobicContact CG1-CD 4.02Å; V195-K199 HydrophobicContact CG1-CG 4.18Å; V195-K199 VanDerWaalsContact O-CB 3.26Å; V195-K199 WeakPolarHBondContact O-CB 3.36Å; V195-K199 VanDerWaalsContact O-CG 3.23Å; V195-K199 WeakPolarHBondContact O-CG 3.4Å; V195-K199 PolarHBondContact O-N 3.24Å; V195-I221 HydrophobicContact CG1-CD1 4.31Å; V195-I221 HydrophobicContact CG1-CG1 3.88Å; V195-I221 HydrophobicContact CG2-CG1 3.82Å; V195-C224 HydrophobicContact CG2-CB 4.28Å
196	F	98	Very high	95.2	Very high	5 Å²	5	32.9 Å²	32.9	2%	0.022	17%	0.165	C	C	.	.	H	α-helix	trans	-63.2	-46.8	177.8	-84.5	-69.6	0	0	0	112.1	F63 L64 I67 L107 Y108 L109 P192 K199 Q200	F63-F196 HydrophobicContact CE1-CB 4.29Å; L64-F196 HydrophobicContact CD1-CB 4.3Å; L64-F196 HydrophobicContact CD1-CD2 3.38Å; L64-F196 HydrophobicContact CD1-CE2 3.97Å; L64-F196 HydrophobicContact CD1-CG 4.07Å; I67-F196 HydrophobicContact CG2-CB 3.89Å; I67-F196 HydrophobicContact CG2-CD1 3.77Å; I67-F196 HydrophobicContact CG2-CE1 4.5Å; I67-F196 HydrophobicContact CG2-CG 3.93Å; L107-F196 HydrophobicContact CD2-CD2 4.43Å; L107-F196 HydrophobicContact CD2-CE2 3.83Å; L107-F196 HydrophobicContact CD2-CZ 4.35Å; Y108-F196 WeakPolarHBondContact O-CE1 3.25Å; L109-F196 HydrophobicContact CD2-CD1 3.99Å; P192-F196 HydrophobicContact CB-CD2 4.26Å; P192-F196 HydrophobicContact CB-CE2 4.33Å; P192-F196 VanDerWaalsContact O-CD2 3.24Å; P192-F196 WeakPolarHBondContact O-CD2 3.29Å; P192-F196 PolarHBondContact O-N 2.79Å; F196-K199 PolarHBondContact O-N 2.78Å; F196-Q200 PolarHBondContact O-N 3.42Å; F196-Q200 VanDerWaalsContact O-N 3.09Å
197	V	98	Very high	95.3	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.006	14%	0.137	C	C	.	.	H	α-helix	trans	-58.1	-51.5	176.1	166.6	0	0	0	0	110.5	I60 F63 C193 L194 K199 Q200 F201 L247 L345 I349	I60-V197 HydrophobicContact CG1-CG2 4.47Å; I60-V197 HydrophobicContact CG2-CG2 4.19Å; F63-V197 HydrophobicContact CD1-CG2 3.62Å; F63-V197 HydrophobicContact CE1-CB 4.34Å; F63-V197 HydrophobicContact CE1-CG2 3.7Å; C193-V197 WeakPolarHBondContact O-CB 3.45Å; C193-V197 VanDerWaalsContact O-CG2 3.25Å; C193-V197 WeakPolarHBondContact O-CG2 3.23Å; C193-V197 PolarHBondContact O-N 3.49Å; L194-V197 PolarHBondContact O-N 2.85Å; V197-K199 PolarHBondContact O-N 3.34Å; V197-Q200 PolarHBondContact O-N 3.23Å; V197-F201 VanDerWaalsContact O-CB 3.29Å; V197-F201 WeakPolarHBondContact O-CB 3.19Å; V197-F201 PolarHBondContact O-N 2.92Å; V197-L247 HydrophobicContact CG1-CD1 3.56Å; V197-L247 HydrophobicContact CG1-CD2 3.75Å; V197-L247 HydrophobicContact CG1-CG 4.32Å; V197-L345 HydrophobicContact CG1-CD1 4.14Å; V197-L345 HydrophobicContact CG2-CD2 4.45Å; V197-I349 HydrophobicContact CB-CD1 4.23Å; V197-I349 HydrophobicContact CG1-CD1 3.58Å; V197-I349 WeakPolarHBondContact O-CD1 3.47Å
198	L	98.4	Very high	95.4	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-71.8	-31.4	-175.9	-66.3	164.7	0	0	0	113.1	L194 V195 L202 L220 C224 L247 F250 F251 F318	L194-L198 HydrophobicContact CB-CD1 4.29Å; L194-L198 VanDerWaalsContact O-CB 3.29Å; L194-L198 WeakPolarHBondContact O-CB 3.35Å; L194-L198 WeakPolarHBondContact O-CD1 3.39Å; L194-L198 WeakPolarHBondContact O-CG 3.21Å; L194-L198 PolarHBondContact O-N 3.15Å; V195-L198 PolarHBondContact O-N 2.94Å; L198-L202 WeakPolarHBondContact O-CG 3.23Å; L198-L202 PolarHBondContact O-N 3.13Å; L198-L202 VanDerWaalsContact O-N 3.08Å; L198-L220 HydrophobicContact CB-CD1 3.81Å; L198-L220 HydrophobicContact CB-CD2 4Å; L198-L220 HydrophobicContact CB-CG 4.4Å; L198-L220 HydrophobicContact CD1-CD1 4.21Å; L198-C224 VanDerWaalsContact CD1-SG 3.57Å; L198-L247 HydrophobicContact CD2-CD1 4.33Å; L198-F250 HydrophobicContact CD1-CD1 3.74Å; L198-F250 HydrophobicContact CD1-CD2 4.09Å; L198-F250 HydrophobicContact CD1-CE1 3.48Å; L198-F250 VanDerWaalsContact CD1-CE1 3.48Å; L198-F250 HydrophobicContact CD1-CE2 3.81Å; L198-F250 HydrophobicContact CD1-CG 4.07Å; L198-F250 HydrophobicContact CD1-CZ 3.51Å; L198-F250 HydrophobicContact CD2-CD1 3.76Å; L198-F250 HydrophobicContact CD2-CE1 3.55Å; L198-F250 HydrophobicContact CD2-CZ 4.36Å; L198-F250 HydrophobicContact CG-CD1 4.41Å; L198-F250 HydrophobicContact CG-CE1 4.16Å; L198-F251 HydrophobicContact CD2-CD1 4.19Å; L198-F251 HydrophobicContact CD2-CE1 3.36Å; L198-F251 HydrophobicContact CD2-CE2 4.41Å; L198-F251 HydrophobicContact CD2-CZ 3.5Å; L198-F318 HydrophobicContact CD2-CE1 4.4Å
199	K	97.5	Very high	95.3	Very high	10 Å²	10	23.9 Å²	23.9	4%	0.043	13%	0.134	C	C	.	.	H	α-helix	trans	-63.3	-49.7	171.2	-79.8	-172.4	179.4	-158.5	0	111.3	L107 L109 V195 F196 V197 F201 L202 L203 S217 L220	L107-K199 PolarHBondContact O-NZ 3.22Å; L109-K199 HydrophobicContact CD1-CB 3.9Å; L109-K199 HydrophobicContact CD2-CB 4.5Å; L109-K199 HydrophobicContact CG-CB 4.23Å; V195-K199 HydrophobicContact CG1-CD 4.02Å; V195-K199 HydrophobicContact CG1-CG 4.18Å; V195-K199 VanDerWaalsContact O-CB 3.26Å; V195-K199 WeakPolarHBondContact O-CB 3.36Å; V195-K199 VanDerWaalsContact O-CG 3.23Å; V195-K199 WeakPolarHBondContact O-CG 3.4Å; V195-K199 PolarHBondContact O-N 3.24Å; F196-K199 PolarHBondContact O-N 2.78Å; V197-K199 PolarHBondContact O-N 3.34Å; K199-F201 VanDerWaalsContact C-N 3.33Å; K199-F201 PolarHBondContact O-N 3.09Å; K199-L202 PolarHBondContact O-N 3.13Å; K199-L203 VanDerWaalsContact O-CB 3.31Å; K199-L203 WeakPolarHBondContact O-CB 3.42Å; K199-L203 PolarHBondContact O-N 3.08Å; K199-S217 WeakPolarHBondContact CE-OG 3.33Å; K199-S217 PolarHBondContact NZ-OG 2.84Å; K199-S217 VanDerWaalsContact NZ-OG 3.09Å; K199-L220 HydrophobicContact CB-CD2 4.45Å; K199-L220 HydrophobicContact CG-CD2 3.64Å
200	Q	96.7	Very high	95.3	Very high	11 Å²	11	22.4 Å²	22.4	5%	0.051	12%	0.124	C	C	.	.	H	α-helix	trans	-64.7	-40.1	178.8	-175.5	60	23.2	0	0	111.4	F63 L109 F196 V197 L202 L203 Q204 I349 R350 I351	F63-Q200 HydrophobicContact CE2-CG 4.44Å; F63-Q200 HydrophobicContact CZ-CB 3.88Å; F63-Q200 HydrophobicContact CZ-CG 4.19Å; L109-Q200 HydrophobicContact CD2-CB 4.47Å; F196-Q200 PolarHBondContact O-N 3.42Å; F196-Q200 VanDerWaalsContact O-N 3.09Å; V197-Q200 PolarHBondContact O-N 3.23Å; Q200-L202 VanDerWaalsContact C-N 3.31Å; Q200-L202 PolarHBondContact O-N 2.94Å; Q200-L203 PolarHBondContact O-N 3.34Å; Q200-Q204 WeakPolarHBondContact O-CG 3.49Å; Q200-Q204 PolarHBondContact O-N 3.22Å; Q200-Q204 VanDerWaalsContact O-N 3.08Å; Q200-I349 HydrophobicContact CB-CG2 4.35Å; Q200-I349 HydrophobicContact CG-CG2 3.66Å; Q200-R350 PolarHBondContact NE2-O 3.05Å; Q200-I351 HydrophobicContact CG-CD1 3.94Å
201	F	96.7	Very high	94.9	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-56.3	-41.6	175.3	178	-88.8	0	0	0	113.1	V197 K199 R205 F251 A317 F318 A321 I348 I349	V197-F201 VanDerWaalsContact O-CB 3.29Å; V197-F201 WeakPolarHBondContact O-CB 3.19Å; V197-F201 PolarHBondContact O-N 2.92Å; K199-F201 VanDerWaalsContact C-N 3.33Å; K199-F201 PolarHBondContact O-N 3.09Å; F201-R205 VanDerWaalsContact CE2-NH1 3.28Å; F201-R205 WeakPolarHBondContact O-CD 3.44Å; F201-R205 PolarHBondContact O-NH1 3.08Å; F201-F251 HydrophobicContact CD1-CE1 4.23Å; F201-F251 HydrophobicContact CD1-CZ 4.5Å; F201-F251 HydrophobicContact CD2-CE1 4.5Å; F201-F251 HydrophobicContact CD2-CZ 4.1Å; F201-F251 HydrophobicContact CE1-CE1 4.24Å; F201-F251 HydrophobicContact CE2-CE1 4.49Å; F201-F251 HydrophobicContact CE2-CZ 4.35Å; F201-F251 HydrophobicContact CG-CE1 4.39Å; F201-F251 HydrophobicContact CG-CZ 4.2Å; F201-F251 HydrophobicContact CZ-CE1 4.39Å; F201-A317 HydrophobicContact CE1-CB 3.85Å; F201-A317 HydrophobicContact CZ-CB 4Å; F201-A317 VanDerWaalsContact CZ-O 3.32Å; F201-A317 WeakPolarHBondContact CZ-O 3.38Å; F201-F318 HydrophobicContact CD1-CD1 4.31Å; F201-F318 HydrophobicContact CD1-CE1 4.15Å; F201-F318 AromaticContact CE1-CD1 3.83Å; F201-F318 HydrophobicContact CE1-CD1 3.83Å; F201-F318 HydrophobicContact CE1-CE1 4.07Å; F201-A321 HydrophobicContact CD2-CB 4.5Å; F201-A321 HydrophobicContact CE2-CB 3.6Å; F201-A321 HydrophobicContact CZ-CB 3.74Å; F201-I348 HydrophobicContact CD2-CB 4.12Å; F201-I348 HydrophobicContact CD2-CD1 4.12Å; F201-I348 HydrophobicContact CE2-CB 4.08Å; F201-I349 HydrophobicContact CB-CD1 4.11Å; F201-I349 HydrophobicContact CB-CG1 4.01Å; F201-I349 HydrophobicContact CD2-CG1 4.36Å
202	L	96.3	Very high	94.7	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.01	17%	0.173	C	C	.	.	H	α-helix	trans	-79.2	-38.2	177.7	-69	167.1	0	0	0	112.3	L198 K199 Q200 R205 S206 L207 N208 L215 L220 I314 F318	L198-L202 WeakPolarHBondContact O-CG 3.23Å; L198-L202 PolarHBondContact O-N 3.13Å; L198-L202 VanDerWaalsContact O-N 3.08Å; K199-L202 PolarHBondContact O-N 3.13Å; Q200-L202 VanDerWaalsContact C-N 3.31Å; Q200-L202 PolarHBondContact O-N 2.94Å; L202-R205 CarbonylContact O-C 3.56Å; L202-R205 PolarHBondContact O-N 3.39Å; L202-R205 VanDerWaalsContact O-N 3.14Å; L202-S206 PolarHBondContact O-N 3.15Å; L202-L207 HydrophobicContact CB-CB 4.39Å; L202-L207 HydrophobicContact CD2-CB 3.73Å; L202-L207 HydrophobicContact CD2-CD1 4.41Å; L202-L207 PolarHBondContact O-N 2.74Å; L202-N208 HydrophobicContact CB-CB 4.29Å; L202-L215 HydrophobicContact CD1-CB 4.19Å; L202-L215 HydrophobicContact CD1-CD2 3.87Å; L202-L220 HydrophobicContact CD1-CD1 4.19Å; L202-L220 HydrophobicContact CD1-CD2 4.15Å; L202-I314 HydrophobicContact CD2-CG2 4.38Å; L202-F318 HydrophobicContact CD1-CZ 4.49Å; L202-F318 HydrophobicContact CD2-CE1 4.05Å; L202-F318 HydrophobicContact CD2-CZ 4.35Å; L202-F318 HydrophobicContact CG-CE1 4.46Å
203	L	94	Very high	94.5	Very high	55 Å²	55	33.1 Å²	33.1	29%	0.288	17%	0.166	S	C	.	.	H	α-helix	trans	-59.3	-48.7	179.5	178	62.2	0	0	0	112	L109 K199 Q200 R205 S206 N208	L109-L203 HydrophobicContact CD1-CB 4.38Å; L109-L203 HydrophobicContact CD1-CD2 3.63Å; K199-L203 VanDerWaalsContact O-CB 3.31Å; K199-L203 WeakPolarHBondContact O-CB 3.42Å; K199-L203 PolarHBondContact O-N 3.08Å; Q200-L203 PolarHBondContact O-N 3.34Å; L203-R205 PolarHBondContact O-N 2.94Å; L203-S206 PolarHBondContact O-N 3.43Å; L203-N208 WeakPolarHBondContact CA-OD1 3.49Å
204	Q	92.8	Very high	94.5	Very high	52 Å²	52	32.6 Å²	32.6	24%	0.243	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-2	179.6	74.7	177.8	63.8	0	0	114.5	Q200 I348 R350	Q200-Q204 WeakPolarHBondContact O-CG 3.49Å; Q200-Q204 PolarHBondContact O-N 3.22Å; Q200-Q204 VanDerWaalsContact O-N 3.08Å; Q204-I348 PolarHBondContact NE2-O 3.03Å; Q204-R350 PolarHBondContact OE1-O 2.79Å
205	R	91.9	Very high	94.4	Very high	20 Å²	20	32.6 Å²	32.6	8%	0.075	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.1	5.4	176.1	-67.5	172.4	179	74.9	3.2	111.9	F201 L202 L203 L207 I348	F201-R205 VanDerWaalsContact CE2-NH1 3.28Å; F201-R205 WeakPolarHBondContact O-CD 3.44Å; F201-R205 PolarHBondContact O-NH1 3.08Å; L202-R205 CarbonylContact O-C 3.56Å; L202-R205 PolarHBondContact O-N 3.39Å; L202-R205 VanDerWaalsContact O-N 3.14Å; L203-R205 PolarHBondContact O-N 2.94Å; R205-L207 HydrophobicContact CB-CB 4.49Å; R205-L207 HydrophobicContact CB-CD1 4.1Å; R205-L207 HydrophobicContact CB-CG 4.08Å; R205-L207 PolarHBondContact O-N 3.42Å; R205-L207 VanDerWaalsContact O-N 3.15Å; R205-I348 PolarHBondContact NH1-O 3.03Å; R205-I348 PolarHBondContact NH2-O 3.09Å
206	S	92.8	Very high	94.3	Very high	87 Å²	87	33.6 Å²	33.6	61%	0.608	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.4	22.4	-172.9	-53.2	0	0	0	0	114.5	L202 L203	L202-S206 PolarHBondContact O-N 3.15Å; L203-S206 PolarHBondContact O-N 3.43Å
207	L	94.7	Very high	94.2	Very high	21 Å²	21	36 Å²	36	11%	0.11	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.3	10	-178.5	-68.4	178.3	0	0	0	113.1	L202 R205 G214 L215 Q313 I314 A317	L202-L207 HydrophobicContact CB-CB 4.39Å; L202-L207 HydrophobicContact CD2-CB 3.73Å; L202-L207 HydrophobicContact CD2-CD1 4.41Å; L202-L207 PolarHBondContact O-N 2.74Å; R205-L207 HydrophobicContact CB-CB 4.49Å; R205-L207 HydrophobicContact CB-CD1 4.1Å; R205-L207 HydrophobicContact CB-CG 4.08Å; R205-L207 PolarHBondContact O-N 3.42Å; R205-L207 VanDerWaalsContact O-N 3.15Å; L207-G214 CarbonylContact O-C 3.55Å; L207-G214 WeakPolarHBondContact O-CA 3.24Å; L207-L215 PolarHBondContact O-N 3.35Å; L207-Q313 HydrophobicContact CD2-CB 4.36Å; L207-I314 HydrophobicContact CB-CG1 4.33Å; L207-I314 HydrophobicContact CD1-CG1 4.31Å; L207-I314 HydrophobicContact CD2-CG1 4.35Å; L207-A317 HydrophobicContact CD1-CB 3.97Å
208	N	93.1	Very high	94.1	Very high	40 Å²	40	37.9 Å²	37.9	21%	0.214	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-12.9	176.4	69.8	-72.1	0	0	0	113.6	L202 L203 L215	L202-N208 HydrophobicContact CB-CB 4.29Å; L203-N208 WeakPolarHBondContact CA-OD1 3.49Å; N208-L215 CarbonylContact C-O 3.6Å
209	E	91.7	Very high	94	Very high	78 Å²	78	37.9 Å²	37.9	36%	0.364	20%	0.195	S	C	.	.			trans	-91.4	118.7	-172.3	-74.9	-52.8	133.1	0	0	112.3	W211 T212 G214	E209-W211 VanDerWaalsContact C-N 3.3Å; E209-W211 PolarHBondContact O-N 2.84Å; E209-W211 PolarHBondContact OE2-NE1 3.44Å; E209-T212 WeakPolarHBondContact CB-OG1 3.16Å; E209-T212 PolarHBondContact O-N 3.41Å; E209-T212 PolarHBondContact O-OG1 3.04Å; E209-T212 VanDerWaalsContact O-OG1 3.05Å; E209-G214 WeakPolarHBondContact O-CA 3.45Å; E209-G214 PolarHBondContact O-N 3.46Å
210	V	92.1	Very high	94.1	Very high	46 Å²	46	37.6 Å²	37.6	28%	0.279	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-69.9	-30	-173.7	-174.9	0	0	0	0	112.3	T212 G213 R307	V210-T212 VanDerWaalsContact C-N 3.34Å; V210-G213 PolarHBondContact O-N 3.06Å; V210-R307 HydrophobicContact CG1-CB 3.44Å; V210-R307 VanDerWaalsContact CG1-CB 3.44Å; V210-R307 HydrophobicContact CG1-CG 4.22Å
211	W	86.8	Confident	94.1	Very high	199 Å²	199	37.2 Å²	37.2	75%	0.754	19%	0.192	S	C	*	.	G	3₁₀ helix	trans	-76.9	-19.4	-177.4	71.4	-88	0	0	0	113.3	E209 Y309	E209-W211 VanDerWaalsContact C-N 3.3Å; E209-W211 PolarHBondContact O-N 2.84Å; E209-W211 PolarHBondContact OE2-NE1 3.44Å; W211-Y309 PolarHBondContact O-OH 2.94Å
212	T	90.2	Very high	94.2	Very high	53 Å²	53	37.2 Å²	37.2	33%	0.325	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-95.7	5.9	170.4	59.4	0	0	0	0	113	E209 V210 Y309 C310	E209-T212 WeakPolarHBondContact CB-OG1 3.16Å; E209-T212 PolarHBondContact O-N 3.41Å; E209-T212 PolarHBondContact O-OG1 3.04Å; E209-T212 VanDerWaalsContact O-OG1 3.05Å; V210-T212 VanDerWaalsContact C-N 3.34Å; T212-Y309 VanDerWaalsContact C-CZ 3.48Å; T212-Y309 PolarHBondContact O-OH 3.06Å; T212-C310 PolarHBondContact O-SG 3.1Å
213	G	92.6	Very high	94.3	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.6	6.5	-179.7	0	0	0	0	0	115.3	V210 R307 S308 Y309 C310	V210-G213 PolarHBondContact O-N 3.06Å; G213-R307 WeakPolarHBondContact CA-O 3.43Å; G213-S308 CarbonylContact O-C 3.49Å; G213-S308 WeakPolarHBondContact O-CA 3.48Å; G213-Y309 VanDerWaalsContact CA-CZ 3.41Å; G213-Y309 PolarHBondContact N-OH 3.46Å; G213-Y309 PolarHBondContact O-N 3.09Å; G213-C310 VanDerWaalsContact O-CB 3.28Å; G213-C310 WeakPolarHBondContact O-CB 3.42Å; G213-C310 PolarHBondContact O-N 3.09Å
214	G	94.8	Very high	94.5	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.01	18%	0.178	C	C	.	.			trans	-71.4	-177.7	175.9	0	0	0	0	0	114.7	L207 E209 S308	L207-G214 CarbonylContact O-C 3.55Å; L207-G214 WeakPolarHBondContact O-CA 3.24Å; E209-G214 WeakPolarHBondContact O-CA 3.45Å; E209-G214 PolarHBondContact O-N 3.46Å; G214-S308 WeakPolarHBondContact O-CA 3.41Å; G214-S308 WeakPolarHBondContact O-CB 3.28Å; G214-S308 PolarHBondContact O-OG 3.18Å
215	L	96.2	Very high	94.7	Very high	3 Å²	3	32 Å²	32	2%	0.016	17%	0.166	C	C	.	.			trans	-93.8	121.9	-176.2	-170.5	65.8	0	0	0	111.4	L202 L207 N208 A219 L220 M223 L292 I314 F318	L202-L215 HydrophobicContact CD1-CB 4.19Å; L202-L215 HydrophobicContact CD1-CD2 3.87Å; L207-L215 PolarHBondContact O-N 3.35Å; N208-L215 CarbonylContact C-O 3.6Å; L215-A219 HydrophobicContact CD1-CB 3.56Å; L215-A219 HydrophobicContact CG-CB 4.21Å; L215-L220 HydrophobicContact CD2-CB 3.82Å; L215-L220 HydrophobicContact CD2-CD1 3.9Å; L215-L220 HydrophobicContact CD2-CG 4.45Å; L215-L220 HydrophobicContact CG-CB 4.21Å; L215-M223 HydrophobicContact CD1-SD 4.09Å; L215-M223 HydrophobicContact CD2-SD 3.87Å; L215-L292 HydrophobicContact CD1-CD2 3.48Å; L215-L292 VanDerWaalsContact CD1-CD2 3.48Å; L215-I314 HydrophobicContact CB-CD1 3.9Å; L215-F318 HydrophobicContact CD2-CZ 4.47Å
216	S	95.3	Very high	95	Very high	21 Å²	21	31.1 Å²	31.1	15%	0.147	16%	0.163	C	C	.	.			trans	-65	149	177.3	82.9	0	0	0	0	111.8	Y218 A219 L220	S216-Y218 PolarHBondContact O-N 2.87Å; S216-Y218 VanDerWaalsContact O-N 3.14Å; S216-Y218 PolarHBondContact OG-N 2.69Å; S216-A219 PolarHBondContact O-N 2.91Å; S216-A219 VanDerWaalsContact O-N 3.16Å; S216-A219 VanDerWaalsContact OG-CB 3.3Å; S216-A219 WeakPolarHBondContact OG-CB 3.13Å; S216-A219 PolarHBondContact OG-N 2.79Å; S216-L220 PolarHBondContact O-N 3.43Å
217	S	95.2	Very high	95.3	Very high	55 Å²	55	27.1 Å²	27.1	39%	0.385	13%	0.134	S	C	.	.	H	α-helix	trans	-54.3	-32.7	173.1	-87.2	0	0	0	0	112.6	K199 I221	K199-S217 WeakPolarHBondContact CE-OG 3.33Å; K199-S217 PolarHBondContact NZ-OG 2.84Å; K199-S217 VanDerWaalsContact NZ-OG 3.09Å; S217-I221 WeakPolarHBondContact O-CD1 3.29Å; S217-I221 VanDerWaalsContact O-CG1 3.23Å; S217-I221 WeakPolarHBondContact O-CG1 3.35Å; S217-I221 PolarHBondContact O-N 3.08Å
218	Y	96.1	Very high	95.3	Very high	42 Å²	42	26.1 Å²	26.1	17%	0.165	13%	0.129	C	C	.	.	H	α-helix	trans	-72	-49.8	176.9	-173.7	-129.4	0	0	0	111.5	A177 I181 S216 L220 I221 L222 P297 V304	A177-Y218 HydrophobicContact CB-CD2 4.42Å; A177-Y218 HydrophobicContact CB-CE2 3.97Å; I181-Y218 HydrophobicContact CD1-CD2 4.14Å; I181-Y218 HydrophobicContact CD1-CE2 4.46Å; S216-Y218 PolarHBondContact O-N 2.87Å; S216-Y218 VanDerWaalsContact O-N 3.14Å; S216-Y218 PolarHBondContact OG-N 2.69Å; Y218-L220 VanDerWaalsContact C-N 3.29Å; Y218-L220 PolarHBondContact O-N 3.29Å; Y218-I221 PolarHBondContact O-N 2.72Å; Y218-I221 VanDerWaalsContact O-N 3.08Å; Y218-L222 HydrophobicContact CD2-CD2 4.03Å; Y218-L222 HydrophobicContact CD2-CG 4.43Å; Y218-L222 HydrophobicContact CE1-CD1 4Å; Y218-L222 HydrophobicContact CE1-CG 4.43Å; Y218-L222 HydrophobicContact CE2-CD1 4.5Å; Y218-L222 HydrophobicContact CE2-CD2 3.61Å; Y218-L222 HydrophobicContact CE2-CG 4.26Å; Y218-L222 WeakPolarHBondContact O-CG 3.46Å; Y218-L222 PolarHBondContact O-N 2.67Å; Y218-P297 WeakPolarHBondContact OH-CD 3.4Å; Y218-P297 WeakPolarHBondContact OH-CG 3.14Å; Y218-V304 HydrophobicContact CD1-CG1 3.56Å; Y218-V304 HydrophobicContact CD1-CG2 4.44Å; Y218-V304 HydrophobicContact CE1-CG1 4.11Å; Y218-V304 HydrophobicContact CE1-CG2 4.16Å; Y218-V304 HydrophobicContact CG-CG1 4.48Å
219	A	97.6	Very high	95.4	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-56.6	-43.1	176.8	0	0	0	0	0	111.9	L215 S216 I221 L222 M223 I294 V304	L215-A219 HydrophobicContact CD1-CB 3.56Å; L215-A219 HydrophobicContact CG-CB 4.21Å; S216-A219 PolarHBondContact O-N 2.91Å; S216-A219 VanDerWaalsContact O-N 3.16Å; S216-A219 VanDerWaalsContact OG-CB 3.3Å; S216-A219 WeakPolarHBondContact OG-CB 3.13Å; S216-A219 PolarHBondContact OG-N 2.79Å; A219-I221 PolarHBondContact O-N 3.36Å; A219-L222 PolarHBondContact O-N 2.86Å; A219-M223 WeakPolarHBondContact O-CG 3.47Å; A219-M223 PolarHBondContact O-N 2.73Å; A219-I294 HydrophobicContact CB-CD1 4.1Å; A219-V304 HydrophobicContact CB-CG1 4.04Å
220	L	98.2	Very high	95.4	Very high	3 Å²	3	25.2 Å²	25.2	2%	0.016	12%	0.123	C	C	.	.	H	α-helix	trans	-58.5	-46.9	174.5	176.2	63.9	0	0	0	112.1	L198 K199 L202 L215 S216 Y218 L222 M223 C224 F250	L198-L220 HydrophobicContact CB-CD1 3.81Å; L198-L220 HydrophobicContact CB-CD2 4Å; L198-L220 HydrophobicContact CB-CG 4.4Å; L198-L220 HydrophobicContact CD1-CD1 4.21Å; K199-L220 HydrophobicContact CB-CD2 4.45Å; K199-L220 HydrophobicContact CG-CD2 3.64Å; L202-L220 HydrophobicContact CD1-CD1 4.19Å; L202-L220 HydrophobicContact CD1-CD2 4.15Å; L215-L220 HydrophobicContact CD2-CB 3.82Å; L215-L220 HydrophobicContact CD2-CD1 3.9Å; L215-L220 HydrophobicContact CD2-CG 4.45Å; L215-L220 HydrophobicContact CG-CB 4.21Å; S216-L220 PolarHBondContact O-N 3.43Å; Y218-L220 VanDerWaalsContact C-N 3.29Å; Y218-L220 PolarHBondContact O-N 3.29Å; L220-L222 VanDerWaalsContact C-N 3.31Å; L220-L222 PolarHBondContact O-N 3Å; L220-M223 PolarHBondContact O-N 2.83Å; L220-C224 PolarHBondContact O-N 2.66Å; L220-C224 PolarHBondContact O-SG 2.96Å; L220-F250 HydrophobicContact CD1-CZ 4.4Å
221	I	98.1	Very high	95.3	Very high	4 Å²	4	24.9 Å²	24.9	2%	0.021	12%	0.121	C	C	.	.	H	α-helix	trans	-63.7	-39	177.9	-66.9	164.1	0	0	0	110.4	L107 I181 L191 V195 S217 Y218 A219 M223 C224 V225	L107-I221 HydrophobicContact CD1-CD1 4.07Å; I181-I221 HydrophobicContact CD1-CD1 3.95Å; I181-I221 HydrophobicContact CG1-CD1 4.41Å; I181-I221 HydrophobicContact CG1-CG2 4.17Å; I181-I221 HydrophobicContact CG2-CD1 4.37Å; I181-I221 HydrophobicContact CG2-CG2 4.47Å; L191-I221 HydrophobicContact CD2-CG2 4.44Å; V195-I221 HydrophobicContact CG1-CD1 4.31Å; V195-I221 HydrophobicContact CG1-CG1 3.88Å; V195-I221 HydrophobicContact CG2-CG1 3.82Å; S217-I221 WeakPolarHBondContact O-CD1 3.29Å; S217-I221 VanDerWaalsContact O-CG1 3.23Å; S217-I221 WeakPolarHBondContact O-CG1 3.35Å; S217-I221 PolarHBondContact O-N 3.08Å; Y218-I221 PolarHBondContact O-N 2.72Å; Y218-I221 VanDerWaalsContact O-N 3.08Å; A219-I221 PolarHBondContact O-N 3.36Å; I221-M223 PolarHBondContact O-N 3.37Å; I221-C224 PolarHBondContact O-N 3.25Å; I221-V225 HydrophobicContact CG2-CG2 4.31Å; I221-V225 WeakPolarHBondContact O-CG2 3.5Å; I221-V225 PolarHBondContact O-N 3.46Å
222	L	98.2	Very high	95.4	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-65.7	-37.8	176.4	-56.5	-153.9	0	0	0	112.1	Y218 A219 L220 V225 S226 I267 I294 P297 V304	Y218-L222 HydrophobicContact CD2-CD2 4.03Å; Y218-L222 HydrophobicContact CD2-CG 4.43Å; Y218-L222 HydrophobicContact CE1-CD1 4Å; Y218-L222 HydrophobicContact CE1-CG 4.43Å; Y218-L222 HydrophobicContact CE2-CD1 4.5Å; Y218-L222 HydrophobicContact CE2-CD2 3.61Å; Y218-L222 HydrophobicContact CE2-CG 4.26Å; Y218-L222 WeakPolarHBondContact O-CG 3.46Å; Y218-L222 PolarHBondContact O-N 2.67Å; A219-L222 PolarHBondContact O-N 2.86Å; L220-L222 VanDerWaalsContact C-N 3.31Å; L220-L222 PolarHBondContact O-N 3Å; L222-V225 PolarHBondContact O-N 2.78Å; L222-S226 WeakPolarHBondContact O-CB 3.42Å; L222-S226 PolarHBondContact O-N 2.93Å; L222-I267 HydrophobicContact CB-CD1 4.19Å; L222-I267 HydrophobicContact CD1-CD1 3.94Å; L222-I267 HydrophobicContact CD2-CD1 3.62Å; L222-I267 HydrophobicContact CG-CD1 4.09Å; L222-I294 HydrophobicContact CB-CG2 4.03Å; L222-I294 HydrophobicContact CD1-CG2 3.9Å; L222-P297 HydrophobicContact CD1-CG 4.48Å; L222-V304 HydrophobicContact CD1-CG2 4.13Å
223	M	98.4	Very high	94.6	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-63.9	-40.5	172	-70	178.2	71.8	0	0	112.3	L215 A219 L220 I221 S226 F227 F250 Y254 I265 L292 I294 F318	L215-M223 HydrophobicContact CD1-SD 4.09Å; L215-M223 HydrophobicContact CD2-SD 3.87Å; A219-M223 WeakPolarHBondContact O-CG 3.47Å; A219-M223 PolarHBondContact O-N 2.73Å; L220-M223 PolarHBondContact O-N 2.83Å; I221-M223 PolarHBondContact O-N 3.37Å; M223-S226 PolarHBondContact O-N 3.37Å; M223-F227 WeakPolarHBondContact O-CB 3.45Å; M223-F227 PolarHBondContact O-N 3.23Å; M223-F250 HydrophobicContact CB-CE2 4.46Å; M223-Y254 HydrophobicContact CB-CE2 4.05Å; M223-Y254 HydrophobicContact CE-CD1 3.4Å; M223-Y254 HydrophobicContact CE-CD2 3.83Å; M223-Y254 HydrophobicContact CE-CE1 3.73Å; M223-Y254 HydrophobicContact CE-CE2 4.09Å; M223-Y254 HydrophobicContact CE-CG 3.45Å; M223-Y254 VanDerWaalsContact CE-CG 3.45Å; M223-Y254 WeakPolarHBondContact O-CE2 3.44Å; M223-Y254 PolarHBondContact O-OH 3.14Å; M223-I265 HydrophobicContact CG-CD1 3.94Å; M223-L292 HydrophobicContact CE-CD1 4.37Å; M223-L292 HydrophobicContact SD-CD1 4.13Å; M223-L292 HydrophobicContact SD-CD2 3.74Å; M223-I294 HydrophobicContact CG-CD1 3.78Å; M223-I294 HydrophobicContact SD-CD1 4.41Å; M223-F318 HydrophobicContact CE-CE2 4.12Å
