A0A5K4FBQ7_SCHMA Loading...

CBM21 domain-containing protein AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4FBQ7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 764 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	36.3	Very low	32.4	Very low	227 Å²	227	167.1 Å²	167.1	100%	1.118	83%	0.825	S	S	*	*				0	105	0	-71.7	162.9	171.8	0	0	106.3
2	N	31	Very low	32.1	Very low	148 Å²	148	165.7 Å²	165.7	79%	0.791	82%	0.823	S	S	*	*				84.5	133.9	56.9	-66.4	24.5	0	0	0	111.2
3	N	28.3	Very low	31.9	Very low	129 Å²	129	163.6 Å²	163.6	69%	0.69	82%	0.815	S	S	*	*			cis	-167.1	170.7	-24	-149.1	-14.1	0	0	0	109.2
4	M	29.7	Very low	31.9	Very low	146 Å²	146	162.4 Å²	162.4	72%	0.719	81%	0.813	S	S	*	*			trans	67.4	133.4	163.8	-60.2	158.7	66.1	0	0	116.2
5	I	31	Very low	31.5	Very low	139 Å²	139	162.5 Å²	162.5	71%	0.713	81%	0.81	S	S	*	*			cis	81.4	103.6	20	-47.2	169.6	0	0	0	115.7
6	K	34.3	Very low	31.3	Very low	191 Å²	191	167.9 Å²	167.9	83%	0.83	82%	0.821	S	S	*	*			trans	-174	119.3	136.8	-96.4	163.7	-176.4	-172.7	0	105.5
7	K	30.2	Very low	30.9	Very low	180 Å²	180	163.4 Å²	163.4	78%	0.783	81%	0.809	S	S	*	*			cis	64	113.5	39.8	-110.1	-172.9	-173.6	178.8	0	113.5
8	D	34.8	Very low	30.7	Very low	166 Å²	166	163.6 Å²	163.6	89%	0.888	81%	0.813	S	S	*	*				-154.9	-175.7	124.5	-92.8	-35.4	0	0	0	110.9
9	K	31.2	Very low	30.5	Very low	195 Å²	195	162.1 Å²	162.1	85%	0.848	81%	0.808	S	S	*	*			trans	-124.7	168.7	-144.1	-104.4	-168.8	169.3	-170.1	0	117
10	P	36.7	Very low	30.3	Very low	115 Å²	115	161.5 Å²	161.5	75%	0.747	81%	0.808	S	S	*	*			trans	-107.2	175.8	-177.8	42.4	-35.3	0	0	0	114.8
11	E	33.3	Very low	30.1	Very low	202 Å²	202	160.5 Å²	160.5	94%	0.944	81%	0.805	S	S	*	*			trans	-131.6	-177.7	165.3	-102.7	172.2	-163	0	0	112.6
12	N	28	Very low	30	Very low	150 Å²	150	155.1 Å²	155.1	80%	0.802	78%	0.777	S	S	*	*			trans	-139.7	-162.5	-142	-160.5	5.3	0	0	0	114.6
13	L	30.4	Very low	30	Very low	139 Å²	139	153.3 Å²	153.3	73%	0.728	77%	0.768	S	S	*	*			trans	91.8	137.9	-176.9	-70.8	71.9	0	0	0	113.6
14	D	31.8	Very low	30.2	Very low	147 Å²	147	155.7 Å²	155.7	79%	0.786	77%	0.774	S	S	*	*			cis	-146.1	166.9	4.8	-121.9	-23.6	0	0	0	114
15	Q	25.4	Very low	30.3	Very low	164 Å²	164	158 Å²	158	77%	0.766	78%	0.775	S	S	*	*			trans	-107.1	147.3	-174.1	-65.9	-179.7	-32.8	0	0	114.4
16	Y	28.6	Very low	30.1	Very low	249 Å²	249	158.3 Å²	158.3	98%	0.976	78%	0.778	S	S	*	*			trans	-134.7	128.2	144.9	-90.3	-76.2	0	0	0	109.9
17	S	23.7	Very low	30	Very low	90 Å²	90	157 Å²	157	63%	0.629	78%	0.775	S	S	*	*			trans	-127.1	144.6	-163.1	55.4	0	0	0	0	113
18	L	27.8	Very low	30	Very low	168 Å²	168	151.4 Å²	151.4	88%	0.88	77%	0.768	S	S	*	*			trans	-151.5	76.1	165.8	-114.7	168.9	0	0	0	112.4
19	N	26.4	Very low	30	Very low	134 Å²	134	151.6 Å²	151.6	72%	0.717	77%	0.769	S	S	*	*			trans	29.6	97.5	157.8	-59.1	-2.5	0	0	0	119.5
20	D	27.5	Very low	30.2	Very low	150 Å²	150	149.9 Å²	149.9	80%	0.802	76%	0.758	S	S	*	*			trans	-76.9	127.6	150.3	-97.3	-41.7	0	0	0	109.7
21	N	26.6	Very low	30.1	Very low	141 Å²	141	147.8 Å²	147.8	75%	0.754	75%	0.747	S	S	*	*			trans	-137.7	94.7	170.6	-100	-23.5	0	0	0	108.9
22	H	32.5	Very low	30.4	Very low	114 Å²	114	143.7 Å²	143.7	53%	0.528	72%	0.724	S	S	.	*			trans	-148.2	129.2	172.2	-92.4	-63.2	0	0	0	112.3	Q24 N36	H22-Q24 PolarHBondContact O-N 3.48Å; H22-N36 PolarHBondContact NE2-ND2 3.19Å; H22-N36 VanDerWaalsContact NE2-ND2 3.18Å
23	D	32.5	Very low	30.9	Very low	110 Å²	110	141.1 Å²	141.1	59%	0.588	71%	0.705	S	S	*	*			trans	-59	124.3	-178.5	-64	-11.8	0	0	0	113.1	R25	D23-R25 HydrophobicContact CB-CG 3.86Å; D23-R25 PolarHBondContact O-N 2.97Å; D23-R25 IonicContact OD2-CZ 3.95Å; D23-R25 VanDerWaalsContact OD2-CZ 3.28Å; D23-R25 IonicContact OD2-NE 3.6Å; D23-R25 PolarHBondContact OD2-NE 3Å; D23-R25 IonicContact OD2-NH2 2.93Å; D23-R25 PolarHBondContact OD2-NH2 3.15Å
24	Q	32.6	Very low	31.3	Very low	179 Å²	179	136.8 Å²	136.8	84%	0.836	68%	0.684	S	S	*	*			trans	-80.2	98.3	158.7	-71.3	-173.7	-4.7	0	0	109.7	H22	H22-Q24 PolarHBondContact O-N 3.48Å
25	R	30.4	Very low	31.8	Very low	194 Å²	194	133.1 Å²	133.1	73%	0.732	66%	0.664	S	S	*	*			trans	-96.3	100.1	174.8	-60.7	-170.4	-175.1	-168.3	1.3	110.5	D23 H27	D23-R25 HydrophobicContact CB-CG 3.86Å; D23-R25 PolarHBondContact O-N 2.97Å; D23-R25 IonicContact OD2-CZ 3.95Å; D23-R25 VanDerWaalsContact OD2-CZ 3.28Å; D23-R25 IonicContact OD2-NE 3.6Å; D23-R25 PolarHBondContact OD2-NE 3Å; D23-R25 IonicContact OD2-NH2 2.93Å; D23-R25 PolarHBondContact OD2-NH2 3.15Å; R25-H27 PolarHBondContact O-N 2.93Å
26	N	28.6	Very low	32.5	Very low	146 Å²	146	128.7 Å²	128.7	78%	0.781	65%	0.646	S	S	*	*			trans	-73.5	110.3	178.7	-74.7	-24.6	0	0	0	111.7
27	H	30.4	Very low	33	Very low	164 Å²	164	118.4 Å²	118.4	76%	0.759	61%	0.61	S	S	*	*			trans	-133	117.5	163.1	-77.1	-64.4	0	0	0	110.1	R25	R25-H27 PolarHBondContact O-N 2.93Å
28	G	30.6	Very low	33.4	Very low	62 Å²	62	119.1 Å²	119.1	64%	0.639	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	55.3	84.6	160.9	0	0	0	0	0	117.6	Y30	G28-Y30 WeakPolarHBondContact O-CD2 3.06Å; G28-Y30 PolarHBondContact O-N 2.92Å
29	N	35.6	Very low	33.9	Very low	170 Å²	170	114.6 Å²	114.6	91%	0.909	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	57.8	-5.2	160.4	-65.9	4.1	0	0	0	119.8
30	Y	34	Very low	34.2	Very low	159 Å²	159	111.3 Å²	111.3	62%	0.624	57%	0.568	S	S	*	*			trans	-122.8	121.1	178.5	-64.9	-81.9	0	0	0	111.7	G28 Y32	G28-Y30 WeakPolarHBondContact O-CD2 3.06Å; G28-Y30 PolarHBondContact O-N 2.92Å; Y30-Y32 VanDerWaalsContact CB-CE2 3.49Å; Y30-Y32 WeakPolarHBondContact O-CD2 3.44Å; Y30-Y32 WeakPolarHBondContact O-CE2 3.34Å
31	S	36.2	Very low	34.3	Very low	72 Å²	72	115.2 Å²	115.2	50%	0.503	57%	0.571	S	S	.	*			trans	-86.7	123.4	171.5	52.5	0	0	0	0	110.5	I52	S31-I52 WeakPolarHBondContact O-CB 3.4Å; S31-I52 WeakPolarHBondContact O-CG1 3.47Å; S31-I52 PolarHBondContact O-N 2.96Å
32	Y	38.6	Very low	34.5	Very low	116 Å²	116	116.2 Å²	116.2	46%	0.455	57%	0.571	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-111.4	150.1	177.4	-62.1	-90.3	0	0	0	111	Y30 I50 P51	Y30-Y32 VanDerWaalsContact CB-CE2 3.49Å; Y30-Y32 WeakPolarHBondContact O-CD2 3.44Å; Y30-Y32 WeakPolarHBondContact O-CE2 3.34Å; Y32-I50 CarbonylContact C-O 3.55Å; Y32-I50 WeakPolarHBondContact CA-O 3.47Å; Y32-P51 HydrophobicContact CD1-CB 4.48Å; Y32-P51 HydrophobicContact CD1-CG 4.32Å; Y32-P51 HydrophobicContact CE1-CB 4.39Å; Y32-P51 HydrophobicContact CE1-CG 4.08Å
33	K	38.1	Very low	34.7	Very low	95 Å²	95	116.5 Å²	116.5	41%	0.413	57%	0.572	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-112.4	125.6	166.4	-169.3	169.2	-175.9	174.3	0	110.2	I50 I52	K33-I50 PolarHBondContact N-O 2.7Å; K33-I50 PolarHBondContact O-N 3.24Å; K33-I52 HydrophobicContact CB-CD1 3.92Å; K33-I52 HydrophobicContact CB-CG1 3.98Å
34	T	40.1	Very low	34.5	Very low	48 Å²	48	112.8 Å²	112.8	29%	0.294	56%	0.56	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-78	137.8	169	19.9	0	0	0	0	111.1	T47 E48 M49	T34-T47 HydrophobicContact CG2-CG2 3.75Å; T34-E48 CarbonylContact C-O 3.52Å; T34-E48 VanDerWaalsContact CA-O 3.31Å; T34-E48 WeakPolarHBondContact CA-O 3.33Å; T34-M49 HydrophobicContact CG2-CG 3.98Å
35	I	42.7	Very low	34.6	Very low	71 Å²	71	112.9 Å²	112.9	36%	0.364	55%	0.553	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-129.7	133.3	171.9	-56.8	-172.7	0	0	0	108.6	T47 E48 I50	I35-T47 WeakPolarHBondContact O-CA 3.35Å; I35-E48 PolarHBondContact N-O 2.85Å; I35-E48 PolarHBondContact O-N 2.9Å; I35-I50 HydrophobicContact CD1-CD1 3.69Å; I35-I50 HydrophobicContact CG1-CD1 4.44Å
36	N	38.4	Very low	34.9	Very low	71 Å²	71	107.8 Å²	107.8	38%	0.38	53%	0.534	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	118.6	173.3	-68.8	-29.5	0	0	0	110	H22 W45 Y46 T47	H22-N36 PolarHBondContact NE2-ND2 3.19Å; H22-N36 VanDerWaalsContact NE2-ND2 3.18Å; N36-W45 HydrophobicContact CB-CE3 4.27Å; N36-Y46 WeakPolarHBondContact CA-O 3.24Å; N36-T47 WeakPolarHBondContact OD1-CB 3.49Å; N36-T47 WeakPolarHBondContact OD1-CG2 3.35Å; N36-T47 PolarHBondContact OD1-OG1 3Å
37	C	38.9	Very low	35.4	Very low	32 Å²	32	104.7 Å²	104.7	22%	0.216	52%	0.521	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	124.1	-176.9	-70.8	0	0	0	0	110.6	W45 Y46	C37-W45 WeakPolarHBondContact O-CA 3.5Å; C37-Y46 HydrophobicContact CB-CD1 3.82Å; C37-Y46 HydrophobicContact CB-CD2 4.32Å; C37-Y46 HydrophobicContact CB-CE1 3.34Å; C37-Y46 HydrophobicContact CB-CE2 3.9Å; C37-Y46 HydrophobicContact CB-CG 4.29Å; C37-Y46 PolarHBondContact N-O 3.27Å; C37-Y46 PolarHBondContact O-N 3.02Å
38	L	33.7	Very low	35.6	Very low	105 Å²	105	100.6 Å²	100.6	55%	0.55	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	124	171.4	-175.7	76.6	0	0	0	109.2	W45	L38-W45 HydrophobicContact CB-CE3 4.01Å; L38-W45 HydrophobicContact CB-CH2 4.32Å; L38-W45 HydrophobicContact CB-CZ3 3.9Å; L38-W45 HydrophobicContact CD1-CD2 3.95Å; L38-W45 HydrophobicContact CD1-CE3 4.26Å; L38-W45 HydrophobicContact CD1-CG 4.5Å; L38-W45 HydrophobicContact CD1-CH2 4.25Å; L38-W45 HydrophobicContact CD1-CZ2 3.92Å; L38-W45 HydrophobicContact CD1-CZ3 4.41Å
39	V	38.2	Very low	36	Very low	73 Å²	73	103.8 Å²	103.8	44%	0.442	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	-48.8	-178.9	-176.6	0	0	0	0	111.4	H43 G44 Y46	V39-H43 HydrophobicContact CB-CB 3.71Å; V39-H43 HydrophobicContact CG1-CB 3.6Å; V39-G44 PolarHBondContact N-O 3.09Å; V39-Y46 HydrophobicContact CG2-CD1 3.65Å; V39-Y46 HydrophobicContact CG2-CE1 3.95Å
40	D	32.5	Very low	36.3	Very low	65 Å²	65	97.4 Å²	97.4	35%	0.348	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-175.6	166.7	173.2	168.2	48.3	0	0	0	108.5	H42 H43 G44	D40-H42 PolarHBondContact O-N 3.12Å; D40-H42 WeakPolarHBondContact OD2-CB 3.47Å; D40-H42 IonicContact OD2-CD2 3.42Å; D40-H42 PolarHBondContact OD2-CD2 3.15Å; D40-H42 IonicContact OD2-CG 3.75Å; D40-H42 PolarHBondContact OD2-N 3.31Å; D40-H42 VanDerWaalsContact OD2-N 3.12Å; D40-H43 HydrophobicContact CB-CB 4.32Å; D40-H43 PolarHBondContact O-N 2.94Å; D40-H43 IonicContact OD2-ND1 3.55Å; D40-H43 PolarHBondContact OD2-ND1 3.36Å; D40-G44 PolarHBondContact O-N 2.69Å
41	R	29.3	Very low	36.6	Very low	233 Å²	233	93.3 Å²	93.3	88%	0.879	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49	-26.5	171.2	-69.9	-178	175.4	171	-0.2	114
42	H	31.7	Very low	36.8	Very low	162 Å²	162	92.8 Å²	92.8	75%	0.75	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102	-7.1	179.5	-62.2	-70.6	0	0	0	115.1	D40	D40-H42 PolarHBondContact O-N 3.12Å; D40-H42 WeakPolarHBondContact OD2-CB 3.47Å; D40-H42 IonicContact OD2-CD2 3.42Å; D40-H42 PolarHBondContact OD2-CD2 3.15Å; D40-H42 IonicContact OD2-CG 3.75Å; D40-H42 PolarHBondContact OD2-N 3.31Å; D40-H42 VanDerWaalsContact OD2-N 3.12Å
43	H	35.3	Very low	36.9	Very low	119 Å²	119	92.3 Å²	92.3	55%	0.551	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.1	-5.7	-167.4	-66.1	95.4	0	0	0	114.6	V39 D40	V39-H43 HydrophobicContact CB-CB 3.71Å; V39-H43 HydrophobicContact CG1-CB 3.6Å; D40-H43 HydrophobicContact CB-CB 4.32Å; D40-H43 PolarHBondContact O-N 2.94Å; D40-H43 IonicContact OD2-ND1 3.55Å; D40-H43 PolarHBondContact OD2-ND1 3.36Å
44	G	29.7	Very low	37	Very low	32 Å²	32	97.5 Å²	97.5	33%	0.33	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	77.6	-158.8	169.9	0	0	0	0	0	114.6	V39 D40	V39-G44 PolarHBondContact N-O 3.09Å; D40-G44 PolarHBondContact O-N 2.69Å
45	W	34.3	Very low	36.9	Very low	181 Å²	181	103.1 Å²	103.1	69%	0.686	50%	0.502	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.5	145.5	-176.2	-57.9	89.4	0	0	0	110.8	N36 C37 L38	N36-W45 HydrophobicContact CB-CE3 4.27Å; C37-W45 WeakPolarHBondContact O-CA 3.5Å; L38-W45 HydrophobicContact CB-CE3 4.01Å; L38-W45 HydrophobicContact CB-CH2 4.32Å; L38-W45 HydrophobicContact CB-CZ3 3.9Å; L38-W45 HydrophobicContact CD1-CD2 3.95Å; L38-W45 HydrophobicContact CD1-CE3 4.26Å; L38-W45 HydrophobicContact CD1-CG 4.5Å; L38-W45 HydrophobicContact CD1-CH2 4.25Å; L38-W45 HydrophobicContact CD1-CZ2 3.92Å; L38-W45 HydrophobicContact CD1-CZ3 4.41Å
46	Y	36.7	Very low	36.8	Very low	88 Å²	88	106.8 Å²	106.8	35%	0.345	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	158.6	159.9	74	-89.1	0	0	0	110.6	N36 C37 V39 E48	N36-Y46 WeakPolarHBondContact CA-O 3.24Å; C37-Y46 HydrophobicContact CB-CD1 3.82Å; C37-Y46 HydrophobicContact CB-CD2 4.32Å; C37-Y46 HydrophobicContact CB-CE1 3.34Å; C37-Y46 HydrophobicContact CB-CE2 3.9Å; C37-Y46 HydrophobicContact CB-CG 4.29Å; C37-Y46 PolarHBondContact N-O 3.27Å; C37-Y46 PolarHBondContact O-N 3.02Å; V39-Y46 HydrophobicContact CG2-CD1 3.65Å; V39-Y46 HydrophobicContact CG2-CE1 3.95Å; Y46-E48 HydrophobicContact CD2-CB 4.45Å; Y46-E48 HydrophobicContact CE2-CB 4.12Å
47	T	37.5	Very low	36.4	Very low	81 Å²	81	109.9 Å²	109.9	50%	0.497	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	130.4	179.6	-55.8	0	0	0	0	109.4	T34 I35 N36	T34-T47 HydrophobicContact CG2-CG2 3.75Å; I35-T47 WeakPolarHBondContact O-CA 3.35Å; N36-T47 WeakPolarHBondContact OD1-CB 3.49Å; N36-T47 WeakPolarHBondContact OD1-CG2 3.35Å; N36-T47 PolarHBondContact OD1-OG1 3Å
48	E	35	Very low	36.2	Very low	77 Å²	77	113 Å²	113	36%	0.36	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	140.5	-177.8	-171	164.6	-164	0	0	109.8	T34 I35 Y46 I50	T34-E48 CarbonylContact C-O 3.52Å; T34-E48 VanDerWaalsContact CA-O 3.31Å; T34-E48 WeakPolarHBondContact CA-O 3.33Å; I35-E48 PolarHBondContact N-O 2.85Å; I35-E48 PolarHBondContact O-N 2.9Å; Y46-E48 HydrophobicContact CD2-CB 4.45Å; Y46-E48 HydrophobicContact CE2-CB 4.12Å; E48-I50 HydrophobicContact CG-CG1 4.36Å
49	M	40.1	Very low	36.3	Very low	129 Å²	129	117.5 Å²	117.5	64%	0.635	55%	0.55	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-109.2	117.4	176.2	-59.7	-158.1	-47.6	0	0	109.9	T34	T34-M49 HydrophobicContact CG2-CG 3.98Å
50	I	41.1	Very low	36	Very low	36 Å²	36	122.1 Å²	122.1	19%	0.185	56%	0.561	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.4	129	-178.3	-54.6	-175	0	0	0	109.5	Y32 K33 I35 E48 I52	Y32-I50 CarbonylContact C-O 3.55Å; Y32-I50 WeakPolarHBondContact CA-O 3.47Å; K33-I50 PolarHBondContact N-O 2.7Å; K33-I50 PolarHBondContact O-N 3.24Å; I35-I50 HydrophobicContact CD1-CD1 3.69Å; I35-I50 HydrophobicContact CG1-CD1 4.44Å; E48-I50 HydrophobicContact CG-CG1 4.36Å; I50-I52 PolarHBondContact O-N 3.15Å
51	P	39.9	Very low	36.1	Very low	74 Å²	74	127.9 Å²	127.9	48%	0.481	58%	0.583	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-61.7	132.2	172	-19.5	31.3	0	0	0	111.4	Y32 D53	Y32-P51 HydrophobicContact CD1-CB 4.48Å; Y32-P51 HydrophobicContact CD1-CG 4.32Å; Y32-P51 HydrophobicContact CE1-CB 4.39Å; Y32-P51 HydrophobicContact CE1-CG 4.08Å; P51-D53 VanDerWaalsContact C-N 3.27Å; P51-D53 PolarHBondContact O-N 2.82Å; P51-D53 VanDerWaalsContact O-N 3.1Å
52	I	41.5	Very low	36.2	Very low	61 Å²	61	125 Å²	125	31%	0.313	58%	0.577	S	S	.	*			trans	-88.6	65.2	178.3	-47.8	173.9	0	0	0	109.7	S31 K33 I50 Y57	S31-I52 WeakPolarHBondContact O-CB 3.4Å; S31-I52 WeakPolarHBondContact O-CG1 3.47Å; S31-I52 PolarHBondContact O-N 2.96Å; K33-I52 HydrophobicContact CB-CD1 3.92Å; K33-I52 HydrophobicContact CB-CG1 3.98Å; I50-I52 PolarHBondContact O-N 3.15Å; I52-Y57 HydrophobicContact CG2-CD2 4.45Å; I52-Y57 HydrophobicContact CG2-CE2 4.15Å
53	D	41	Very low	36.1	Very low	106 Å²	106	124.6 Å²	124.6	57%	0.567	58%	0.575	S	S	*	*			trans	-81	127.4	168.8	-98.9	-47.3	0	0	0	111.1	P51 Q55 Y56	P51-D53 VanDerWaalsContact C-N 3.27Å; P51-D53 PolarHBondContact O-N 2.82Å; P51-D53 VanDerWaalsContact O-N 3.1Å; D53-Q55 PolarHBondContact O-N 3.27Å; D53-Y56 PolarHBondContact O-N 3.42Å
54	K	39.1	Very low	35.6	Very low	203 Å²	203	124.2 Å²	124.2	88%	0.883	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.6	-8.5	-166.6	-68.7	179.7	179	174.8	0	114.8
55	Q	39	Very low	35.4	Very low	166 Å²	166	128.8 Å²	128.8	78%	0.776	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	-22.7	-178.5	-67.2	180	-14	0	0	114.1	D53	D53-Q55 PolarHBondContact O-N 3.27Å
56	Y	38.8	Very low	35	Very low	149 Å²	149	125.4 Å²	125.4	58%	0.584	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.5	-7.2	-171	-70.9	-81.6	0	0	0	115.4	D53 P58 Y59	D53-Y56 PolarHBondContact O-N 3.42Å; Y56-P58 VanDerWaalsContact C-N 3.35Å; Y56-P58 VanDerWaalsContact O-N 3.16Å; Y56-Y59 PolarHBondContact O-N 2.79Å
57	Y	31.9	Very low	34.4	Very low	135 Å²	135	130.2 Å²	130.2	53%	0.529	63%	0.626	S	S	.	*	T	Hydrogen-bonded Turn	trans	-55.7	-29	-174.4	-138.5	-103.2	0	0	0	116.9	I52	I52-Y57 HydrophobicContact CG2-CD2 4.45Å; I52-Y57 HydrophobicContact CG2-CE2 4.15Å
58	P	33.4	Very low	33.8	Very low	97 Å²	97	132 Å²	132	63%	0.63	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68	-31.2	179.1	-24.3	35.6	0	0	0	115.3	Y56	Y56-P58 VanDerWaalsContact C-N 3.35Å; Y56-P58 VanDerWaalsContact O-N 3.16Å
59	Y	35.6	Very low	33.4	Very low	201 Å²	201	132.5 Å²	132.5	79%	0.788	64%	0.64	S	S	*	*	G	3₁₀ helix	trans	-78.3	-36.7	-168.8	-91.3	-89.7	0	0	0	113.7	Y56 K61	Y56-Y59 PolarHBondContact O-N 2.79Å; Y59-K61 PolarHBondContact O-N 2.74Å; Y59-K61 VanDerWaalsContact O-N 3.11Å
60	Y	32.9	Very low	32.6	Very low	169 Å²	169	133.6 Å²	133.6	66%	0.663	64%	0.644	S	S	*	*	G	3₁₀ helix	trans	-70	-7.4	-175.7	-73.5	-87.9	0	0	0	114.6
61	K	34.2	Very low	31.8	Very low	187 Å²	187	137 Å²	137	81%	0.813	67%	0.666	S	S	*	*	G	3₁₀ helix	trans	-91.1	6.8	-170.9	-146.4	178.2	-178.2	-178.2	0	115.2	Y59	Y59-K61 PolarHBondContact O-N 2.74Å; Y59-K61 VanDerWaalsContact O-N 3.11Å
62	K	32.1	Very low	31	Very low	171 Å²	171	139.3 Å²	139.3	74%	0.743	68%	0.675	S	S	*	*	S	Bend	trans	-121.5	-15.6	-170.9	-83.1	-172.1	173.4	-179	0	118.3
63	H	29.5	Very low	30.2	Very low	154 Å²	154	146.7 Å²	146.7	71%	0.713	70%	0.7	S	S	*	*			trans	-136.8	81.9	-175.3	-72.2	-67.7	0	0	0	114.5
64	P	23.7	Very low	29.4	Very low	111 Å²	111	146.9 Å²	146.9	72%	0.721	71%	0.705	S	S	*	*			trans	-63	159.6	148.9	31.6	-34.2	0	0	0	110.3
65	C	25.3	Very low	28.7	Very low	129 Å²	129	143.3 Å²	143.3	87%	0.872	70%	0.7	S	S	*	*			trans	71.7	49.1	171.5	-52.6	0	0	0	0	117.9
66	V	26.3	Very low	28	Very low	110 Å²	110	141.7 Å²	141.7	67%	0.667	70%	0.697	S	S	*	*			trans	-128.4	53.1	164.3	-161.7	0	0	0	0	112.4
67	Y	24.6	Very low	27.5	Very low	188 Å²	188	144.5 Å²	144.5	74%	0.737	71%	0.712	S	S	*	*			trans	-138.4	119.9	173.6	-70.8	-87.9	0	0	0	111.1
68	I	25.7	Very low	27.2	Very low	119 Å²	119	144.1 Å²	144.1	61%	0.61	72%	0.718	S	S	*	*			trans	-132.2	100.9	172.9	-64.2	-175.9	0	0	0	110.8	N316	I68-N316 WeakPolarHBondContact CG2-ND2 3.22Å
69	V	25.7	Very low	26.9	Very low	88 Å²	88	146.2 Å²	146.2	53%	0.533	72%	0.723	S	S	.	*			trans	29	108.8	148.7	-169.1	0	0	0	0	118.6	T71	V69-T71 HydrophobicContact CG1-CG2 4.1Å
70	Q	23.4	Very low	26.5	Very low	152 Å²	152	144.2 Å²	144.2	71%	0.71	73%	0.727	S	S	*	*			trans	-79.9	108.3	163.5	179	-179.4	-0.8	0	0	111.1	N72	Q70-N72 PolarHBondContact O-N 2.86Å
71	T	24.4	Very low	26.3	Very low	107 Å²	107	140.8 Å²	140.8	66%	0.656	73%	0.725	S	S	*	*			trans	-87	99.3	178.7	56.2	0	0	0	0	112.6	V69 Y73	V69-T71 HydrophobicContact CG1-CG2 4.1Å; T71-Y73 PolarHBondContact O-N 3.24Å
72	N	23.6	Very low	25.9	Very low	123 Å²	123	139 Å²	139	66%	0.658	72%	0.723	S	S	*	*			trans	-76.4	113.3	176.1	-74.1	-27.8	0	0	0	112.3	Q70 V74	Q70-N72 PolarHBondContact O-N 2.86Å; N72-V74 PolarHBondContact O-N 2.9Å
73	Y	23.9	Very low	25.6	Very low	216 Å²	216	137.5 Å²	137.5	85%	0.847	72%	0.723	S	S	*	*			trans	-84.9	93	170.6	-85.8	-87.4	0	0	0	111.4	T71	T71-Y73 PolarHBondContact O-N 3.24Å
74	V	24	Very low	25.5	Very low	110 Å²	110	138.6 Å²	138.6	67%	0.667	73%	0.725	S	S	*	*			trans	-103	102.6	168.9	-178.3	0	0	0	0	109.5	N72 N76	N72-V74 PolarHBondContact O-N 2.9Å; V74-N76 PolarHBondContact O-N 2.8Å; V74-N76 VanDerWaalsContact O-N 3.12Å
75	T	25.8	Very low	25.5	Very low	127 Å²	127	138.6 Å²	138.6	78%	0.779	73%	0.728	S	S	*	*			trans	-82.9	83.8	176.3	55.3	0	0	0	0	111.1	K77	T75-K77 PolarHBondContact O-N 2.72Å; T75-K77 VanDerWaalsContact O-N 3.11Å
76	N	24.3	Very low	25.7	Very low	133 Å²	133	141.2 Å²	141.2	71%	0.711	73%	0.73	S	S	*	*			trans	-61.8	110.7	172.3	-81.7	-14.2	0	0	0	111.1	V74	V74-N76 PolarHBondContact O-N 2.8Å; V74-N76 VanDerWaalsContact O-N 3.12Å
77	K	26.9	Very low	25.6	Very low	208 Å²	208	144.6 Å²	144.6	90%	0.904	74%	0.736	S	S	*	*			trans	-100	106.6	160.4	-87.8	-173.7	171.7	-178.3	0	108.8	T75	T75-K77 PolarHBondContact O-N 2.72Å; T75-K77 VanDerWaalsContact O-N 3.11Å
78	I	25.9	Very low	25.7	Very low	127 Å²	127	141.3 Å²	141.3	65%	0.651	73%	0.731	S	S	*	*			trans	-132.7	146.6	173.4	-65.2	-179.5	0	0	0	107.5
79	N	26.5	Very low	25.8	Very low	140 Å²	140	142.5 Å²	142.5	75%	0.749	74%	0.738	S	S	*	*			trans	71.5	120.2	-173.5	-51.1	-35.1	0	0	0	113.7
80	N	27.8	Very low	25.8	Very low	160 Å²	160	144.9 Å²	144.9	86%	0.856	74%	0.744	S	S	*	*			cis	-133.4	156.3	49.2	-77.6	-19.7	0	0	0	114.7
81	P	28.1	Very low	25.9	Very low	97 Å²	97	145.6 Å²	145.6	63%	0.63	75%	0.745	S	S	*	*			trans	-99.4	178.2	176	41.4	-36.7	0	0	0	113.3
82	I	25.6	Very low	25.9	Very low	150 Å²	150	148 Å²	148	77%	0.769	75%	0.754	S	S	*	*			trans	71.4	119.6	168.3	-53	159.9	0	0	0	112.4
83	N	27	Very low	26.1	Very low	138 Å²	138	149.8 Å²	149.8	74%	0.738	76%	0.762	S	S	*	*			cis	-159.2	164.9	41.2	-138.2	-21.6	0	0	0	114.9
84	K	26.4	Very low	26.3	Very low	177 Å²	177	147.8 Å²	147.8	77%	0.77	76%	0.764	S	S	*	*			trans	-14.8	143.8	172	-70.9	172.9	174.7	-178	0	123.4
85	S	25	Very low	26.4	Very low	111 Å²	111	149.3 Å²	149.3	78%	0.776	76%	0.764	S	S	*	*			trans	89.4	150.4	132.9	70.5	0	0	0	0	121.6
86	M	27.9	Very low	26.4	Very low	184 Å²	184	152 Å²	152	91%	0.906	77%	0.765	S	S	*	*			trans	59.1	102.8	-176.9	-65	179	168.9	0	0	114.6
87	K	25.5	Very low	26.5	Very low	181 Å²	181	151.1 Å²	151.1	79%	0.787	77%	0.769	S	S	*	*				70.9	129.1	66.2	-92.8	-162.5	155.4	-143	0	115.3
88	D	27	Very low	26.4	Very low	119 Å²	119	149 Å²	149	64%	0.636	76%	0.76	S	S	*	*			trans	76.5	119.5	151.4	-49.5	-18.3	0	0	0	119.6
89	N	26.7	Very low	26.2	Very low	144 Å²	144	149.4 Å²	149.4	77%	0.77	76%	0.763	S	S	*	*			trans	86.3	110.3	147.4	-63.9	-7.8	0	0	0	123.4
90	E	25.8	Very low	26.2	Very low	139 Å²	139	150.3 Å²	150.3	65%	0.65	77%	0.767	S	S	*	*				84	118.3	129.8	-64.6	-158.1	115.8	0	0	123.6
91	K	25.9	Very low	26.3	Very low	167 Å²	167	146 Å²	146	73%	0.726	75%	0.749	S	S	*	*				39.7	95.5	125.9	-54.8	170.2	-174.2	159.5	0	117.4
92	N	25.4	Very low	26.2	Very low	158 Å²	158	150.3 Å²	150.3	85%	0.845	76%	0.758	S	S	*	*				179.2	-178.9	121.4	-95.1	-44.8	0	0	0	111.5
93	L	26.7	Very low	26.4	Very low	160 Å²	160	149.3 Å²	149.3	84%	0.838	75%	0.753	S	S	*	*			trans	72.9	54.3	171.5	-63.5	151.4	0	0	0	116.9
94	I	27.3	Very low	26.4	Very low	174 Å²	174	149.3 Å²	149.3	89%	0.892	75%	0.753	S	S	*	*			trans	-109.6	81.1	151.7	-55.7	-177.8	0	0	0	108.8
95	E	26.1	Very low	26.6	Very low	142 Å²	142	147 Å²	147	66%	0.664	75%	0.748	S	S	*	*			trans	-129.4	160.1	172.4	-84.7	-152.8	135.5	0	0	111.4
96	K	26.6	Very low	26.9	Very low	184 Å²	184	146.1 Å²	146.1	80%	0.8	74%	0.743	S	S	*	*			trans	68.9	63	163	-66.5	149.2	178.6	136.8	0	117.1
97	S	26.1	Very low	27	Very low	114 Å²	114	139.6 Å²	139.6	80%	0.797	71%	0.711	S	S	*	*			trans	-148.3	30.1	166.3	60.4	0	0	0	0	116.9
98	K	24.5	Very low	27.4	Very low	164 Å²	164	138.4 Å²	138.4	71%	0.713	71%	0.708	S	S	*	*			trans	-118	91.3	174.2	-67.9	-166.8	178.8	-172.3	0	112.9
99	L	23.3	Very low	27.9	Very low	134 Å²	134	138.5 Å²	138.5	70%	0.702	70%	0.703	S	S	*	*			trans	-163.8	84.3	170.4	-135.6	176.5	0	0	0	112.7
100	L	25.8	Very low	28.1	Very low	159 Å²	159	135.5 Å²	135.5	83%	0.832	69%	0.685	S	S	*	*			trans	-165.3	126.6	148.2	-132.7	70.6	0	0	0	110.8
101	S	29	Very low	28.5	Very low	71 Å²	71	134.6 Å²	134.6	50%	0.497	68%	0.684	S	S	.	*			trans	-90.1	122.4	171.4	56.1	0	0	0	0	109.4	R126	S101-R126 PolarHBondContact OG-NH2 3.25Å
102	F	26.7	Very low	29	Very low	187 Å²	187	135.4 Å²	135.4	82%	0.82	69%	0.688	S	S	*	*			trans	-66.3	144.8	171.3	-71.9	-94	0	0	0	110.6
103	I	29.4	Very low	29.7	Very low	129 Å²	129	130.9 Å²	130.9	66%	0.662	67%	0.666	S	S	*	*			trans	-113.1	115.3	170.3	-58	176.2	0	0	0	106.3	L105	I103-L105 HydrophobicContact CB-CD1 4.33Å; I103-L105 HydrophobicContact CG2-CD1 3.72Å; I103-L105 HydrophobicContact CG2-CG 4.06Å
104	N	26.8	Very low	30.1	Very low	137 Å²	137	127.3 Å²	127.3	73%	0.733	64%	0.642	S	S	*	*			trans	-92.1	116.6	171.7	-165.1	2.5	0	0	0	108.5	S106	N104-S106 PolarHBondContact ND2-OG 3.26Å; N104-S106 PolarHBondContact OD1-OG 3.15Å
105	L	32	Very low	30.7	Very low	128 Å²	128	127.7 Å²	127.7	67%	0.67	64%	0.637	S	S	*	*			trans	-94.5	15	-175.3	-79.9	108.5	0	0	0	113.7	I103 N107	I103-L105 HydrophobicContact CB-CD1 4.33Å; I103-L105 HydrophobicContact CG2-CD1 3.72Å; I103-L105 HydrophobicContact CG2-CG 4.06Å; L105-N107 PolarHBondContact O-N 2.93Å
106	S	30.6	Very low	31.7	Very low	94 Å²	94	124.2 Å²	124.2	66%	0.657	63%	0.626	S	S	*	*			trans	-68.9	-11.2	-177.7	55.6	0	0	0	0	115.4	N104	N104-S106 PolarHBondContact ND2-OG 3.26Å; N104-S106 PolarHBondContact OD1-OG 3.15Å
107	N	30.8	Very low	32.7	Very low	46 Å²	46	121 Å²	121	25%	0.246	61%	0.614	C	S	.	*			trans	-97.5	107.9	-165.2	-166.1	-17.3	0	0	0	114.1	L105 K109 M110 D699	L105-N107 PolarHBondContact O-N 2.93Å; N107-K109 PolarHBondContact O-N 2.8Å; N107-K109 VanDerWaalsContact O-N 3.13Å; N107-K109 PolarHBondContact OD1-N 3.25Å; N107-K109 VanDerWaalsContact OD1-N 3.11Å; N107-M110 PolarHBondContact O-N 2.88Å; N107-M110 VanDerWaalsContact O-N 3.16Å; N107-D699 PolarHBondContact ND2-OD1 3.34Å; N107-D699 PolarHBondContact ND2-OD2 2.94Å
108	H	33.8	Very low	33.9	Very low	156 Å²	156	122 Å²	122	72%	0.722	60%	0.603	S	S	*	*	G	3₁₀ helix	trans	-63.3	-18.1	-176.8	-134.3	-69.5	0	0	0	114.5	L111	H108-L111 WeakPolarHBondContact O-CB 3.15Å; H108-L111 PolarHBondContact O-N 3.24Å
109	K	35.9	Very low	35.1	Very low	121 Å²	121	117.7 Å²	117.7	53%	0.526	59%	0.585	S	S	.	*	G	3₁₀ helix	trans	-69.7	-28.9	175.4	-69.3	178.9	-178.5	172.9	0	113.2	N107 L111 K112 L698 D699	N107-K109 PolarHBondContact O-N 2.8Å; N107-K109 VanDerWaalsContact O-N 3.13Å; N107-K109 PolarHBondContact OD1-N 3.25Å; N107-K109 VanDerWaalsContact OD1-N 3.11Å; K109-L111 PolarHBondContact O-N 2.99Å; K109-K112 PolarHBondContact O-N 3.41Å; K109-L698 WeakPolarHBondContact CD-O 3.45Å; K109-L698 WeakPolarHBondContact CE-O 3.48Å; K109-L698 PolarHBondContact NZ-O 2.98Å; K109-D699 IonicContact NZ-OD1 3.9Å
110	M	32.8	Very low	36.1	Very low	82 Å²	82	114.4 Å²	114.4	40%	0.404	56%	0.563	S	S	.	*	G	3₁₀ helix	trans	-62	-16.5	177.1	-75	-70.2	166.3	0	0	113	N107 K112 T113 Y114	N107-M110 PolarHBondContact O-N 2.88Å; N107-M110 VanDerWaalsContact O-N 3.16Å; M110-K112 PolarHBondContact O-N 3.45Å; M110-T113 PolarHBondContact O-N 2.85Å; M110-T113 PolarHBondContact O-OG1 2.77Å; M110-T113 HydrophobicContact SD-CG2 4.45Å; M110-T113 PolarHBondContact SD-OG1 3.09Å; M110-T113 VanDerWaalsContact SD-OG1 3.35Å; M110-Y114 HydrophobicContact CB-CE2 4.12Å; M110-Y114 WeakPolarHBondContact O-CD2 3.31Å; M110-Y114 VanDerWaalsContact O-CE2 3.29Å; M110-Y114 WeakPolarHBondContact O-CE2 3.44Å
111	L	33.3	Very low	37.4	Very low	120 Å²	120	111.2 Å²	111.2	63%	0.628	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-57.9	-20.6	177.1	-152.3	70.3	0	0	0	113.5	H108 K109	H108-L111 WeakPolarHBondContact O-CB 3.15Å; H108-L111 PolarHBondContact O-N 3.24Å; K109-L111 PolarHBondContact O-N 2.99Å
112	K	36.5	Very low	38.4	Very low	184 Å²	184	112.2 Å²	112.2	80%	0.8	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-85	-30	173.6	-70	-175.4	177.6	-179.7	0	114.3	K109 M110	K109-K112 PolarHBondContact O-N 3.41Å; M110-K112 PolarHBondContact O-N 3.45Å
113	T	39.6	Very low	39.7	Very low	63 Å²	63	105.8 Å²	105.8	39%	0.387	52%	0.52	S	S	.	.	G	3₁₀ helix	trans	-79.9	-24	-173.7	53.4	0	0	0	0	113.5	M110 K115 T116	M110-T113 PolarHBondContact O-N 2.85Å; M110-T113 PolarHBondContact O-OG1 2.77Å; M110-T113 HydrophobicContact SD-CG2 4.45Å; M110-T113 PolarHBondContact SD-OG1 3.09Å; M110-T113 VanDerWaalsContact SD-OG1 3.35Å; T113-K115 PolarHBondContact O-N 2.99Å; T113-T116 PolarHBondContact O-N 3.26Å; T113-T116 VanDerWaalsContact O-N 3.14Å; T113-T116 PolarHBondContact O-OG1 3.44Å
114	Y	35.5	Very low	40.7	Very low	84 Å²	84	103.1 Å²	103.1	33%	0.329	51%	0.506	S	S	.	.	G	3₁₀ helix	trans	-59.3	-16.8	174	-61	-62.9	0	0	0	114.5	M110 T116 F119	M110-Y114 HydrophobicContact CB-CE2 4.12Å; M110-Y114 WeakPolarHBondContact O-CD2 3.31Å; M110-Y114 VanDerWaalsContact O-CE2 3.29Å; M110-Y114 WeakPolarHBondContact O-CE2 3.44Å; Y114-T116 PolarHBondContact O-N 2.63Å; Y114-F119 HydrophobicContact CD1-CD1 4.12Å; Y114-F119 AromaticContact CD1-CE1 3.56Å; Y114-F119 HydrophobicContact CD1-CE1 3.56Å; Y114-F119 HydrophobicContact CD1-CZ 4.07Å; Y114-F119 AromaticContact CE1-CE1 3.83Å; Y114-F119 HydrophobicContact CE1-CE1 3.83Å; Y114-F119 AromaticContact CE1-CZ 3.91Å; Y114-F119 HydrophobicContact CE1-CZ 3.91Å
115	K	39.9	Very low	41.9	Very low	182 Å²	182	101.3 Å²	101.3	79%	0.791	50%	0.496	S	S	*	.	G	3₁₀ helix	trans	-71.1	-6.4	175.3	-70.2	-164	173.4	-167.4	0	114.1	T113	T113-K115 PolarHBondContact O-N 2.99Å
116	T	47.8	Very low	42.9	Very low	70 Å²	70	102.4 Å²	102.4	43%	0.429	49%	0.491	S	S	.	.			trans	-91.6	129	-175.3	61	0	0	0	0	113.8	T113 Y114 K118 F119 R120	T113-T116 PolarHBondContact O-N 3.26Å; T113-T116 VanDerWaalsContact O-N 3.14Å; T113-T116 PolarHBondContact O-OG1 3.44Å; Y114-T116 PolarHBondContact O-N 2.63Å; T116-K118 VanDerWaalsContact C-N 3.28Å; T116-K118 PolarHBondContact O-N 2.88Å; T116-F119 WeakPolarHBondContact O-CB 3.23Å; T116-F119 PolarHBondContact O-N 3.14Å; T116-F119 VanDerWaalsContact OG1-CB 3.24Å; T116-F119 WeakPolarHBondContact OG1-CB 3.41Å; T116-R120 PolarHBondContact O-N 3.15Å
117	E	47.2	Very low	43.7	Very low	116 Å²	116	102.3 Å²	102.3	54%	0.542	48%	0.483	S	S	.	.	H	α-helix	trans	-61.6	-35.5	177.8	-151.8	71.6	168.7	0	0	111.9	F119 R120 I121	E117-F119 VanDerWaalsContact C-N 3.29Å; E117-F119 PolarHBondContact O-N 3.3Å; E117-R120 PolarHBondContact O-N 2.98Å; E117-R120 IonicContact OE1-NH1 3.36Å; E117-R120 IonicContact OE2-CZ 3.41Å; E117-R120 IonicContact OE2-NH1 3.82Å; E117-R120 PolarHBondContact OE2-NH1 2.81Å; E117-I121 HydrophobicContact CG-CD1 4.16Å; E117-I121 WeakPolarHBondContact O-CG1 3.38Å; E117-I121 PolarHBondContact O-N 2.82Å
118	K	51	Low	44.4	Very low	134 Å²	134	107.8 Å²	107.8	58%	0.583	50%	0.5	S	S	*	.	H	α-helix	trans	-56.2	-38.3	172.9	-170.3	-178.8	179.3	-174.5	0	111.9	T116 N122 E719	T116-K118 VanDerWaalsContact C-N 3.28Å; T116-K118 PolarHBondContact O-N 2.88Å; K118-N122 WeakPolarHBondContact O-CB 3.49Å; K118-N122 PolarHBondContact O-N 2.81Å; K118-N122 PolarHBondContact O-ND2 3.31Å; K118-E719 IonicContact NZ-OE2 3.43Å; K118-E719 PolarHBondContact NZ-OE2 2.95Å