224	C	98.2	Very high	93.5	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-65.2	-46.6	175.8	-64.3	0	0	0	0	111.4	L191 V195 L198 L220 I221 S226 F227 L228	L191-C224 HydrophobicContact CD1-CB 3.47Å; L191-C224 VanDerWaalsContact CD1-CB 3.47Å; V195-C224 HydrophobicContact CG2-CB 4.28Å; L198-C224 VanDerWaalsContact CD1-SG 3.57Å; L220-C224 PolarHBondContact O-N 2.66Å; L220-C224 PolarHBondContact O-SG 2.96Å; I221-C224 PolarHBondContact O-N 3.25Å; C224-S226 PolarHBondContact O-N 3.48Å; C224-F227 PolarHBondContact O-N 2.85Å; C224-L228 WeakPolarHBondContact O-CG 3.12Å; C224-L228 PolarHBondContact O-N 3.15Å
225	V	97.7	Very high	92.2	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-59.9	-45.6	175.4	168.8	0	0	0	0	110.8	F184 L191 I221 L222 F227 L228 Q229 I267	F184-V225 HydrophobicContact CB-CG2 3.8Å; F184-V225 HydrophobicContact CD1-CG1 3.72Å; F184-V225 HydrophobicContact CD1-CG2 4.18Å; F184-V225 HydrophobicContact CD2-CG1 4.27Å; F184-V225 HydrophobicContact CD2-CG2 3.83Å; F184-V225 HydrophobicContact CE1-CG1 3.66Å; F184-V225 HydrophobicContact CE2-CG1 4.18Å; F184-V225 HydrophobicContact CE2-CG2 4.43Å; F184-V225 HydrophobicContact CG-CG1 4.05Å; F184-V225 HydrophobicContact CG-CG2 3.7Å; F184-V225 HydrophobicContact CZ-CG1 3.9Å; L191-V225 HydrophobicContact CD1-CG2 4.17Å; L191-V225 HydrophobicContact CD2-CG2 3.84Å; I221-V225 HydrophobicContact CG2-CG2 4.31Å; I221-V225 WeakPolarHBondContact O-CG2 3.5Å; I221-V225 PolarHBondContact O-N 3.46Å; L222-V225 PolarHBondContact O-N 2.78Å; V225-F227 VanDerWaalsContact C-N 3.35Å; V225-F227 PolarHBondContact O-N 3.3Å; V225-L228 PolarHBondContact O-N 2.85Å; V225-Q229 HydrophobicContact CG1-CG 4.37Å; V225-Q229 WeakPolarHBondContact O-CB 3.45Å; V225-Q229 VanDerWaalsContact O-CG 3.29Å; V225-Q229 WeakPolarHBondContact O-CG 3.5Å; V225-Q229 PolarHBondContact O-N 3.23Å; V225-I267 HydrophobicContact CG1-CB 4.4Å; V225-I267 HydrophobicContact CG1-CD1 4.5Å; V225-I267 HydrophobicContact CG1-CG2 4.41Å
226	S	98	Very high	90.8	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-61.8	-40.1	176.8	-173.3	0	0	0	0	112.8	L222 M223 C224 Q229 H230 I265 Y273	L222-S226 WeakPolarHBondContact O-CB 3.42Å; L222-S226 PolarHBondContact O-N 2.93Å; M223-S226 PolarHBondContact O-N 3.37Å; C224-S226 PolarHBondContact O-N 3.48Å; S226-Q229 PolarHBondContact O-N 3.14Å; S226-H230 PolarHBondContact O-N 3.01Å; S226-H230 PolarHBondContact O-ND1 3.45Å; S226-I265 WeakPolarHBondContact OG-CG2 3.38Å; S226-Y273 WeakPolarHBondContact OG-CE1 3.43Å
227	F	97.5	Very high	89.6	Confident	4 Å²	4	36.1 Å²	36.1	2%	0.018	20%	0.196	C	C	.	.	H	α-helix	trans	-62.2	-49.6	173.7	166.6	-105.7	0	0	0	111.2	L194 M223 C224 V225 Q229 H230 T231 L246 E249 F250 L253 Y254	L194-F227 HydrophobicContact CD1-CD1 4.15Å; L194-F227 HydrophobicContact CD1-CE1 4.14Å; M223-F227 WeakPolarHBondContact O-CB 3.45Å; M223-F227 PolarHBondContact O-N 3.23Å; C224-F227 PolarHBondContact O-N 2.85Å; V225-F227 VanDerWaalsContact C-N 3.35Å; V225-F227 PolarHBondContact O-N 3.3Å; F227-Q229 VanDerWaalsContact C-N 3.27Å; F227-Q229 PolarHBondContact O-N 3.04Å; F227-H230 PolarHBondContact O-N 3.31Å; F227-T231 WeakPolarHBondContact CD2-OG1 3.41Å; F227-T231 HydrophobicContact CE2-CG2 4.25Å; F227-T231 WeakPolarHBondContact CE2-OG1 3.39Å; F227-T231 HydrophobicContact CZ-CG2 3.98Å; F227-T231 WeakPolarHBondContact O-CB 3.43Å; F227-T231 PolarHBondContact O-N 3.15Å; F227-T231 PolarHBondContact O-OG1 2.94Å; F227-T231 VanDerWaalsContact O-OG1 3.09Å; F227-L246 HydrophobicContact CE1-CB 4.1Å; F227-L246 HydrophobicContact CE1-CD2 3.9Å; F227-L246 HydrophobicContact CE1-CG 4.47Å; F227-L246 WeakPolarHBondContact CE1-O 3.35Å; F227-L246 HydrophobicContact CZ-CB 4.45Å; F227-L246 HydrophobicContact CZ-CD2 4.01Å; F227-L246 VanDerWaalsContact CZ-O 3.27Å; F227-L246 WeakPolarHBondContact CZ-O 3.33Å; F227-E249 HydrophobicContact CE2-CB 3.88Å; F227-E249 HydrophobicContact CZ-CB 3.79Å; F227-F250 HydrophobicContact CB-CD2 4Å; F227-F250 HydrophobicContact CD1-CB 4.18Å; F227-F250 AromaticContact CD1-CD2 3.97Å; F227-F250 HydrophobicContact CD1-CD2 3.97Å; F227-F250 HydrophobicContact CD2-CB 4.46Å; F227-F250 HydrophobicContact CE1-CB 4.04Å; F227-F250 HydrophobicContact CE2-CB 4.33Å; F227-F250 HydrophobicContact CG-CB 4.39Å; F227-F250 AromaticContact CG-CD2 3.94Å; F227-F250 HydrophobicContact CG-CD2 3.94Å; F227-F250 HydrophobicContact CZ-CB 4.13Å; F227-L253 HydrophobicContact CB-CD2 4.5Å; F227-L253 HydrophobicContact CD2-CD2 3.85Å; F227-Y254 HydrophobicContact CB-CE2 4.02Å
228	L	95.6	Very high	88.3	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-63.9	-30.5	179.2	-64.1	176.7	0	0	0	113	Y188 L191 L194 C224 V225 H230 L232 L246	Y188-L228 HydrophobicContact CD1-CB 3.97Å; Y188-L228 HydrophobicContact CD1-CD1 4.34Å; Y188-L228 HydrophobicContact CE1-CB 4.01Å; Y188-L228 HydrophobicContact CG-CB 4.27Å; Y188-L228 HydrophobicContact CG-CD1 4.07Å; L191-L228 HydrophobicContact CB-CD1 4.03Å; L191-L228 HydrophobicContact CD1-CD1 4.02Å; L194-L228 HydrophobicContact CD1-CD1 4.39Å; L194-L228 HydrophobicContact CD1-CD2 3.9Å; L194-L228 HydrophobicContact CD1-CG 4.29Å; C224-L228 WeakPolarHBondContact O-CG 3.12Å; C224-L228 PolarHBondContact O-N 3.15Å; V225-L228 PolarHBondContact O-N 2.85Å; L228-H230 VanDerWaalsContact C-N 3.33Å; L228-H230 PolarHBondContact O-N 2.99Å; L228-L232 HydrophobicContact CB-CD1 4.37Å; L228-L232 HydrophobicContact CD2-CD1 3.89Å; L228-L232 HydrophobicContact CD2-CG 4.18Å; L228-L232 WeakPolarHBondContact O-CB 3.08Å; L228-L232 PolarHBondContact O-N 3.15Å; L228-L246 HydrophobicContact CD2-CD1 3.76Å; L228-L246 HydrophobicContact CD2-CD2 4.48Å
229	Q	94.6	Very high	86.9	Confident	33 Å²	33	41 Å²	41	15%	0.154	22%	0.223	C	C	.	.	H	α-helix	trans	-64.1	-32	172.1	-79.7	173.5	-36.1	0	0	113.6	Y188 V225 S226 F227 I267 G270	Y188-Q229 HydrophobicContact CE2-CG 4.46Å; Y188-Q229 VanDerWaalsContact OH-CG 3.31Å; Y188-Q229 WeakPolarHBondContact OH-CG 3.09Å; V225-Q229 HydrophobicContact CG1-CG 4.37Å; V225-Q229 WeakPolarHBondContact O-CB 3.45Å; V225-Q229 VanDerWaalsContact O-CG 3.29Å; V225-Q229 WeakPolarHBondContact O-CG 3.5Å; V225-Q229 PolarHBondContact O-N 3.23Å; S226-Q229 PolarHBondContact O-N 3.14Å; F227-Q229 VanDerWaalsContact C-N 3.27Å; F227-Q229 PolarHBondContact O-N 3.04Å; Q229-I267 PolarHBondContact NE2-O 3.49Å; Q229-G270 WeakPolarHBondContact CB-O 3.17Å; Q229-G270 VanDerWaalsContact CD-O 3.24Å; Q229-G270 VanDerWaalsContact CG-O 3.28Å; Q229-G270 WeakPolarHBondContact CG-O 3.31Å; Q229-G270 PolarHBondContact NE2-O 3.08Å
230	H	92.2	Very high	86	Confident	66 Å²	66	47.6 Å²	47.6	31%	0.306	26%	0.258	S	S	.	.	H	α-helix	trans	-95	-25.5	178.9	-65.7	88.9	0	0	0	113.4	S226 F227 L228 Y273	S226-H230 PolarHBondContact O-N 3.01Å; S226-H230 PolarHBondContact O-ND1 3.45Å; F227-H230 PolarHBondContact O-N 3.31Å; L228-H230 VanDerWaalsContact C-N 3.33Å; L228-H230 PolarHBondContact O-N 2.99Å; H230-Y273 AromaticContact CD2-CE2 3.84Å; H230-Y273 AromaticContact CE1-CD2 3.92Å; H230-Y273 AromaticContact CE1-CE1 3.83Å; H230-Y273 AromaticContact CE1-CE2 3.58Å; H230-Y273 AromaticContact CE1-CZ 3.5Å; H230-Y273 AromaticContact CG-CE2 3.91Å; H230-Y273 AromaticContact ND1-CE2 3.75Å; H230-Y273 AromaticContact ND1-CZ 3.57Å; H230-Y273 PolarHBondContact ND1-OH 3.26Å; H230-Y273 AromaticContact NE2-CD2 3.66Å; H230-Y273 AromaticContact NE2-CE2 3.63Å
231	T	90.8	Very high	85.6	Confident	38 Å²	38	48.1 Å²	48.1	23%	0.233	26%	0.261	C	S	.	.	H	α-helix	trans	-95	-34.5	-175.1	-55.6	0	0	0	0	113.5	F227 L246	F227-T231 WeakPolarHBondContact CD2-OG1 3.41Å; F227-T231 HydrophobicContact CE2-CG2 4.25Å; F227-T231 WeakPolarHBondContact CE2-OG1 3.39Å; F227-T231 HydrophobicContact CZ-CG2 3.98Å; F227-T231 WeakPolarHBondContact O-CB 3.43Å; F227-T231 PolarHBondContact O-N 3.15Å; F227-T231 PolarHBondContact O-OG1 2.94Å; F227-T231 VanDerWaalsContact O-OG1 3.09Å; T231-L246 HydrophobicContact CG2-CD2 3.69Å
232	L	87.6	Confident	85.4	Confident	29 Å²	29	49.8 Å²	49.8	15%	0.152	27%	0.27	C	S	.	.	S	Bend	trans	-95.4	108	-178.9	-61.5	-177.2	0	0	0	111.4	Y188 L228 V241 L246	Y188-L232 HydrophobicContact CD1-CD1 3.96Å; Y188-L232 HydrophobicContact CE1-CD1 4.33Å; L228-L232 HydrophobicContact CB-CD1 4.37Å; L228-L232 HydrophobicContact CD2-CD1 3.89Å; L228-L232 HydrophobicContact CD2-CG 4.18Å; L228-L232 WeakPolarHBondContact O-CB 3.08Å; L228-L232 PolarHBondContact O-N 3.15Å; L232-V241 HydrophobicContact CD2-CG1 4.06Å; L232-V241 HydrophobicContact CD2-CG2 3.91Å; L232-L246 HydrophobicContact CD2-CD2 4.29Å
233	L	74.3	Confident	85.3	Confident	62 Å²	62	50.2 Å²	50.2	33%	0.325	27%	0.272	S	S	.	.			trans	-62.7	143	169.8	-60.7	176.1	0	0	0	110.4	E235 I236	L233-E235 PolarHBondContact O-N 3.3Å; L233-I236 HydrophobicContact CB-CD1 3.93Å; L233-I236 HydrophobicContact CB-CG1 4.14Å; L233-I236 HydrophobicContact CD1-CD1 4.47Å; L233-I236 HydrophobicContact CG-CD1 4.29Å; L233-I236 PolarHBondContact O-N 3.21Å; L233-I236 VanDerWaalsContact O-N 3.09Å
234	P	70.1	Confident	85.2	Confident	117 Å²	117	50.2 Å²	50.2	76%	0.76	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-19.3	-178.6	-26.8	35.3	0	0	0	115.9
235	E	65.7	Low	85.1	Confident	182 Å²	182	53.5 Å²	53.5	85%	0.85	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-13.6	-177.9	-62.9	168.3	-167.5	0	0	113.6	L233 S237	L233-E235 PolarHBondContact O-N 3.3Å; E235-S237 PolarHBondContact O-N 3.39Å
236	I	67.6	Low	85	Confident	68 Å²	68	53.8 Å²	53.8	35%	0.349	29%	0.291	S	S	.	.	S	Bend	trans	-80.1	116.5	-176.4	-64.8	171.3	0	0	0	109.3	L233 V238 V241	L233-I236 HydrophobicContact CB-CD1 3.93Å; L233-I236 HydrophobicContact CB-CG1 4.14Å; L233-I236 HydrophobicContact CD1-CD1 4.47Å; L233-I236 HydrophobicContact CG-CD1 4.29Å; L233-I236 PolarHBondContact O-N 3.21Å; L233-I236 VanDerWaalsContact O-N 3.09Å; I236-V238 PolarHBondContact O-N 2.89Å; I236-V241 HydrophobicContact CG2-CG2 3.93Å
237	S	69.3	Low	85	Confident	56 Å²	56	53.8 Å²	53.8	39%	0.392	29%	0.291	S	S	.	.			trans	-59.1	129.7	167.7	-174.8	0	0	0	0	110	E235 D239 N240	E235-S237 PolarHBondContact O-N 3.39Å; S237-D239 PolarHBondContact O-N 3.38Å; S237-D239 VanDerWaalsContact O-N 3.16Å; S237-D239 PolarHBondContact OG-OD2 3.02Å; S237-N240 PolarHBondContact O-N 3.41Å
238	V	67.7	Low	85	Confident	51 Å²	51	54.5 Å²	54.5	31%	0.309	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-59.4	-30.2	-176.4	-171.8	0	0	0	0	111.6	P189 I236 N240 V241	P189-V238 HydrophobicContact CB-CG1 3.96Å; P189-V238 HydrophobicContact CG-CG1 4.06Å; I236-V238 PolarHBondContact O-N 2.89Å; V238-N240 PolarHBondContact O-N 3.48Å; V238-V241 VanDerWaalsContact O-CB 3.32Å; V238-V241 WeakPolarHBondContact O-CB 3.32Å; V238-V241 WeakPolarHBondContact O-CG2 3.11Å; V238-V241 PolarHBondContact O-N 3.37Å
239	D	68	Low	85.1	Confident	148 Å²	148	57 Å²	57	79%	0.791	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-62.2	-26.7	179.5	-50.9	-49.2	0	0	0	113.1	S237 V241	S237-D239 PolarHBondContact O-N 3.38Å; S237-D239 VanDerWaalsContact O-N 3.16Å; S237-D239 PolarHBondContact OG-OD2 3.02Å; D239-V241 VanDerWaalsContact C-N 3.33Å
240	N	78.7	Confident	85.3	Confident	138 Å²	138	55.4 Å²	55.4	74%	0.738	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-88.7	3.3	-177.7	-66.1	-26.4	0	0	0	113.3	S237 V238 N242	S237-N240 PolarHBondContact O-N 3.41Å; V238-N240 PolarHBondContact O-N 3.48Å; N240-N242 PolarHBondContact O-N 2.7Å
241	V	90.1	Very high	85.6	Confident	15 Å²	15	52.2 Å²	52.2	9%	0.091	29%	0.285	C	S	.	.			trans	-83.7	112.5	-171.4	176.6	0	0	0	0	111.6	L232 I236 V238 D239 L243 L246	L232-V241 HydrophobicContact CD2-CG1 4.06Å; L232-V241 HydrophobicContact CD2-CG2 3.91Å; I236-V241 HydrophobicContact CG2-CG2 3.93Å; V238-V241 VanDerWaalsContact O-CB 3.32Å; V238-V241 WeakPolarHBondContact O-CB 3.32Å; V238-V241 WeakPolarHBondContact O-CG2 3.11Å; V238-V241 PolarHBondContact O-N 3.37Å; D239-V241 VanDerWaalsContact C-N 3.33Å; V241-L243 PolarHBondContact O-N 3.33Å; V241-L246 HydrophobicContact CG1-CD1 3.31Å; V241-L246 HydrophobicContact CG1-CD2 4.38Å; V241-L246 HydrophobicContact CG1-CG 3.79Å
242	N	94	Very high	85.9	Confident	38 Å²	38	52.3 Å²	52.3	20%	0.203	28%	0.282	C	S	.	.			trans	-74.2	99.9	175.3	-174	-60.9	0	0	0	111.2	V53 N240 G244 I245 L246	V53-N242 PolarHBondContact O-ND2 2.8Å; V53-N242 PolarHBondContact O-OD1 3.49Å; N240-N242 PolarHBondContact O-N 2.7Å; N242-G244 PolarHBondContact O-N 3.4Å; N242-G244 VanDerWaalsContact O-N 3.17Å; N242-G244 VanDerWaalsContact OD1-CA 3.28Å; N242-G244 WeakPolarHBondContact OD1-CA 3.49Å; N242-G244 PolarHBondContact OD1-N 3.29Å; N242-I245 HydrophobicContact CB-CB 4.33Å; N242-I245 HydrophobicContact CB-CD1 3.99Å; N242-I245 HydrophobicContact CB-CG1 4.07Å; N242-I245 PolarHBondContact O-N 3.16Å; N242-I245 VanDerWaalsContact O-N 3.12Å; N242-I245 PolarHBondContact OD1-N 3.03Å; N242-L246 PolarHBondContact O-N 2.94Å; N242-L246 VanDerWaalsContact O-N 3.1Å
243	L	95.6	Very high	86.4	Confident	9 Å²	9	51.5 Å²	51.5	5%	0.047	28%	0.278	C	S	.	.	H	α-helix	trans	-47.6	-34	172.4	-56.8	176	0	0	0	115.4	H57 I60 K61 C190 C193 V241 L247	H57-L243 PolarHBondContact ND1-N 2.9Å; I60-L243 HydrophobicContact CD1-CB 4.19Å; I60-L243 HydrophobicContact CG2-CB 4.16Å; I60-L243 HydrophobicContact CG2-CD1 3.93Å; K61-L243 HydrophobicContact CG-CD1 4.09Å; C190-L243 HydrophobicContact CB-CD2 3.77Å; C193-L243 HydrophobicContact CB-CD1 4.01Å; C193-L243 HydrophobicContact CB-CD2 3.81Å; C193-L243 HydrophobicContact CB-CG 4.48Å; V241-L243 PolarHBondContact O-N 3.33Å; L243-L247 WeakPolarHBondContact O-CB 3.1Å; L243-L247 PolarHBondContact O-N 3.09Å
244	G	96.1	Very high	87.6	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-70.4	-40.4	178.5	0	0	0	0	0	112.8	N242 V248	N242-G244 PolarHBondContact O-N 3.4Å; N242-G244 VanDerWaalsContact O-N 3.17Å; N242-G244 VanDerWaalsContact OD1-CA 3.28Å; N242-G244 WeakPolarHBondContact OD1-CA 3.49Å; N242-G244 PolarHBondContact OD1-N 3.29Å; G244-V248 WeakPolarHBondContact O-CG2 3.39Å; G244-V248 PolarHBondContact O-N 2.98Å
245	I	95.6	Very high	88.9	Confident	69 Å²	69	43 Å²	43	35%	0.354	23%	0.227	S	C	.	.	H	α-helix	trans	-61.4	-51.3	170.3	-63.5	178.7	0	0	0	109.6	V53 N242 L247 V248 E249	V53-I245 HydrophobicContact CB-CG1 3.92Å; V53-I245 HydrophobicContact CG1-CG1 4.02Å; V53-I245 HydrophobicContact CG2-CD1 4.2Å; V53-I245 HydrophobicContact CG2-CG1 3.84Å; N242-I245 HydrophobicContact CB-CB 4.33Å; N242-I245 HydrophobicContact CB-CD1 3.99Å; N242-I245 HydrophobicContact CB-CG1 4.07Å; N242-I245 PolarHBondContact O-N 3.16Å; N242-I245 VanDerWaalsContact O-N 3.12Å; N242-I245 PolarHBondContact OD1-N 3.03Å; I245-L247 VanDerWaalsContact C-N 3.29Å; I245-L247 PolarHBondContact O-N 2.85Å; I245-V248 PolarHBondContact O-N 3.42Å; I245-E249 HydrophobicContact CG2-CG 4.11Å; I245-E249 WeakPolarHBondContact O-CB 3.27Å; I245-E249 WeakPolarHBondContact O-CG 3.42Å; I245-E249 PolarHBondContact O-N 3.32Å
246	L	96.4	Very high	90.4	Very high	6 Å²	6	39.6 Å²	39.6	3%	0.031	21%	0.206	C	C	.	.	H	α-helix	trans	-57	-40	180	-72.8	-168.5	0	0	0	113.1	L194 F227 L228 T231 L232 V241 N242 F250	L194-L246 HydrophobicContact CD1-CB 4.46Å; L194-L246 HydrophobicContact CD1-CD1 4.39Å; L194-L246 HydrophobicContact CD2-CB 4.19Å; F227-L246 HydrophobicContact CE1-CB 4.1Å; F227-L246 HydrophobicContact CE1-CD2 3.9Å; F227-L246 HydrophobicContact CE1-CG 4.47Å; F227-L246 WeakPolarHBondContact CE1-O 3.35Å; F227-L246 HydrophobicContact CZ-CB 4.45Å; F227-L246 HydrophobicContact CZ-CD2 4.01Å; F227-L246 VanDerWaalsContact CZ-O 3.27Å; F227-L246 WeakPolarHBondContact CZ-O 3.33Å; L228-L246 HydrophobicContact CD2-CD1 3.76Å; L228-L246 HydrophobicContact CD2-CD2 4.48Å; T231-L246 HydrophobicContact CG2-CD2 3.69Å; L232-L246 HydrophobicContact CD2-CD2 4.29Å; V241-L246 HydrophobicContact CG1-CD1 3.31Å; V241-L246 HydrophobicContact CG1-CD2 4.38Å; V241-L246 HydrophobicContact CG1-CG 3.79Å; N242-L246 PolarHBondContact O-N 2.94Å; N242-L246 VanDerWaalsContact O-N 3.1Å; L246-F250 VanDerWaalsContact O-CB 3.28Å; L246-F250 WeakPolarHBondContact O-CB 3.27Å; L246-F250 PolarHBondContact O-N 2.97Å
247	L	98	Very high	91.8	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-67	-43.6	179.4	-176.5	62.7	0	0	0	111.8	L56 I60 L194 V197 L198 L243 I245 F251 L325 L345	L56-L247 HydrophobicContact CD1-CD2 4.49Å; I60-L247 HydrophobicContact CD1-CB 4.09Å; I60-L247 HydrophobicContact CD1-CD2 3.69Å; I60-L247 HydrophobicContact CG1-CD2 4.28Å; L194-L247 HydrophobicContact CD2-CB 4.26Å; L194-L247 HydrophobicContact CD2-CD1 4.26Å; V197-L247 HydrophobicContact CG1-CD1 3.56Å; V197-L247 HydrophobicContact CG1-CD2 3.75Å; V197-L247 HydrophobicContact CG1-CG 4.32Å; L198-L247 HydrophobicContact CD2-CD1 4.33Å; L243-L247 WeakPolarHBondContact O-CB 3.1Å; L243-L247 PolarHBondContact O-N 3.09Å; I245-L247 VanDerWaalsContact C-N 3.29Å; I245-L247 PolarHBondContact O-N 2.85Å; L247-F251 HydrophobicContact CD1-CD2 3.97Å; L247-F251 HydrophobicContact CD1-CE2 3.42Å; L247-F251 VanDerWaalsContact CD1-CE2 3.42Å; L247-F251 HydrophobicContact CD1-CZ 4Å; L247-F251 HydrophobicContact CD2-CE2 4.22Å; L247-F251 HydrophobicContact CG-CD2 3.96Å; L247-F251 HydrophobicContact CG-CE2 3.63Å; L247-F251 WeakPolarHBondContact O-CD2 3.37Å; L247-F251 PolarHBondContact O-N 3.22Å; L247-F251 VanDerWaalsContact O-N 3.14Å; L247-L325 HydrophobicContact CD2-CD1 3.82Å; L247-L325 HydrophobicContact CG-CD1 4Å; L247-L345 HydrophobicContact CD2-CD1 3.76Å
248	V	97.2	Very high	93.1	Very high	19 Å²	19	39.2 Å²	39.2	12%	0.115	20%	0.196	C	C	.	.	H	α-helix	trans	-66	-43.6	177.2	173.6	0	0	0	0	111.1	L56 G244 I245 F251 E252 Y322 L325 V329	L56-V248 HydrophobicContact CD2-CG2 4.08Å; G244-V248 WeakPolarHBondContact O-CG2 3.39Å; G244-V248 PolarHBondContact O-N 2.98Å; I245-V248 PolarHBondContact O-N 3.42Å; V248-F251 PolarHBondContact O-N 3.34Å; V248-E252 PolarHBondContact O-N 2.76Å; V248-Y322 HydrophobicContact CG1-CD2 4.05Å; V248-Y322 HydrophobicContact CG1-CE2 4.12Å; V248-L325 HydrophobicContact CG2-CB 3.93Å; V248-L325 HydrophobicContact CG2-CD1 4.2Å; V248-V329 HydrophobicContact CG2-CG2 4.28Å
249	E	97.4	Very high	94.5	Very high	52 Å²	52	40.2 Å²	40.2	24%	0.243	20%	0.2	C	C	.	.	H	α-helix	trans	-66.9	-36.1	177.7	-71.9	179.7	161.9	0	0	112.6	F227 I245 E252 L253	F227-E249 HydrophobicContact CE2-CB 3.88Å; F227-E249 HydrophobicContact CZ-CB 3.79Å; I245-E249 HydrophobicContact CG2-CG 4.11Å; I245-E249 WeakPolarHBondContact O-CB 3.27Å; I245-E249 WeakPolarHBondContact O-CG 3.42Å; I245-E249 PolarHBondContact O-N 3.32Å; E249-E252 PolarHBondContact O-N 3.34Å; E249-L253 WeakPolarHBondContact O-CB 3.48Å; E249-L253 PolarHBondContact O-N 3.25Å
250	F	98.4	Very high	95.9	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-60.5	-48.8	172.4	177.5	-80.2	0	0	0	111.2	L198 L220 M223 F227 L246 E252 L253 Y254 F318	L198-F250 HydrophobicContact CD1-CD1 3.74Å; L198-F250 HydrophobicContact CD1-CD2 4.09Å; L198-F250 HydrophobicContact CD1-CE1 3.48Å; L198-F250 VanDerWaalsContact CD1-CE1 3.48Å; L198-F250 HydrophobicContact CD1-CE2 3.81Å; L198-F250 HydrophobicContact CD1-CG 4.07Å; L198-F250 HydrophobicContact CD1-CZ 3.51Å; L198-F250 HydrophobicContact CD2-CD1 3.76Å; L198-F250 HydrophobicContact CD2-CE1 3.55Å; L198-F250 HydrophobicContact CD2-CZ 4.36Å; L198-F250 HydrophobicContact CG-CD1 4.41Å; L198-F250 HydrophobicContact CG-CE1 4.16Å; L220-F250 HydrophobicContact CD1-CZ 4.4Å; M223-F250 HydrophobicContact CB-CE2 4.46Å; F227-F250 HydrophobicContact CB-CD2 4Å; F227-F250 HydrophobicContact CD1-CB 4.18Å; F227-F250 AromaticContact CD1-CD2 3.97Å; F227-F250 HydrophobicContact CD1-CD2 3.97Å; F227-F250 HydrophobicContact CD2-CB 4.46Å; F227-F250 HydrophobicContact CE1-CB 4.04Å; F227-F250 HydrophobicContact CE2-CB 4.33Å; F227-F250 HydrophobicContact CG-CB 4.39Å; F227-F250 AromaticContact CG-CD2 3.94Å; F227-F250 HydrophobicContact CG-CD2 3.94Å; F227-F250 HydrophobicContact CZ-CB 4.13Å; L246-F250 VanDerWaalsContact O-CB 3.28Å; L246-F250 WeakPolarHBondContact O-CB 3.27Å; L246-F250 PolarHBondContact O-N 2.97Å; F250-E252 VanDerWaalsContact C-N 3.32Å; F250-E252 PolarHBondContact O-N 3.32Å; F250-L253 PolarHBondContact O-N 2.85Å; F250-Y254 HydrophobicContact CD1-CD2 4.2Å; F250-Y254 AromaticContact CD2-CD2 3.8Å; F250-Y254 HydrophobicContact CD2-CD2 3.8Å; F250-Y254 AromaticContact CD2-CE2 3.79Å; F250-Y254 HydrophobicContact CD2-CE2 3.79Å; F250-Y254 AromaticContact CE1-CD2 3.87Å; F250-Y254 HydrophobicContact CE1-CD2 3.87Å; F250-Y254 AromaticContact CE2-CD2 3.48Å; F250-Y254 HydrophobicContact CE2-CD2 3.48Å; F250-Y254 VanDerWaalsContact CE2-CD2 3.48Å; F250-Y254 AromaticContact CE2-CE2 3.4Å; F250-Y254 HydrophobicContact CE2-CE2 3.4Å; F250-Y254 VanDerWaalsContact CE2-CE2 3.4Å; F250-Y254 HydrophobicContact CG-CD2 4.14Å; F250-Y254 AromaticContact CZ-CD2 3.5Å; F250-Y254 HydrophobicContact CZ-CD2 3.5Å; F250-Y254 VanDerWaalsContact CZ-CD2 3.5Å; F250-Y254 AromaticContact CZ-CE2 3.86Å; F250-Y254 HydrophobicContact CZ-CE2 3.86Å; F250-Y254 PolarHBondContact O-N 3.34Å; F250-F318 HydrophobicContact CE1-CE1 4.42Å; F250-F318 HydrophobicContact CE1-CE2 4.23Å; F250-F318 HydrophobicContact CE1-CZ 4.13Å
251	F	98.4	Very high	96.7	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-68	-30.8	177.4	-72.1	-52.8	0	0	0	112.2	L198 F201 L247 V248 G255 F318 A321 L325 I348	L198-F251 HydrophobicContact CD2-CD1 4.19Å; L198-F251 HydrophobicContact CD2-CE1 3.36Å; L198-F251 HydrophobicContact CD2-CE2 4.41Å; L198-F251 HydrophobicContact CD2-CZ 3.5Å; F201-F251 HydrophobicContact CD1-CE1 4.23Å; F201-F251 HydrophobicContact CD1-CZ 4.5Å; F201-F251 HydrophobicContact CD2-CE1 4.5Å; F201-F251 HydrophobicContact CD2-CZ 4.1Å; F201-F251 HydrophobicContact CE1-CE1 4.24Å; F201-F251 HydrophobicContact CE2-CE1 4.49Å; F201-F251 HydrophobicContact CE2-CZ 4.35Å; F201-F251 HydrophobicContact CG-CE1 4.39Å; F201-F251 HydrophobicContact CG-CZ 4.2Å; F201-F251 HydrophobicContact CZ-CE1 4.39Å; L247-F251 HydrophobicContact CD1-CD2 3.97Å; L247-F251 HydrophobicContact CD1-CE2 3.42Å; L247-F251 VanDerWaalsContact CD1-CE2 3.42Å; L247-F251 HydrophobicContact CD1-CZ 4Å; L247-F251 HydrophobicContact CD2-CE2 4.22Å; L247-F251 HydrophobicContact CG-CD2 3.96Å; L247-F251 HydrophobicContact CG-CE2 3.63Å; L247-F251 WeakPolarHBondContact O-CD2 3.37Å; L247-F251 PolarHBondContact O-N 3.22Å; L247-F251 VanDerWaalsContact O-N 3.14Å; V248-F251 PolarHBondContact O-N 3.34Å; F251-G255 WeakPolarHBondContact O-CA 3.32Å; F251-G255 PolarHBondContact O-N 3.42Å; F251-F318 HydrophobicContact CD1-CB 3.97Å; F251-F318 AromaticContact CD1-CD1 3.7Å; F251-F318 HydrophobicContact CD1-CD1 3.7Å; F251-F318 HydrophobicContact CD1-CE1 4.5Å; F251-F318 HydrophobicContact CD1-CG 4.05Å; F251-F318 AromaticContact CE1-CD1 3.63Å; F251-F318 HydrophobicContact CE1-CD1 3.63Å; F251-F318 HydrophobicContact CE1-CE1 4.14Å; F251-F318 HydrophobicContact CE1-CG 4.43Å; F251-A321 HydrophobicContact CB-CB 4.44Å; F251-A321 HydrophobicContact CD1-CB 3.65Å; F251-A321 HydrophobicContact CD2-CB 3.8Å; F251-A321 HydrophobicContact CE1-CB 3.62Å; F251-A321 HydrophobicContact CE2-CB 3.77Å; F251-A321 HydrophobicContact CG-CB 3.73Å; F251-A321 HydrophobicContact CZ-CB 3.68Å; F251-L325 HydrophobicContact CD2-CD1 3.85Å; F251-L325 HydrophobicContact CE2-CD1 3.83Å; F251-I348 HydrophobicContact CE2-CD1 3.58Å; F251-I348 HydrophobicContact CZ-CD1 3.87Å
252	E	98	Very high	96.9	Very high	39 Å²	39	39.9 Å²	39.9	18%	0.182	18%	0.181	C	C	.	.	H	α-helix	trans	-65.5	-50.5	172.7	-161.2	-169.2	-165.4	0	0	111.3	V248 E249 F250 R256 H257 Y322 Y606	V248-E252 PolarHBondContact O-N 2.76Å; E249-E252 PolarHBondContact O-N 3.34Å; F250-E252 VanDerWaalsContact C-N 3.32Å; F250-E252 PolarHBondContact O-N 3.32Å; E252-R256 WeakPolarHBondContact O-CA 3.28Å; E252-R256 VanDerWaalsContact O-CB 3.28Å; E252-R256 WeakPolarHBondContact O-CB 3.39Å; E252-R256 PolarHBondContact O-N 3.36Å; E252-H257 WeakPolarHBondContact CG-NE2 3.2Å; E252-H257 PolarHBondContact O-N 3.5Å; E252-H257 IonicContact OE1-CD2 3.12Å; E252-H257 IonicContact OE1-CE1 3.82Å; E252-H257 IonicContact OE1-NE2 3.7Å; E252-H257 PolarHBondContact OE1-NE2 3.31Å; E252-H257 IonicContact OE2-NE2 3.3Å; E252-Y322 HydrophobicContact CB-CD2 3.41Å; E252-Y322 VanDerWaalsContact CB-CD2 3.41Å; E252-Y322 HydrophobicContact CB-CE2 3.44Å; E252-Y322 VanDerWaalsContact CB-CE2 3.44Å; E252-Y322 HydrophobicContact CB-CG 4.28Å; E252-Y322 HydrophobicContact CG-CD2 3.72Å; E252-Y322 HydrophobicContact CG-CE1 4.48Å; E252-Y322 HydrophobicContact CG-CE2 3.31Å; E252-Y322 HydrophobicContact CG-CG 4.41Å; E252-Y322 PolarHBondContact OE1-OH 2.93Å; E252-Y606 PolarHBondContact OE2-OH 3.19Å; E252-Y606 VanDerWaalsContact OE2-OH 3.14Å
253	L	98.3	Very high	97.1	Very high	12 Å²	12	38.5 Å²	38.5	6%	0.063	17%	0.174	C	C	.	.	I	π-helix	trans	-58.6	-61.7	-178.8	173.2	63.2	0	0	0	110.6	F227 E249 F250 H257 F258 Y606	F227-L253 HydrophobicContact CB-CD2 4.5Å; F227-L253 HydrophobicContact CD2-CD2 3.85Å; E249-L253 WeakPolarHBondContact O-CB 3.48Å; E249-L253 PolarHBondContact O-N 3.25Å; F250-L253 PolarHBondContact O-N 2.85Å; L253-H257 PolarHBondContact O-N 3.33Å; L253-H257 VanDerWaalsContact O-N 3.08Å; L253-F258 HydrophobicContact CD1-CB 4.34Å; L253-F258 WeakPolarHBondContact O-CB 3.29Å; L253-F258 PolarHBondContact O-N 2.84Å; L253-Y606 HydrophobicContact CD1-CE2 4.11Å
254	Y	98.5	Very high	97.2	Very high	0 Å²	0	38 Å²	38	0%	0	17%	0.172	C	C	.	.	I	π-helix	trans	-82.3	-18	-174.1	-63.7	-60.8	0	0	0	113.5	M223 F227 F250 F258 Y260 I265	M223-Y254 HydrophobicContact CB-CE2 4.05Å; M223-Y254 HydrophobicContact CE-CD1 3.4Å; M223-Y254 HydrophobicContact CE-CD2 3.83Å; M223-Y254 HydrophobicContact CE-CE1 3.73Å; M223-Y254 HydrophobicContact CE-CE2 4.09Å; M223-Y254 HydrophobicContact CE-CG 3.45Å; M223-Y254 VanDerWaalsContact CE-CG 3.45Å; M223-Y254 WeakPolarHBondContact O-CE2 3.44Å; M223-Y254 PolarHBondContact O-OH 3.14Å; F227-Y254 HydrophobicContact CB-CE2 4.02Å; F250-Y254 HydrophobicContact CD1-CD2 4.2Å; F250-Y254 AromaticContact CD2-CD2 3.8Å; F250-Y254 HydrophobicContact CD2-CD2 3.8Å; F250-Y254 AromaticContact CD2-CE2 3.79Å; F250-Y254 HydrophobicContact CD2-CE2 3.79Å; F250-Y254 AromaticContact CE1-CD2 3.87Å; F250-Y254 HydrophobicContact CE1-CD2 3.87Å; F250-Y254 AromaticContact CE2-CD2 3.48Å; F250-Y254 HydrophobicContact CE2-CD2 3.48Å; F250-Y254 VanDerWaalsContact CE2-CD2 3.48Å; F250-Y254 AromaticContact CE2-CE2 3.4Å; F250-Y254 HydrophobicContact CE2-CE2 3.4Å; F250-Y254 VanDerWaalsContact CE2-CE2 3.4Å; F250-Y254 HydrophobicContact CG-CD2 4.14Å; F250-Y254 AromaticContact CZ-CD2 3.5Å; F250-Y254 HydrophobicContact CZ-CD2 3.5Å; F250-Y254 VanDerWaalsContact CZ-CD2 3.5Å; F250-Y254 AromaticContact CZ-CE2 3.86Å; F250-Y254 HydrophobicContact CZ-CE2 3.86Å; F250-Y254 PolarHBondContact O-N 3.34Å; Y254-F258 HydrophobicContact CD1-CB 3.93Å; Y254-F258 HydrophobicContact CD1-CD1 4.38Å; Y254-F258 HydrophobicContact CD1-CD2 4.18Å; Y254-F258 AromaticContact CD1-CG 3.89Å; Y254-F258 HydrophobicContact CD1-CG 3.89Å; Y254-F258 AromaticContact CE1-CD2 3.92Å; Y254-F258 HydrophobicContact CE1-CD2 3.92Å; Y254-F258 HydrophobicContact CE1-CE2 4.35Å; Y254-F258 HydrophobicContact CE1-CG 4.11Å; Y254-Y260 WeakPolarHBondContact O-CE2 3.46Å; Y254-Y260 PolarHBondContact O-OH 3.15Å; Y254-Y260 VanDerWaalsContact O-OH 3.13Å; Y254-I265 HydrophobicContact CE1-CD1 3.87Å
255	G	97.8	Very high	97.3	Very high	0 Å²	0	38 Å²	38	0%	0	17%	0.172	C	C	.	.	I	π-helix	trans	-77	-39.3	169.5	0	0	0	0	0	112.9	F251 K315	F251-G255 WeakPolarHBondContact O-CA 3.32Å; F251-G255 PolarHBondContact O-N 3.42Å; G255-K315 WeakPolarHBondContact O-CE 3.43Å; G255-K315 VanDerWaalsContact O-CG 3.24Å; G255-K315 WeakPolarHBondContact O-CG 3.37Å; G255-K315 PolarHBondContact O-NZ 2.91Å
256	R	96.7	Very high	97.4	Very high	111 Å²	111	37.1 Å²	37.1	42%	0.419	16%	0.164	S	C	.	.	I	π-helix	trans	-126.7	-44.9	-161.9	-45.7	-167.1	70.3	-149.8	1.7	114.9	E252 E319 Y322	E252-R256 WeakPolarHBondContact O-CA 3.28Å; E252-R256 VanDerWaalsContact O-CB 3.28Å; E252-R256 WeakPolarHBondContact O-CB 3.39Å; E252-R256 PolarHBondContact O-N 3.36Å; R256-E319 HydrophobicContact CG-CB 4.37Å; R256-E319 HydrophobicContact CG-CG 3.93Å; R256-E319 IonicContact CZ-OE1 2.75Å; R256-E319 IonicContact NE-OE1 2.73Å; R256-E319 PolarHBondContact NE-OE1 3.14Å; R256-E319 IonicContact NH2-OE1 2.66Å; R256-Y322 HydrophobicContact CG-CD1 4.42Å
257	H	97	Very high	97.4	Very high	102 Å²	102	37.1 Å²	37.1	47%	0.472	16%	0.164	S	C	.	.	I	π-helix	trans	-102	-23.4	-166.5	-59.3	-56.8	0	0	0	115	E252 L253 N259 Y606	E252-H257 WeakPolarHBondContact CG-NE2 3.2Å; E252-H257 PolarHBondContact O-N 3.5Å; E252-H257 IonicContact OE1-CD2 3.12Å; E252-H257 IonicContact OE1-CE1 3.82Å; E252-H257 IonicContact OE1-NE2 3.7Å; E252-H257 PolarHBondContact OE1-NE2 3.31Å; E252-H257 IonicContact OE2-NE2 3.3Å; L253-H257 PolarHBondContact O-N 3.33Å; L253-H257 VanDerWaalsContact O-N 3.08Å; H257-N259 PolarHBondContact O-N 3.47Å; H257-Y606 PolarHBondContact CD2-OH 2.91Å
258	F	97.5	Very high	97.2	Very high	14 Å²	14	39.6 Å²	39.6	6%	0.061	18%	0.179	C	C	.	.			trans	-67.7	125	-177.7	-174.8	-96.1	0	0	0	111.3	L253 Y254 Y260 T263 I265 Y273	L253-F258 HydrophobicContact CD1-CB 4.34Å; L253-F258 WeakPolarHBondContact O-CB 3.29Å; L253-F258 PolarHBondContact O-N 2.84Å; Y254-F258 HydrophobicContact CD1-CB 3.93Å; Y254-F258 HydrophobicContact CD1-CD1 4.38Å; Y254-F258 HydrophobicContact CD1-CD2 4.18Å; Y254-F258 AromaticContact CD1-CG 3.89Å; Y254-F258 HydrophobicContact CD1-CG 3.89Å; Y254-F258 AromaticContact CE1-CD2 3.92Å; Y254-F258 HydrophobicContact CE1-CD2 3.92Å; Y254-F258 HydrophobicContact CE1-CE2 4.35Å; Y254-F258 HydrophobicContact CE1-CG 4.11Å; F258-Y260 VanDerWaalsContact C-N 3.31Å; F258-Y260 HydrophobicContact CB-CD2 4.47Å; F258-Y260 HydrophobicContact CB-CE2 4.17Å; F258-Y260 HydrophobicContact CD1-CD1 4.13Å; F258-Y260 AromaticContact CD1-CD2 3.74Å; F258-Y260 HydrophobicContact CD1-CD2 3.74Å; F258-Y260 HydrophobicContact CD1-CE1 4.2Å; F258-Y260 AromaticContact CD1-CE2 3.78Å; F258-Y260 HydrophobicContact CD1-CE2 3.78Å; F258-Y260 AromaticContact CD1-CG 3.9Å; F258-Y260 HydrophobicContact CD1-CG 3.9Å; F258-Y260 HydrophobicContact CE1-CD1 4.3Å; F258-Y260 HydrophobicContact CE1-CG 4.34Å; F258-Y260 HydrophobicContact CG-CE2 4.45Å; F258-Y260 VanDerWaalsContact O-CD2 3.26Å; F258-Y260 WeakPolarHBondContact O-CD2 3.41Å; F258-Y260 PolarHBondContact O-N 3.33Å; F258-T263 HydrophobicContact CE2-CG2 3.71Å; F258-T263 HydrophobicContact CZ-CG2 3.75Å; F258-I265 HydrophobicContact CE2-CD1 4.25Å; F258-I265 HydrophobicContact CE2-CG1 3.87Å; F258-I265 HydrophobicContact CZ-CD1 4.06Å; F258-I265 HydrophobicContact CZ-CG1 3.64Å; F258-Y273 HydrophobicContact CD2-CE1 4.35Å; F258-Y273 AromaticContact CE2-CD1 3.8Å; F258-Y273 HydrophobicContact CE2-CD1 3.8Å; F258-Y273 AromaticContact CE2-CE1 3.8Å; F258-Y273 HydrophobicContact CE2-CE1 3.8Å; F258-Y273 HydrophobicContact CE2-CG 4.47Å
259	N	96.7	Very high	96.9	Very high	73 Å²	73	43.5 Å²	43.5	39%	0.39	20%	0.199	S	C	.	.			trans	-82.1	74.8	-177.1	-176.1	-1.9	0	0	0	111.7	H257 R261 N262 T263	H257-N259 PolarHBondContact O-N 3.47Å; N259-R261 PolarHBondContact O-N 3.44Å; N259-R261 WeakPolarHBondContact OD1-CB 3.26Å; N259-R261 PolarHBondContact OD1-N 2.89Å; N259-N262 PolarHBondContact O-N 2.87Å; N259-N262 PolarHBondContact OD1-N 3.1Å; N259-T263 VanDerWaalsContact O-CB 3.29Å; N259-T263 WeakPolarHBondContact O-CB 3.49Å; N259-T263 PolarHBondContact O-N 2.94Å
260	Y	96.8	Very high	96.5	Very high	11 Å²	11	43.7 Å²	43.7	4%	0.043	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50	-22	172.6	-74.2	-88.9	0	0	0	114.2	Y254 F258 K276 L291 L292 K315	Y254-Y260 WeakPolarHBondContact O-CE2 3.46Å; Y254-Y260 PolarHBondContact O-OH 3.15Å; Y254-Y260 VanDerWaalsContact O-OH 3.13Å; F258-Y260 VanDerWaalsContact C-N 3.31Å; F258-Y260 HydrophobicContact CB-CD2 4.47Å; F258-Y260 HydrophobicContact CB-CE2 4.17Å; F258-Y260 HydrophobicContact CD1-CD1 4.13Å; F258-Y260 AromaticContact CD1-CD2 3.74Å; F258-Y260 HydrophobicContact CD1-CD2 3.74Å; F258-Y260 HydrophobicContact CD1-CE1 4.2Å; F258-Y260 AromaticContact CD1-CE2 3.78Å; F258-Y260 HydrophobicContact CD1-CE2 3.78Å; F258-Y260 AromaticContact CD1-CG 3.9Å; F258-Y260 HydrophobicContact CD1-CG 3.9Å; F258-Y260 HydrophobicContact CE1-CD1 4.3Å; F258-Y260 HydrophobicContact CE1-CG 4.34Å; F258-Y260 HydrophobicContact CG-CE2 4.45Å; F258-Y260 VanDerWaalsContact O-CD2 3.26Å; F258-Y260 WeakPolarHBondContact O-CD2 3.41Å; F258-Y260 PolarHBondContact O-N 3.33Å; Y260-K276 PolarHBondContact O-NZ 2.6Å; Y260-L291 WeakPolarHBondContact O-CD1 3.36Å; Y260-L292 HydrophobicContact CD1-CB 4.31Å; Y260-L292 HydrophobicContact CD1-CD1 4.46Å; Y260-L292 HydrophobicContact CE1-CB 4.21Å; Y260-L292 HydrophobicContact CE1-CD1 3.95Å; Y260-L292 HydrophobicContact CE1-CG 4.46Å; Y260-K315 HydrophobicContact CD2-CD 4.28Å; Y260-K315 HydrophobicContact CD2-CG 4.28Å; Y260-K315 HydrophobicContact CE2-CB 3.97Å; Y260-K315 HydrophobicContact CE2-CD 4.33Å; Y260-K315 HydrophobicContact CE2-CG 3.83Å
261	R	95.3	Very high	96.3	Very high	205 Å²	205	44.6 Å²	44.6	77%	0.774	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-55.1	178.4	-163.7	-170	175.4	104	2.2	111.1	N259 K276	N259-R261 PolarHBondContact O-N 3.44Å; N259-R261 WeakPolarHBondContact OD1-CB 3.26Å; N259-R261 PolarHBondContact OD1-N 2.89Å; R261-K276 WeakPolarHBondContact O-CD 3.39Å; R261-K276 WeakPolarHBondContact O-CE 3.25Å; R261-K276 PolarHBondContact O-NZ 3.44Å
262	N	96.4	Very high	96.1	Very high	77 Å²	77	45.2 Å²	45.2	41%	0.412	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.8	-14.8	-165.5	-59.1	6	0	0	0	114.5	N259 K276	N259-N262 PolarHBondContact O-N 2.87Å; N259-N262 PolarHBondContact OD1-N 3.1Å; N262-K276 WeakPolarHBondContact O-CG 3.34Å; N262-K276 PolarHBondContact O-N 2.78Å
263	T	97.6	Very high	96.1	Very high	9 Å²	9	43.8 Å²	43.8	6%	0.055	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	142.3	-172.7	-60.8	0	0	0	0	111.8	F258 N259 Y273 V274 K276 I602	F258-T263 HydrophobicContact CE2-CG2 3.71Å; F258-T263 HydrophobicContact CZ-CG2 3.75Å; N259-T263 VanDerWaalsContact O-CB 3.29Å; N259-T263 WeakPolarHBondContact O-CB 3.49Å; N259-T263 PolarHBondContact O-N 2.94Å; T263-Y273 HydrophobicContact CG2-CD1 4.27Å; T263-Y273 HydrophobicContact CG2-CG 4.18Å; T263-V274 WeakPolarHBondContact CA-O 3.41Å; T263-K276 WeakPolarHBondContact O-CE 3.43Å; T263-I602 HydrophobicContact CG2-CD1 4.29Å
264	A	97.9	Very high	96	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	154.3	168.4	0	0	0	0	0	111	V274 K276 V279 C293	A264-V274 HydrophobicContact CB-CG2 4.16Å; A264-V274 PolarHBondContact N-O 3.05Å; A264-V274 PolarHBondContact O-N 3.3Å; A264-V274 VanDerWaalsContact O-N 3.15Å; A264-K276 HydrophobicContact CB-CG 4.05Å; A264-V279 HydrophobicContact CB-CB 4.5Å; A264-V279 HydrophobicContact CB-CG2 3.52Å; A264-C293 VanDerWaalsContact CA-O 3.31Å; A264-C293 WeakPolarHBondContact CA-O 3.45Å; A264-C293 HydrophobicContact CB-CB 3.77Å
265	I	98.2	Very high	95.9	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	120.1	179.7	-60.6	-177.4	0	0	0	109.7	M223 S226 Y254 F258 I267 Y273 L292 C293 I294 E295	M223-I265 HydrophobicContact CG-CD1 3.94Å; S226-I265 WeakPolarHBondContact OG-CG2 3.38Å; Y254-I265 HydrophobicContact CE1-CD1 3.87Å; F258-I265 HydrophobicContact CE2-CD1 4.25Å; F258-I265 HydrophobicContact CE2-CG1 3.87Å; F258-I265 HydrophobicContact CZ-CD1 4.06Å; F258-I265 HydrophobicContact CZ-CG1 3.64Å; I265-I267 HydrophobicContact CG2-CG2 3.99Å; I265-Y273 HydrophobicContact CG1-CD1 4.36Å; I265-Y273 HydrophobicContact CG1-CE1 4.17Å; I265-L292 HydrophobicContact CD1-CD1 4.32Å; I265-C293 PolarHBondContact N-O 3.16Å; I265-I294 HydrophobicContact CB-CB 4.43Å; I265-I294 HydrophobicContact CB-CG1 4.21Å; I265-I294 HydrophobicContact CB-CG2 4.18Å; I265-I294 HydrophobicContact CD1-CD1 4.46Å; I265-I294 HydrophobicContact CD1-CG1 4.23Å; I265-I294 HydrophobicContact CG1-CG1 4.49Å; I265-I294 HydrophobicContact CG2-CG2 4.26Å; I265-E295 PolarHBondContact O-N 3.24Å
266	R	97.5	Very high	95.8	Very high	50 Å²	50	49 Å²	49	19%	0.189	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	128.8	167.8	-179.2	172.4	-70.2	164.8	-0.5	108.7	T268 G271 C272 E295	R266-T268 WeakPolarHBondContact CG-OG1 3.29Å; R266-G271 CarbonylContact O-C 3.58Å; R266-G271 VanDerWaalsContact O-CA 3.27Å; R266-G271 WeakPolarHBondContact O-CA 3.31Å; R266-C272 WeakPolarHBondContact CB-O 3.28Å; R266-C272 PolarHBondContact N-O 2.93Å; R266-C272 VanDerWaalsContact N-O 3.09Å; R266-C272 PolarHBondContact O-N 3.09Å; R266-C272 VanDerWaalsContact O-O 3.05Å; R266-E295 VanDerWaalsContact CB-OE2 3.31Å; R266-E295 WeakPolarHBondContact CB-OE2 3.24Å; R266-E295 WeakPolarHBondContact CG-OE2 3.21Å; R266-E295 IonicContact CZ-OE1 2.72Å; R266-E295 IonicContact CZ-OE2 2.72Å; R266-E295 VanDerWaalsContact CZ-OE2 3.3Å; R266-E295 IonicContact NE-OE1 2.78Å; R266-E295 IonicContact NE-OE2 2.83Å; R266-E295 PolarHBondContact NE-OE2 2.86Å; R266-E295 VanDerWaalsContact NH2-CD 3.34Å; R266-E295 IonicContact NH2-OE1 3.78Å; R266-E295 PolarHBondContact NH2-OE1 3.28Å; R266-E295 IonicContact NH2-OE2 3.78Å; R266-E295 PolarHBondContact NH2-OE2 3.47Å; R266-E295 VanDerWaalsContact NH2-OE2 3.12Å
267	I	96.1	Very high	95.7	Very high	6 Å²	6	47.6 Å²	47.6	3%	0.031	24%	0.24	C	C	.	.			trans	-110.9	-7.2	177.3	64.3	173.3	0	0	0	114.1	F184 L222 V225 Q229 I265 P297	F184-I267 HydrophobicContact CE2-CD1 3.9Å; F184-I267 HydrophobicContact CZ-CD1 3.92Å; L222-I267 HydrophobicContact CB-CD1 4.19Å; L222-I267 HydrophobicContact CD1-CD1 3.94Å; L222-I267 HydrophobicContact CD2-CD1 3.62Å; L222-I267 HydrophobicContact CG-CD1 4.09Å; V225-I267 HydrophobicContact CG1-CB 4.4Å; V225-I267 HydrophobicContact CG1-CD1 4.5Å; V225-I267 HydrophobicContact CG1-CG2 4.41Å; Q229-I267 PolarHBondContact NE2-O 3.49Å; I265-I267 HydrophobicContact CG2-CG2 3.99Å; I267-P297 HydrophobicContact CD1-CG 4.11Å; I267-P297 HydrophobicContact CG1-CB 4.4Å; I267-P297 HydrophobicContact CG1-CG 4.45Å
268	T	94.1	Very high	95.6	Very high	51 Å²	51	43.5 Å²	43.5	31%	0.313	22%	0.222	S	C	.	.	S	Bend	trans	-71.6	157	174.9	55.7	0	0	0	0	111.1	R266 G270 G271 P297	R266-T268 WeakPolarHBondContact CG-OG1 3.29Å; T268-G270 PolarHBondContact O-N 3.49Å; T268-G271 PolarHBondContact O-N 3.38Å; T268-P297 HydrophobicContact CG2-CB 3.97Å
269	N	90.7	Very high	95.4	Very high	101 Å²	101	42.9 Å²	42.9	54%	0.54	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	54	44	174	-58.6	-44.5	0	0	0	114.7	G271	N269-G271 VanDerWaalsContact C-N 3.31Å
270	G	88.5	Confident	95.2	Very high	56 Å²	56	43.4 Å²	43.4	58%	0.577	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	90.8	-17.5	-177.9	0	0	0	0	0	114.6	Q229 T268	Q229-G270 WeakPolarHBondContact CB-O 3.17Å; Q229-G270 VanDerWaalsContact CD-O 3.24Å; Q229-G270 VanDerWaalsContact CG-O 3.28Å; Q229-G270 WeakPolarHBondContact CG-O 3.31Å; Q229-G270 PolarHBondContact NE2-O 3.08Å; T268-G270 PolarHBondContact O-N 3.49Å
271	G	93.6	Very high	95	Very high	20 Å²	20	50 Å²	50	21%	0.206	25%	0.251	C	S	.	.			trans	88.6	145.8	-178.3	0	0	0	0	0	113.4	R266 T268 N269	R266-G271 CarbonylContact O-C 3.58Å; R266-G271 VanDerWaalsContact O-CA 3.27Å; R266-G271 WeakPolarHBondContact O-CA 3.31Å; T268-G271 PolarHBondContact O-N 3.38Å; N269-G271 VanDerWaalsContact C-N 3.31Å
272	C	95.4	Very high	94.8	Very high	13 Å²	13	44.7 Å²	44.7	9%	0.088	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164	160.3	173	59.8	0	0	0	0	111.5	R266	R266-C272 WeakPolarHBondContact CB-O 3.28Å; R266-C272 PolarHBondContact N-O 2.93Å; R266-C272 VanDerWaalsContact N-O 3.09Å; R266-C272 PolarHBondContact O-N 3.09Å; R266-C272 VanDerWaalsContact O-O 3.05Å
273	Y	97.1	Very high	94.6	Very high	9 Å²	9	41.8 Å²	41.8	4%	0.035	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	132.5	164.9	-60.2	-47.3	0	0	0	110.6	S226 H230 F258 T263 I265 I602	S226-Y273 WeakPolarHBondContact OG-CE1 3.43Å; H230-Y273 AromaticContact CD2-CE2 3.84Å; H230-Y273 AromaticContact CE1-CD2 3.92Å; H230-Y273 AromaticContact CE1-CE1 3.83Å; H230-Y273 AromaticContact CE1-CE2 3.58Å; H230-Y273 AromaticContact CE1-CZ 3.5Å; H230-Y273 AromaticContact CG-CE2 3.91Å; H230-Y273 AromaticContact ND1-CE2 3.75Å; H230-Y273 AromaticContact ND1-CZ 3.57Å; H230-Y273 PolarHBondContact ND1-OH 3.26Å; H230-Y273 AromaticContact NE2-CD2 3.66Å; H230-Y273 AromaticContact NE2-CE2 3.63Å; F258-Y273 HydrophobicContact CD2-CE1 4.35Å; F258-Y273 AromaticContact CE2-CD1 3.8Å; F258-Y273 HydrophobicContact CE2-CD1 3.8Å; F258-Y273 AromaticContact CE2-CE1 3.8Å; F258-Y273 HydrophobicContact CE2-CE1 3.8Å; F258-Y273 HydrophobicContact CE2-CG 4.47Å; T263-Y273 HydrophobicContact CG2-CD1 4.27Å; T263-Y273 HydrophobicContact CG2-CG 4.18Å; I265-Y273 HydrophobicContact CG1-CD1 4.36Å; I265-Y273 HydrophobicContact CG1-CE1 4.17Å; Y273-I602 PolarHBondContact O-N 2.88Å
274	V	96.3	Very high	94.3	Very high	2 Å²	2	48.6 Å²	48.6	1%	0.012	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	162.3	-179.8	-63	0	0	0	0	110.7	T263 A264 V279	T263-V274 WeakPolarHBondContact CA-O 3.41Å; A264-V274 HydrophobicContact CB-CG2 4.16Å; A264-V274 PolarHBondContact N-O 3.05Å; A264-V274 PolarHBondContact O-N 3.3Å; A264-V274 VanDerWaalsContact O-N 3.15Å; V274-V279 HydrophobicContact CG2-CG2 3.73Å
275	R	97	Very high	93.8	Very high	99 Å²	99	61 Å²	61	37%	0.374	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	143.1	170.7	-64.3	178.1	-67.5	117.4	-3.7	110.2	E277 V278 D600 I602	R275-E277 WeakPolarHBondContact CB-OE2 3.47Å; R275-E277 WeakPolarHBondContact CD-OE2 3.32Å; R275-E277 IonicContact CZ-OE2 2.74Å; R275-E277 IonicContact NE-OE2 3.64Å; R275-E277 IonicContact NH1-OE2 2.73Å; R275-E277 PolarHBondContact NH1-OE2 3.44Å; R275-E277 PolarHBondContact O-N 3.05Å; R275-V278 HydrophobicContact CB-CG2 4.33Å; R275-V278 WeakPolarHBondContact O-CB 3.5Å; R275-V278 PolarHBondContact O-N 3.47Å; R275-D600 IonicContact CZ-OD1 3.15Å; R275-D600 IonicContact NE-OD1 3.64Å; R275-D600 IonicContact NH2-OD1 3.78Å; R275-D600 PolarHBondContact NH2-OD1 3.15Å; R275-I602 HydrophobicContact CG-CD1 3.86Å; R275-I602 HydrophobicContact CG-CG1 4.29Å
276	K	96.4	Very high	93.3	Very high	19 Å²	19	64.6 Å²	64.6	8%	0.083	34%	0.337	C	S	.	.	H	α-helix	trans	-59.2	-30.7	-179.7	-78.9	177.5	-174.7	-172.4	0	113.2	Y260 R261 N262 T263 A264 V278 V279 Q280 P289 S290 L291 C293	Y260-K276 PolarHBondContact O-NZ 2.6Å; R261-K276 WeakPolarHBondContact O-CD 3.39Å; R261-K276 WeakPolarHBondContact O-CE 3.25Å; R261-K276 PolarHBondContact O-NZ 3.44Å; N262-K276 WeakPolarHBondContact O-CG 3.34Å; N262-K276 PolarHBondContact O-N 2.78Å; T263-K276 WeakPolarHBondContact O-CE 3.43Å; A264-K276 HydrophobicContact CB-CG 4.05Å; K276-V278 PolarHBondContact O-N 2.95Å; K276-V279 PolarHBondContact O-N 3.43Å; K276-V279 VanDerWaalsContact O-N 3.12Å; K276-Q280 PolarHBondContact O-N 2.93Å; K276-P289 HydrophobicContact CB-CB 4Å; K276-P289 HydrophobicContact CB-CG 4.09Å; K276-P289 HydrophobicContact CD-CB 4.03Å; K276-P289 HydrophobicContact CG-CB 4.06Å; K276-S290 WeakPolarHBondContact CE-O 3.39Å; K276-S290 PolarHBondContact NZ-O 3.09Å; K276-L291 PolarHBondContact NZ-O 2.85Å; K276-C293 HydrophobicContact CD-CB 4.27Å; K276-C293 HydrophobicContact CG-CB 4.13Å
277	E	94.4	Very high	93	Very high	82 Å²	82	64.9 Å²	64.9	38%	0.383	34%	0.342	S	S	.	.	H	α-helix	trans	-59.3	-29.7	173.9	-46.8	84.9	-96.5	0	0	113	R275 Q281	R275-E277 WeakPolarHBondContact CB-OE2 3.47Å; R275-E277 WeakPolarHBondContact CD-OE2 3.32Å; R275-E277 IonicContact CZ-OE2 2.74Å; R275-E277 IonicContact NE-OE2 3.64Å; R275-E277 IonicContact NH1-OE2 2.73Å; R275-E277 PolarHBondContact NH1-OE2 3.44Å; R275-E277 PolarHBondContact O-N 3.05Å; E277-Q281 WeakPolarHBondContact O-CG 3.47Å; E277-Q281 PolarHBondContact O-NE2 3.36Å; E277-Q281 VanDerWaalsContact O-NE2 3.14Å
278	V	93.6	Very high	92.8	Very high	16 Å²	16	73.4 Å²	73.4	10%	0.097	37%	0.374	C	S	.	.	H	α-helix	trans	-73.6	-37.3	176.8	-178.6	0	0	0	0	110.6	R275 K276	R275-V278 HydrophobicContact CB-CG2 4.33Å; R275-V278 WeakPolarHBondContact O-CB 3.5Å; R275-V278 PolarHBondContact O-N 3.47Å; K276-V278 PolarHBondContact O-N 2.95Å
279	V	93.2	Very high	92.9	Very high	1 Å²	1	72.1 Å²	72.1	1%	0.006	37%	0.367	C	S	.	.	H	α-helix	trans	-72.8	-38.3	175.7	-173.8	0	0	0	0	111.1	A264 V274 K276 Q281 N282 M283 E295	A264-V279 HydrophobicContact CB-CB 4.5Å; A264-V279 HydrophobicContact CB-CG2 3.52Å; V274-V279 HydrophobicContact CG2-CG2 3.73Å; K276-V279 PolarHBondContact O-N 3.43Å; K276-V279 VanDerWaalsContact O-N 3.12Å; V279-Q281 PolarHBondContact O-N 3.06Å; V279-N282 PolarHBondContact O-N 3.08Å; V279-M283 HydrophobicContact CB-CE 4.46Å; V279-M283 HydrophobicContact CG1-CE 3.63Å; V279-E295 HydrophobicContact CB-CG 4.23Å; V279-E295 HydrophobicContact CG1-CG 3.38Å; V279-E295 HydrophobicContact CG2-CG 3.84Å
280	Q	93.6	Very high	93.2	Very high	84 Å²	84	68.3 Å²	68.3	39%	0.393	35%	0.348	S	S	.	.	H	α-helix	trans	-61	-27.6	-178.7	-166.2	168.5	17.4	0	0	113.2	K276 N282 M283 L287 P289	K276-Q280 PolarHBondContact O-N 2.93Å; Q280-N282 PolarHBondContact O-N 2.9Å; Q280-M283 PolarHBondContact O-N 2.79Å; Q280-M283 VanDerWaalsContact O-N 3.14Å; Q280-L287 PolarHBondContact NE2-O 3.38Å; Q280-P289 HydrophobicContact CB-CG 3.75Å; Q280-P289 HydrophobicContact CG-CG 4.15Å
281	Q	92.1	Very high	93.5	Very high	151 Å²	151	68.7 Å²	68.7	71%	0.706	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-26.4	173.9	-69.8	164	39.7	0	0	113.2	E277 V279	E277-Q281 WeakPolarHBondContact O-CG 3.47Å; E277-Q281 PolarHBondContact O-NE2 3.36Å; E277-Q281 VanDerWaalsContact O-NE2 3.14Å; V279-Q281 PolarHBondContact O-N 3.06Å
282	N	90.8	Very high	93.6	Very high	93 Å²	93	67.8 Å²	67.8	50%	0.497	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-7.4	178.5	-60.1	-32.9	0	0	0	113	V279 Q280 G301	V279-N282 PolarHBondContact O-N 3.08Å; Q280-N282 PolarHBondContact O-N 2.9Å; N282-G301 WeakPolarHBondContact O-CA 3.25Å
283	M	93.4	Very high	93.8	Very high	16 Å²	16	67.1 Å²	67.1	8%	0.079	32%	0.322	C	S	.	.	S	Bend	trans	-83.6	157	-179.6	-62.3	-167.6	179.8	0	0	111.9	V279 Q280 L287 P289 D303 R306	V279-M283 HydrophobicContact CB-CE 4.46Å; V279-M283 HydrophobicContact CG1-CE 3.63Å; Q280-M283 PolarHBondContact O-N 2.79Å; Q280-M283 VanDerWaalsContact O-N 3.14Å; M283-L287 HydrophobicContact CB-CB 4.17Å; M283-L287 HydrophobicContact SD-CB 4.36Å; M283-P289 HydrophobicContact CE-CB 4.01Å; M283-P289 HydrophobicContact CE-CG 3.91Å; M283-P289 HydrophobicContact SD-CG 4.1Å; M283-D303 HydrophobicContact CE-CB 3.84Å; M283-R306 PolarHBondContact SD-NH2 3.01Å
284	E	90.2	Very high	93.8	Very high	151 Å²	151	66.7 Å²	66.7	71%	0.706	32%	0.321	S	S	*	.	P	Polyproline II helix	trans	-59	147.4	170.6	-56.6	-178.5	150.3	0	0	111.8	G286 L287	E284-G286 PolarHBondContact O-N 2.68Å; E284-L287 HydrophobicContact CB-CD1 3.78Å; E284-L287 HydrophobicContact CB-CG 4.11Å; E284-L287 HydrophobicContact CG-CD1 4.22Å; E284-L287 WeakPolarHBondContact O-CB 3.31Å; E284-L287 PolarHBondContact O-N 2.96Å
285	R	88.4	Confident	93.8	Very high	260 Å²	260	67.7 Å²	67.7	98%	0.981	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	126	-175.3	-68.3	-175.4	178.8	-175.8	1.1	111.3