119	F	49.1	Very low	45.2	Very low	75 Å²	75	102.9 Å²	102.9	33%	0.329	48%	0.483	S	S	.	.	H	α-helix	trans	-73.2	-46.1	176.1	-177.6	-90.3	0	0	0	111.7	Y114 T116 E117 I121 N122 L123	Y114-F119 HydrophobicContact CD1-CD1 4.12Å; Y114-F119 AromaticContact CD1-CE1 3.56Å; Y114-F119 HydrophobicContact CD1-CE1 3.56Å; Y114-F119 HydrophobicContact CD1-CZ 4.07Å; Y114-F119 AromaticContact CE1-CE1 3.83Å; Y114-F119 HydrophobicContact CE1-CE1 3.83Å; Y114-F119 AromaticContact CE1-CZ 3.91Å; Y114-F119 HydrophobicContact CE1-CZ 3.91Å; T116-F119 WeakPolarHBondContact O-CB 3.23Å; T116-F119 PolarHBondContact O-N 3.14Å; T116-F119 VanDerWaalsContact OG1-CB 3.24Å; T116-F119 WeakPolarHBondContact OG1-CB 3.41Å; E117-F119 VanDerWaalsContact C-N 3.29Å; E117-F119 PolarHBondContact O-N 3.3Å; F119-I121 PolarHBondContact O-N 2.92Å; F119-N122 PolarHBondContact O-N 2.8Å; F119-L123 HydrophobicContact CE1-CB 4.5Å; F119-L123 HydrophobicContact CE1-CD2 4.12Å; F119-L123 WeakPolarHBondContact O-CB 3.4Å; F119-L123 PolarHBondContact O-N 2.63Å
120	R	44.5	Very low	45.9	Very low	65 Å²	65	101.6 Å²	101.6	25%	0.245	48%	0.481	C	S	.	.	H	α-helix	trans	-59.5	-45.5	-179.3	-62.2	175	75.8	-138.5	2.6	111.4	T116 E117 L123 I124 L324 N325	T116-R120 PolarHBondContact O-N 3.15Å; E117-R120 PolarHBondContact O-N 2.98Å; E117-R120 IonicContact OE1-NH1 3.36Å; E117-R120 IonicContact OE2-CZ 3.41Å; E117-R120 IonicContact OE2-NH1 3.82Å; E117-R120 PolarHBondContact OE2-NH1 2.81Å; R120-L123 PolarHBondContact O-N 3.45Å; R120-I124 WeakPolarHBondContact O-CD1 3.3Å; R120-I124 VanDerWaalsContact O-CG1 3.27Å; R120-I124 WeakPolarHBondContact O-CG1 3.45Å; R120-I124 PolarHBondContact O-N 3.18Å; R120-L324 PolarHBondContact NE-O 2.92Å; R120-L324 PolarHBondContact NH2-O 2.87Å; R120-N325 PolarHBondContact NH2-O 2.78Å
121	I	52.3	Low	46.3	Very low	91 Å²	91	106.6 Å²	106.6	47%	0.467	50%	0.496	S	S	.	.	H	α-helix	trans	-62.4	-48.3	175.8	-67.2	167.3	0	0	0	111.3	E117 F119 L123 I124 L125	E117-I121 HydrophobicContact CG-CD1 4.16Å; E117-I121 WeakPolarHBondContact O-CG1 3.38Å; E117-I121 PolarHBondContact O-N 2.82Å; F119-I121 PolarHBondContact O-N 2.92Å; I121-L123 VanDerWaalsContact C-N 3.33Å; I121-L123 PolarHBondContact O-N 2.89Å; I121-I124 PolarHBondContact O-N 2.88Å; I121-L125 HydrophobicContact CG2-CD1 3.95Å; I121-L125 HydrophobicContact CG2-CG 4.43Å; I121-L125 WeakPolarHBondContact O-CG 3.41Å; I121-L125 PolarHBondContact O-N 2.85Å
122	N	51.5	Low	46.8	Very low	93 Å²	93	104.3 Å²	104.3	50%	0.497	49%	0.489	S	S	.	.	H	α-helix	trans	-62.2	-38.4	178.8	-88.6	-46.4	0	0	0	112.9	K118 F119 L125 R126	K118-N122 WeakPolarHBondContact O-CB 3.49Å; K118-N122 PolarHBondContact O-N 2.81Å; K118-N122 PolarHBondContact O-ND2 3.31Å; F119-N122 PolarHBondContact O-N 2.8Å; N122-L125 PolarHBondContact O-N 2.83Å; N122-R126 VanDerWaalsContact O-CB 3.3Å; N122-R126 WeakPolarHBondContact O-CB 3.21Å; N122-R126 PolarHBondContact O-N 3.18Å
123	L	54.2	Low	47.3	Very low	51 Å²	51	102.5 Å²	102.5	27%	0.267	48%	0.478	S	S	.	.	H	α-helix	trans	-63.6	-45.6	175.5	-173.9	65.7	0	0	0	111.2	F119 R120 I121 L125 R126 L127 L324	F119-L123 HydrophobicContact CE1-CB 4.5Å; F119-L123 HydrophobicContact CE1-CD2 4.12Å; F119-L123 WeakPolarHBondContact O-CB 3.4Å; F119-L123 PolarHBondContact O-N 2.63Å; R120-L123 PolarHBondContact O-N 3.45Å; I121-L123 VanDerWaalsContact C-N 3.33Å; I121-L123 PolarHBondContact O-N 2.89Å; L123-L125 PolarHBondContact O-N 2.89Å; L123-R126 PolarHBondContact O-N 2.89Å; L123-L127 HydrophobicContact CD1-CD1 4.48Å; L123-L127 HydrophobicContact CG-CD1 4.1Å; L123-L127 WeakPolarHBondContact O-CB 3.44Å; L123-L127 VanDerWaalsContact O-CG 3.29Å; L123-L127 WeakPolarHBondContact O-CG 3.33Å; L123-L127 PolarHBondContact O-N 2.93Å; L123-L324 HydrophobicContact CD2-CD1 3.74Å; L123-L324 HydrophobicContact CD2-CD2 4.48Å
124	I	50.6	Low	47.3	Very low	74 Å²	74	102.8 Å²	102.8	38%	0.379	48%	0.482	S	S	.	.	H	α-helix	trans	-60.6	-44.4	176.4	-69.7	165.4	0	0	0	111.2	R120 I121 L127 R128	R120-I124 WeakPolarHBondContact O-CD1 3.3Å; R120-I124 VanDerWaalsContact O-CG1 3.27Å; R120-I124 WeakPolarHBondContact O-CG1 3.45Å; R120-I124 PolarHBondContact O-N 3.18Å; I121-I124 PolarHBondContact O-N 2.88Å; I124-L127 PolarHBondContact O-N 3.4Å; I124-R128 WeakPolarHBondContact O-CB 3.49Å; I124-R128 PolarHBondContact O-N 3.09Å
125	L	50.6	Low	47.5	Very low	98 Å²	98	100.9 Å²	100.9	51%	0.513	48%	0.481	S	S	.	.	H	α-helix	trans	-64.1	-42.3	176.9	-70	172.4	0	0	0	112	I121 N122 L123 R128 S129	I121-L125 HydrophobicContact CG2-CD1 3.95Å; I121-L125 HydrophobicContact CG2-CG 4.43Å; I121-L125 WeakPolarHBondContact O-CG 3.41Å; I121-L125 PolarHBondContact O-N 2.85Å; N122-L125 PolarHBondContact O-N 2.83Å; L123-L125 PolarHBondContact O-N 2.89Å; L125-R128 PolarHBondContact O-N 3.35Å; L125-S129 WeakPolarHBondContact O-CB 3.5Å; L125-S129 PolarHBondContact O-N 2.92Å
126	R	52.9	Low	47.7	Very low	152 Å²	152	96.8 Å²	96.8	57%	0.574	47%	0.467	S	S	*	.	H	α-helix	trans	-67.3	-39.8	178.8	-161.7	165.4	-176.9	148.1	-6.2	111.6	S101 N122 L123 S129 I130	S101-R126 PolarHBondContact OG-NH2 3.25Å; N122-R126 VanDerWaalsContact O-CB 3.3Å; N122-R126 WeakPolarHBondContact O-CB 3.21Å; N122-R126 PolarHBondContact O-N 3.18Å; L123-R126 PolarHBondContact O-N 2.89Å; R126-S129 PolarHBondContact O-N 2.88Å; R126-I130 VanDerWaalsContact O-CG1 3.3Å; R126-I130 WeakPolarHBondContact O-CG1 3.33Å; R126-I130 PolarHBondContact O-N 3.19Å
127	L	47.8	Very low	47.2	Very low	91 Å²	91	100.2 Å²	100.2	48%	0.476	48%	0.476	S	S	.	.	H	α-helix	trans	-65.2	-43.6	172.8	-71.3	170.9	0	0	0	112.1	L123 I124 S129 I130 W131	L123-L127 HydrophobicContact CD1-CD1 4.48Å; L123-L127 HydrophobicContact CG-CD1 4.1Å; L123-L127 WeakPolarHBondContact O-CB 3.44Å; L123-L127 VanDerWaalsContact O-CG 3.29Å; L123-L127 WeakPolarHBondContact O-CG 3.33Å; L123-L127 PolarHBondContact O-N 2.93Å; I124-L127 PolarHBondContact O-N 3.4Å; L127-S129 VanDerWaalsContact C-N 3.33Å; L127-S129 PolarHBondContact O-N 3.16Å; L127-I130 PolarHBondContact O-N 3.42Å; L127-W131 WeakPolarHBondContact O-CB 3.45Å; L127-W131 PolarHBondContact O-N 2.8Å
128	R	46.6	Very low	46.7	Very low	162 Å²	162	97 Å²	97	61%	0.611	47%	0.467	S	S	*	.	H	α-helix	trans	-59.4	-41.3	172.4	-91.3	-178.4	154.8	165.5	-6.7	112.4	I124 L125 W131 S132	I124-R128 WeakPolarHBondContact O-CB 3.49Å; I124-R128 PolarHBondContact O-N 3.09Å; L125-R128 PolarHBondContact O-N 3.35Å; R128-W131 PolarHBondContact O-N 3.36Å; R128-S132 VanDerWaalsContact O-CB 3.32Å; R128-S132 WeakPolarHBondContact O-CB 3.26Å; R128-S132 PolarHBondContact O-N 2.93Å
129	S	50.3	Low	45.9	Very low	53 Å²	53	95.8 Å²	95.8	37%	0.371	46%	0.463	S	S	.	.	H	α-helix	trans	-63.7	-43.2	176.5	-171.1	0	0	0	0	112.2	L125 R126 L127 R133	L125-S129 WeakPolarHBondContact O-CB 3.5Å; L125-S129 PolarHBondContact O-N 2.92Å; R126-S129 PolarHBondContact O-N 2.88Å; L127-S129 VanDerWaalsContact C-N 3.33Å; L127-S129 PolarHBondContact O-N 3.16Å; S129-R133 WeakPolarHBondContact O-CB 3.41Å; S129-R133 VanDerWaalsContact O-CG 3.25Å; S129-R133 WeakPolarHBondContact O-CG 3.46Å; S129-R133 PolarHBondContact O-N 3.09Å
130	I	49.3	Very low	45.4	Very low	93 Å²	93	96.6 Å²	96.6	48%	0.477	47%	0.468	S	S	.	.	H	α-helix	trans	-63.5	-45.7	174.8	-68.7	163.1	0	0	0	110.9	R126 L127 R133 S134	R126-I130 VanDerWaalsContact O-CG1 3.3Å; R126-I130 WeakPolarHBondContact O-CG1 3.33Å; R126-I130 PolarHBondContact O-N 3.19Å; L127-I130 PolarHBondContact O-N 3.42Å; I130-R133 PolarHBondContact O-N 3.1Å; I130-S134 WeakPolarHBondContact O-CB 3.38Å; I130-S134 PolarHBondContact O-N 3.33Å; I130-S134 PolarHBondContact O-OG 3.47Å
131	W	42.1	Very low	45.1	Very low	188 Å²	188	98.3 Å²	98.3	71%	0.712	48%	0.481	S	S	*	.	H	α-helix	trans	-63.1	-45.3	178.8	-176.3	74.4	0	0	0	112.2	L127 R128 S134 S135	L127-W131 WeakPolarHBondContact O-CB 3.45Å; L127-W131 PolarHBondContact O-N 2.8Å; R128-W131 PolarHBondContact O-N 3.36Å; W131-S134 PolarHBondContact O-N 3.1Å; W131-S135 WeakPolarHBondContact O-CB 3.43Å; W131-S135 PolarHBondContact O-N 3.23Å
132	S	44.4	Very low	44	Very low	71 Å²	71	99.3 Å²	99.3	50%	0.497	48%	0.483	S	S	.	.	H	α-helix	trans	-58.5	-48	174.7	175.7	0	0	0	0	111.9	R128 S134 S135 L136	R128-S132 VanDerWaalsContact O-CB 3.32Å; R128-S132 WeakPolarHBondContact O-CB 3.26Å; R128-S132 PolarHBondContact O-N 2.93Å; S132-S134 VanDerWaalsContact C-N 3.33Å; S132-S134 PolarHBondContact O-N 2.77Å; S132-S135 PolarHBondContact O-N 3.33Å; S132-L136 WeakPolarHBondContact O-CB 3.29Å; S132-L136 PolarHBondContact O-N 3.28Å
133	R	45.7	Very low	43.3	Very low	147 Å²	147	97.8 Å²	97.8	56%	0.555	48%	0.48	S	S	*	.	H	α-helix	trans	-63.5	-36	177.9	-72.8	172.7	176.6	-158.9	-2.1	112.8	S129 I130 K137	S129-R133 WeakPolarHBondContact O-CB 3.41Å; S129-R133 VanDerWaalsContact O-CG 3.25Å; S129-R133 WeakPolarHBondContact O-CG 3.46Å; S129-R133 PolarHBondContact O-N 3.09Å; I130-R133 PolarHBondContact O-N 3.1Å; R133-K137 WeakPolarHBondContact O-CB 3.39Å; R133-K137 WeakPolarHBondContact O-CG 3.22Å; R133-K137 PolarHBondContact O-N 3.3Å; R133-K137 VanDerWaalsContact O-N 3.11Å
134	S	39.4	Very low	42.4	Very low	69 Å²	69	101.7 Å²	101.7	48%	0.483	50%	0.495	S	S	.	.	H	α-helix	trans	-73.3	-40.5	175.8	-68	0	0	0	0	112.5	I130 W131 S132 K137 S138	I130-S134 WeakPolarHBondContact O-CB 3.38Å; I130-S134 PolarHBondContact O-N 3.33Å; I130-S134 PolarHBondContact O-OG 3.47Å; W131-S134 PolarHBondContact O-N 3.1Å; S132-S134 VanDerWaalsContact C-N 3.33Å; S132-S134 PolarHBondContact O-N 2.77Å; S134-K137 PolarHBondContact O-N 3.49Å; S134-S138 PolarHBondContact O-N 2.87Å
135	S	40.4	Very low	41.7	Very low	44 Å²	44	104.5 Å²	104.5	31%	0.308	51%	0.506	S	S	.	.	H	α-helix	trans	-60.9	-48.2	174.1	-176.5	0	0	0	0	111.3	W131 S132 K137 S138 Q139	W131-S135 WeakPolarHBondContact O-CB 3.43Å; W131-S135 PolarHBondContact O-N 3.23Å; S132-S135 PolarHBondContact O-N 3.33Å; S135-K137 VanDerWaalsContact C-N 3.34Å; S135-K137 PolarHBondContact O-N 2.9Å; S135-S138 WeakPolarHBondContact O-CB 3.49Å; S135-S138 PolarHBondContact O-N 3.04Å; S135-S138 VanDerWaalsContact O-N 3.07Å; S135-Q139 WeakPolarHBondContact O-CG 3.41Å; S135-Q139 PolarHBondContact O-N 3.29Å
136	L	43.2	Very low	40.9	Very low	95 Å²	95	104.4 Å²	104.4	50%	0.497	51%	0.505	S	S	.	.	H	α-helix	trans	-61.7	-39.7	176.8	-162.3	79.2	0	0	0	112	S132 Q140	S132-L136 WeakPolarHBondContact O-CB 3.29Å; S132-L136 PolarHBondContact O-N 3.28Å; L136-Q140 WeakPolarHBondContact O-CB 3.43Å; L136-Q140 WeakPolarHBondContact O-CG 3.5Å; L136-Q140 PolarHBondContact O-N 2.89Å
137	K	37.9	Very low	40.2	Very low	143 Å²	143	103.5 Å²	103.5	62%	0.622	51%	0.507	S	S	*	.	H	α-helix	trans	-63.3	-40.3	172.2	-83.7	-176.9	175	-177.2	0	112.4	R133 S134 S135 Q140 I141	R133-K137 WeakPolarHBondContact O-CB 3.39Å; R133-K137 WeakPolarHBondContact O-CG 3.22Å; R133-K137 PolarHBondContact O-N 3.3Å; R133-K137 VanDerWaalsContact O-N 3.11Å; S134-K137 PolarHBondContact O-N 3.49Å; S135-K137 VanDerWaalsContact C-N 3.34Å; S135-K137 PolarHBondContact O-N 2.9Å; K137-Q140 PolarHBondContact O-N 2.81Å; K137-I141 VanDerWaalsContact O-CG1 3.28Å; K137-I141 WeakPolarHBondContact O-CG1 3.33Å; K137-I141 PolarHBondContact O-N 3.24Å
138	S	36.4	Very low	39.7	Very low	49 Å²	49	106 Å²	106	34%	0.343	51%	0.514	S	S	.	.	H	α-helix	trans	-61.2	-50.2	176.3	-166.3	0	0	0	0	110.9	S134 S135 Q140 I141 E142	S134-S138 PolarHBondContact O-N 2.87Å; S135-S138 WeakPolarHBondContact O-CB 3.49Å; S135-S138 PolarHBondContact O-N 3.04Å; S135-S138 VanDerWaalsContact O-N 3.07Å; S138-Q140 VanDerWaalsContact C-N 3.31Å; S138-Q140 PolarHBondContact O-N 2.95Å; S138-I141 WeakPolarHBondContact O-CA 3.21Å; S138-I141 PolarHBondContact O-N 2.87Å; S138-E142 PolarHBondContact O-N 2.67Å
139	Q	35.1	Very low	39.2	Very low	108 Å²	108	101.4 Å²	101.4	51%	0.505	51%	0.507	S	S	.	.	H	α-helix	trans	-60	-37.9	176.1	-69.1	174.6	-16.5	0	0	112.5	S135 I141 S143	S135-Q139 WeakPolarHBondContact O-CG 3.41Å; S135-Q139 PolarHBondContact O-N 3.29Å; Q139-I141 VanDerWaalsContact C-N 3.32Å; Q139-I141 PolarHBondContact O-N 2.88Å; Q139-S143 WeakPolarHBondContact O-CB 3.37Å; Q139-S143 PolarHBondContact O-N 3.46Å; Q139-S143 PolarHBondContact O-OG 3.44Å
140	Q	39	Very low	38.5	Very low	92 Å²	92	105.8 Å²	105.8	43%	0.43	52%	0.52	S	S	.	.	H	α-helix	trans	-69	-25.6	173.4	-75.8	-174.1	17.1	0	0	113.9	L136 K137 S138 S143 K144	L136-Q140 WeakPolarHBondContact O-CB 3.43Å; L136-Q140 WeakPolarHBondContact O-CG 3.5Å; L136-Q140 PolarHBondContact O-N 2.89Å; K137-Q140 PolarHBondContact O-N 2.81Å; S138-Q140 VanDerWaalsContact C-N 3.31Å; S138-Q140 PolarHBondContact O-N 2.95Å; Q140-S143 WeakPolarHBondContact CA-OG 3.4Å; Q140-S143 PolarHBondContact O-OG 2.99Å; Q140-K144 WeakPolarHBondContact O-CB 3.15Å; Q140-K144 VanDerWaalsContact O-CD 3.24Å; Q140-K144 WeakPolarHBondContact O-CD 3.35Å; Q140-K144 WeakPolarHBondContact O-CG 3.4Å; Q140-K144 PolarHBondContact O-N 2.79Å
141	I	36.6	Very low	38.2	Very low	100 Å²	100	104.1 Å²	104.1	51%	0.513	51%	0.514	S	S	.	.	H	α-helix	trans	-80.7	-42.9	174.4	-70.5	164.5	0	0	0	110	K137 S138 Q139 K144 H145	K137-I141 VanDerWaalsContact O-CG1 3.28Å; K137-I141 WeakPolarHBondContact O-CG1 3.33Å; K137-I141 PolarHBondContact O-N 3.24Å; S138-I141 WeakPolarHBondContact O-CA 3.21Å; S138-I141 PolarHBondContact O-N 2.87Å; Q139-I141 VanDerWaalsContact C-N 3.32Å; Q139-I141 PolarHBondContact O-N 2.88Å; I141-K144 PolarHBondContact O-N 2.79Å; I141-H145 WeakPolarHBondContact O-CB 3.16Å; I141-H145 PolarHBondContact O-N 3.03Å
142	E	30.6	Very low	38.1	Very low	112 Å²	112	99.4 Å²	99.4	52%	0.523	50%	0.503	S	S	.	.	H	α-helix	trans	-59.9	-51.1	174.7	-72.5	-178.3	135.5	0	0	111.5	S138 K144 H145 I146	S138-E142 PolarHBondContact O-N 2.67Å; E142-K144 VanDerWaalsContact C-N 3.33Å; E142-K144 PolarHBondContact O-N 2.97Å; E142-H145 CarbonylContact O-C 3.59Å; E142-H145 PolarHBondContact O-N 3.08Å; E142-H145 VanDerWaalsContact O-N 3.07Å; E142-I146 VanDerWaalsContact O-CG1 3.3Å; E142-I146 WeakPolarHBondContact O-CG1 3.25Å; E142-I146 PolarHBondContact O-N 2.9Å
143	S	36.5	Very low	37.9	Very low	62 Å²	62	101.6 Å²	101.6	43%	0.434	51%	0.505	S	S	.	.	H	α-helix	trans	-59.6	-38.8	176.3	52.3	0	0	0	0	113.1	Q139 Q140 I146 H147	Q139-S143 WeakPolarHBondContact O-CB 3.37Å; Q139-S143 PolarHBondContact O-N 3.46Å; Q139-S143 PolarHBondContact O-OG 3.44Å; Q140-S143 WeakPolarHBondContact CA-OG 3.4Å; Q140-S143 PolarHBondContact O-OG 2.99Å; S143-I146 PolarHBondContact O-N 2.95Å; S143-H147 WeakPolarHBondContact O-CB 3.36Å; S143-H147 PolarHBondContact O-N 2.94Å
144	K	36	Very low	37.8	Very low	132 Å²	132	100.3 Å²	100.3	57%	0.574	51%	0.505	S	S	*	.	H	α-helix	trans	-69.1	-33.1	173.5	-75.1	171.2	-171.9	166.4	0	112.7	Q140 I141 E142 K148	Q140-K144 WeakPolarHBondContact O-CB 3.15Å; Q140-K144 VanDerWaalsContact O-CD 3.24Å; Q140-K144 WeakPolarHBondContact O-CD 3.35Å; Q140-K144 WeakPolarHBondContact O-CG 3.4Å; Q140-K144 PolarHBondContact O-N 2.79Å; I141-K144 PolarHBondContact O-N 2.79Å; E142-K144 VanDerWaalsContact C-N 3.33Å; E142-K144 PolarHBondContact O-N 2.97Å; K144-K148 WeakPolarHBondContact O-CB 3.38Å; K144-K148 PolarHBondContact O-N 3.3Å
145	H	35.4	Very low	38.2	Very low	134 Å²	134	102.7 Å²	102.7	62%	0.62	51%	0.508	S	S	*	.	H	α-helix	trans	-70.2	-44.2	173	-98.9	-91.3	0	0	0	111.9	I141 E142 K148 S149	I141-H145 WeakPolarHBondContact O-CB 3.16Å; I141-H145 PolarHBondContact O-N 3.03Å; E142-H145 CarbonylContact O-C 3.59Å; E142-H145 PolarHBondContact O-N 3.08Å; E142-H145 VanDerWaalsContact O-N 3.07Å; H145-K148 PolarHBondContact O-N 2.93Å; H145-S149 PolarHBondContact O-N 3.31Å; H145-S149 PolarHBondContact O-OG 3.2Å
146	I	33.4	Very low	38.5	Very low	95 Å²	95	106 Å²	106	49%	0.487	52%	0.519	S	S	.	.	H	α-helix	trans	-58.1	-51.6	174.3	-69.1	164.3	0	0	0	109.5	E142 S143 K148 S149 F150	E142-I146 VanDerWaalsContact O-CG1 3.3Å; E142-I146 WeakPolarHBondContact O-CG1 3.25Å; E142-I146 PolarHBondContact O-N 2.9Å; S143-I146 PolarHBondContact O-N 2.95Å; I146-K148 VanDerWaalsContact C-N 3.32Å; I146-K148 PolarHBondContact O-N 2.92Å; I146-S149 WeakPolarHBondContact CA-OG 3.43Å; I146-S149 PolarHBondContact O-N 2.88Å; I146-S149 VanDerWaalsContact O-N 3.11Å; I146-S149 PolarHBondContact O-OG 2.76Å; I146-F150 HydrophobicContact CG2-CD2 3.77Å; I146-F150 HydrophobicContact CG2-CE2 3.78Å; I146-F150 WeakPolarHBondContact O-CD2 3.48Å; I146-F150 PolarHBondContact O-N 3Å
147	H	37.6	Very low	38.9	Very low	134 Å²	134	105.2 Å²	105.2	62%	0.62	51%	0.513	S	S	*	.	H	α-helix	trans	-61.4	-38.3	178.9	-161.4	-51.2	0	0	0	112.3	S143 T151	S143-H147 WeakPolarHBondContact O-CB 3.36Å; S143-H147 PolarHBondContact O-N 2.94Å; H147-T151 WeakPolarHBondContact O-CG2 3.47Å; H147-T151 PolarHBondContact O-N 2.78Å; H147-T151 PolarHBondContact O-OG1 2.92Å
148	K	37.8	Very low	39.2	Very low	142 Å²	142	107 Å²	107	62%	0.617	52%	0.516	S	S	*	.	H	α-helix	trans	-68	-37.7	173.1	-85.8	-168.7	170.5	-170.7	0	113.4	K144 H145 I146 T151 N152	K144-K148 WeakPolarHBondContact O-CB 3.38Å; K144-K148 PolarHBondContact O-N 3.3Å; H145-K148 PolarHBondContact O-N 2.93Å; I146-K148 VanDerWaalsContact C-N 3.32Å; I146-K148 PolarHBondContact O-N 2.92Å; K148-T151 WeakPolarHBondContact CA-OG1 3.36Å; K148-T151 PolarHBondContact O-N 3.33Å; K148-T151 PolarHBondContact O-OG1 3.05Å; K148-T151 VanDerWaalsContact O-OG1 3.08Å; K148-N152 VanDerWaalsContact O-CB 3.26Å; K148-N152 WeakPolarHBondContact O-CB 3.48Å; K148-N152 PolarHBondContact O-N 3.12Å; K148-N152 PolarHBondContact O-OD1 3.21Å
149	S	36	Very low	39.9	Very low	67 Å²	67	109.6 Å²	109.6	47%	0.469	52%	0.522	S	S	.	.	H	α-helix	trans	-65.8	-40.9	175.7	57.9	0	0	0	0	111.6	H145 I146 N152 H153	H145-S149 PolarHBondContact O-N 3.31Å; H145-S149 PolarHBondContact O-OG 3.2Å; I146-S149 WeakPolarHBondContact CA-OG 3.43Å; I146-S149 PolarHBondContact O-N 2.88Å; I146-S149 VanDerWaalsContact O-N 3.11Å; I146-S149 PolarHBondContact O-OG 2.76Å; S149-N152 PolarHBondContact O-N 3.04Å; S149-H153 VanDerWaalsContact O-CB 3.26Å; S149-H153 WeakPolarHBondContact O-CB 3.45Å; S149-H153 PolarHBondContact O-N 3.21Å
150	F	36	Very low	40.7	Very low	145 Å²	145	109.6 Å²	109.6	64%	0.636	52%	0.522	S	S	*	.	H	α-helix	trans	-63.9	-46.5	174.2	-85.6	-71.6	0	0	0	112.2	I146 N152 H153 H154	I146-F150 HydrophobicContact CG2-CD2 3.77Å; I146-F150 HydrophobicContact CG2-CE2 3.78Å; I146-F150 WeakPolarHBondContact O-CD2 3.48Å; I146-F150 PolarHBondContact O-N 3Å; F150-N152 PolarHBondContact O-N 2.86Å; F150-H153 PolarHBondContact O-N 3.17Å; F150-H154 PolarHBondContact O-N 2.91Å
151	T	41.8	Very low	41.3	Very low	57 Å²	57	111.3 Å²	111.3	35%	0.35	53%	0.53	S	S	.	.	H	α-helix	trans	-64.1	-41.1	177.7	53.9	0	0	0	0	112.3	H147 K148 H154 Q155	H147-T151 WeakPolarHBondContact O-CG2 3.47Å; H147-T151 PolarHBondContact O-N 2.78Å; H147-T151 PolarHBondContact O-OG1 2.92Å; K148-T151 WeakPolarHBondContact CA-OG1 3.36Å; K148-T151 PolarHBondContact O-N 3.33Å; K148-T151 PolarHBondContact O-OG1 3.05Å; K148-T151 VanDerWaalsContact O-OG1 3.08Å; T151-H154 PolarHBondContact O-N 2.94Å; T151-Q155 WeakPolarHBondContact O-CB 3.42Å; T151-Q155 WeakPolarHBondContact O-CG 3.43Å; T151-Q155 PolarHBondContact O-N 3.4Å
152	N	40.7	Very low	42	Very low	89 Å²	89	112.4 Å²	112.4	48%	0.476	53%	0.533	S	S	.	.	H	α-helix	trans	-68.5	-38	178.8	-71.4	13.7	0	0	0	111.5	K148 S149 F150 Q155 H156	K148-N152 VanDerWaalsContact O-CB 3.26Å; K148-N152 WeakPolarHBondContact O-CB 3.48Å; K148-N152 PolarHBondContact O-N 3.12Å; K148-N152 PolarHBondContact O-OD1 3.21Å; S149-N152 PolarHBondContact O-N 3.04Å; F150-N152 PolarHBondContact O-N 2.86Å; N152-Q155 PolarHBondContact O-N 3.05Å; N152-H156 PolarHBondContact O-N 3.28Å
153	H	39.7	Very low	42.9	Very low	118 Å²	118	112.7 Å²	112.7	55%	0.546	53%	0.534	S	S	.	.	H	α-helix	trans	-66.5	-42.9	176.4	-162.5	72.1	0	0	0	111.3	S149 F150 Q155 H156 Q157	S149-H153 VanDerWaalsContact O-CB 3.26Å; S149-H153 WeakPolarHBondContact O-CB 3.45Å; S149-H153 PolarHBondContact O-N 3.21Å; F150-H153 PolarHBondContact O-N 3.17Å; H153-Q155 PolarHBondContact O-N 3.17Å; H153-H156 PolarHBondContact O-N 3.4Å; H153-Q157 PolarHBondContact CD2-NE2 2.81Å; H153-Q157 VanDerWaalsContact CD2-NE2 3.26Å; H153-Q157 PolarHBondContact NE2-NE2 2.65Å; H153-Q157 WeakPolarHBondContact O-CG 3.16Å; H153-Q157 PolarHBondContact O-N 3.45Å
154	H	44.6	Very low	43.6	Very low	119 Å²	119	115.8 Å²	115.8	55%	0.551	54%	0.541	S	S	*	.	H	α-helix	trans	-64.8	-37.2	173.6	-109.3	-23.3	0	0	0	113.1	F150 T151 Q157 R158	F150-H154 PolarHBondContact O-N 2.91Å; T151-H154 PolarHBondContact O-N 2.94Å; H154-Q157 PolarHBondContact ND1-OE1 3.21Å; H154-R158 WeakPolarHBondContact O-CB 3.47Å; H154-R158 WeakPolarHBondContact O-CG 3.24Å; H154-R158 PolarHBondContact O-N 3.46Å
155	Q	46.7	Very low	44.2	Very low	119 Å²	119	115.5 Å²	115.5	56%	0.556	54%	0.542	S	S	*	.	H	α-helix	trans	-65.8	-42.3	173	-78.7	-174	-19	0	0	111.8	T151 N152 H153 R158 Q159	T151-Q155 WeakPolarHBondContact O-CB 3.42Å; T151-Q155 WeakPolarHBondContact O-CG 3.43Å; T151-Q155 PolarHBondContact O-N 3.4Å; N152-Q155 PolarHBondContact O-N 3.05Å; H153-Q155 PolarHBondContact O-N 3.17Å; Q155-R158 PolarHBondContact O-N 3.39Å; Q155-Q159 WeakPolarHBondContact O-CB 3.48Å; Q155-Q159 WeakPolarHBondContact O-CG 3.49Å; Q155-Q159 PolarHBondContact O-N 3.29Å
156	H	48.2	Very low	44.6	Very low	114 Å²	114	117.9 Å²	117.9	53%	0.528	55%	0.546	S	S	.	.	H	α-helix	trans	-63.5	-43.4	175.8	-109.3	-50.9	0	0	0	112.4	N152 H153 Q159 Q160	N152-H156 PolarHBondContact O-N 3.28Å; H153-H156 PolarHBondContact O-N 3.4Å; H156-Q159 PolarHBondContact O-N 2.92Å; H156-Q160 WeakPolarHBondContact O-CB 3.35Å; H156-Q160 WeakPolarHBondContact O-CG 3.39Å; H156-Q160 PolarHBondContact O-N 2.96Å
157	Q	50.1	Low	45.2	Very low	79 Å²	79	119 Å²	119	37%	0.369	55%	0.548	S	S	.	.	H	α-helix	trans	-61.2	-43.7	174.4	-73.1	177.6	-7.2	0	0	111.9	H153 H154 Q159 Q160 H161	H153-Q157 PolarHBondContact CD2-NE2 2.81Å; H153-Q157 VanDerWaalsContact CD2-NE2 3.26Å; H153-Q157 PolarHBondContact NE2-NE2 2.65Å; H153-Q157 WeakPolarHBondContact O-CG 3.16Å; H153-Q157 PolarHBondContact O-N 3.45Å; H154-Q157 PolarHBondContact ND1-OE1 3.21Å; Q157-Q159 PolarHBondContact O-N 3.04Å; Q157-Q160 PolarHBondContact O-N 3Å; Q157-H161 PolarHBondContact O-N 3.16Å
158	R	45.5	Very low	45.5	Very low	181 Å²	181	122.1 Å²	122.1	68%	0.683	56%	0.555	S	S	*	*	H	α-helix	trans	-63.3	-40.5	175.3	-76.2	-175.2	178.8	-151.9	0.1	112.2	H154 Q155 Q162	H154-R158 WeakPolarHBondContact O-CB 3.47Å; H154-R158 WeakPolarHBondContact O-CG 3.24Å; H154-R158 PolarHBondContact O-N 3.46Å; Q155-R158 PolarHBondContact O-N 3.39Å; R158-Q162 WeakPolarHBondContact O-CB 3.47Å; R158-Q162 WeakPolarHBondContact O-CG 3.27Å; R158-Q162 PolarHBondContact O-N 3.23Å
159	Q	50.5	Low	45.7	Very low	103 Å²	103	125.9 Å²	125.9	48%	0.481	57%	0.565	S	S	.	*	H	α-helix	trans	-67.6	-40.5	176	-73.7	179.7	5.3	0	0	112.2	Q155 H156 Q157 Q162 Q163	Q155-Q159 WeakPolarHBondContact O-CB 3.48Å; Q155-Q159 WeakPolarHBondContact O-CG 3.49Å; Q155-Q159 PolarHBondContact O-N 3.29Å; H156-Q159 PolarHBondContact O-N 2.92Å; Q157-Q159 PolarHBondContact O-N 3.04Å; Q159-Q162 PolarHBondContact O-N 3.19Å; Q159-Q163 WeakPolarHBondContact O-CB 3.31Å; Q159-Q163 WeakPolarHBondContact O-CG 3.48Å; Q159-Q163 PolarHBondContact O-N 3.11Å
160	Q	51.7	Low	45.8	Very low	108 Å²	108	131.9 Å²	131.9	51%	0.505	58%	0.577	S	S	.	*	H	α-helix	trans	-64.8	-42.1	175.2	-77.1	178.8	-19	0	0	111.9	H156 Q157 Q163 H164	H156-Q160 WeakPolarHBondContact O-CB 3.35Å; H156-Q160 WeakPolarHBondContact O-CG 3.39Å; H156-Q160 PolarHBondContact O-N 2.96Å; Q157-Q160 PolarHBondContact O-N 3Å; Q160-Q163 PolarHBondContact O-N 3.28Å; Q160-H164 WeakPolarHBondContact O-CB 3.32Å; Q160-H164 PolarHBondContact O-CD2 3.39Å; Q160-H164 PolarHBondContact O-N 3.44Å
161	H	52.4	Low	46.1	Very low	127 Å²	127	131.8 Å²	131.8	59%	0.588	58%	0.579	S	S	*	*	H	α-helix	trans	-62.1	-42.8	171.6	-85.5	-53.5	0	0	0	112.3	Q157 Q163 H164 H165	Q157-H161 PolarHBondContact O-N 3.16Å; H161-Q163 VanDerWaalsContact C-N 3.35Å; H161-Q163 PolarHBondContact O-N 2.91Å; H161-H164 PolarHBondContact O-N 3.29Å; H161-H165 PolarHBondContact O-CD2 3.11Å; H161-H165 PolarHBondContact O-N 3.11Å
162	Q	50.5	Low	46	Very low	123 Å²	123	137.1 Å²	137.1	58%	0.575	60%	0.599	S	S	*	*	H	α-helix	trans	-65.1	-35.7	176.4	-74.3	179.9	-0.2	0	0	112.8	R158 Q159 R166	R158-Q162 WeakPolarHBondContact O-CB 3.47Å; R158-Q162 WeakPolarHBondContact O-CG 3.27Å; R158-Q162 PolarHBondContact O-N 3.23Å; Q159-Q162 PolarHBondContact O-N 3.19Å; Q162-R166 WeakPolarHBondContact O-CB 3.42Å; Q162-R166 WeakPolarHBondContact O-CG 3.33Å; Q162-R166 PolarHBondContact O-N 3.13Å
163	Q	50.5	Low	45.8	Very low	119 Å²	119	141.7 Å²	141.7	56%	0.556	62%	0.617	S	S	*	*	H	α-helix	trans	-69.6	-44.4	173.1	-75.4	179.4	-11.9	0	0	111.7	Q159 Q160 H161 H165 R166 H167	Q159-Q163 WeakPolarHBondContact O-CB 3.31Å; Q159-Q163 WeakPolarHBondContact O-CG 3.48Å; Q159-Q163 PolarHBondContact O-N 3.11Å; Q160-Q163 PolarHBondContact O-N 3.28Å; H161-Q163 VanDerWaalsContact C-N 3.35Å; H161-Q163 PolarHBondContact O-N 2.91Å; Q163-H165 VanDerWaalsContact C-N 3.34Å; Q163-H165 PolarHBondContact O-N 3.21Å; Q163-R166 CarbonylContact O-C 3.6Å; Q163-R166 PolarHBondContact O-N 2.79Å; Q163-R166 VanDerWaalsContact O-N 3.12Å; Q163-H167 PolarHBondContact O-CD2 2.86Å; Q163-H167 PolarHBondContact O-N 3.05Å
164	H	50.3	Low	45.5	Very low	126 Å²	126	142.7 Å²	142.7	58%	0.583	63%	0.627	S	S	*	*	H	α-helix	trans	-61.5	-38.8	174.6	-87	-67.7	0	0	0	112.8	Q160 H161 H167 R168	Q160-H164 WeakPolarHBondContact O-CB 3.32Å; Q160-H164 PolarHBondContact O-CD2 3.39Å; Q160-H164 PolarHBondContact O-N 3.44Å; H161-H164 PolarHBondContact O-N 3.29Å; H164-H167 PolarHBondContact O-N 2.79Å; H164-R168 WeakPolarHBondContact O-CB 3.29Å; H164-R168 PolarHBondContact O-N 2.76Å
165	H	48.5	Very low	45	Very low	126 Å²	126	145.5 Å²	145.5	58%	0.583	64%	0.64	S	S	*	*	H	α-helix	trans	-68	-35.2	172.6	-80.8	-68.3	0	0	0	112.8	H161 Q163 R169	H161-H165 PolarHBondContact O-CD2 3.11Å; H161-H165 PolarHBondContact O-N 3.11Å; Q163-H165 VanDerWaalsContact C-N 3.34Å; Q163-H165 PolarHBondContact O-N 3.21Å; H165-R169 WeakPolarHBondContact O-CB 3.5Å; H165-R169 WeakPolarHBondContact O-CG 3.49Å; H165-R169 PolarHBondContact O-N 2.92Å
166	R	44	Very low	44.6	Very low	185 Å²	185	149 Å²	149	70%	0.698	66%	0.655	S	S	*	*	H	α-helix	trans	-71.5	-32.8	175	-77.5	177.9	173.9	-171.4	-1.8	113.3	Q162 Q163 R170	Q162-R166 WeakPolarHBondContact O-CB 3.42Å; Q162-R166 WeakPolarHBondContact O-CG 3.33Å; Q162-R166 PolarHBondContact O-N 3.13Å; Q163-R166 CarbonylContact O-C 3.6Å; Q163-R166 PolarHBondContact O-N 2.79Å; Q163-R166 VanDerWaalsContact O-N 3.12Å; R166-R170 WeakPolarHBondContact O-CG 3.39Å
167	H	46.8	Very low	44	Very low	117 Å²	117	151 Å²	151	54%	0.542	67%	0.665	S	S	.	*	H	α-helix	trans	-76.7	-42.5	172.8	-81.8	-81.6	0	0	0	112.4	Q163 H164 R169 R170 H171	Q163-H167 PolarHBondContact O-CD2 2.86Å; Q163-H167 PolarHBondContact O-N 3.05Å; H164-H167 PolarHBondContact O-N 2.79Å; H167-R169 VanDerWaalsContact C-N 3.27Å; H167-R169 PolarHBondContact O-N 3.06Å; H167-R170 PolarHBondContact O-N 2.81Å; H167-H171 PolarHBondContact O-CD2 2.92Å
168	R	44	Very low	43.4	Very low	201 Å²	201	154.9 Å²	154.9	76%	0.758	68%	0.683	S	S	*	*	H	α-helix	trans	-63.8	-28.3	174.4	-82.2	-171.3	167	-173.3	-4.1	113.5	H164 R170	H164-R168 WeakPolarHBondContact O-CB 3.29Å; H164-R168 PolarHBondContact O-N 2.76Å; R168-R170 VanDerWaalsContact C-N 3.33Å
169	R	40.9	Very low	42.8	Very low	221 Å²	221	154.4 Å²	154.4	83%	0.834	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	-0.6	171.5	-75.7	-169.8	173.3	-165.1	-1.5	114.9	H165 H167	H165-R169 WeakPolarHBondContact O-CB 3.5Å; H165-R169 WeakPolarHBondContact O-CG 3.49Å; H165-R169 PolarHBondContact O-N 2.92Å; H167-R169 VanDerWaalsContact C-N 3.27Å; H167-R169 PolarHBondContact O-N 3.06Å
170	R	38.9	Very low	42.1	Very low	193 Å²	193	153.2 Å²	153.2	73%	0.728	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.9	9.3	179.5	-81.6	-178	168.6	-169.2	-5.9	114.6	R166 H167 R168	R166-R170 WeakPolarHBondContact O-CG 3.39Å; H167-R170 PolarHBondContact O-N 2.81Å; R168-R170 VanDerWaalsContact C-N 3.33Å
171	H	41.3	Very low	41.1	Very low	143 Å²	143	155.3 Å²	155.3	66%	0.662	70%	0.699	S	S	*	*	S	Bend	trans	-130.5	25.5	178.1	-70.9	-64.2	0	0	0	113.3	H167	H167-H171 PolarHBondContact O-CD2 2.92Å
172	H	39.6	Very low	39.9	Very low	168 Å²	168	156.2 Å²	156.2	78%	0.778	70%	0.703	S	S	*	*	S	Bend	trans	-139.8	6.1	-178.6	-94.6	-33.2	0	0	0	116.1
173	H	37	Very low	38.9	Very low	185 Å²	185	157.1 Å²	157.1	86%	0.856	71%	0.707	S	S	*	*			trans	-133.3	55.5	172.8	-85.1	3.5	0	0	0	110.9
174	D	32.6	Very low	37.9	Very low	139 Å²	139	161 Å²	161	74%	0.743	72%	0.718	S	S	*	*			trans	-130.4	64.3	168.2	-84.4	-55.2	0	0	0	109.4
175	H	35.9	Very low	37	Very low	179 Å²	179	162.3 Å²	162.3	83%	0.829	72%	0.724	S	S	*	*			trans	-162.9	96.5	162.8	-92.8	-49.1	0	0	0	109.9
176	H	37.7	Very low	35.9	Very low	191 Å²	191	167.5 Å²	167.5	88%	0.884	74%	0.74	S	S	*	*				-176.8	136.8	123.4	-100.1	-73	0	0	0	110.7
177	H	35.4	Very low	35.3	Very low	156 Å²	156	165.5 Å²	165.5	72%	0.722	74%	0.739	S	S	*	*			trans	-80.1	173.7	173.2	-57.4	-71.8	0	0	0	110.8
178	H	36.8	Very low	34.5	Very low	162 Å²	162	167.2 Å²	167.2	75%	0.75	75%	0.747	S	S	*	*			cis	-144.9	140	19.5	-74.2	-89.4	0	0	0	113.1
179	H	33.4	Very low	33.7	Very low	170 Å²	170	164.1 Å²	164.1	79%	0.787	75%	0.745	S	S	*	*				31.9	159.3	101.4	-105.1	4	0	0	0	120.8
180	P	36.7	Very low	33.4	Very low	78 Å²	78	159.9 Å²	159.9	51%	0.506	74%	0.739	S	S	.	*			cis	-140.4	-168.6	-43.9	25.2	0.2	0	0	0	114
181	H	30.4	Very low	32.9	Very low	153 Å²	153	159.3 Å²	159.3	71%	0.708	74%	0.742	S	S	*	*			trans	69.8	148.7	166	-58.3	-80.3	0	0	0	116.5
182	E	26.5	Very low	32.6	Very low	146 Å²	146	161.8 Å²	161.8	68%	0.682	75%	0.751	S	S	*	*			cis	-162.4	-169.1	-10.3	-126.1	169.2	-151.8	0	0	112.5
183	H	30.4	Very low	32.1	Very low	141 Å²	141	160.2 Å²	160.2	65%	0.653	75%	0.748	S	S	*	*			trans	88.1	105.6	150	-101.3	-104.1	0	0	0	121.1
184	Y	28.7	Very low	31.9	Very low	202 Å²	202	158.8 Å²	158.8	79%	0.792	75%	0.747	S	S	*	*			trans	58.2	160	144.4	-67.7	-115.1	0	0	0	118.3
185	Q	31.6	Very low	31.6	Very low	153 Å²	153	158.3 Å²	158.3	72%	0.715	74%	0.744	S	S	*	*			cis	-145.2	152	13.2	-165.7	167.8	-17.3	0	0	111.3	Q187	Q185-Q187 VanDerWaalsContact NE2-OE1 3.15Å
186	Y	25.7	Very low	31.4	Very low	234 Å²	234	156.9 Å²	156.9	92%	0.918	74%	0.742	S	S	*	*			trans	-122.7	111.3	177.1	-134.6	-74.7	0	0	0	109.3
187	Q	31.1	Very low	30.9	Very low	143 Å²	143	155.4 Å²	155.4	67%	0.668	74%	0.736	S	S	*	*			trans	179.2	155.1	175.9	-102.6	154.4	2.5	0	0	108.4	Q185	Q185-Q187 VanDerWaalsContact NE2-OE1 3.15Å
188	Q	29.3	Very low	30.3	Very low	153 Å²	153	154.5 Å²	154.5	72%	0.715	74%	0.736	S	S	*	*			cis	-173.5	161.8	-30.7	-128.8	179.7	12.5	0	0	108.4
189	L	27.7	Very low	29.9	Very low	137 Å²	137	153.7 Å²	153.7	72%	0.717	74%	0.736	S	S	*	*			trans	65.9	164.2	158.7	-61.2	163	0	0	0	115.8
190	D	34.2	Very low	29.8	Very low	132 Å²	132	153 Å²	153	71%	0.706	74%	0.737	S	S	*	*			cis	-138.7	168.7	0.6	-143.6	-22.6	0	0	0	113.3
191	K	30	Very low	29.6	Very low	180 Å²	180	154.3 Å²	154.3	78%	0.783	75%	0.746	S	S	*	*			trans	-88.3	152.3	170.1	-56.6	170.1	-178.4	174.2	0	110.5
192	K	33.2	Very low	29.4	Very low	195 Å²	195	154.6 Å²	154.6	85%	0.848	75%	0.748	S	S	*	*				-166.8	151.2	127.1	-109.3	152.5	-171.9	166	0	113.9
193	D	29.3	Very low	29.5	Very low	135 Å²	135	153.6 Å²	153.6	72%	0.722	75%	0.747	S	S	*	*			trans	-75.5	159.8	177.2	-39.3	-98.7	0	0	0	111.1
194	N	33.2	Very low	29.4	Very low	156 Å²	156	152.5 Å²	152.5	83%	0.834	75%	0.746	S	S	*	*				-161.9	154.2	119.2	-110.2	-46.4	0	0	0	114.4
195	N	27	Very low	29.4	Very low	129 Å²	129	148 Å²	148	69%	0.69	74%	0.735	S	S	*	*			trans	-74.7	148.1	178	-55.9	-77.3	0	0	0	111.7
196	N	31.2	Very low	29.2	Very low	148 Å²	148	147.1 Å²	147.1	79%	0.791	74%	0.736	S	S	*	*				178.7	121.3	112.4	-80.8	-24.5	0	0	0	107.5
197	Q	26.3	Very low	29.5	Very low	161 Å²	161	141.6 Å²	141.6	75%	0.752	73%	0.727	S	S	*	*				61.6	133.4	69.7	-84.1	-153.7	26.3	0	0	115.5
198	L	24.7	Very low	29.3	Very low	136 Å²	136	142.2 Å²	142.2	71%	0.712	73%	0.729	S	S	*	*			trans	85.3	132.4	150.1	-71.9	162.6	0	0	0	121.3
199	I	26.9	Very low	29.4	Very low	146 Å²	146	139.7 Å²	139.7	75%	0.749	73%	0.729	S	S	*	*			trans	84.6	108.3	142.3	-68.5	163.2	0	0	0	119.1
200	N	32.9	Very low	29.4	Very low	154 Å²	154	140.4 Å²	140.4	82%	0.824	73%	0.731	S	S	*	*			trans	-55.7	151.5	152.4	-75	-22.9	0	0	0	110.4
201	P	31	Very low	29	Very low	106 Å²	106	138 Å²	138	69%	0.688	73%	0.725	S	S	*	*				-146.4	142.3	114.6	36.1	-21.2	0	0	0	116
202	H	26.5	Very low	28.9	Very low	160 Å²	160	135.8 Å²	135.8	74%	0.741	72%	0.722	S	S	*	*			trans	47.2	144	132	-83.9	-80.9	0	0	0	124
203	N	27.8	Very low	28.7	Very low	124 Å²	124	131.9 Å²	131.9	66%	0.663	72%	0.715	S	S	*	*			trans	71.3	156.6	140.8	-66.9	8.6	0	0	0	116.1
204	N	28.7	Very low	28.7	Very low	118 Å²	118	132.8 Å²	132.8	63%	0.631	72%	0.719	S	S	*	*			cis	-161.4	173.3	-8.2	-107.5	2.1	0	0	0	106
205	N	30.1	Very low	28.3	Very low	108 Å²	108	132.3 Å²	132.3	58%	0.578	72%	0.716	S	S	*	*			cis	-165.7	154.4	9.4	-124.6	-7.3	0	0	0	109.6
206	N	27.5	Very low	28.5	Very low	135 Å²	135	134 Å²	134	72%	0.722	73%	0.725	S	S	*	*			trans	63	160.7	148.4	-52.6	-19.7	0	0	0	118.7
207	T	30.3	Very low	28.1	Very low	118 Å²	118	132 Å²	132	72%	0.724	72%	0.722	S	S	*	*			cis	-133.5	167.2	10.7	29.2	0	0	0	0	112.7
208	Q	28.3	Very low	28.2	Very low	156 Å²	156	131.7 Å²	131.7	73%	0.729	72%	0.724	S	S	*	*			trans	-27.6	168.2	174.6	-68.3	105	-32.2	0	0	120.3
209	S	30.4	Very low	28.2	Very low	100 Å²	100	134.3 Å²	134.3	70%	0.699	73%	0.73	S	S	*	*			cis	-157	140.6	15.6	0.6	0	0	0	0	110.2
210	I	27.2	Very low	28	Very low	151 Å²	151	134.5 Å²	134.5	77%	0.774	73%	0.732	S	S	*	*				61.8	127	86.8	-56.9	167.7	0	0	0	113.8
211	S	27.2	Very low	27.6	Very low	81 Å²	81	137.3 Å²	137.3	57%	0.566	74%	0.737	S	S	*	*			cis	-168.3	171.7	-19.5	65.7	0	0	0	0	111.5
212	D	27.7	Very low	27.2	Very low	135 Å²	135	137.2 Å²	137.2	72%	0.722	73%	0.734	S	S	*	*			trans	61.4	153.5	143.5	-57	-27.7	0	0	0	122.8
213	T	28.4	Very low	27.2	Very low	113 Å²	113	136.7 Å²	136.7	69%	0.693	74%	0.742	S	S	*	*			cis	-162.3	-174.5	-20.7	35.6	0	0	0	0	109.4
214	L	29	Very low	26.9	Very low	154 Å²	154	137.8 Å²	137.8	81%	0.806	74%	0.743	S	S	*	*			trans	85.4	86.8	152.5	-72.5	162.8	0	0	0	119.9
215	N	24.4	Very low	26.8	Very low	145 Å²	145	138.4 Å²	138.4	78%	0.775	75%	0.751	S	S	*	*				4.4	138.2	124.1	-65.8	-29.6	0	0	0	118.6
216	N	31.1	Very low	26.4	Very low	165 Å²	165	142.4 Å²	142.4	88%	0.882	76%	0.758	S	S	*	*			trans	-149.6	143.1	131.3	-115.7	-44.2	0	0	0	111.7
217	S	24	Very low	26.4	Very low	105 Å²	105	143 Å²	143	73%	0.734	76%	0.756	S	S	*	*			trans	-147.1	123.7	-172.1	53.7	0	0	0	0	112.2
218	I	27.4	Very low	26.1	Very low	156 Å²	156	142.4 Å²	142.4	80%	0.8	75%	0.753	S	S	*	*			trans	-130.6	93.1	-175	-56.5	-174.8	0	0	0	112.4
219	K	25.2	Very low	25.9	Very low	190 Å²	190	140.4 Å²	140.4	83%	0.826	75%	0.752	S	S	*	*			trans	44.6	120.1	133.7	-62.7	179.3	-179.4	175.5	0	121.3
220	L	22	Very low	25.6	Very low	150 Å²	150	142.9 Å²	142.9	79%	0.785	75%	0.752	S	S	*	*			trans	-14.8	150.4	147.7	-67.3	69.5	0	0	0	118.2
221	K	25.7	Very low	25.5	Very low	214 Å²	214	143 Å²	143	93%	0.93	75%	0.753	S	S	*	*				-141.3	129.3	121	-116.2	176.1	-176.3	178.9	0	111.7
222	T	22.1	Very low	25.4	Very low	104 Å²	104	142.9 Å²	142.9	64%	0.638	75%	0.753	S	S	*	*			trans	-107.9	143.1	-178	-21	0	0	0	0	110.3
223	V	25.6	Very low	25.4	Very low	148 Å²	148	142.7 Å²	142.7	90%	0.897	75%	0.751	S	S	*	*			trans	-132.6	143.4	161.1	-179	0	0	0	0	107.9
224	Q	22.9	Very low	25.3	Very low	147 Å²	147	146 Å²	146	69%	0.687	76%	0.759	S	S	*	*			trans	-115.5	141.7	-168.4	-61.4	176.5	-12.7	0	0	112.8
225	T	25.5	Very low	25.2	Very low	132 Å²	132	142.8 Å²	142.8	81%	0.81	75%	0.75	S	S	*	*			trans	-163.3	116.7	139.1	24.4	0	0	0	0	105.9
226	R	22.7	Very low	25.2	Very low	191 Å²	191	142.6 Å²	142.6	72%	0.721	75%	0.749	S	S	*	*				62.1	125.9	69.5	-69.2	-173.9	-179.3	-170.5	2.7	111.4
227	H	26	Very low	25.1	Very low	147 Å²	147	141 Å²	141	68%	0.681	74%	0.74	S	S	*	*			cis	-149.9	163.3	22	-101.4	-73.1	0	0	0	114.1
228	T	24.4	Very low	25.2	Very low	107 Å²	107	142 Å²	142	66%	0.656	74%	0.737	S	S	*	*			trans	49.1	108.9	148.3	52.5	0	0	0	0	119.9
229	T	24.5	Very low	25.2	Very low	114 Å²	114	140.9 Å²	140.9	70%	0.699	73%	0.733	S	S	*	*				74.6	150	83.9	61.5	0	0	0	0	114.4
230	E	25	Very low	25.2	Very low	152 Å²	152	138.3 Å²	138.3	71%	0.71	73%	0.727	S	S	*	*			cis	-155.9	149.7	28.4	-137.4	134.5	-91	0	0	113.9
231	L	25.4	Very low	25.2	Very low	153 Å²	153	139 Å²	139	80%	0.801	73%	0.726	S	S	*	*			trans	36.7	155.8	149.1	-58.9	172.7	0	0	0	123.9
232	S	24.9	Very low	25.2	Very low	79 Å²	79	136.8 Å²	136.8	55%	0.552	72%	0.722	S	S	*	*			cis	-173.2	179.4	-29.3	65.2	0	0	0	0	111.6
233	N	26.2	Very low	25.2	Very low	130 Å²	130	139.8 Å²	139.8	70%	0.695	73%	0.734	S	S	*	*			trans	79.9	110	164.7	-52.3	-11.7	0	0	0	116
234	Q	26.4	Very low	25.1	Very low	183 Å²	183	140.8 Å²	140.8	86%	0.855	73%	0.733	S	S	*	*				76.6	135	62.6	-72.6	-174.8	6.1	0	0	113.3
235	S	26.9	Very low	25.1	Very low	87 Å²	87	138.6 Å²	138.6	61%	0.608	73%	0.734	S	S	*	*			cis	-158.4	166.7	1.5	61.6	0	0	0	0	112.2
236	N	25.6	Very low	24.9	Very low	140 Å²	140	143.2 Å²	143.2	75%	0.749	74%	0.737	S	S	*	*			trans	54.1	145.8	142.7	-61.4	-8	0	0	0	120.4
237	N	28.5	Very low	25	Very low	132 Å²	132	140.9 Å²	140.9	71%	0.706	73%	0.734	S	S	*	*			cis	-149.6	156.9	13.2	-134.9	-20	0	0	0	113.4
238	N	26.3	Very low	24.9	Very low	127 Å²	127	144.4 Å²	144.4	68%	0.679	74%	0.743	S	S	*	*			trans	-56.1	151.8	177.7	-52.8	-61.4	0	0	0	112.4
239	N	26.2	Very low	25	Very low	132 Å²	132	147.9 Å²	147.9	71%	0.706	75%	0.751	S	S	*	*				179.5	149	81.8	-96.4	-47.3	0	0	0	114
240	I	25.2	Very low	25.2	Very low	135 Å²	135	146.3 Å²	146.3	69%	0.692	75%	0.745	S	S	*	*			trans	53.5	130.8	132.6	-62.4	169.8	0	0	0	118.4
241	Q	23.9	Very low	25.3	Very low	166 Å²	166	146.4 Å²	146.4	78%	0.776	75%	0.745	S	S	*	*			cis	-165.3	136.7	-5.4	-110.6	171.3	2.7	0	0	106.4
242	I	25.5	Very low	25.4	Very low	166 Å²	166	143.2 Å²	143.2	85%	0.851	74%	0.736	S	S	*	*			trans	-136.5	104.7	161.3	-60.4	-176.4	0	0	0	110.1
243	L	21.9	Very low	25.4	Very low	167 Å²	167	143.7 Å²	143.7	87%	0.874	74%	0.738	S	S	*	*			trans	-77.6	131.8	152.4	-80.1	160.3	0	0	0	108.4
244	L	23.9	Very low	25.4	Very low	170 Å²	170	140.2 Å²	140.2	89%	0.89	72%	0.719	S	S	*	*			trans	-168.9	154.1	145.7	-107.1	168.3	0	0	0	110
245	S	22.5	Very low	25.5	Very low	101 Å²	101	138.3 Å²	138.3	71%	0.706	71%	0.714	S	S	*	*			trans	-122.9	141.3	-154.7	49.7	0	0	0	0	115.9
246	R	22	Very low	25.5	Very low	228 Å²	228	144 Å²	144	86%	0.86	72%	0.724	S	S	*	*			trans	41.3	103.8	150.7	-68.4	178.8	165.7	179.7	-5.3	118.3
247	Q	23	Very low	25.5	Very low	142 Å²	142	142.6 Å²	142.6	66%	0.664	72%	0.722	S	S	*	*				-173.4	175.2	109.3	-101.8	171.8	-8.7	0	0	111.7
248	Y	24.7	Very low	25.3	Very low	222 Å²	222	146.9 Å²	146.9	87%	0.871	73%	0.73	S	S	*	*			trans	76.5	111.4	-171.9	-51.9	-75.1	0	0	0	116.2
249	H	26.1	Very low	25.2	Very low	180 Å²	180	148.9 Å²	148.9	83%	0.833	74%	0.741	S	S	*	*			trans	-103.3	139.7	150.6	-94.3	-85.1	0	0	0	108
250	S	28.4	Very low	25.1	Very low	80 Å²	80	150.4 Å²	150.4	56%	0.559	75%	0.746	S	S	*	*			trans	-90.7	152.3	167.4	52.5	0	0	0	0	110.7	S252	S250-S252 PolarHBondContact O-N 3.08Å; S250-S252 PolarHBondContact OG-OG 2.79Å
251	E	27.5	Very low	25	Very low	154 Å²	154	151.9 Å²	151.9	72%	0.72	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	49.1	-179.2	-63.8	-173.9	111.7	0	0	112.7	K661	E251-K661 IonicContact OE1-NZ 3.27Å; E251-K661 PolarHBondContact OE1-NZ 3.3Å
252	S	27.6	Very low	25	Very low	87 Å²	87	150 Å²	150	61%	0.608	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-139.3	9.5	-170.4	64.1	0	0	0	0	114.4	S250	S250-S252 PolarHBondContact O-N 3.08Å; S250-S252 PolarHBondContact OG-OG 2.79Å
253	C	25.4	Very low	25	Very low	88 Å²	88	150.2 Å²	150.2	60%	0.595	74%	0.742	S	S	*	*			trans	-116.8	85.1	179.3	-66.5	0	0	0	0	110.3
254	L	26.3	Very low	25.1	Very low	58 Å²	58	149.3 Å²	149.3	30%	0.304	74%	0.736	S	S	.	*			trans	-129.8	69.7	-176.2	-73.5	165.6	0	0	0	110.4	T702 L704	L254-T702 HydrophobicContact CD1-CG2 3.77Å; L254-L704 HydrophobicContact CB-CD2 3.77Å; L254-L704 HydrophobicContact CD1-CD1 4.19Å; L254-L704 HydrophobicContact CD1-CD2 3.86Å; L254-L704 HydrophobicContact CD1-CG 4.05Å; L254-L704 HydrophobicContact CD2-CD1 4.4Å; L254-L704 HydrophobicContact CD2-CD2 4.28Å; L254-L704 HydrophobicContact CG-CD2 4.18Å
255	L	28	Very low	25.2	Very low	142 Å²	142	149 Å²	149	74%	0.743	73%	0.73	S	S	*	*			trans	-168.3	155.4	170.9	-109.1	156.6	0	0	0	111.2
256	Y	27.3	Very low	25.3	Very low	206 Å²	206	150.9 Å²	150.9	81%	0.808	73%	0.732	S	S	*	*			trans	69	109.8	174.9	-68	-74.2	0	0	0	120
257	P	26.1	Very low	25.3	Very low	111 Å²	111	145.1 Å²	145.1	72%	0.721	73%	0.725	S	S	*	*			trans	-80.3	149.3	155.5	34.3	-32.3	0	0	0	111.7
258	Y	24.3	Very low	25.2	Very low	223 Å²	223	145.1 Å²	145.1	88%	0.875	73%	0.729	S	S	*	*			trans	24.3	102.7	159.4	-68	-92	0	0	0	119.5
259	N	23.8	Very low	25.2	Very low	168 Å²	168	142.8 Å²	142.8	90%	0.898	73%	0.726	S	S	*	*				-158	153.4	116.8	-120.3	-34.4	0	0	0	113.4
260	M	22.7	Very low	25	Very low	164 Å²	164	142.5 Å²	142.5	81%	0.808	73%	0.728	S	S	*	*			trans	-92.4	122.4	177.8	-68.2	-72.1	-168.1	0	0	110.7
261	H	24.2	Very low	24.8	Very low	166 Å²	166	146.2 Å²	146.2	77%	0.769	74%	0.737	S	S	*	*				172.7	132.9	123.1	-94.7	-63.6	0	0	0	114.2
262	N	23.7	Very low	24.6	Very low	127 Å²	127	148.7 Å²	148.7	68%	0.679	74%	0.741	S	S	*	*			trans	50.1	105.5	144.2	-58.3	7.9	0	0	0	121.6
263	H	24.8	Very low	24.4	Very low	170 Å²	170	150.8 Å²	150.8	79%	0.787	74%	0.741	S	S	*	*			trans	63.6	82.9	133.7	-66.5	-73.9	0	0	0	121.4
264	I	25	Very low	24.3	Very low	149 Å²	149	154.5 Å²	154.5	76%	0.764	75%	0.754	S	S	*	*				28.7	120.9	115.5	-55.1	167.5	0	0	0	117.5
265	H	25.3	Very low	24.2	Very low	164 Å²	164	157.2 Å²	157.2	76%	0.759	77%	0.769	S	S	*	*				-157	144.1	130	-121.2	-80.9	0	0	0	113.5
266	N	24.1	Very low	24	Very low	140 Å²	140	157 Å²	157	75%	0.749	77%	0.768	S	S	*	*			trans	69.6	149.6	163.1	-56.9	-22.2	0	0	0	118.9
267	C	21.9	Very low	23.8	Very low	106 Å²	106	153.3 Å²	153.3	72%	0.716	77%	0.77	S	S	*	*			cis	-168.4	179.7	-27.1	-166.9	0	0	0	0	109.9
268	L	22.8	Very low	23.8	Very low	142 Å²	142	152.8 Å²	152.8	74%	0.743	77%	0.769	S	S	*	*			trans	81.7	154.6	168.2	-66.9	109.1	0	0	0	119.7
269	H	23.4	Very low	23.8	Very low	173 Å²	173	150.8 Å²	150.8	80%	0.801	77%	0.765	S	S	*	*			trans	76.8	41.9	175.8	-52.7	116.1	0	0	0	119.4
270	I	23.3	Very low	23.9	Very low	174 Å²	174	148 Å²	148	89%	0.892	76%	0.759	S	S	*	*			trans	-115	95.7	136.8	-60.3	-179.4	0	0	0	107.8
271	H	22.9	Very low	24	Very low	159 Å²	159	146.6 Å²	146.6	74%	0.736	75%	0.753	S	S	*	*			trans	-154.7	77.5	178.1	-163	-55.3	0	0	0	112.6
272	Y	23.1	Very low	24.2	Very low	205 Å²	205	145 Å²	145	80%	0.804	75%	0.75	S	S	*	*	S	Bend	trans	-165.7	157	146.2	-109.7	-70.4	0	0	0	112.2
273	H	23.5	Very low	24.3	Very low	132 Å²	132	149.2 Å²	149.2	61%	0.611	76%	0.763	S	S	*	*	S	Bend	trans	54.2	63.6	167.3	-76.4	-78.1	0	0	0	119.6
274	L	24.2	Very low	24.4	Very low	166 Å²	166	149.1 Å²	149.1	87%	0.869	76%	0.763	S	S	*	*	S	Bend	trans	-149.2	44.5	141.5	-117.7	173.4	0	0	0	113.1
275	N	23.6	Very low	24.6	Very low	115 Å²	115	148.5 Å²	148.5	62%	0.615	76%	0.759	S	S	*	*			trans	-153.8	81.2	169.8	-97.5	-79.2	0	0	0	110.9
276	L	23.3	Very low	24.6	Very low	138 Å²	138	148 Å²	148	72%	0.723	76%	0.762	S	S	*	*			trans	-116.6	152.7	151.6	-88.6	84.9	0	0	0	108.1
277	C	23.7	Very low	24.7	Very low	127 Å²	127	147.8 Å²	147.8	86%	0.858	76%	0.761	S	S	*	*	S	Bend	trans	60.1	81.2	178.7	-60.2	0	0	0	0	116.3
278	S	25.2	Very low	25	Very low	100 Å²	100	149.8 Å²	149.8	70%	0.699	77%	0.765	S	S	*	*	S	Bend	trans	170.3	-20.9	135.9	44.7	0	0	0	0	114.8	S280	S278-S280 PolarHBondContact O-N 2.89Å
279	K	24.8	Very low	25.2	Very low	181 Å²	181	150.3 Å²	150.3	79%	0.787	77%	0.768	S	S	*	*			trans	-79.2	55.9	179.6	-70.6	-176.1	177.7	175.1	0	113.7
280	S	26.1	Very low	25.6	Very low	110 Å²	110	149 Å²	149	77%	0.769	77%	0.768	S	S	*	*	S	Bend	trans	-140	26.4	175.3	63.9	0	0	0	0	113.1	S278	S278-S280 PolarHBondContact O-N 2.89Å
281	I	26.1	Very low	25.9	Very low	134 Å²	134	146.3 Å²	146.3	69%	0.687	76%	0.755	S	S	*	*	S	Bend	trans	-152	162.7	168.3	-91	137.5	0	0	0	105.7
282	N	26.4	Very low	26.2	Very low	132 Å²	132	145.7 Å²	145.7	71%	0.706	76%	0.755	S	S	*	*			trans	71.7	30	-176.8	-56.1	-15.7	0	0	0	116.8
283	K	26.4	Very low	26.5	Very low	216 Å²	216	144.4 Å²	144.4	94%	0.939	75%	0.754	S	S	*	*	S	Bend	trans	-109.6	23	148.3	-112.7	-168.4	178.7	-169.5	0	113.1
284	Q	26.8	Very low	26.7	Very low	168 Å²	168	145.9 Å²	145.9	79%	0.785	76%	0.758	S	S	*	*	S	Bend	trans	-145.5	173.1	162.2	-86.9	173.2	-10	0	0	105.8
285	I	29	Very low	26.9	Very low	136 Å²	136	143.3 Å²	143.3	70%	0.697	75%	0.745	S	S	*	*			trans	67.8	49.7	-166.8	-36.9	176.7	0	0	0	112.2	N287	I285-N287 WeakPolarHBondContact CG2-O 3.37Å
286	N	26.2	Very low	27	Very low	153 Å²	153	141.1 Å²	141.1	82%	0.818	74%	0.739	S	S	*	*				-66.2	152.9	126.5	-101.3	-7.3	0	0	0	107.7
287	N	26.7	Very low	27.2	Very low	137 Å²	137	141 Å²	141	73%	0.733	73%	0.734	S	S	*	*	S	Bend	trans	76.5	153.6	-175.3	-50.4	-19.1	0	0	0	115.4	I285	I285-N287 WeakPolarHBondContact CG2-O 3.37Å
288	N	27.5	Very low	27.3	Very low	148 Å²	148	142.1 Å²	142.1	79%	0.791	73%	0.727	S	S	*	*			trans	67.3	65.1	173.9	-61.1	-7.7	0	0	0	116.9	N290	N288-N290 PolarHBondContact O-N 2.9Å; N288-N290 VanDerWaalsContact O-N 3.15Å
289	N	27.7	Very low	27.3	Very low	152 Å²	152	144 Å²	144	81%	0.813	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-36.1	115	140.2	-68.7	-36.9	0	0	0	110.9
290	N	31	Very low	27.3	Very low	147 Å²	147	138.9 Å²	138.9	79%	0.786	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	179.7	-32.3	153.2	-97.1	-31.8	0	0	0	113.3	N288 I292	N288-N290 PolarHBondContact O-N 2.9Å; N288-N290 VanDerWaalsContact O-N 3.15Å; N290-I292 PolarHBondContact O-N 3.03Å
291	N	28.9	Very low	27.2	Very low	116 Å²	116	139.9 Å²	139.9	62%	0.62	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	-7.3	-168.5	-77.2	-36	0	0	0	116.4	K293 K294	N291-K293 PolarHBondContact O-N 2.7Å; N291-K294 WeakPolarHBondContact O-CB 3.42Å; N291-K294 PolarHBondContact O-N 2.9Å
292	I	29.6	Very low	27.1	Very low	147 Å²	147	139.4 Å²	139.4	75%	0.754	71%	0.71	S	S	*	*	H	α-helix	trans	-62.9	-28.4	-179.3	-65.8	176.4	0	0	0	112.1	N290 K294	N290-I292 PolarHBondContact O-N 3.03Å; I292-K294 VanDerWaalsContact C-N 3.26Å; I292-K294 PolarHBondContact O-N 2.82Å
293	K	29.5	Very low	26.9	Very low	178 Å²	178	142.3 Å²	142.3	77%	0.774	72%	0.716	S	S	*	*	H	α-helix	trans	-75.2	-4.8	173.1	-72.6	-175.4	176.4	178.7	0	114.8	N291 S296	N291-K293 PolarHBondContact O-N 2.7Å; K293-S296 PolarHBondContact O-OG 3.03Å; K293-S296 VanDerWaalsContact O-OG 3.09Å
294	K	28.9	Very low	26.7	Very low	162 Å²	162	139.6 Å²	139.6	70%	0.704	71%	0.711	S	S	*	*	H	α-helix	trans	-96.8	-31.5	179	-124.6	173.7	-177	176.9	0	112.9	N291 I292	N291-K294 WeakPolarHBondContact O-CB 3.42Å; N291-K294 PolarHBondContact O-N 2.9Å; I292-K294 VanDerWaalsContact C-N 3.26Å; I292-K294 PolarHBondContact O-N 2.82Å
295	L	26.8	Very low	26.4	Very low	113 Å²	113	139.5 Å²	139.5	59%	0.592	71%	0.711	S	S	*	*	H	α-helix	trans	-76.5	-27.7	175.2	-87.3	155.2	0	0	0	113.2	H297 Q298	L295-H297 PolarHBondContact O-N 3.45Å; L295-H297 VanDerWaalsContact O-N 3.1Å; L295-Q298 PolarHBondContact O-N 3.1Å; L295-Q298 VanDerWaalsContact O-N 3.16Å
296	S	26.8	Very low	26	Very low	68 Å²	68	138.2 Å²	138.2	48%	0.476	71%	0.713	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.4	-15.3	173.8	52.8	0	0	0	0	114.5	K293	K293-S296 PolarHBondContact O-OG 3.03Å; K293-S296 VanDerWaalsContact O-OG 3.09Å
297	H	27.2	Very low	25.8	Very low	136 Å²	136	135.5 Å²	135.5	63%	0.63	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.4	0.4	177.8	-75.3	-66.5	0	0	0	114.8	L295 S300	L295-H297 PolarHBondContact O-N 3.45Å; L295-H297 VanDerWaalsContact O-N 3.1Å; H297-S300 PolarHBondContact O-OG 3.18Å
298	Q	26.2	Very low	25.7	Very low	150 Å²	150	139 Å²	139	70%	0.701	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	-29.2	170.7	-71.4	-166	-33.8	0	0	112.7	L295 S300	L295-Q298 PolarHBondContact O-N 3.1Å; L295-Q298 VanDerWaalsContact O-N 3.16Å; Q298-S300 PolarHBondContact O-N 2.82Å
299	L	25.1	Very low	25.4	Very low	139 Å²	139	139.8 Å²	139.8	73%	0.728	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.6	-9.5	173.1	-77.7	161.8	0	0	0	114
300	S	24.4	Very low	25.2	Very low	75 Å²	75	140.8 Å²	140.8	52%	0.524	71%	0.709	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.6	-6.9	-179.6	56.3	0	0	0	0	115.2	H297 Q298	H297-S300 PolarHBondContact O-OG 3.18Å; Q298-S300 PolarHBondContact O-N 2.82Å
301	N	24.2	Very low	25	Very low	131 Å²	131	142.4 Å²	142.4	70%	0.701	71%	0.711	S	S	*	*			trans	-105.8	2.4	-173.3	-82.6	-12.2	0	0	0	115.2	K303	N301-K303 PolarHBondContact O-N 3.13Å
302	I	24.6	Very low	24.9	Very low	124 Å²	124	141.6 Å²	141.6	64%	0.636	72%	0.715	S	S	*	*			trans	-75.7	81.4	171.8	-53.2	-178.4	0	0	0	109.1	L304	I302-L304 VanDerWaalsContact C-N 3.27Å; I302-L304 HydrophobicContact CG2-CG 4.31Å; I302-L304 PolarHBondContact O-N 2.87Å
303	K	21	Very low	25	Very low	193 Å²	193	138.2 Å²	138.2	84%	0.839	70%	0.698	S	S	*	*			trans	-64.1	89.3	163	-79.7	-179.8	176.2	174.9	0	108.8	N301 Q305	N301-K303 PolarHBondContact O-N 3.13Å; K303-Q305 VanDerWaalsContact C-N 3.3Å; K303-Q305 PolarHBondContact O-N 3.02Å
304	L	22.5	Very low	25.2	Very low	158 Å²	158	133.6 Å²	133.6	83%	0.827	69%	0.685	S	S	*	*			trans	-61.4	94	163.5	-81.8	167.8	0	0	0	108.5	I302 S306	I302-L304 VanDerWaalsContact C-N 3.27Å; I302-L304 HydrophobicContact CG2-CG 4.31Å; I302-L304 PolarHBondContact O-N 2.87Å; L304-S306 PolarHBondContact O-N 3.16Å; L304-S306 VanDerWaalsContact O-N 3.15Å
305	Q	21.1	Very low	25.3	Very low	167 Å²	167	129.7 Å²	129.7	78%	0.78	68%	0.675	S	S	*	*			trans	-61.1	116.4	171	-79.2	-175.7	-53.8	0	0	108.8	K303 S307	K303-Q305 VanDerWaalsContact C-N 3.3Å; K303-Q305 PolarHBondContact O-N 3.02Å; Q305-S307 PolarHBondContact O-N 3.48Å
306	S	21	Very low	25.5	Very low	108 Å²	108	127.6 Å²	127.6	76%	0.755	66%	0.664	S	S	*	*			trans	-70.2	67.3	172.6	44	0	0	0	0	111.2	L304 Y308	L304-S306 PolarHBondContact O-N 3.16Å; L304-S306 VanDerWaalsContact O-N 3.15Å; S306-Y308 PolarHBondContact O-N 3.29Å
307	S	21.9	Very low	26	Very low	96 Å²	96	128.2 Å²	128.2	67%	0.671	66%	0.662	S	S	*	*			trans	-76.1	119.1	168.8	50.7	0	0	0	0	109.1	Q305 M309	Q305-S307 PolarHBondContact O-N 3.48Å; S307-M309 PolarHBondContact O-N 3.35Å
308	Y	23	Very low	26.3	Very low	212 Å²	212	125.3 Å²	125.3	83%	0.831	65%	0.65	S	S	*	*			trans	-71	102.9	-174	-76.2	-107.8	0	0	0	110.7	S306 K310	S306-Y308 PolarHBondContact O-N 3.29Å; Y308-K310 VanDerWaalsContact C-N 3.26Å; Y308-K310 PolarHBondContact O-N 3.33Å
309	M	22.7	Very low	26.6	Very low	163 Å²	163	121.9 Å²	121.9	80%	0.803	64%	0.642	S	S	*	*			trans	-67.9	79.3	170.8	-91.1	-84.5	168	0	0	111.1	S307 H311	S307-M309 PolarHBondContact O-N 3.35Å; M309-H311 PolarHBondContact O-N 3.27Å
310	K	23.9	Very low	27.1	Very low	174 Å²	174	118 Å²	118	76%	0.757	63%	0.626	S	S	*	*			trans	-60.8	123.4	163	-72.3	-176.1	175.6	-178.3	0	108.4	Y308 S312	Y308-K310 VanDerWaalsContact C-N 3.26Å; Y308-K310 PolarHBondContact O-N 3.33Å; K310-S312 PolarHBondContact O-N 3.42Å
311	H	25.7	Very low	27.6	Very low	181 Å²	181	116.6 Å²	116.6	84%	0.838	61%	0.612	S	S	*	*			trans	-69.6	85.6	-173.8	-63.8	-59	0	0	0	112.7	M309	M309-H311 PolarHBondContact O-N 3.27Å
312	S	26.8	Very low	28.2	Very low	99 Å²	99	113.8 Å²	113.8	69%	0.692	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-71.7	154.9	160.7	51	0	0	0	0	110.6	K310 T314	K310-S312 PolarHBondContact O-N 3.42Å; S312-T314 PolarHBondContact O-N 3.18Å
313	L	31	Very low	28.7	Very low	75 Å²	75	112.4 Å²	112.4	39%	0.393	59%	0.59	S	S	.	*	P	Polyproline II helix	trans	-65.2	120.3	174.6	-77.8	158.6	0	0	0	109.5	N317 I318 C332	L313-N317 HydrophobicContact CD2-CB 3.9Å; L313-I318 HydrophobicContact CB-CD1 4.27Å; L313-I318 HydrophobicContact CB-CG1 4.03Å; L313-C332 HydrophobicContact CD1-CB 4.06Å
314	T	34.5	Very low	29.3	Very low	81 Å²	81	105.8 Å²	105.8	50%	0.497	56%	0.563	S	S	.	*	P	Polyproline II helix	trans	-61.5	150.6	170.7	50.9	0	0	0	0	110.5	S312 N316 N317 I318	S312-T314 PolarHBondContact O-N 3.18Å; T314-N316 PolarHBondContact O-N 2.94Å; T314-N317 WeakPolarHBondContact O-CB 3.36Å; T314-N317 PolarHBondContact O-N 3.24Å; T314-N317 PolarHBondContact OG1-ND2 3.42Å; T314-I318 PolarHBondContact O-N 3.42Å
315	T	31.6	Very low	29.7	Very low	81 Å²	81	103.4 Å²	103.4	50%	0.497	55%	0.551	S	S	.	*	H	α-helix	trans	-48.8	-44.2	-179.5	38.3	0	0	0	0	112.7	N317 I318 C319 F409	T315-N317 VanDerWaalsContact C-N 3.31Å; T315-N317 PolarHBondContact O-N 3.32Å; T315-I318 PolarHBondContact O-N 3.13Å; T315-I318 VanDerWaalsContact O-N 3.12Å; T315-C319 PolarHBondContact O-N 3.14Å; T315-C319 PolarHBondContact O-SG 2.96Å; T315-F409 HydrophobicContact CG2-CZ 4.25Å
316	N	31.2	Very low	30.2	Very low	68 Å²	68	96.5 Å²	96.5	36%	0.364	52%	0.521	S	S	.	.	H	α-helix	trans	-58.5	-40.2	178.3	-62.4	20.3	0	0	0	112.5	I68 T314 I318 C319 C320	I68-N316 WeakPolarHBondContact CG2-ND2 3.22Å; T314-N316 PolarHBondContact O-N 2.94Å; N316-I318 VanDerWaalsContact C-N 3.29Å; N316-I318 PolarHBondContact O-N 2.92Å; N316-C319 PolarHBondContact O-N 3.29Å; N316-C320 PolarHBondContact O-N 3.06Å; N316-C320 PolarHBondContact O-SG 3.23Å
317	N	35.8	Very low	30.8	Very low	81 Å²	81	96.1 Å²	96.1	43%	0.433	51%	0.514	S	S	.	.	H	α-helix	trans	-68	-30.7	179.7	-69.4	-10.4	0	0	0	112	L313 T314 T315 L321	L313-N317 HydrophobicContact CD2-CB 3.9Å; T314-N317 WeakPolarHBondContact O-CB 3.36Å; T314-N317 PolarHBondContact O-N 3.24Å; T314-N317 PolarHBondContact OG1-ND2 3.42Å; T315-N317 VanDerWaalsContact C-N 3.31Å; T315-N317 PolarHBondContact O-N 3.32Å; N317-L321 WeakPolarHBondContact O-CG 3.41Å; N317-L321 PolarHBondContact O-N 2.89Å
318	I	33.3	Very low	31.1	Very low	76 Å²	76	93.3 Å²	93.3	39%	0.39	49%	0.493	S	S	.	.	H	α-helix	trans	-72.2	-45.3	174.5	-59.8	176.7	0	0	0	109.8	L313 T314 T315 N316 C320 L321 Y322	L313-I318 HydrophobicContact CB-CD1 4.27Å; L313-I318 HydrophobicContact CB-CG1 4.03Å; T314-I318 PolarHBondContact O-N 3.42Å; T315-I318 PolarHBondContact O-N 3.13Å; T315-I318 VanDerWaalsContact O-N 3.12Å; N316-I318 VanDerWaalsContact C-N 3.29Å; N316-I318 PolarHBondContact O-N 2.92Å; I318-C320 VanDerWaalsContact C-N 3.32Å; I318-C320 PolarHBondContact O-N 3.35Å; I318-L321 PolarHBondContact O-N 2.7Å; I318-L321 VanDerWaalsContact O-N 3.09Å; I318-Y322 HydrophobicContact CG2-CD2 4.06Å; I318-Y322 HydrophobicContact CG2-CE2 4.04Å; I318-Y322 WeakPolarHBondContact O-CD2 3.31Å; I318-Y322 PolarHBondContact O-N 2.99Å; I318-Y322 VanDerWaalsContact O-N 3.12Å
319	C	33.7	Very low	31.4	Very low	77 Å²	77	85.7 Å²	85.7	52%	0.52	47%	0.471	S	S	.	.	H	α-helix	trans	-57.1	-43.9	174.2	-65.8	0	0	0	0	112	T315 N316 L321 Y322 T323	T315-C319 PolarHBondContact O-N 3.14Å; T315-C319 PolarHBondContact O-SG 2.96Å; N316-C319 PolarHBondContact O-N 3.29Å; C319-L321 VanDerWaalsContact C-N 3.29Å; C319-L321 PolarHBondContact O-N 3.07Å; C319-Y322 PolarHBondContact O-N 2.99Å; C319-T323 PolarHBondContact O-N 3.5Å; C319-T323 PolarHBondContact O-OG1 3.38Å
320	C	34.9	Very low	31.7	Very low	58 Å²	58	83.8 Å²	83.8	39%	0.392	46%	0.464	S	S	.	.	H	α-helix	trans	-63	-29.6	175.8	-69.3	0	0	0	0	113.9	N316 I318 T323 L324	N316-C320 PolarHBondContact O-N 3.06Å; N316-C320 PolarHBondContact O-SG 3.23Å; I318-C320 VanDerWaalsContact C-N 3.32Å; I318-C320 PolarHBondContact O-N 3.35Å; C320-T323 WeakPolarHBondContact CA-OG1 3.48Å; C320-T323 PolarHBondContact O-OG1 2.87Å; C320-L324 WeakPolarHBondContact O-CB 3.47Å; C320-L324 VanDerWaalsContact O-CD1 3.31Å; C320-L324 WeakPolarHBondContact O-CD1 3.37Å; C320-L324 WeakPolarHBondContact O-CG 3.2Å; C320-L324 PolarHBondContact O-N 2.81Å
321	L	36.2	Very low	31.9	Very low	45 Å²	45	81.9 Å²	81.9	24%	0.236	46%	0.458	C	S	.	.	H	α-helix	trans	-73.7	-38.7	174.4	-73.6	166.4	0	0	0	111.5	N317 I318 C319 L324 N325 C326 P328	N317-L321 WeakPolarHBondContact O-CG 3.41Å; N317-L321 PolarHBondContact O-N 2.89Å; I318-L321 PolarHBondContact O-N 2.7Å; I318-L321 VanDerWaalsContact O-N 3.09Å; C319-L321 VanDerWaalsContact C-N 3.29Å; C319-L321 PolarHBondContact O-N 3.07Å; L321-L324 PolarHBondContact O-N 3.46Å; L321-N325 PolarHBondContact O-N 3.15Å; L321-C326 HydrophobicContact CB-CB 4.45Å; L321-C326 HydrophobicContact CD2-CB 3.79Å; L321-C326 WeakPolarHBondContact O-CB 3.38Å; L321-C326 PolarHBondContact O-N 3.05Å; L321-P328 HydrophobicContact CD1-CB 4.43Å
322	Y	34.9	Very low	32.2	Very low	72 Å²	72	76.7 Å²	76.7	28%	0.282	44%	0.441	S	S	.	.	H	α-helix	trans	-67.6	-42.2	175.4	-87.3	-93.5	0	0	0	112.6	I318 C319 L324 N325 L404 Y410 I421	I318-Y322 HydrophobicContact CG2-CD2 4.06Å; I318-Y322 HydrophobicContact CG2-CE2 4.04Å; I318-Y322 WeakPolarHBondContact O-CD2 3.31Å; I318-Y322 PolarHBondContact O-N 2.99Å; I318-Y322 VanDerWaalsContact O-N 3.12Å; C319-Y322 PolarHBondContact O-N 2.99Å; Y322-L324 PolarHBondContact O-N 2.76Å; Y322-N325 PolarHBondContact O-N 2.81Å; Y322-N325 VanDerWaalsContact O-N 3.16Å; Y322-L404 WeakPolarHBondContact OH-CD1 3.27Å; Y322-Y410 PolarHBondContact OH-OH 3.18Å; Y322-I421 HydrophobicContact CE1-CD1 4.47Å
323	T	36.5	Very low	32.3	Very low	96 Å²	96	76.1 Å²	76.1	59%	0.589	43%	0.429	S	S	*	.	H	α-helix	trans	-68	-16.2	177	53.7	0	0	0	0	113.9	C319 C320 W420	C319-T323 PolarHBondContact O-N 3.5Å; C319-T323 PolarHBondContact O-OG1 3.38Å; C320-T323 WeakPolarHBondContact CA-OG1 3.48Å; C320-T323 PolarHBondContact O-OG1 2.87Å; T323-W420 HydrophobicContact CG2-CH2 4.44Å
324	L	32.7	Very low	32.3	Very low	54 Å²	54	76.2 Å²	76.2	28%	0.283	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	5.4	175.3	-67.1	172.7	0	0	0	113.8	R120 L123 C320 L321 Y322 C326	R120-L324 PolarHBondContact NE-O 2.92Å; R120-L324 PolarHBondContact NH2-O 2.87Å; L123-L324 HydrophobicContact CD2-CD1 3.74Å; L123-L324 HydrophobicContact CD2-CD2 4.48Å; C320-L324 WeakPolarHBondContact O-CB 3.47Å; C320-L324 VanDerWaalsContact O-CD1 3.31Å; C320-L324 WeakPolarHBondContact O-CD1 3.37Å; C320-L324 WeakPolarHBondContact O-CG 3.2Å; C320-L324 PolarHBondContact O-N 2.81Å; L321-L324 PolarHBondContact O-N 3.46Å; Y322-L324 PolarHBondContact O-N 2.76Å; L324-C326 HydrophobicContact CB-CB 4.4Å; L324-C326 PolarHBondContact O-N 3.04Å; L324-C326 PolarHBondContact O-SG 3.05Å
325	N	31.7	Very low	32	Very low	107 Å²	107	79.9 Å²	79.9	57%	0.572	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	37	-171.1	-75.2	-22.4	0	0	0	112.6	R120 L321 Y322	R120-N325 PolarHBondContact NH2-O 2.78Å; L321-N325 PolarHBondContact O-N 3.15Å; Y322-N325 PolarHBondContact O-N 2.81Å; Y322-N325 VanDerWaalsContact O-N 3.16Å
326	C	32	Very low	31.9	Very low	23 Å²	23	81.6 Å²	81.6	16%	0.155	47%	0.465	C	S	.	.	P	Polyproline II helix	trans	-99.5	120.2	-176.7	-73.9	0	0	0	0	111.1	L321 L324 P328	L321-C326 HydrophobicContact CB-CB 4.45Å; L321-C326 HydrophobicContact CD2-CB 3.79Å; L321-C326 WeakPolarHBondContact O-CB 3.38Å; L321-C326 PolarHBondContact O-N 3.05Å; L324-C326 HydrophobicContact CB-CB 4.4Å; L324-C326 PolarHBondContact O-N 3.04Å; L324-C326 PolarHBondContact O-SG 3.05Å; C326-P328 WeakPolarHBondContact O-CD 3.4Å
327	V	32.6	Very low	31.7	Very low	100 Å²	100	85.5 Å²	85.5	61%	0.606	48%	0.484	S	S	*	.	P	Polyproline II helix	trans	-74	120.2	173.8	-176.7	0	0	0	0	109.4	F401	V327-F401 HydrophobicContact CG2-CZ 3.96Å
328	P	29.3	Very low	31.3	Very low	36 Å²	36	86.7 Å²	86.7	23%	0.234	50%	0.499	C	S	.	.	P	Polyproline II helix	trans	-66.1	142	172.1	27	-33	0	0	0	110.7	L321 C326 C332 I333	L321-P328 HydrophobicContact CD1-CB 4.43Å; C326-P328 WeakPolarHBondContact O-CD 3.4Å; P328-C332 HydrophobicContact CB-CB 4.47Å; P328-I333 HydrophobicContact CG-CD1 4.36Å
329	S	27.9	Very low	30.9	Very low	52 Å²	52	88.8 Å²	88.8	36%	0.364	52%	0.515	S	S	.	.	P	Polyproline II helix	trans	-65	151.7	178.7	57.9	0	0	0	0	111.5	E331 C332	S329-E331 PolarHBondContact O-N 3.12Å; S329-E331 VanDerWaalsContact O-N 3.09Å; S329-C332 WeakPolarHBondContact O-CB 3.27Å; S329-C332 PolarHBondContact O-N 3.08Å
330	L	28.6	Very low	30.6	Very low	124 Å²	124	90.5 Å²	90.5	65%	0.649	53%	0.528	S	S	*	.	G	3₁₀ helix	trans	-56.7	-30.4	-175.7	-122.9	69.1	0	0	0	113.1	C332 I333 A334	L330-C332 PolarHBondContact O-N 2.84Å; L330-I333 PolarHBondContact O-N 2.88Å; L330-I333 VanDerWaalsContact O-N 3.07Å; L330-A334 PolarHBondContact O-N 3.22Å
331	E	29.8	Very low	30.2	Very low	134 Å²	134	96.7 Å²	96.7	63%	0.626	55%	0.548	S	S	*	.	G	3₁₀ helix	trans	-57.7	-32.2	174.7	-60.6	168.9	120.2	0	0	113	S329 I333	S329-E331 PolarHBondContact O-N 3.12Å; S329-E331 VanDerWaalsContact O-N 3.09Å; E331-I333 VanDerWaalsContact C-N 3.29Å; E331-I333 PolarHBondContact O-N 2.79Å
332	C	31.1	Very low	29.7	Very low	72 Å²	72	99.8 Å²	99.8	49%	0.486	57%	0.574	S	S	.	*	G	3₁₀ helix	trans	-76.4	-13.5	178.2	-61	0	0	0	0	113.6	L313 P328 S329 L330	L313-C332 HydrophobicContact CD1-CB 4.06Å; P328-C332 HydrophobicContact CB-CB 4.47Å; S329-C332 WeakPolarHBondContact O-CB 3.27Å; S329-C332 PolarHBondContact O-N 3.08Å; L330-C332 PolarHBondContact O-N 2.84Å
333	I	29.9	Very low	29.4	Very low	86 Å²	86	102.9 Å²	102.9	44%	0.441	59%	0.594	S	S	.	*	T	Hydrogen-bonded Turn	trans	-107.3	-22.3	-176	-54.4	177.3	0	0	0	111.1	P328 L330 E331	P328-I333 HydrophobicContact CG-CD1 4.36Å; L330-I333 PolarHBondContact O-N 2.88Å; L330-I333 VanDerWaalsContact O-N 3.07Å; E331-I333 VanDerWaalsContact C-N 3.29Å; E331-I333 PolarHBondContact O-N 2.79Å
334	A	29.8	Very low	29.1	Very low	77 Å²	77	103.8 Å²	103.8	64%	0.636	60%	0.601	S	S	*	*			trans	-87	-4.8	-169.5	0	0	0	0	0	116	L330 P336	L330-A334 PolarHBondContact O-N 3.22Å; A334-P336 WeakPolarHBondContact O-CD 3.44Å
335	Q	29.1	Very low	28.8	Very low	158 Å²	158	108 Å²	108	74%	0.738	63%	0.629	S	S	*	*			trans	-84.1	120.1	-178.4	-65.9	-164.7	5.8	0	0	112.2	I337	Q335-I337 PolarHBondContact O-N 2.91Å
336	P	28	Very low	28.8	Very low	118 Å²	118	109.2 Å²	109.2	77%	0.766	64%	0.64	S	S	*	*			trans	-69.4	124.7	174.9	-16.3	31	0	0	0	110.9	A334 S338	A334-P336 WeakPolarHBondContact O-CD 3.44Å; P336-S338 PolarHBondContact O-N 2.9Å