286	G	88.1	Confident	93.8	Very high	76 Å²	76	64 Å²	64	78%	0.784	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	97	-19.9	-178.5	0	0	0	0	0	113.9	E284	E284-G286 PolarHBondContact O-N 2.68Å
287	L	90.3	Very high	93.7	Very high	57 Å²	57	64.8 Å²	64.8	30%	0.298	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-67.3	137.7	171.8	-62.7	-176.8	0	0	0	110.6	Q280 M283 E284	Q280-L287 PolarHBondContact NE2-O 3.38Å; M283-L287 HydrophobicContact CB-CB 4.17Å; M283-L287 HydrophobicContact SD-CB 4.36Å; E284-L287 HydrophobicContact CB-CD1 3.78Å; E284-L287 HydrophobicContact CB-CG 4.11Å; E284-L287 HydrophobicContact CG-CD1 4.22Å; E284-L287 WeakPolarHBondContact O-CB 3.31Å; E284-L287 PolarHBondContact O-N 2.96Å
288	R	92.9	Very high	93.7	Very high	184 Å²	184	62.8 Å²	62.8	69%	0.694	31%	0.311	S	S	*	.	P	Polyproline II helix	trans	-103.5	143.8	169.2	-64.3	-179.3	-179.6	176.5	0.2	109.3	R306	R288-R306 PolarHBondContact O-NH1 3.32Å
289	P	95	Very high	93.7	Very high	25 Å²	25	64.4 Å²	64.4	16%	0.162	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-56.9	138.9	165.7	-26.7	36.2	0	0	0	111.2	K276 Q280 M283 C293	K276-P289 HydrophobicContact CB-CB 4Å; K276-P289 HydrophobicContact CB-CG 4.09Å; K276-P289 HydrophobicContact CD-CB 4.03Å; K276-P289 HydrophobicContact CG-CB 4.06Å; Q280-P289 HydrophobicContact CB-CG 3.75Å; Q280-P289 HydrophobicContact CG-CG 4.15Å; M283-P289 HydrophobicContact CE-CB 4.01Å; M283-P289 HydrophobicContact CE-CG 3.91Å; M283-P289 HydrophobicContact SD-CG 4.1Å; P289-C293 HydrophobicContact CB-CB 4.27Å
290	S	96.1	Very high	93.5	Very high	21 Å²	21	70 Å²	70	15%	0.147	36%	0.359	C	S	.	.			trans	-76.8	179.6	178.9	70.1	0	0	0	0	112.4	K276 L292 D303 G305	K276-S290 WeakPolarHBondContact CE-O 3.39Å; K276-S290 PolarHBondContact NZ-O 3.09Å; S290-L292 PolarHBondContact OG-O 2.99Å; S290-D303 VanDerWaalsContact CB-OD2 3.27Å; S290-D303 WeakPolarHBondContact CB-OD2 3.35Å; S290-D303 PolarHBondContact N-OD2 3.16Å; S290-D303 PolarHBondContact OG-OD1 3.37Å; S290-D303 PolarHBondContact OG-OD2 3.04Å; S290-G305 PolarHBondContact OG-O 3.31Å
291	L	95.2	Very high	93.5	Very high	63 Å²	63	66.6 Å²	66.6	33%	0.33	35%	0.347	S	S	.	.	S	Bend	trans	-66.6	-50.8	178.8	-172.6	65.7	0	0	0	111.2	Y260 K276 C293 A311 L312	Y260-L291 WeakPolarHBondContact O-CD1 3.36Å; K276-L291 PolarHBondContact NZ-O 2.85Å; L291-C293 PolarHBondContact O-N 3.35Å; L291-A311 HydrophobicContact CB-CB 4.47Å; L291-A311 HydrophobicContact CD2-CB 4.14Å; L291-A311 HydrophobicContact CG-CB 4.43Å; L291-L312 HydrophobicContact CD2-CD1 4.39Å; L291-L312 HydrophobicContact CD2-CD2 3.74Å; L291-L312 HydrophobicContact CD2-CG 3.6Å
292	L	97.3	Very high	93.6	Very high	1 Å²	1	62.5 Å²	62.5	1%	0.005	33%	0.33	C	S	.	.	S	Bend	trans	-92.3	80.1	168.1	174.2	51.1	0	0	0	109.1	L215 M223 Y260 I265 S290 I294 G305 A311	L215-L292 HydrophobicContact CD1-CD2 3.48Å; L215-L292 VanDerWaalsContact CD1-CD2 3.48Å; M223-L292 HydrophobicContact CE-CD1 4.37Å; M223-L292 HydrophobicContact SD-CD1 4.13Å; M223-L292 HydrophobicContact SD-CD2 3.74Å; Y260-L292 HydrophobicContact CD1-CB 4.31Å; Y260-L292 HydrophobicContact CD1-CD1 4.46Å; Y260-L292 HydrophobicContact CE1-CB 4.21Å; Y260-L292 HydrophobicContact CE1-CD1 3.95Å; Y260-L292 HydrophobicContact CE1-CG 4.46Å; I265-L292 HydrophobicContact CD1-CD1 4.32Å; S290-L292 PolarHBondContact OG-O 2.99Å; L292-I294 HydrophobicContact CD1-CD1 3.99Å; L292-I294 HydrophobicContact CD1-CG1 3.92Å; L292-I294 HydrophobicContact CD2-CD1 4.42Å; L292-I294 HydrophobicContact CG-CD1 4.03Å; L292-I294 HydrophobicContact CG-CG1 4.12Å; L292-I294 PolarHBondContact O-N 3.5Å; L292-G305 VanDerWaalsContact O-CA 3.29Å; L292-G305 WeakPolarHBondContact O-CA 3.37Å; L292-A311 HydrophobicContact CB-CB 3.86Å
293	C	97.8	Very high	93.8	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	122.3	-179.4	-168.9	0	0	0	0	111.1	A264 I265 K276 P289 L291 D303	A264-C293 VanDerWaalsContact CA-O 3.31Å; A264-C293 WeakPolarHBondContact CA-O 3.45Å; A264-C293 HydrophobicContact CB-CB 3.77Å; I265-C293 PolarHBondContact N-O 3.16Å; K276-C293 HydrophobicContact CD-CB 4.27Å; K276-C293 HydrophobicContact CG-CB 4.13Å; P289-C293 HydrophobicContact CB-CB 4.27Å; L291-C293 PolarHBondContact O-N 3.35Å; C293-D303 WeakPolarHBondContact CA-OD1 3.4Å; C293-D303 PolarHBondContact SG-OD2 3.1Å; C293-D303 VanDerWaalsContact SG-OD2 3.33Å
294	I	98	Very high	94	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	120.3	177.7	-50.9	-179.6	0	0	0	108.4	A219 L222 M223 I265 L292 D296 D303 V304	A219-I294 HydrophobicContact CB-CD1 4.1Å; L222-I294 HydrophobicContact CB-CG2 4.03Å; L222-I294 HydrophobicContact CD1-CG2 3.9Å; M223-I294 HydrophobicContact CG-CD1 3.78Å; M223-I294 HydrophobicContact SD-CD1 4.41Å; I265-I294 HydrophobicContact CB-CB 4.43Å; I265-I294 HydrophobicContact CB-CG1 4.21Å; I265-I294 HydrophobicContact CB-CG2 4.18Å; I265-I294 HydrophobicContact CD1-CD1 4.46Å; I265-I294 HydrophobicContact CD1-CG1 4.23Å; I265-I294 HydrophobicContact CG1-CG1 4.49Å; I265-I294 HydrophobicContact CG2-CG2 4.26Å; L292-I294 HydrophobicContact CD1-CD1 3.99Å; L292-I294 HydrophobicContact CD1-CG1 3.92Å; L292-I294 HydrophobicContact CD2-CD1 4.42Å; L292-I294 HydrophobicContact CG-CD1 4.03Å; L292-I294 HydrophobicContact CG-CG1 4.12Å; L292-I294 PolarHBondContact O-N 3.5Å; I294-D296 PolarHBondContact O-N 3.18Å; I294-D303 PolarHBondContact N-OD1 3.38Å; I294-D303 CarbonylContact O-C 3.44Å; I294-D303 WeakPolarHBondContact O-CA 3.47Å; I294-V304 HydrophobicContact CB-CB 4.24Å; I294-V304 HydrophobicContact CG2-CB 4.47Å; I294-V304 PolarHBondContact O-N 2.77Å
295	E	96.8	Very high	94.3	Very high	23 Å²	23	51.4 Å²	51.4	11%	0.107	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-69	128.6	175.2	-81.3	174.6	133.8	0	0	111.3	I265 R266 V279 P297	I265-E295 PolarHBondContact O-N 3.24Å; R266-E295 VanDerWaalsContact CB-OE2 3.31Å; R266-E295 WeakPolarHBondContact CB-OE2 3.24Å; R266-E295 WeakPolarHBondContact CG-OE2 3.21Å; R266-E295 IonicContact CZ-OE1 2.72Å; R266-E295 IonicContact CZ-OE2 2.72Å; R266-E295 VanDerWaalsContact CZ-OE2 3.3Å; R266-E295 IonicContact NE-OE1 2.78Å; R266-E295 IonicContact NE-OE2 2.83Å; R266-E295 PolarHBondContact NE-OE2 2.86Å; R266-E295 VanDerWaalsContact NH2-CD 3.34Å; R266-E295 IonicContact NH2-OE1 3.78Å; R266-E295 PolarHBondContact NH2-OE1 3.28Å; R266-E295 IonicContact NH2-OE2 3.78Å; R266-E295 PolarHBondContact NH2-OE2 3.47Å; R266-E295 VanDerWaalsContact NH2-OE2 3.12Å; V279-E295 HydrophobicContact CB-CG 4.23Å; V279-E295 HydrophobicContact CG1-CG 3.38Å; V279-E295 HydrophobicContact CG2-CG 3.84Å; E295-P297 WeakPolarHBondContact O-CD 3.35Å
296	D	95.8	Very high	94.6	Very high	21 Å²	21	42.8 Å²	42.8	11%	0.112	25%	0.245	C	C	.	.			trans	-73.2	116.9	173.6	-169.4	-30.4	0	0	0	110.4	I294 L298 C299 N302 V304	I294-D296 PolarHBondContact O-N 3.18Å; D296-L298 PolarHBondContact O-N 2.65Å; D296-L298 WeakPolarHBondContact OD1-CA 3.25Å; D296-L298 WeakPolarHBondContact OD1-CB 3.47Å; D296-L298 PolarHBondContact OD1-N 2.78Å; D296-C299 HydrophobicContact CB-CB 4.18Å; D296-C299 PolarHBondContact O-N 3.4Å; D296-C299 PolarHBondContact OD1-N 2.88Å; D296-C299 VanDerWaalsContact OD1-N 3.11Å; D296-C299 WeakPolarHBondContact OD2-CB 3.48Å; D296-N302 HydrophobicContact CB-CB 3.77Å; D296-N302 PolarHBondContact N-O 3.2Å; D296-N302 PolarHBondContact OD2-ND2 3.26Å; D296-V304 HydrophobicContact CB-CG2 3.57Å
297	P	95.3	Very high	94.8	Very high	35 Å²	35	45.5 Å²	45.5	23%	0.227	23%	0.231	C	C	.	.	S	Bend	trans	-71.8	-10.5	179.7	33.3	-39.4	0	0	0	113.5	L180 Y218 L222 I267 T268 E295	L180-P297 HydrophobicContact CD2-CB 4.07Å; L180-P297 HydrophobicContact CD2-CG 3.43Å; L180-P297 VanDerWaalsContact CD2-CG 3.43Å; Y218-P297 WeakPolarHBondContact OH-CD 3.4Å; Y218-P297 WeakPolarHBondContact OH-CG 3.14Å; L222-P297 HydrophobicContact CD1-CG 4.48Å; I267-P297 HydrophobicContact CD1-CG 4.11Å; I267-P297 HydrophobicContact CG1-CB 4.4Å; I267-P297 HydrophobicContact CG1-CG 4.45Å; T268-P297 HydrophobicContact CG2-CB 3.97Å; E295-P297 WeakPolarHBondContact O-CD 3.35Å
298	L	94.4	Very high	95.1	Very high	40 Å²	40	42.9 Å²	42.9	21%	0.209	22%	0.218	C	C	.	.	S	Bend	trans	-110.7	-13.2	-179.3	-62.3	174	0	0	0	112.9	K176 A177 L180 D296	K176-L298 HydrophobicContact CB-CD1 3.86Å; K176-L298 HydrophobicContact CB-CD2 4.15Å; A177-L298 VanDerWaalsContact CA-CD1 3.49Å; A177-L298 HydrophobicContact CB-CD1 3.86Å; A177-L298 VanDerWaalsContact N-CD1 3.35Å; L180-L298 HydrophobicContact CD2-CD1 4.22Å; L180-L298 HydrophobicContact CD2-CD2 4.23Å; L180-L298 HydrophobicContact CD2-CG 4.05Å; D296-L298 PolarHBondContact O-N 2.65Å; D296-L298 WeakPolarHBondContact OD1-CA 3.25Å; D296-L298 WeakPolarHBondContact OD1-CB 3.47Å; D296-L298 PolarHBondContact OD1-N 2.78Å
299	C	92.5	Very high	95.1	Very high	50 Å²	50	41.5 Å²	41.5	34%	0.338	21%	0.213	S	C	.	.	S	Bend	trans	-140.5	79	179.6	-164.5	0	0	0	0	110.6	D296 G301 N302	D296-C299 HydrophobicContact CB-CB 4.18Å; D296-C299 PolarHBondContact O-N 3.4Å; D296-C299 PolarHBondContact OD1-N 2.88Å; D296-C299 VanDerWaalsContact OD1-N 3.11Å; D296-C299 WeakPolarHBondContact OD2-CB 3.48Å; C299-G301 PolarHBondContact O-N 3.18Å; C299-N302 HydrophobicContact CB-CB 3.94Å; C299-N302 WeakPolarHBondContact O-CB 3.17Å; C299-N302 PolarHBondContact O-N 2.85Å
300	P	89.9	Confident	95.1	Very high	118 Å²	118	41.2 Å²	41.2	77%	0.766	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.6	131	-178.9	-27.7	35.9	0	0	0	112.5
301	G	92.5	Very high	95	Very high	14 Å²	14	40.2 Å²	40.2	14%	0.144	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	92.1	-16.9	-173.7	0	0	0	0	0	115	N282 C299	N282-G301 WeakPolarHBondContact O-CA 3.25Å; C299-G301 PolarHBondContact O-N 3.18Å
302	N	94.4	Very high	95	Very high	64 Å²	64	42 Å²	42	34%	0.342	21%	0.214	S	C	.	.			trans	-74.5	144.3	168.7	-175.3	34.6	0	0	0	111.2	D296 C299	D296-N302 HydrophobicContact CB-CB 3.77Å; D296-N302 PolarHBondContact N-O 3.2Å; D296-N302 PolarHBondContact OD2-ND2 3.26Å; C299-N302 HydrophobicContact CB-CB 3.94Å; C299-N302 WeakPolarHBondContact O-CB 3.17Å; C299-N302 PolarHBondContact O-N 2.85Å
303	D	96.2	Very high	94.8	Very high	2 Å²	2	45.4 Å²	45.4	1%	0.011	23%	0.23	C	C	.	.	B	Isolated β-bridge	trans	-112.6	105.5	174.5	179.5	-1.2	0	0	0	108.3	M283 S290 C293 I294 G305 R306	M283-D303 HydrophobicContact CE-CB 3.84Å; S290-D303 VanDerWaalsContact CB-OD2 3.27Å; S290-D303 WeakPolarHBondContact CB-OD2 3.35Å; S290-D303 PolarHBondContact N-OD2 3.16Å; S290-D303 PolarHBondContact OG-OD1 3.37Å; S290-D303 PolarHBondContact OG-OD2 3.04Å; C293-D303 WeakPolarHBondContact CA-OD1 3.4Å; C293-D303 PolarHBondContact SG-OD2 3.1Å; C293-D303 VanDerWaalsContact SG-OD2 3.33Å; I294-D303 PolarHBondContact N-OD1 3.38Å; I294-D303 CarbonylContact O-C 3.44Å; I294-D303 WeakPolarHBondContact O-CA 3.47Å; D303-G305 PolarHBondContact O-N 2.96Å; D303-G305 PolarHBondContact OD1-N 3.25Å; D303-R306 HydrophobicContact CB-CB 4.17Å; D303-R306 WeakPolarHBondContact O-CB 3.09Å; D303-R306 PolarHBondContact O-N 3.21Å
304	V	96.1	Very high	94.7	Very high	24 Å²	24	45.4 Å²	45.4	15%	0.145	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-29.2	-173	-171.9	0	0	0	0	111.5	Y218 A219 L222 I294 D296 R306	Y218-V304 HydrophobicContact CD1-CG1 3.56Å; Y218-V304 HydrophobicContact CD1-CG2 4.44Å; Y218-V304 HydrophobicContact CE1-CG1 4.11Å; Y218-V304 HydrophobicContact CE1-CG2 4.16Å; Y218-V304 HydrophobicContact CG-CG1 4.48Å; A219-V304 HydrophobicContact CB-CG1 4.04Å; L222-V304 HydrophobicContact CD1-CG2 4.13Å; I294-V304 HydrophobicContact CB-CB 4.24Å; I294-V304 HydrophobicContact CG2-CB 4.47Å; I294-V304 PolarHBondContact O-N 2.77Å; D296-V304 HydrophobicContact CB-CG2 3.57Å; V304-R306 VanDerWaalsContact C-N 3.34Å
305	G	96.2	Very high	94.7	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.01	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	4.1	177.3	0	0	0	0	0	114.5	S290 L292 D303 R307 S308	S290-G305 PolarHBondContact OG-O 3.31Å; L292-G305 VanDerWaalsContact O-CA 3.29Å; L292-G305 WeakPolarHBondContact O-CA 3.37Å; D303-G305 PolarHBondContact O-N 2.96Å; D303-G305 PolarHBondContact OD1-N 3.25Å; G305-R307 PolarHBondContact O-N 3.45Å; G305-S308 PolarHBondContact O-N 2.89Å
306	R	94.9	Very high	94.7	Very high	80 Å²	80	49.9 Å²	49.9	30%	0.302	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-31.5	-176.2	-175.7	175.9	-61.1	-69.8	-0.2	114.8	M283 R288 D303 V304	M283-R306 PolarHBondContact SD-NH2 3.01Å; R288-R306 PolarHBondContact O-NH1 3.32Å; D303-R306 HydrophobicContact CB-CB 4.17Å; D303-R306 WeakPolarHBondContact O-CB 3.09Å; D303-R306 PolarHBondContact O-N 3.21Å; V304-R306 VanDerWaalsContact C-N 3.34Å
307	R	94	Very high	94.7	Very high	132 Å²	132	49 Å²	49	50%	0.498	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-10.8	179.9	-63.5	-179.4	-167.6	-121	-12.6	114.1	T150 V210 G213 G305 Y309	T150-R307 PolarHBondContact OG1-NH1 3.09Å; T150-R307 PolarHBondContact OG1-NH2 3.34Å; V210-R307 HydrophobicContact CG1-CB 3.44Å; V210-R307 VanDerWaalsContact CG1-CB 3.44Å; V210-R307 HydrophobicContact CG1-CG 4.22Å; G213-R307 WeakPolarHBondContact CA-O 3.43Å; G305-R307 PolarHBondContact O-N 3.45Å; R307-Y309 WeakPolarHBondContact O-CD1 3.36Å; R307-Y309 PolarHBondContact O-N 2.82Å
308	S	95.5	Very high	94.8	Very high	3 Å²	3	47.3 Å²	47.3	2%	0.021	24%	0.235	C	C	.	.			trans	-79.8	57.7	179.6	-61.3	0	0	0	0	111.4	G213 G214 G305 C310 A311	G213-S308 CarbonylContact O-C 3.49Å; G213-S308 WeakPolarHBondContact O-CA 3.48Å; G214-S308 WeakPolarHBondContact O-CA 3.41Å; G214-S308 WeakPolarHBondContact O-CB 3.28Å; G214-S308 PolarHBondContact O-OG 3.18Å; G305-S308 PolarHBondContact O-N 2.89Å; S308-C310 PolarHBondContact O-N 3.48Å; S308-A311 VanDerWaalsContact O-CB 3.24Å; S308-A311 WeakPolarHBondContact O-CB 3.34Å; S308-A311 PolarHBondContact O-N 2.96Å
309	Y	94	Very high	94.9	Very high	154 Å²	154	48.2 Å²	48.2	60%	0.604	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66	-21.6	-175.4	57.3	-102.4	0	0	0	113.1	W211 T212 G213 R307 A311	W211-Y309 PolarHBondContact O-OH 2.94Å; T212-Y309 VanDerWaalsContact C-CZ 3.48Å; T212-Y309 PolarHBondContact O-OH 3.06Å; G213-Y309 VanDerWaalsContact CA-CZ 3.41Å; G213-Y309 PolarHBondContact N-OH 3.46Å; G213-Y309 PolarHBondContact O-N 3.09Å; R307-Y309 WeakPolarHBondContact O-CD1 3.36Å; R307-Y309 PolarHBondContact O-N 2.82Å; Y309-A311 PolarHBondContact O-N 3.26Å
310	C	93.3	Very high	95.1	Very high	20 Å²	20	47.1 Å²	47.1	14%	0.135	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	19.6	171	-60.8	0	0	0	0	113.2	T212 G213 S308 L312 Q313 I314	T212-C310 PolarHBondContact O-SG 3.1Å; G213-C310 VanDerWaalsContact O-CB 3.28Å; G213-C310 WeakPolarHBondContact O-CB 3.42Å; G213-C310 PolarHBondContact O-N 3.09Å; S308-C310 PolarHBondContact O-N 3.48Å; C310-L312 PolarHBondContact O-N 2.97Å; C310-Q313 HydrophobicContact CB-CB 4.4Å; C310-Q313 HydrophobicContact CB-CG 4.49Å; C310-Q313 WeakPolarHBondContact O-CA 3.29Å; C310-Q313 WeakPolarHBondContact O-CB 3.46Å; C310-Q313 PolarHBondContact O-N 3.29Å; C310-I314 PolarHBondContact O-N 2.7Å; C310-I314 VanDerWaalsContact O-N 3.07Å
311	A	95	Very high	95.4	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-54.2	-25.9	-179.7	0	0	0	0	0	114.9	L291 L292 S308 Y309 K315	L291-A311 HydrophobicContact CB-CB 4.47Å; L291-A311 HydrophobicContact CD2-CB 4.14Å; L291-A311 HydrophobicContact CG-CB 4.43Å; L292-A311 HydrophobicContact CB-CB 3.86Å; S308-A311 VanDerWaalsContact O-CB 3.24Å; S308-A311 WeakPolarHBondContact O-CB 3.34Å; S308-A311 PolarHBondContact O-N 2.96Å; Y309-A311 PolarHBondContact O-N 3.26Å; A311-K315 WeakPolarHBondContact O-CB 3.39Å; A311-K315 PolarHBondContact O-N 2.97Å
312	L	94.5	Very high	95.6	Very high	100 Å²	100	42.8 Å²	42.8	52%	0.524	19%	0.191	S	C	.	.	H	α-helix	trans	-70.1	-38	171.1	-68.1	-177.4	0	0	0	113.1	L291 C310 K315 Q316	L291-L312 HydrophobicContact CD2-CD1 4.39Å; L291-L312 HydrophobicContact CD2-CD2 3.74Å; L291-L312 HydrophobicContact CD2-CG 3.6Å; C310-L312 PolarHBondContact O-N 2.97Å; L312-K315 WeakPolarHBondContact O-CB 3.34Å; L312-K315 PolarHBondContact O-N 3.25Å; L312-Q316 VanDerWaalsContact O-CG 3.3Å; L312-Q316 WeakPolarHBondContact O-CG 3.26Å; L312-Q316 PolarHBondContact O-N 3.13Å; L312-Q316 PolarHBondContact O-OE1 3.37Å
313	Q	94.5	Very high	95.5	Very high	72 Å²	72	42.3 Å²	42.3	34%	0.336	19%	0.191	S	C	.	.	H	α-helix	trans	-68.2	-39.2	174.8	-61.4	174.8	-6	0	0	110.5	Y27 L207 C310 Q316 A317	Y27-Q313 HydrophobicContact CE1-CG 4.44Å; L207-Q313 HydrophobicContact CD2-CB 4.36Å; C310-Q313 HydrophobicContact CB-CB 4.4Å; C310-Q313 HydrophobicContact CB-CG 4.49Å; C310-Q313 WeakPolarHBondContact O-CA 3.29Å; C310-Q313 WeakPolarHBondContact O-CB 3.46Å; C310-Q313 PolarHBondContact O-N 3.29Å; Q313-Q316 PolarHBondContact O-N 2.71Å; Q313-A317 WeakPolarHBondContact O-CB 3.19Å; Q313-A317 PolarHBondContact O-N 3.29Å
314	I	95.6	Very high	95.3	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-61.1	-46.1	172.6	-65.9	155.2	0	0	0	110.7	L202 L207 L215 C310 Q316 A317 F318	L202-I314 HydrophobicContact CD2-CG2 4.38Å; L207-I314 HydrophobicContact CB-CG1 4.33Å; L207-I314 HydrophobicContact CD1-CG1 4.31Å; L207-I314 HydrophobicContact CD2-CG1 4.35Å; L215-I314 HydrophobicContact CB-CD1 3.9Å; C310-I314 PolarHBondContact O-N 2.7Å; C310-I314 VanDerWaalsContact O-N 3.07Å; I314-Q316 PolarHBondContact O-N 2.93Å; I314-A317 PolarHBondContact O-N 3.04Å; I314-F318 HydrophobicContact CG2-CD2 4.03Å; I314-F318 HydrophobicContact CG2-CE1 4.31Å; I314-F318 HydrophobicContact CG2-CE2 3.49Å; I314-F318 VanDerWaalsContact CG2-CE2 3.49Å; I314-F318 HydrophobicContact CG2-CZ 3.65Å; I314-F318 WeakPolarHBondContact O-CG 3.3Å; I314-F318 PolarHBondContact O-N 3.37Å
315	K	97.4	Very high	95.2	Very high	46 Å²	46	41.8 Å²	41.8	20%	0.2	19%	0.188	C	C	.	.	H	α-helix	trans	-57.5	-46.7	171.8	-178.8	-152	165	-60.8	0	111.5	G255 Y260 A311 L312 A317 F318 E319	G255-K315 WeakPolarHBondContact O-CE 3.43Å; G255-K315 VanDerWaalsContact O-CG 3.24Å; G255-K315 WeakPolarHBondContact O-CG 3.37Å; G255-K315 PolarHBondContact O-NZ 2.91Å; Y260-K315 HydrophobicContact CD2-CD 4.28Å; Y260-K315 HydrophobicContact CD2-CG 4.28Å; Y260-K315 HydrophobicContact CE2-CB 3.97Å; Y260-K315 HydrophobicContact CE2-CD 4.33Å; Y260-K315 HydrophobicContact CE2-CG 3.83Å; A311-K315 WeakPolarHBondContact O-CB 3.39Å; A311-K315 PolarHBondContact O-N 2.97Å; L312-K315 WeakPolarHBondContact O-CB 3.34Å; L312-K315 PolarHBondContact O-N 3.25Å; K315-A317 VanDerWaalsContact C-N 3.33Å; K315-A317 PolarHBondContact O-N 3.06Å; K315-F318 PolarHBondContact O-N 3.39Å; K315-E319 IonicContact NZ-OE2 3.21Å; K315-E319 PolarHBondContact NZ-OE2 2.93Å; K315-E319 PolarHBondContact O-N 2.84Å
316	Q	96.3	Very high	95	Very high	72 Å²	72	42.2 Å²	42.2	34%	0.336	19%	0.191	S	C	.	.	H	α-helix	trans	-61.6	-40.4	178.7	-75.5	167.4	-43.3	0	0	111.9	L312 Q313 I314 E319 Y320	L312-Q316 VanDerWaalsContact O-CG 3.3Å; L312-Q316 WeakPolarHBondContact O-CG 3.26Å; L312-Q316 PolarHBondContact O-N 3.13Å; L312-Q316 PolarHBondContact O-OE1 3.37Å; Q313-Q316 PolarHBondContact O-N 2.71Å; I314-Q316 PolarHBondContact O-N 2.93Å; Q316-E319 PolarHBondContact O-N 3.08Å; Q316-Y320 WeakPolarHBondContact O-CB 3.37Å; Q316-Y320 PolarHBondContact O-N 3.37Å
317	A	95.9	Very high	94.7	Very high	2 Å²	2	38.9 Å²	38.9	2%	0.017	18%	0.179	C	C	.	.	H	α-helix	trans	-63.9	-43	174.5	0	0	0	0	0	111.7	F201 L207 Q313 I314 K315 Y320 A321	F201-A317 HydrophobicContact CE1-CB 3.85Å; F201-A317 HydrophobicContact CZ-CB 4Å; F201-A317 VanDerWaalsContact CZ-O 3.32Å; F201-A317 WeakPolarHBondContact CZ-O 3.38Å; L207-A317 HydrophobicContact CD1-CB 3.97Å; Q313-A317 WeakPolarHBondContact O-CB 3.19Å; Q313-A317 PolarHBondContact O-N 3.29Å; I314-A317 PolarHBondContact O-N 3.04Å; K315-A317 VanDerWaalsContact C-N 3.33Å; K315-A317 PolarHBondContact O-N 3.06Å; A317-Y320 WeakPolarHBondContact O-CB 3.35Å; A317-Y320 PolarHBondContact O-N 2.94Å; A317-A321 WeakPolarHBondContact O-CB 3.34Å; A317-A321 PolarHBondContact O-N 3.45Å
318	F	97.8	Very high	94.5	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-65.4	-38.4	174.5	-65.1	-19.5	0	0	0	112.8	L198 F201 L202 L215 M223 F250 F251 I314 K315 A321 Y322	L198-F318 HydrophobicContact CD2-CE1 4.4Å; F201-F318 HydrophobicContact CD1-CD1 4.31Å; F201-F318 HydrophobicContact CD1-CE1 4.15Å; F201-F318 AromaticContact CE1-CD1 3.83Å; F201-F318 HydrophobicContact CE1-CD1 3.83Å; F201-F318 HydrophobicContact CE1-CE1 4.07Å; L202-F318 HydrophobicContact CD1-CZ 4.49Å; L202-F318 HydrophobicContact CD2-CE1 4.05Å; L202-F318 HydrophobicContact CD2-CZ 4.35Å; L202-F318 HydrophobicContact CG-CE1 4.46Å; L215-F318 HydrophobicContact CD2-CZ 4.47Å; M223-F318 HydrophobicContact CE-CE2 4.12Å; F250-F318 HydrophobicContact CE1-CE1 4.42Å; F250-F318 HydrophobicContact CE1-CE2 4.23Å; F250-F318 HydrophobicContact CE1-CZ 4.13Å; F251-F318 HydrophobicContact CD1-CB 3.97Å; F251-F318 AromaticContact CD1-CD1 3.7Å; F251-F318 HydrophobicContact CD1-CD1 3.7Å; F251-F318 HydrophobicContact CD1-CE1 4.5Å; F251-F318 HydrophobicContact CD1-CG 4.05Å; F251-F318 AromaticContact CE1-CD1 3.63Å; F251-F318 HydrophobicContact CE1-CD1 3.63Å; F251-F318 HydrophobicContact CE1-CE1 4.14Å; F251-F318 HydrophobicContact CE1-CG 4.43Å; I314-F318 HydrophobicContact CG2-CD2 4.03Å; I314-F318 HydrophobicContact CG2-CE1 4.31Å; I314-F318 HydrophobicContact CG2-CE2 3.49Å; I314-F318 VanDerWaalsContact CG2-CE2 3.49Å; I314-F318 HydrophobicContact CG2-CZ 3.65Å; I314-F318 WeakPolarHBondContact O-CG 3.3Å; I314-F318 PolarHBondContact O-N 3.37Å; K315-F318 PolarHBondContact O-N 3.39Å; F318-A321 PolarHBondContact O-N 2.92Å; F318-Y322 PolarHBondContact O-N 3.47Å
319	E	97.4	Very high	94.3	Very high	58 Å²	58	33.5 Å²	33.5	27%	0.271	16%	0.162	S	C	.	.	H	α-helix	trans	-65.6	-42	174.8	-176	150.8	-146.2	0	0	112	R256 K315 Q316 A321 Y322 V323	R256-E319 HydrophobicContact CG-CB 4.37Å; R256-E319 HydrophobicContact CG-CG 3.93Å; R256-E319 IonicContact CZ-OE1 2.75Å; R256-E319 IonicContact NE-OE1 2.73Å; R256-E319 PolarHBondContact NE-OE1 3.14Å; R256-E319 IonicContact NH2-OE1 2.66Å; K315-E319 IonicContact NZ-OE2 3.21Å; K315-E319 PolarHBondContact NZ-OE2 2.93Å; K315-E319 PolarHBondContact O-N 2.84Å; Q316-E319 PolarHBondContact O-N 3.08Å; E319-A321 VanDerWaalsContact C-N 3.34Å; E319-A321 PolarHBondContact O-N 3.3Å; E319-Y322 PolarHBondContact O-N 2.92Å; E319-V323 WeakPolarHBondContact O-CG2 3.38Å; E319-V323 PolarHBondContact O-N 3.2Å
320	Y	95	Very high	94	Very high	27 Å²	27	28.2 Å²	28.2	11%	0.106	14%	0.144	C	C	.	.	H	α-helix	trans	-54.4	-49	168.9	160.3	-80.8	0	0	0	111.2	F29 L31 Q316 A317 Y322 V323 V324 R347 I348 L529	F29-Y320 HydrophobicContact CB-CE2 4.2Å; F29-Y320 AromaticContact CD1-CD1 3.88Å; F29-Y320 HydrophobicContact CD1-CD1 3.88Å; F29-Y320 AromaticContact CD1-CD2 3.43Å; F29-Y320 HydrophobicContact CD1-CD2 3.43Å; F29-Y320 VanDerWaalsContact CD1-CD2 3.43Å; F29-Y320 HydrophobicContact CD1-CE1 4.06Å; F29-Y320 AromaticContact CD1-CE2 3.55Å; F29-Y320 HydrophobicContact CD1-CE2 3.55Å; F29-Y320 AromaticContact CD1-CG 3.62Å; F29-Y320 HydrophobicContact CD1-CG 3.62Å; F29-Y320 AromaticContact CD1-CZ 3.9Å; F29-Y320 AromaticContact CE1-CD1 3.87Å; F29-Y320 HydrophobicContact CE1-CD1 3.87Å; F29-Y320 AromaticContact CE1-CD2 3.64Å; F29-Y320 HydrophobicContact CE1-CD2 3.64Å; F29-Y320 HydrophobicContact CE1-CE1 4.5Å; F29-Y320 HydrophobicContact CE1-CE2 4.23Å; F29-Y320 AromaticContact CE1-CG 3.44Å; F29-Y320 HydrophobicContact CE1-CG 3.44Å; F29-Y320 VanDerWaalsContact CE1-CG 3.44Å; F29-Y320 HydrophobicContact CG-CD2 4.18Å; F29-Y320 HydrophobicContact CG-CE2 4.12Å; F29-Y320 HydrophobicContact CZ-CG 4.44Å; L31-Y320 HydrophobicContact CD1-CE2 4.03Å; L31-Y320 WeakPolarHBondContact CD1-OH 3.25Å; L31-Y320 WeakPolarHBondContact CG-OH 3.26Å; Q316-Y320 WeakPolarHBondContact O-CB 3.37Å; Q316-Y320 PolarHBondContact O-N 3.37Å; A317-Y320 WeakPolarHBondContact O-CB 3.35Å; A317-Y320 PolarHBondContact O-N 2.94Å; Y320-Y322 PolarHBondContact O-N 2.95Å; Y320-V323 PolarHBondContact O-N 2.97Å; Y320-V324 HydrophobicContact CD1-CG2 4.48Å; Y320-V324 HydrophobicContact CD2-CG2 4.25Å; Y320-V324 HydrophobicContact CE1-CG2 4.17Å; Y320-V324 HydrophobicContact CE2-CG2 3.99Å; Y320-V324 HydrophobicContact CG-CG2 4.48Å; Y320-V324 WeakPolarHBondContact O-CB 3.35Å; Y320-V324 WeakPolarHBondContact O-CG2 3.46Å; Y320-V324 PolarHBondContact O-N 3.32Å; Y320-R347 PolarHBondContact OH-O 3.39Å; Y320-I348 HydrophobicContact CE1-CG2 4.28Å; Y320-L529 HydrophobicContact CD2-CD1 4.32Å; Y320-L529 HydrophobicContact CE2-CD1 3.84Å