337	I	28.2	Very low	28.6	Very low	150 Å²	150	113.6 Å²	113.6	77%	0.769	67%	0.671	S	S	*	*			trans	-72.1	96.8	167.4	-58.2	175.9	0	0	0	107.4	Q335 T339	Q335-I337 PolarHBondContact O-N 2.91Å; I337-T339 PolarHBondContact O-N 2.93Å
338	S	27.7	Very low	28.6	Very low	106 Å²	106	114 Å²	114	74%	0.741	68%	0.679	S	S	*	*			trans	-70	96.3	177.6	49.4	0	0	0	0	110.6	P336 S340	P336-S338 PolarHBondContact O-N 2.9Å; S338-S340 PolarHBondContact O-N 3.09Å
339	T	25.1	Very low	28.6	Very low	119 Å²	119	117 Å²	117	73%	0.73	70%	0.7	S	S	*	*			trans	-72.7	90.9	-175.1	54.2	0	0	0	0	112.7	I337 K341	I337-T339 PolarHBondContact O-N 2.93Å; T339-K341 PolarHBondContact O-N 3.43Å; T339-K341 VanDerWaalsContact O-N 3.15Å
340	S	26.4	Very low	28.8	Very low	113 Å²	113	120.6 Å²	120.6	79%	0.79	72%	0.72	S	S	*	*			trans	-76.4	94.1	169.4	57.1	0	0	0	0	110.9	S338 S342	S338-S340 PolarHBondContact O-N 3.09Å; S340-S342 PolarHBondContact O-N 2.89Å; S340-S342 VanDerWaalsContact O-N 3.16Å
341	K	26.2	Very low	28.9	Very low	189 Å²	189	118.4 Å²	118.4	82%	0.822	72%	0.72	S	S	*	*			trans	-65.1	108.9	169.1	-74.6	-175.9	176.6	-178.8	0	110.1	T339 I343	T339-K341 PolarHBondContact O-N 3.43Å; T339-K341 VanDerWaalsContact O-N 3.15Å; K341-I343 PolarHBondContact O-N 3.19Å
342	S	26.9	Very low	29	Very low	110 Å²	110	117.4 Å²	117.4	77%	0.769	73%	0.728	S	S	*	*			trans	-84.9	95.5	169.6	54.9	0	0	0	0	110.5	S340	S340-S342 PolarHBondContact O-N 2.89Å; S340-S342 VanDerWaalsContact O-N 3.16Å
343	I	29	Very low	29.3	Very low	137 Å²	137	118.8 Å²	118.8	70%	0.703	74%	0.739	S	S	*	*			trans	-84.9	127	169.2	-60.5	174.3	0	0	0	108	K341	K341-I343 PolarHBondContact O-N 3.19Å
344	P	28.4	Very low	29.6	Very low	115 Å²	115	120.4 Å²	120.4	75%	0.747	76%	0.757	S	S	*	*			trans	-75.3	124.3	173.4	30.6	-32.3	0	0	0	110.1
345	V	27.9	Very low	30.2	Very low	141 Å²	141	122.4 Å²	122.4	86%	0.855	76%	0.764	S	S	*	*			trans	-94.7	112.4	174	179.7	0	0	0	0	109
346	T	31.5	Very low	30.6	Very low	133 Å²	133	119.7 Å²	119.7	82%	0.816	76%	0.762	S	S	*	*			trans	-91.9	138.1	168.2	42.3	0	0	0	0	110.9
347	S	27.3	Very low	30.9	Very low	115 Å²	115	120.2 Å²	120.2	80%	0.804	76%	0.763	S	S	*	*			trans	-65.9	141.9	-177.6	50.7	0	0	0	0	115.3
348	S	32.4	Very low	31.2	Very low	109 Å²	109	118.4 Å²	118.4	76%	0.762	76%	0.76	S	S	*	*				-168.8	161.1	124.4	57.3	0	0	0	0	113.7
349	S	29.7	Very low	31.5	Very low	98 Å²	98	119.5 Å²	119.5	69%	0.685	76%	0.762	S	S	*	*			trans	-28.9	159.9	158.6	51.9	0	0	0	0	118
350	T	31.9	Very low	32	Very low	128 Å²	128	118.5 Å²	118.5	79%	0.785	76%	0.76	S	S	*	*			cis	-164.5	155.4	16.9	-6.8	0	0	0	0	113.9
351	A	30.6	Very low	32.6	Very low	78 Å²	78	118 Å²	118	65%	0.645	76%	0.756	S	S	*	*			trans	46.7	145.7	141.2	0	0	0	0	0	124.9
352	S	32.8	Very low	33	Very low	114 Å²	114	114.3 Å²	114.3	80%	0.797	75%	0.754	S	S	*	*			trans	65	145.9	151.8	41.3	0	0	0	0	120.4
353	S	36.6	Very low	33.3	Very low	101 Å²	101	113.8 Å²	113.8	71%	0.706	75%	0.751	S	S	*	*			cis	-168.6	139.8	-14.8	48.4	0	0	0	0	113.7
354	S	35.6	Very low	33.5	Very low	120 Å²	120	112 Å²	112	84%	0.839	75%	0.75	S	S	*	*			trans	72.7	154.3	147.5	-56.5	0	0	0	0	121.8
355	P	44	Very low	33.7	Very low	118 Å²	118	111.6 Å²	111.6	77%	0.766	75%	0.75	S	S	*	*			trans	-130.3	-173.8	-168.9	44.4	-28.1	0	0	0	114.9
356	S	35.8	Very low	33.7	Very low	102 Å²	102	115.4 Å²	115.4	71%	0.713	75%	0.751	S	S	*	*			trans	-177.6	137.2	139.1	34.4	0	0	0	0	115.9
357	T	34.5	Very low	33.6	Very low	128 Å²	128	112.5 Å²	112.5	79%	0.785	75%	0.747	S	S	*	*			trans	60.8	153.1	146.7	50.6	0	0	0	0	121.3
358	T	35.9	Very low	33.7	Very low	113 Å²	113	114.7 Å²	114.7	69%	0.693	74%	0.744	S	S	*	*			cis	-148.4	148.7	9.7	-13.1	0	0	0	0	112.5
359	T	32.6	Very low	33.4	Very low	129 Å²	129	116.9 Å²	116.9	79%	0.791	74%	0.743	S	S	*	*			trans	20.7	149.9	145.5	55.4	0	0	0	0	122.5
360	S	36.6	Very low	33.1	Very low	98 Å²	98	119.3 Å²	119.3	69%	0.685	74%	0.743	S	S	*	*			cis	-157.9	162.5	31.5	55.8	0	0	0	0	115.3
361	S	37.4	Very low	32.7	Very low	102 Å²	102	121.4 Å²	121.4	71%	0.713	74%	0.742	S	S	*	*			trans	43.9	137.5	144.9	59.4	0	0	0	0	121.4
362	S	35.4	Very low	32.3	Very low	111 Å²	111	125 Å²	125	78%	0.776	75%	0.75	S	S	*	*			cis	174.2	158.3	-1.5	42.3	0	0	0	0	107.4
363	S	34.2	Very low	32	Very low	99 Å²	99	129 Å²	129	69%	0.692	76%	0.756	S	S	*	*			cis	-171.2	-173.8	-11.9	52.4	0	0	0	0	108.5
364	S	32.4	Very low	31.3	Very low	100 Å²	100	128.8 Å²	128.8	70%	0.699	76%	0.755	S	S	*	*			trans	49.7	121.1	150.6	49.8	0	0	0	0	120.2
365	S	32.7	Very low	30.8	Very low	106 Å²	106	129.1 Å²	129.1	74%	0.741	75%	0.747	S	S	*	*			cis	-158	156	12.5	-77.2	0	0	0	0	113.9
366	Y	27.9	Very low	29.9	Very low	222 Å²	222	133.2 Å²	133.2	87%	0.871	75%	0.749	S	S	*	*			trans	-2	145.9	155.2	-63.6	-98.3	0	0	0	119.6
367	G	28.5	Very low	29.2	Very low	71 Å²	71	138.7 Å²	138.7	73%	0.732	76%	0.76	S	S	*	*			cis	158.5	163.8	5.8	0	0	0	0	0	108.6
368	Q	29.2	Very low	28.7	Very low	161 Å²	161	138.1 Å²	138.1	75%	0.752	76%	0.76	S	S	*	*			cis	-145.4	162.7	5.5	-63.1	176.6	-22.6	0	0	109.7
369	Q	26.1	Very low	28.2	Very low	156 Å²	156	138 Å²	138	73%	0.729	76%	0.764	S	S	*	*			trans	39.9	136.8	143.7	-65.3	176.2	16.1	0	0	121.3
370	Q	24.4	Very low	27.8	Very low	148 Å²	148	139.8 Å²	139.8	69%	0.692	77%	0.769	S	S	*	*			cis	-169.2	171	-5.5	-126.7	175.5	20.3	0	0	110.4
371	F	24.2	Very low	27.3	Very low	172 Å²	172	141.7 Å²	141.7	75%	0.754	77%	0.77	S	S	*	*			trans	64	84.8	166.3	-73.1	-70.4	0	0	0	120.8
372	N	22.1	Very low	26.7	Very low	154 Å²	154	142.1 Å²	142.1	82%	0.824	77%	0.771	S	S	*	*				20	104.2	125.3	-61	-5.1	0	0	0	118.5
373	Q	25.9	Very low	26.2	Very low	197 Å²	197	142 Å²	142	92%	0.921	77%	0.765	S	S	*	*			trans	-129.6	99.9	145	-74.9	-164.3	-0.9	0	0	111
374	S	22.7	Very low	25.7	Very low	98 Å²	98	143.4 Å²	143.4	69%	0.685	77%	0.77	S	S	*	*			trans	-70.6	134.4	156.9	53	0	0	0	0	109.5
375	N	24	Very low	25.3	Very low	127 Å²	127	143 Å²	143	68%	0.679	77%	0.767	S	S	*	*			trans	154.8	118	130.7	-79.8	-41.7	0	0	0	113.4
376	Y	24.8	Very low	25.1	Very low	203 Å²	203	145.1 Å²	145.1	80%	0.796	77%	0.769	S	S	*	*			trans	41.6	81.1	146.2	-56.3	-77.3	0	0	0	119.1	C378	Y376-C378 PolarHBondContact O-N 2.89Å
377	K	21.8	Very low	24.9	Very low	217 Å²	217	143.2 Å²	143.2	94%	0.943	77%	0.77	S	S	*	*			trans	-71.4	109.7	137.8	-81.7	-176.5	175.7	178.2	0	108.3
378	C	24.4	Very low	24.9	Very low	116 Å²	116	146.2 Å²	146.2	78%	0.784	77%	0.768	S	S	*	*			trans	-135.2	140.1	159.5	-89.7	0	0	0	0	108.4	Y376	Y376-C378 PolarHBondContact O-N 2.89Å
379	S	24.8	Very low	24.8	Very low	112 Å²	112	146.1 Å²	146.1	78%	0.783	77%	0.773	S	S	*	*			trans	-77.7	155.2	-168	36.2	0	0	0	0	113.2	L381	S379-L381 PolarHBondContact O-N 3.06Å
380	N	24.9	Very low	24.9	Very low	166 Å²	166	144.2 Å²	144.2	89%	0.888	76%	0.759	S	S	*	*	S	Bend	trans	-65.8	100.2	167.4	-64	-33.5	0	0	0	109.8
381	L	25.1	Very low	25.1	Very low	138 Å²	138	148.6 Å²	148.6	72%	0.723	77%	0.769	S	S	*	*			trans	-159.4	127	162.6	-135.7	77.5	0	0	0	109.4	S379 T383	S379-L381 PolarHBondContact O-N 3.06Å; L381-T383 PolarHBondContact O-N 2.92Å
382	P	25.2	Very low	25.5	Very low	111 Å²	111	147.2 Å²	147.2	72%	0.721	77%	0.77	S	S	*	*			trans	-79.7	96.3	174.6	30.8	-31.9	0	0	0	110.2	T384	P382-T384 PolarHBondContact O-N 3.47Å; P382-T384 VanDerWaalsContact O-N 3.09Å
383	T	25.3	Very low	25.9	Very low	108 Å²	108	149.8 Å²	149.8	66%	0.663	77%	0.774	S	S	*	*			trans	-70.5	101.5	-178.3	1.2	0	0	0	0	112	L381 S385	L381-T383 PolarHBondContact O-N 2.92Å; T383-S385 PolarHBondContact O-N 2.83Å
384	T	23.5	Very low	26	Very low	128 Å²	128	149.1 Å²	149.1	79%	0.785	77%	0.768	S	S	*	*			trans	-78.2	42.4	-178.5	54	0	0	0	0	114	P382	P382-T384 PolarHBondContact O-N 3.47Å; P382-T384 VanDerWaalsContact O-N 3.09Å
385	S	23.3	Very low	26.3	Very low	93 Å²	93	149.4 Å²	149.4	65%	0.65	77%	0.769	S	S	*	*			trans	-167.7	116.3	177.6	54.9	0	0	0	0	111.6	T383	T383-S385 PolarHBondContact O-N 2.83Å
386	I	28.3	Very low	26.6	Very low	150 Å²	150	151.9 Å²	151.9	77%	0.769	77%	0.774	S	S	*	*			trans	-135.2	101.8	166.2	-59.2	-176.6	0	0	0	109.6
387	M	24.5	Very low	26.8	Very low	182 Å²	182	150.5 Å²	150.5	90%	0.897	78%	0.779	S	S	*	*			trans	-60.7	134.2	163.5	-64.5	151.2	59.7	0	0	109.8	N389	M387-N389 PolarHBondContact O-N 3.49Å
388	L	29.5	Very low	27.4	Very low	133 Å²	133	144.6 Å²	144.6	70%	0.696	76%	0.757	S	S	*	*			trans	-89.1	104.4	165.7	-85.9	168.7	0	0	0	109.7
389	N	25.9	Very low	27.8	Very low	159 Å²	159	141.1 Å²	141.1	85%	0.85	73%	0.734	S	S	*	*			trans	-54.6	137.3	176.9	-172.1	-9.4	0	0	0	111	M387	M387-N389 PolarHBondContact O-N 3.49Å
390	R	29.6	Very low	28.2	Very low	116 Å²	116	139 Å²	139	44%	0.438	72%	0.717	S	S	.	*			trans	-123.2	114.5	-170.8	-86.8	171.1	163.1	-119.4	15	112.8	K394 C395	R390-K394 VanDerWaalsContact CZ-O 3.23Å; R390-K394 VanDerWaalsContact NH1-N 3.19Å; R390-K394 PolarHBondContact NH1-O 3.27Å; R390-K394 PolarHBondContact NH2-O 3.25Å; R390-C395 PolarHBondContact NE-SG 2.99Å; R390-C395 PolarHBondContact NH2-SG 3.34Å; R390-C395 VanDerWaalsContact NH2-SG 3.36Å
391	R	28.6	Very low	28.6	Very low	240 Å²	240	137.4 Å²	137.4	91%	0.906	70%	0.703	S	S	*	*	S	Bend	trans	-83.4	127.2	143.6	-66.8	175.3	178.5	151.3	-0.2	107
392	N	31.2	Very low	29.3	Very low	143 Å²	143	134.9 Å²	134.9	77%	0.765	69%	0.687	S	S	*	*	S	Bend	trans	83	152.4	175.8	-52.8	-20.9	0	0	0	118.5
393	K	30.1	Very low	30.1	Very low	208 Å²	208	135.9 Å²	135.9	90%	0.904	68%	0.68	S	S	*	*	S	Bend	trans	-100.1	119.6	-150.7	-57.8	170.9	179.5	176.4	0	114.2
394	K	28	Very low	30.7	Very low	183 Å²	183	132.4 Å²	132.4	80%	0.796	66%	0.657	S	S	*	*			trans	160.6	109.8	143.8	-92.9	177.1	177.3	-178.4	0	112.8	R390 K396	R390-K394 VanDerWaalsContact CZ-O 3.23Å; R390-K394 VanDerWaalsContact NH1-N 3.19Å; R390-K394 PolarHBondContact NH1-O 3.27Å; R390-K394 PolarHBondContact NH2-O 3.25Å; K394-K396 PolarHBondContact O-N 3.49Å
395	C	29.5	Very low	31.5	Very low	105 Å²	105	133.6 Å²	133.6	71%	0.709	65%	0.651	S	S	*	*			trans	-45.8	1.3	-167.4	-114.7	0	0	0	0	123.7	R390 L397	R390-C395 PolarHBondContact NE-SG 2.99Å; R390-C395 PolarHBondContact NH2-SG 3.34Å; R390-C395 VanDerWaalsContact NH2-SG 3.36Å; C395-L397 PolarHBondContact O-N 2.78Å; C395-L397 VanDerWaalsContact O-N 3.12Å
396	K	29.9	Very low	32.4	Very low	179 Å²	179	138 Å²	138	78%	0.778	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-60.6	119.9	-163.8	-77.2	-160.8	172.4	-167.7	0	114.3	K394 I398	K394-K396 PolarHBondContact O-N 3.49Å; K396-I398 PolarHBondContact O-N 2.73Å
397	L	30.6	Very low	32.8	Very low	173 Å²	173	135.4 Å²	135.4	91%	0.906	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-61.3	123.4	160.1	-87.4	158.4	0	0	0	108.8	C395	C395-L397 PolarHBondContact O-N 2.78Å; C395-L397 VanDerWaalsContact O-N 3.12Å
398	I	34.1	Very low	33.3	Very low	93 Å²	93	131.9 Å²	131.9	48%	0.477	63%	0.633	S	S	.	*	P	Polyproline II helix	trans	-101.1	124.4	177.3	-77	176.9	0	0	0	107.8	K396 E402 K403	K396-I398 PolarHBondContact O-N 2.73Å; I398-E402 HydrophobicContact CG2-CB 3.71Å; I398-K403 HydrophobicContact CG2-CB 4.48Å; I398-K403 HydrophobicContact CG2-CG 4.05Å
399	S	31.6	Very low	33.6	Very low	44 Å²	44	132.6 Å²	132.6	31%	0.308	63%	0.631	S	S	.	*	P	Polyproline II helix	trans	-66.3	156.5	178.7	64.9	0	0	0	0	111.8	F401 E402 K403	S399-F401 PolarHBondContact O-N 2.9Å; S399-E402 PolarHBondContact N-OE2 3.22Å; S399-E402 VanDerWaalsContact N-OE2 3.1Å; S399-E402 PolarHBondContact O-N 3.32Å; S399-E402 WeakPolarHBondContact OG-CG 3.33Å; S399-E402 PolarHBondContact OG-N 2.94Å; S399-E402 PolarHBondContact OG-OE2 3.19Å; S399-K403 PolarHBondContact O-N 3.45Å; S399-K403 VanDerWaalsContact O-N 3.11Å
400	P	33.1	Very low	33.9	Very low	66 Å²	66	129.7 Å²	129.7	43%	0.429	61%	0.608	S	S	.	*	H	α-helix	trans	-54	-34.1	171.1	-26.9	35.8	0	0	0	112.8	K403 L404	P400-K403 PolarHBondContact O-N 3.06Å; P400-L404 PolarHBondContact O-N 2.93Å
401	F	32.9	Very low	34.1	Very low	134 Å²	134	134.6 Å²	134.6	59%	0.588	63%	0.627	S	S	*	*	H	α-helix	trans	-67.3	-38.7	175.2	-64.7	-81.3	0	0	0	113.5	V327 S399 L404	V327-F401 HydrophobicContact CG2-CZ 3.96Å; S399-F401 PolarHBondContact O-N 2.9Å; F401-L404 PolarHBondContact O-N 3.48Å
402	E	41.5	Very low	34.4	Very low	84 Å²	84	129.1 Å²	129.1	39%	0.393	62%	0.615	S	S	.	*	H	α-helix	trans	-69.7	-36	174.4	-80.9	177.8	119.5	0	0	112.5	I398 S399 L404 K405 Y406	I398-E402 HydrophobicContact CG2-CB 3.71Å; S399-E402 PolarHBondContact N-OE2 3.22Å; S399-E402 VanDerWaalsContact N-OE2 3.1Å; S399-E402 PolarHBondContact O-N 3.32Å; S399-E402 WeakPolarHBondContact OG-CG 3.33Å; S399-E402 PolarHBondContact OG-N 2.94Å; S399-E402 PolarHBondContact OG-OE2 3.19Å; E402-L404 PolarHBondContact O-N 3.33Å; E402-K405 WeakPolarHBondContact O-CB 3.32Å; E402-K405 PolarHBondContact O-N 3.18Å; E402-Y406 VanDerWaalsContact O-CD2 3.28Å; E402-Y406 WeakPolarHBondContact O-CD2 3.48Å; E402-Y406 WeakPolarHBondContact O-CE2 3.45Å
403	K	40.6	Very low	34.5	Very low	132 Å²	132	128.3 Å²	128.3	57%	0.574	62%	0.616	S	S	*	*	H	α-helix	trans	-58.9	-32.8	175.4	-109.1	179.3	-179.8	177.2	0	112.5	I398 S399 P400 K405 Y406	I398-K403 HydrophobicContact CG2-CB 4.48Å; I398-K403 HydrophobicContact CG2-CG 4.05Å; S399-K403 PolarHBondContact O-N 3.45Å; S399-K403 VanDerWaalsContact O-N 3.11Å; P400-K403 PolarHBondContact O-N 3.06Å; K403-K405 VanDerWaalsContact C-N 3.34Å; K403-K405 PolarHBondContact O-N 3.04Å; K403-Y406 PolarHBondContact O-N 3.26Å
404	L	38.7	Very low	34.9	Very low	35 Å²	35	125.6 Å²	125.6	18%	0.183	61%	0.606	C	S	.	*	H	α-helix	trans	-64.2	-33.1	178.2	-78.8	155.9	0	0	0	113.2	Y322 P400 F401 E402 Y406 H407 Y410	Y322-L404 WeakPolarHBondContact OH-CD1 3.27Å; P400-L404 PolarHBondContact O-N 2.93Å; F401-L404 PolarHBondContact O-N 3.48Å; E402-L404 PolarHBondContact O-N 3.33Å; L404-Y406 PolarHBondContact O-N 2.89Å; L404-H407 WeakPolarHBondContact O-CB 3.44Å; L404-H407 PolarHBondContact O-N 2.84Å; L404-Y410 HydrophobicContact CB-CE2 3.94Å; L404-Y410 HydrophobicContact CD2-CE2 4.17Å; L404-Y410 WeakPolarHBondContact O-CD2 3.26Å; L404-Y410 VanDerWaalsContact O-CG 3.29Å
405	K	41	Very low	35.2	Very low	153 Å²	153	121.5 Å²	121.5	67%	0.665	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.1	-20.3	175.8	-72.4	-176.8	173.6	176.8	0	114.2	E402 K403	E402-K405 WeakPolarHBondContact O-CB 3.32Å; E402-K405 PolarHBondContact O-N 3.18Å; K403-K405 VanDerWaalsContact C-N 3.34Å; K403-K405 PolarHBondContact O-N 3.04Å
406	Y	41.5	Very low	36	Very low	187 Å²	187	122.2 Å²	122.2	73%	0.733	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.9	-0.6	-178.5	-57.2	-80.1	0	0	0	113.5	E402 K403 L404	E402-Y406 VanDerWaalsContact O-CD2 3.28Å; E402-Y406 WeakPolarHBondContact O-CD2 3.48Å; E402-Y406 WeakPolarHBondContact O-CE2 3.45Å; K403-Y406 PolarHBondContact O-N 3.26Å; L404-Y406 PolarHBondContact O-N 2.89Å
407	H	37.1	Very low	36.4	Very low	95 Å²	95	119.2 Å²	119.2	44%	0.44	59%	0.589	S	S	.	*	S	Bend	trans	-73.2	143.5	179.6	-166.8	-113.1	0	0	0	111	L404 F409 Y410	L404-H407 WeakPolarHBondContact O-CB 3.44Å; L404-H407 PolarHBondContact O-N 2.84Å; H407-F409 PolarHBondContact O-N 2.72Å; H407-Y410 WeakPolarHBondContact O-CB 3.24Å; H407-Y410 PolarHBondContact O-N 3.22Å
408	S	35	Very low	37	Very low	107 Å²	107	113 Å²	113	75%	0.748	57%	0.566	S	S	*	*	G	3₁₀ helix	trans	-58.5	-27.9	-174.6	-50.5	0	0	0	0	113.9	Y410 R411	S408-Y410 VanDerWaalsContact C-N 3.3Å; S408-Y410 PolarHBondContact O-N 3.31Å; S408-R411 PolarHBondContact O-N 2.85Å
409	F	35.9	Very low	37.4	Very low	149 Å²	149	114.8 Å²	114.8	65%	0.654	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-71.2	-17.5	174.8	-117.4	-88.5	0	0	0	114.1	T315 H407 R411	T315-F409 HydrophobicContact CG2-CZ 4.25Å; H407-F409 PolarHBondContact O-N 2.72Å; F409-R411 VanDerWaalsContact C-N 3.33Å
410	Y	32.1	Very low	38.3	Very low	98 Å²	98	118.6 Å²	118.6	38%	0.384	58%	0.578	S	S	.	*	G	3₁₀ helix	trans	-87	-0.2	177.3	-97.8	-100.6	0	0	0	113.2	Y322 L404 H407 S408 D412	Y322-Y410 PolarHBondContact OH-OH 3.18Å; L404-Y410 HydrophobicContact CB-CE2 3.94Å; L404-Y410 HydrophobicContact CD2-CE2 4.17Å; L404-Y410 WeakPolarHBondContact O-CD2 3.26Å; L404-Y410 VanDerWaalsContact O-CG 3.29Å; H407-Y410 WeakPolarHBondContact O-CB 3.24Å; H407-Y410 PolarHBondContact O-N 3.22Å; S408-Y410 VanDerWaalsContact C-N 3.3Å; S408-Y410 PolarHBondContact O-N 3.31Å; Y410-D412 VanDerWaalsContact C-N 3.34Å
411	R	32.9	Very low	38.6	Very low	219 Å²	219	117 Å²	117	83%	0.826	57%	0.566	S	S	*	*	G	3₁₀ helix	trans	-92.9	15.8	172.1	-77.5	-168.3	170.1	-155.3	-1.8	113.6	S408 F409	S408-R411 PolarHBondContact O-N 2.85Å; F409-R411 VanDerWaalsContact C-N 3.33Å
412	D	34.9	Very low	39.1	Very low	124 Å²	124	117 Å²	117	66%	0.663	57%	0.567	S	S	*	*			trans	-67	135.2	179.6	-152.2	-14.5	0	0	0	111.1	Y410 Q414	Y410-D412 VanDerWaalsContact C-N 3.34Å; D412-Q414 VanDerWaalsContact C-N 3.27Å; D412-Q414 PolarHBondContact O-N 3.03Å
413	T	33.8	Very low	39.3	Very low	126 Å²	126	118.5 Å²	118.5	77%	0.773	57%	0.574	S	S	*	*	S	Bend	trans	-87.8	11.4	-157.1	50.4	0	0	0	0	114.4
414	Q	37.7	Very low	39.3	Very low	151 Å²	151	114.4 Å²	114.4	71%	0.706	56%	0.561	S	S	*	*			trans	-118.9	108.2	179.5	-60.7	-167.7	-4.7	0	0	110.3	D412 N416	D412-Q414 VanDerWaalsContact C-N 3.27Å; D412-Q414 PolarHBondContact O-N 3.03Å; Q414-N416 PolarHBondContact O-N 2.74Å
415	C	35.2	Very low	39.3	Very low	98 Å²	98	117.9 Å²	117.9	66%	0.662	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	24.1	-162.1	-56.1	0	0	0	0	116.8	K419	C415-K419 WeakPolarHBondContact O-CG 3.47Å
416	N	45.9	Very low	39.3	Very low	120 Å²	120	114.4 Å²	114.4	64%	0.642	57%	0.57	S	S	*	*	H	α-helix	trans	-87.9	-45.3	-171.9	-66.3	-15.2	0	0	0	112.6	Q414 G418 K419 W420	Q414-N416 PolarHBondContact O-N 2.74Å; N416-G418 PolarHBondContact O-N 2.93Å; N416-K419 PolarHBondContact O-N 2.78Å; N416-W420 WeakPolarHBondContact O-CB 3.3Å; N416-W420 PolarHBondContact O-N 3Å
417	L	39.4	Very low	39	Very low	116 Å²	116	108.9 Å²	108.9	61%	0.607	56%	0.559	S	S	*	*	H	α-helix	trans	-64.7	-42.3	-175.7	-175.6	62.7	0	0	0	112.4	W420 I421	L417-W420 PolarHBondContact O-N 3.32Å; L417-I421 HydrophobicContact CD1-CD1 4.16Å; L417-I421 HydrophobicContact CD1-CG1 4.39Å; L417-I421 HydrophobicContact CG-CD1 4.04Å; L417-I421 WeakPolarHBondContact O-CG1 3.43Å; L417-I421 PolarHBondContact O-N 2.77Å
418	G	41.2	Very low	38.9	Very low	42 Å²	42	108.7 Å²	108.7	43%	0.433	56%	0.561	S	S	.	*	H	α-helix	trans	-62.5	-42.8	176.5	0	0	0	0	0	112.9	N416 Q422	N416-G418 PolarHBondContact O-N 2.93Å; G418-Q422 WeakPolarHBondContact O-CG 3.28Å; G418-Q422 PolarHBondContact O-N 2.95Å
419	K	43.8	Very low	39	Very low	130 Å²	130	108.9 Å²	108.9	57%	0.565	55%	0.553	S	S	*	*	H	α-helix	trans	-63.7	-44.8	174.1	-77.6	-176.3	175.5	-176.4	0	111.9	C415 N416 I421 Q422 Q423	C415-K419 WeakPolarHBondContact O-CG 3.47Å; N416-K419 PolarHBondContact O-N 2.78Å; K419-I421 PolarHBondContact O-N 3.49Å; K419-Q422 PolarHBondContact O-N 3.12Å; K419-Q423 WeakPolarHBondContact O-CB 3.38Å; K419-Q423 VanDerWaalsContact O-CG 3.3Å; K419-Q423 WeakPolarHBondContact O-CG 3.31Å; K419-Q423 PolarHBondContact O-N 3.46Å
420	W	49.4	Very low	39	Very low	124 Å²	124	106 Å²	106	47%	0.47	54%	0.544	S	S	.	.	H	α-helix	trans	-63.1	-41.6	179.4	-175.2	84.7	0	0	0	112.3	T323 N416 L417 Q423 T424	T323-W420 HydrophobicContact CG2-CH2 4.44Å; N416-W420 WeakPolarHBondContact O-CB 3.3Å; N416-W420 PolarHBondContact O-N 3Å; L417-W420 PolarHBondContact O-N 3.32Å; W420-Q423 PolarHBondContact O-N 3.16Å; W420-T424 VanDerWaalsContact O-CB 3.29Å; W420-T424 WeakPolarHBondContact O-CB 3.32Å; W420-T424 PolarHBondContact O-N 3.23Å; W420-T424 PolarHBondContact O-OG1 3.26Å
421	I	39.6	Very low	39.2	Very low	33 Å²	33	107 Å²	107	17%	0.169	56%	0.556	C	S	.	*	H	α-helix	trans	-64.5	-44.5	174	-67.9	172	0	0	0	110.7	Y322 L417 K419 T424 L425	Y322-I421 HydrophobicContact CE1-CD1 4.47Å; L417-I421 HydrophobicContact CD1-CD1 4.16Å; L417-I421 HydrophobicContact CD1-CG1 4.39Å; L417-I421 HydrophobicContact CG-CD1 4.04Å; L417-I421 WeakPolarHBondContact O-CG1 3.43Å; L417-I421 PolarHBondContact O-N 2.77Å; K419-I421 PolarHBondContact O-N 3.49Å; I421-T424 PolarHBondContact O-N 2.98Å; I421-L425 HydrophobicContact CG2-CD1 3.95Å; I421-L425 WeakPolarHBondContact O-CB 3.24Å; I421-L425 VanDerWaalsContact O-CG 3.3Å; I421-L425 WeakPolarHBondContact O-CG 3.11Å; I421-L425 PolarHBondContact O-N 3.02Å
422	Q	43.6	Very low	39.3	Very low	134 Å²	134	104.1 Å²	104.1	63%	0.626	55%	0.549	S	S	*	.	H	α-helix	trans	-60.3	-48.1	175.3	-76.5	-174	-72.4	0	0	112	G418 K419 T424 L425 T426	G418-Q422 WeakPolarHBondContact O-CG 3.28Å; G418-Q422 PolarHBondContact O-N 2.95Å; K419-Q422 PolarHBondContact O-N 3.12Å; Q422-T424 PolarHBondContact O-N 3.34Å; Q422-L425 PolarHBondContact O-N 2.9Å; Q422-T426 WeakPolarHBondContact O-CG2 3.29Å; Q422-T426 PolarHBondContact O-N 3Å; Q422-T426 PolarHBondContact O-OG1 3.45Å; Q422-T426 VanDerWaalsContact O-OG1 3.06Å
423	Q	46.3	Very low	39.3	Very low	115 Å²	115	105.7 Å²	105.7	54%	0.537	55%	0.55	S	S	.	*	H	α-helix	trans	-58.4	-49	178	-75.1	171.2	-36.3	0	0	111.3	K419 W420 L425 T426 C427	K419-Q423 WeakPolarHBondContact O-CB 3.38Å; K419-Q423 VanDerWaalsContact O-CG 3.3Å; K419-Q423 WeakPolarHBondContact O-CG 3.31Å; K419-Q423 PolarHBondContact O-N 3.46Å; W420-Q423 PolarHBondContact O-N 3.16Å; Q423-L425 VanDerWaalsContact C-N 3.29Å; Q423-L425 PolarHBondContact O-N 3.49Å; Q423-T426 WeakPolarHBondContact CA-OG1 3.31Å; Q423-T426 PolarHBondContact O-N 2.95Å; Q423-T426 PolarHBondContact O-OG1 3.4Å; Q423-C427 PolarHBondContact O-N 3.44Å; Q423-C427 PolarHBondContact O-SG 3.26Å
424	T	40.5	Very low	39.3	Very low	47 Å²	47	108.7 Å²	108.7	29%	0.288	55%	0.549	S	S	.	.	H	α-helix	trans	-60.9	-37.2	179.4	-56.2	0	0	0	0	111.8	W420 I421 Q422 N428	W420-T424 VanDerWaalsContact O-CB 3.29Å; W420-T424 WeakPolarHBondContact O-CB 3.32Å; W420-T424 PolarHBondContact O-N 3.23Å; W420-T424 PolarHBondContact O-OG1 3.26Å; I421-T424 PolarHBondContact O-N 2.98Å; Q422-T424 PolarHBondContact O-N 3.34Å; T424-N428 PolarHBondContact O-ND2 3.21Å
425	L	37.7	Very low	39.2	Very low	108 Å²	108	108.6 Å²	108.6	57%	0.565	55%	0.552	S	S	*	*	H	α-helix	trans	-69.2	-49.3	173.1	-69.4	169.4	0	0	0	111.5	I421 Q422 Q423 C427 N428	I421-L425 HydrophobicContact CG2-CD1 3.95Å; I421-L425 WeakPolarHBondContact O-CB 3.24Å; I421-L425 VanDerWaalsContact O-CG 3.3Å; I421-L425 WeakPolarHBondContact O-CG 3.11Å; I421-L425 PolarHBondContact O-N 3.02Å; Q422-L425 PolarHBondContact O-N 2.9Å; Q423-L425 VanDerWaalsContact C-N 3.29Å; Q423-L425 PolarHBondContact O-N 3.49Å; L425-C427 VanDerWaalsContact C-N 3.33Å; L425-C427 PolarHBondContact O-N 3.31Å; L425-N428 PolarHBondContact O-N 2.96Å
426	T	41.3	Very low	39.2	Very low	79 Å²	79	110.5 Å²	110.5	49%	0.485	56%	0.556	S	S	.	*	H	α-helix	trans	-63.4	-32.4	-177.9	49.4	0	0	0	0	114.1	Q422 Q423 N428 D429	Q422-T426 WeakPolarHBondContact O-CG2 3.29Å; Q422-T426 PolarHBondContact O-N 3Å; Q422-T426 PolarHBondContact O-OG1 3.45Å; Q422-T426 VanDerWaalsContact O-OG1 3.06Å; Q423-T426 WeakPolarHBondContact CA-OG1 3.31Å; Q423-T426 PolarHBondContact O-N 2.95Å; Q423-T426 PolarHBondContact O-OG1 3.4Å; T426-N428 VanDerWaalsContact C-N 3.26Å; T426-N428 PolarHBondContact O-N 3.27Å; T426-D429 PolarHBondContact O-N 2.93Å
427	C	36.7	Very low	38.6	Very low	72 Å²	72	111.3 Å²	111.3	49%	0.486	56%	0.56	S	S	.	*	H	α-helix	trans	-65.3	-29.3	178.2	-68	0	0	0	0	112.7	Q423 L425 D429 I430	Q423-C427 PolarHBondContact O-N 3.44Å; Q423-C427 PolarHBondContact O-SG 3.26Å; L425-C427 VanDerWaalsContact C-N 3.33Å; L425-C427 PolarHBondContact O-N 3.31Å; C427-D429 VanDerWaalsContact C-N 3.29Å; C427-D429 PolarHBondContact O-N 3.36Å; C427-I430 PolarHBondContact O-N 3.43Å
428	N	34.3	Very low	38.3	Very low	91 Å²	91	113 Å²	113	49%	0.487	57%	0.57	S	S	.	*	H	α-helix	trans	-73.5	-19.1	178.9	-74.9	-76.9	0	0	0	113.5	T424 L425 T426	T424-N428 PolarHBondContact O-ND2 3.21Å; L425-N428 PolarHBondContact O-N 2.96Å; T426-N428 VanDerWaalsContact C-N 3.26Å; T426-N428 PolarHBondContact O-N 3.27Å
429	D	36.2	Very low	37.8	Very low	111 Å²	111	120 Å²	120	59%	0.594	59%	0.589	S	S	*	*	H	α-helix	trans	-86.4	-13.3	175.2	-71.4	-34	0	0	0	112.9	T426 C427	T426-D429 PolarHBondContact O-N 2.93Å; C427-D429 VanDerWaalsContact C-N 3.29Å; C427-D429 PolarHBondContact O-N 3.36Å
430	I	36.9	Very low	37.4	Very low	89 Å²	89	121.6 Å²	121.6	46%	0.456	60%	0.603	S	S	.	*	H	α-helix	trans	-83.4	-45.9	-179.8	-64.8	172.5	0	0	0	110.6	C427 K432 K433 Y434	C427-I430 PolarHBondContact O-N 3.43Å; I430-K432 PolarHBondContact O-N 3.06Å; I430-K433 PolarHBondContact O-N 3.43Å; I430-Y434 HydrophobicContact CG2-CD2 3.9Å; I430-Y434 HydrophobicContact CG2-CE2 3.83Å
431	D	35.4	Very low	36.8	Very low	119 Å²	119	125 Å²	125	64%	0.636	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.9	-20.5	177.9	-77.6	2.3	0	0	0	113.3
432	K	36	Very low	36.4	Very low	158 Å²	158	131.1 Å²	131.1	69%	0.687	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.8	-13.6	174.3	-79.1	-172.8	172	-176.3	0	115.1	I430	I430-K432 PolarHBondContact O-N 3.06Å
433	K	34.9	Very low	36.1	Very low	156 Å²	156	132 Å²	132	68%	0.678	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.7	-10.3	-179	-74.1	-173.4	174.1	-176.3	0	114.4	I430	I430-K433 PolarHBondContact O-N 3.43Å
434	Y	33	Very low	35.5	Very low	189 Å²	189	133 Å²	133	74%	0.741	68%	0.676	S	S	*	*	S	Bend	trans	-96.1	0.3	175.7	-80.1	-78.4	0	0	0	114.4	I430	I430-Y434 HydrophobicContact CG2-CD2 3.9Å; I430-Y434 HydrophobicContact CG2-CE2 3.83Å
435	L	36.1	Very low	35.1	Very low	149 Å²	149	136.2 Å²	136.2	78%	0.78	70%	0.695	S	S	*	*	S	Bend	trans	-104.6	-21.4	-179.3	-136.3	74.2	0	0	0	114.8
436	D	36	Very low	34.8	Very low	138 Å²	138	136.5 Å²	136.5	74%	0.738	70%	0.701	S	S	*	*	S	Bend	trans	-97	-4	-174.8	-71.8	-26	0	0	0	114.3
437	N	33	Very low	34.5	Very low	137 Å²	137	138.6 Å²	138.6	73%	0.733	71%	0.71	S	S	*	*	S	Bend	trans	-96.6	-1.3	-173.6	-79	0.5	0	0	0	115.6
438	N	33.6	Very low	34.5	Very low	151 Å²	151	141.1 Å²	141.1	81%	0.807	72%	0.718	S	S	*	*	S	Bend	trans	-113	45.7	-175.9	-76.4	-10.2	0	0	0	112.8
439	K	30.6	Very low	34.5	Very low	191 Å²	191	143 Å²	143	83%	0.83	73%	0.728	S	S	*	*			trans	-145.3	85.8	168.4	-74.7	-170.3	178.8	179.3	0	110.9
440	D	35.5	Very low	34.3	Very low	163 Å²	163	143.4 Å²	143.4	87%	0.872	74%	0.735	S	S	*	*			trans	-175.2	163.3	145.1	-96.1	-24.3	0	0	0	109.1
441	Q	35.1	Very low	34.1	Very low	194 Å²	194	144.4 Å²	144.4	91%	0.907	75%	0.746	S	S	*	*			trans	67	72.4	178.1	-56.3	-165.3	-7.7	0	0	117.5
442	D	31.9	Very low	34	Very low	162 Å²	162	144.3 Å²	144.3	87%	0.866	75%	0.749	S	S	*	*			trans	-110.5	108.5	132.8	-103.5	-43	0	0	0	107.8
443	N	36.4	Very low	33.8	Very low	153 Å²	153	143.1 Å²	143.1	82%	0.818	75%	0.75	S	S	*	*			trans	-176.8	145.4	154.8	-102.9	-47.4	0	0	0	113
444	N	34.4	Very low	33.7	Very low	137 Å²	137	140.2 Å²	140.2	73%	0.733	75%	0.746	S	S	*	*			trans	75.8	85.5	160.1	-62.3	-16.6	0	0	0	121.3
445	T	32.6	Very low	33.7	Very low	114 Å²	114	136.2 Å²	136.2	70%	0.699	74%	0.741	S	S	*	*				64.5	126.9	118.1	-15.4	0	0	0	0	122.3
446	T	32.1	Very low	33.5	Very low	113 Å²	113	138.7 Å²	138.7	69%	0.693	74%	0.742	S	S	*	*			trans	79.3	138.2	141.6	27.8	0	0	0	0	122.7
447	N	34.6	Very low	33.4	Very low	124 Å²	124	137.1 Å²	137.1	66%	0.663	73%	0.734	S	S	*	*			trans	90.6	92.4	145.6	-65.3	-12.9	0	0	0	121
448	N	35.3	Very low	33.3	Very low	124 Å²	124	136.4 Å²	136.4	66%	0.663	73%	0.73	S	S	*	*				87.6	113.3	111	-64.6	-8	0	0	0	120.9
449	N	35.1	Very low	33.3	Very low	131 Å²	131	135.7 Å²	135.7	70%	0.701	73%	0.726	S	S	*	*				95.8	131.3	123	-69.2	-0.8	0	0	0	121
450	T	32.6	Very low	33.2	Very low	120 Å²	120	132.6 Å²	132.6	74%	0.736	72%	0.718	S	S	*	*			trans	69.2	134.4	141.6	54.3	0	0	0	0	118
451	T	32.3	Very low	33.1	Very low	110 Å²	110	136 Å²	136	68%	0.675	72%	0.721	S	S	*	*			cis	-167.6	155.2	-0.6	4.6	0	0	0	0	111.1
452	T	32.2	Very low	32.6	Very low	117 Å²	117	134 Å²	134	72%	0.718	71%	0.711	S	S	*	*			trans	62.1	154.4	151.9	57.7	0	0	0	0	117.8
453	N	31.9	Very low	32.7	Very low	132 Å²	132	133.5 Å²	133.5	71%	0.706	71%	0.709	S	S	*	*			cis	-169.8	163	-4.7	-110.1	16.9	0	0	0	107.4
454	T	32.9	Very low	32.3	Very low	96 Å²	96	133.4 Å²	133.4	59%	0.589	70%	0.701	S	S	*	*			cis	-170.5	157.3	-12.2	15	0	0	0	0	108.9
455	T	32.7	Very low	32.1	Very low	105 Å²	105	136.8 Å²	136.8	64%	0.644	71%	0.709	S	S	*	*			trans	62.9	157.7	152.9	56.1	0	0	0	0	118.5
456	Y	32.6	Very low	31.9	Very low	200 Å²	200	137.2 Å²	137.2	78%	0.784	71%	0.707	S	S	*	*			cis	-174.4	160	-11.8	-99.7	-12.1	0	0	0	106.4
457	N	34.7	Very low	31.9	Very low	106 Å²	106	138.8 Å²	138.8	57%	0.567	71%	0.712	S	S	*	*			cis	-161	141.1	-10.9	-133.1	27.9	0	0	0	113.4
458	D	30	Very low	31.7	Very low	122 Å²	122	139.9 Å²	139.9	65%	0.652	72%	0.717	S	S	*	*				57.9	158.2	127.4	-79	-10.5	0	0	0	125.6
459	N	33.7	Very low	31.4	Very low	136 Å²	136	139.3 Å²	139.3	73%	0.727	72%	0.723	S	S	*	*			trans	85.9	142.1	169.3	-55.8	-79	0	0	0	116.8
460	N	29.3	Very low	31.1	Very low	126 Å²	126	140.7 Å²	140.7	67%	0.674	73%	0.727	S	S	*	*			cis	179.6	142	-31.4	-114.7	-42.5	0	0	0	106
461	Y	32.4	Very low	31	Very low	235 Å²	235	141.8 Å²	141.8	92%	0.922	73%	0.729	S	S	*	*			trans	173.1	119.1	138.9	-102.4	-65.8	0	0	0	111
462	E	25.3	Very low	30.8	Very low	151 Å²	151	144.2 Å²	144.2	71%	0.706	73%	0.73	S	S	*	*			trans	-88.6	157.6	173.6	-56.8	-179.5	116.7	0	0	112.2
463	N	32.6	Very low	30.7	Very low	152 Å²	152	144.7 Å²	144.7	81%	0.813	73%	0.728	S	S	*	*			trans	-175	103	133.6	-92.3	-51.1	0	0	0	107.2
464	K	28.8	Very low	30.6	Very low	151 Å²	151	146 Å²	146	66%	0.657	73%	0.73	S	S	*	*				55.2	111.3	89.7	-79.7	-174.8	173.2	172.6	0	114.9
465	F	31.3	Very low	30.4	Very low	207 Å²	207	145.5 Å²	145.5	91%	0.908	73%	0.73	S	S	*	*				-162.5	129.9	107.3	-109.4	-72.3	0	0	0	111
466	D	28.4	Very low	30.1	Very low	123 Å²	123	148.1 Å²	148.1	66%	0.658	74%	0.74	S	S	*	*			trans	-94.6	160	179.6	-50.2	-83.1	0	0	0	111.9
467	N	32.1	Very low	29.8	Very low	147 Å²	147	146.2 Å²	146.2	79%	0.786	74%	0.744	S	S	*	*				168.4	110.4	125.4	-83.2	-23	0	0	0	113.6
468	D	29.7	Very low	29.5	Very low	146 Å²	146	148.8 Å²	148.8	78%	0.781	75%	0.752	S	S	*	*			trans	27.3	125.9	134.3	-58.5	-17.5	0	0	0	121.6
469	S	29.7	Very low	29.2	Very low	113 Å²	113	153 Å²	153	79%	0.79	77%	0.765	S	S	*	*				175.4	108.1	93.3	43.3	0	0	0	0	116.6
470	M	27.7	Very low	29	Very low	159 Å²	159	151.8 Å²	151.8	78%	0.783	76%	0.758	S	S	*	*				43	100.1	123.8	-66.9	-71.1	171.9	0	0	121.7
471	N	30.9	Very low	28.9	Very low	144 Å²	144	150.8 Å²	150.8	77%	0.77	75%	0.752	S	S	*	*				-168	127.5	119.3	-94.2	-40	0	0	0	108.6
472	K	28.6	Very low	28.7	Very low	160 Å²	160	147.4 Å²	147.4	70%	0.696	75%	0.749	S	S	*	*				56.2	119.7	71.9	-67.5	-178.6	-180	173.2	0	110.9
473	N	29.7	Very low	28.7	Very low	128 Å²	128	143.6 Å²	143.6	68%	0.684	74%	0.735	S	S	*	*			cis	-165.5	175.6	29.6	-98.7	-18.7	0	0	0	111.9
474	H	29.8	Very low	28.5	Very low	159 Å²	159	142.2 Å²	142.2	74%	0.736	73%	0.728	S	S	*	*			trans	52.1	100.4	155	-69.5	-57.7	0	0	0	118.7