321	A	96.2	Very high	93.5	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-65.8	-39.7	-175.9	0	0	0	0	0	111.9	F201 F251 A317 F318 E319 L325 I348	F201-A321 HydrophobicContact CD2-CB 4.5Å; F201-A321 HydrophobicContact CE2-CB 3.6Å; F201-A321 HydrophobicContact CZ-CB 3.74Å; F251-A321 HydrophobicContact CB-CB 4.44Å; F251-A321 HydrophobicContact CD1-CB 3.65Å; F251-A321 HydrophobicContact CD2-CB 3.8Å; F251-A321 HydrophobicContact CE1-CB 3.62Å; F251-A321 HydrophobicContact CE2-CB 3.77Å; F251-A321 HydrophobicContact CG-CB 3.73Å; F251-A321 HydrophobicContact CZ-CB 3.68Å; A317-A321 WeakPolarHBondContact O-CB 3.34Å; A317-A321 PolarHBondContact O-N 3.45Å; F318-A321 PolarHBondContact O-N 2.92Å; E319-A321 VanDerWaalsContact C-N 3.34Å; E319-A321 PolarHBondContact O-N 3.3Å; A321-L325 WeakPolarHBondContact O-CB 3.32Å; A321-L325 WeakPolarHBondContact O-CG 3.28Å; A321-L325 PolarHBondContact O-N 2.88Å; A321-I348 HydrophobicContact CB-CG2 4.27Å
322	Y	96.9	Very high	92.8	Very high	41 Å²	41	37.7 Å²	37.7	16%	0.161	20%	0.196	C	C	.	.	H	α-helix	trans	-58.9	-48.8	171.4	168.5	-94.3	0	0	0	112	V248 E252 R256 F318 E319 Y320 S326	V248-Y322 HydrophobicContact CG1-CD2 4.05Å; V248-Y322 HydrophobicContact CG1-CE2 4.12Å; E252-Y322 HydrophobicContact CB-CD2 3.41Å; E252-Y322 VanDerWaalsContact CB-CD2 3.41Å; E252-Y322 HydrophobicContact CB-CE2 3.44Å; E252-Y322 VanDerWaalsContact CB-CE2 3.44Å; E252-Y322 HydrophobicContact CB-CG 4.28Å; E252-Y322 HydrophobicContact CG-CD2 3.72Å; E252-Y322 HydrophobicContact CG-CE1 4.48Å; E252-Y322 HydrophobicContact CG-CE2 3.31Å; E252-Y322 HydrophobicContact CG-CG 4.41Å; E252-Y322 PolarHBondContact OE1-OH 2.93Å; R256-Y322 HydrophobicContact CG-CD1 4.42Å; F318-Y322 PolarHBondContact O-N 3.47Å; E319-Y322 PolarHBondContact O-N 2.92Å; Y320-Y322 PolarHBondContact O-N 2.95Å; Y322-S326 WeakPolarHBondContact CE2-OG 3.34Å; Y322-S326 WeakPolarHBondContact O-CB 3.18Å; Y322-S326 PolarHBondContact O-N 3.45Å; Y322-S326 PolarHBondContact O-OG 3.06Å
323	V	93	Very high	92.1	Very high	54 Å²	54	35.8 Å²	35.8	33%	0.327	18%	0.182	S	C	.	.	H	α-helix	trans	-63.6	-46.5	-178	171.5	0	0	0	0	110.7	E319 Y320 S326 S327 L533	E319-V323 WeakPolarHBondContact O-CG2 3.38Å; E319-V323 PolarHBondContact O-N 3.2Å; Y320-V323 PolarHBondContact O-N 2.97Å; V323-S326 PolarHBondContact O-N 3.18Å; V323-S327 WeakPolarHBondContact O-CB 3.46Å; V323-S327 PolarHBondContact O-N 3.24Å; V323-L533 HydrophobicContact CG1-CD2 4.2Å
324	V	91.6	Very high	91.3	Very high	15 Å²	15	35.4 Å²	35.4	9%	0.091	18%	0.18	C	C	.	.	H	α-helix	trans	-64.7	-48.2	-179	170.2	0	0	0	0	111.7	L31 Y320 S327 A328 R347 I348	L31-V324 HydrophobicContact CD1-CG2 4.23Å; Y320-V324 HydrophobicContact CD1-CG2 4.48Å; Y320-V324 HydrophobicContact CD2-CG2 4.25Å; Y320-V324 HydrophobicContact CE1-CG2 4.17Å; Y320-V324 HydrophobicContact CE2-CG2 3.99Å; Y320-V324 HydrophobicContact CG-CG2 4.48Å; Y320-V324 WeakPolarHBondContact O-CB 3.35Å; Y320-V324 WeakPolarHBondContact O-CG2 3.46Å; Y320-V324 PolarHBondContact O-N 3.32Å; V324-S327 PolarHBondContact O-N 3.12Å; V324-A328 PolarHBondContact O-N 3.01Å; V324-A328 VanDerWaalsContact O-N 3.15Å; V324-R347 HydrophobicContact CG1-CB 3.45Å; V324-R347 VanDerWaalsContact CG1-CB 3.45Å; V324-R347 HydrophobicContact CG1-CG 4.33Å; V324-I348 HydrophobicContact CB-CG2 4.09Å; V324-I348 HydrophobicContact CG1-CG2 3.75Å
325	L	93.5	Very high	90.2	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-67.1	-41	176.3	-71	-178.7	0	0	0	111.9	L56 L247 V248 F251 A321 S327 A328 V329 I344 I348	L56-L325 HydrophobicContact CD1-CD2 4.29Å; L56-L325 HydrophobicContact CD2-CD1 4.29Å; L56-L325 HydrophobicContact CD2-CD2 4.28Å; L247-L325 HydrophobicContact CD2-CD1 3.82Å; L247-L325 HydrophobicContact CG-CD1 4Å; V248-L325 HydrophobicContact CG2-CB 3.93Å; V248-L325 HydrophobicContact CG2-CD1 4.2Å; F251-L325 HydrophobicContact CD2-CD1 3.85Å; F251-L325 HydrophobicContact CE2-CD1 3.83Å; A321-L325 WeakPolarHBondContact O-CB 3.32Å; A321-L325 WeakPolarHBondContact O-CG 3.28Å; A321-L325 PolarHBondContact O-N 2.88Å; L325-S327 VanDerWaalsContact C-N 3.31Å; L325-S327 PolarHBondContact O-N 2.88Å; L325-A328 CarbonylContact O-C 3.55Å; L325-A328 PolarHBondContact O-N 2.9Å; L325-V329 WeakPolarHBondContact O-CG2 3.4Å; L325-V329 PolarHBondContact O-N 3.17Å; L325-I344 HydrophobicContact CD2-CG2 4.09Å; L325-I344 WeakPolarHBondContact CD2-O 3.45Å; L325-I348 HydrophobicContact CD1-CD1 3.78Å; L325-I348 HydrophobicContact CD2-CD1 4.26Å; L325-I348 HydrophobicContact CD2-CG1 4.23Å; L325-I348 HydrophobicContact CD2-CG2 4.34Å; L325-I348 HydrophobicContact CG-CD1 4.12Å; L325-I348 HydrophobicContact CG-CG1 4.47Å; L325-I348 HydrophobicContact CG-CG2 4.15Å
326	S	92.3	Very high	89	Confident	11 Å²	11	42.6 Å²	42.6	8%	0.077	22%	0.215	C	C	.	.	H	α-helix	trans	-62.5	-37.9	177.8	-62.2	0	0	0	0	112.1	Y322 V323 A328 L330	Y322-S326 WeakPolarHBondContact CE2-OG 3.34Å; Y322-S326 WeakPolarHBondContact O-CB 3.18Å; Y322-S326 PolarHBondContact O-N 3.45Å; Y322-S326 PolarHBondContact O-OG 3.06Å; V323-S326 PolarHBondContact O-N 3.18Å; S326-A328 VanDerWaalsContact C-N 3.33Å; S326-L330 VanDerWaalsContact O-CB 3.26Å; S326-L330 WeakPolarHBondContact O-CB 3.4Å; S326-L330 WeakPolarHBondContact O-CD1 3.36Å; S326-L330 WeakPolarHBondContact O-CG 3.28Å; S326-L330 PolarHBondContact O-N 3.41Å; S326-L330 VanDerWaalsContact O-N 3.17Å
327	S	89.2	Confident	87.8	Confident	9 Å²	9	40.2 Å²	40.2	6%	0.063	20%	0.204	C	C	.	.	H	α-helix	trans	-59.3	-45.3	170.9	-170.5	0	0	0	0	110.9	V323 V324 L325 Y333 H337	V323-S327 WeakPolarHBondContact O-CB 3.46Å; V323-S327 PolarHBondContact O-N 3.24Å; V324-S327 PolarHBondContact O-N 3.12Å; L325-S327 VanDerWaalsContact C-N 3.31Å; L325-S327 PolarHBondContact O-N 2.88Å; S327-Y333 WeakPolarHBondContact O-CB 3.42Å; S327-H337 PolarHBondContact O-CD2 3.13Å; S327-H337 PolarHBondContact O-NE2 3.33Å; S327-H337 PolarHBondContact OG-NE2 3.29Å
328	A	88.9	Confident	86.1	Confident	11 Å²	11	43.3 Å²	43.3	9%	0.091	22%	0.224	C	C	.	.	H	α-helix	trans	-74.6	-28.6	-177.6	0	0	0	0	0	115.1	V324 L325 S326 I344	V324-A328 PolarHBondContact O-N 3.01Å; V324-A328 VanDerWaalsContact O-N 3.15Å; L325-A328 CarbonylContact O-C 3.55Å; L325-A328 PolarHBondContact O-N 2.9Å; S326-A328 VanDerWaalsContact C-N 3.33Å; A328-I344 HydrophobicContact CB-CG2 3.87Å
329	V	91.7	Very high	84.1	Confident	12 Å²	12	50.5 Å²	50.5	7%	0.073	26%	0.263	C	S	.	.	H	α-helix	trans	-103.9	-13.6	-174.2	-53.9	0	0	0	0	116.2	G52 V53 L56 V248 L325 I344	G52-V329 WeakPolarHBondContact CA-O 3.14Å; V53-V329 HydrophobicContact CG1-CB 3.99Å; V53-V329 HydrophobicContact CG1-CG1 4.46Å; V53-V329 HydrophobicContact CG1-CG2 3.83Å; L56-V329 HydrophobicContact CB-CG1 4.15Å; L56-V329 HydrophobicContact CD2-CG1 3.86Å; V248-V329 HydrophobicContact CG2-CG2 4.28Å; L325-V329 WeakPolarHBondContact O-CG2 3.4Å; L325-V329 PolarHBondContact O-N 3.17Å; V329-I344 HydrophobicContact CG1-CG2 3.77Å
330	L	87.5	Confident	82.6	Confident	43 Å²	43	50.5 Å²	50.5	23%	0.225	27%	0.267	C	S	.	.	S	Bend	trans	-84.2	128.2	-178.7	-72.9	171.6	0	0	0	111.2	S326 Q332 Y333	S326-L330 VanDerWaalsContact O-CB 3.26Å; S326-L330 WeakPolarHBondContact O-CB 3.4Å; S326-L330 WeakPolarHBondContact O-CD1 3.36Å; S326-L330 WeakPolarHBondContact O-CG 3.28Å; S326-L330 PolarHBondContact O-N 3.41Å; S326-L330 VanDerWaalsContact O-N 3.17Å; L330-Q332 PolarHBondContact O-N 2.77Å; L330-Q332 VanDerWaalsContact O-N 3.07Å; L330-Y333 HydrophobicContact CB-CD2 3.94Å; L330-Y333 HydrophobicContact CB-CE2 4.46Å; L330-Y333 HydrophobicContact CD1-CD2 4.31Å; L330-Y333 HydrophobicContact CD1-CE2 4.08Å; L330-Y333 PolarHBondContact O-N 3.4Å
331	P	82.8	Confident	81.4	Confident	109 Å²	109	55.4 Å²	55.4	71%	0.708	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-54.6	-33.3	-175.3	-29.5	35.9	0	0	0	115	Y333 H334	P331-Y333 PolarHBondContact O-N 3.31Å; P331-H334 WeakPolarHBondContact O-CB 3.31Å; P331-H334 PolarHBondContact O-N 3.07Å
332	Q	81.4	Confident	80.4	Confident	109 Å²	109	57.1 Å²	57.1	51%	0.509	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-66.7	-14.4	179	69.7	-97.1	28.2	0	0	114.6	L330 F335	L330-Q332 PolarHBondContact O-N 2.77Å; L330-Q332 VanDerWaalsContact O-N 3.07Å; Q332-F335 VanDerWaalsContact O-CE1 3.23Å; Q332-F335 WeakPolarHBondContact O-CE1 3.48Å
333	Y	79.6	Confident	80	Confident	61 Å²	61	55.5 Å²	55.5	24%	0.239	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-110.4	0.6	-180	-60.6	-45.5	0	0	0	113	S327 L330 P331 F335 L336 H337 L536	S327-Y333 WeakPolarHBondContact O-CB 3.42Å; L330-Y333 HydrophobicContact CB-CD2 3.94Å; L330-Y333 HydrophobicContact CB-CE2 4.46Å; L330-Y333 HydrophobicContact CD1-CD2 4.31Å; L330-Y333 HydrophobicContact CD1-CE2 4.08Å; L330-Y333 PolarHBondContact O-N 3.4Å; P331-Y333 PolarHBondContact O-N 3.31Å; Y333-F335 PolarHBondContact O-N 3.41Å; Y333-F335 VanDerWaalsContact O-N 3.11Å; Y333-L336 HydrophobicContact CD1-CD1 4.22Å; Y333-L336 WeakPolarHBondContact O-CB 3.38Å; Y333-L336 PolarHBondContact O-N 2.83Å; Y333-H337 PolarHBondContact O-CD2 3.21Å; Y333-L536 HydrophobicContact CD1-CD2 4.06Å; Y333-L536 HydrophobicContact CE1-CD2 3.76Å
334	H	76.9	Confident	79.9	Confident	64 Å²	64	53.9 Å²	53.9	30%	0.296	29%	0.289	S	S	.	.	H	α-helix	trans	-55.2	-35	-175.7	178.8	-149.9	0	0	0	113	F51 P331 L336 H337 C338	F51-H334 AromaticContact CD1-CD2 3.81Å; F51-H334 AromaticContact CD1-CE1 3.68Å; F51-H334 AromaticContact CD1-NE2 3.12Å; F51-H334 WeakPolarHBondContact CD1-NE2 3.21Å; F51-H334 AromaticContact CD2-CE1 3.56Å; F51-H334 AromaticContact CD2-NE2 3.9Å; F51-H334 AromaticContact CE1-CE1 3.76Å; F51-H334 AromaticContact CE1-NE2 3.15Å; F51-H334 WeakPolarHBondContact CE1-NE2 3.49Å; F51-H334 AromaticContact CE2-CE1 3.63Å; F51-H334 AromaticContact CE2-NE2 3.91Å; F51-H334 AromaticContact CG-CE1 3.58Å; F51-H334 AromaticContact CG-NE2 3.52Å; F51-H334 AromaticContact CZ-CE1 3.73Å; F51-H334 AromaticContact CZ-NE2 3.56Å; P331-H334 WeakPolarHBondContact O-CB 3.31Å; P331-H334 PolarHBondContact O-N 3.07Å; H334-L336 PolarHBondContact O-N 2.64Å; H334-L336 VanDerWaalsContact O-N 3.15Å; H334-H337 PolarHBondContact O-N 3.26Å; H334-C338 PolarHBondContact O-N 3.18Å
335	F	74	Confident	80	Confident	128 Å²	128	53.1 Å²	53.1	56%	0.561	29%	0.285	S	S	*	.	H	α-helix	trans	-63.9	-16.3	177.1	74.9	-93.2	0	0	0	114.8	Q332 Y333	Q332-F335 VanDerWaalsContact O-CE1 3.23Å; Q332-F335 WeakPolarHBondContact O-CE1 3.48Å; Y333-F335 PolarHBondContact O-N 3.41Å; Y333-F335 VanDerWaalsContact O-N 3.11Å
336	L	70.5	Confident	79.9	Confident	68 Å²	68	53.2 Å²	53.2	36%	0.356	29%	0.285	S	S	.	.	H	α-helix	trans	-81.5	-22.9	173	-59.2	173.5	0	0	0	112	Y333 H334 L536	Y333-L336 HydrophobicContact CD1-CD1 4.22Å; Y333-L336 WeakPolarHBondContact O-CB 3.38Å; Y333-L336 PolarHBondContact O-N 2.83Å; H334-L336 PolarHBondContact O-N 2.64Å; H334-L336 VanDerWaalsContact O-N 3.15Å; L336-L536 HydrophobicContact CD1-CD2 4.02Å
337	H	71.3	Confident	79.8	Confident	23 Å²	23	53.8 Å²	53.8	11%	0.106	29%	0.286	C	S	.	.	H	α-helix	trans	-115.2	-9.2	-167.3	-61.9	-63.4	0	0	0	114	S327 Y333 H334 N339 T340 R347 E532	S327-H337 PolarHBondContact O-CD2 3.13Å; S327-H337 PolarHBondContact O-NE2 3.33Å; S327-H337 PolarHBondContact OG-NE2 3.29Å; Y333-H337 PolarHBondContact O-CD2 3.21Å; H334-H337 PolarHBondContact O-N 3.26Å; H337-N339 PolarHBondContact O-N 3.16Å; H337-T340 PolarHBondContact O-N 2.74Å; H337-T340 PolarHBondContact O-OG1 2.87Å; H337-T340 VanDerWaalsContact O-OG1 3.05Å; H337-R347 PolarHBondContact ND1-NE 3.17Å; H337-R347 PolarHBondContact ND1-NH2 3.11Å; H337-E532 IonicContact CE1-OE1 3.93Å
338	C	60	Low	80	Confident	67 Å²	67	53.3 Å²	53.3	45%	0.453	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-18.1	-178.3	63.9	0	0	0	0	114.7	H334	H334-C338 PolarHBondContact O-N 3.18Å
339	N	57.3	Low	80.2	Confident	151 Å²	151	52.8 Å²	52.8	81%	0.807	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.2	19.8	-178.5	-63	-14.2	0	0	0	113	H337	H337-N339 PolarHBondContact O-N 3.16Å
340	T	66.1	Low	80.1	Confident	57 Å²	57	53.4 Å²	53.4	35%	0.35	28%	0.279	S	S	.	.			trans	-99.8	126.6	-179.4	64.6	0	0	0	0	111.9	H337 V342 R347	H337-T340 PolarHBondContact O-N 2.74Å; H337-T340 PolarHBondContact O-OG1 2.87Å; H337-T340 VanDerWaalsContact O-OG1 3.05Å; T340-V342 PolarHBondContact O-N 2.9Å; T340-V342 PolarHBondContact OG1-O 2.89Å; T340-R347 PolarHBondContact OG1-NH2 3.07Å
341	D	68.4	Low	80.3	Confident	130 Å²	130	51.6 Å²	51.6	70%	0.695	27%	0.27	S	S	*	.	S	Bend	trans	-61.8	-26.1	169.9	-56.5	-57.2	0	0	0	112.5	F35 S343	F35-D341 HydrophobicContact CD1-CB 3.83Å; F35-D341 HydrophobicContact CE1-CB 3.61Å; F35-D341 WeakPolarHBondContact CZ-O 3.2Å; D341-S343 PolarHBondContact O-N 3.5Å
342	V	76	Confident	80.7	Confident	36 Å²	36	49.4 Å²	49.4	22%	0.218	26%	0.257	C	S	.	.	S	Bend	trans	-62	128.4	176.3	-158.6	0	0	0	0	110.6	F35 T340 R347	F35-V342 HydrophobicContact CB-CG2 4.26Å; F35-V342 HydrophobicContact CD1-CG2 4.44Å; F35-V342 HydrophobicContact CD2-CB 4.12Å; F35-V342 HydrophobicContact CD2-CG1 3.9Å; F35-V342 HydrophobicContact CD2-CG2 3.76Å; F35-V342 HydrophobicContact CE2-CB 4.09Å; F35-V342 HydrophobicContact CE2-CG1 3.85Å; F35-V342 HydrophobicContact CE2-CG2 4.22Å; F35-V342 HydrophobicContact CG-CG2 3.88Å; T340-V342 PolarHBondContact O-N 2.9Å; T340-V342 PolarHBondContact OG1-O 2.89Å; V342-R347 HydrophobicContact CB-CG 4.46Å; V342-R347 HydrophobicContact CG1-CG 3.75Å; V342-R347 PolarHBondContact O-NH1 3.18Å
343	S	87.7	Confident	81.1	Confident	7 Å²	7	50 Å²	50	5%	0.049	26%	0.258	C	S	.	.			trans	-76.7	170.7	171.2	67.2	0	0	0	0	112.3	I40 E59 D341 G346 R347	I40-S343 WeakPolarHBondContact CD1-OG 3.29Å; E59-S343 WeakPolarHBondContact OE1-CB 3.39Å; E59-S343 PolarHBondContact OE1-OG 3.27Å; D341-S343 PolarHBondContact O-N 3.5Å; S343-G346 PolarHBondContact O-N 3.37Å; S343-G346 WeakPolarHBondContact OG-CA 3.35Å; S343-G346 PolarHBondContact OG-N 3.47Å; S343-R347 VanDerWaalsContact C-NH1 3.26Å; S343-R347 WeakPolarHBondContact O-CG 3.42Å; S343-R347 PolarHBondContact O-N 3.12Å; S343-R347 PolarHBondContact O-NH1 2.87Å
344	I	91.7	Very high	81.7	Confident	20 Å²	20	54.6 Å²	54.6	10%	0.103	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-49.6	-170.9	-53	178.2	0	0	0	110	L56 E59 L325 A328 V329 G346	L56-I344 HydrophobicContact CB-CD1 4.49Å; L56-I344 HydrophobicContact CB-CG2 4.14Å; L56-I344 HydrophobicContact CD1-CB 4.3Å; L56-I344 HydrophobicContact CD1-CG2 3.92Å; L56-I344 HydrophobicContact CD2-CG2 4.45Å; L56-I344 HydrophobicContact CG-CG2 4.37Å; E59-I344 WeakPolarHBondContact OE2-CA 3.4Å; E59-I344 WeakPolarHBondContact OE2-CB 3.26Å; E59-I344 PolarHBondContact OE2-N 2.97Å; L325-I344 HydrophobicContact CD2-CG2 4.09Å; L325-I344 WeakPolarHBondContact CD2-O 3.45Å; A328-I344 HydrophobicContact CB-CG2 3.87Å; V329-I344 HydrophobicContact CG1-CG2 3.77Å; I344-G346 VanDerWaalsContact C-N 3.33Å
345	L	94	Very high	82.4	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-70.2	-32.8	174.9	-164.3	68.2	0	0	0	111.4	W42 L56 E59 I60 F63 V197 L247 R347 I348 I349	W42-L345 HydrophobicContact CZ2-CB 4.26Å; W42-L345 HydrophobicContact CZ2-CD2 4.16Å; W42-L345 HydrophobicContact CZ2-CG 4.36Å; L56-L345 HydrophobicContact CD1-CB 4.21Å; L56-L345 HydrophobicContact CD1-CD1 4.11Å; E59-L345 HydrophobicContact CG-CB 3.83Å; E59-L345 HydrophobicContact CG-CD2 4.46Å; E59-L345 WeakPolarHBondContact OE1-CB 3.38Å; E59-L345 PolarHBondContact OE1-N 3.15Å; E59-L345 PolarHBondContact OE2-N 3.24Å; I60-L345 HydrophobicContact CG1-CD1 4.2Å; I60-L345 HydrophobicContact CG1-CD2 4.32Å; F63-L345 HydrophobicContact CB-CD2 3.6Å; F63-L345 HydrophobicContact CD1-CD2 4.09Å; F63-L345 HydrophobicContact CD2-CD2 4.15Å; F63-L345 HydrophobicContact CG-CD2 3.66Å; V197-L345 HydrophobicContact CG1-CD1 4.14Å; V197-L345 HydrophobicContact CG2-CD2 4.45Å; L247-L345 HydrophobicContact CD2-CD1 3.76Å; L345-R347 PolarHBondContact O-N 3.34Å; L345-R347 VanDerWaalsContact O-N 3.12Å; L345-I348 HydrophobicContact CD1-CD1 4.15Å; L345-I348 HydrophobicContact CD1-CG1 4.25Å; L345-I348 VanDerWaalsContact O-CG1 3.26Å; L345-I348 WeakPolarHBondContact O-CG1 3.35Å; L345-I348 PolarHBondContact O-N 3.22Å; L345-I349 HydrophobicContact CD1-CD1 4.19Å; L345-I349 HydrophobicContact CG-CB 4.5Å; L345-I349 HydrophobicContact CG-CD1 4.34Å; L345-I349 PolarHBondContact O-N 3.42Å
346	G	91.5	Very high	83.4	Confident	1 Å²	1	48.7 Å²	48.7	1%	0.01	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-55.5	-23.8	175.4	0	0	0	0	0	115.8	I40 S343 I344 I348 I349	I40-G346 VanDerWaalsContact CD1-CA 3.4Å; S343-G346 PolarHBondContact O-N 3.37Å; S343-G346 WeakPolarHBondContact OG-CA 3.35Å; S343-G346 PolarHBondContact OG-N 3.47Å; I344-G346 VanDerWaalsContact C-N 3.33Å; G346-I348 VanDerWaalsContact C-N 3.28Å; G346-I348 PolarHBondContact O-N 3.16Å; G346-I349 WeakPolarHBondContact CA-O 3.39Å
347	R	89.4	Confident	84.5	Confident	23 Å²	23	49.1 Å²	49.1	9%	0.087	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-69.1	-22.8	174	-67.7	162.2	166.7	64.3	2.5	113.4	Y320 V324 H337 T340 V342 S343 L345	Y320-R347 PolarHBondContact OH-O 3.39Å; V324-R347 HydrophobicContact CG1-CB 3.45Å; V324-R347 VanDerWaalsContact CG1-CB 3.45Å; V324-R347 HydrophobicContact CG1-CG 4.33Å; H337-R347 PolarHBondContact ND1-NE 3.17Å; H337-R347 PolarHBondContact ND1-NH2 3.11Å; T340-R347 PolarHBondContact OG1-NH2 3.07Å; V342-R347 HydrophobicContact CB-CG 4.46Å; V342-R347 HydrophobicContact CG1-CG 3.75Å; V342-R347 PolarHBondContact O-NH1 3.18Å; S343-R347 VanDerWaalsContact C-NH1 3.26Å; S343-R347 WeakPolarHBondContact O-CG 3.42Å; S343-R347 PolarHBondContact O-N 3.12Å; S343-R347 PolarHBondContact O-NH1 2.87Å; L345-R347 PolarHBondContact O-N 3.34Å; L345-R347 VanDerWaalsContact O-N 3.12Å
348	I	92.7	Very high	85.6	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.1	-23.5	-177.4	64.4	155.7	0	0	0	114.2	F201 Q204 R205 F251 Y320 A321 V324 L325 L345 G346	F201-I348 HydrophobicContact CD2-CB 4.12Å; F201-I348 HydrophobicContact CD2-CD1 4.12Å; F201-I348 HydrophobicContact CE2-CB 4.08Å; Q204-I348 PolarHBondContact NE2-O 3.03Å; R205-I348 PolarHBondContact NH1-O 3.03Å; R205-I348 PolarHBondContact NH2-O 3.09Å; F251-I348 HydrophobicContact CE2-CD1 3.58Å; F251-I348 HydrophobicContact CZ-CD1 3.87Å; Y320-I348 HydrophobicContact CE1-CG2 4.28Å; A321-I348 HydrophobicContact CB-CG2 4.27Å; V324-I348 HydrophobicContact CB-CG2 4.09Å; V324-I348 HydrophobicContact CG1-CG2 3.75Å; L325-I348 HydrophobicContact CD1-CD1 3.78Å; L325-I348 HydrophobicContact CD2-CD1 4.26Å; L325-I348 HydrophobicContact CD2-CG1 4.23Å; L325-I348 HydrophobicContact CD2-CG2 4.34Å; L325-I348 HydrophobicContact CG-CD1 4.12Å; L325-I348 HydrophobicContact CG-CG1 4.47Å; L325-I348 HydrophobicContact CG-CG2 4.15Å; L345-I348 HydrophobicContact CD1-CD1 4.15Å; L345-I348 HydrophobicContact CD1-CG1 4.25Å; L345-I348 VanDerWaalsContact O-CG1 3.26Å; L345-I348 WeakPolarHBondContact O-CG1 3.35Å; L345-I348 PolarHBondContact O-N 3.22Å; G346-I348 VanDerWaalsContact C-N 3.28Å; G346-I348 PolarHBondContact O-N 3.16Å
349	I	93	Very high	87.3	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.242	C	C	.	.			trans	-130.5	142.5	-175.6	-74.5	168.6	0	0	0	111.1	W42 F63 V197 Q200 F201 L345 G346	W42-I349 HydrophobicContact CH2-CG2 3.92Å; W42-I349 HydrophobicContact CZ3-CG2 4.43Å; F63-I349 HydrophobicContact CD2-CG2 4.46Å; F63-I349 HydrophobicContact CE2-CG2 3.79Å; F63-I349 HydrophobicContact CZ-CG2 4.22Å; V197-I349 HydrophobicContact CB-CD1 4.23Å; V197-I349 HydrophobicContact CG1-CD1 3.58Å; V197-I349 WeakPolarHBondContact O-CD1 3.47Å; Q200-I349 HydrophobicContact CB-CG2 4.35Å; Q200-I349 HydrophobicContact CG-CG2 3.66Å; F201-I349 HydrophobicContact CB-CD1 4.11Å; F201-I349 HydrophobicContact CB-CG1 4.01Å; F201-I349 HydrophobicContact CD2-CG1 4.36Å; L345-I349 HydrophobicContact CD1-CD1 4.19Å; L345-I349 HydrophobicContact CG-CB 4.5Å; L345-I349 HydrophobicContact CG-CD1 4.34Å; L345-I349 PolarHBondContact O-N 3.42Å; G346-I349 WeakPolarHBondContact CA-O 3.39Å
350	R	91	Very high	89.1	Confident	25 Å²	25	45 Å²	45	9%	0.094	23%	0.227	C	C	.	.			trans	-142.6	157.4	170.9	-66.7	-168.4	-164.8	-169.8	14.7	110.1	P30 Q33 S34 D39 Q200 Q204	P30-R350 PolarHBondContact O-NH2 3.12Å; P30-R350 VanDerWaalsContact O-NH2 3.15Å; Q33-R350 PolarHBondContact O-NH2 2.81Å; S34-R350 PolarHBondContact O-NH1 3.19Å; D39-R350 HydrophobicContact CB-CB 4.06Å; D39-R350 HydrophobicContact CB-CG 4.08Å; D39-R350 WeakPolarHBondContact OD2-CD 3.47Å; D39-R350 IonicContact OD2-CZ 3.02Å; D39-R350 IonicContact OD2-NE 3.31Å; D39-R350 IonicContact OD2-NH1 2.81Å; D39-R350 PolarHBondContact OD2-NH1 2.96Å; Q200-R350 PolarHBondContact NE2-O 3.05Å; Q204-R350 PolarHBondContact OE1-O 2.79Å
351	I	91.6	Very high	90.5	Very high	4 Å²	4	47.2 Å²	47.2	2%	0.021	23%	0.229	C	C	.	.			trans	-107.3	128.7	169.4	-57.5	-59.9	0	0	0	108.6	D39 P41 W42 F63 Y66 I67 Q200 V356	D39-I351 PolarHBondContact O-N 3.19Å; P41-I351 HydrophobicContact CG-CB 4.03Å; P41-I351 HydrophobicContact CG-CG1 4.07Å; P41-I351 HydrophobicContact CG-CG2 4.41Å; W42-I351 HydrophobicContact CE3-CG1 4.33Å; W42-I351 HydrophobicContact CZ3-CG1 4.01Å; F63-I351 HydrophobicContact CE2-CD1 4.28Å; Y66-I351 HydrophobicContact CE1-CG1 4.12Å; I67-I351 HydrophobicContact CD1-CD1 3.67Å; Q200-I351 HydrophobicContact CG-CD1 3.94Å; I351-V356 HydrophobicContact CG2-CG2 3.73Å
352	S	90.1	Very high	91.8	Very high	63 Å²	63	41.2 Å²	41.2	44%	0.441	20%	0.197	S	C	.	.			trans	-74.9	147.4	179.3	64.9	0	0	0	0	112.1	K354 S355 V356	S352-K354 VanDerWaalsContact C-N 3.27Å; S352-K354 PolarHBondContact O-N 2.91Å; S352-S355 WeakPolarHBondContact O-CA 3.47Å; S352-S355 VanDerWaalsContact O-CB 3.29Å; S352-S355 WeakPolarHBondContact O-CB 3.38Å; S352-S355 PolarHBondContact O-N 2.85Å; S352-S355 PolarHBondContact OG-OG 3.3Å; S352-V356 PolarHBondContact O-N 2.94Å; S352-V356 VanDerWaalsContact O-N 3.12Å
353	K	91	Very high	92.7	Very high	121 Å²	121	42.4 Å²	42.4	53%	0.526	20%	0.2	S	C	.	.	H	α-helix	trans	-49.2	-45.6	176.5	-172.2	172.2	-175.8	-80.2	0	112.8	S355 V356 E357	K353-S355 VanDerWaalsContact C-N 3.26Å; K353-S355 PolarHBondContact O-N 3.12Å; K353-V356 PolarHBondContact O-N 3.35Å; K353-E357 HydrophobicContact CG-CG 4.41Å; K353-E357 IonicContact NZ-OE1 3.76Å; K353-E357 PolarHBondContact NZ-OE1 2.84Å; K353-E357 WeakPolarHBondContact O-CG 3.45Å; K353-E357 PolarHBondContact O-N 3.25Å
354	K	91.7	Very high	93.1	Very high	158 Å²	158	45.1 Å²	45.1	69%	0.687	21%	0.214	S	C	*	.	H	α-helix	trans	-56.4	-35.9	174.4	-177.2	172.9	-178	172.6	0	113.3	S352 F358	S352-K354 VanDerWaalsContact C-N 3.27Å; S352-K354 PolarHBondContact O-N 2.91Å; K354-F358 VanDerWaalsContact O-CB 3.31Å; K354-F358 WeakPolarHBondContact O-CB 3.43Å; K354-F358 PolarHBondContact O-N 3.19Å
355	S	92.4	Very high	93.2	Very high	20 Å²	20	45.8 Å²	45.8	14%	0.14	22%	0.215	C	C	.	.	H	α-helix	trans	-70.7	-43.1	174.9	-55.9	0	0	0	0	111.4	S352 K353 F358 R359	S352-S355 WeakPolarHBondContact O-CA 3.47Å; S352-S355 VanDerWaalsContact O-CB 3.29Å; S352-S355 WeakPolarHBondContact O-CB 3.38Å; S352-S355 PolarHBondContact O-N 2.85Å; S352-S355 PolarHBondContact OG-OG 3.3Å; K353-S355 VanDerWaalsContact C-N 3.26Å; K353-S355 PolarHBondContact O-N 3.12Å; S355-F358 PolarHBondContact O-N 3.17Å; S355-R359 WeakPolarHBondContact O-CG 3.32Å; S355-R359 PolarHBondContact O-N 3.09Å; S355-R359 VanDerWaalsContact O-N 3.13Å
356	V	93.6	Very high	93.2	Very high	49 Å²	49	45.8 Å²	45.8	30%	0.297	22%	0.216	S	C	.	.	H	α-helix	trans	-61.2	-47.6	176.8	-174.8	0	0	0	0	110.9	P41 I351 S352 K353 F358 R359 Q360	P41-V356 HydrophobicContact CG-CG2 4.3Å; I351-V356 HydrophobicContact CG2-CG2 3.73Å; S352-V356 PolarHBondContact O-N 2.94Å; S352-V356 VanDerWaalsContact O-N 3.12Å; K353-V356 PolarHBondContact O-N 3.35Å; V356-F358 VanDerWaalsContact C-N 3.32Å; V356-F358 PolarHBondContact O-N 3.17Å; V356-R359 PolarHBondContact O-N 3.31Å; V356-Q360 PolarHBondContact O-N 2.91Å
357	E	94.6	Very high	93.2	Very high	76 Å²	76	50.8 Å²	50.8	36%	0.355	24%	0.238	S	C	.	.	H	α-helix	trans	-59.9	-39.8	176.6	-69.6	168.6	168.2	0	0	112.6	K353 Q360 R361	K353-E357 HydrophobicContact CG-CG 4.41Å; K353-E357 IonicContact NZ-OE1 3.76Å; K353-E357 PolarHBondContact NZ-OE1 2.84Å; K353-E357 WeakPolarHBondContact O-CG 3.45Å; K353-E357 PolarHBondContact O-N 3.25Å; E357-Q360 PolarHBondContact O-N 2.87Å; E357-R361 PolarHBondContact O-N 3.39Å
358	F	94.7	Very high	93.4	Very high	19 Å²	19	56.4 Å²	56.4	8%	0.083	27%	0.265	C	S	.	.	H	α-helix	trans	-61.9	-42.7	175.3	175.5	-90.3	0	0	0	111.8	P110 T111 T161 E162 L163 K354 S355 V356 Q360 R361 I362	P110-F358 VanDerWaalsContact O-CE1 3.31Å; P110-F358 WeakPolarHBondContact O-CE1 3.45Å; T111-F358 HydrophobicContact CG2-CD1 3.92Å; T111-F358 HydrophobicContact CG2-CE1 4.45Å; T111-F358 HydrophobicContact CG2-CG 4.27Å; T161-F358 WeakPolarHBondContact O-CE2 3.36Å; E162-F358 HydrophobicContact CB-CE2 4.17Å; L163-F358 HydrophobicContact CD2-CZ 3.82Å; L163-F358 HydrophobicContact CG-CZ 4.23Å; K354-F358 VanDerWaalsContact O-CB 3.31Å; K354-F358 WeakPolarHBondContact O-CB 3.43Å; K354-F358 PolarHBondContact O-N 3.19Å; S355-F358 PolarHBondContact O-N 3.17Å; V356-F358 VanDerWaalsContact C-N 3.32Å; V356-F358 PolarHBondContact O-N 3.17Å; F358-Q360 VanDerWaalsContact C-N 3.3Å; F358-Q360 PolarHBondContact O-N 3.43Å; F358-R361 PolarHBondContact O-N 2.96Å; F358-I362 HydrophobicContact CD1-CG1 4.22Å; F358-I362 HydrophobicContact CE1-CD1 4.41Å; F358-I362 HydrophobicContact CE1-CG1 3.7Å; F358-I362 HydrophobicContact CE2-CD1 4.3Å; F358-I362 HydrophobicContact CE2-CG1 4.18Å; F358-I362 HydrophobicContact CZ-CD1 3.9Å; F358-I362 HydrophobicContact CZ-CG1 3.68Å; F358-I362 WeakPolarHBondContact O-CG1 3.38Å; F358-I362 PolarHBondContact O-N 3.05Å
359	R	95.5	Very high	93.3	Very high	32 Å²	32	58.6 Å²	58.6	12%	0.121	28%	0.277	C	S	.	.	H	α-helix	trans	-60.7	-41.3	176	-57.3	-163.9	82.3	173.6	5.7	111.8	Y66 S68 E73 P110 S355 V356 I362 Q363	Y66-R359 PolarHBondContact O-NH1 3.02Å; Y66-R359 PolarHBondContact O-NH2 3.4Å; S68-R359 PolarHBondContact O-NH2 3.37Å; E73-R359 IonicContact OE1-CZ 3.93Å; E73-R359 IonicContact OE1-NE 4Å; E73-R359 PolarHBondContact OE1-NE 2.92Å; E73-R359 IonicContact OE1-NH2 2.66Å; E73-R359 PolarHBondContact OE1-NH2 2.8Å; E73-R359 IonicContact OE2-CZ 2.64Å; E73-R359 IonicContact OE2-NE 3.98Å; E73-R359 IonicContact OE2-NH2 2.66Å; E73-R359 PolarHBondContact OE2-NH2 3.4Å; P110-R359 HydrophobicContact CB-CG 3.79Å; P110-R359 HydrophobicContact CG-CG 4.21Å; P110-R359 VanDerWaalsContact CG-NE 3.3Å; S355-R359 WeakPolarHBondContact O-CG 3.32Å; S355-R359 PolarHBondContact O-N 3.09Å; S355-R359 VanDerWaalsContact O-N 3.13Å; V356-R359 PolarHBondContact O-N 3.31Å; R359-I362 PolarHBondContact O-N 3.1Å; R359-Q363 WeakPolarHBondContact O-CB 3.41Å; R359-Q363 PolarHBondContact O-N 2.94Å
360	Q	94.9	Very high	93	Very high	105 Å²	105	63.8 Å²	63.8	49%	0.491	30%	0.296	S	S	.	.	H	α-helix	trans	-63.1	-47.4	177	-170.4	59	50.4	0	0	111.2	V356 E357 F358 I362 Q363 D364	V356-Q360 PolarHBondContact O-N 2.91Å; E357-Q360 PolarHBondContact O-N 2.87Å; F358-Q360 VanDerWaalsContact C-N 3.3Å; F358-Q360 PolarHBondContact O-N 3.43Å; Q360-I362 VanDerWaalsContact C-N 3.3Å; Q360-I362 PolarHBondContact O-N 3.42Å; Q360-Q363 WeakPolarHBondContact O-CB 3.49Å; Q360-Q363 PolarHBondContact O-N 3.17Å; Q360-Q363 VanDerWaalsContact O-N 3.08Å; Q360-D364 PolarHBondContact NE2-OD1 3.4Å; Q360-D364 PolarHBondContact NE2-OD2 2.68Å; Q360-D364 PolarHBondContact O-N 3.05Å
361	R	95.4	Very high	92.9	Very high	103 Å²	103	66.5 Å²	66.5	39%	0.389	32%	0.324	S	S	.	.	H	α-helix	trans	-55.3	-43.2	175.3	-72.2	-163.1	-67.4	-80.2	13	112.8	E162 E357 F358 D364 Y365	E162-R361 IonicContact OE1-NH2 3.75Å; E162-R361 IonicContact OE2-CZ 3.36Å; E162-R361 VanDerWaalsContact OE2-CZ 3.26Å; E162-R361 IonicContact OE2-NE 2.66Å; E162-R361 PolarHBondContact OE2-NE 3.14Å; E162-R361 IonicContact OE2-NH2 2.71Å; E162-R361 PolarHBondContact OE2-NH2 2.93Å; E357-R361 PolarHBondContact O-N 3.39Å; F358-R361 PolarHBondContact O-N 2.96Å; R361-D364 PolarHBondContact O-N 3.49Å; R361-Y365 VanDerWaalsContact O-CB 3.28Å; R361-Y365 WeakPolarHBondContact O-CB 3.39Å; R361-Y365 PolarHBondContact O-N 2.85Å
362	I	95.8	Very high	92.5	Very high	4 Å²	4	70.5 Å²	70.5	2%	0.021	35%	0.352	C	S	.	.	H	α-helix	trans	-68.4	-37.5	177.6	-65.5	-65.9	0	0	0	112.1	E73 A76 T161 L163 F358 R359 Q360 A366	E73-I362 HydrophobicContact CB-CG2 4.18Å; E73-I362 HydrophobicContact CG-CB 4.48Å; E73-I362 HydrophobicContact CG-CG2 3.71Å; A76-I362 HydrophobicContact CB-CD1 4.44Å; A76-I362 HydrophobicContact CB-CG2 3.76Å; T161-I362 HydrophobicContact CG2-CD1 4.32Å; T161-I362 WeakPolarHBondContact O-CD1 3.42Å; L163-I362 HydrophobicContact CD1-CD1 4.17Å; L163-I362 HydrophobicContact CG-CD1 4.23Å; F358-I362 HydrophobicContact CD1-CG1 4.22Å; F358-I362 HydrophobicContact CE1-CD1 4.41Å; F358-I362 HydrophobicContact CE1-CG1 3.7Å; F358-I362 HydrophobicContact CE2-CD1 4.3Å; F358-I362 HydrophobicContact CE2-CG1 4.18Å; F358-I362 HydrophobicContact CZ-CD1 3.9Å; F358-I362 HydrophobicContact CZ-CG1 3.68Å; F358-I362 WeakPolarHBondContact O-CG1 3.38Å; F358-I362 PolarHBondContact O-N 3.05Å; R359-I362 PolarHBondContact O-N 3.1Å; Q360-I362 VanDerWaalsContact C-N 3.3Å; Q360-I362 PolarHBondContact O-N 3.42Å; I362-A366 WeakPolarHBondContact O-CB 3.42Å; I362-A366 PolarHBondContact O-N 2.8Å
363	Q	94.8	Very high	91.8	Very high	60 Å²	60	70.9 Å²	70.9	28%	0.28	35%	0.349	S	S	.	.	H	α-helix	trans	-61.8	-48.3	174.1	-173.2	67.2	39.4	0	0	110.9	R359 Q360 A366 H367	R359-Q363 WeakPolarHBondContact O-CB 3.41Å; R359-Q363 PolarHBondContact O-N 2.94Å; Q360-Q363 WeakPolarHBondContact O-CB 3.49Å; Q360-Q363 PolarHBondContact O-N 3.17Å; Q360-Q363 VanDerWaalsContact O-N 3.08Å; Q363-A366 PolarHBondContact O-N 2.89Å; Q363-H367 PolarHBondContact NE2-CD2 3.45Å; Q363-H367 PolarHBondContact NE2-NE2 2.85Å; Q363-H367 PolarHBondContact O-CD2 3.34Å; Q363-H367 PolarHBondContact O-N 2.88Å
364	D	95.4	Very high	90.6	Very high	65 Å²	65	70 Å²	70	35%	0.348	36%	0.356	S	S	.	.	H	α-helix	trans	-64.9	-45.8	179.9	-60.9	-29.5	0	0	0	111.4	Q360 R361 A366 H367 H368	Q360-D364 PolarHBondContact NE2-OD1 3.4Å; Q360-D364 PolarHBondContact NE2-OD2 2.68Å; Q360-D364 PolarHBondContact O-N 3.05Å; R361-D364 PolarHBondContact O-N 3.49Å; D364-A366 VanDerWaalsContact C-N 3.35Å; D364-A366 PolarHBondContact O-N 3.09Å; D364-H367 WeakPolarHBondContact O-CB 3.38Å; D364-H367 PolarHBondContact O-N 2.94Å; D364-H367 VanDerWaalsContact O-N 3.1Å; D364-H368 PolarHBondContact O-CD2 3.41Å; D364-H368 PolarHBondContact O-N 3.12Å
365	Y	95.1	Very high	88.8	Confident	33 Å²	33	69 Å²	69	13%	0.129	36%	0.363	C	S	.	.	H	α-helix	trans	-54.3	-47.7	173.9	175.9	-100.9	0	0	0	112.3	A76 E160 T161 R361 H367 H368 L369	A76-Y365 HydrophobicContact CB-CD1 4.02Å; A76-Y365 HydrophobicContact CB-CE1 4.22Å; E160-Y365 HydrophobicContact CB-CD2 4.49Å; E160-Y365 HydrophobicContact CB-CE2 3.7Å; E160-Y365 HydrophobicContact CG-CE2 4.4Å; E160-Y365 WeakPolarHBondContact OE2-CE2 3.48Å; E160-Y365 PolarHBondContact OE2-OH 3.08Å; T161-Y365 HydrophobicContact CG2-CD1 3.65Å; T161-Y365 HydrophobicContact CG2-CD2 4.32Å; T161-Y365 HydrophobicContact CG2-CE1 3.28Å; T161-Y365 HydrophobicContact CG2-CE2 4.03Å; T161-Y365 HydrophobicContact CG2-CG 4.14Å; T161-Y365 VanDerWaalsContact CG2-CZ 3.48Å; R361-Y365 VanDerWaalsContact O-CB 3.28Å; R361-Y365 WeakPolarHBondContact O-CB 3.39Å; R361-Y365 PolarHBondContact O-N 2.85Å; Y365-H367 VanDerWaalsContact C-N 3.32Å; Y365-H367 PolarHBondContact O-N 3.46Å; Y365-H368 PolarHBondContact O-N 3.48Å; Y365-L369 HydrophobicContact CD1-CD1 4.12Å; Y365-L369 HydrophobicContact CE1-CD1 3.44Å; Y365-L369 VanDerWaalsContact CE1-CD1 3.44Å; Y365-L369 HydrophobicContact CE1-CG 4.25Å; Y365-L369 HydrophobicContact CE2-CD1 4.22Å; Y365-L369 HydrophobicContact CE2-CG 4.34Å; Y365-L369 PolarHBondContact O-N 3.04Å
366	A	93.5	Very high	86.6	Confident	1 Å²	1	74.9 Å²	74.9	1%	0.008	39%	0.393	C	S	.	.	H	α-helix	trans	-65.4	-33.1	177.7	0	0	0	0	0	112.7	A72 F75 I362 Q363 D364 R370	A72-A366 HydrophobicContact CB-CB 3.54Å; F75-A366 HydrophobicContact CD1-CB 3.97Å; I362-A366 WeakPolarHBondContact O-CB 3.42Å; I362-A366 PolarHBondContact O-N 2.8Å; Q363-A366 PolarHBondContact O-N 2.89Å; D364-A366 VanDerWaalsContact C-N 3.35Å; D364-A366 PolarHBondContact O-N 3.09Å; A366-R370 WeakPolarHBondContact O-CB 3.4Å; A366-R370 WeakPolarHBondContact O-CD 3.01Å; A366-R370 WeakPolarHBondContact O-CG 3.21Å; A366-R370 PolarHBondContact O-N 3.34Å; A366-R370 VanDerWaalsContact O-N 3.1Å
367	H	91.5	Very high	84.3	Confident	106 Å²	106	78.7 Å²	78.7	49%	0.491	42%	0.416	S	S	.	.	H	α-helix	trans	-68.1	-46.1	172.3	-82	-69.4	0	0	0	112	Q363 D364 Y365 R370 A371	Q363-H367 PolarHBondContact NE2-CD2 3.45Å; Q363-H367 PolarHBondContact NE2-NE2 2.85Å; Q363-H367 PolarHBondContact O-CD2 3.34Å; Q363-H367 PolarHBondContact O-N 2.88Å; D364-H367 WeakPolarHBondContact O-CB 3.38Å; D364-H367 PolarHBondContact O-N 2.94Å; D364-H367 VanDerWaalsContact O-N 3.1Å; Y365-H367 VanDerWaalsContact C-N 3.32Å; Y365-H367 PolarHBondContact O-N 3.46Å; H367-R370 PolarHBondContact O-N 2.88Å; H367-A371 WeakPolarHBondContact O-CB 3.13Å; H367-A371 PolarHBondContact O-N 3.15Å
368	H	92.2	Very high	81.6	Confident	140 Å²	140	83.7 Å²	83.7	65%	0.648	44%	0.437	S	S	*	.	H	α-helix	trans	-61.3	-45.2	178.2	-72.4	-59.7	0	0	0	112.3	D364 Y365 A371 S372	D364-H368 PolarHBondContact O-CD2 3.41Å; D364-H368 PolarHBondContact O-N 3.12Å; Y365-H368 PolarHBondContact O-N 3.48Å; H368-A371 PolarHBondContact O-N 3.23Å; H368-S372 PolarHBondContact O-N 3.02Å; H368-S372 VanDerWaalsContact O-N 3.13Å
369	L	90.7	Very high	78.7	Confident	47 Å²	47	91.4 Å²	91.4	25%	0.246	48%	0.475	C	S	.	.	H	α-helix	trans	-61.6	-43.4	173.9	-75.7	-173.3	0	0	0	112.4	F75 V79 Y365 A371 S372 L373	F75-L369 HydrophobicContact CE1-CB 3.94Å; F75-L369 HydrophobicContact CE1-CD1 4.12Å; F75-L369 HydrophobicContact CZ-CB 4.44Å; V79-L369 HydrophobicContact CG1-CD1 4.09Å; V79-L369 HydrophobicContact CG2-CD1 4.05Å; Y365-L369 HydrophobicContact CD1-CD1 4.12Å; Y365-L369 HydrophobicContact CE1-CD1 3.44Å; Y365-L369 VanDerWaalsContact CE1-CD1 3.44Å; Y365-L369 HydrophobicContact CE1-CG 4.25Å; Y365-L369 HydrophobicContact CE2-CD1 4.22Å; Y365-L369 HydrophobicContact CE2-CG 4.34Å; Y365-L369 PolarHBondContact O-N 3.04Å; L369-A371 VanDerWaalsContact C-N 3.26Å; L369-A371 PolarHBondContact O-N 3.38Å; L369-S372 PolarHBondContact O-N 2.94Å; L369-S372 PolarHBondContact O-OG 3.2Å; L369-L373 PolarHBondContact O-N 3.23Å
370	R	88.4	Confident	75.8	Confident	108 Å²	108	97.2 Å²	97.2	41%	0.408	51%	0.508	S	S	.	.	H	α-helix	trans	-66.8	-28.2	178.3	-75.1	172	179.9	163.6	1.7	113.1	P71 F75 A366 H367	P71-R370 PolarHBondContact O-NH2 3.23Å; F75-R370 HydrophobicContact CE1-CG 4.03Å; F75-R370 HydrophobicContact CZ-CG 4.25Å; A366-R370 WeakPolarHBondContact O-CB 3.4Å; A366-R370 WeakPolarHBondContact O-CD 3.01Å; A366-R370 WeakPolarHBondContact O-CG 3.21Å; A366-R370 PolarHBondContact O-N 3.34Å; A366-R370 VanDerWaalsContact O-N 3.1Å; H367-R370 PolarHBondContact O-N 2.88Å
371	A	87.5	Confident	72.7	Confident	82 Å²	82	101.7 Å²	101.7	68%	0.678	53%	0.529	S	S	*	.	H	α-helix	trans	-77	-26	175.3	0	0	0	0	0	113.5	H367 H368 L369	H367-A371 WeakPolarHBondContact O-CB 3.13Å; H367-A371 PolarHBondContact O-N 3.15Å; H368-A371 PolarHBondContact O-N 3.23Å; L369-A371 VanDerWaalsContact C-N 3.26Å; L369-A371 PolarHBondContact O-N 3.38Å
372	S	83.2	Confident	69.7	Low	88 Å²	88	99.7 Å²	99.7	62%	0.615	54%	0.54	S	S	*	.	H	α-helix	trans	-84	-10.8	176.8	67.4	0	0	0	0	114.1	H368 L369	H368-S372 PolarHBondContact O-N 3.02Å; H368-S372 VanDerWaalsContact O-N 3.13Å; L369-S372 PolarHBondContact O-N 2.94Å; L369-S372 PolarHBondContact O-OG 3.2Å
373	L	75.4	Confident	66.4	Low	71 Å²	71	105.7 Å²	105.7	37%	0.372	58%	0.582	S	S	.	*	S	Bend	trans	-69.9	133.4	175.3	-72.9	176.7	0	0	0	111.8	L369 V375 W398	L369-L373 PolarHBondContact O-N 3.23Å; L373-V375 PolarHBondContact O-N 2.97Å; L373-W398 HydrophobicContact CD2-CH2 3.68Å; L373-W398 HydrophobicContact CD2-CZ3 4.27Å
374	P	65.6	Low	63.4	Low	104 Å²	104	109.7 Å²	109.7	68%	0.675	61%	0.611	S	S	*	*			trans	-56.3	127.9	177	-26.9	35.2	0	0	0	112.9	N376	P374-N376 PolarHBondContact O-N 2.93Å
375	V	54.5	Low	60.3	Low	137 Å²	137	111.8 Å²	111.8	83%	0.83	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	71.5	-176.4	-170.8	0	0	0	0	111.1	L373	L373-V375 PolarHBondContact O-N 2.97Å
376	N	46.9	Very low	57.2	Low	143 Å²	143	115.9 Å²	115.9	77%	0.765	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.2	-7.7	175	-136	-7.4	0	0	0	113.8	P374 K378	P374-N376 PolarHBondContact O-N 2.93Å; N376-K378 VanDerWaalsContact C-N 3.25Å; N376-K378 PolarHBondContact O-N 3.19Å
377	T	45.4	Very low	54.1	Low	128 Å²	128	127.3 Å²	127.3	79%	0.785	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	51.2	179.5	-37.2	0	0	0	0	112.9
378	K	37.1	Very low	51.1	Low	181 Å²	181	127.8 Å²	127.8	79%	0.787	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	-10	169.1	-86.8	-172.2	173.3	-178.9	0	114	N376 L380	N376-K378 VanDerWaalsContact C-N 3.25Å; N376-K378 PolarHBondContact O-N 3.19Å; K378-L380 VanDerWaalsContact C-N 3.34Å; K378-L380 PolarHBondContact O-N 3.09Å
379	M	33.5	Very low	48.2	Very low	182 Å²	182	129.5 Å²	129.5	90%	0.897	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	60.9	175.7	-67.6	-146	72.3	0	0	113.1
380	L	36.1	Very low	45.3	Very low	153 Å²	153	135.1 Å²	135.1	80%	0.801	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-156.5	30.3	165.2	-115.9	164.1	0	0	0	113.8	K378	K378-L380 VanDerWaalsContact C-N 3.34Å; K378-L380 PolarHBondContact O-N 3.09Å
381	Q	29.5	Very low	42.6	Very low	200 Å²	200	138.6 Å²	138.6	94%	0.935	78%	0.779	S	S	*	*			trans	-104	61.9	165.1	-71.1	-173.4	-19.7	0	0	110
382	G	31.1	Very low	39.7	Very low	61 Å²	61	142 Å²	142	63%	0.629	78%	0.784	S	S	*	*			trans	-105	145.1	171.9	0	0	0	0	0	110.9	V384	G382-V384 PolarHBondContact O-N 2.9Å
383	S	27.9	Very low	37.3	Very low	129 Å²	129	145.3 Å²	145.3	90%	0.902	79%	0.794	S	S	*	*			trans	-64.7	121.6	-176.7	42.6	0	0	0	0	112.9
384	V	31.3	Very low	35.1	Very low	145 Å²	145	147 Å²	147	88%	0.879	81%	0.809	S	S	*	*			trans	-109.4	98.3	165.3	-177.7	0	0	0	0	108.5	G382	G382-V384 PolarHBondContact O-N 2.9Å
385	S	30.7	Very low	33.4	Very low	108 Å²	108	147.4 Å²	147.4	76%	0.755	82%	0.815	S	S	*	*			trans	-73.8	163	167.5	53.4	0	0	0	0	110.8	R387	S385-R387 PolarHBondContact O-N 3.43Å; S385-R387 VanDerWaalsContact O-N 3.12Å
386	S	28.3	Very low	32.3	Very low	120 Å²	120	145.4 Å²	145.4	84%	0.839	81%	0.807	S	S	*	*	S	Bend	trans	-67.4	105.7	-171.2	44.2	0	0	0	0	114.2
387	R	29.8	Very low	31.4	Very low	241 Å²	241	144.2 Å²	144.2	91%	0.909	81%	0.807	S	S	*	*			trans	-160.3	155.9	142.4	-116.5	166.4	-179.3	178.4	-1	114.1	S385	S385-R387 PolarHBondContact O-N 3.43Å; S385-R387 VanDerWaalsContact O-N 3.12Å
388	S	28.5	Very low	30.9	Very low	116 Å²	116	147.2 Å²	147.2	81%	0.811	80%	0.804	S	S	*	*			trans	-60.4	135.1	-172.3	-37.4	0	0	0	0	114
389	Q	31.8	Very low	30.5	Very low	175 Å²	175	145.4 Å²	145.4	82%	0.818	81%	0.808	S	S	*	*			trans	-158.6	147.2	154.8	-113.9	157.7	29.3	0	0	112.5
390	N	28.3	Very low	30.3	Very low	166 Å²	166	142.1 Å²	142.1	89%	0.888	80%	0.803	S	S	*	*			trans	-75	125.6	174.2	-59.5	-48.8	0	0	0	109.1
391	F	31.6	Very low	29.9	Very low	181 Å²	181	146.1 Å²	146.1	79%	0.794	81%	0.807	S	S	*	*			trans	-101.9	107.8	173.8	-102.1	-88.4	0	0	0	112.2
392	I	28.2	Very low	29.9	Very low	152 Å²	152	141.7 Å²	141.7	78%	0.779	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-71	120.1	157.4	-63.1	168	0	0	0	106.2	P394	I392-P394 WeakPolarHBondContact O-CD 3.44Å
393	L	31.9	Very low	29.8	Very low	158 Å²	158	146 Å²	146	83%	0.827	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-70.8	126.5	172.2	-93.8	160.7	0	0	0	109.5
394	P	28.6	Very low	29.9	Very low	106 Å²	106	147 Å²	147	69%	0.688	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-63.5	155.3	170.7	-20.2	33.1	0	0	0	111.7	I392 S396	I392-P394 WeakPolarHBondContact O-CD 3.44Å; P394-S396 PolarHBondContact O-N 3.07Å
395	S	29.8	Very low	29.9	Very low	113 Å²	113	148.2 Å²	148.2	79%	0.79	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-59.6	126.8	174.7	50.7	0	0	0	0	112.2	P397	S395-P397 WeakPolarHBondContact O-CD 3.29Å
396	S	32.3	Very low	29.7	Very low	95 Å²	95	149.4 Å²	149.4	66%	0.664	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-51	119.3	176.3	-90.3	0	0	0	0	113.9	P394 W398	P394-S396 PolarHBondContact O-N 3.07Å; S396-W398 PolarHBondContact O-N 3.07Å
397	P	27.2	Very low	29.9	Very low	119 Å²	119	149.8 Å²	149.8	77%	0.773	80%	0.803	S	S	*	*			trans	-84.3	60.4	172.6	35.7	-35.1	0	0	0	111.3	S395	S395-P397 WeakPolarHBondContact O-CD 3.29Å
398	W	34.7	Very low	30	Very low	191 Å²	191	143.6 Å²	143.6	72%	0.723	80%	0.797	S	S	*	*			trans	-113.8	54.3	-178.3	-71.7	104.5	0	0	0	112.6	L373 S396	L373-W398 HydrophobicContact CD2-CH2 3.68Å; L373-W398 HydrophobicContact CD2-CZ3 4.27Å; S396-W398 PolarHBondContact O-N 3.07Å
399	V	29.6	Very low	29.8	Very low	142 Å²	142	149.2 Å²	149.2	86%	0.861	80%	0.8	S	S	*	*			trans	-127.6	71.7	170.8	-170.7	0	0	0	0	110
400	S	29.9	Very low	29.9	Very low	113 Å²	113	149 Å²	149	79%	0.79	80%	0.803	S	S	*	*			trans	-126	119.4	171.5	-74.8	0	0	0	0	109	S402	S400-S402 PolarHBondContact O-N 2.81Å
401	R	26.9	Very low	29.8	Very low	238 Å²	238	147.9 Å²	147.9	90%	0.898	80%	0.797	S	S	*	*			trans	-66.4	112.2	-169.4	-62.6	174	-179.8	165.2	-2.4	112.6	N403	R401-N403 PolarHBondContact O-N 3.18Å
402	S	30.2	Very low	29.7	Very low	107 Å²	107	144.6 Å²	144.6	75%	0.748	80%	0.795	S	S	*	*			trans	-92.5	80.1	163.8	42.1	0	0	0	0	110.9	S400 L404	S400-S402 PolarHBondContact O-N 2.81Å; S402-L404 PolarHBondContact O-N 3.25Å
403	N	27.6	Very low	30	Very low	150 Å²	150	143.7 Å²	143.7	80%	0.802	80%	0.797	S	S	*	*			trans	-67.5	103.7	170.1	-82.9	-2.6	0	0	0	110.1	R401	R401-N403 PolarHBondContact O-N 3.18Å
404	L	30	Very low	29.9	Very low	151 Å²	151	145 Å²	145	79%	0.791	80%	0.798	S	S	*	*			trans	-122.7	58.3	171.5	-80.5	171.8	0	0	0	111.5	S402	S402-L404 PolarHBondContact O-N 3.25Å
405	N	31.2	Very low	30.2	Very low	170 Å²	170	144.8 Å²	144.8	91%	0.909	80%	0.797	S	S	*	*			trans	-112.9	96	163.9	-89.7	-13.2	0	0	0	109.2
406	T	27.8	Very low	30.2	Very low	133 Å²	133	144.3 Å²	144.3	82%	0.816	79%	0.794	S	S	*	*			trans	-121.5	100.3	172.4	-59.4	0	0	0	0	109.2
407	V	31.6	Very low	30.3	Very low	128 Å²	128	145 Å²	145	78%	0.776	80%	0.799	S	S	*	*	S	Bend	trans	-176.8	142.5	147.2	138	0	0	0	0	109.4
408	S	32.2	Very low	30.6	Very low	112 Å²	112	145.8 Å²	145.8	78%	0.783	80%	0.801	S	S	*	*			trans	52.1	116.3	172.1	54.9	0	0	0	0	119.2
409	R	25.5	Very low	30.2	Very low	234 Å²	234	143.9 Å²	143.9	88%	0.883	80%	0.801	S	S	*	*			trans	-75.5	155.5	161.5	-62.7	171.1	172.2	149.3	-6.5	111.1
410	I	32.8	Very low	30.3	Very low	171 Å²	171	146.5 Å²	146.5	88%	0.877	80%	0.804	S	S	*	*				-158.6	138.9	128	-97.4	157.3	0	0	0	107
411	D	26.2	Very low	30.1	Very low	141 Å²	141	149.4 Å²	149.4	75%	0.754	80%	0.802	S	S	*	*			trans	-86.4	153.4	-177.4	-80.2	-73.9	0	0	0	113
412	C	30.1	Very low	30.2	Very low	112 Å²	112	144.7 Å²	144.7	76%	0.757	80%	0.8	S	S	*	*				-179.1	126.3	115.9	-98.1	0	0	0	0	114.9
413	T	33.5	Very low	29.9	Very low	134 Å²	134	146 Å²	146	82%	0.822	80%	0.804	S	S	*	*			trans	52.2	109.5	143.4	59.3	0	0	0	0	121.9
414	Q	29.9	Very low	30	Very low	184 Å²	184	148.4 Å²	148.4	86%	0.86	81%	0.807	S	S	*	*			trans	-78.7	-174.6	148.1	-102.4	-165	15.5	0	0	110.8
415	P	34.7	Very low	29.7	Very low	103 Å²	103	146.2 Å²	146.2	67%	0.669	81%	0.805	S	S	*	*			cis	-151.2	177.4	22.9	45.4	-24.7	0	0	0	121.1
416	S	30	Very low	29.7	Very low	103 Å²	103	144.2 Å²	144.2	72%	0.72	80%	0.798	S	S	*	*			trans	83.3	160.6	136.4	74.1	0	0	0	0	124.5
417	S	34.2	Very low	29.6	Very low	109 Å²	109	146.7 Å²	146.7	76%	0.762	80%	0.8	S	S	*	*			trans	78.8	134.3	170.1	74.1	0	0	0	0	117.9
418	T	33.2	Very low	29.5	Very low	135 Å²	135	145.7 Å²	145.7	83%	0.828	80%	0.799	S	S	*	*			cis	-153	158.7	-15.4	-69	0	0	0	0	109.7
419	E	26.6	Very low	29.5	Very low	152 Å²	152	147.9 Å²	147.9	71%	0.71	80%	0.802	S	S	*	*			trans	-65.6	157.8	173.8	-60.6	-178.9	102.1	0	0	114.6
420	Q	31.6	Very low	29.4	Very low	197 Å²	197	144 Å²	144	92%	0.921	80%	0.797	S	S	*	*			trans	-148.5	133.7	138.4	-116.2	177.8	24.1	0	0	111.8
421	K	26	Very low	29.1	Very low	174 Å²	174	141.3 Å²	141.3	76%	0.757	79%	0.792	S	S	*	*			trans	-96.1	139	174.7	-71.2	169.2	-179.1	158	0	110.2
422	T	29.1	Very low	29.2	Very low	139 Å²	139	140.7 Å²	140.7	85%	0.853	79%	0.793	S	S	*	*			trans	-133.7	133	156.4	44.3	0	0	0	0	110
423	T	24.6	Very low	29.1	Very low	135 Å²	135	141.4 Å²	141.4	83%	0.828	79%	0.793	S	S	*	*			trans	-102.2	133.9	175.6	45.1	0	0	0	0	109.7
424	F	28.3	Very low	28.9	Very low	199 Å²	199	140.5 Å²	140.5	87%	0.873	79%	0.789	S	S	*	*			trans	-136	129.1	163.9	-103.5	-86.6	0	0	0	110.2
425	S	23.7	Very low	28.6	Very low	106 Å²	106	143 Å²	143	74%	0.741	79%	0.791	S	S	*	*			trans	-107.3	131.7	171.6	50.5	0	0	0	0	109.6
426	V	31.4	Very low	28.4	Very low	128 Å²	128	144.9 Å²	144.9	78%	0.776	80%	0.795	S	S	*	*			trans	-136.8	121.5	167.9	-178.8	0	0	0	0	108.1
427	H	25.4	Very low	28.3	Very low	185 Å²	185	149.3 Å²	149.3	86%	0.856	81%	0.805	S	S	*	*			trans	-82.3	133.2	170.5	-77.1	-95.7	0	0	0	110.3
428	S	31.5	Very low	28	Very low	107 Å²	107	151.5 Å²	151.5	75%	0.748	80%	0.803	S	S	*	*			trans	-154	142.1	156.7	54.1	0	0	0	0	109.8
429	N	30.6	Very low	27.9	Very low	157 Å²	157	151.3 Å²	151.3	84%	0.84	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-82.6	154.1	-162.2	-61.3	-49	0	0	0	114.3
430	L	23.7	Very low	28	Very low	152 Å²	152	150.8 Å²	150.8	80%	0.796	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-72.8	145.5	169.8	-71.5	80	0	0	0	111.4
431	P	26.7	Very low	27.9	Very low	116 Å²	116	146.4 Å²	146.4	75%	0.753	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-87.2	124.1	140.9	25.5	-13.2	0	0	0	109.8
432	V	28.8	Very low	28	Very low	128 Å²	128	143 Å²	143	78%	0.776	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-76.5	123.1	171.2	175.4	0	0	0	0	109
433	V	28.3	Very low	28	Very low	127 Å²	127	142.4 Å²	142.4	77%	0.77	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-84.2	129.5	173.5	-178.7	0	0	0	0	109.4
434	P	28.1	Very low	28	Very low	114 Å²	114	142.2 Å²	142.2	74%	0.74	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-64.1	143.6	-178.5	-23.4	34.1	0	0	0	113.7
435	R	25	Very low	28	Very low	236 Å²	236	137.7 Å²	137.7	89%	0.891	75%	0.748	S	S	*	*			trans	-82.3	112	151.4	-92.8	-178.8	-88.2	-161.6	-7.6	107.6
436	N	29	Very low	28	Very low	143 Å²	143	142.9 Å²	142.9	77%	0.765	75%	0.752	S	S	*	*			trans	168.5	106.7	139.5	-86.8	-7.3	0	0	0	111.4
437	E	28.6	Very low	27.8	Very low	196 Å²	196	144.5 Å²	144.5	92%	0.916	75%	0.751	S	S	*	*			trans	-133.5	89.3	144.4	-81.5	-163.4	155.1	0	0	106.8