475	S	27.6	Very low	28.5	Very low	86 Å²	86	146.2 Å²	146.2	60%	0.601	74%	0.741	S	S	*	*				68.8	101	74.5	77.1	0	0	0	0	115.4
476	N	27.5	Very low	28.4	Very low	160 Å²	160	143.4 Å²	143.4	86%	0.856	74%	0.735	S	S	*	*				-163.8	145.5	111.2	-97.6	-27.4	0	0	0	112.4	Q478	N476-Q478 PolarHBondContact O-N 3.01Å
477	N	25.6	Very low	28.3	Very low	159 Å²	159	142.3 Å²	142.3	85%	0.85	73%	0.729	S	S	*	*			trans	-76.8	119.5	175.4	-68.9	-34.4	0	0	0	110.1
478	Q	28.4	Very low	28.2	Very low	160 Å²	160	145.6 Å²	145.6	75%	0.748	73%	0.732	S	S	*	*			trans	-128.8	81.2	159.1	-80.5	-166.7	-16.8	0	0	110.5	N476 I480	N476-Q478 PolarHBondContact O-N 3.01Å; Q478-I480 VanDerWaalsContact C-N 3.26Å; Q478-I480 HydrophobicContact CB-CD1 3.97Å; Q478-I480 HydrophobicContact CB-CG1 4.01Å; Q478-I480 VanDerWaalsContact CD-CD1 3.49Å; Q478-I480 HydrophobicContact CG-CD1 3.9Å; Q478-I480 HydrophobicContact CG-CG1 4.35Å; Q478-I480 PolarHBondContact O-N 3.02Å
479	F	24.3	Very low	28.1	Very low	210 Å²	210	141.5 Å²	141.5	92%	0.921	72%	0.723	S	S	*	*			trans	-61.2	93.6	149.6	-97.7	-98	0	0	0	107.6
480	I	29.8	Very low	27.9	Very low	112 Å²	112	146 Å²	146	57%	0.574	72%	0.723	S	S	*	*			trans	-123.9	106.8	174.1	-67.6	-177.8	0	0	0	109.6	Q478	Q478-I480 VanDerWaalsContact C-N 3.26Å; Q478-I480 HydrophobicContact CB-CD1 3.97Å; Q478-I480 HydrophobicContact CB-CG1 4.01Å; Q478-I480 VanDerWaalsContact CD-CD1 3.49Å; Q478-I480 HydrophobicContact CG-CD1 3.9Å; Q478-I480 HydrophobicContact CG-CG1 4.35Å; Q478-I480 PolarHBondContact O-N 3.02Å
481	D	26.9	Very low	27.9	Very low	105 Å²	105	144.7 Å²	144.7	56%	0.561	72%	0.719	S	S	*	*			trans	53.7	76.4	152.4	-72.7	-58.1	0	0	0	120.2	T483	D481-T483 VanDerWaalsContact CB-OG1 3.31Å; D481-T483 WeakPolarHBondContact CB-OG1 3.27Å; D481-T483 VanDerWaalsContact CG-OG1 3.26Å; D481-T483 PolarHBondContact O-N 2.94Å; D481-T483 VanDerWaalsContact O-N 3.14Å; D481-T483 VanDerWaalsContact OD1-CG2 3.23Å; D481-T483 WeakPolarHBondContact OD1-CG2 3.46Å; D481-T483 PolarHBondContact OD1-OG1 2.88Å
482	I	27.4	Very low	27.8	Very low	164 Å²	164	141.3 Å²	141.3	84%	0.841	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-66.1	3.3	151.6	-67	171	0	0	0	111.8	N484	I482-N484 PolarHBondContact O-N 3.26Å
483	T	26.2	Very low	27.7	Very low	70 Å²	70	140.4 Å²	140.4	43%	0.429	71%	0.709	S	S	.	*	G	3₁₀ helix	trans	-77.9	-15.7	-169.3	54.2	0	0	0	0	115.4	D481 Y485 L486	D481-T483 VanDerWaalsContact CB-OG1 3.31Å; D481-T483 WeakPolarHBondContact CB-OG1 3.27Å; D481-T483 VanDerWaalsContact CG-OG1 3.26Å; D481-T483 PolarHBondContact O-N 2.94Å; D481-T483 VanDerWaalsContact O-N 3.14Å; D481-T483 VanDerWaalsContact OD1-CG2 3.23Å; D481-T483 WeakPolarHBondContact OD1-CG2 3.46Å; D481-T483 PolarHBondContact OD1-OG1 2.88Å; T483-Y485 VanDerWaalsContact C-N 3.32Å; T483-Y485 PolarHBondContact O-N 3.25Å; T483-L486 PolarHBondContact O-N 3.4Å
484	N	28.2	Very low	27.5	Very low	124 Å²	124	139.8 Å²	139.8	66%	0.663	71%	0.71	S	S	*	*	G	3₁₀ helix	trans	-75.1	-9.2	-173.7	-86.8	-39.4	0	0	0	116.1	I482	I482-N484 PolarHBondContact O-N 3.26Å
485	Y	29.7	Very low	27.4	Very low	234 Å²	234	140.1 Å²	140.1	92%	0.918	71%	0.71	S	S	*	*	G	3₁₀ helix	trans	-85	-1	172.6	-97.2	-84.4	0	0	0	114.8	T483	T483-Y485 VanDerWaalsContact C-N 3.32Å; T483-Y485 PolarHBondContact O-N 3.25Å
486	L	27.7	Very low	27.3	Very low	149 Å²	149	145.5 Å²	145.5	78%	0.78	72%	0.722	S	S	*	*	S	Bend	trans	-110.3	-6	-179.6	-72.3	169.9	0	0	0	114.8	T483 Y488	T483-L486 PolarHBondContact O-N 3.4Å; L486-Y488 VanDerWaalsContact C-N 3.27Å; L486-Y488 PolarHBondContact O-N 3.44Å
487	N	26.4	Very low	27.2	Very low	99 Å²	99	145.3 Å²	145.3	53%	0.529	72%	0.716	S	S	.	*	G	3₁₀ helix	trans	-77.1	1.8	-174.4	-92.1	-41.1	0	0	0	116.1	G489 R490	N487-G489 PolarHBondContact O-N 2.92Å; N487-G489 VanDerWaalsContact O-N 3.13Å; N487-R490 PolarHBondContact O-N 3.42Å
488	Y	29.8	Very low	27.2	Very low	217 Å²	217	143.7 Å²	143.7	85%	0.851	71%	0.711	S	S	*	*	G	3₁₀ helix	trans	-66.3	-8.1	170.3	-102.3	-78.5	0	0	0	113.9	L486 R490	L486-Y488 VanDerWaalsContact C-N 3.27Å; L486-Y488 PolarHBondContact O-N 3.44Å; Y488-R490 VanDerWaalsContact C-N 3.32Å; Y488-R490 PolarHBondContact O-N 3.06Å
489	G	27.5	Very low	27.1	Very low	59 Å²	59	143.6 Å²	143.6	61%	0.608	71%	0.711	S	S	*	*	G	3₁₀ helix	trans	-78.3	4.8	174	0	0	0	0	0	116.6	N487	N487-G489 PolarHBondContact O-N 2.92Å; N487-G489 VanDerWaalsContact O-N 3.13Å
490	R	26.6	Very low	27.2	Very low	208 Å²	208	141.4 Å²	141.4	79%	0.785	70%	0.701	S	S	*	*	G	3₁₀ helix	trans	-120.3	14.3	-177.6	-85.3	-170.4	173.8	-170.5	1	116.4	N487 Y488	N487-R490 PolarHBondContact O-N 3.42Å; Y488-R490 VanDerWaalsContact C-N 3.32Å; Y488-R490 PolarHBondContact O-N 3.06Å
491	L	28.1	Very low	27	Very low	132 Å²	132	140.1 Å²	140.1	69%	0.691	71%	0.707	S	S	*	*	S	Bend	trans	-115.5	13.2	171.7	-75.9	173.8	0	0	0	114.2	D493	L491-D493 VanDerWaalsContact C-N 3.31Å
492	S	27.9	Very low	27.1	Very low	72 Å²	72	142.3 Å²	142.3	50%	0.503	72%	0.719	S	S	.	*	G	3₁₀ helix	trans	-61.4	-36.6	167.9	39.7	0	0	0	0	113	T494 F495	S492-T494 PolarHBondContact O-N 2.75Å; S492-F495 PolarHBondContact O-N 2.76Å
493	D	26.1	Very low	27.1	Very low	142 Å²	142	142.7 Å²	142.7	76%	0.759	72%	0.717	S	S	*	*	G	3₁₀ helix	trans	-81.3	6.5	-155.4	-60.3	2.4	0	0	0	114.7	L491	L491-D493 VanDerWaalsContact C-N 3.31Å
494	T	27.1	Very low	27.3	Very low	115 Å²	115	144.7 Å²	144.7	71%	0.706	73%	0.734	S	S	*	*	G	3₁₀ helix	trans	-112	-9.5	174.9	55.3	0	0	0	0	114.3	S492 K496	S492-T494 PolarHBondContact O-N 2.75Å; T494-K496 PolarHBondContact O-N 2.84Å
495	F	26.3	Very low	27.4	Very low	165 Å²	165	144.1 Å²	144.1	72%	0.724	74%	0.735	S	S	*	*	S	Bend	trans	-93.5	83.3	166.7	-81.3	-79	0	0	0	110.3	S492 H497	S492-F495 PolarHBondContact O-N 2.76Å; F495-H497 PolarHBondContact O-N 2.84Å
496	K	25.9	Very low	27.2	Very low	200 Å²	200	143.3 Å²	143.3	87%	0.87	73%	0.732	S	S	*	*			trans	-49.5	113.4	165.4	-76.2	-172.6	174.1	-174.5	0	109	T494 V498	T494-K496 PolarHBondContact O-N 2.84Å; K496-V498 PolarHBondContact O-N 3.03Å
497	H	26	Very low	27.4	Very low	156 Å²	156	141.5 Å²	141.5	72%	0.722	73%	0.732	S	S	*	*			trans	-56.4	127.2	175.9	-72.1	-28.3	0	0	0	109.9	F495 H499	F495-H497 PolarHBondContact O-N 2.84Å; H497-H499 PolarHBondContact O-N 2.91Å
498	V	24.4	Very low	27.5	Very low	124 Å²	124	141.4 Å²	141.4	75%	0.752	74%	0.739	S	S	*	*			trans	-76	72.7	166	-175.4	0	0	0	0	107.4	K496 F500	K496-V498 PolarHBondContact O-N 3.03Å; V498-F500 HydrophobicContact CG1-CD2 4.37Å; V498-F500 HydrophobicContact CG1-CE2 3.95Å; V498-F500 HydrophobicContact CG1-CZ 4.38Å; V498-F500 PolarHBondContact O-N 3.02Å
499	H	26.9	Very low	27.5	Very low	159 Å²	159	138.1 Å²	138.1	74%	0.736	74%	0.735	S	S	*	*			trans	-69.5	109.4	164.7	-93	-79.4	0	0	0	107.9	H497	H497-H499 PolarHBondContact O-N 2.91Å
500	F	27.3	Very low	27.5	Very low	163 Å²	163	142.4 Å²	142.4	72%	0.715	74%	0.744	S	S	*	*			trans	-61.8	138.1	157.8	-69.7	-94.5	0	0	0	107.9	V498	V498-F500 HydrophobicContact CG1-CD2 4.37Å; V498-F500 HydrophobicContact CG1-CE2 3.95Å; V498-F500 HydrophobicContact CG1-CZ 4.38Å; V498-F500 PolarHBondContact O-N 3.02Å
501	A	25.1	Very low	27.7	Very low	85 Å²	85	137.2 Å²	137.2	70%	0.702	74%	0.74	S	S	*	*			trans	-66	143.4	178.3	0	0	0	0	0	110.7
502	D	28	Very low	27.8	Very low	151 Å²	151	138.2 Å²	138.2	81%	0.807	75%	0.745	S	S	*	*				-173.9	160.9	106.3	-93.5	-24.3	0	0	0	113.3
503	E	28.9	Very low	27.7	Very low	173 Å²	173	140.2 Å²	140.2	81%	0.808	76%	0.759	S	S	*	*			trans	55.8	99	159.7	-67.5	-175.3	157	0	0	121.6
504	S	28.5	Very low	27.9	Very low	112 Å²	112	145.5 Å²	145.5	78%	0.783	77%	0.768	S	S	*	*				76.9	159.5	129.8	89.3	0	0	0	0	118.6
505	T	30.6	Very low	27.9	Very low	111 Å²	111	145.7 Å²	145.7	68%	0.681	77%	0.774	S	S	*	*			cis	-149.4	125	-3.7	-38.8	0	0	0	0	111
506	Y	26.9	Very low	28.3	Very low	217 Å²	217	143.3 Å²	143.3	85%	0.851	78%	0.778	S	S	*	*			trans	56.4	158.2	152.2	-83.2	-114.5	0	0	0	123.3
507	S	31.3	Very low	28.6	Very low	112 Å²	112	138.4 Å²	138.4	78%	0.783	77%	0.769	S	S	*	*			trans	72.7	151.7	170.6	74.9	0	0	0	0	118.6
508	S	27.5	Very low	29	Very low	96 Å²	96	138.7 Å²	138.7	67%	0.671	78%	0.775	S	S	*	*				-179.3	157.8	-61.5	45.8	0	0	0	0	110.9
509	L	30.4	Very low	29.2	Very low	148 Å²	148	137.5 Å²	137.5	78%	0.775	77%	0.771	S	S	*	*			trans	78.3	118.7	173.6	-53.1	174	0	0	0	113.9
510	N	27.3	Very low	29.2	Very low	149 Å²	149	134.8 Å²	134.8	80%	0.797	77%	0.77	S	S	*	*				78.6	133.8	70.6	-73.5	-6.8	0	0	0	112.1
511	S	31.2	Very low	29.4	Very low	99 Å²	99	132.6 Å²	132.6	69%	0.692	78%	0.775	S	S	*	*			cis	-170.1	176.9	20.5	51.9	0	0	0	0	115.4
512	L	30.1	Very low	29.5	Very low	154 Å²	154	135.7 Å²	135.7	81%	0.806	78%	0.779	S	S	*	*			trans	75.4	89.3	145.5	-76.7	160.9	0	0	0	123.4
513	S	26.8	Very low	29.7	Very low	113 Å²	113	139.6 Å²	139.6	79%	0.79	78%	0.784	S	S	*	*				14.5	140.1	122.4	-39.8	0	0	0	0	123.3
514	R	29.5	Very low	29.7	Very low	253 Å²	253	136.7 Å²	136.7	96%	0.955	78%	0.779	S	S	*	*			trans	-158.3	156.2	140.1	-134.5	169.5	172.2	167.4	-3.8	113
515	S	27.8	Very low	29.8	Very low	119 Å²	119	138 Å²	138	83%	0.832	78%	0.777	S	S	*	*			trans	-158.5	167.1	-168.2	55.3	0	0	0	0	115.9
516	S	33.3	Very low	29.5	Very low	115 Å²	115	137.7 Å²	137.7	80%	0.804	78%	0.78	S	S	*	*			trans	-173.4	-177.4	-179.4	59.8	0	0	0	0	107.5
517	S	33.7	Very low	29.7	Very low	98 Å²	98	132.3 Å²	132.3	69%	0.685	77%	0.773	S	S	*	*			cis	178.1	157.2	-27.9	50.2	0	0	0	0	106.1
518	L	32.4	Very low	29.7	Very low	162 Å²	162	132.5 Å²	132.5	85%	0.848	78%	0.775	S	S	*	*			cis	-166.6	163	-18.5	-87.3	165.7	0	0	0	103.6
519	C	29.9	Very low	29.7	Very low	99 Å²	99	132.9 Å²	132.9	67%	0.669	78%	0.777	S	S	*	*			cis	-138.2	-175	3.5	-116.3	0	0	0	0	107.4
520	S	27.3	Very low	29.8	Very low	101 Å²	101	131.9 Å²	131.9	71%	0.706	78%	0.78	S	S	*	*			cis	66.8	129.8	49.5	-34.4	0	0	0	0	114
521	S	30.2	Very low	29.8	Very low	117 Å²	117	133.7 Å²	133.7	82%	0.818	78%	0.784	S	S	*	*			cis	-148.2	173.1	17.9	-64.1	0	0	0	0	114.2
522	N	28	Very low	29.7	Very low	150 Å²	150	136 Å²	136	80%	0.802	79%	0.794	S	S	*	*			trans	-97.2	162.1	175	-54.8	-58.8	0	0	0	113
523	Y	31.8	Very low	29.5	Very low	233 Å²	233	133.4 Å²	133.4	91%	0.914	79%	0.788	S	S	*	*			trans	-158.5	173.2	141.6	-106.6	-70.1	0	0	0	111.3
524	T	28.7	Very low	29.7	Very low	112 Å²	112	139.6 Å²	139.6	69%	0.687	80%	0.796	S	S	*	*			trans	-136.1	172.6	-162.2	59.3	0	0	0	0	114.9
525	N	30	Very low	29.5	Very low	140 Å²	140	133 Å²	133	75%	0.749	78%	0.784	S	S	*	*			trans	98.7	109.5	157.8	-63.5	4.9	0	0	0	120.6
526	S	26.2	Very low	29.8	Very low	105 Å²	105	136.5 Å²	136.5	73%	0.734	79%	0.789	S	S	*	*				66.6	145.5	126.2	66.3	0	0	0	0	124.6
527	S	30.5	Very low	29.5	Very low	103 Å²	103	137.4 Å²	137.4	72%	0.72	79%	0.785	S	S	*	*			trans	91.7	128.7	146.1	71.7	0	0	0	0	121.2
528	S	31.7	Very low	29.6	Very low	116 Å²	116	140.8 Å²	140.8	81%	0.811	80%	0.795	S	S	*	*			trans	57.2	136.1	151.3	37.7	0	0	0	0	122.3
529	S	26.7	Very low	29.6	Very low	104 Å²	104	138.3 Å²	138.3	73%	0.727	78%	0.782	S	S	*	*			trans	-82.6	173.6	164.2	51	0	0	0	0	111.9
530	P	33.7	Very low	29.8	Very low	127 Å²	127	139.8 Å²	139.8	83%	0.825	78%	0.784	S	S	*	*				-138.7	-179.3	99.4	39.1	-27.4	0	0	0	114.2
531	Q	26.5	Very low	30.1	Very low	188 Å²	188	140.2 Å²	140.2	88%	0.879	79%	0.787	S	S	*	*			trans	-91.2	158.5	176.6	-61.4	167.3	-68.8	0	0	112.1
532	T	29.1	Very low	30.4	Very low	147 Å²	147	140.3 Å²	140.3	90%	0.902	79%	0.785	S	S	*	*			trans	-134.1	133.1	154.7	51.4	0	0	0	0	109.4
533	S	25.4	Very low	30.7	Very low	99 Å²	99	141.1 Å²	141.1	69%	0.692	78%	0.783	S	S	*	*			trans	-100.7	157.7	-173.8	48.1	0	0	0	0	113
534	Y	30.6	Very low	30.9	Very low	243 Å²	243	136.7 Å²	136.7	95%	0.953	77%	0.773	S	S	*	*			trans	-142.4	135.3	149.6	-97.7	-78.6	0	0	0	108.9
535	T	26.8	Very low	31.3	Very low	114 Å²	114	137 Å²	137	70%	0.699	77%	0.77	S	S	*	*			trans	-129.5	148	-174.8	43.1	0	0	0	0	110.9
536	M	32.5	Very low	31.6	Very low	193 Å²	193	136.1 Å²	136.1	95%	0.951	77%	0.766	S	S	*	*			trans	-137.7	121.9	157.9	-82.9	-65.8	174.6	0	0	107.5
537	N	28	Very low	32.1	Very low	135 Å²	135	137.4 Å²	137.4	72%	0.722	76%	0.764	S	S	*	*			trans	-92.1	154.4	178.2	-89.3	5.6	0	0	0	111.1
538	L	35.2	Very low	32.5	Very low	169 Å²	169	139.2 Å²	139.2	89%	0.885	77%	0.766	S	S	*	*			trans	-153.8	94.2	150.3	-106.2	165.3	0	0	0	109.8
539	N	32.9	Very low	32.8	Very low	109 Å²	109	139 Å²	139	58%	0.583	76%	0.755	S	S	*	*			trans	7.9	146.9	131	-63.8	60.8	0	0	0	118.1
540	D	34.1	Very low	33.4	Very low	131 Å²	131	140.9 Å²	140.9	70%	0.701	75%	0.751	S	S	*	*			cis	-163.1	160.7	0.5	-101.4	-21.7	0	0	0	112.2
541	S	34.5	Very low	33.4	Very low	110 Å²	110	141.5 Å²	141.5	77%	0.769	75%	0.747	S	S	*	*			trans	68.9	124.1	152.2	-60.4	0	0	0	0	122.9
542	P	35.1	Very low	33.7	Very low	119 Å²	119	139.1 Å²	139.1	77%	0.773	74%	0.739	S	S	*	*			trans	-102	161.1	156.5	38.9	-31.2	0	0	0	112.7
543	E	34.4	Very low	33.9	Very low	166 Å²	166	139.1 Å²	139.1	78%	0.776	74%	0.738	S	S	*	*				173.5	158.1	123.5	-108.4	-175.8	-162	0	0	116.9
544	M	37	Very low	34.2	Very low	140 Å²	140	143.1 Å²	143.1	69%	0.69	74%	0.743	S	S	*	*			trans	68.6	104.6	153.1	-66.2	-65.4	-178.4	0	0	123.6
545	N	35.7	Very low	34.3	Very low	118 Å²	118	141 Å²	141	63%	0.631	74%	0.742	S	S	*	*				78	120	116	-75.4	38.9	0	0	0	125.9
546	D	36.9	Very low	34.5	Very low	123 Å²	123	140.7 Å²	140.7	66%	0.658	75%	0.745	S	S	*	*				93.7	132.4	120.4	-64.5	-10.6	0	0	0	124.6
547	N	37.2	Very low	34.4	Very low	132 Å²	132	138.5 Å²	138.5	71%	0.706	74%	0.735	S	S	*	*			trans	75.4	115.1	152.9	-56.8	-24.3	0	0	0	121.3
548	D	38.7	Very low	34.5	Very low	140 Å²	140	136.8 Å²	136.8	75%	0.749	73%	0.734	S	S	*	*				58.9	144.8	127.5	-55.2	-17.4	0	0	0	120.9
549	D	38.8	Very low	34.4	Very low	111 Å²	111	138.4 Å²	138.4	59%	0.594	73%	0.734	S	S	*	*			cis	-153.6	159.1	16	-147.4	4.4	0	0	0	116.9
550	K	37.6	Very low	34.3	Very low	144 Å²	144	139 Å²	139	63%	0.626	74%	0.737	S	S	*	*			trans	8.1	124.1	160	-66.2	155.5	-163.1	81.4	0	120.7
551	N	34	Very low	34.1	Very low	141 Å²	141	140.1 Å²	140.1	75%	0.754	74%	0.741	S	S	*	*				158.7	99.7	113.7	-81.7	-50.3	0	0	0	112.3
552	I	32.9	Very low	33.8	Very low	138 Å²	138	141.7 Å²	141.7	71%	0.708	74%	0.74	S	S	*	*				62	95.4	87.3	-56	168.2	0	0	0	115.2
553	V	34.6	Very low	33.5	Very low	146 Å²	146	145.3 Å²	145.3	89%	0.885	74%	0.744	S	S	*	*				-139.7	141.4	122.7	177.1	0	0	0	0	107.4
554	K	29.7	Very low	33.3	Very low	183 Å²	183	144.8 Å²	144.8	80%	0.796	75%	0.747	S	S	*	*			trans	-104.1	139.7	-179.3	-62.8	174.3	179.8	175.4	0	111.4
555	Q	33.8	Very low	32.9	Very low	199 Å²	199	146.1 Å²	146.1	93%	0.93	75%	0.751	S	S	*	*			trans	-152.1	130.2	133.2	-114.9	165	26.2	0	0	111.7
556	S	30.6	Very low	32.7	Very low	108 Å²	108	147.5 Å²	147.5	76%	0.755	76%	0.757	S	S	*	*			trans	-74.7	166.8	173.4	42.3	0	0	0	0	110.1
557	I	31.7	Very low	32.3	Very low	147 Å²	147	148.8 Å²	148.8	75%	0.754	76%	0.759	S	S	*	*			cis	-147.2	131.1	39.6	-64.3	159.4	0	0	0	111.3
558	S	29.8	Very low	32	Very low	99 Å²	99	152.9 Å²	152.9	69%	0.692	77%	0.767	S	S	*	*			trans	-94.6	146.1	159.5	-64	0	0	0	0	111
559	K	32.8	Very low	31.5	Very low	202 Å²	202	152.1 Å²	152.1	88%	0.878	76%	0.759	S	S	*	*			trans	-139.4	60.8	164.7	-94.3	-162.7	172.2	-172.3	0	110
560	D	30	Very low	31.2	Very low	121 Å²	121	154.5 Å²	154.5	65%	0.647	76%	0.764	S	S	*	*			trans	-81.3	168	169.3	-60.1	-72.2	0	0	0	111.2
561	I	30.2	Very low	30.9	Very low	156 Å²	156	156.8 Å²	156.8	80%	0.8	77%	0.774	S	S	*	*			trans	64.2	100.6	162.6	-53.4	142.5	0	0	0	115.2
562	L	27.9	Very low	30.7	Very low	142 Å²	142	159.5 Å²	159.5	74%	0.743	78%	0.779	S	S	*	*				171.4	105.8	97.3	-170.7	71.7	0	0	0	110.9
563	F	30	Very low	30.6	Very low	196 Å²	196	158.5 Å²	158.5	86%	0.86	78%	0.781	S	S	*	*			trans	-174.8	86.8	145.4	-106.2	-64.2	0	0	0	110.4
564	N	29.4	Very low	30.5	Very low	155 Å²	155	159.5 Å²	159.5	83%	0.829	78%	0.781	S	S	*	*			trans	-142.5	158.6	161	-100.8	-27.6	0	0	0	106.9
565	H	28.9	Very low	30.7	Very low	167 Å²	167	159.5 Å²	159.5	77%	0.773	78%	0.781	S	S	*	*			trans	60.9	82.8	-170.2	-77.3	-84.7	0	0	0	116.2
566	L	31.8	Very low	30.6	Very low	147 Å²	147	161.2 Å²	161.2	77%	0.77	78%	0.779	S	S	*	*				-128.3	108.2	129.1	-82	179.1	0	0	0	108.4
567	E	27.6	Very low	30.7	Very low	150 Å²	150	161.7 Å²	161.7	70%	0.701	78%	0.777	S	S	*	*			trans	-69.7	136	164.6	-68.8	-177.9	88.3	0	0	109.3
568	Y	30.4	Very low	30.9	Very low	218 Å²	218	161.6 Å²	161.6	86%	0.855	78%	0.777	S	S	*	*			trans	-128.5	99.7	166.5	-111.9	-85.3	0	0	0	110.6
569	Q	28.7	Very low	31.2	Very low	125 Å²	125	162 Å²	162	58%	0.584	78%	0.78	S	S	*	*			trans	-83.1	140.3	174.4	-68.8	-162.7	21.6	0	0	112.2
570	K	33.5	Very low	31.4	Very low	161 Å²	161	156.5 Å²	156.5	70%	0.7	77%	0.767	S	S	*	*			trans	66	105.1	149.1	-67.4	158.2	-178.9	152	0	119.1
571	K	29.8	Very low	31.9	Very low	192 Å²	192	156.2 Å²	156.2	84%	0.835	77%	0.772	S	S	*	*				55.8	102.7	126.3	-61.4	-178.2	177.7	-177	0	119
572	F	30.1	Very low	32.2	Very low	197 Å²	197	158.7 Å²	158.7	86%	0.864	78%	0.777	S	S	*	*			trans	-135.2	127.2	140.1	-81.9	-76.1	0	0	0	111.5	L574	F572-L574 PolarHBondContact O-N 3.06Å
573	P	31.6	Very low	32.7	Very low	117 Å²	117	159.7 Å²	159.7	76%	0.76	78%	0.779	S	S	*	*			trans	-88.1	91.4	177.5	33.6	-32	0	0	0	111	K575	P573-K575 PolarHBondContact O-N 2.96Å
574	L	33.3	Very low	33.1	Very low	167 Å²	167	157.2 Å²	157.2	87%	0.874	78%	0.775	S	S	*	*			trans	-67.9	94.3	176.3	-83	167.8	0	0	0	111.7	F572 R576	F572-L574 PolarHBondContact O-N 3.06Å; L574-R576 PolarHBondContact O-N 2.78Å
575	K	32.5	Very low	33.6	Very low	183 Å²	183	155.1 Å²	155.1	80%	0.796	77%	0.772	S	S	*	*			trans	-58.3	116.6	169	-70.1	177.4	178.2	174.8	0	109.5	P573 T577	P573-K575 PolarHBondContact O-N 2.96Å; K575-T577 VanDerWaalsContact C-N 3.28Å; K575-T577 PolarHBondContact O-N 3.12Å
576	R	33.2	Very low	34.3	Very low	236 Å²	236	154.4 Å²	154.4	89%	0.891	78%	0.775	S	S	*	*			trans	-69.7	87	163.6	-74.8	-171.1	177.4	119	2.8	109.7	L574 I578	L574-R576 PolarHBondContact O-N 2.78Å; R576-I578 VanDerWaalsContact C-N 3.31Å; R576-I578 PolarHBondContact O-N 2.93Å
577	T	30.8	Very low	35	Very low	117 Å²	117	156.8 Å²	156.8	72%	0.718	78%	0.778	S	S	*	*			trans	-69.3	89.6	166.1	45.4	0	0	0	0	109.2	K575 S579	K575-T577 VanDerWaalsContact C-N 3.28Å; K575-T577 PolarHBondContact O-N 3.12Å; T577-S579 PolarHBondContact O-N 3.21Å
578	I	37.2	Very low	35.8	Very low	146 Å²	146	155.9 Å²	155.9	75%	0.749	78%	0.784	S	S	*	*			trans	-70.1	86.5	165.7	-56.1	176.2	0	0	0	106.8	R576 S580	R576-I578 VanDerWaalsContact C-N 3.31Å; R576-I578 PolarHBondContact O-N 2.93Å; I578-S580 PolarHBondContact O-N 3.45Å
579	S	35.3	Very low	36.8	Very low	107 Å²	107	152.9 Å²	152.9	75%	0.748	78%	0.782	S	S	*	*			trans	-73.4	71.8	170.2	56.1	0	0	0	0	109.3	T577	T577-S579 PolarHBondContact O-N 3.21Å
580	S	37	Very low	37.8	Very low	87 Å²	87	152.1 Å²	152.1	61%	0.608	79%	0.786	S	S	*	*			trans	-58.5	127.5	167.3	40.1	0	0	0	0	108.7	I578 K582	I578-S580 PolarHBondContact O-N 3.45Å; S580-K582 PolarHBondContact O-N 2.87Å; S580-K582 VanDerWaalsContact O-N 3.12Å
581	P	41.4	Very low	38.5	Very low	115 Å²	115	149.2 Å²	149.2	75%	0.747	78%	0.784	S	S	*	*			trans	-58.7	121.6	175.5	-24.1	34.1	0	0	0	109.3	M583	P581-M583 VanDerWaalsContact C-N 3.29Å; P581-M583 PolarHBondContact O-N 3.38Å
582	K	36.8	Very low	40	Very low	208 Å²	208	149.4 Å²	149.4	90%	0.904	79%	0.785	S	S	*	*			trans	-66.1	94.1	168.7	-79.6	-176	175.2	179.2	0	107.9	S580 N584	S580-K582 PolarHBondContact O-N 2.87Å; S580-K582 VanDerWaalsContact O-N 3.12Å; K582-N584 PolarHBondContact O-N 3.26Å
583	M	37.7	Very low	41.2	Very low	162 Å²	162	145.1 Å²	145.1	80%	0.798	78%	0.775	S	S	*	*			trans	-59.9	98.5	170.3	-94.7	-73.5	158	0	0	108.7	P581	P581-M583 VanDerWaalsContact C-N 3.29Å; P581-M583 PolarHBondContact O-N 3.38Å
584	N	39.2	Very low	42.3	Very low	144 Å²	144	145.1 Å²	145.1	77%	0.77	77%	0.773	S	S	*	*			trans	-68.5	133.6	175.6	-155.8	7.8	0	0	0	108.2	K582 N586	K582-N584 PolarHBondContact O-N 3.26Å; N584-N586 VanDerWaalsContact C-N 3.32Å; N584-N586 PolarHBondContact O-N 3.12Å
585	S	37.9	Very low	43.8	Very low	111 Å²	111	142.1 Å²	142.1	78%	0.776	76%	0.761	S	S	*	*	S	Bend	trans	-80.4	69.8	-156.7	60.3	0	0	0	0	114.2
586	N	44.4	Very low	45	Very low	153 Å²	153	139 Å²	139	82%	0.818	75%	0.753	S	S	*	*			trans	-110.8	139.4	164.4	-82.2	-33.3	0	0	0	110.7	N584	N584-N586 VanDerWaalsContact C-N 3.32Å; N584-N586 PolarHBondContact O-N 3.12Å
587	K	45.8	Very low	46.1	Very low	196 Å²	196	134.3 Å²	134.3	85%	0.852	75%	0.745	S	S	*	*			trans	-73.7	166.4	-177.1	-66.5	172.4	-179.6	171.7	0	110.9
588	T	45.4	Very low	47.5	Very low	132 Å²	132	137.1 Å²	137.1	81%	0.81	75%	0.748	S	S	*	*	S	Bend	trans	56.9	73.1	170.2	59.2	0	0	0	0	116.4
589	N	51.1	Low	48.2	Very low	154 Å²	154	136.9 Å²	136.9	82%	0.824	74%	0.743	S	S	*	*			trans	-171.6	101.3	131	-97.2	-18.1	0	0	0	111.2
590	T	49.1	Very low	48.9	Very low	110 Å²	110	139.2 Å²	139.2	68%	0.675	75%	0.747	S	S	*	*			trans	-80.6	124.4	165	45.3	0	0	0	0	109.2	F592	T590-F592 PolarHBondContact O-N 3.09Å
591	P	49.7	Very low	49.5	Very low	100 Å²	100	140.4 Å²	140.4	65%	0.649	75%	0.747	S	S	*	*			trans	-66.7	120.4	176.7	26.9	-33.1	0	0	0	110.2	V593	P591-V593 PolarHBondContact O-N 3.22Å
592	F	60	Low	50	Low	195 Å²	195	142.9 Å²	142.9	86%	0.855	75%	0.752	S	S	*	*	S	Bend	trans	-69.1	-14.8	-175.9	-77.9	-85.8	0	0	0	114.5	T590	T590-F592 PolarHBondContact O-N 3.09Å
593	V	56.6	Low	50.9	Low	107 Å²	107	140 Å²	140	65%	0.648	75%	0.747	S	S	*	*			trans	-140.8	131.2	-179.4	-175.1	0	0	0	0	109.7	P591 V595	P591-V593 PolarHBondContact O-N 3.22Å; V593-V595 HydrophobicContact CG1-CG2 3.77Å
594	T	54.7	Low	51.6	Low	117 Å²	117	140.3 Å²	140.3	72%	0.718	75%	0.751	S	S	*	*			trans	-98.4	109.7	165.6	-54.9	0	0	0	0	108.4
595	V	64.6	Low	52.5	Low	105 Å²	105	141.2 Å²	141.2	64%	0.636	76%	0.755	S	S	*	*			trans	-94.5	104.4	177.4	-176.5	0	0	0	0	109.2	V593 L597	V593-V595 HydrophobicContact CG1-CG2 3.77Å; V595-L597 HydrophobicContact CG1-CD2 3.95Å; V595-L597 HydrophobicContact CG1-CG 4.21Å; V595-L597 PolarHBondContact O-N 2.92Å
596	N	56.9	Low	53.7	Low	116 Å²	116	144.8 Å²	144.8	62%	0.62	76%	0.759	S	S	*	*			trans	-79.6	101.6	171.1	-73	-3.2	0	0	0	109.4	F598	N596-F598 HydrophobicContact CB-CE2 4.09Å; N596-F598 HydrophobicContact CB-CZ 4.33Å; N596-F598 PolarHBondContact O-N 3.38Å
597	L	56.8	Low	54.6	Low	139 Å²	139	140.9 Å²	140.9	73%	0.728	74%	0.741	S	S	*	*			trans	-80.3	99.8	172.8	-66	174.5	0	0	0	110	V595 H599	V595-L597 HydrophobicContact CG1-CD2 3.95Å; V595-L597 HydrophobicContact CG1-CG 4.21Å; V595-L597 PolarHBondContact O-N 2.92Å; L597-H599 PolarHBondContact O-N 3.03Å
598	F	59.1	Low	55.6	Low	176 Å²	176	134.9 Å²	134.9	77%	0.772	72%	0.722	S	S	*	*			trans	-74.2	115.9	166.4	-58.9	-84.4	0	0	0	108.5	N596	N596-F598 HydrophobicContact CB-CE2 4.09Å; N596-F598 HydrophobicContact CB-CZ 4.33Å; N596-F598 PolarHBondContact O-N 3.38Å
599	H	53.2	Low	56.1	Low	140 Å²	140	135 Å²	135	65%	0.648	72%	0.717	S	S	*	*			trans	-77.5	140	168.3	-79.6	46.7	0	0	0	109.3	L597 D601	L597-H599 PolarHBondContact O-N 3.03Å; H599-D601 HydrophobicContact CB-CB 4.47Å; H599-D601 WeakPolarHBondContact CB-OD2 3.28Å; H599-D601 IonicContact CD2-OD2 2.79Å; H599-D601 PolarHBondContact CD2-OD2 3.31Å; H599-D601 IonicContact CG-OD2 2.74Å; H599-D601 PolarHBondContact O-N 3.5Å
600	N	49.2	Very low	56.7	Low	157 Å²	157	137.3 Å²	137.3	84%	0.84	71%	0.714	S	S	*	*			trans	-89.9	36.6	179.2	-70.5	-24.7	0	0	0	111.4	I602	N600-I602 VanDerWaalsContact C-N 3.34Å; N600-I602 PolarHBondContact O-N 3.21Å
601	D	49.6	Very low	57.1	Low	111 Å²	111	134.8 Å²	134.8	59%	0.594	70%	0.698	S	S	*	*			trans	-84.6	75.7	-170.1	-64.4	-20.9	0	0	0	111.1	H599 D603	H599-D601 HydrophobicContact CB-CB 4.47Å; H599-D601 WeakPolarHBondContact CB-OD2 3.28Å; H599-D601 IonicContact CD2-OD2 2.79Å; H599-D601 PolarHBondContact CD2-OD2 3.31Å; H599-D601 IonicContact CG-OD2 2.74Å; H599-D601 PolarHBondContact O-N 3.5Å; D601-D603 PolarHBondContact O-N 2.9Å
602	I	53.3	Low	57.6	Low	167 Å²	167	132.8 Å²	132.8	86%	0.856	68%	0.684	S	S	*	*	S	Bend	trans	55.6	-34	153.9	-59.1	178.7	0	0	0	119.2	N600 L604	N600-I602 VanDerWaalsContact C-N 3.34Å; N600-I602 PolarHBondContact O-N 3.21Å; I602-L604 PolarHBondContact O-N 3.25Å; I602-L604 VanDerWaalsContact O-N 3.13Å
603	D	55.1	Low	57.1	Low	148 Å²	148	126.7 Å²	126.7	79%	0.791	66%	0.661	S	S	*	*			trans	-60.3	113.3	176	-74.4	-20.1	0	0	0	110.4	D601 L605	D601-D603 PolarHBondContact O-N 2.9Å; D603-L605 PolarHBondContact O-N 2.95Å; D603-L605 VanDerWaalsContact O-N 3.17Å
604	L	52.6	Low	56.8	Low	168 Å²	168	130.3 Å²	130.3	88%	0.88	66%	0.663	S	S	*	*			trans	-54.2	121.5	173	-88	161.7	0	0	0	109.4	I602 E606	I602-L604 PolarHBondContact O-N 3.25Å; I602-L604 VanDerWaalsContact O-N 3.13Å; L604-E606 VanDerWaalsContact C-N 3.32Å; L604-E606 PolarHBondContact O-N 3.43Å
605	L	57.1	Low	56.6	Low	164 Å²	164	130.8 Å²	130.8	86%	0.859	66%	0.66	S	S	*	*			trans	-60.2	92.6	176.4	-76.9	168.5	0	0	0	110.1	D603 T607	D603-L605 PolarHBondContact O-N 2.95Å; D603-L605 VanDerWaalsContact O-N 3.17Å; L605-T607 PolarHBondContact O-N 3.29Å; L605-T607 PolarHBondContact O-OG1 3Å
606	E	63.8	Low	55.9	Low	185 Å²	185	129.8 Å²	129.8	86%	0.864	65%	0.648	S	S	*	*			trans	-58.3	103.4	-176.8	-170.1	178	-135.1	0	0	109.1	L604 P608	L604-E606 VanDerWaalsContact C-N 3.32Å; L604-E606 PolarHBondContact O-N 3.43Å; E606-P608 VanDerWaalsContact O-CD 3.23Å; E606-P608 WeakPolarHBondContact O-CD 3.42Å
607	T	63.6	Low	55.6	Low	71 Å²	71	128.8 Å²	128.8	44%	0.436	65%	0.647	S	S	.	*			trans	-70.8	114.7	-171.3	-68.3	0	0	0	0	107.6	L605 L609 V611 V612	L605-T607 PolarHBondContact O-N 3.29Å; L605-T607 PolarHBondContact O-OG1 3Å; T607-L609 PolarHBondContact O-N 2.91Å; T607-V611 HydrophobicContact CG2-CB 3.75Å; T607-V611 HydrophobicContact CG2-CG1 3.7Å; T607-V612 HydrophobicContact CG2-CG2 3.84Å; T607-V612 WeakPolarHBondContact O-CG2 3.5Å
608	P	65.3	Low	55.8	Low	71 Å²	71	130.2 Å²	130.2	46%	0.461	65%	0.65	S	S	.	*			trans	-58	140.8	-171.1	-26.5	35.3	0	0	0	110.6	E606 R610 V611 V612	E606-P608 VanDerWaalsContact O-CD 3.23Å; E606-P608 WeakPolarHBondContact O-CD 3.42Å; P608-R610 HydrophobicContact CB-CG 4.14Å; P608-R610 PolarHBondContact O-N 3.48Å; P608-V611 HydrophobicContact CB-CG2 4.42Å; P608-V611 WeakPolarHBondContact O-CA 3.4Å; P608-V611 VanDerWaalsContact O-CB 3.29Å; P608-V611 WeakPolarHBondContact O-CB 3.28Å; P608-V611 PolarHBondContact O-N 2.89Å; P608-V612 PolarHBondContact O-N 3.02Å
609	L	57.6	Low	56.7	Low	135 Å²	135	124.3 Å²	124.3	71%	0.707	62%	0.624	S	S	*	*	H	α-helix	trans	-48.7	-43.1	-175.9	-70.4	170.4	0	0	0	112.7	T607 V611 V612 N613	T607-L609 PolarHBondContact O-N 2.91Å; L609-V611 CarbonylContact O-C 3.54Å; L609-V611 PolarHBondContact O-N 3.3Å; L609-V612 CarbonylContact O-C 3.12Å; L609-V612 WeakPolarHBondContact O-CA 3.5Å; L609-V612 PolarHBondContact O-N 3.32Å; L609-N613 VanDerWaalsContact C-OD1 3.3Å; L609-N613 WeakPolarHBondContact O-CB 3.5Å; L609-N613 PolarHBondContact O-N 3.25Å; L609-N613 PolarHBondContact O-OD1 2.99Å
610	R	63.9	Low	58.3	Low	201 Å²	201	122 Å²	122	76%	0.758	61%	0.613	S	S	*	*	H	α-helix	trans	-54.5	-12.8	172.8	71.7	172.8	-169.4	163.5	4.1	116.5	P608 R614	P608-R610 HydrophobicContact CB-CG 4.14Å; P608-R610 PolarHBondContact O-N 3.48Å; R610-R614 WeakPolarHBondContact O-CB 3.47Å; R610-R614 WeakPolarHBondContact O-CD 3.46Å; R610-R614 WeakPolarHBondContact O-CG 3.48Å
611	V	57.3	Low	60.4	Low	57 Å²	57	114.8 Å²	114.8	35%	0.345	57%	0.574	S	S	.	*	H	α-helix	trans	-101.1	-40.4	173.9	-175.9	0	0	0	0	109.9	T607 P608 L609 R614 L615	T607-V611 HydrophobicContact CG2-CB 3.75Å; T607-V611 HydrophobicContact CG2-CG1 3.7Å; P608-V611 HydrophobicContact CB-CG2 4.42Å; P608-V611 WeakPolarHBondContact O-CA 3.4Å; P608-V611 VanDerWaalsContact O-CB 3.29Å; P608-V611 WeakPolarHBondContact O-CB 3.28Å; P608-V611 PolarHBondContact O-N 2.89Å; L609-V611 CarbonylContact O-C 3.54Å; L609-V611 PolarHBondContact O-N 3.3Å; V611-R614 CarbonylContact O-C 3.55Å; V611-R614 VanDerWaalsContact O-CA 3.3Å; V611-R614 WeakPolarHBondContact O-CA 3.29Å; V611-R614 PolarHBondContact O-N 3.37Å; V611-L615 HydrophobicContact CG1-CD1 4.18Å; V611-L615 VanDerWaalsContact O-CG 3.32Å; V611-L615 WeakPolarHBondContact O-CG 3.36Å; V611-L615 PolarHBondContact O-N 3.48Å
612	V	59.3	Low	62.5	Low	58 Å²	58	111.3 Å²	111.3	35%	0.352	56%	0.556	S	S	.	*	H	α-helix	trans	-59.8	-50.5	170.5	-173.6	0	0	0	0	110.6	T607 P608 L609 R614 L615 E616	T607-V612 HydrophobicContact CG2-CG2 3.84Å; T607-V612 WeakPolarHBondContact O-CG2 3.5Å; P608-V612 PolarHBondContact O-N 3.02Å; L609-V612 CarbonylContact O-C 3.12Å; L609-V612 WeakPolarHBondContact O-CA 3.5Å; L609-V612 PolarHBondContact O-N 3.32Å; V612-R614 PolarHBondContact O-N 2.92Å; V612-L615 CarbonylContact O-C 3.55Å; V612-L615 WeakPolarHBondContact O-CA 3.49Å; V612-L615 WeakPolarHBondContact O-CB 3.36Å; V612-L615 PolarHBondContact O-N 2.71Å; V612-E616 WeakPolarHBondContact O-CG 3.41Å; V612-E616 PolarHBondContact O-N 2.84Å
613	N	50.3	Low	64.4	Low	67 Å²	67	105.4 Å²	105.4	36%	0.358	53%	0.529	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-6	171.1	-58.1	68.3	0	0	0	113.7	L609 E616	L609-N613 VanDerWaalsContact C-OD1 3.3Å; L609-N613 WeakPolarHBondContact O-CB 3.5Å; L609-N613 PolarHBondContact O-N 3.25Å; L609-N613 PolarHBondContact O-OD1 2.99Å; N613-E616 WeakPolarHBondContact CA-OE2 3.3Å
614	R	50.3	Low	66.3	Low	183 Å²	183	101.9 Å²	101.9	69%	0.691	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.1	17.2	169.5	-68.3	-178.6	71.2	166.3	3.8	113.1	R610 V611 V612 T617	R610-R614 WeakPolarHBondContact O-CB 3.47Å; R610-R614 WeakPolarHBondContact O-CD 3.46Å; R610-R614 WeakPolarHBondContact O-CG 3.48Å; V611-R614 CarbonylContact O-C 3.55Å; V611-R614 VanDerWaalsContact O-CA 3.3Å; V611-R614 WeakPolarHBondContact O-CA 3.29Å; V611-R614 PolarHBondContact O-N 3.37Å; V612-R614 PolarHBondContact O-N 2.92Å; R614-T617 PolarHBondContact O-OG1 2.9Å; R614-T617 VanDerWaalsContact O-OG1 3.06Å
615	L	49.7	Very low	68.3	Low	127 Å²	127	94.8 Å²	94.8	67%	0.665	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.6	-23.1	167.8	-71.1	168.2	0	0	0	110.5	V611 V612 T617	V611-L615 HydrophobicContact CG1-CD1 4.18Å; V611-L615 VanDerWaalsContact O-CG 3.32Å; V611-L615 WeakPolarHBondContact O-CG 3.36Å; V611-L615 PolarHBondContact O-N 3.48Å; V612-L615 CarbonylContact O-C 3.55Å; V612-L615 WeakPolarHBondContact O-CA 3.49Å; V612-L615 WeakPolarHBondContact O-CB 3.36Å; V612-L615 PolarHBondContact O-N 2.71Å; L615-T617 PolarHBondContact O-N 2.98Å
616	E	49.9	Very low	70	Confident	84 Å²	84	90.9 Å²	90.9	39%	0.393	46%	0.459	S	S	.	.	S	Bend	trans	-56.9	-4.2	155	-68.9	178.6	155.3	0	0	113.4	V612 N613 E618 Q619	V612-E616 WeakPolarHBondContact O-CG 3.41Å; V612-E616 PolarHBondContact O-N 2.84Å; N613-E616 WeakPolarHBondContact CA-OE2 3.3Å; E616-E618 PolarHBondContact O-N 3.4Å; E616-Q619 PolarHBondContact O-N 3.37Å; E616-Q619 VanDerWaalsContact O-N 3.12Å
617	T	51.3	Low	71.5	Confident	96 Å²	96	83.6 Å²	83.6	59%	0.589	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	56	173.3	51.6	0	0	0	0	113.6	R614 L615	R614-T617 PolarHBondContact O-OG1 2.9Å; R614-T617 VanDerWaalsContact O-OG1 3.06Å; L615-T617 PolarHBondContact O-N 2.98Å
618	E	61.5	Low	73	Confident	168 Å²	168	80.4 Å²	80.4	79%	0.785	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-152.3	-4.7	152.8	-114.4	173.7	-125.6	0	0	112.6	E616 K620	E616-E618 PolarHBondContact O-N 3.4Å; E618-K620 PolarHBondContact O-N 3.06Å
619	Q	76.9	Confident	74.2	Confident	52 Å²	52	79.9 Å²	79.9	24%	0.243	40%	0.4	C	S	.	.			trans	-63.5	122.3	174	-65.3	-161.4	60.2	0	0	111.6	E616 N652 L653 S761 T762	E616-Q619 PolarHBondContact O-N 3.37Å; E616-Q619 VanDerWaalsContact O-N 3.12Å; Q619-N652 CarbonylContact O-C 3.59Å; Q619-N652 VanDerWaalsContact O-CA 3.24Å; Q619-N652 WeakPolarHBondContact O-CA 3.41Å; Q619-L653 HydrophobicContact CB-CD1 3.87Å; Q619-L653 HydrophobicContact CB-CG 4.03Å; Q619-L653 PolarHBondContact O-N 3.33Å; Q619-S761 WeakPolarHBondContact CA-OG 3.35Å; Q619-T762 HydrophobicContact CG-CG2 3.89Å; Q619-T762 PolarHBondContact OE1-OG1 3.44Å
620	K	88.1	Confident	75.8	Confident	93 Å²	93	80.2 Å²	80.2	40%	0.404	40%	0.398	S	S	.	.			trans	-142.6	165	-177.1	72	-163.3	175.1	-156.1	0	111.1	E618 V622 L653 S761	E618-K620 PolarHBondContact O-N 3.06Å; K620-V622 PolarHBondContact O-N 3.1Å; K620-L653 VanDerWaalsContact C-CD2 3.47Å; K620-S761 PolarHBondContact N-OG 3.43Å; K620-S761 PolarHBondContact O-N 3.37Å
621	W	92.2	Very high	77.1	Confident	5 Å²	5	72.6 Å²	72.6	2%	0.019	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	123.6	172.7	-63.4	105.7	0	0	0	111.3	F648 S650 L653 L683 L722 F731 L734 C758 P760	W621-F648 HydrophobicContact CB-CE1 4.1Å; W621-F648 HydrophobicContact CB-CZ 3.78Å; W621-S650 PolarHBondContact N-OG 3.39Å; W621-S650 WeakPolarHBondContact O-CB 3.49Å; W621-L653 HydrophobicContact CD2-CD2 3.86Å; W621-L653 HydrophobicContact CE3-CD2 4.3Å; W621-L653 HydrophobicContact CG-CD2 4.12Å; W621-L653 HydrophobicContact CZ2-CD2 4.31Å; W621-L653 PolarHBondContact NE1-O 2.87Å; W621-L683 HydrophobicContact CH2-CD2 3.97Å; W621-L683 HydrophobicContact CZ2-CD2 4Å; W621-L722 HydrophobicContact CZ2-CD1 3.88Å; W621-F731 HydrophobicContact CH2-CB 3.75Å; W621-F731 AromaticContact CH2-CD1 3.61Å; W621-F731 HydrophobicContact CH2-CD1 3.61Å; W621-F731 HydrophobicContact CH2-CE1 4.46Å; W621-F731 AromaticContact CH2-CG 3.88Å; W621-F731 HydrophobicContact CH2-CG 3.88Å; W621-F731 HydrophobicContact CZ2-CB 4.38Å; W621-F731 AromaticContact CZ2-CD1 3.58Å; W621-F731 HydrophobicContact CZ2-CD1 3.58Å; W621-F731 HydrophobicContact CZ2-CE1 4Å; W621-F731 HydrophobicContact CZ2-CG 4.03Å; W621-F731 HydrophobicContact CZ3-CB 4.44Å; W621-L734 HydrophobicContact CD2-CB 3.96Å; W621-L734 HydrophobicContact CD2-CD2 3.87Å; W621-L734 HydrophobicContact CE3-CB 3.59Å; W621-L734 HydrophobicContact CE3-CD2 4.29Å; W621-L734 HydrophobicContact CG-CD2 4.05Å; W621-L734 HydrophobicContact CH2-CB 3.52Å; W621-L734 HydrophobicContact CZ2-CB 3.92Å; W621-L734 HydrophobicContact CZ3-CB 3.35Å; W621-L734 VanDerWaalsContact CZ3-N 3.33Å; W621-C758 HydrophobicContact CB-CB 4.06Å; W621-C758 HydrophobicContact CD2-CB 4.49Å; W621-C758 HydrophobicContact CE3-CB 3.97Å; W621-C758 WeakPolarHBondContact CZ3-O 3.49Å; W621-P760 HydrophobicContact CE3-CG 4.38Å; W621-P760 HydrophobicContact CH2-CG 4.34Å; W621-P760 HydrophobicContact CZ3-CG 3.88Å
622	V	93.2	Very high	78.6	Confident	38 Å²	38	78 Å²	78	23%	0.23	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	113.2	173.9	-177.1	0	0	0	0	107.7	K620 C758 Y759 Y764	K620-V622 PolarHBondContact O-N 3.1Å; V622-C758 CarbonylContact O-C 3.56Å; V622-C758 VanDerWaalsContact O-CA 3.28Å; V622-C758 WeakPolarHBondContact O-CA 3.35Å; V622-Y759 PolarHBondContact N-O 3.41Å; V622-Y759 PolarHBondContact O-N 3.06Å; V622-Y764 HydrophobicContact CB-CE2 4.38Å; V622-Y764 HydrophobicContact CG1-CE2 4.07Å
623	P	94.7	Very high	80.1	Confident	42 Å²	42	78.6 Å²	78.6	27%	0.273	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	141.9	177.8	30.3	-34.6	0	0	0	111	F625 F648	P623-F625 HydrophobicContact CB-CD1 3.76Å; P623-F625 HydrophobicContact CB-CD2 4.14Å; P623-F625 HydrophobicContact CB-CE1 3.44Å; P623-F625 VanDerWaalsContact CB-CE1 3.44Å; P623-F625 HydrophobicContact CB-CE2 3.86Å; P623-F625 HydrophobicContact CB-CG 4.1Å; P623-F625 HydrophobicContact CB-CZ 3.5Å; P623-F625 VanDerWaalsContact CB-CZ 3.5Å; P623-F625 PolarHBondContact O-N 3.06Å; P623-F648 HydrophobicContact CB-CD1 4.12Å; P623-F648 HydrophobicContact CB-CE1 4.44Å; P623-F648 HydrophobicContact CG-CD1 4.05Å; P623-F648 HydrophobicContact CG-CE1 4.45Å
624	T	94	Very high	82.1	Confident	74 Å²	74	76 Å²	76	45%	0.454	39%	0.387	S	S	.	.	S	Bend	trans	-73.3	-14.4	170.4	61.2	0	0	0	0	112.5	I757 Y759	T624-I757 HydrophobicContact CG2-CB 4.16Å; T624-I757 HydrophobicContact CG2-CG2 3.95Å; T624-I757 PolarHBondContact N-O 2.84Å; T624-I757 PolarHBondContact OG1-O 3.12Å; T624-I757 VanDerWaalsContact OG1-O 3.09Å; T624-Y759 HydrophobicContact CG2-CD2 3.64Å; T624-Y759 HydrophobicContact CG2-CE2 3.39Å
625	F	94.1	Very high	84	Confident	19 Å²	19	71.2 Å²	71.2	8%	0.083	38%	0.375	C	S	.	.	S	Bend	trans	-110	145.5	-173.4	55.4	-86	0	0	0	111.5	P623 L645 F648 F736 Y756 I757	P623-F625 HydrophobicContact CB-CD1 3.76Å; P623-F625 HydrophobicContact CB-CD2 4.14Å; P623-F625 HydrophobicContact CB-CE1 3.44Å; P623-F625 VanDerWaalsContact CB-CE1 3.44Å; P623-F625 HydrophobicContact CB-CE2 3.86Å; P623-F625 HydrophobicContact CB-CG 4.1Å; P623-F625 HydrophobicContact CB-CZ 3.5Å; P623-F625 VanDerWaalsContact CB-CZ 3.5Å; P623-F625 PolarHBondContact O-N 3.06Å; F625-L645 HydrophobicContact CD2-CD2 4.45Å; F625-L645 HydrophobicContact CE2-CD2 3.65Å; F625-L645 HydrophobicContact CZ-CD2 4.21Å; F625-F648 HydrophobicContact CE2-CB 3.96Å; F625-F648 HydrophobicContact CE2-CG 4.5Å; F625-F648 HydrophobicContact CZ-CB 4.06Å; F625-F648 HydrophobicContact CZ-CD2 4.47Å; F625-F648 HydrophobicContact CZ-CG 4.12Å; F625-F736 HydrophobicContact CZ-CE1 4.2Å; F625-F736 HydrophobicContact CZ-CZ 4.04Å; F625-Y756 AromaticContact CD1-CD1 3.76Å; F625-Y756 HydrophobicContact CD1-CD1 3.76Å; F625-Y756 AromaticContact CD2-CD1 3.58Å; F625-Y756 HydrophobicContact CD2-CD1 3.58Å; F625-Y756 AromaticContact CD2-CE1 3.85Å; F625-Y756 HydrophobicContact CD2-CE1 3.85Å; F625-Y756 AromaticContact CE1-CD1 3.7Å; F625-Y756 HydrophobicContact CE1-CD1 3.7Å; F625-Y756 HydrophobicContact CE1-CG 4.21Å; F625-Y756 AromaticContact CE2-CD1 3.52Å; F625-Y756 HydrophobicContact CE2-CD1 3.52Å; F625-Y756 HydrophobicContact CE2-CE1 4.03Å; F625-Y756 HydrophobicContact CE2-CG 4.4Å; F625-Y756 AromaticContact CG-CD1 3.71Å; F625-Y756 HydrophobicContact CG-CD1 3.71Å; F625-Y756 HydrophobicContact CG-CE1 4.19Å; F625-Y756 AromaticContact CZ-CD1 3.58Å; F625-Y756 HydrophobicContact CZ-CD1 3.58Å; F625-Y756 HydrophobicContact CZ-CG 4.11Å; F625-I757 WeakPolarHBondContact CD1-O 3.45Å; F625-I757 VanDerWaalsContact CE1-O 3.3Å; F625-I757 WeakPolarHBondContact CE1-O 3.39Å
626	P	93.9	Very high	86	Confident	83 Å²	83	70.5 Å²	70.5	54%	0.539	37%	0.368	S	S	.	.			trans	-66.1	150.6	165.1	30.5	-35	0	0	0	110.2	P628	P626-P628 WeakPolarHBondContact O-CD 3.48Å; P626-P628 VanDerWaalsContact O-N 3.13Å
627	N	94.9	Very high	88	Confident	31 Å²	31	67 Å²	67	17%	0.166	35%	0.352	C	S	.	.			trans	-54.9	119.3	171	-80.1	-44.8	0	0	0	109.6	N629 Q630 Q647 F648	N627-N629 PolarHBondContact O-N 3.11Å; N627-N629 VanDerWaalsContact O-N 3.1Å; N627-Q630 HydrophobicContact CB-CG 4.21Å; N627-Q630 WeakPolarHBondContact O-CB 3.24Å; N627-Q630 PolarHBondContact O-N 3.17Å; N627-Q647 WeakPolarHBondContact OD1-CA 3.34Å; N627-F648 PolarHBondContact OD1-N 3.15Å; N627-F648 PolarHBondContact OD1-O 2.95Å; N627-F648 VanDerWaalsContact OD1-O 3.12Å
628	P	94.2	Very high	90	Very high	4 Å²	4	62.7 Å²	62.7	3%	0.026	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-65.6	-22.9	-166.8	-22.9	33.3	0	0	0	113.5	P626 Q630 C631 F634 L645 Y756	P626-P628 WeakPolarHBondContact O-CD 3.48Å; P626-P628 VanDerWaalsContact O-N 3.13Å; P628-Q630 PolarHBondContact O-N 3.06Å; P628-C631 VanDerWaalsContact O-CB 3.28Å; P628-C631 WeakPolarHBondContact O-CB 3.43Å; P628-C631 PolarHBondContact O-N 3.18Å; P628-F634 HydrophobicContact CB-CD2 4.01Å; P628-F634 HydrophobicContact CB-CE2 4.49Å; P628-F634 VanDerWaalsContact O-CB 3.31Å; P628-F634 WeakPolarHBondContact O-CB 3.39Å; P628-F634 WeakPolarHBondContact O-CD2 3.34Å; P628-L645 VanDerWaalsContact CB-O 3.24Å; P628-L645 WeakPolarHBondContact CB-O 3.14Å; P628-L645 WeakPolarHBondContact CD-O 3.38Å; P628-L645 HydrophobicContact CG-CB 4.21Å; P628-L645 HydrophobicContact CG-CD2 4.28Å; P628-L645 HydrophobicContact CG-CG 4.41Å; P628-L645 VanDerWaalsContact CG-O 3.26Å; P628-L645 WeakPolarHBondContact CG-O 3.16Å; P628-Y756 HydrophobicContact CG-CE1 4Å
629	N	90.9	Very high	91.3	Very high	60 Å²	60	57.2 Å²	57.2	32%	0.321	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-62	-7.7	170.5	70.2	14.3	0	0	0	115	N627 F634 S646	N627-N629 PolarHBondContact O-N 3.11Å; N627-N629 VanDerWaalsContact O-N 3.1Å; N629-F634 HydrophobicContact CB-CZ 4.46Å; N629-S646 VanDerWaalsContact CB-O 3.27Å; N629-S646 WeakPolarHBondContact CB-O 3.45Å; N629-S646 PolarHBondContact N-O 3.44Å; N629-S646 PolarHBondContact ND2-O 2.99Å; N629-S646 PolarHBondContact ND2-OG 3.4Å; N629-S646 PolarHBondContact OD1-O 2.89Å
630	Q	91.1	Very high	92	Very high	143 Å²	143	60.3 Å²	60.3	67%	0.668	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-97.8	-7.2	171.9	-51	-176.2	7	0	0	112.7	N627 P628	N627-Q630 HydrophobicContact CB-CG 4.21Å; N627-Q630 WeakPolarHBondContact O-CB 3.24Å; N627-Q630 PolarHBondContact O-N 3.17Å; P628-Q630 PolarHBondContact O-N 3.06Å
631	C	90.8	Very high	92.2	Very high	40 Å²	40	57.3 Å²	57.3	27%	0.27	30%	0.302	S	S	.	.	S	Bend	trans	-90.8	142.3	-178.2	-60.8	0	0	0	0	111.6	P628 N633 F634	P628-C631 VanDerWaalsContact O-CB 3.28Å; P628-C631 WeakPolarHBondContact O-CB 3.43Å; P628-C631 PolarHBondContact O-N 3.18Å; C631-N633 VanDerWaalsContact C-N 3.26Å; C631-N633 WeakPolarHBondContact CB-OD1 3.44Å; C631-N633 PolarHBondContact O-N 3.44Å; C631-F634 WeakPolarHBondContact O-CB 3.3Å; C631-F634 PolarHBondContact O-N 3.46Å; C631-F634 VanDerWaalsContact O-N 3.16Å
632	I	90.2	Very high	92.2	Very high	172 Å²	172	59 Å²	59	88%	0.882	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-31.7	-174.6	-57.3	172.9	0	0	0	111.5	F634	I632-F634 VanDerWaalsContact C-N 3.33Å; I632-F634 PolarHBondContact O-N 3.26Å
633	N	90.8	Very high	92.3	Very high	69 Å²	69	57.2 Å²	57.2	37%	0.369	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	5.2	179.1	64.8	-30.3	0	0	0	114.5	C631 N635 Q636 R637	C631-N633 VanDerWaalsContact C-N 3.26Å; C631-N633 WeakPolarHBondContact CB-OD1 3.44Å; C631-N633 PolarHBondContact O-N 3.44Å; N633-N635 PolarHBondContact O-N 3.43Å; N633-Q636 WeakPolarHBondContact O-CB 3.42Å; N633-Q636 PolarHBondContact O-N 3.45Å; N633-R637 PolarHBondContact O-N 3.47Å
634	F	92.3	Very high	92.4	Very high	14 Å²	14	55.2 Å²	55.2	6%	0.061	29%	0.286	C	S	.	.	H	α-helix	trans	-54.9	-50.5	-176.8	-180	-110.9	0	0	0	113.5	P628 N629 C631 I632 Q636 R637 L638 C644 L645 K661	P628-F634 HydrophobicContact CB-CD2 4.01Å; P628-F634 HydrophobicContact CB-CE2 4.49Å; P628-F634 VanDerWaalsContact O-CB 3.31Å; P628-F634 WeakPolarHBondContact O-CB 3.39Å; P628-F634 WeakPolarHBondContact O-CD2 3.34Å; N629-F634 HydrophobicContact CB-CZ 4.46Å; C631-F634 WeakPolarHBondContact O-CB 3.3Å; C631-F634 PolarHBondContact O-N 3.46Å; C631-F634 VanDerWaalsContact O-N 3.16Å; I632-F634 VanDerWaalsContact C-N 3.33Å; I632-F634 PolarHBondContact O-N 3.26Å; F634-Q636 VanDerWaalsContact C-N 3.32Å; F634-Q636 PolarHBondContact O-N 3.43Å; F634-R637 PolarHBondContact O-N 2.86Å; F634-L638 HydrophobicContact CE1-CD2 4.27Å; F634-L638 HydrophobicContact CZ-CD2 4.4Å; F634-L638 WeakPolarHBondContact O-CB 3.48Å; F634-L638 PolarHBondContact O-N 3.37Å; F634-C644 HydrophobicContact CE2-CB 4.03Å; F634-L645 WeakPolarHBondContact CE2-O 3.47Å; F634-K661 HydrophobicContact CE1-CD 4.14Å; F634-K661 HydrophobicContact CZ-CB 4.3Å; F634-K661 HydrophobicContact CZ-CD 4.14Å; F634-K661 HydrophobicContact CZ-CG 4.13Å
635	N	89.8	Confident	92.5	Very high	82 Å²	82	51.7 Å²	51.7	44%	0.439	26%	0.264	S	S	.	.	H	α-helix	trans	-67.4	-34.3	-178.4	-66.4	-23.3	0	0	0	111.7	N633 I639	N633-N635 PolarHBondContact O-N 3.43Å; N635-I639 WeakPolarHBondContact O-CD1 3.21Å; N635-I639 WeakPolarHBondContact O-CG1 3.31Å; N635-I639 PolarHBondContact O-N 3.41Å; N635-I639 VanDerWaalsContact O-N 3.1Å
636	Q	90.6	Very high	92.5	Very high	111 Å²	111	50.9 Å²	50.9	52%	0.519	26%	0.261	S	S	.	.	H	α-helix	trans	-63.2	-53.9	174.7	176.4	177.8	-1.9	0	0	110.3	N633 F634 L638 I639 E640	N633-Q636 WeakPolarHBondContact O-CB 3.42Å; N633-Q636 PolarHBondContact O-N 3.45Å; F634-Q636 VanDerWaalsContact C-N 3.32Å; F634-Q636 PolarHBondContact O-N 3.43Å; Q636-L638 VanDerWaalsContact C-N 3.32Å; Q636-L638 PolarHBondContact O-N 3.05Å; Q636-I639 PolarHBondContact O-N 3.12Å; Q636-I639 VanDerWaalsContact O-N 3.09Å; Q636-E640 VanDerWaalsContact CG-CD 3.48Å; Q636-E640 HydrophobicContact CG-CG 4.31Å; Q636-E640 WeakPolarHBondContact CG-OE1 3.27Å; Q636-E640 PolarHBondContact NE2-OE1 3.33Å; Q636-E640 WeakPolarHBondContact O-CB 3.47Å; Q636-E640 WeakPolarHBondContact O-CG 3.42Å; Q636-E640 PolarHBondContact O-N 3.18Å
637	R	93	Very high	92.6	Very high	12 Å²	12	50.3 Å²	50.3	5%	0.045	25%	0.251	C	S	.	.	H	α-helix	trans	-52.9	-47.3	175.2	-78.4	-177.2	64.1	173.8	-8.9	112.4	N633 F634 I639 E640 Q641 D749 N751 H752 Y756	N633-R637 PolarHBondContact O-N 3.47Å; F634-R637 PolarHBondContact O-N 2.86Å; R637-I639 VanDerWaalsContact C-N 3.3Å; R637-I639 PolarHBondContact O-N 3.22Å; R637-E640 PolarHBondContact O-N 2.88Å; R637-Q641 VanDerWaalsContact O-CB 3.22Å; R637-Q641 WeakPolarHBondContact O-CB 3.36Å; R637-Q641 WeakPolarHBondContact O-CG 3.37Å; R637-Q641 PolarHBondContact O-N 3.41Å; R637-D749 IonicContact CZ-OD1 2.99Å; R637-D749 VanDerWaalsContact NH2-CG 3.28Å; R637-D749 IonicContact NH2-OD1 2.81Å; R637-D749 PolarHBondContact NH2-OD1 3.34Å; R637-D749 IonicContact NH2-OD2 3.28Å; R637-D749 PolarHBondContact NH2-OD2 2.83Å; R637-N751 PolarHBondContact NH1-OD1 2.96Å; R637-H752 VanDerWaalsContact CD-NE2 3.29Å; R637-H752 WeakPolarHBondContact CD-NE2 3.48Å; R637-H752 PolarHBondContact NE-NE2 2.89Å; R637-Y756 PolarHBondContact NH2-OH 2.9Å
638	L	92.7	Very high	92.7	Very high	4 Å²	4	49 Å²	49	2%	0.021	24%	0.244	C	C	.	.	H	α-helix	trans	-63.2	-33.5	-179.8	-179.5	60.4	0	0	0	113	F634 Q636 K642 C644 K661 I663	F634-L638 HydrophobicContact CE1-CD2 4.27Å; F634-L638 HydrophobicContact CZ-CD2 4.4Å; F634-L638 WeakPolarHBondContact O-CB 3.48Å; F634-L638 PolarHBondContact O-N 3.37Å; Q636-L638 VanDerWaalsContact C-N 3.32Å; Q636-L638 PolarHBondContact O-N 3.05Å; L638-K642 VanDerWaalsContact O-CA 3.29Å; L638-K642 WeakPolarHBondContact O-CA 3.41Å; L638-K642 PolarHBondContact O-N 3.28Å; L638-C644 HydrophobicContact CB-CB 4.07Å; L638-C644 HydrophobicContact CD1-CB 3.99Å; L638-K661 HydrophobicContact CD1-CB 3.92Å; L638-K661 WeakPolarHBondContact CD1-O 3.37Å; L638-K661 HydrophobicContact CD2-CB 3.76Å; L638-K661 HydrophobicContact CD2-CD 4.38Å; L638-I663 HydrophobicContact CD1-CD1 4.5Å; L638-I663 HydrophobicContact CD1-CG1 4.21Å; L638-I663 HydrophobicContact CD2-CD1 4.21Å; L638-I663 HydrophobicContact CD2-CG1 4.37Å; L638-I663 HydrophobicContact CG-CD1 3.75Å; L638-I663 HydrophobicContact CG-CG1 3.96Å
639	I	89.7	Confident	92.7	Very high	53 Å²	53	51.4 Å²	51.4	27%	0.272	26%	0.259	S	S	.	.	H	α-helix	trans	-76	-43.3	176.5	-68.9	167.9	0	0	0	111.3	N635 Q636 R637 I663 I706	N635-I639 WeakPolarHBondContact O-CD1 3.21Å; N635-I639 WeakPolarHBondContact O-CG1 3.31Å; N635-I639 PolarHBondContact O-N 3.41Å; N635-I639 VanDerWaalsContact O-N 3.1Å; Q636-I639 PolarHBondContact O-N 3.12Å; Q636-I639 VanDerWaalsContact O-N 3.09Å; R637-I639 VanDerWaalsContact C-N 3.3Å; R637-I639 PolarHBondContact O-N 3.22Å; I639-I663 HydrophobicContact CG1-CD1 4.02Å; I639-I706 HydrophobicContact CD1-CD1 4.25Å; I639-I706 HydrophobicContact CG1-CD1 4Å; I639-I706 HydrophobicContact CG2-CD1 4.46Å
640	E	90.9	Very high	92.8	Very high	118 Å²	118	49.5 Å²	49.5	55%	0.551	25%	0.25	S	C	*	.	H	α-helix	trans	-68.9	-48.3	-179.9	-71	169.7	172.3	0	0	112.4	Q636 R637	Q636-E640 VanDerWaalsContact CG-CD 3.48Å; Q636-E640 HydrophobicContact CG-CG 4.31Å; Q636-E640 WeakPolarHBondContact CG-OE1 3.27Å; Q636-E640 PolarHBondContact NE2-OE1 3.33Å; Q636-E640 WeakPolarHBondContact O-CB 3.47Å; Q636-E640 WeakPolarHBondContact O-CG 3.42Å; Q636-E640 PolarHBondContact O-N 3.18Å; R637-E640 PolarHBondContact O-N 2.88Å
641	Q	92.6	Very high	92.6	Very high	30 Å²	30	50 Å²	50	14%	0.14	25%	0.252	C	S	.	.	H	α-helix	trans	-91.2	-12	-172.5	-55.7	-179.5	-92.2	0	0	113.2	R637 V643 D749	R637-Q641 VanDerWaalsContact O-CB 3.22Å; R637-Q641 WeakPolarHBondContact O-CB 3.36Å; R637-Q641 WeakPolarHBondContact O-CG 3.37Å; R637-Q641 PolarHBondContact O-N 3.41Å; Q641-V643 WeakPolarHBondContact CB-O 3.3Å; Q641-V643 PolarHBondContact O-N 2.9Å; Q641-D749 PolarHBondContact NE2-OD1 3.33Å
642	K	92.1	Very high	92.4	Very high	40 Å²	40	50.4 Å²	50.4	17%	0.174	25%	0.252	C	S	.	.	S	Bend	trans	58.5	-7.8	-171.9	-58.1	-69.8	179.3	170.8	0	116	L638 T662 I663 H711 Y747	L638-K642 VanDerWaalsContact O-CA 3.29Å; L638-K642 WeakPolarHBondContact O-CA 3.41Å; L638-K642 PolarHBondContact O-N 3.28Å; K642-T662 CarbonylContact O-C 3.6Å; K642-T662 WeakPolarHBondContact O-CA 3.36Å; K642-I663 HydrophobicContact CD-CB 4.14Å; K642-I663 HydrophobicContact CD-CG2 3.73Å; K642-I663 PolarHBondContact O-N 3.09Å; K642-H711 PolarHBondContact NZ-CD2 3.12Å; K642-H711 PolarHBondContact NZ-NE2 3.38Å; K642-Y747 HydrophobicContact CB-CD1 3.77Å; K642-Y747 HydrophobicContact CB-CD2 4.31Å; K642-Y747 HydrophobicContact CB-CE1 4.03Å; K642-Y747 HydrophobicContact CB-CG 3.93Å; K642-Y747 HydrophobicContact CG-CD1 4Å; K642-Y747 HydrophobicContact CG-CE1 3.8Å
643	V	95	Very high	92.2	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	141.4	171.8	58.8	0	0	0	0	108.9	Q641 V660 T662 I738 Y740 D749	Q641-V643 WeakPolarHBondContact CB-O 3.3Å; Q641-V643 PolarHBondContact O-N 2.9Å; V643-V660 HydrophobicContact CG2-CG1 3.58Å; V643-T662 HydrophobicContact CB-CG2 3.91Å; V643-T662 HydrophobicContact CG2-CG2 3.7Å; V643-I738 HydrophobicContact CG2-CB 4.41Å; V643-I738 HydrophobicContact CG2-CG2 3.63Å; V643-Y740 HydrophobicContact CB-CD1 4.45Å; V643-D749 HydrophobicContact CG1-CB 4.12Å
644	C	95.9	Very high	92	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	138.7	174.3	-168.9	0	0	0	0	111.9	F634 L638 S646 K661 D749	F634-C644 HydrophobicContact CE2-CB 4.03Å; L638-C644 HydrophobicContact CB-CB 4.07Å; L638-C644 HydrophobicContact CD1-CB 3.99Å; C644-S646 PolarHBondContact O-N 3.3Å; C644-K661 PolarHBondContact N-O 3.07Å; C644-K661 PolarHBondContact O-N 3.17Å; C644-D749 VanDerWaalsContact CA-OD2 3.32Å; C644-D749 WeakPolarHBondContact CA-OD2 3.46Å
645	L	97.4	Very high	91.9	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	117.4	170.4	-177.3	68.5	0	0	0	110.1	F625 P628 F634 F648 V658 V660 F736 I738 D749 Y756	F625-L645 HydrophobicContact CD2-CD2 4.45Å; F625-L645 HydrophobicContact CE2-CD2 3.65Å; F625-L645 HydrophobicContact CZ-CD2 4.21Å; P628-L645 VanDerWaalsContact CB-O 3.24Å; P628-L645 WeakPolarHBondContact CB-O 3.14Å; P628-L645 WeakPolarHBondContact CD-O 3.38Å; P628-L645 HydrophobicContact CG-CB 4.21Å; P628-L645 HydrophobicContact CG-CD2 4.28Å; P628-L645 HydrophobicContact CG-CG 4.41Å; P628-L645 VanDerWaalsContact CG-O 3.26Å; P628-L645 WeakPolarHBondContact CG-O 3.16Å; F634-L645 WeakPolarHBondContact CE2-O 3.47Å; L645-F648 HydrophobicContact CD2-CB 4.34Å; L645-V658 HydrophobicContact CD1-CB 4.19Å; L645-V658 HydrophobicContact CD1-CG1 4.21Å; L645-V660 HydrophobicContact CD1-CG2 4.48Å; L645-F736 HydrophobicContact CD1-CE2 4.3Å; L645-F736 HydrophobicContact CD2-CE2 4.15Å; L645-F736 HydrophobicContact CD2-CZ 4.03Å; L645-I738 HydrophobicContact CB-CD1 3.54Å; L645-I738 HydrophobicContact CD1-CD1 3.97Å; L645-I738 HydrophobicContact CG-CD1 4.33Å; L645-D749 PolarHBondContact N-OD2 2.93Å; L645-Y756 HydrophobicContact CB-CE1 4.3Å; L645-Y756 HydrophobicContact CB-CE2 3.77Å; L645-Y756 HydrophobicContact CD2-CD1 3.65Å; L645-Y756 HydrophobicContact CD2-CD2 4.1Å; L645-Y756 HydrophobicContact CD2-CE1 3.52Å; L645-Y756 HydrophobicContact CD2-CE2 3.97Å; L645-Y756 HydrophobicContact CD2-CG 3.93Å
646	S	94.5	Very high	92.1	Very high	2 Å²	2	41.1 Å²	41.1	1%	0.014	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	-53.7	170.7	-174.8	0	0	0	0	110.1	N629 C644 Q659	N629-S646 VanDerWaalsContact CB-O 3.27Å; N629-S646 WeakPolarHBondContact CB-O 3.45Å; N629-S646 PolarHBondContact N-O 3.44Å; N629-S646 PolarHBondContact ND2-O 2.99Å; N629-S646 PolarHBondContact ND2-OG 3.4Å; N629-S646 PolarHBondContact OD1-O 2.89Å; C644-S646 PolarHBondContact O-N 3.3Å; S646-Q659 WeakPolarHBondContact CA-O 3.46Å; S646-Q659 VanDerWaalsContact CB-O 3.27Å; S646-Q659 WeakPolarHBondContact CB-O 3.48Å; S646-Q659 PolarHBondContact N-O 2.86Å; S646-Q659 PolarHBondContact OG-OE1 3.12Å
647	Q	95.5	Very high	92.3	Very high	71 Å²	71	37.7 Å²	37.7	33%	0.332	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	141.6	-169.2	178.8	171.3	-37.9	0	0	112.2	N627 T649 V658 Q659	N627-Q647 WeakPolarHBondContact OD1-CA 3.34Å; Q647-T649 HydrophobicContact CG-CG2 4.21Å; Q647-V658 WeakPolarHBondContact O-CA 3.45Å; Q647-Q659 HydrophobicContact CB-CB 4.33Å; Q647-Q659 PolarHBondContact N-O 3.06Å; Q647-Q659 VanDerWaalsContact N-O 3.08Å; Q647-Q659 PolarHBondContact O-N 2.9Å
648	F	96.8	Very high	92.5	Very high	4 Å²	4	37.2 Å²	37.2	2%	0.018	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	138	168.7	175.1	-85.8	0	0	0	109.7	W621 P623 F625 N627 L645 F656 V658 L734 F736 C758	W621-F648 HydrophobicContact CB-CE1 4.1Å; W621-F648 HydrophobicContact CB-CZ 3.78Å; P623-F648 HydrophobicContact CB-CD1 4.12Å; P623-F648 HydrophobicContact CB-CE1 4.44Å; P623-F648 HydrophobicContact CG-CD1 4.05Å; P623-F648 HydrophobicContact CG-CE1 4.45Å; F625-F648 HydrophobicContact CE2-CB 3.96Å; F625-F648 HydrophobicContact CE2-CG 4.5Å; F625-F648 HydrophobicContact CZ-CB 4.06Å; F625-F648 HydrophobicContact CZ-CD2 4.47Å; F625-F648 HydrophobicContact CZ-CG 4.12Å; N627-F648 PolarHBondContact OD1-N 3.15Å; N627-F648 PolarHBondContact OD1-O 2.95Å; N627-F648 VanDerWaalsContact OD1-O 3.12Å; L645-F648 HydrophobicContact CD2-CB 4.34Å; F648-F656 AromaticContact CD2-CD2 3.89Å; F648-F656 HydrophobicContact CD2-CD2 3.89Å; F648-F656 HydrophobicContact CD2-CE2 4.42Å; F648-F656 HydrophobicContact CE2-CB 3.86Å; F648-F656 AromaticContact CE2-CD2 3.32Å; F648-F656 HydrophobicContact CE2-CD2 3.32Å; F648-F656 AromaticContact CE2-CE2 3.92Å; F648-F656 HydrophobicContact CE2-CE2 3.92Å; F648-F656 AromaticContact CE2-CG 3.67Å; F648-F656 HydrophobicContact CE2-CG 3.67Å; F648-F656 HydrophobicContact CZ-CB 3.87Å; F648-F656 HydrophobicContact CZ-CD2 4.19Å; F648-F656 HydrophobicContact CZ-CG 4.09Å; F648-V658 HydrophobicContact CD2-CG1 3.84Å; F648-L734 HydrophobicContact CE2-CD2 4.4Å; F648-L734 HydrophobicContact CZ-CD2 4.45Å; F648-F736 AromaticContact CD2-CE1 3.64Å; F648-F736 HydrophobicContact CD2-CE1 3.64Å; F648-F736 AromaticContact CD2-CZ 3.63Å; F648-F736 HydrophobicContact CD2-CZ 3.63Å; F648-F736 AromaticContact CE2-CE1 3.71Å; F648-F736 HydrophobicContact CE2-CE1 3.71Å; F648-F736 HydrophobicContact CE2-CZ 4.19Å; F648-F736 HydrophobicContact CG-CZ 4.48Å; F648-C758 HydrophobicContact CZ-CB 4.38Å; F648-C758 WeakPolarHBondContact CZ-SG 3.49Å
649	T	94.6	Very high	92.6	Very high	55 Å²	55	38.9 Å²	38.9	34%	0.337	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	138.9	170.2	54.2	0	0	0	0	111.6	Q647 F656 N657	Q647-T649 HydrophobicContact CG-CG2 4.21Å; T649-F656 CarbonylContact O-C 3.51Å; T649-F656 WeakPolarHBondContact O-CA 3.3Å; T649-N657 PolarHBondContact N-O 3.26Å; T649-N657 PolarHBondContact O-N 3.03Å
650	S	92.8	Very high	92.9	Very high	19 Å²	19	36.4 Å²	36.4	13%	0.133	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	145	174.5	178.7	0	0	0	0	111	W621 N652	W621-S650 PolarHBondContact N-OG 3.39Å; W621-S650 WeakPolarHBondContact O-CB 3.49Å; S650-N652 PolarHBondContact OG-O 2.76Å
651	Q	86.8	Confident	93	Very high	155 Å²	155	31.8 Å²	31.8	72%	0.724	15%	0.154	S	C	*	.	S	Bend	trans	-114.3	-20.6	172.6	-62	-176.5	16.2	0	0	112.4
652	N	85.8	Confident	93	Very high	47 Å²	47	30.4 Å²	30.4	25%	0.251	15%	0.147	S	C	.	.	S	Bend	trans	-158.3	168	-177.1	67.4	87.3	0	0	0	109.1	Q619 S650 Y654 S655	Q619-N652 CarbonylContact O-C 3.59Å; Q619-N652 VanDerWaalsContact O-CA 3.24Å; Q619-N652 WeakPolarHBondContact O-CA 3.41Å; S650-N652 PolarHBondContact OG-O 2.76Å; N652-Y654 VanDerWaalsContact C-N 3.33Å; N652-Y654 PolarHBondContact O-N 3.33Å; N652-Y654 VanDerWaalsContact OD1-CA 3.28Å; N652-Y654 WeakPolarHBondContact OD1-CA 3.49Å; N652-Y654 VanDerWaalsContact OD1-CB 3.27Å; N652-Y654 WeakPolarHBondContact OD1-CB 3.47Å; N652-Y654 PolarHBondContact OD1-N 2.9Å; N652-S655 PolarHBondContact ND2-OG 3.49Å; N652-S655 VanDerWaalsContact ND2-OG 3.15Å; N652-S655 PolarHBondContact OD1-N 3.12Å
653	L	87.1	Confident	92.8	Very high	12 Å²	12	28.6 Å²	28.6	6%	0.063	14%	0.14	C	C	.	.	S	Bend	trans	-74.2	-16.7	178.9	-64.8	178.3	0	0	0	114.9	Q619 K620 W621 L722 F731 P760	Q619-L653 HydrophobicContact CB-CD1 3.87Å; Q619-L653 HydrophobicContact CB-CG 4.03Å; Q619-L653 PolarHBondContact O-N 3.33Å; K620-L653 VanDerWaalsContact C-CD2 3.47Å; W621-L653 HydrophobicContact CD2-CD2 3.86Å; W621-L653 HydrophobicContact CE3-CD2 4.3Å; W621-L653 HydrophobicContact CG-CD2 4.12Å; W621-L653 HydrophobicContact CZ2-CD2 4.31Å; W621-L653 PolarHBondContact NE1-O 2.87Å; L653-L722 WeakPolarHBondContact O-CD1 3.46Å; L653-F731 HydrophobicContact CB-CD2 4.33Å; L653-F731 HydrophobicContact CB-CE2 4.02Å; L653-F731 HydrophobicContact CB-CZ 4.47Å; L653-F731 HydrophobicContact CD1-CD2 3.73Å; L653-F731 HydrophobicContact CD1-CE2 4.09Å; L653-P760 HydrophobicContact CD1-CB 4.2Å; L653-P760 HydrophobicContact CD2-CB 3.91Å; L653-P760 HydrophobicContact CD2-CG 4.25Å
654	Y	85.7	Confident	92.2	Very high	121 Å²	121	28.8 Å²	28.8	48%	0.475	14%	0.14	S	C	.	.	S	Bend	trans	-88.2	-25.6	-176.6	-49.4	-91.3	0	0	0	113.3	N652 L722 I725	N652-Y654 VanDerWaalsContact C-N 3.33Å; N652-Y654 PolarHBondContact O-N 3.33Å; N652-Y654 VanDerWaalsContact OD1-CA 3.28Å; N652-Y654 WeakPolarHBondContact OD1-CA 3.49Å; N652-Y654 VanDerWaalsContact OD1-CB 3.27Å; N652-Y654 WeakPolarHBondContact OD1-CB 3.47Å; N652-Y654 PolarHBondContact OD1-N 2.9Å; Y654-L722 PolarHBondContact O-N 3.23Å; Y654-I725 HydrophobicContact CD1-CD1 3.59Å; Y654-I725 HydrophobicContact CE1-CD1 4.23Å; Y654-I725 HydrophobicContact CE1-CG2 4.42Å; Y654-I725 HydrophobicContact CG-CD1 4.43Å
655	S	90	Very high	91.3	Very high	10 Å²	10	31 Å²	31	7%	0.07	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	145.6	174.1	76.4	0	0	0	0	115	N652 E719 I720	N652-S655 PolarHBondContact ND2-OG 3.49Å; N652-S655 VanDerWaalsContact ND2-OG 3.15Å; N652-S655 PolarHBondContact OD1-N 3.12Å; S655-E719 WeakPolarHBondContact CB-OE1 3.16Å; S655-E719 PolarHBondContact OG-OE1 3.36Å; S655-I720 WeakPolarHBondContact CA-O 3.34Å; S655-I720 WeakPolarHBondContact CB-O 3.3Å
656	F	94.1	Very high	89.9	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	151.2	172.5	64.2	-91.6	0	0	0	110.3	F648 T649 V658 L679 I720 L722 L734	F648-F656 AromaticContact CD2-CD2 3.89Å; F648-F656 HydrophobicContact CD2-CD2 3.89Å; F648-F656 HydrophobicContact CD2-CE2 4.42Å; F648-F656 HydrophobicContact CE2-CB 3.86Å; F648-F656 AromaticContact CE2-CD2 3.32Å; F648-F656 HydrophobicContact CE2-CD2 3.32Å; F648-F656 AromaticContact CE2-CE2 3.92Å; F648-F656 HydrophobicContact CE2-CE2 3.92Å; F648-F656 AromaticContact CE2-CG 3.67Å; F648-F656 HydrophobicContact CE2-CG 3.67Å; F648-F656 HydrophobicContact CZ-CB 3.87Å; F648-F656 HydrophobicContact CZ-CD2 4.19Å; F648-F656 HydrophobicContact CZ-CG 4.09Å; T649-F656 CarbonylContact O-C 3.51Å; T649-F656 WeakPolarHBondContact O-CA 3.3Å; F656-V658 HydrophobicContact CD2-CG1 3.82Å; F656-V658 HydrophobicContact CE2-CG1 3.86Å; F656-L679 HydrophobicContact CE2-CD2 3.9Å; F656-L679 HydrophobicContact CZ-CD2 4.41Å; F656-I720 HydrophobicContact CD1-CB 4.31Å; F656-I720 HydrophobicContact CD2-CB 4.19Å; F656-I720 HydrophobicContact CD2-CG1 4.19Å; F656-I720 HydrophobicContact CE1-CB 3.94Å; F656-I720 HydrophobicContact CE1-CG2 3.86Å; F656-I720 HydrophobicContact CE2-CB 3.82Å; F656-I720 HydrophobicContact CE2-CG1 3.66Å; F656-I720 HydrophobicContact CE2-CG2 4.3Å; F656-I720 HydrophobicContact CG-CB 4.43Å; F656-I720 HydrophobicContact CZ-CB 3.68Å; F656-I720 HydrophobicContact CZ-CG1 3.92Å; F656-I720 HydrophobicContact CZ-CG2 3.68Å; F656-I720 PolarHBondContact N-O 3.09Å; F656-I720 VanDerWaalsContact N-O 3.11Å; F656-I720 PolarHBondContact O-N 3Å; F656-L722 HydrophobicContact CD1-CD1 4.45Å; F656-L722 HydrophobicContact CD1-CG 4.46Å; F656-L722 HydrophobicContact CE1-CD1 4.29Å; F656-L722 HydrophobicContact CE1-CD2 4Å; F656-L722 HydrophobicContact CE1-CG 4.09Å; F656-L734 HydrophobicContact CD1-CD2 3.86Å; F656-L734 HydrophobicContact CE1-CD1 4.26Å; F656-L734 HydrophobicContact CE1-CD2 3.64Å; F656-L734 HydrophobicContact CZ-CD1 4.5Å; F656-L734 HydrophobicContact CZ-CD2 4.1Å
657	N	95.5	Very high	88.3	Confident	39 Å²	39	39.8 Å²	39.8	21%	0.209	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	132.7	-176.9	-65.6	-105.4	0	0	0	108.9	T649 G718 E719	T649-N657 PolarHBondContact N-O 3.26Å; T649-N657 PolarHBondContact O-N 3.03Å; N657-G718 WeakPolarHBondContact CA-O 3.45Å; N657-E719 WeakPolarHBondContact OD1-CB 3.24Å
658	V	96.7	Very high	86.5	Confident	2 Å²	2	39.3 Å²	39.3	1%	0.012	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	142	178.8	-69.2	0	0	0	0	111.4	L645 Q647 F648 F656 L679 L695 E717 G718 I720 F736	L645-V658 HydrophobicContact CD1-CB 4.19Å; L645-V658 HydrophobicContact CD1-CG1 4.21Å; Q647-V658 WeakPolarHBondContact O-CA 3.45Å; F648-V658 HydrophobicContact CD2-CG1 3.84Å; F656-V658 HydrophobicContact CD2-CG1 3.82Å; F656-V658 HydrophobicContact CE2-CG1 3.86Å; V658-L679 HydrophobicContact CB-CD2 4.36Å; V658-L679 HydrophobicContact CG1-CD2 3.91Å; V658-L679 HydrophobicContact CG2-CD1 3.8Å; V658-L679 HydrophobicContact CG2-CD2 3.84Å; V658-L695 HydrophobicContact CG2-CD1 4.22Å; V658-L695 HydrophobicContact CG2-CD2 3.96Å; V658-E717 VanDerWaalsContact O-CA 3.31Å; V658-E717 WeakPolarHBondContact O-CA 3.39Å; V658-E717 WeakPolarHBondContact O-CG 3.49Å; V658-G718 PolarHBondContact N-O 3.1Å; V658-G718 PolarHBondContact O-N 3.16Å; V658-I720 HydrophobicContact CG2-CD1 4.36Å; V658-I720 HydrophobicContact CG2-CG1 4.11Å; V658-F736 HydrophobicContact CG1-CZ 4.45Å