438	Q	27.5	Very low	27.9	Very low	155 Å²	155	141.3 Å²	141.3	72%	0.724	75%	0.749	S	S	*	*			trans	-83.4	116.1	175	-172.5	163.7	-48.7	0	0	107.8	D440	Q438-D440 PolarHBondContact O-N 2.79Å
439	L	31.3	Very low	27.8	Very low	132 Å²	132	140.6 Å²	140.6	69%	0.691	75%	0.745	S	S	*	*			trans	-71.2	96.2	177.3	-84.8	166.8	0	0	0	109.7	L441	L439-L441 PolarHBondContact O-N 2.8Å
440	D	28.2	Very low	27.8	Very low	140 Å²	140	139 Å²	139	75%	0.749	74%	0.743	S	S	*	*			trans	-69.4	72	171.7	-77	-27.8	0	0	0	111.3	Q438 P442	Q438-D440 PolarHBondContact O-N 2.79Å; D440-P442 WeakPolarHBondContact O-CD 3.42Å
441	L	30.1	Very low	28	Very low	105 Å²	105	137.2 Å²	137.2	55%	0.55	74%	0.743	S	S	.	*			trans	-68.4	121.5	154.1	-70.2	173.4	0	0	0	107.2	L439 I443	L439-L441 PolarHBondContact O-N 2.8Å; L441-I443 VanDerWaalsContact C-N 3.31Å; L441-I443 PolarHBondContact O-N 3.21Å
442	P	28.5	Very low	28.2	Very low	104 Å²	104	138.1 Å²	138.1	68%	0.675	75%	0.746	S	S	*	*			trans	-70.9	86.7	-178.2	27.8	-34.6	0	0	0	110.7	D440 L444	D440-P442 WeakPolarHBondContact O-CD 3.42Å; P442-L444 PolarHBondContact O-N 2.7Å; P442-L444 VanDerWaalsContact O-N 3.08Å
443	I	28.1	Very low	28.1	Very low	125 Å²	125	139.1 Å²	139.1	64%	0.641	75%	0.747	S	S	*	*			trans	-71.5	101.1	170.1	-57.7	179.5	0	0	0	107.3	L441 V445	L441-I443 VanDerWaalsContact C-N 3.31Å; L441-I443 PolarHBondContact O-N 3.21Å; I443-V445 VanDerWaalsContact C-N 3.3Å; I443-V445 HydrophobicContact CB-CG2 4.47Å; I443-V445 HydrophobicContact CG2-CG2 3.79Å; I443-V445 PolarHBondContact O-N 2.88Å
444	L	26.4	Very low	28.3	Very low	131 Å²	131	139.5 Å²	139.5	69%	0.686	75%	0.75	S	S	*	*			trans	-70	89.3	170.4	-133.2	112.8	0	0	0	108.7	P442 W446	P442-L444 PolarHBondContact O-N 2.7Å; P442-L444 VanDerWaalsContact O-N 3.08Å; L444-W446 PolarHBondContact O-N 2.83Å
445	V	26.4	Very low	28.5	Very low	104 Å²	104	138.8 Å²	138.8	63%	0.63	75%	0.747	S	S	*	*			trans	-73.1	97.1	-179.5	-175.7	0	0	0	0	109.5	I443 Q447	I443-V445 VanDerWaalsContact C-N 3.3Å; I443-V445 HydrophobicContact CB-CG2 4.47Å; I443-V445 HydrophobicContact CG2-CG2 3.79Å; I443-V445 PolarHBondContact O-N 2.88Å; V445-Q447 HydrophobicContact CG1-CG 3.97Å; V445-Q447 PolarHBondContact O-N 2.71Å; V445-Q447 VanDerWaalsContact O-N 3.16Å
446	W	25.4	Very low	28.9	Very low	215 Å²	215	137 Å²	137	81%	0.814	75%	0.749	S	S	*	*			trans	-74	99.9	167.1	-80.2	71.7	0	0	0	109.7	L444 S448	L444-W446 PolarHBondContact O-N 2.83Å; W446-S448 PolarHBondContact O-N 2.8Å
447	Q	26.2	Very low	28.7	Very low	163 Å²	163	134.7 Å²	134.7	76%	0.762	75%	0.75	S	S	*	*			trans	-83.7	91.9	169.7	-70	-170	-14.5	0	0	110.7	V445 S449	V445-Q447 HydrophobicContact CG1-CG 3.97Å; V445-Q447 PolarHBondContact O-N 2.71Å; V445-Q447 VanDerWaalsContact O-N 3.16Å; Q447-S449 VanDerWaalsContact C-N 3.3Å; Q447-S449 PolarHBondContact O-N 3.31Å; Q447-S449 VanDerWaalsContact O-N 3.16Å
448	S	28.5	Very low	29	Very low	117 Å²	117	131.7 Å²	131.7	82%	0.818	75%	0.747	S	S	*	*			trans	-83.2	74.3	164.6	50.9	0	0	0	0	110.4	W446	W446-S448 PolarHBondContact O-N 2.8Å
449	S	27.6	Very low	29	Very low	93 Å²	93	133.8 Å²	133.8	65%	0.65	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-69.7	137.2	172.1	-64.7	0	0	0	0	110.9	Q447	Q447-S449 VanDerWaalsContact C-N 3.3Å; Q447-S449 PolarHBondContact O-N 3.31Å; Q447-S449 VanDerWaalsContact O-N 3.16Å
450	P	31.8	Very low	29	Very low	124 Å²	124	135.8 Å²	135.8	81%	0.805	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-71	139.3	179	29.4	-34.5	0	0	0	111.6	V452	P450-V452 PolarHBondContact O-N 3.44Å
451	S	26.8	Very low	29.1	Very low	114 Å²	114	134.4 Å²	134.4	80%	0.797	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-74.8	120.2	-178.3	55.4	0	0	0	0	112.8
452	V	32.3	Very low	29.1	Very low	134 Å²	134	133.3 Å²	133.3	81%	0.812	78%	0.78	S	S	*	*			trans	-132.3	127.2	160.4	-178.8	0	0	0	0	108.1	P450	P450-V452 PolarHBondContact O-N 3.44Å
453	N	27.1	Very low	29.3	Very low	149 Å²	149	132.9 Å²	132.9	80%	0.797	79%	0.785	S	S	*	*			trans	-89.9	122.4	-177.2	-67	-30.1	0	0	0	111.5
454	T	31.2	Very low	29.3	Very low	135 Å²	135	134.8 Å²	134.8	83%	0.828	79%	0.792	S	S	*	*			trans	-159.3	100.1	141.2	11.8	0	0	0	0	113
455	S	32	Very low	29.6	Very low	99 Å²	99	136.6 Å²	136.6	69%	0.692	80%	0.802	S	S	*	*			trans	-10.1	147.7	151.9	57.7	0	0	0	0	122.1
456	Q	33.1	Very low	29.6	Very low	200 Å²	200	137.8 Å²	137.8	94%	0.935	81%	0.805	S	S	*	*			trans	101.8	145.1	157.1	-60.3	-177.7	0.7	0	0	118.4
457	A	26.8	Very low	29.8	Very low	93 Å²	93	133.4 Å²	133.4	77%	0.769	81%	0.805	S	S	*	*			trans	-141.5	177	-170.8	0	0	0	0	0	109.7
458	P	33.9	Very low	30.1	Very low	133 Å²	133	132.6 Å²	132.6	86%	0.864	81%	0.811	S	S	*	*				-147.5	-168.7	83.4	38	-17.9	0	0	0	115.3
459	K	26.6	Very low	30.1	Very low	199 Å²	199	131.1 Å²	131.1	87%	0.865	81%	0.806	S	S	*	*			trans	-99	162	-173.8	-55.3	170.8	176.7	177.3	0	113.3
460	L	31.9	Very low	30.3	Very low	174 Å²	174	134.9 Å²	134.9	91%	0.911	82%	0.819	S	S	*	*			trans	-159.5	171.1	149.2	-101.6	154.8	0	0	0	110.1
461	S	31	Very low	30.2	Very low	111 Å²	111	135.5 Å²	135.5	78%	0.776	82%	0.815	S	S	*	*				-150.9	160.3	-123.5	54.1	0	0	0	0	117.7
462	G	30.3	Very low	30.4	Very low	83 Å²	83	135.5 Å²	135.5	86%	0.856	81%	0.807	S	S	*	*			trans	90.1	153.6	171.3	0	0	0	0	0	113.6
463	A	32.6	Very low	30.3	Very low	95 Å²	95	135.2 Å²	135.2	79%	0.785	81%	0.805	S	S	*	*			cis	-135	144.2	-5.3	0	0	0	0	0	107.1
464	Q	28.2	Very low	30.4	Very low	165 Å²	165	133.7 Å²	133.7	77%	0.771	81%	0.806	S	S	*	*				71.9	112.1	60.3	-163.6	-179.5	4.5	0	0	114.3
465	D	31.1	Very low	30.1	Very low	168 Å²	168	138.8 Å²	138.8	90%	0.898	81%	0.81	S	S	*	*			trans	-159.5	144	151.9	-110.3	-26.8	0	0	0	108.4
466	D	28.2	Very low	30	Very low	130 Å²	130	140 Å²	140	70%	0.695	82%	0.819	S	S	*	*			trans	-129.9	148.7	-168.5	-73.3	-72.4	0	0	0	112
467	C	29.3	Very low	29.6	Very low	122 Å²	122	138.3 Å²	138.3	82%	0.824	81%	0.811	S	S	*	*			trans	171.5	116.8	151.5	-92.7	0	0	0	0	108.8
468	V	31.5	Very low	29.6	Very low	146 Å²	146	142 Å²	142	89%	0.885	82%	0.816	S	S	*	*				83.8	140.3	65.1	174.5	0	0	0	0	112.5
469	A	29.1	Very low	29.1	Very low	86 Å²	86	141.5 Å²	141.5	71%	0.711	81%	0.806	S	S	*	*			trans	-109.2	171	-161.9	0	0	0	0	0	113.7
470	D	32.3	Very low	29.2	Very low	173 Å²	173	141 Å²	141	93%	0.925	80%	0.804	S	S	*	*			trans	-165.7	-177.6	133	-108.4	-22.9	0	0	0	112.8
471	D	29.1	Very low	29	Very low	136 Å²	136	137.8 Å²	137.8	73%	0.727	80%	0.796	S	S	*	*			trans	-125.6	-178.7	-152.8	-173.5	22.4	0	0	0	114.4
472	N	31.8	Very low	28.9	Very low	115 Å²	115	136.4 Å²	136.4	62%	0.615	79%	0.791	S	S	*	*			trans	90.2	120.9	155.9	-74.4	-74.7	0	0	0	123.3
473	T	28.4	Very low	28.9	Very low	127 Å²	127	142.2 Å²	142.2	78%	0.779	79%	0.793	S	S	*	*			trans	69.9	154.3	143.8	68.5	0	0	0	0	118.5
474	S	29.8	Very low	28.7	Very low	117 Å²	117	147.3 Å²	147.3	82%	0.818	80%	0.798	S	S	*	*			cis	-148.7	169.1	31	-77.2	0	0	0	0	114.9
475	R	25	Very low	28.8	Very low	242 Å²	242	145 Å²	145	91%	0.913	80%	0.797	S	S	*	*			trans	-84.2	158.1	174.3	-79.3	173.7	163	164.2	-5.9	113.6
476	S	29.4	Very low	28.6	Very low	124 Å²	124	143.6 Å²	143.6	87%	0.867	79%	0.794	S	S	*	*			trans	-140.2	165	148.3	63.5	0	0	0	0	111.2
477	Q	25	Very low	28.3	Very low	166 Å²	166	142.8 Å²	142.8	78%	0.776	80%	0.798	S	S	*	*			trans	-130.4	149.8	-170.2	-58.7	173.3	-39.5	0	0	111.9
478	I	27	Very low	28.2	Very low	170 Å²	170	144.8 Å²	144.8	87%	0.872	80%	0.799	S	S	*	*			trans	-141.2	136.7	151.9	-59	-174.7	0	0	0	109.2
479	N	24.7	Very low	27.8	Very low	122 Å²	122	143.1 Å²	143.1	65%	0.652	79%	0.794	S	S	*	*			trans	-93.6	169.1	176.8	-76.2	-52.6	0	0	0	110.7
480	F	28.1	Very low	27.7	Very low	188 Å²	188	144.5 Å²	144.5	83%	0.825	80%	0.799	S	S	*	*				-160.3	142.4	58.7	-87	-97.4	0	0	0	108.7
481	S	27.6	Very low	27.3	Very low	108 Å²	108	141.1 Å²	141.1	76%	0.755	79%	0.789	S	S	*	*				71.3	130	69.9	-156.2	0	0	0	0	113.7
482	A	27.8	Very low	27.3	Very low	81 Å²	81	141.2 Å²	141.2	67%	0.669	79%	0.789	S	S	*	*			cis	-169.5	-177.2	-9	0	0	0	0	0	111.6
483	K	30.9	Very low	26.9	Very low	205 Å²	205	140.8 Å²	140.8	89%	0.891	80%	0.795	S	S	*	*			trans	76.7	144.1	173.9	-49.3	173	-176.3	176.4	0	115.1
484	K	28.1	Very low	26.9	Very low	203 Å²	203	144.6 Å²	144.6	88%	0.883	80%	0.797	S	S	*	*			cis	-177.9	155.8	-43.8	-116.2	-162.6	174.3	-172.9	0	104.9
485	P	30.5	Very low	26.8	Very low	116 Å²	116	146.1 Å²	146.1	75%	0.753	80%	0.796	S	S	*	*			trans	-103.7	170.1	-161.6	39.7	-35.9	0	0	0	114.8
486	V	26.5	Very low	27.1	Very low	139 Å²	139	143 Å²	143	84%	0.842	79%	0.791	S	S	*	*			trans	-128.7	140.2	158.3	177.8	0	0	0	0	108.4
487	S	23.1	Very low	27.1	Very low	112 Å²	112	145 Å²	145	78%	0.783	79%	0.787	S	S	*	*			trans	-122.5	126.1	-179.5	55.1	0	0	0	0	110.7
488	I	26.6	Very low	27.4	Very low	165 Å²	165	144.8 Å²	144.8	85%	0.846	79%	0.789	S	S	*	*			trans	-132.7	138.8	163.8	-62.8	-176.7	0	0	0	108.4
489	S	22.6	Very low	27.5	Very low	111 Å²	111	144.8 Å²	144.8	78%	0.776	79%	0.786	S	S	*	*			trans	-100.6	137.2	-179.1	54.9	0	0	0	0	112
490	S	27.1	Very low	27.7	Very low	115 Å²	115	146.7 Å²	146.7	80%	0.804	79%	0.792	S	S	*	*			trans	-156.4	154.2	141	58.7	0	0	0	0	110.7
491	S	24.4	Very low	27.9	Very low	102 Å²	102	145 Å²	145	71%	0.713	79%	0.79	S	S	*	*			trans	-63.3	151.5	160	50	0	0	0	0	110.8
492	D	28.2	Very low	27.9	Very low	138 Å²	138	146.7 Å²	146.7	74%	0.738	79%	0.791	S	S	*	*			trans	-159.7	156.4	130.5	-105.2	-29.6	0	0	0	112	Y494	D492-Y494 HydrophobicContact CB-CD2 4.23Å; D492-Y494 HydrophobicContact CB-CE2 4.31Å
493	S	24.7	Very low	28.1	Very low	106 Å²	106	148 Å²	148	74%	0.741	80%	0.795	S	S	*	*			trans	-112	111.5	179.7	61.4	0	0	0	0	110.8
494	Y	28.4	Very low	28	Very low	206 Å²	206	142.7 Å²	142.7	81%	0.808	79%	0.79	S	S	*	*			trans	-131.2	150.6	176.3	-85.8	-81.1	0	0	0	113.6	D492	D492-Y494 HydrophobicContact CB-CD2 4.23Å; D492-Y494 HydrophobicContact CB-CE2 4.31Å
495	N	26.1	Very low	28.2	Very low	149 Å²	149	139.8 Å²	139.8	80%	0.797	79%	0.789	S	S	*	*			trans	-78.2	126.3	175.2	-57.5	-52.6	0	0	0	109.2	H497	N495-H497 PolarHBondContact O-N 2.93Å
496	E	31.8	Very low	28.1	Very low	176 Å²	176	139.9 Å²	139.9	82%	0.822	79%	0.793	S	S	*	*			trans	-76.1	100.4	160.2	-73.6	-177.6	153.6	0	0	108.5
497	H	29.6	Very low	28.5	Very low	168 Å²	168	138.7 Å²	138.7	78%	0.778	79%	0.79	S	S	*	*			trans	-63.8	129.5	151.5	-91.9	-109	0	0	0	107.6	N495 E499	N495-H497 PolarHBondContact O-N 2.93Å; H497-E499 PolarHBondContact O-N 2.86Å
498	I	32	Very low	29	Very low	160 Å²	160	141.4 Å²	141.4	82%	0.821	80%	0.796	S	S	*	*			trans	-81.3	102	165.6	-63.7	174.3	0	0	0	106.6	M500	I498-M500 PolarHBondContact O-N 3.48Å
499	E	28.3	Very low	29.2	Very low	171 Å²	171	137.1 Å²	137.1	80%	0.799	79%	0.793	S	S	*	*			trans	-68	125.3	165.8	-68	-171.6	124.7	0	0	109.2	H497 I501	H497-E499 PolarHBondContact O-N 2.86Å; E499-I501 PolarHBondContact O-N 3.4Å
500	M	29.9	Very low	29.6	Very low	161 Å²	161	139.2 Å²	139.2	79%	0.793	80%	0.795	S	S	*	*			trans	-81.2	115	164.6	-64.4	-160.1	-53.4	0	0	108.3	I498 N502	I498-M500 PolarHBondContact O-N 3.48Å; M500-N502 PolarHBondContact O-N 2.67Å
501	I	31.1	Very low	29.5	Very low	153 Å²	153	143.7 Å²	143.7	79%	0.785	80%	0.796	S	S	*	*			trans	-73.2	92.1	177.9	-58.1	176.8	0	0	0	109	E499 S503	E499-I501 PolarHBondContact O-N 3.4Å; I501-S503 PolarHBondContact O-N 3.48Å
502	N	28.5	Very low	29.9	Very low	144 Å²	144	144.9 Å²	144.9	77%	0.77	80%	0.803	S	S	*	*			trans	-80.5	87	165.1	-79	-12.1	0	0	0	109.1	M500 A504	M500-N502 PolarHBondContact O-N 2.67Å; N502-A504 PolarHBondContact O-N 3.03Å
503	S	32.2	Very low	29.7	Very low	107 Å²	107	144.5 Å²	144.5	75%	0.748	80%	0.801	S	S	*	*			trans	-75.9	88.4	175.2	57	0	0	0	0	111.2	I501	I501-S503 PolarHBondContact O-N 3.48Å
504	A	28.5	Very low	30.1	Very low	95 Å²	95	146.1 Å²	146.1	79%	0.785	81%	0.807	S	S	*	*			trans	-103.2	113.3	170.2	0	0	0	0	0	110.3	N502	N502-A504 PolarHBondContact O-N 3.03Å
505	T	33.1	Very low	30	Very low	142 Å²	142	143.5 Å²	143.5	87%	0.871	81%	0.807	S	S	*	*			trans	-134.9	124	171.1	46.6	0	0	0	0	109.2
506	S	28.4	Very low	30.2	Very low	118 Å²	118	139.7 Å²	139.7	83%	0.825	80%	0.803	S	S	*	*			trans	-90.6	140.6	-171.4	51.3	0	0	0	0	113.7
507	S	35	Very low	29.9	Very low	113 Å²	113	140.5 Å²	140.5	79%	0.79	81%	0.806	S	S	*	*			trans	-157.1	129.7	152.6	56.9	0	0	0	0	109.2
508	D	31.6	Very low	30	Very low	169 Å²	169	137.2 Å²	137.2	90%	0.904	80%	0.803	S	S	*	*			trans	-77	162.6	-168.7	-48.3	-88.6	0	0	0	114
509	G	32.2	Very low	29.8	Very low	76 Å²	76	137.2 Å²	137.2	78%	0.784	80%	0.804	S	S	*	*			trans	172.7	61.5	-177.7	0	0	0	0	0	116.3
510	D	30.1	Very low	29.9	Very low	154 Å²	154	135.2 Å²	135.2	82%	0.824	80%	0.803	S	S	*	*			trans	26.8	116.4	161.3	-64.6	-35.8	0	0	0	122.6
511	Y	26.2	Very low	30	Very low	209 Å²	209	136.4 Å²	136.4	82%	0.82	81%	0.807	S	S	*	*			trans	15.5	125.3	137.3	-78	-89.7	0	0	0	120.8
512	C	31.2	Very low	29.8	Very low	128 Å²	128	138.5 Å²	138.5	87%	0.865	81%	0.81	S	S	*	*				-153.5	140.6	109.8	-148.5	0	0	0	0	111.9
513	N	25.6	Very low	29.9	Very low	129 Å²	129	137.5 Å²	137.5	69%	0.69	81%	0.812	S	S	*	*			trans	-93.1	132.7	-179.7	-94.7	-9.2	0	0	0	111.8
514	T	32.4	Very low	29.8	Very low	141 Å²	141	135.7 Å²	135.7	87%	0.865	81%	0.809	S	S	*	*			trans	-133.8	130.6	151.3	47.9	0	0	0	0	109.5
515	N	27.2	Very low	29.8	Very low	151 Å²	151	137.5 Å²	137.5	81%	0.807	80%	0.802	S	S	*	*			trans	-79.5	140	-171.8	-61.5	-21.2	0	0	0	111.4
516	G	30.2	Very low	30	Very low	69 Å²	69	138.3 Å²	138.3	71%	0.711	79%	0.79	S	S	*	*			trans	-144.8	86.6	170.9	0	0	0	0	0	109.8	S518	G516-S518 PolarHBondContact O-N 2.85Å
517	E	25.7	Very low	30.1	Very low	192 Å²	192	135.9 Å²	135.9	90%	0.897	77%	0.773	S	S	*	*			trans	-62.7	131.3	175.8	-76.3	168.2	113.6	0	0	110.5
518	S	30.5	Very low	30.3	Very low	100 Å²	100	135.1 Å²	135.1	70%	0.699	76%	0.763	S	S	*	*			trans	-138.8	120.5	166.4	44.8	0	0	0	0	107.6	G516 V520	G516-S518 PolarHBondContact O-N 2.85Å; S518-V520 PolarHBondContact O-N 3.25Å; S518-V520 VanDerWaalsContact O-N 3.11Å
519	D	27.8	Very low	30.7	Very low	159 Å²	159	129 Å²	129	85%	0.85	73%	0.73	S	S	*	*			trans	-67.8	109.7	-163.8	-67.3	-74.5	0	0	0	113.2	E521	D519-E521 PolarHBondContact O-N 3.19Å
520	V	30.8	Very low	30.9	Very low	129 Å²	129	127.5 Å²	127.5	78%	0.782	71%	0.711	S	S	*	*			trans	-86.1	93	168	-177.4	0	0	0	0	108.3	S518 K522	S518-V520 PolarHBondContact O-N 3.25Å; S518-V520 VanDerWaalsContact O-N 3.11Å; V520-K522 PolarHBondContact O-N 3.2Å
521	E	31.8	Very low	31.2	Very low	186 Å²	186	125.5 Å²	125.5	87%	0.869	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-57.7	131.7	174.3	-75.7	-165.4	126.3	0	0	111.3	D519	D519-E521 PolarHBondContact O-N 3.19Å
522	K	26.8	Very low	32	Very low	198 Å²	198	118.8 Å²	118.8	86%	0.861	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-86.7	132.5	-172.8	-61.5	170.8	-175.4	169.5	0	110.6	V520 G524	V520-K522 PolarHBondContact O-N 3.2Å; K522-G524 PolarHBondContact O-N 3.15Å
523	P	30.8	Very low	32.7	Very low	123 Å²	123	116.1 Å²	116.1	80%	0.799	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-75.7	118.8	178.1	29.5	-33.4	0	0	0	111.8
524	G	30.4	Very low	33.3	Very low	68 Å²	68	112 Å²	112	70%	0.701	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-102.5	121.7	175.7	0	0	0	0	0	113.4	K522	K522-G524 PolarHBondContact O-N 3.15Å
525	E	27.4	Very low	33.7	Very low	133 Å²	133	108.6 Å²	108.6	62%	0.621	62%	0.619	S	S	*	*			trans	41.5	137.5	134.3	-67.2	-160.8	119.3	0	0	124.1
526	Y	37.1	Very low	34.3	Very low	159 Å²	159	102.9 Å²	102.9	62%	0.624	59%	0.588	S	S	*	*			trans	60.2	126.3	168.7	-48.4	-65.2	0	0	0	118
527	S	31	Very low	34.9	Very low	67 Å²	67	103.3 Å²	103.3	47%	0.469	58%	0.577	S	S	.	*			cis	81.1	56.7	41.4	-165	0	0	0	0	115.2	A530	S527-A530 WeakPolarHBondContact OG-CB 3.26Å
528	V	38.9	Very low	35.6	Very low	97 Å²	97	97.3 Å²	97.3	59%	0.588	55%	0.554	S	S	*	*	S	Bend	trans	-101.6	-40.1	162.5	-177.9	0	0	0	0	111.4	A530 E532	V528-A530 PolarHBondContact O-N 3.06Å; V528-E532 PolarHBondContact O-N 3.05Å
529	L	40.6	Very low	36	Very low	40 Å²	40	98.2 Å²	98.2	21%	0.209	55%	0.545	C	S	.	.	H	α-helix	trans	-64.8	-22.2	178.2	-93	-172.1	0	0	0	114.6	L31 Y320 E532 L533	L31-L529 HydrophobicContact CB-CD1 4.26Å; L31-L529 HydrophobicContact CB-CG 4.2Å; L31-L529 HydrophobicContact CD1-CD1 3.62Å; L31-L529 HydrophobicContact CD1-CD2 4.01Å; L31-L529 HydrophobicContact CD1-CG 3.71Å; Y320-L529 HydrophobicContact CD2-CD1 4.32Å; Y320-L529 HydrophobicContact CE2-CD1 3.84Å; L529-E532 PolarHBondContact O-N 3.3Å; L529-L533 HydrophobicContact CB-CD1 4.44Å; L529-L533 HydrophobicContact CD2-CG 4.47Å; L529-L533 VanDerWaalsContact O-CB 3.25Å; L529-L533 WeakPolarHBondContact O-CB 3.41Å; L529-L533 VanDerWaalsContact O-CG 3.26Å; L529-L533 WeakPolarHBondContact O-CG 3.48Å; L529-L533 PolarHBondContact O-N 3.27Å
530	A	35.7	Very low	36.6	Very low	46 Å²	46	93.5 Å²	93.5	38%	0.38	52%	0.52	S	S	.	.	H	α-helix	trans	-63	-47.9	-178.5	0	0	0	0	0	110.8	S527 V528 A534	S527-A530 WeakPolarHBondContact OG-CB 3.26Å; V528-A530 PolarHBondContact O-N 3.06Å; A530-A534 WeakPolarHBondContact O-CB 3.03Å; A530-A534 PolarHBondContact O-N 3.49Å
531	D	36.8	Very low	37.1	Very low	112 Å²	112	92.6 Å²	92.6	60%	0.599	51%	0.507	S	S	*	.	H	α-helix	trans	-75.5	-30.6	179.2	-64.7	-40.9	0	0	0	112.5	S535	D531-S535 WeakPolarHBondContact O-CB 3.12Å; D531-S535 PolarHBondContact O-N 2.82Å; D531-S535 PolarHBondContact O-OG 3.07Å
532	E	44	Very low	37.5	Very low	67 Å²	67	87.3 Å²	87.3	31%	0.313	48%	0.484	S	S	.	.	H	α-helix	trans	-69.5	-43.2	174.8	-160.6	-176.6	173.2	0	0	111.6	H337 V528 L529 S535 L536	H337-E532 IonicContact CE1-OE1 3.93Å; V528-E532 PolarHBondContact O-N 3.05Å; L529-E532 PolarHBondContact O-N 3.3Å; E532-S535 PolarHBondContact O-N 3.37Å; E532-L536 WeakPolarHBondContact O-CB 3.33Å; E532-L536 WeakPolarHBondContact O-CG 3.14Å; E532-L536 PolarHBondContact O-N 2.69Å
533	L	44.3	Very low	38.2	Very low	72 Å²	72	83.6 Å²	83.6	38%	0.377	47%	0.47	S	S	.	.	H	α-helix	trans	-71.2	-34.9	173.8	-68.8	171.2	0	0	0	112.2	V323 L529 S535 T537	V323-L533 HydrophobicContact CG1-CD2 4.2Å; L529-L533 HydrophobicContact CB-CD1 4.44Å; L529-L533 HydrophobicContact CD2-CG 4.47Å; L529-L533 VanDerWaalsContact O-CB 3.25Å; L529-L533 WeakPolarHBondContact O-CB 3.41Å; L529-L533 VanDerWaalsContact O-CG 3.26Å; L529-L533 WeakPolarHBondContact O-CG 3.48Å; L529-L533 PolarHBondContact O-N 3.27Å; L533-S535 VanDerWaalsContact C-N 3.33Å; L533-T537 WeakPolarHBondContact O-CB 3.33Å; L533-T537 WeakPolarHBondContact O-CG2 3.48Å; L533-T537 PolarHBondContact O-N 3.18Å; L533-T537 PolarHBondContact O-OG1 2.62Å
534	A	39.1	Very low	38.9	Very low	42 Å²	42	84.1 Å²	84.1	35%	0.347	46%	0.46	S	S	.	.	H	α-helix	trans	-63.1	-40.6	169.8	0	0	0	0	0	111.1	A530 T537 T538	A530-A534 WeakPolarHBondContact O-CB 3.03Å; A530-A534 PolarHBondContact O-N 3.49Å; A534-T537 WeakPolarHBondContact CA-OG1 3.43Å; A534-T537 PolarHBondContact O-OG1 2.8Å; A534-T538 WeakPolarHBondContact O-CB 3.08Å; A534-T538 PolarHBondContact O-N 3.07Å; A534-T538 PolarHBondContact O-OG1 2.86Å
535	S	41	Very low	39.4	Very low	71 Å²	71	87.5 Å²	87.5	50%	0.497	46%	0.455	S	S	.	.	H	α-helix	trans	-65.4	-47	176.2	-64.2	0	0	0	0	111.6	D531 E532 L533 T538 F539	D531-S535 WeakPolarHBondContact O-CB 3.12Å; D531-S535 PolarHBondContact O-N 2.82Å; D531-S535 PolarHBondContact O-OG 3.07Å; E532-S535 PolarHBondContact O-N 3.37Å; L533-S535 VanDerWaalsContact C-N 3.33Å; S535-T538 CarbonylContact O-C 3.59Å; S535-T538 PolarHBondContact O-N 2.96Å; S535-F539 PolarHBondContact O-N 2.53Å
536	L	40.3	Very low	39.9	Very low	30 Å²	30	87.1 Å²	87.1	16%	0.157	46%	0.457	C	S	.	.	H	α-helix	trans	-66	-38.4	177.8	-74.8	168.4	0	0	0	112.8	Y333 L336 E532 N540	Y333-L536 HydrophobicContact CD1-CD2 4.06Å; Y333-L536 HydrophobicContact CE1-CD2 3.76Å; L336-L536 HydrophobicContact CD1-CD2 4.02Å; E532-L536 WeakPolarHBondContact O-CB 3.33Å; E532-L536 WeakPolarHBondContact O-CG 3.14Å; E532-L536 PolarHBondContact O-N 2.69Å; L536-N540 WeakPolarHBondContact O-CB 3.4Å; L536-N540 PolarHBondContact O-N 3Å; L536-N540 VanDerWaalsContact O-N 3.07Å; L536-N540 PolarHBondContact O-ND2 2.92Å
537	T	42.2	Very low	40	Very low	79 Å²	79	86.4 Å²	86.4	49%	0.485	46%	0.463	S	S	.	.	H	α-helix	trans	-73	-27.7	173.3	53.3	0	0	0	0	112.6	L533 A534 Q541	L533-T537 WeakPolarHBondContact O-CB 3.33Å; L533-T537 WeakPolarHBondContact O-CG2 3.48Å; L533-T537 PolarHBondContact O-N 3.18Å; L533-T537 PolarHBondContact O-OG1 2.62Å; A534-T537 WeakPolarHBondContact CA-OG1 3.43Å; A534-T537 PolarHBondContact O-OG1 2.8Å; T537-Q541 VanDerWaalsContact O-CG 3.3Å; T537-Q541 WeakPolarHBondContact O-CG 3.17Å; T537-Q541 PolarHBondContact O-N 3.34Å; T537-Q541 PolarHBondContact O-NE2 3.5Å
538	T	41.2	Very low	40	Very low	66 Å²	66	90.1 Å²	90.1	41%	0.405	48%	0.477	S	S	.	.	H	α-helix	trans	-73.4	-42.1	172.4	-63.5	0	0	0	0	111.3	A534 S535 N540 Q541 I542	A534-T538 WeakPolarHBondContact O-CB 3.08Å; A534-T538 PolarHBondContact O-N 3.07Å; A534-T538 PolarHBondContact O-OG1 2.86Å; S535-T538 CarbonylContact O-C 3.59Å; S535-T538 PolarHBondContact O-N 2.96Å; T538-N540 VanDerWaalsContact C-N 3.33Å; T538-N540 PolarHBondContact O-N 3.11Å; T538-Q541 CarbonylContact O-C 3.49Å; T538-Q541 WeakPolarHBondContact O-CA 3.23Å; T538-Q541 WeakPolarHBondContact O-CB 3.33Å; T538-Q541 PolarHBondContact O-N 3.2Å; T538-I542 HydrophobicContact CG2-CD1 3.79Å; T538-I542 HydrophobicContact CG2-CG1 4.26Å; T538-I542 WeakPolarHBondContact O-CG1 3.47Å; T538-I542 PolarHBondContact O-N 2.81Å
539	F	38.2	Very low	39.6	Very low	119 Å²	119	89.1 Å²	89.1	52%	0.522	48%	0.479	S	S	.	.	H	α-helix	trans	-57.6	-46.9	171.7	-122.3	-91.9	0	0	0	111	S535 Q541 I542 E543	S535-F539 PolarHBondContact O-N 2.53Å; F539-Q541 PolarHBondContact O-N 3.17Å; F539-Q541 VanDerWaalsContact O-N 3.09Å; F539-I542 PolarHBondContact O-N 3.19Å; F539-I542 VanDerWaalsContact O-N 3.07Å; F539-E543 PolarHBondContact O-N 2.72Å
540	N	41.1	Very low	39.3	Very low	60 Å²	60	92.7 Å²	92.7	32%	0.321	50%	0.504	S	S	.	.	H	α-helix	trans	-64.2	-10.1	173.5	-88.5	-90.8	0	0	0	114.6	L536 T538 K544	L536-N540 WeakPolarHBondContact O-CB 3.4Å; L536-N540 PolarHBondContact O-N 3Å; L536-N540 VanDerWaalsContact O-N 3.07Å; L536-N540 PolarHBondContact O-ND2 2.92Å; T538-N540 VanDerWaalsContact C-N 3.33Å; T538-N540 PolarHBondContact O-N 3.11Å; N540-K544 WeakPolarHBondContact O-CD 3.46Å; N540-K544 WeakPolarHBondContact O-CG 3.45Å; N540-K544 PolarHBondContact O-NZ 3.22Å
541	Q	40.5	Very low	39.3	Very low	109 Å²	109	97.8 Å²	97.8	51%	0.509	52%	0.523	S	S	.	.	H	α-helix	trans	-100.7	-31.9	170	-75.2	174	66.8	0	0	112.4	T537 T538 F539 K544 K545	T537-Q541 VanDerWaalsContact O-CG 3.3Å; T537-Q541 WeakPolarHBondContact O-CG 3.17Å; T537-Q541 PolarHBondContact O-N 3.34Å; T537-Q541 PolarHBondContact O-NE2 3.5Å; T538-Q541 CarbonylContact O-C 3.49Å; T538-Q541 WeakPolarHBondContact O-CA 3.23Å; T538-Q541 WeakPolarHBondContact O-CB 3.33Å; T538-Q541 PolarHBondContact O-N 3.2Å; F539-Q541 PolarHBondContact O-N 3.17Å; F539-Q541 VanDerWaalsContact O-N 3.09Å; Q541-K544 CarbonylContact O-C 3.49Å; Q541-K544 PolarHBondContact O-N 3.26Å; Q541-K545 WeakPolarHBondContact O-CG 3.42Å; Q541-K545 PolarHBondContact O-N 2.82Å
542	I	40.3	Very low	39	Very low	75 Å²	75	98.3 Å²	98.3	39%	0.385	53%	0.531	S	S	.	.	H	α-helix	trans	-69.1	-44.3	176.7	-71.3	170.9	0	0	0	110.3	T538 F539 K544 K545 N546	T538-I542 HydrophobicContact CG2-CD1 3.79Å; T538-I542 HydrophobicContact CG2-CG1 4.26Å; T538-I542 WeakPolarHBondContact O-CG1 3.47Å; T538-I542 PolarHBondContact O-N 2.81Å; F539-I542 PolarHBondContact O-N 3.19Å; F539-I542 VanDerWaalsContact O-N 3.07Å; I542-K544 PolarHBondContact O-N 3.47Å; I542-K545 PolarHBondContact O-N 2.87Å; I542-N546 WeakPolarHBondContact O-CB 3.45Å; I542-N546 PolarHBondContact O-N 2.78Å
543	E	41.7	Very low	38.5	Very low	120 Å²	120	101.9 Å²	101.9	56%	0.561	55%	0.552	S	S	*	*	H	α-helix	trans	-58.5	-31.8	170.9	-70.2	-169.1	131.9	0	0	112.2	F539 I547	F539-E543 PolarHBondContact O-N 2.72Å; E543-I547 WeakPolarHBondContact O-CD1 3.12Å; E543-I547 WeakPolarHBondContact O-CG1 3.15Å