659	Q	95.5	Very high	84.3	Confident	39 Å²	39	46.1 Å²	46.1	18%	0.182	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	132.2	169.1	-172.5	-173.2	92.7	0	0	108.5	S646 Q647 I715 N716 E717	S646-Q659 WeakPolarHBondContact CA-O 3.46Å; S646-Q659 VanDerWaalsContact CB-O 3.27Å; S646-Q659 WeakPolarHBondContact CB-O 3.48Å; S646-Q659 PolarHBondContact N-O 2.86Å; S646-Q659 PolarHBondContact OG-OE1 3.12Å; Q647-Q659 HydrophobicContact CB-CB 4.33Å; Q647-Q659 PolarHBondContact N-O 3.06Å; Q647-Q659 VanDerWaalsContact N-O 3.08Å; Q647-Q659 PolarHBondContact O-N 2.9Å; Q659-I715 HydrophobicContact CG-CG2 3.54Å; Q659-N716 CarbonylContact C-O 3.52Å; Q659-N716 WeakPolarHBondContact CA-O 3.36Å; Q659-E717 HydrophobicContact CB-CG 4.27Å; Q659-E717 PolarHBondContact NE2-OE2 3.36Å
660	V	95.7	Very high	82.4	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	139.6	-178	179	0	0	0	0	108.1	V643 L645 T662 V677 L695 N716 I738	V643-V660 HydrophobicContact CG2-CG1 3.58Å; L645-V660 HydrophobicContact CD1-CG2 4.48Å; V660-T662 HydrophobicContact CG1-CG2 4.36Å; V660-V677 HydrophobicContact CB-CG1 4.27Å; V660-V677 HydrophobicContact CG1-CG1 3.98Å; V660-V677 HydrophobicContact CG2-CG1 4.43Å; V660-L695 HydrophobicContact CB-CD1 4.09Å; V660-L695 HydrophobicContact CG2-CD1 3.53Å; V660-N716 HydrophobicContact CB-CB 4.45Å; V660-N716 PolarHBondContact N-O 3.28Å; V660-N716 PolarHBondContact O-N 2.82Å; V660-I738 HydrophobicContact CG1-CD1 4.23Å; V660-I738 HydrophobicContact CG1-CG2 4.01Å; V660-I738 HydrophobicContact CG2-CD1 3.61Å; V660-I738 HydrophobicContact CG2-CG1 4.12Å; V660-I738 HydrophobicContact CG2-CG2 4.18Å
661	K	93.3	Very high	80.6	Confident	22 Å²	22	54.6 Å²	54.6	10%	0.096	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	138.9	164.9	-61.4	-156.9	-177.1	-170.4	0	109.1	E251 F634 L638 C644 I713 E714 I715	E251-K661 IonicContact OE1-NZ 3.27Å; E251-K661 PolarHBondContact OE1-NZ 3.3Å; F634-K661 HydrophobicContact CE1-CD 4.14Å; F634-K661 HydrophobicContact CZ-CB 4.3Å; F634-K661 HydrophobicContact CZ-CD 4.14Å; F634-K661 HydrophobicContact CZ-CG 4.13Å; L638-K661 HydrophobicContact CD1-CB 3.92Å; L638-K661 WeakPolarHBondContact CD1-O 3.37Å; L638-K661 HydrophobicContact CD2-CB 3.76Å; L638-K661 HydrophobicContact CD2-CD 4.38Å; C644-K661 PolarHBondContact N-O 3.07Å; C644-K661 PolarHBondContact O-N 3.17Å; K661-I713 HydrophobicContact CB-CG2 3.94Å; K661-I713 HydrophobicContact CD-CG2 3.93Å; K661-I713 HydrophobicContact CG-CG2 4.31Å; K661-E714 WeakPolarHBondContact CA-O 3.46Å; K661-I715 HydrophobicContact CD-CD1 4.39Å; K661-I715 HydrophobicContact CD-CG1 4.29Å; K661-I715 HydrophobicContact CG-CG1 4.22Å
662	T	92.3	Very high	78.8	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	144.7	175.2	37.7	0	0	0	0	110.4	K642 V643 V660 V677 I713 E714 N716 Y740	K642-T662 CarbonylContact O-C 3.6Å; K642-T662 WeakPolarHBondContact O-CA 3.36Å; V643-T662 HydrophobicContact CB-CG2 3.91Å; V643-T662 HydrophobicContact CG2-CG2 3.7Å; V660-T662 HydrophobicContact CG1-CG2 4.36Å; T662-V677 HydrophobicContact CG2-CG2 3.75Å; T662-I713 CarbonylContact O-C 3.56Å; T662-I713 VanDerWaalsContact O-CA 3.26Å; T662-I713 WeakPolarHBondContact O-CA 3.44Å; T662-E714 PolarHBondContact N-O 2.9Å; T662-E714 PolarHBondContact O-N 3.18Å; T662-N716 PolarHBondContact OG1-ND2 3.07Å; T662-N716 VanDerWaalsContact OG1-ND2 3.15Å; T662-Y740 HydrophobicContact CG2-CD1 3.72Å; T662-Y740 HydrophobicContact CG2-CD2 4.04Å; T662-Y740 HydrophobicContact CG2-CE1 4.29Å; T662-Y740 HydrophobicContact CG2-CG 3.6Å
663	I	88	Confident	77.9	Confident	3 Å²	3	57.1 Å²	57.1	2%	0.015	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	127	175.8	-77.5	-176.7	0	0	0	109.4	L638 I639 K642 L704 I706 H711 C712 I713	L638-I663 HydrophobicContact CD1-CD1 4.5Å; L638-I663 HydrophobicContact CD1-CG1 4.21Å; L638-I663 HydrophobicContact CD2-CD1 4.21Å; L638-I663 HydrophobicContact CD2-CG1 4.37Å; L638-I663 HydrophobicContact CG-CD1 3.75Å; L638-I663 HydrophobicContact CG-CG1 3.96Å; I639-I663 HydrophobicContact CG1-CD1 4.02Å; K642-I663 HydrophobicContact CD-CB 4.14Å; K642-I663 HydrophobicContact CD-CG2 3.73Å; K642-I663 PolarHBondContact O-N 3.09Å; I663-L704 HydrophobicContact CD1-CD1 4.46Å; I663-I706 HydrophobicContact CD1-CD1 4.47Å; I663-H711 HydrophobicContact CG2-CB 4.09Å; I663-H711 VanDerWaalsContact CG2-CD2 3.44Å; I663-H711 WeakPolarHBondContact CG2-CD2 3.5Å; I663-C712 WeakPolarHBondContact CA-O 3.33Å; I663-I713 HydrophobicContact CD1-CG1 4.17Å; I663-I713 HydrophobicContact CG1-CG1 3.76Å
664	H	81.8	Confident	77.6	Confident	4 Å²	4	64.1 Å²	64.1	2%	0.019	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	159.3	172.2	62.7	87.6	0	0	0	111.2	H670 K675 E700 H711 C712 E714	H664-H670 AromaticContact CE1-CE1 3.58Å; H664-H670 AromaticContact CE1-NE2 3.85Å; H664-H670 AromaticContact ND1-CE1 3.79Å; H664-H670 AromaticContact ND1-NE2 3.74Å; H664-K675 PolarHBondContact CD2-NZ 3.11Å; H664-K675 PolarHBondContact CE1-NZ 3.12Å; H664-K675 PolarHBondContact NE2-NZ 3.11Å; H664-E700 IonicContact CE1-OE1 2.82Å; H664-E700 PolarHBondContact CE1-OE1 2.92Å; H664-E700 VanDerWaalsContact CE1-OE1 3.27Å; H664-E700 IonicContact NE2-OE1 2.7Å; H664-H711 CarbonylContact O-C 3.5Å; H664-H711 WeakPolarHBondContact O-CA 3.45Å; H664-H711 WeakPolarHBondContact O-CB 3.29Å; H664-C712 PolarHBondContact N-O 2.92Å; H664-C712 PolarHBondContact O-N 3.46Å; H664-E714 IonicContact CD2-OE2 3.84Å; H664-E714 PolarHBondContact CD2-OE2 3.5Å; H664-E714 IonicContact NE2-OE1 2.65Å; H664-E714 IonicContact NE2-OE2 3.33Å; H664-E714 PolarHBondContact NE2-OE2 2.8Å
665	N	77	Confident	77.6	Confident	47 Å²	47	60.9 Å²	60.9	25%	0.251	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	142.4	176.9	-56.9	9.4	0	0	0	109.4	I709 H711	N665-I709 HydrophobicContact CB-CG2 4.22Å; N665-H711 PolarHBondContact OD1-CD2 3.33Å; N665-H711 PolarHBondContact OD1-NE2 3.4Å
666	I	68.4	Low	77.7	Confident	51 Å²	51	61.6 Å²	61.6	26%	0.262	30%	0.299	S	S	.	.	S	Bend	trans	-89.3	-17.2	-177.5	-65.9	159.8	0	0	0	112.3	I668 Y703 N710 H711 C712	I666-I668 PolarHBondContact O-N 2.83Å; I666-Y703 HydrophobicContact CD1-CD1 3.47Å; I666-Y703 VanDerWaalsContact CD1-CD1 3.47Å; I666-Y703 HydrophobicContact CD1-CE1 3.72Å; I666-N710 HydrophobicContact CB-CB 4.39Å; I666-N710 WeakPolarHBondContact CB-O 3.42Å; I666-N710 HydrophobicContact CD1-CB 4.15Å; I666-N710 PolarHBondContact N-O 3.16Å; I666-H711 VanDerWaalsContact CD1-C 3.44Å; I666-H711 WeakPolarHBondContact CD1-O 3.23Å; I666-C712 HydrophobicContact CD1-CB 3.92Å; I666-C712 HydrophobicContact CG1-CB 4.11Å
667	Q	61.4	Low	77.8	Confident	134 Å²	134	61.9 Å²	61.9	63%	0.626	30%	0.301	S	S	*	.	S	Bend	trans	-75.9	-2.8	-177.1	-70	175.2	-42.5	0	0	114.7
668	I	58.2	Low	77.9	Confident	61 Å²	61	61.8 Å²	61.8	31%	0.313	30%	0.298	S	S	.	.	S	Bend	trans	-90.7	125.1	174.8	-66	165.6	0	0	0	107.2	I666 H670 Y673 N743	I666-I668 PolarHBondContact O-N 2.83Å; I668-H670 PolarHBondContact O-CD2 2.89Å; I668-H670 PolarHBondContact O-N 3.34Å; I668-Y673 HydrophobicContact CG2-CD2 4.13Å; I668-Y673 HydrophobicContact CG2-CE2 4.07Å; I668-N743 HydrophobicContact CD1-CB 4.13Å; I668-N743 VanDerWaalsContact CD1-ND2 3.34Å; I668-N743 WeakPolarHBondContact CD1-ND2 3.46Å
669	N	49.2	Very low	77.9	Confident	148 Å²	148	61.7 Å²	61.7	79%	0.791	30%	0.298	S	S	*	.			trans	-55.9	108.1	-175.3	-75.5	-18.4	0	0	0	111	L671	N669-L671 PolarHBondContact O-N 3.29Å
670	H	56	Low	77.9	Confident	94 Å²	94	62.5 Å²	62.5	44%	0.435	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	12.7	-158.8	-107.8	-110.4	0	0	0	115.9	H664 I668 E700	H664-H670 AromaticContact CE1-CE1 3.58Å; H664-H670 AromaticContact CE1-NE2 3.85Å; H664-H670 AromaticContact ND1-CE1 3.79Å; H664-H670 AromaticContact ND1-NE2 3.74Å; I668-H670 PolarHBondContact O-CD2 2.89Å; I668-H670 PolarHBondContact O-N 3.34Å; H670-E700 IonicContact CE1-OE1 2.7Å
671	L	53.5	Low	77.9	Confident	158 Å²	158	63 Å²	63	83%	0.827	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-41.5	-161.3	-134.3	71.3	0	0	0	115.1	N669	N669-L671 PolarHBondContact O-N 3.29Å
672	D	50.5	Low	77.9	Confident	145 Å²	145	62.1 Å²	62.1	78%	0.775	30%	0.298	S	S	*	.	S	Bend	trans	-114.6	-12.1	-168.8	-64.3	-63.5	0	0	0	115.2	K674	D672-K674 PolarHBondContact O-N 3.13Å; D672-K674 VanDerWaalsContact O-N 3.15Å
673	Y	65.7	Low	77.8	Confident	110 Å²	110	64 Å²	64	43%	0.431	31%	0.308	S	S	.	.			trans	-79.9	101.8	-174.8	-64.8	-79.2	0	0	0	112.5	I668 K675	I668-Y673 HydrophobicContact CG2-CD2 4.13Å; I668-Y673 HydrophobicContact CG2-CE2 4.07Å; Y673-K675 PolarHBondContact O-N 3.17Å
674	K	80.5	Confident	77.8	Confident	158 Å²	158	66.1 Å²	66.1	69%	0.687	32%	0.319	S	S	*	.			trans	-66.2	96.7	174.5	-173.5	-160	175.6	-151.1	0	111.5	D672 E676	D672-K674 PolarHBondContact O-N 3.13Å; D672-K674 VanDerWaalsContact O-N 3.15Å; K674-E676 IonicContact NZ-OE2 2.94Å; K674-E676 PolarHBondContact NZ-OE2 2.67Å
675	K	86.7	Confident	78.2	Confident	54 Å²	54	70.5 Å²	70.5	24%	0.235	34%	0.339	C	S	.	.			trans	-65.2	138.9	165.3	-58.6	-177.8	-169.5	176.2	0	111	H664 Y673 E714 Y740 R741	H664-K675 PolarHBondContact CD2-NZ 3.11Å; H664-K675 PolarHBondContact CE1-NZ 3.12Å; H664-K675 PolarHBondContact NE2-NZ 3.11Å; Y673-K675 PolarHBondContact O-N 3.17Å; K675-E714 WeakPolarHBondContact CD-OE2 3.29Å; K675-E714 IonicContact NZ-OE1 3.94Å; K675-E714 PolarHBondContact NZ-OE1 2.83Å; K675-E714 IonicContact NZ-OE2 3Å; K675-E714 PolarHBondContact NZ-OE2 2.81Å; K675-Y740 HydrophobicContact CB-CE2 4.26Å; K675-Y740 HydrophobicContact CG-CE2 4.41Å; K675-R741 CarbonylContact C-O 3.57Å; K675-R741 WeakPolarHBondContact CA-O 3.45Å
676	E	92.6	Very high	79	Confident	25 Å²	25	72.3 Å²	72.3	12%	0.117	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	134.9	161.5	59	173.9	-133.6	0	0	112.2	K674 K678 Y740 R741	K674-E676 IonicContact NZ-OE2 2.94Å; K674-E676 PolarHBondContact NZ-OE2 2.67Å; E676-K678 VanDerWaalsContact CD-NZ 3.33Å; E676-K678 WeakPolarHBondContact OE1-CD 3.3Å; E676-K678 VanDerWaalsContact OE1-CE 3.24Å; E676-K678 WeakPolarHBondContact OE1-CE 3.43Å; E676-K678 IonicContact OE1-NZ 2.69Å; E676-K678 PolarHBondContact OE1-NZ 2.94Å; E676-K678 IonicContact OE2-NZ 3.36Å; E676-K678 PolarHBondContact OE2-NZ 3.36Å; E676-Y740 WeakPolarHBondContact O-CA 3.36Å; E676-R741 HydrophobicContact CG-CB 3.92Å; E676-R741 HydrophobicContact CG-CG 4.49Å; E676-R741 PolarHBondContact N-O 3.45Å; E676-R741 PolarHBondContact O-N 2.91Å; E676-R741 WeakPolarHBondContact OE1-CD 3.45Å; E676-R741 IonicContact OE1-CZ 3.42Å; E676-R741 IonicContact OE1-NH1 3.24Å; E676-R741 PolarHBondContact OE1-NH1 3.36Å
677	V	95.3	Very high	80	Confident	5 Å²	5	80.5 Å²	80.5	3%	0.03	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	126.3	169.7	-177.2	0	0	0	0	108	V660 T662 S694 L695 N716 I738 V739 Y740	V660-V677 HydrophobicContact CB-CG1 4.27Å; V660-V677 HydrophobicContact CG1-CG1 3.98Å; V660-V677 HydrophobicContact CG2-CG1 4.43Å; T662-V677 HydrophobicContact CG2-CG2 3.75Å; V677-S694 CarbonylContact O-C 3.59Å; V677-S694 VanDerWaalsContact O-CA 3.3Å; V677-S694 WeakPolarHBondContact O-CA 3.36Å; V677-L695 HydrophobicContact CB-CB 4.43Å; V677-L695 HydrophobicContact CG1-CD1 3.87Å; V677-L695 HydrophobicContact CG1-CG 4.35Å; V677-L695 PolarHBondContact O-N 3.23Å; V677-N716 HydrophobicContact CB-CB 4.32Å; V677-N716 HydrophobicContact CG1-CB 4.48Å; V677-N716 HydrophobicContact CG2-CB 4.33Å; V677-I738 HydrophobicContact CG1-CG2 3.85Å; V677-V739 WeakPolarHBondContact CA-O 3.32Å; V677-Y740 HydrophobicContact CG2-CD2 3.69Å; V677-Y740 HydrophobicContact CG2-CE2 4.49Å; V677-Y740 HydrophobicContact CG2-CG 4.24Å
678	K	96.7	Very high	81.4	Confident	37 Å²	37	78.1 Å²	78.1	16%	0.161	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	161.1	179.9	-72.1	171.8	171.3	165.4	0	110.5	E676 E691 S692 S694 I738 V739	E676-K678 VanDerWaalsContact CD-NZ 3.33Å; E676-K678 WeakPolarHBondContact OE1-CD 3.3Å; E676-K678 VanDerWaalsContact OE1-CE 3.24Å; E676-K678 WeakPolarHBondContact OE1-CE 3.43Å; E676-K678 IonicContact OE1-NZ 2.69Å; E676-K678 PolarHBondContact OE1-NZ 2.94Å; E676-K678 IonicContact OE2-NZ 3.36Å; E676-K678 PolarHBondContact OE2-NZ 3.36Å; K678-E691 IonicContact NZ-OE2 3.93Å; K678-S692 WeakPolarHBondContact CD-O 3.46Å; K678-S692 WeakPolarHBondContact CG-O 3.43Å; K678-S694 WeakPolarHBondContact CE-OG 3.41Å; K678-I738 WeakPolarHBondContact O-CA 3.46Å; K678-V739 HydrophobicContact CB-CG1 3.79Å; K678-V739 PolarHBondContact N-O 2.81Å; K678-V739 PolarHBondContact O-N 2.92Å
679	L	96.9	Very high	83.1	Confident	0 Å²	0	81.4 Å²	81.4	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	133.1	164.4	-86	67.4	0	0	0	109	F656 V658 E691 S692 L695 I720 F736 A737 I738	F656-L679 HydrophobicContact CE2-CD2 3.9Å; F656-L679 HydrophobicContact CZ-CD2 4.41Å; V658-L679 HydrophobicContact CB-CD2 4.36Å; V658-L679 HydrophobicContact CG1-CD2 3.91Å; V658-L679 HydrophobicContact CG2-CD1 3.8Å; V658-L679 HydrophobicContact CG2-CD2 3.84Å; L679-E691 CarbonylContact O-C 3.59Å; L679-E691 WeakPolarHBondContact O-CA 3.32Å; L679-S692 PolarHBondContact N-OG 2.85Å; L679-S692 PolarHBondContact O-N 3.05Å; L679-L695 HydrophobicContact CD1-CD1 3.98Å; L679-L695 HydrophobicContact CD1-CD2 4.36Å; L679-L695 HydrophobicContact CD1-CG 4.4Å; L679-I720 HydrophobicContact CD2-CG1 4.43Å; L679-F736 HydrophobicContact CD2-CB 4.4Å; L679-F736 HydrophobicContact CD2-CD2 3.44Å; L679-F736 VanDerWaalsContact CD2-CD2 3.44Å; L679-F736 HydrophobicContact CD2-CE2 3.78Å; L679-F736 HydrophobicContact CD2-CG 3.97Å; L679-F736 HydrophobicContact CG-CD2 3.95Å; L679-A737 WeakPolarHBondContact CA-O 3.28Å; L679-I738 HydrophobicContact CD1-CG1 3.97Å; L679-I738 HydrophobicContact CG-CG1 4.09Å
680	R	96.5	Very high	85.2	Confident	56 Å²	56	76.6 Å²	76.6	21%	0.211	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	122.4	162.5	-168.2	-177.8	-73.1	169.8	-0.3	107.6	W686 Y689 T690 E691 F736 A737 W748	R680-W686 HydrophobicContact CG-CZ3 4.06Å; R680-Y689 VanDerWaalsContact CD-CD2 3.46Å; R680-Y689 HydrophobicContact CG-CD2 3.5Å; R680-Y689 HydrophobicContact CG-CE2 4.18Å; R680-Y689 HydrophobicContact CG-CG 3.99Å; R680-T690 WeakPolarHBondContact CA-O 3.46Å; R680-E691 HydrophobicContact CB-CG 4.26Å; R680-E691 HydrophobicContact CG-CG 4.13Å; R680-E691 IonicContact CZ-OE1 2.9Å; R680-E691 IonicContact NE-OE1 2.72Å; R680-E691 PolarHBondContact NE-OE1 3.25Å; R680-E691 IonicContact NH2-OE1 3.25Å; R680-E691 PolarHBondContact NH2-OE1 3Å; R680-F736 CarbonylContact O-C 3.56Å; R680-F736 VanDerWaalsContact O-CA 3.27Å; R680-F736 WeakPolarHBondContact O-CA 3.26Å; R680-A737 PolarHBondContact N-O 3.09Å; R680-A737 PolarHBondContact O-N 2.89Å; R680-W748 HydrophobicContact CB-CH2 4.28Å; R680-W748 HydrophobicContact CB-CZ3 4.34Å
681	Y	95.2	Very high	87.1	Confident	11 Å²	11	74.8 Å²	74.8	4%	0.043	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	158.1	-173.5	67.8	-95	0	0	0	113	Y689 T690 I720 L722 L734 E735	Y681-Y689 CarbonylContact O-C 3.57Å; Y681-Y689 WeakPolarHBondContact O-CA 3.49Å; Y681-Y689 WeakPolarHBondContact O-CB 3.46Å; Y681-T690 WeakPolarHBondContact CD1-O 3.25Å; Y681-T690 HydrophobicContact CE1-CG2 3.89Å; Y681-T690 HydrophobicContact CE2-CG2 4.37Å; Y681-T690 PolarHBondContact N-O 3.24Å; Y681-T690 PolarHBondContact O-N 3.46Å; Y681-T690 WeakPolarHBondContact OH-CG2 3.39Å; Y681-I720 HydrophobicContact CD1-CG2 4.47Å; Y681-I720 HydrophobicContact CE1-CG2 4.07Å; Y681-L722 HydrophobicContact CD2-CD2 3.6Å; Y681-L722 HydrophobicContact CE2-CD2 3.17Å; Y681-L722 HydrophobicContact CG-CD2 4.44Å; Y681-L734 HydrophobicContact CD2-CD1 4.46Å; Y681-E735 CarbonylContact C-O 3.59Å; Y681-E735 VanDerWaalsContact CA-O 3.24Å; Y681-E735 WeakPolarHBondContact CA-O 3.43Å; Y681-E735 WeakPolarHBondContact CB-O 3.46Å
682	T	93	Very high	89	Confident	3 Å²	3	67.8 Å²	67.8	2%	0.018	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	153.9	179.9	161.8	0	0	0	0	110.4	D684 H685 W686 E735	T682-D684 PolarHBondContact OG1-N 3.32Å; T682-D684 VanDerWaalsContact OG1-N 3.08Å; T682-D684 PolarHBondContact OG1-OD1 3.24Å; T682-H685 PolarHBondContact OG1-N 2.84Å; T682-W686 HydrophobicContact CG2-CD2 3.46Å; T682-W686 VanDerWaalsContact CG2-CD2 3.46Å; T682-W686 HydrophobicContact CG2-CE3 3.98Å; T682-W686 HydrophobicContact CG2-CG 3.79Å; T682-W686 HydrophobicContact CG2-CH2 4.22Å; T682-W686 HydrophobicContact CG2-CZ2 3.73Å; T682-W686 HydrophobicContact CG2-CZ3 4.33Å; T682-W686 PolarHBondContact OG1-N 3.4Å; T682-E735 HydrophobicContact CG2-CB 3.57Å; T682-E735 HydrophobicContact CG2-CG 4.08Å; T682-E735 WeakPolarHBondContact CG2-O 3.14Å; T682-E735 PolarHBondContact N-O 3.26Å; T682-E735 PolarHBondContact O-N 3.31Å
683	L	90.6	Very high	91	Very high	40 Å²	40	68.3 Å²	68.3	21%	0.209	31%	0.309	C	S	.	.	S	Bend	trans	-122.4	2	169	-62	173.9	0	0	0	113	W621 L722 F731 L734	W621-L683 HydrophobicContact CH2-CD2 3.97Å; W621-L683 HydrophobicContact CZ2-CD2 4Å; L683-L722 HydrophobicContact CD1-CD1 4.41Å; L683-L722 HydrophobicContact CD1-CD2 4.4Å; L683-L722 HydrophobicContact CD2-CD1 4.08Å; L683-F731 HydrophobicContact CD1-CD1 4.48Å; L683-F731 HydrophobicContact CD1-CE1 4.09Å; L683-F731 HydrophobicContact CD2-CD1 4.21Å; L683-F731 HydrophobicContact CD2-CE1 4.44Å; L683-L734 HydrophobicContact CD2-CB 4.11Å; L683-L734 HydrophobicContact CD2-CD1 3.97Å
684	D	88.3	Confident	92.4	Very high	48 Å²	48	65.7 Å²	65.7	26%	0.257	31%	0.306	S	S	.	.	S	Bend	trans	-134.7	25.6	-169	68.2	7.9	0	0	0	114.1	T682 W686 R687 T688	T682-D684 PolarHBondContact OG1-N 3.32Å; T682-D684 VanDerWaalsContact OG1-N 3.08Å; T682-D684 PolarHBondContact OG1-OD1 3.24Å; D684-W686 PolarHBondContact OD1-N 2.94Å; D684-R687 WeakPolarHBondContact O-CD 3.37Å; D684-R687 WeakPolarHBondContact O-CG 3.43Å; D684-R687 PolarHBondContact OD1-N 3.07Å; D684-T688 PolarHBondContact OD1-N 2.97Å; D684-T688 WeakPolarHBondContact OD2-CB 3.39Å; D684-T688 WeakPolarHBondContact OD2-CG2 3.46Å; D684-T688 PolarHBondContact OD2-N 3.34Å; D684-T688 VanDerWaalsContact OD2-N 3.09Å; D684-T688 PolarHBondContact OD2-OG1 2.96Å
685	H	90.1	Very high	93.1	Very high	95 Å²	95	58.8 Å²	58.8	44%	0.44	28%	0.276	S	S	.	.	S	Bend	trans	58.9	49.2	-174	-53.6	-69.1	0	0	0	114.1	T682 R687 E735	T682-H685 PolarHBondContact OG1-N 2.84Å; H685-R687 PolarHBondContact O-N 2.98Å; H685-E735 IonicContact ND1-OE1 2.7Å; H685-E735 PolarHBondContact ND1-OE1 3.08Å
686	W	92.6	Very high	93.3	Very high	86 Å²	86	60.6 Å²	60.6	33%	0.326	29%	0.292	S	S	.	.	S	Bend	trans	64.2	19.7	174.4	-58.4	96.5	0	0	0	114.9	R680 T682 D684 T688 E735 N755	R680-W686 HydrophobicContact CG-CZ3 4.06Å; T682-W686 HydrophobicContact CG2-CD2 3.46Å; T682-W686 VanDerWaalsContact CG2-CD2 3.46Å; T682-W686 HydrophobicContact CG2-CE3 3.98Å; T682-W686 HydrophobicContact CG2-CG 3.79Å; T682-W686 HydrophobicContact CG2-CH2 4.22Å; T682-W686 HydrophobicContact CG2-CZ2 3.73Å; T682-W686 HydrophobicContact CG2-CZ3 4.33Å; T682-W686 PolarHBondContact OG1-N 3.4Å; D684-W686 PolarHBondContact OD1-N 2.94Å; W686-T688 VanDerWaalsContact C-N 3.28Å; W686-E735 HydrophobicContact CZ2-CB 4.17Å; W686-E735 PolarHBondContact NE1-OE2 3.21Å; W686-N755 PolarHBondContact NE1-ND2 3.39Å; W686-N755 VanDerWaalsContact NE1-ND2 3.12Å
687	R	90.2	Very high	93.2	Very high	222 Å²	222	61.7 Å²	61.7	84%	0.838	30%	0.302	S	S	*	.	S	Bend	trans	-69.8	-34.8	166.9	-62.5	172.6	176	-167.6	-1.2	110.1	D684 H685	D684-R687 WeakPolarHBondContact O-CD 3.37Å; D684-R687 WeakPolarHBondContact O-CG 3.43Å; D684-R687 PolarHBondContact OD1-N 3.07Å; H685-R687 PolarHBondContact O-N 2.98Å
688	T	90.8	Very high	92.5	Very high	84 Å²	84	63.9 Å²	63.9	52%	0.515	31%	0.313	S	S	.	.	S	Bend	trans	-127.9	163.5	164.1	66	0	0	0	0	110	D684 W686	D684-T688 PolarHBondContact OD1-N 2.97Å; D684-T688 WeakPolarHBondContact OD2-CB 3.39Å; D684-T688 WeakPolarHBondContact OD2-CG2 3.46Å; D684-T688 PolarHBondContact OD2-N 3.34Å; D684-T688 VanDerWaalsContact OD2-N 3.09Å; D684-T688 PolarHBondContact OD2-OG1 2.96Å; W686-T688 VanDerWaalsContact C-N 3.28Å
689	Y	93.6	Very high	91.1	Very high	130 Å²	130	63.8 Å²	63.8	51%	0.51	32%	0.315	S	S	.	.			trans	-146.3	159.4	168.6	64.3	-97.2	0	0	0	110.1	R680 Y681	R680-Y689 VanDerWaalsContact CD-CD2 3.46Å; R680-Y689 HydrophobicContact CG-CD2 3.5Å; R680-Y689 HydrophobicContact CG-CE2 4.18Å; R680-Y689 HydrophobicContact CG-CG 3.99Å; Y681-Y689 CarbonylContact O-C 3.57Å; Y681-Y689 WeakPolarHBondContact O-CA 3.49Å; Y681-Y689 WeakPolarHBondContact O-CB 3.46Å
690	T	93.8	Very high	89.5	Confident	48 Å²	48	68 Å²	68	29%	0.294	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	135.2	173.2	-63.5	0	0	0	0	108.9	R680 Y681	R680-T690 WeakPolarHBondContact CA-O 3.46Å; Y681-T690 WeakPolarHBondContact CD1-O 3.25Å; Y681-T690 HydrophobicContact CE1-CG2 3.89Å; Y681-T690 HydrophobicContact CE2-CG2 4.37Å; Y681-T690 PolarHBondContact N-O 3.24Å; Y681-T690 PolarHBondContact O-N 3.46Å; Y681-T690 WeakPolarHBondContact OH-CG2 3.39Å
691	E	95.3	Very high	87.8	Confident	55 Å²	55	68.5 Å²	68.5	26%	0.257	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	137	164.3	-70.3	-163.3	178	0	0	109.7	K678 L679 R680 R741	K678-E691 IonicContact NZ-OE2 3.93Å; L679-E691 CarbonylContact O-C 3.59Å; L679-E691 WeakPolarHBondContact O-CA 3.32Å; R680-E691 HydrophobicContact CB-CG 4.26Å; R680-E691 HydrophobicContact CG-CG 4.13Å; R680-E691 IonicContact CZ-OE1 2.9Å; R680-E691 IonicContact NE-OE1 2.72Å; R680-E691 PolarHBondContact NE-OE1 3.25Å; R680-E691 IonicContact NH2-OE1 3.25Å; R680-E691 PolarHBondContact NH2-OE1 3Å; E691-R741 IonicContact OE1-CZ 3.45Å; E691-R741 IonicContact OE1-NH1 3.98Å; E691-R741 IonicContact OE1-NH2 3.18Å; E691-R741 PolarHBondContact OE1-NH2 3.18Å; E691-R741 IonicContact OE2-CZ 3.75Å; E691-R741 IonicContact OE2-NH1 3.75Å; E691-R741 PolarHBondContact OE2-NH1 3.01Å; E691-R741 IonicContact OE2-NH2 2.86Å; E691-R741 PolarHBondContact OE2-NH2 3.05Å
692	S	94	Very high	86.2	Confident	11 Å²	11	71 Å²	71	8%	0.077	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-70.1	165.7	175.7	72.8	0	0	0	0	112.2	K678 L679	K678-S692 WeakPolarHBondContact CD-O 3.46Å; K678-S692 WeakPolarHBondContact CG-O 3.43Å; L679-S692 PolarHBondContact N-OG 2.85Å; L679-S692 PolarHBondContact O-N 3.05Å
693	L	93.5	Very high	84.7	Confident	157 Å²	157	79.2 Å²	79.2	82%	0.822	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-55.5	151	153.9	-62	178	0	0	0	109.6	L695	L693-L695 PolarHBondContact O-N 3.36Å
694	S	94.2	Very high	83.4	Confident	54 Å²	54	77.9 Å²	77.9	38%	0.378	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-62.3	134.7	178.1	-50.7	0	0	0	0	110.8	V677 K678	V677-S694 CarbonylContact O-C 3.59Å; V677-S694 VanDerWaalsContact O-CA 3.3Å; V677-S694 WeakPolarHBondContact O-CA 3.36Å; K678-S694 WeakPolarHBondContact CE-OG 3.41Å
695	L	94.5	Very high	82	Confident	13 Å²	13	79 Å²	79	7%	0.068	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-62	151.1	174.5	-59.9	-173	0	0	0	110.5	V658 V660 V677 L679 L693 N716 I720	V658-L695 HydrophobicContact CG2-CD1 4.22Å; V658-L695 HydrophobicContact CG2-CD2 3.96Å; V660-L695 HydrophobicContact CB-CD1 4.09Å; V660-L695 HydrophobicContact CG2-CD1 3.53Å; V677-L695 HydrophobicContact CB-CB 4.43Å; V677-L695 HydrophobicContact CG1-CD1 3.87Å; V677-L695 HydrophobicContact CG1-CG 4.35Å; V677-L695 PolarHBondContact O-N 3.23Å; L679-L695 HydrophobicContact CD1-CD1 3.98Å; L679-L695 HydrophobicContact CD1-CD2 4.36Å; L679-L695 HydrophobicContact CD1-CG 4.4Å; L693-L695 PolarHBondContact O-N 3.36Å; L695-N716 HydrophobicContact CB-CB 3.92Å; L695-N716 HydrophobicContact CD1-CB 4.26Å; L695-I720 HydrophobicContact CD2-CD1 3.97Å
696	T	92.4	Very high	80.7	Confident	92 Å²	92	75.5 Å²	75.5	56%	0.564	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.7	118.5	177.9	-61.6	0	0	0	0	109.6	L698 N716 E717	T696-L698 PolarHBondContact O-N 3.5Å; T696-N716 WeakPolarHBondContact O-CA 3.36Å; T696-E717 PolarHBondContact N-O 3.06Å; T696-E717 PolarHBondContact O-N 2.77Å
697	C	89.1	Confident	79.4	Confident	49 Å²	49	80.9 Å²	80.9	33%	0.331	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	107.9	166.5	-177.1	0	0	0	0	108.9	N716	C697-N716 VanDerWaalsContact CA-OD1 3.25Å; C697-N716 WeakPolarHBondContact CA-OD1 3.42Å; C697-N716 WeakPolarHBondContact CB-OD1 3.46Å; C697-N716 PolarHBondContact N-OD1 3.32Å
698	L	81.7	Confident	78	Confident	50 Å²	50	77.3 Å²	77.3	26%	0.262	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	-57.9	176.5	-65.8	-178.3	0	0	0	109	K109 T696 I715 E717	K109-L698 WeakPolarHBondContact CD-O 3.45Å; K109-L698 WeakPolarHBondContact CE-O 3.48Å; K109-L698 PolarHBondContact NZ-O 2.98Å; T696-L698 PolarHBondContact O-N 3.5Å; L698-I715 PolarHBondContact N-O 3.49Å; L698-E717 HydrophobicContact CD1-CB 3.63Å; L698-E717 HydrophobicContact CD1-CG 4.36Å; L698-E717 HydrophobicContact CG-CB 3.95Å
699	D	67.1	Low	76.8	Confident	35 Å²	35	76 Å²	76	19%	0.187	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	139.6	-173.7	-63.8	-50.2	0	0	0	111.8	N107 K109 L701 E714 I715	N107-D699 PolarHBondContact ND2-OD1 3.34Å; N107-D699 PolarHBondContact ND2-OD2 2.94Å; K109-D699 IonicContact NZ-OD1 3.9Å; D699-L701 HydrophobicContact CB-CD1 3.88Å; D699-L701 HydrophobicContact CB-CD2 3.85Å; D699-L701 HydrophobicContact CB-CG 3.57Å; D699-E714 WeakPolarHBondContact O-CA 3.28Å; D699-I715 PolarHBondContact O-N 3.28Å
700	E	63	Low	75.8	Confident	89 Å²	89	73.8 Å²	73.8	42%	0.416	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	109.8	164.3	-177.5	171.3	-151	0	0	106	H664 H670 C712 E714	H664-E700 IonicContact CE1-OE1 2.82Å; H664-E700 PolarHBondContact CE1-OE1 2.92Å; H664-E700 VanDerWaalsContact CE1-OE1 3.27Å; H664-E700 IonicContact NE2-OE1 2.7Å; H670-E700 IonicContact CE1-OE1 2.7Å; E700-C712 HydrophobicContact CG-CB 4.06Å; E700-C712 VanDerWaalsContact CG-SG 3.56Å; E700-E714 HydrophobicContact CB-CG 4.26Å; E700-E714 HydrophobicContact CG-CG 4.24Å
701	L	61.8	Low	75	Confident	66 Å²	66	71.8 Å²	71.8	35%	0.346	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	144	-167.7	-66.9	175.6	0	0	0	111.3	D699 I713 I715	D699-L701 HydrophobicContact CB-CD1 3.88Å; D699-L701 HydrophobicContact CB-CD2 3.85Å; D699-L701 HydrophobicContact CB-CG 3.57Å; L701-I713 PolarHBondContact N-O 3.37Å; L701-I713 WeakPolarHBondContact O-CA 3.39Å; L701-I713 WeakPolarHBondContact O-CB 3.39Å; L701-I713 PolarHBondContact O-N 2.87Å; L701-I715 HydrophobicContact CD1-CD1 3.63Å; L701-I715 HydrophobicContact CD1-CG1 4.08Å
702	T	60.2	Low	74.3	Confident	65 Å²	65	69.2 Å²	69.2	40%	0.399	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	59.7	94.8	167.3	-48.5	0	0	0	0	114.3	L254 L704	L254-T702 HydrophobicContact CD1-CG2 3.77Å; T702-L704 HydrophobicContact CG2-CG 4.48Å; T702-L704 PolarHBondContact O-N 2.85Å
703	Y	61.2	Low	74	Confident	174 Å²	174	69.4 Å²	69.4	68%	0.682	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-56.4	125	162.5	-64.4	-77	0	0	0	110.6	I666	I666-Y703 HydrophobicContact CD1-CD1 3.47Å; I666-Y703 VanDerWaalsContact CD1-CD1 3.47Å; I666-Y703 HydrophobicContact CD1-CE1 3.72Å
704	L	63.2	Low	73.8	Confident	12 Å²	12	62.9 Å²	62.9	6%	0.063	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	104.1	-171.2	-109.9	-178.9	0	0	0	110.3	L254 I663 T702 I706 I709 H711 I713	L254-L704 HydrophobicContact CB-CD2 3.77Å; L254-L704 HydrophobicContact CD1-CD1 4.19Å; L254-L704 HydrophobicContact CD1-CD2 3.86Å; L254-L704 HydrophobicContact CD1-CG 4.05Å; L254-L704 HydrophobicContact CD2-CD1 4.4Å; L254-L704 HydrophobicContact CD2-CD2 4.28Å; L254-L704 HydrophobicContact CG-CD2 4.18Å; I663-L704 HydrophobicContact CD1-CD1 4.46Å; T702-L704 HydrophobicContact CG2-CG 4.48Å; T702-L704 PolarHBondContact O-N 2.85Å; L704-I706 HydrophobicContact CB-CD1 4.48Å; L704-I706 HydrophobicContact CB-CG1 4.14Å; L704-I706 HydrophobicContact CD1-CD1 4.2Å; L704-I706 HydrophobicContact CD2-CG1 4.16Å; L704-I706 PolarHBondContact O-N 3.34Å; L704-I709 VanDerWaalsContact O-O 3.08Å; L704-H711 HydrophobicContact CB-CB 4.06Å; L704-H711 PolarHBondContact N-O 2.87Å; L704-H711 WeakPolarHBondContact O-CB 3.34Å; L704-H711 PolarHBondContact O-N 2.78Å; L704-I713 HydrophobicContact CD1-CD1 3.53Å; L704-I713 HydrophobicContact CD1-CG1 3.92Å
705	S	59.3	Low	73.7	Confident	71 Å²	71	61.1 Å²	61.1	50%	0.497	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	102.8	166.4	-173.9	0	0	0	0	108.8
706	I	63.6	Low	73.7	Confident	22 Å²	22	61 Å²	61	11%	0.113	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	125.8	171.3	-34.5	177.9	0	0	0	106.6	I639 I663 L704 N708 I709 H711	I639-I706 HydrophobicContact CD1-CD1 4.25Å; I639-I706 HydrophobicContact CG1-CD1 4Å; I639-I706 HydrophobicContact CG2-CD1 4.46Å; I663-I706 HydrophobicContact CD1-CD1 4.47Å; L704-I706 HydrophobicContact CB-CD1 4.48Å; L704-I706 HydrophobicContact CB-CG1 4.14Å; L704-I706 HydrophobicContact CD1-CD1 4.2Å; L704-I706 HydrophobicContact CD2-CG1 4.16Å; L704-I706 PolarHBondContact O-N 3.34Å; I706-N708 PolarHBondContact O-N 3.15Å; I706-I709 PolarHBondContact N-O 3.36Å; I706-I709 VanDerWaalsContact N-O 3.09Å; I706-I709 PolarHBondContact O-N 3.15Å; I706-H711 PolarHBondContact O-CE1 2.86Å
707	Y	63.9	Low	73.8	Confident	199 Å²	199	59.9 Å²	59.9	78%	0.78	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	39.2	-176	-49.1	-68.6	0	0	0	113.6	I709	Y707-I709 PolarHBondContact O-N 3.35Å; Y707-I709 VanDerWaalsContact O-N 3.15Å
708	N	62	Low	74	Confident	148 Å²	148	58.5 Å²	58.5	79%	0.791	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.4	7.9	-174.7	-54.9	-26	0	0	0	115.6	I706	I706-N708 PolarHBondContact O-N 3.15Å
709	I	65.7	Low	74.6	Confident	56 Å²	56	60 Å²	60	29%	0.287	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	128	175	-63.2	170.2	0	0	0	108.6	N665 L704 I706 Y707 H711	N665-I709 HydrophobicContact CB-CG2 4.22Å; L704-I709 VanDerWaalsContact O-O 3.08Å; I706-I709 PolarHBondContact N-O 3.36Å; I706-I709 VanDerWaalsContact N-O 3.09Å; I706-I709 PolarHBondContact O-N 3.15Å; Y707-I709 PolarHBondContact O-N 3.35Å; Y707-I709 VanDerWaalsContact O-N 3.15Å; I709-H711 PolarHBondContact O-N 3.15Å; I709-H711 PolarHBondContact O-ND1 2.9Å
710	N	71.7	Confident	75.9	Confident	83 Å²	83	58.8 Å²	58.8	44%	0.444	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	112.3	172.2	-72.6	-13.1	0	0	0	109.8	I666	I666-N710 HydrophobicContact CB-CB 4.39Å; I666-N710 WeakPolarHBondContact CB-O 3.42Å; I666-N710 HydrophobicContact CD1-CB 4.15Å; I666-N710 PolarHBondContact N-O 3.16Å
711	H	78	Confident	77.2	Confident	6 Å²	6	59.8 Å²	59.8	3%	0.028	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	161.1	170.4	-60.2	77	0	0	0	110.5	K642 I663 H664 N665 I666 L704 I706 I709	K642-H711 PolarHBondContact NZ-CD2 3.12Å; K642-H711 PolarHBondContact NZ-NE2 3.38Å; I663-H711 HydrophobicContact CG2-CB 4.09Å; I663-H711 VanDerWaalsContact CG2-CD2 3.44Å; I663-H711 WeakPolarHBondContact CG2-CD2 3.5Å; H664-H711 CarbonylContact O-C 3.5Å; H664-H711 WeakPolarHBondContact O-CA 3.45Å; H664-H711 WeakPolarHBondContact O-CB 3.29Å; N665-H711 PolarHBondContact OD1-CD2 3.33Å; N665-H711 PolarHBondContact OD1-NE2 3.4Å; I666-H711 VanDerWaalsContact CD1-C 3.44Å; I666-H711 WeakPolarHBondContact CD1-O 3.23Å; L704-H711 HydrophobicContact CB-CB 4.06Å; L704-H711 PolarHBondContact N-O 2.87Å; L704-H711 WeakPolarHBondContact O-CB 3.34Å; L704-H711 PolarHBondContact O-N 2.78Å; I706-H711 PolarHBondContact O-CE1 2.86Å; I709-H711 PolarHBondContact O-N 3.15Å; I709-H711 PolarHBondContact O-ND1 2.9Å