544	K	45.8	Very low	37.8	Very low	134 Å²	134	103.8 Å²	103.8	58%	0.583	57%	0.566	S	S	*	*	H	α-helix	trans	-82.7	-13.8	177.2	-63.1	-173	-175.1	94.9	0	113.9	N540 Q541 I542	N540-K544 WeakPolarHBondContact O-CD 3.46Å; N540-K544 WeakPolarHBondContact O-CG 3.45Å; N540-K544 PolarHBondContact O-NZ 3.22Å; Q541-K544 CarbonylContact O-C 3.49Å; Q541-K544 PolarHBondContact O-N 3.26Å; I542-K544 PolarHBondContact O-N 3.47Å
545	K	40.9	Very low	37.4	Very low	139 Å²	139	108.4 Å²	108.4	60%	0.604	59%	0.585	S	S	*	*	H	α-helix	trans	-94.4	-35.5	171.6	-77.5	179.8	176.1	178.9	0	112.2	Q541 I542 I547 L548 A549	Q541-K545 WeakPolarHBondContact O-CG 3.42Å; Q541-K545 PolarHBondContact O-N 2.82Å; I542-K545 PolarHBondContact O-N 2.87Å; K545-I547 PolarHBondContact O-N 3.05Å; K545-L548 CarbonylContact O-C 3.26Å; K545-L548 VanDerWaalsContact O-C 3.26Å; K545-L548 WeakPolarHBondContact O-CA 2.97Å; K545-L548 PolarHBondContact O-N 3.23Å; K545-A549 PolarHBondContact O-N 3.32Å
546	N	38.3	Very low	37	Very low	126 Å²	126	109.6 Å²	109.6	67%	0.674	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	-0.9	178.4	-68.5	-2.1	0	0	0	113.6	I542	I542-N546 WeakPolarHBondContact O-CB 3.45Å; I542-N546 PolarHBondContact O-N 2.78Å
547	I	37.4	Very low	36.5	Very low	144 Å²	144	115.4 Å²	115.4	74%	0.738	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103	3.5	165.9	-62.4	171.9	0	0	0	110.8	E543 K545	E543-I547 WeakPolarHBondContact O-CD1 3.12Å; E543-I547 WeakPolarHBondContact O-CG1 3.15Å; K545-I547 PolarHBondContact O-N 3.05Å
548	L	32.3	Very low	36	Very low	144 Å²	144	120.4 Å²	120.4	75%	0.754	64%	0.639	S	S	*	*	S	Bend	trans	-142	41.7	-173.9	-107.6	139.4	0	0	0	112.9	K545	K545-L548 CarbonylContact O-C 3.26Å; K545-L548 VanDerWaalsContact O-C 3.26Å; K545-L548 WeakPolarHBondContact O-CA 2.97Å; K545-L548 PolarHBondContact O-N 3.23Å
549	A	31.2	Very low	35.4	Very low	77 Å²	77	122.3 Å²	122.3	64%	0.636	66%	0.655	S	S	*	*			trans	-112.8	104.6	168.1	0	0	0	0	0	109.8	K545 I551	K545-A549 PolarHBondContact O-N 3.32Å; A549-I551 PolarHBondContact O-N 3.14Å
550	P	34.1	Very low	35	Very low	114 Å²	114	122.8 Å²	122.8	74%	0.74	67%	0.673	S	S	*	*			trans	-72.5	125.3	171.5	29.5	-31.7	0	0	0	109.5	V552	P550-V552 PolarHBondContact O-N 3.46Å; P550-V552 VanDerWaalsContact O-N 3.14Å
551	I	34	Very low	34.4	Very low	153 Å²	153	128.4 Å²	128.4	79%	0.785	70%	0.698	S	S	*	*			trans	-66.7	112.2	170.6	-63.5	174	0	0	0	107.7	A549 N553	A549-I551 PolarHBondContact O-N 3.14Å; I551-N553 PolarHBondContact O-N 3.43Å; I551-N553 VanDerWaalsContact O-N 3.14Å
552	V	30.8	Very low	33.7	Very low	124 Å²	124	128.8 Å²	128.8	75%	0.752	71%	0.707	S	S	*	*			trans	-79.6	93.7	173.3	-179	0	0	0	0	108.4	P550	P550-V552 PolarHBondContact O-N 3.46Å; P550-V552 VanDerWaalsContact O-N 3.14Å
553	N	33.7	Very low	33.2	Very low	142 Å²	142	131.9 Å²	131.9	76%	0.759	73%	0.73	S	S	*	*			trans	-113.6	112.9	156.2	-85.1	-12.2	0	0	0	108	I551	I551-N553 PolarHBondContact O-N 3.43Å; I551-N553 VanDerWaalsContact O-N 3.14Å
554	T	30.3	Very low	32.3	Very low	111 Å²	111	134.5 Å²	134.5	68%	0.681	74%	0.739	S	S	*	*			trans	-65.1	130.1	159	50	0	0	0	0	106.9
555	D	31.3	Very low	31.5	Very low	139 Å²	139	139.6 Å²	139.6	74%	0.743	76%	0.755	S	S	*	*				-164.2	166.8	57.3	-94.8	-54.3	0	0	0	115
556	S	30.6	Very low	30.8	Very low	97 Å²	97	142.4 Å²	142.4	68%	0.678	77%	0.767	S	S	*	*			trans	50.7	99.1	149.3	72.1	0	0	0	0	119.9
557	L	31	Very low	30.6	Very low	151 Å²	151	141.6 Å²	141.6	79%	0.791	77%	0.769	S	S	*	*				167.4	108.2	102.4	-87.8	162.7	0	0	0	115
558	K	31.1	Very low	30.3	Very low	184 Å²	184	143.5 Å²	143.5	80%	0.8	77%	0.774	S	S	*	*			trans	43.2	93.4	138.5	-65.4	-178.3	178.4	178.8	0	120.9
559	S	28.3	Very low	30.2	Very low	107 Å²	107	145.3 Å²	145.3	75%	0.748	78%	0.779	S	S	*	*				51.4	120.8	118.8	64	0	0	0	0	122.4
560	S	31.1	Very low	30.1	Very low	128 Å²	128	145.1 Å²	145.1	90%	0.895	78%	0.784	S	S	*	*				-168.3	165.5	121.7	27.9	0	0	0	0	111.3
561	E	27.3	Very low	29.9	Very low	179 Å²	179	151.3 Å²	151.3	84%	0.836	79%	0.793	S	S	*	*			trans	-112.3	148.7	-155.5	-80.7	-170.6	101.8	0	0	117.5
562	V	26.1	Very low	29.7	Very low	116 Å²	116	153.3 Å²	153.3	70%	0.703	80%	0.796	S	S	*	*			trans	49.5	123	135.3	-179.6	0	0	0	0	120.3
563	T	29	Very low	29.7	Very low	141 Å²	141	158.6 Å²	158.6	87%	0.865	80%	0.802	S	S	*	*				-167.4	139	120.6	14.6	0	0	0	0	112.4
564	F	24.4	Very low	29.5	Very low	174 Å²	174	158 Å²	158	76%	0.763	79%	0.79	S	S	*	*			trans	-112.7	134.2	-179.8	-141.1	-89.9	0	0	0	109.9
565	R	27.6	Very low	29.4	Very low	242 Å²	242	158.6 Å²	158.6	91%	0.913	80%	0.797	S	S	*	*			trans	-124.3	138.3	172.3	-75.8	-171	175.6	-169.5	-0.5	111.4
566	K	27.3	Very low	29.4	Very low	198 Å²	198	159.4 Å²	159.4	86%	0.861	80%	0.8	S	S	*	*			trans	-91.5	176.6	169.5	-71.5	-178.6	179.3	178.4	0	109.7
567	P	33.5	Very low	29.2	Very low	108 Å²	108	162.4 Å²	162.4	70%	0.701	80%	0.797	S	S	*	*			cis	-128.6	-176.4	-43.4	36.5	-21.6	0	0	0	111
568	H	30.6	Very low	29.3	Very low	184 Å²	184	161.9 Å²	161.9	85%	0.852	80%	0.799	S	S	*	*			trans	-165.3	179.7	137.5	-111.2	-72.5	0	0	0	111.8
569	Q	31.4	Very low	29.2	Very low	182 Å²	182	159.5 Å²	159.5	85%	0.85	80%	0.795	S	S	*	*			trans	-102	145.1	-159.3	-63.3	163.9	-33.9	0	0	114.7
570	G	27.8	Very low	29.3	Very low	73 Å²	73	160.8 Å²	160.8	75%	0.753	80%	0.798	S	S	*	*			trans	94.2	107.8	135.6	0	0	0	0	0	120.3
571	R	30.7	Very low	29.3	Very low	245 Å²	245	160.7 Å²	160.7	93%	0.925	80%	0.798	S	S	*	*			trans	-171.2	145.4	132.1	-109.8	167.9	173.3	174.1	-1.6	112.6
572	K	29.9	Very low	29.5	Very low	194 Å²	194	157.1 Å²	157.1	84%	0.843	79%	0.793	S	S	*	*			trans	-95.2	142.4	172.5	-64	-178.9	178.5	-178	0	111.1
573	R	30.1	Very low	29.7	Very low	236 Å²	236	161.4 Å²	161.4	89%	0.891	80%	0.802	S	S	*	*			trans	-145.8	125.7	160.3	-68.3	-174.9	170.8	175.6	-4.2	106.4
574	R	30.7	Very low	29.9	Very low	129 Å²	129	160.4 Å²	160.4	49%	0.487	80%	0.8	S	S	.	*			cis	86.3	97.6	47.5	-162.3	-176.4	-137.3	175.2	11.1	111.6	N608	R574-N608 PolarHBondContact NH2-O 3.35Å; R574-N608 VanDerWaalsContact NH2-O 3.16Å
575	C	28	Very low	30.3	Very low	124 Å²	124	160 Å²	160	84%	0.838	81%	0.806	S	S	*	*			trans	-101.9	175.3	168.8	-84.5	0	0	0	0	111.2
576	L	29.9	Very low	30.3	Very low	155 Å²	155	153.3 Å²	153.3	81%	0.812	80%	0.803	S	S	*	*			trans	52.6	87.6	-176.7	-82.2	162.9	0	0	0	114.1
577	R	27.8	Very low	30.5	Very low	161 Å²	161	147.5 Å²	147.5	61%	0.608	80%	0.799	S	S	*	*			trans	-144.1	103.9	162.6	-163.1	178.1	-155.2	-162.7	7.5	109.5	L579	R577-L579 HydrophobicContact CG-CD2 4.15Å; R577-L579 HydrophobicContact CG-CG 4.42Å; R577-L579 PolarHBondContact O-N 3.18Å
578	V	33.3	Very low	30.3	Very low	139 Å²	139	150.4 Å²	150.4	84%	0.842	81%	0.809	S	S	*	*			trans	-65.4	130	162	-179.9	0	0	0	0	106.9
579	L	29.4	Very low	30.4	Very low	134 Å²	134	147.7 Å²	147.7	70%	0.702	81%	0.81	S	S	*	*			trans	-113.3	111.3	-178.3	-76.8	172.6	0	0	0	109.9	R577	R577-L579 HydrophobicContact CG-CD2 4.15Å; R577-L579 HydrophobicContact CG-CG 4.42Å; R577-L579 PolarHBondContact O-N 3.18Å
580	T	29.6	Very low	30.4	Very low	135 Å²	135	143.9 Å²	143.9	83%	0.828	80%	0.803	S	S	*	*			trans	-97.7	150.4	153.5	51.9	0	0	0	0	108.9
581	S	30.1	Very low	30.6	Very low	126 Å²	126	146.8 Å²	146.8	88%	0.881	80%	0.802	S	S	*	*			trans	-101.9	124.3	-165.7	44.3	0	0	0	0	113.3
582	S	32.5	Very low	30.5	Very low	104 Å²	104	141.7 Å²	141.7	73%	0.727	79%	0.789	S	S	*	*			trans	-149.2	154.5	159	55.6	0	0	0	0	110
583	K	29.6	Very low	30.4	Very low	205 Å²	205	140.3 Å²	140.3	89%	0.891	79%	0.785	S	S	*	*			trans	-117.3	135.8	-178.5	-64.5	175.9	-179.7	175	0	109.6
584	S	33.3	Very low	30.2	Very low	120 Å²	120	134.3 Å²	134.3	84%	0.839	78%	0.779	S	S	*	*				178.4	160.6	122.2	41.7	0	0	0	0	113.3
585	N	32.7	Very low	30.2	Very low	166 Å²	166	132.8 Å²	132.8	89%	0.888	79%	0.794	S	S	*	*			trans	-26	163.4	-177.9	-60.5	-7.4	0	0	0	121.5
586	A	29.2	Very low	30.2	Very low	102 Å²	102	135 Å²	135	84%	0.843	80%	0.798	S	S	*	*			trans	-112.7	161.5	179	0	0	0	0	0	112.6
587	G	30.9	Very low	30.2	Very low	75 Å²	75	134.9 Å²	134.9	77%	0.773	80%	0.797	S	S	*	*			trans	-141.8	137.9	165.8	0	0	0	0	0	110
588	N	29.1	Very low	30.8	Very low	170 Å²	170	133.8 Å²	133.8	91%	0.909	79%	0.793	S	S	*	*			trans	-104	140.5	-178.9	-80.4	-15.1	0	0	0	111.5
589	S	33.2	Very low	31.5	Very low	126 Å²	126	135.4 Å²	135.4	88%	0.881	80%	0.797	S	S	*	*			trans	-154.1	162.7	146.3	57	0	0	0	0	109.4
590	S	31	Very low	32.8	Very low	102 Å²	102	132.8 Å²	132.8	71%	0.713	78%	0.784	S	S	*	*			trans	-146.2	168.8	-166.9	57.7	0	0	0	0	112.6
591	N	31.5	Very low	33.9	Very low	135 Å²	135	128.8 Å²	128.8	72%	0.722	76%	0.761	S	S	*	*			trans	107.1	146.4	178.4	-61.4	-27.9	0	0	0	113.7
592	Q	29.8	Very low	35.4	Very low	138 Å²	138	125.9 Å²	125.9	65%	0.645	74%	0.735	S	S	*	*			cis	-165.5	162.6	-19	-117.4	-178.4	49.1	0	0	109.2
593	Q	26.6	Very low	35.9	Very low	165 Å²	165	127 Å²	127	77%	0.771	74%	0.737	S	S	*	*			trans	65.6	156.2	162	-66.4	166.4	41.7	0	0	115.6
594	S	26.5	Very low	36.3	Very low	110 Å²	110	118.9 Å²	118.9	77%	0.769	71%	0.706	S	S	*	*			cis	-164.3	141.9	-12	46.2	0	0	0	0	110.4
595	A	30.3	Very low	36.4	Very low	97 Å²	97	121.8 Å²	121.8	80%	0.802	71%	0.708	S	S	*	*			trans	176.1	125.7	146.5	0	0	0	0	0	111.4
596	N	26.9	Very low	36.5	Very low	170 Å²	170	117.8 Å²	117.8	91%	0.909	68%	0.681	S	S	*	*			trans	-97.5	118.4	169.9	-75.6	-12.5	0	0	0	110.1
597	L	31.2	Very low	36.7	Very low	152 Å²	152	117.1 Å²	117.1	80%	0.796	67%	0.669	S	S	*	*			trans	-153.7	124	169.4	-99.1	174.6	0	0	0	112.3
598	R	40.7	Very low	36.7	Very low	138 Å²	138	119 Å²	119	52%	0.521	66%	0.661	S	S	.	*			trans	74.1	99.3	162.4	-55.2	176	179.3	167.3	1.1	118.5
599	D	46.7	Very low	36.8	Very low	173 Å²	173	115.8 Å²	115.8	93%	0.925	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-11.6	172.7	-68.5	-63.8	0	0	0	115.7	C601	D599-C601 VanDerWaalsContact C-N 3.35Å; D599-C601 PolarHBondContact O-N 3.29Å
600	D	57.2	Low	36.5	Very low	80 Å²	80	117 Å²	117	43%	0.428	64%	0.64	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85	2.7	-175.4	-94.1	-56.3	0	0	0	115.4	R275	R275-D600 IonicContact CZ-OD1 3.15Å; R275-D600 IonicContact NE-OD1 3.64Å; R275-D600 IonicContact NH2-OD1 3.78Å; R275-D600 PolarHBondContact NH2-OD1 3.15Å
601	C	52.6	Low	36.5	Very low	51 Å²	51	115.5 Å²	115.5	35%	0.345	64%	0.64	S	S	.	*			trans	-81.5	120	-177.2	-69.5	0	0	0	0	112.5	D599 V603	D599-C601 VanDerWaalsContact C-N 3.35Å; D599-C601 PolarHBondContact O-N 3.29Å; C601-V603 PolarHBondContact O-N 2.97Å; C601-V603 VanDerWaalsContact O-N 3.09Å
602	I	62.9	Low	36.3	Very low	64 Å²	64	114.4 Å²	114.4	33%	0.328	64%	0.638	S	S	.	*			trans	-76.8	95.6	171.2	-52.5	176	0	0	0	108.6	T263 Y273 R275 S604	T263-I602 HydrophobicContact CG2-CD1 4.29Å; Y273-I602 PolarHBondContact O-N 2.88Å; R275-I602 HydrophobicContact CG-CD1 3.86Å; R275-I602 HydrophobicContact CG-CG1 4.29Å; I602-S604 PolarHBondContact O-N 3.07Å
603	V	42.8	Very low	36.1	Very low	127 Å²	127	112.6 Å²	112.6	77%	0.77	65%	0.646	S	S	*	*			trans	-61.8	119.9	173.6	-177.5	0	0	0	0	109.6	C601	C601-V603 PolarHBondContact O-N 2.97Å; C601-V603 VanDerWaalsContact O-N 3.09Å
604	S	36.8	Very low	36.2	Very low	36 Å²	36	113 Å²	113	25%	0.252	65%	0.646	S	S	.	*			trans	-68	148.2	175.5	72.9	0	0	0	0	110.4	I602 Y606	I602-S604 PolarHBondContact O-N 3.07Å; S604-Y606 PolarHBondContact O-N 3.08Å
605	M	35.3	Very low	36.3	Very low	180 Å²	180	112.6 Å²	112.6	89%	0.887	64%	0.643	S	S	*	*	S	Bend	trans	-81	23.6	-174.7	-68.6	-142	-175.7	0	0	114.7	P607	M605-P607 WeakPolarHBondContact O-CD 3.4Å
606	Y	34.8	Very low	36.2	Very low	82 Å²	82	112.8 Å²	112.8	32%	0.322	65%	0.645	S	S	.	*			trans	-79.9	118.3	175.1	-79.3	-91.4	0	0	0	110.5	E252 L253 H257 S604	E252-Y606 PolarHBondContact OE2-OH 3.19Å; E252-Y606 VanDerWaalsContact OE2-OH 3.14Å; L253-Y606 HydrophobicContact CD1-CE2 4.11Å; H257-Y606 PolarHBondContact CD2-OH 2.91Å; S604-Y606 PolarHBondContact O-N 3.08Å
607	P	33.6	Very low	36.2	Very low	89 Å²	89	113.3 Å²	113.3	58%	0.578	64%	0.642	S	S	*	*			trans	-86.3	115.2	-177.6	32.3	-31.6	0	0	0	111.7	M605 T609	M605-P607 WeakPolarHBondContact O-CD 3.4Å; P607-T609 PolarHBondContact O-N 3.14Å
608	N	30.2	Very low	35.9	Very low	115 Å²	115	117.8 Å²	117.8	62%	0.615	65%	0.648	S	S	*	*			trans	-37.2	126	-175.2	-64.9	12.5	0	0	0	115	R574 Q610	R574-N608 PolarHBondContact NH2-O 3.35Å; R574-N608 VanDerWaalsContact NH2-O 3.16Å; N608-Q610 PolarHBondContact O-N 3.05Å; N608-Q610 VanDerWaalsContact O-N 3.11Å
609	T	31.8	Very low	35.5	Very low	102 Å²	102	117.7 Å²	117.7	63%	0.626	66%	0.663	S	S	*	*			trans	-77	87.7	174.5	32.1	0	0	0	0	110.4	P607 G611	P607-T609 PolarHBondContact O-N 3.14Å; T609-G611 VanDerWaalsContact C-N 3.31Å; T609-G611 PolarHBondContact O-N 3.44Å
610	Q	27.9	Very low	34.5	Very low	152 Å²	152	115.2 Å²	115.2	71%	0.71	66%	0.66	S	S	*	*			trans	-64.1	91.4	165.2	-73.5	176.8	-47.8	0	0	110	N608	N608-Q610 PolarHBondContact O-N 3.05Å; N608-Q610 VanDerWaalsContact O-N 3.11Å
611	G	30.3	Very low	33.3	Very low	70 Å²	70	117 Å²	117	72%	0.722	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-73.1	140.1	165.6	0	0	0	0	0	110.6	T609	T609-G611 VanDerWaalsContact C-N 3.31Å; T609-G611 PolarHBondContact O-N 3.44Å
612	V	26.8	Very low	32.2	Very low	111 Å²	111	123 Å²	123	67%	0.673	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-91.1	117.4	168.6	178.6	0	0	0	0	107	F614	V612-F614 HydrophobicContact CG1-CD2 4Å; V612-F614 HydrophobicContact CG1-CE2 3.82Å
613	A	26.5	Very low	30.8	Very low	100 Å²	100	128.2 Å²	128.2	83%	0.826	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-67.8	134.6	173.5	0	0	0	0	0	110.1
614	F	28.6	Very low	30.2	Very low	173 Å²	173	130.1 Å²	130.1	76%	0.759	73%	0.73	S	S	*	*			trans	-125.2	121.1	170.4	-99.4	-82.6	0	0	0	110	V612	V612-F614 HydrophobicContact CG1-CD2 4Å; V612-F614 HydrophobicContact CG1-CE2 3.82Å
615	S	27.6	Very low	30	Very low	103 Å²	103	133.6 Å²	133.6	72%	0.72	75%	0.749	S	S	*	*			trans	-77	118.8	172.9	53.2	0	0	0	0	110.4	Q617	S615-Q617 PolarHBondContact O-N 2.93Å
616	A	28.3	Very low	29.7	Very low	101 Å²	101	134 Å²	134	84%	0.835	75%	0.748	S	S	*	*			trans	-72.6	95.5	169.9	0	0	0	0	0	110.2	R618	A616-R618 PolarHBondContact O-N 3.48Å
617	Q	28.7	Very low	29.4	Very low	180 Å²	180	133.4 Å²	133.4	84%	0.841	77%	0.767	S	S	*	*			trans	-66.4	128.1	166.6	-76.6	-174	-52.7	0	0	109.4	S615	S615-Q617 PolarHBondContact O-N 2.93Å
618	R	24.6	Very low	29.2	Very low	246 Å²	246	138.6 Å²	138.6	93%	0.928	78%	0.781	S	S	*	*			trans	-74.6	123.7	171.7	-68.1	178.1	176.3	174.4	-2	109.5	A616	A616-R618 PolarHBondContact O-N 3.48Å
619	T	31	Very low	29.1	Very low	136 Å²	136	137.6 Å²	137.6	83%	0.834	78%	0.783	S	S	*	*			trans	-111.8	113.9	155.8	53.4	0	0	0	0	108.8
620	S	26.5	Very low	29.1	Very low	122 Å²	122	139.3 Å²	139.3	85%	0.853	79%	0.789	S	S	*	*			trans	-87.6	128.3	-179.2	51.3	0	0	0	0	111.8
621	S	31.7	Very low	29.1	Very low	117 Å²	117	138.8 Å²	138.8	82%	0.818	79%	0.789	S	S	*	*			trans	-139.3	109.3	160.5	57.3	0	0	0	0	109.1
622	Q	29.6	Very low	29	Very low	178 Å²	178	145.1 Å²	145.1	83%	0.832	80%	0.797	S	S	*	*			trans	-70.2	143.3	170.1	-65.7	170.5	-59.8	0	0	109.5
623	N	33.2	Very low	28.9	Very low	173 Å²	173	144.7 Å²	144.7	93%	0.925	80%	0.798	S	S	*	*			trans	-155.6	162.1	136.9	-101.9	-34.7	0	0	0	109.7
624	H	29.9	Very low	29	Very low	166 Å²	166	148.6 Å²	148.6	77%	0.769	80%	0.796	S	S	*	*			trans	-135.4	164.6	-146.2	-143.6	-73.6	0	0	0	112.2
625	V	32.2	Very low	28.8	Very low	109 Å²	109	145 Å²	145	66%	0.661	79%	0.793	S	S	*	*			trans	81.2	102.3	161.3	-176.3	0	0	0	0	118.9
626	H	30	Very low	28.9	Very low	188 Å²	188	151.5 Å²	151.5	87%	0.87	80%	0.803	S	S	*	*			trans	56.1	139	133.6	-63	11.7	0	0	0	122.7
627	G	28.3	Very low	29	Very low	70 Å²	70	153.5 Å²	153.5	72%	0.722	80%	0.795	S	S	*	*				155.7	90.2	129.9	0	0	0	0	0	120.2
628	K	30.2	Very low	29	Very low	199 Å²	199	153.1 Å²	153.1	87%	0.865	79%	0.79	S	S	*	*			trans	50.6	103.9	145.3	-61.3	-178.8	179.1	180	0	120.8
629	S	28.3	Very low	29.5	Very low	94 Å²	94	146.7 Å²	146.7	66%	0.657	78%	0.781	S	S	*	*				20.2	122.1	124.3	59.8	0	0	0	0	120.7
630	N	30.7	Very low	29.6	Very low	138 Å²	138	149.4 Å²	149.4	74%	0.738	78%	0.783	S	S	*	*				-179.2	134.8	104.9	-94.4	-13.4	0	0	0	115.5
631	I	28.2	Very low	29.6	Very low	140 Å²	140	152.6 Å²	152.6	72%	0.718	79%	0.785	S	S	*	*			trans	26.2	112	130.5	-42.9	168.1	0	0	0	118.2
632	F	28.3	Very low	29.5	Very low	204 Å²	204	153.1 Å²	153.1	90%	0.895	79%	0.789	S	S	*	*				-160	174.3	113.9	-132.8	-100	0	0	0	113
633	C	25.2	Very low	29.4	Very low	101 Å²	101	149.3 Å²	149.3	68%	0.682	79%	0.787	S	S	*	*			trans	-132.5	168.1	-163.1	-172.3	0	0	0	0	113
634	K	27.4	Very low	29.2	Very low	182 Å²	182	149.4 Å²	149.4	79%	0.791	79%	0.787	S	S	*	*			trans	88.1	113.2	165	-60.8	-170.9	174.2	-178.4	0	119.8
635	S	25.3	Very low	29	Very low	99 Å²	99	148.6 Å²	148.6	69%	0.692	79%	0.787	S	S	*	*			trans	55.1	131.8	130.9	65.7	0	0	0	0	121.9
636	Y	30.1	Very low	28.9	Very low	239 Å²	239	149.6 Å²	149.6	94%	0.937	80%	0.798	S	S	*	*				-153.6	165.1	124	-111.9	-73.4	0	0	0	111.6
637	E	30.5	Very low	28.6	Very low	142 Å²	142	149.6 Å²	149.6	66%	0.664	80%	0.796	S	S	*	*			trans	-101.3	152.3	-168.5	-69	-167.1	89.3	0	0	116
638	K	28.8	Very low	28.9	Very low	172 Å²	172	152.2 Å²	152.2	75%	0.748	80%	0.8	S	S	*	*			trans	71.7	158.1	142.6	-79.1	163.4	-178.1	148.7	0	119.9
639	P	34.5	Very low	28.9	Very low	111 Å²	111	149.6 Å²	149.6	72%	0.721	80%	0.801	S	S	*	*			trans	-113.3	169.4	-157.9	41.8	-32.6	0	0	0	114.3
640	H	32.2	Very low	29	Very low	193 Å²	193	150.6 Å²	150.6	89%	0.894	81%	0.808	S	S	*	*			trans	-127.9	138.8	163.8	-97.2	-93.3	0	0	0	112.2
641	Q	26.1	Very low	29	Very low	190 Å²	190	151 Å²	151	89%	0.888	82%	0.815	S	S	*	*			trans	-86.7	137	164	-65.8	176	-14.3	0	0	109.6
642	S	31	Very low	29	Very low	128 Å²	128	147.4 Å²	147.4	90%	0.895	81%	0.813	S	S	*	*			trans	-157.2	145.1	148.9	55.5	0	0	0	0	109.3
643	A	26.1	Very low	29.1	Very low	97 Å²	97	143.9 Å²	143.9	80%	0.802	81%	0.814	S	S	*	*			trans	-123.7	146	-179.3	0	0	0	0	0	110
644	L	30.3	Very low	29.2	Very low	176 Å²	176	148.2 Å²	148.2	92%	0.921	82%	0.824	S	S	*	*			trans	-137	148.8	162.6	-88	176.2	0	0	0	110.3
645	L	25.7	Very low	29.4	Very low	148 Å²	148	146.7 Å²	146.7	78%	0.775	83%	0.829	S	S	*	*			trans	-93.4	160.9	-171.8	-60.2	96.6	0	0	0	112.2
646	C	29.3	Very low	29.8	Very low	130 Å²	130	147.6 Å²	147.6	88%	0.878	84%	0.836	S	S	*	*			trans	-159.2	134.4	130.3	-120.1	0	0	0	0	112.2
647	F	24.2	Very low	29.7	Very low	189 Å²	189	147.7 Å²	147.7	83%	0.829	83%	0.834	S	S	*	*			trans	-124	155.4	169.9	-87.4	-83.7	0	0	0	108.8
648	P	33.8	Very low	29.9	Very low	125 Å²	125	147 Å²	147	81%	0.812	84%	0.843	S	S	*	*			trans	-116.3	164.2	146.4	20.5	-2.8	0	0	0	112.3
649	T	31.7	Very low	30.1	Very low	143 Å²	143	144 Å²	144	88%	0.877	84%	0.843	S	S	*	*			trans	-101.4	172.3	-159.9	43.2	0	0	0	0	115.3
650	S	28.7	Very low	30.1	Very low	115 Å²	115	145.9 Å²	145.9	80%	0.804	85%	0.847	S	S	*	*			trans	-82.9	155.3	-178.5	54	0	0	0	0	114.3
651	V	32.5	Very low	30.1	Very low	146 Å²	146	141.2 Å²	141.2	89%	0.885	84%	0.836	S	S	*	*			trans	-108.5	141.6	160	-170.1	0	0	0	0	108.1
652	G	27.2	Very low	30.4	Very low	66 Å²	66	135.9 Å²	135.9	68%	0.68	83%	0.832	S	S	*	*			trans	-132.9	162.1	177.8	0	0	0	0	0	112.1
653	S	30.8	Very low	30.4	Very low	130 Å²	130	134.8 Å²	134.8	91%	0.909	82%	0.824	S	S	*	*			trans	-144.7	142.8	174.2	-68.9	0	0	0	0	110.5
654	Q	27.3	Very low	30.7	Very low	192 Å²	192	136.9 Å²	136.9	90%	0.897	82%	0.822	S	S	*	*			trans	-101.4	149.1	-176.8	-55.9	177.5	3.5	0	0	111.3
655	V	31.6	Very low	30.8	Very low	150 Å²	150	133 Å²	133	91%	0.909	81%	0.81	S	S	*	*			trans	-142.4	147.8	147.9	-174.8	0	0	0	0	108.3
656	S	32.9	Very low	31.1	Very low	118 Å²	118	135.3 Å²	135.3	83%	0.825	81%	0.814	S	S	*	*			trans	-99.9	175.6	-164.9	40.4	0	0	0	0	115.4
657	R	27.9	Very low	31.3	Very low	240 Å²	240	133.5 Å²	133.5	91%	0.906	80%	0.803	S	S	*	*			trans	-121.4	156.5	176.7	-70.8	-176.2	178.1	177.7	1.2	112
658	P	35.8	Very low	31.8	Very low	129 Å²	129	134.8 Å²	134.8	84%	0.838	80%	0.802	S	S	*	*			trans	-120.3	177.2	148.9	0.4	22.5	0	0	0	115.6
659	S	33.4	Very low	31.7	Very low	108 Å²	108	136.1 Å²	136.1	76%	0.755	80%	0.802	S	S	*	*			trans	-80	-171.6	179.2	-14	0	0	0	0	113
660	N	32.8	Very low	31.8	Very low	150 Å²	150	134.7 Å²	134.7	80%	0.802	80%	0.797	S	S	*	*			cis	-163.1	-178.7	7.2	-122.5	8.8	0	0	0	107.3
661	S	33.4	Very low	31.9	Very low	96 Å²	96	138.6 Å²	138.6	67%	0.671	80%	0.803	S	S	*	*			cis	-174.5	143.4	-29.3	47.4	0	0	0	0	110.6
662	G	31.7	Very low	32	Very low	78 Å²	78	135.9 Å²	135.9	80%	0.804	80%	0.796	S	S	*	*			trans	79.9	169	171	0	0	0	0	0	116.1
663	S	31	Very low	32.3	Very low	104 Å²	104	142 Å²	142	73%	0.727	81%	0.807	S	S	*	*			cis	-164.4	169.9	-18.9	57.4	0	0	0	0	111.4
664	N	33.3	Very low	32.3	Very low	141 Å²	141	145.6 Å²	145.6	75%	0.754	81%	0.806	S	S	*	*			trans	77.3	118.4	159.6	-63.4	-9.5	0	0	0	122.7
665	S	31	Very low	32.7	Very low	95 Å²	95	147.4 Å²	147.4	66%	0.664	81%	0.805	S	S	*	*			trans	43.7	130.3	134.8	65.2	0	0	0	0	122.6
666	F	32.5	Very low	33	Very low	197 Å²	197	147.8 Å²	147.8	86%	0.864	80%	0.796	S	S	*	*				-162	174.7	90.8	-116.8	-85.9	0	0	0	111.7
667	S	33.3	Very low	33.2	Very low	92 Å²	92	145.8 Å²	145.8	64%	0.643	79%	0.787	S	S	*	*			trans	-135.5	159.1	-170.5	61.6	0	0	0	0	112.9
668	R	35.4	Very low	33.6	Very low	216 Å²	216	140.9 Å²	140.9	82%	0.815	78%	0.784	S	S	*	*			trans	162.7	139.3	131	-91.3	167.5	-178.3	-158.7	-0.4	115.2
669	L	31.6	Very low	33.6	Very low	153 Å²	153	139.7 Å²	139.7	80%	0.801	78%	0.784	S	S	*	*			trans	63.1	152.7	138.4	-62.9	169.8	0	0	0	119.8
670	S	33.6	Very low	33.9	Very low	113 Å²	113	140 Å²	140	79%	0.79	79%	0.786	S	S	*	*			cis	-151.8	165.3	-2.8	33.4	0	0	0	0	112.1
671	Q	31.6	Very low	34.2	Very low	196 Å²	196	143.7 Å²	143.7	92%	0.916	79%	0.789	S	S	*	*			trans	-99	150.2	179.6	-56.3	162.1	-56.8	0	0	113
672	A	33.5	Very low	34.4	Very low	90 Å²	90	149.7 Å²	149.7	74%	0.744	80%	0.797	S	S	*	*			trans	-173.3	154	146.8	0	0	0	0	0	109.5
673	Q	33.2	Very low	34.7	Very low	195 Å²	195	150.9 Å²	150.9	91%	0.911	79%	0.793	S	S	*	*			cis	-158.3	166.1	-23.9	-112.6	170.9	-10.8	0	0	107.2
674	K	32.4	Very low	35.2	Very low	205 Å²	205	159.5 Å²	159.5	89%	0.891	82%	0.818	S	S	*	*			trans	-149.8	119.7	-174.9	-148.6	-176.9	-170.3	-175.5	0	113.3
675	R	35.7	Very low	35.3	Very low	229 Å²	229	160.5 Å²	160.5	86%	0.864	82%	0.821	S	S	*	*			trans	173.1	155.8	175.9	-100.7	160.9	-160.7	-154.6	4	106.9
676	H	36.1	Very low	35.5	Very low	159 Å²	159	163.9 Å²	163.9	74%	0.736	83%	0.829	S	S	*	*			cis	-129	154.7	-0.2	-96	-84.9	0	0	0	108.2
677	A	37.4	Very low	35.7	Very low	75 Å²	75	162.1 Å²	162.1	62%	0.62	83%	0.827	S	S	*	*				57.5	140.6	81.4	0	0	0	0	0	115.4
678	T	36.2	Very low	35.8	Very low	138 Å²	138	166.2 Å²	166.2	85%	0.847	84%	0.838	S	S	*	*			cis	-172.8	148.7	-12.8	14.7	0	0	0	0	110.4
679	A	36.8	Very low	35.8	Very low	103 Å²	103	163.1 Å²	163.1	85%	0.851	84%	0.84	S	S	*	*			trans	54.3	117.3	148.4	0	0	0	0	0	124
680	S	38.6	Very low	36.1	Very low	114 Å²	114	163.7 Å²	163.7	80%	0.797	84%	0.842	S	S	*	*				-177.1	130.4	126.6	-166.3	0	0	0	0	107.8
681	R	39	Very low	36.3	Very low	229 Å²	229	167.4 Å²	167.4	86%	0.864	85%	0.846	S	S	*	*			cis	94.2	124.9	35.1	-148.3	-175.7	-163.2	-169	5.8	113.5
682	R	38.7	Very low	36.7	Very low	221 Å²	221	165.2 Å²	165.2	83%	0.834	84%	0.84	S	S	*	*			trans	78.6	100.3	170.3	-77.7	-178.3	169.2	168.6	-4.7	120.6
683	S	37.6	Very low	36.9	Very low	104 Å²	104	171.4 Å²	171.4	73%	0.727	85%	0.849	S	S	*	*				36.1	115.4	121.4	62.2	0	0	0	0	120.2
684	K	41.4	Very low	37.3	Very low	285 Å²	285	169.3 Å²	169.3	100%	1.239	84%	0.843	S	S	*	*				-129	0	103.6	-120.1	-178.4	-179.8	-175.4	0	109.5

Retrieved 684 of 684 residues in 1341.9 ms (Link to these results)

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