712	C	80.9	Confident	78.4	Confident	1 Å²	1	56.9 Å²	56.9	1%	0.007	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	154.9	163.2	-128	0	0	0	0	110.6	I663 H664 I666 E700	I663-C712 WeakPolarHBondContact CA-O 3.33Å; H664-C712 PolarHBondContact N-O 2.92Å; H664-C712 PolarHBondContact O-N 3.46Å; I666-C712 HydrophobicContact CD1-CB 3.92Å; I666-C712 HydrophobicContact CG1-CB 4.11Å; E700-C712 HydrophobicContact CG-CB 4.06Å; E700-C712 VanDerWaalsContact CG-SG 3.56Å
713	I	87.3	Confident	78.8	Confident	15 Å²	15	58.6 Å²	58.6	8%	0.077	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	115.9	169.5	-60.6	164.3	0	0	0	109.5	K661 T662 I663 L701 L704	K661-I713 HydrophobicContact CB-CG2 3.94Å; K661-I713 HydrophobicContact CD-CG2 3.93Å; K661-I713 HydrophobicContact CG-CG2 4.31Å; T662-I713 CarbonylContact O-C 3.56Å; T662-I713 VanDerWaalsContact O-CA 3.26Å; T662-I713 WeakPolarHBondContact O-CA 3.44Å; I663-I713 HydrophobicContact CD1-CG1 4.17Å; I663-I713 HydrophobicContact CG1-CG1 3.76Å; L701-I713 PolarHBondContact N-O 3.37Å; L701-I713 WeakPolarHBondContact O-CA 3.39Å; L701-I713 WeakPolarHBondContact O-CB 3.39Å; L701-I713 PolarHBondContact O-N 2.87Å; L704-I713 HydrophobicContact CD1-CD1 3.53Å; L704-I713 HydrophobicContact CD1-CG1 3.92Å
714	E	89.6	Confident	78.6	Confident	20 Å²	20	54 Å²	54	9%	0.093	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	137.9	168.3	-71.8	168.3	131.5	0	0	110.5	K661 T662 H664 K675 D699 E700	K661-E714 WeakPolarHBondContact CA-O 3.46Å; T662-E714 PolarHBondContact N-O 2.9Å; T662-E714 PolarHBondContact O-N 3.18Å; H664-E714 IonicContact CD2-OE2 3.84Å; H664-E714 PolarHBondContact CD2-OE2 3.5Å; H664-E714 IonicContact NE2-OE1 2.65Å; H664-E714 IonicContact NE2-OE2 3.33Å; H664-E714 PolarHBondContact NE2-OE2 2.8Å; K675-E714 WeakPolarHBondContact CD-OE2 3.29Å; K675-E714 IonicContact NZ-OE1 3.94Å; K675-E714 PolarHBondContact NZ-OE1 2.83Å; K675-E714 IonicContact NZ-OE2 3Å; K675-E714 PolarHBondContact NZ-OE2 2.81Å; D699-E714 WeakPolarHBondContact O-CA 3.28Å; E700-E714 HydrophobicContact CB-CG 4.26Å; E700-E714 HydrophobicContact CG-CG 4.24Å
715	I	91.9	Very high	78.4	Confident	18 Å²	18	55.3 Å²	55.3	9%	0.092	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	116.6	167.9	-57.2	-167.8	0	0	0	108.8	Q659 K661 L698 D699 L701	Q659-I715 HydrophobicContact CG-CG2 3.54Å; K661-I715 HydrophobicContact CD-CD1 4.39Å; K661-I715 HydrophobicContact CD-CG1 4.29Å; K661-I715 HydrophobicContact CG-CG1 4.22Å; L698-I715 PolarHBondContact N-O 3.49Å; D699-I715 PolarHBondContact O-N 3.28Å; L701-I715 HydrophobicContact CD1-CD1 3.63Å; L701-I715 HydrophobicContact CD1-CG1 4.08Å
716	N	93.6	Very high	78.2	Confident	9 Å²	9	55.6 Å²	55.6	5%	0.048	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	128.8	-179.8	-74.2	-82.4	0	0	0	110	Q659 V660 T662 V677 L695 T696 C697	Q659-N716 CarbonylContact C-O 3.52Å; Q659-N716 WeakPolarHBondContact CA-O 3.36Å; V660-N716 HydrophobicContact CB-CB 4.45Å; V660-N716 PolarHBondContact N-O 3.28Å; V660-N716 PolarHBondContact O-N 2.82Å; T662-N716 PolarHBondContact OG1-ND2 3.07Å; T662-N716 VanDerWaalsContact OG1-ND2 3.15Å; V677-N716 HydrophobicContact CB-CB 4.32Å; V677-N716 HydrophobicContact CG1-CB 4.48Å; V677-N716 HydrophobicContact CG2-CB 4.33Å; L695-N716 HydrophobicContact CB-CB 3.92Å; L695-N716 HydrophobicContact CD1-CB 4.26Å; T696-N716 WeakPolarHBondContact O-CA 3.36Å; C697-N716 VanDerWaalsContact CA-OD1 3.25Å; C697-N716 WeakPolarHBondContact CA-OD1 3.42Å; C697-N716 WeakPolarHBondContact CB-OD1 3.46Å; C697-N716 PolarHBondContact N-OD1 3.32Å
717	E	94.9	Very high	77.7	Confident	70 Å²	70	62 Å²	62	33%	0.327	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	151.9	-176.4	-163.9	168.1	125.3	0	0	112.3	V658 Q659 T696 L698	V658-E717 VanDerWaalsContact O-CA 3.31Å; V658-E717 WeakPolarHBondContact O-CA 3.39Å; V658-E717 WeakPolarHBondContact O-CG 3.49Å; Q659-E717 HydrophobicContact CB-CG 4.27Å; Q659-E717 PolarHBondContact NE2-OE2 3.36Å; T696-E717 PolarHBondContact N-O 3.06Å; T696-E717 PolarHBondContact O-N 2.77Å; L698-E717 HydrophobicContact CD1-CB 3.63Å; L698-E717 HydrophobicContact CD1-CG 4.36Å; L698-E717 HydrophobicContact CG-CB 3.95Å
718	G	93.9	Very high	77.2	Confident	20 Å²	20	59.9 Å²	59.9	21%	0.206	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.2	150.8	174.8	0	0	0	0	0	115.3	N657 V658	N657-G718 WeakPolarHBondContact CA-O 3.45Å; V658-G718 PolarHBondContact N-O 3.1Å; V658-G718 PolarHBondContact O-N 3.16Å
719	E	94.6	Very high	77.1	Confident	80 Å²	80	55.9 Å²	55.9	37%	0.374	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	109.2	166.8	-175.7	166.9	-160.2	0	0	108.4	K118 S655 N657	K118-E719 IonicContact NZ-OE2 3.43Å; K118-E719 PolarHBondContact NZ-OE2 2.95Å; S655-E719 WeakPolarHBondContact CB-OE1 3.16Å; S655-E719 PolarHBondContact OG-OE1 3.36Å; N657-E719 WeakPolarHBondContact OD1-CB 3.24Å
720	I	94	Very high	77	Confident	11 Å²	11	62.3 Å²	62.3	6%	0.056	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	126.4	174.7	-50.1	-53.7	0	0	0	108.4	S655 F656 V658 L679 Y681 L695	S655-I720 WeakPolarHBondContact CA-O 3.34Å; S655-I720 WeakPolarHBondContact CB-O 3.3Å; F656-I720 HydrophobicContact CD1-CB 4.31Å; F656-I720 HydrophobicContact CD2-CB 4.19Å; F656-I720 HydrophobicContact CD2-CG1 4.19Å; F656-I720 HydrophobicContact CE1-CB 3.94Å; F656-I720 HydrophobicContact CE1-CG2 3.86Å; F656-I720 HydrophobicContact CE2-CB 3.82Å; F656-I720 HydrophobicContact CE2-CG1 3.66Å; F656-I720 HydrophobicContact CE2-CG2 4.3Å; F656-I720 HydrophobicContact CG-CB 4.43Å; F656-I720 HydrophobicContact CZ-CB 3.68Å; F656-I720 HydrophobicContact CZ-CG1 3.92Å; F656-I720 HydrophobicContact CZ-CG2 3.68Å; F656-I720 PolarHBondContact N-O 3.09Å; F656-I720 VanDerWaalsContact N-O 3.11Å; F656-I720 PolarHBondContact O-N 3Å; V658-I720 HydrophobicContact CG2-CD1 4.36Å; V658-I720 HydrophobicContact CG2-CG1 4.11Å; L679-I720 HydrophobicContact CD2-CG1 4.43Å; Y681-I720 HydrophobicContact CD1-CG2 4.47Å; Y681-I720 HydrophobicContact CE1-CG2 4.07Å; L695-I720 HydrophobicContact CD2-CD1 3.97Å
721	I	89.6	Confident	76.8	Confident	109 Å²	109	59.8 Å²	59.8	56%	0.559	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.7	114.1	176.9	-57.5	175.3	0	0	0	108.4	S723	I721-S723 PolarHBondContact O-N 3.33Å; I721-S723 PolarHBondContact O-OG 3.41Å
722	L	87.4	Confident	76.9	Confident	6 Å²	6	64.8 Å²	64.8	3%	0.031	35%	0.349	C	S	.	.			trans	-72.7	109	176.9	-67.6	177.6	0	0	0	108.7	W621 L653 Y654 F656 Y681 L683 I725	W621-L722 HydrophobicContact CZ2-CD1 3.88Å; L653-L722 WeakPolarHBondContact O-CD1 3.46Å; Y654-L722 PolarHBondContact O-N 3.23Å; F656-L722 HydrophobicContact CD1-CD1 4.45Å; F656-L722 HydrophobicContact CD1-CG 4.46Å; F656-L722 HydrophobicContact CE1-CD1 4.29Å; F656-L722 HydrophobicContact CE1-CD2 4Å; F656-L722 HydrophobicContact CE1-CG 4.09Å; Y681-L722 HydrophobicContact CD2-CD2 3.6Å; Y681-L722 HydrophobicContact CE2-CD2 3.17Å; Y681-L722 HydrophobicContact CG-CD2 4.44Å; L683-L722 HydrophobicContact CD1-CD1 4.41Å; L683-L722 HydrophobicContact CD1-CD2 4.4Å; L683-L722 HydrophobicContact CD2-CD1 4.08Å; L722-I725 HydrophobicContact CB-CD1 3.82Å; L722-I725 HydrophobicContact CB-CG1 4.39Å; L722-I725 WeakPolarHBondContact O-CD1 3.33Å
723	S	67.8	Low	77.3	Confident	100 Å²	100	65.9 Å²	65.9	70%	0.699	35%	0.354	S	S	*	.			trans	-98.4	-4.5	-169.9	-58.2	0	0	0	0	113.9	I721	I721-S723 PolarHBondContact O-N 3.33Å; I721-S723 PolarHBondContact O-OG 3.41Å
724	T	58.1	Low	77.6	Confident	78 Å²	78	65.2 Å²	65.2	48%	0.479	35%	0.351	S	S	.	.			trans	-109.5	51.1	-169.5	53.2	0	0	0	0	111.8	P726	T724-P726 WeakPolarHBondContact O-CD 3.37Å
725	I	58.6	Low	77.9	Confident	39 Å²	39	65.1 Å²	65.1	20%	0.2	35%	0.35	C	S	.	.			trans	-119.1	97.3	-172	-54	162.9	0	0	0	110.3	Y654 L722 F731	Y654-I725 HydrophobicContact CD1-CD1 3.59Å; Y654-I725 HydrophobicContact CE1-CD1 4.23Å; Y654-I725 HydrophobicContact CE1-CG2 4.42Å; Y654-I725 HydrophobicContact CG-CD1 4.43Å; L722-I725 HydrophobicContact CB-CD1 3.82Å; L722-I725 HydrophobicContact CB-CG1 4.39Å; L722-I725 WeakPolarHBondContact O-CD1 3.33Å; I725-F731 HydrophobicContact CB-CZ 4.38Å; I725-F731 HydrophobicContact CD1-CE1 4.2Å; I725-F731 HydrophobicContact CD1-CZ 3.71Å; I725-F731 HydrophobicContact CG1-CE1 3.99Å; I725-F731 HydrophobicContact CG1-CZ 3.76Å; I725-F731 HydrophobicContact CG2-CE1 4.46Å; I725-F731 HydrophobicContact CG2-CE2 4.29Å; I725-F731 HydrophobicContact CG2-CZ 3.67Å
726	P	56.2	Low	78.2	Confident	77 Å²	77	64.2 Å²	64.2	50%	0.5	35%	0.346	S	S	.	.			trans	-60.9	139.5	155.8	-14.2	28.6	0	0	0	109.2	T724 D728 T729	T724-P726 WeakPolarHBondContact O-CD 3.37Å; P726-D728 PolarHBondContact O-N 2.75Å; P726-T729 HydrophobicContact CB-CG2 4.05Å; P726-T729 HydrophobicContact CG-CG2 3.77Å; P726-T729 PolarHBondContact O-N 3.11Å; P726-T729 VanDerWaalsContact O-N 3.08Å; P726-T729 PolarHBondContact O-OG1 2.93Å
727	L	51.5	Low	78.4	Confident	156 Å²	156	64 Å²	64	82%	0.817	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-21.7	-174.4	-70.5	111.8	0	0	0	113.9
728	D	53.9	Low	78.5	Confident	155 Å²	155	60.7 Å²	60.7	83%	0.829	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-6.4	-179.2	-53	-54.7	0	0	0	114	P726 K730	P726-D728 PolarHBondContact O-N 2.75Å; D728-K730 PolarHBondContact O-N 2.95Å
729	T	59.7	Low	78.6	Confident	65 Å²	65	59.8 Å²	59.8	40%	0.399	32%	0.32	S	S	.	.			trans	-74.7	102.8	178.2	53.2	0	0	0	0	110.9	P726 F731	P726-T729 HydrophobicContact CB-CG2 4.05Å; P726-T729 HydrophobicContact CG-CG2 3.77Å; P726-T729 PolarHBondContact O-N 3.11Å; P726-T729 VanDerWaalsContact O-N 3.08Å; P726-T729 PolarHBondContact O-OG1 2.93Å; T729-F731 PolarHBondContact O-N 3.34Å
730	K	64.2	Low	78.7	Confident	190 Å²	190	56 Å²	56	83%	0.826	30%	0.303	S	S	*	.			trans	-59.3	108.9	161.4	-67.8	-177.4	-179.5	179.8	0	108.8	D728 L732	D728-K730 PolarHBondContact O-N 2.95Å; K730-L732 PolarHBondContact O-N 3.47Å
731	F	67.4	Low	78.7	Confident	31 Å²	31	58.1 Å²	58.1	14%	0.136	31%	0.31	C	S	.	.			trans	-55.6	123	167.2	-60.6	-81.1	0	0	0	109.2	W621 L653 L683 I725 T729 P760	W621-F731 HydrophobicContact CH2-CB 3.75Å; W621-F731 AromaticContact CH2-CD1 3.61Å; W621-F731 HydrophobicContact CH2-CD1 3.61Å; W621-F731 HydrophobicContact CH2-CE1 4.46Å; W621-F731 AromaticContact CH2-CG 3.88Å; W621-F731 HydrophobicContact CH2-CG 3.88Å; W621-F731 HydrophobicContact CZ2-CB 4.38Å; W621-F731 AromaticContact CZ2-CD1 3.58Å; W621-F731 HydrophobicContact CZ2-CD1 3.58Å; W621-F731 HydrophobicContact CZ2-CE1 4Å; W621-F731 HydrophobicContact CZ2-CG 4.03Å; W621-F731 HydrophobicContact CZ3-CB 4.44Å; L653-F731 HydrophobicContact CB-CD2 4.33Å; L653-F731 HydrophobicContact CB-CE2 4.02Å; L653-F731 HydrophobicContact CB-CZ 4.47Å; L653-F731 HydrophobicContact CD1-CD2 3.73Å; L653-F731 HydrophobicContact CD1-CE2 4.09Å; L683-F731 HydrophobicContact CD1-CD1 4.48Å; L683-F731 HydrophobicContact CD1-CE1 4.09Å; L683-F731 HydrophobicContact CD2-CD1 4.21Å; L683-F731 HydrophobicContact CD2-CE1 4.44Å; I725-F731 HydrophobicContact CB-CZ 4.38Å; I725-F731 HydrophobicContact CD1-CE1 4.2Å; I725-F731 HydrophobicContact CD1-CZ 3.71Å; I725-F731 HydrophobicContact CG1-CE1 3.99Å; I725-F731 HydrophobicContact CG1-CZ 3.76Å; I725-F731 HydrophobicContact CG2-CE1 4.46Å; I725-F731 HydrophobicContact CG2-CE2 4.29Å; I725-F731 HydrophobicContact CG2-CZ 3.67Å; T729-F731 PolarHBondContact O-N 3.34Å; F731-P760 HydrophobicContact CB-CG 3.57Å; F731-P760 WeakPolarHBondContact O-CG 3.39Å
732	L	80.1	Confident	78.5	Confident	110 Å²	110	53.3 Å²	53.3	58%	0.576	29%	0.287	S	S	*	.			trans	-90.2	-52	167.6	-65.1	175.5	0	0	0	109.4	K730 Y759 P760	K730-L732 PolarHBondContact O-N 3.47Å; L732-Y759 WeakPolarHBondContact O-CD1 3.44Å; L732-P760 WeakPolarHBondContact O-CD 3.39Å
733	Q	90	Very high	78	Confident	25 Å²	25	54.3 Å²	54.3	12%	0.117	29%	0.292	C	S	.	.			trans	-154.1	140.7	-169.2	-169.1	162.9	-57.3	0	0	110	E735 I757 Y759	Q733-E735 HydrophobicContact CG-CG 3.94Å; Q733-E735 VanDerWaalsContact NE2-CD 3.32Å; Q733-E735 PolarHBondContact NE2-OE1 3.21Å; Q733-I757 HydrophobicContact CG-CG2 3.71Å; Q733-Y759 HydrophobicContact CB-CE1 4.26Å; Q733-Y759 HydrophobicContact CG-CD1 4.46Å; Q733-Y759 HydrophobicContact CG-CE1 4.01Å; Q733-Y759 PolarHBondContact OE1-OH 3.49Å; Q733-Y759 VanDerWaalsContact OE1-OH 3.13Å
734	L	93.5	Very high	78.7	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	128.4	161.7	163	67.2	0	0	0	106.7	W621 F648 F656 Y681 L683 F736 I757 C758	W621-L734 HydrophobicContact CD2-CB 3.96Å; W621-L734 HydrophobicContact CD2-CD2 3.87Å; W621-L734 HydrophobicContact CE3-CB 3.59Å; W621-L734 HydrophobicContact CE3-CD2 4.29Å; W621-L734 HydrophobicContact CG-CD2 4.05Å; W621-L734 HydrophobicContact CH2-CB 3.52Å; W621-L734 HydrophobicContact CZ2-CB 3.92Å; W621-L734 HydrophobicContact CZ3-CB 3.35Å; W621-L734 VanDerWaalsContact CZ3-N 3.33Å; F648-L734 HydrophobicContact CE2-CD2 4.4Å; F648-L734 HydrophobicContact CZ-CD2 4.45Å; F656-L734 HydrophobicContact CD1-CD2 3.86Å; F656-L734 HydrophobicContact CE1-CD1 4.26Å; F656-L734 HydrophobicContact CE1-CD2 3.64Å; F656-L734 HydrophobicContact CZ-CD1 4.5Å; F656-L734 HydrophobicContact CZ-CD2 4.1Å; Y681-L734 HydrophobicContact CD2-CD1 4.46Å; L683-L734 HydrophobicContact CD2-CB 4.11Å; L683-L734 HydrophobicContact CD2-CD1 3.97Å; L734-F736 HydrophobicContact CG-CD1 4.46Å; L734-I757 CarbonylContact O-C 3.52Å; L734-I757 WeakPolarHBondContact O-CA 3.26Å; L734-C758 HydrophobicContact CB-CB 4.22Å; L734-C758 HydrophobicContact CD2-CB 4.27Å; L734-C758 HydrophobicContact CG-CB 4.47Å; L734-C758 PolarHBondContact N-O 3.5Å; L734-C758 PolarHBondContact O-N 3.02Å
735	E	95.7	Very high	80.2	Confident	18 Å²	18	58.7 Å²	58.7	8%	0.084	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	145.3	166.1	-41.5	177.5	-151.2	0	0	109.8	Y681 T682 H685 W686 Q733 N755 Y756 I757	Y681-E735 CarbonylContact C-O 3.59Å; Y681-E735 VanDerWaalsContact CA-O 3.24Å; Y681-E735 WeakPolarHBondContact CA-O 3.43Å; Y681-E735 WeakPolarHBondContact CB-O 3.46Å; T682-E735 HydrophobicContact CG2-CB 3.57Å; T682-E735 HydrophobicContact CG2-CG 4.08Å; T682-E735 WeakPolarHBondContact CG2-O 3.14Å; T682-E735 PolarHBondContact N-O 3.26Å; T682-E735 PolarHBondContact O-N 3.31Å; H685-E735 IonicContact ND1-OE1 2.7Å; H685-E735 PolarHBondContact ND1-OE1 3.08Å; W686-E735 HydrophobicContact CZ2-CB 4.17Å; W686-E735 PolarHBondContact NE1-OE2 3.21Å; Q733-E735 HydrophobicContact CG-CG 3.94Å; Q733-E735 VanDerWaalsContact NE2-CD 3.32Å; Q733-E735 PolarHBondContact NE2-OE1 3.21Å; E735-N755 HydrophobicContact CB-CB 4.35Å; E735-N755 PolarHBondContact OE2-ND2 2.98Å; E735-Y756 CarbonylContact C-O 3.47Å; E735-Y756 VanDerWaalsContact CA-O 3.32Å; E735-Y756 WeakPolarHBondContact CA-O 3.43Å; E735-I757 HydrophobicContact CG-CG1 4.22Å
736	F	96.8	Very high	81.9	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	158.4	171.7	67.1	-87.9	0	0	0	113.1	F625 L645 F648 V658 L679 R680 L734 Y756	F625-F736 HydrophobicContact CZ-CE1 4.2Å; F625-F736 HydrophobicContact CZ-CZ 4.04Å; L645-F736 HydrophobicContact CD1-CE2 4.3Å; L645-F736 HydrophobicContact CD2-CE2 4.15Å; L645-F736 HydrophobicContact CD2-CZ 4.03Å; F648-F736 AromaticContact CD2-CE1 3.64Å; F648-F736 HydrophobicContact CD2-CE1 3.64Å; F648-F736 AromaticContact CD2-CZ 3.63Å; F648-F736 HydrophobicContact CD2-CZ 3.63Å; F648-F736 AromaticContact CE2-CE1 3.71Å; F648-F736 HydrophobicContact CE2-CE1 3.71Å; F648-F736 HydrophobicContact CE2-CZ 4.19Å; F648-F736 HydrophobicContact CG-CZ 4.48Å; V658-F736 HydrophobicContact CG1-CZ 4.45Å; L679-F736 HydrophobicContact CD2-CB 4.4Å; L679-F736 HydrophobicContact CD2-CD2 3.44Å; L679-F736 VanDerWaalsContact CD2-CD2 3.44Å; L679-F736 HydrophobicContact CD2-CE2 3.78Å; L679-F736 HydrophobicContact CD2-CG 3.97Å; L679-F736 HydrophobicContact CG-CD2 3.95Å; R680-F736 CarbonylContact O-C 3.56Å; R680-F736 VanDerWaalsContact O-CA 3.27Å; R680-F736 WeakPolarHBondContact O-CA 3.26Å; L734-F736 HydrophobicContact CG-CD1 4.46Å; F736-Y756 WeakPolarHBondContact CD1-O 3.47Å; F736-Y756 HydrophobicContact CD2-CD2 4.14Å; F736-Y756 HydrophobicContact CD2-CG 4.34Å; F736-Y756 VanDerWaalsContact CE1-CB 3.47Å; F736-Y756 HydrophobicContact CE1-CG 4.45Å; F736-Y756 AromaticContact CE2-CD2 3.74Å; F736-Y756 HydrophobicContact CE2-CD2 3.74Å; F736-Y756 AromaticContact CE2-CG 3.78Å; F736-Y756 HydrophobicContact CE2-CG 3.78Å; F736-Y756 HydrophobicContact CZ-CD2 4.28Å; F736-Y756 AromaticContact CZ-CG 3.85Å; F736-Y756 HydrophobicContact CZ-CG 3.85Å; F736-Y756 PolarHBondContact N-O 3.47Å; F736-Y756 WeakPolarHBondContact O-CB 3.44Å; F736-Y756 PolarHBondContact O-N 3.37Å
737	A	97.7	Very high	83.7	Confident	4 Å²	4	60.8 Å²	60.8	3%	0.033	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	154.4	165.2	0	0	0	0	0	108.8	L679 R680 W748 D749 N750	L679-A737 WeakPolarHBondContact CA-O 3.28Å; R680-A737 PolarHBondContact N-O 3.09Å; R680-A737 PolarHBondContact O-N 2.89Å; A737-W748 HydrophobicContact CB-CE3 4.07Å; A737-W748 HydrophobicContact CB-CZ3 3.99Å; A737-D749 WeakPolarHBondContact CA-O 3.47Å; A737-N750 HydrophobicContact CB-CB 4.06Å
738	I	97.7	Very high	85.9	Confident	0 Å²	0	57 Å²	57	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	136.8	176.8	-58.1	155.9	0	0	0	108.9	V643 L645 V660 V677 K678 L679 W748 D749	V643-I738 HydrophobicContact CG2-CB 4.41Å; V643-I738 HydrophobicContact CG2-CG2 3.63Å; L645-I738 HydrophobicContact CB-CD1 3.54Å; L645-I738 HydrophobicContact CD1-CD1 3.97Å; L645-I738 HydrophobicContact CG-CD1 4.33Å; V660-I738 HydrophobicContact CG1-CD1 4.23Å; V660-I738 HydrophobicContact CG1-CG2 4.01Å; V660-I738 HydrophobicContact CG2-CD1 3.61Å; V660-I738 HydrophobicContact CG2-CG1 4.12Å; V660-I738 HydrophobicContact CG2-CG2 4.18Å; V677-I738 HydrophobicContact CG1-CG2 3.85Å; K678-I738 WeakPolarHBondContact O-CA 3.46Å; L679-I738 HydrophobicContact CD1-CG1 3.97Å; L679-I738 HydrophobicContact CG-CG1 4.09Å; I738-W748 WeakPolarHBondContact O-CA 3.38Å; I738-D749 HydrophobicContact CB-CB 4.27Å; I738-D749 HydrophobicContact CD1-CB 4.39Å; I738-D749 PolarHBondContact N-O 2.88Å; I738-D749 PolarHBondContact O-N 3.39Å
739	V	96.8	Very high	88	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.006	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	132.4	170.3	66.4	0	0	0	0	109.8	V677 K678 R741 E746 Y747 W748	V677-V739 WeakPolarHBondContact CA-O 3.32Å; K678-V739 HydrophobicContact CB-CG1 3.79Å; K678-V739 PolarHBondContact N-O 2.81Å; K678-V739 PolarHBondContact O-N 2.92Å; V739-R741 HydrophobicContact CG2-CG 4.28Å; V739-E746 VanDerWaalsContact CG2-CD 3.41Å; V739-E746 HydrophobicContact CG2-CG 3.29Å; V739-E746 WeakPolarHBondContact CG2-OE2 3.41Å; V739-Y747 WeakPolarHBondContact CA-O 3.39Å; V739-W748 HydrophobicContact CB-CD2 4.22Å; V739-W748 HydrophobicContact CB-CE3 4.1Å; V739-W748 HydrophobicContact CB-CH2 3.71Å; V739-W748 HydrophobicContact CB-CZ2 3.83Å; V739-W748 HydrophobicContact CB-CZ3 3.86Å; V739-W748 HydrophobicContact CG1-CH2 4.4Å; V739-W748 HydrophobicContact CG2-CD2 4.19Å; V739-W748 HydrophobicContact CG2-CH2 4.02Å; V739-W748 HydrophobicContact CG2-CZ2 3.59Å; V739-W748 HydrophobicContact CG2-CZ3 4.48Å
740	Y	95.4	Very high	89.7	Confident	2 Å²	2	48.7 Å²	48.7	1%	0.008	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	115.4	171.9	165.4	-133.4	0	0	0	108.9	V643 T662 K675 E676 V677 Y747	V643-Y740 HydrophobicContact CB-CD1 4.45Å; T662-Y740 HydrophobicContact CG2-CD1 3.72Å; T662-Y740 HydrophobicContact CG2-CD2 4.04Å; T662-Y740 HydrophobicContact CG2-CE1 4.29Å; T662-Y740 HydrophobicContact CG2-CG 3.6Å; K675-Y740 HydrophobicContact CB-CE2 4.26Å; K675-Y740 HydrophobicContact CG-CE2 4.41Å; E676-Y740 WeakPolarHBondContact O-CA 3.36Å; V677-Y740 HydrophobicContact CG2-CD2 3.69Å; V677-Y740 HydrophobicContact CG2-CE2 4.49Å; V677-Y740 HydrophobicContact CG2-CG 4.24Å; Y740-Y747 AromaticContact CD1-CD2 3.56Å; Y740-Y747 HydrophobicContact CD1-CD2 3.56Å; Y740-Y747 HydrophobicContact CD1-CE2 4.39Å; Y740-Y747 HydrophobicContact CD1-CG 4.23Å; Y740-Y747 AromaticContact CE1-CD2 3.79Å; Y740-Y747 HydrophobicContact CE1-CD2 3.79Å; Y740-Y747 HydrophobicContact CE1-CE2 4.17Å; Y740-Y747 HydrophobicContact CG-CD2 4.45Å; Y740-Y747 PolarHBondContact N-O 3.08Å; Y740-Y747 PolarHBondContact O-N 3.26Å
741	R	93.7	Very high	91.1	Very high	55 Å²	55	40.6 Å²	40.6	21%	0.208	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	130.4	175.8	-64.9	166.1	-178.2	134.4	8.8	109	K675 E676 E691 V739 F745 E746	K675-R741 CarbonylContact C-O 3.57Å; K675-R741 WeakPolarHBondContact CA-O 3.45Å; E676-R741 HydrophobicContact CG-CB 3.92Å; E676-R741 HydrophobicContact CG-CG 4.49Å; E676-R741 PolarHBondContact N-O 3.45Å; E676-R741 PolarHBondContact O-N 2.91Å; E676-R741 WeakPolarHBondContact OE1-CD 3.45Å; E676-R741 IonicContact OE1-CZ 3.42Å; E676-R741 IonicContact OE1-NH1 3.24Å; E676-R741 PolarHBondContact OE1-NH1 3.36Å; E691-R741 IonicContact OE1-CZ 3.45Å; E691-R741 IonicContact OE1-NH1 3.98Å; E691-R741 IonicContact OE1-NH2 3.18Å; E691-R741 PolarHBondContact OE1-NH2 3.18Å; E691-R741 IonicContact OE2-CZ 3.75Å; E691-R741 IonicContact OE2-NH1 3.75Å; E691-R741 PolarHBondContact OE2-NH1 3.01Å; E691-R741 IonicContact OE2-NH2 2.86Å; E691-R741 PolarHBondContact OE2-NH2 3.05Å; V739-R741 HydrophobicContact CG2-CG 4.28Å; R741-F745 WeakPolarHBondContact CA-O 3.43Å; R741-E746 HydrophobicContact CG-CB 4.39Å; R741-E746 HydrophobicContact CG-CG 3.91Å; R741-E746 IonicContact CZ-OE2 3.53Å; R741-E746 VanDerWaalsContact CZ-OE2 3.25Å; R741-E746 IonicContact NE-OE2 3.21Å; R741-E746 PolarHBondContact NE-OE2 3.29Å; R741-E746 IonicContact NH2-OE2 3.7Å; R741-E746 PolarHBondContact NH2-OE2 2.88Å
742	G	86.4	Confident	92.3	Very high	7 Å²	7	43.9 Å²	43.9	7%	0.072	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177.8	148.1	176.8	0	0	0	0	0	111.9	D744 F745	G742-D744 PolarHBondContact O-N 2.92Å; G742-F745 PolarHBondContact N-O 2.98Å; G742-F745 PolarHBondContact O-N 3.29Å; G742-F745 VanDerWaalsContact O-N 3.12Å
743	N	77.7	Confident	92.9	Very high	27 Å²	27	43.3 Å²	43.3	14%	0.144	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.4	43	-178.4	-51.1	-11.5	0	0	0	112.4	I668 F745	I668-N743 HydrophobicContact CD1-CB 4.13Å; I668-N743 VanDerWaalsContact CD1-ND2 3.34Å; I668-N743 WeakPolarHBondContact CD1-ND2 3.46Å; N743-F745 WeakPolarHBondContact O-CD2 3.36Å; N743-F745 PolarHBondContact O-N 3.49Å; N743-F745 VanDerWaalsContact O-N 3.09Å
744	D	82.4	Confident	93.1	Very high	140 Å²	140	48.7 Å²	48.7	75%	0.749	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.4	8.8	-177.8	-49.6	-36.9	0	0	0	116.6	G742	G742-D744 PolarHBondContact O-N 2.92Å
745	F	89.5	Confident	93.2	Very high	131 Å²	131	50.2 Å²	50.2	58%	0.575	25%	0.246	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-107.9	150.1	172.9	-64.5	-73.3	0	0	0	112.4	R741 G742 N743 Y747	R741-F745 WeakPolarHBondContact CA-O 3.43Å; G742-F745 PolarHBondContact N-O 2.98Å; G742-F745 PolarHBondContact O-N 3.29Å; G742-F745 VanDerWaalsContact O-N 3.12Å; N743-F745 WeakPolarHBondContact O-CD2 3.36Å; N743-F745 PolarHBondContact O-N 3.49Å; N743-F745 VanDerWaalsContact O-N 3.09Å; F745-Y747 HydrophobicContact CB-CD2 4.28Å; F745-Y747 HydrophobicContact CB-CE1 4.36Å; F745-Y747 HydrophobicContact CB-CE2 3.57Å
746	E	93.7	Very high	93.2	Very high	89 Å²	89	49.3 Å²	49.3	42%	0.416	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	114	169.4	-169.5	178.4	80.2	0	0	109.3	V739 R741 W748	V739-E746 VanDerWaalsContact CG2-CD 3.41Å; V739-E746 HydrophobicContact CG2-CG 3.29Å; V739-E746 WeakPolarHBondContact CG2-OE2 3.41Å; R741-E746 HydrophobicContact CG-CB 4.39Å; R741-E746 HydrophobicContact CG-CG 3.91Å; R741-E746 IonicContact CZ-OE2 3.53Å; R741-E746 VanDerWaalsContact CZ-OE2 3.25Å; R741-E746 IonicContact NE-OE2 3.21Å; R741-E746 PolarHBondContact NE-OE2 3.29Å; R741-E746 IonicContact NH2-OE2 3.7Å; R741-E746 PolarHBondContact NH2-OE2 2.88Å; E746-W748 WeakPolarHBondContact OE1-CZ2 3.34Å; E746-W748 PolarHBondContact OE1-NE1 3.5Å
747	Y	94.7	Very high	93.2	Very high	71 Å²	71	51 Å²	51	28%	0.278	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	142.4	178.8	-58.7	-79.3	0	0	0	110.5	K642 V739 Y740 F745	K642-Y747 HydrophobicContact CB-CD1 3.77Å; K642-Y747 HydrophobicContact CB-CD2 4.31Å; K642-Y747 HydrophobicContact CB-CE1 4.03Å; K642-Y747 HydrophobicContact CB-CG 3.93Å; K642-Y747 HydrophobicContact CG-CD1 4Å; K642-Y747 HydrophobicContact CG-CE1 3.8Å; V739-Y747 WeakPolarHBondContact CA-O 3.39Å; Y740-Y747 AromaticContact CD1-CD2 3.56Å; Y740-Y747 HydrophobicContact CD1-CD2 3.56Å; Y740-Y747 HydrophobicContact CD1-CE2 4.39Å; Y740-Y747 HydrophobicContact CD1-CG 4.23Å; Y740-Y747 AromaticContact CE1-CD2 3.79Å; Y740-Y747 HydrophobicContact CE1-CD2 3.79Å; Y740-Y747 HydrophobicContact CE1-CE2 4.17Å; Y740-Y747 HydrophobicContact CG-CD2 4.45Å; Y740-Y747 PolarHBondContact N-O 3.08Å; Y740-Y747 PolarHBondContact O-N 3.26Å; F745-Y747 HydrophobicContact CB-CD2 4.28Å; F745-Y747 HydrophobicContact CB-CE1 4.36Å; F745-Y747 HydrophobicContact CB-CE2 3.57Å
748	W	97	Very high	93	Very high	76 Å²	76	50.9 Å²	50.9	29%	0.288	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	131.7	-174	-77.8	90.3	0	0	0	112.7	R680 A737 I738 V739 E746	R680-W748 HydrophobicContact CB-CH2 4.28Å; R680-W748 HydrophobicContact CB-CZ3 4.34Å; A737-W748 HydrophobicContact CB-CE3 4.07Å; A737-W748 HydrophobicContact CB-CZ3 3.99Å; I738-W748 WeakPolarHBondContact O-CA 3.38Å; V739-W748 HydrophobicContact CB-CD2 4.22Å; V739-W748 HydrophobicContact CB-CE3 4.1Å; V739-W748 HydrophobicContact CB-CH2 3.71Å; V739-W748 HydrophobicContact CB-CZ2 3.83Å; V739-W748 HydrophobicContact CB-CZ3 3.86Å; V739-W748 HydrophobicContact CG1-CH2 4.4Å; V739-W748 HydrophobicContact CG2-CD2 4.19Å; V739-W748 HydrophobicContact CG2-CH2 4.02Å; V739-W748 HydrophobicContact CG2-CZ2 3.59Å; V739-W748 HydrophobicContact CG2-CZ3 4.48Å; E746-W748 WeakPolarHBondContact OE1-CZ2 3.34Å; E746-W748 PolarHBondContact OE1-NE1 3.5Å
749	D	97.2	Very high	92.8	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	96.3	159.8	-174.1	16.5	0	0	0	110.3	R637 Q641 V643 C644 L645 A737 I738 N751 Y756	R637-D749 IonicContact CZ-OD1 2.99Å; R637-D749 VanDerWaalsContact NH2-CG 3.28Å; R637-D749 IonicContact NH2-OD1 2.81Å; R637-D749 PolarHBondContact NH2-OD1 3.34Å; R637-D749 IonicContact NH2-OD2 3.28Å; R637-D749 PolarHBondContact NH2-OD2 2.83Å; Q641-D749 PolarHBondContact NE2-OD1 3.33Å; V643-D749 HydrophobicContact CG1-CB 4.12Å; C644-D749 VanDerWaalsContact CA-OD2 3.32Å; C644-D749 WeakPolarHBondContact CA-OD2 3.46Å; L645-D749 PolarHBondContact N-OD2 2.93Å; A737-D749 WeakPolarHBondContact CA-O 3.47Å; I738-D749 HydrophobicContact CB-CB 4.27Å; I738-D749 HydrophobicContact CD1-CB 4.39Å; I738-D749 PolarHBondContact N-O 2.88Å; I738-D749 PolarHBondContact O-N 3.39Å; D749-N751 PolarHBondContact OD1-N 3.47Å; D749-Y756 WeakPolarHBondContact OD2-CE2 3.39Å; D749-Y756 PolarHBondContact OD2-OH 3.38Å; D749-Y756 VanDerWaalsContact OD2-OH 3.05Å
750	N	96.1	Very high	92.4	Very high	45 Å²	45	54.5 Å²	54.5	24%	0.241	26%	0.264	C	S	.	.			trans	-103.5	21.6	174.6	71.1	-6.3	0	0	0	112.1	A737 H752 S753 Q754 N755	A737-N750 HydrophobicContact CB-CB 4.06Å; N750-H752 PolarHBondContact O-N 2.98Å; N750-H752 PolarHBondContact OD1-N 2.84Å; N750-S753 VanDerWaalsContact CG-N 3.32Å; N750-S753 WeakPolarHBondContact ND2-CA 3.47Å; N750-S753 PolarHBondContact ND2-OG 3.33Å; N750-S753 VanDerWaalsContact ND2-OG 3.16Å; N750-S753 PolarHBondContact O-N 3.35Å; N750-S753 PolarHBondContact OD1-N 3.28Å; N750-Q754 PolarHBondContact O-N 2.84Å; N750-N755 VanDerWaalsContact O-CA 3.31Å; N750-N755 WeakPolarHBondContact O-CA 3.4Å; N750-N755 PolarHBondContact O-N 3.36Å
751	N	94.5	Very high	91.9	Very high	21 Å²	21	56.1 Å²	56.1	11%	0.112	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.2	50	-179	-165.2	40.4	0	0	0	113.6	R637 D749 S753 Q754 N755 Y756	R637-N751 PolarHBondContact NH1-OD1 2.96Å; D749-N751 PolarHBondContact OD1-N 3.47Å; N751-S753 PolarHBondContact O-N 3Å; N751-Q754 WeakPolarHBondContact O-CB 3.41Å; N751-Q754 PolarHBondContact O-N 2.88Å; N751-N755 WeakPolarHBondContact CB-O 3.32Å; N751-N755 PolarHBondContact ND2-O 3.21Å; N751-Y756 HydrophobicContact CB-CD1 4.13Å; N751-Y756 HydrophobicContact CB-CD2 4.11Å; N751-Y756 HydrophobicContact CB-CE1 3.86Å; N751-Y756 HydrophobicContact CB-CE2 3.83Å; N751-Y756 HydrophobicContact CB-CG 4.25Å
752	H	92.1	Very high	90.8	Very high	99 Å²	99	57.6 Å²	57.6	46%	0.458	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.1	47.6	-174.7	-52.1	-73.1	0	0	0	113.2	R637 N750 Q754	R637-H752 VanDerWaalsContact CD-NE2 3.29Å; R637-H752 WeakPolarHBondContact CD-NE2 3.48Å; R637-H752 PolarHBondContact NE-NE2 2.89Å; N750-H752 PolarHBondContact O-N 2.98Å; N750-H752 PolarHBondContact OD1-N 2.84Å; H752-Q754 PolarHBondContact O-N 3.5Å
753	S	92.2	Very high	89.3	Confident	98 Å²	98	62.2 Å²	62.2	69%	0.685	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.5	17.4	-179.2	-54.1	0	0	0	0	115.9	N750 N751	N750-S753 VanDerWaalsContact CG-N 3.32Å; N750-S753 WeakPolarHBondContact ND2-CA 3.47Å; N750-S753 PolarHBondContact ND2-OG 3.33Å; N750-S753 VanDerWaalsContact ND2-OG 3.16Å; N750-S753 PolarHBondContact O-N 3.35Å; N750-S753 PolarHBondContact OD1-N 3.28Å; N751-S753 PolarHBondContact O-N 3Å
754	Q	93.6	Very high	87.6	Confident	138 Å²	138	71.2 Å²	71.2	65%	0.645	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	-9.4	172.2	-59.1	-176.2	-2.7	0	0	113.2	N750 N751 H752	N750-Q754 PolarHBondContact O-N 2.84Å; N751-Q754 WeakPolarHBondContact O-CB 3.41Å; N751-Q754 PolarHBondContact O-N 2.88Å; H752-Q754 PolarHBondContact O-N 3.5Å
755	N	96	Very high	87.9	Confident	32 Å²	32	67.8 Å²	67.8	17%	0.171	33%	0.327	C	S	.	.			trans	56.8	174.5	-165.4	-59.9	-37	0	0	0	113.5	W686 E735 N750 N751	W686-N755 PolarHBondContact NE1-ND2 3.39Å; W686-N755 VanDerWaalsContact NE1-ND2 3.12Å; E735-N755 HydrophobicContact CB-CB 4.35Å; E735-N755 PolarHBondContact OE2-ND2 2.98Å; N750-N755 VanDerWaalsContact O-CA 3.31Å; N750-N755 WeakPolarHBondContact O-CA 3.4Å; N750-N755 PolarHBondContact O-N 3.36Å; N751-N755 WeakPolarHBondContact CB-O 3.32Å; N751-N755 PolarHBondContact ND2-O 3.21Å
756	Y	97.1	Very high	87.8	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	105.1	167.9	-73.8	-68.6	0	0	0	109.6	F625 P628 R637 L645 E735 F736 D749 N751	F625-Y756 AromaticContact CD1-CD1 3.76Å; F625-Y756 HydrophobicContact CD1-CD1 3.76Å; F625-Y756 AromaticContact CD2-CD1 3.58Å; F625-Y756 HydrophobicContact CD2-CD1 3.58Å; F625-Y756 AromaticContact CD2-CE1 3.85Å; F625-Y756 HydrophobicContact CD2-CE1 3.85Å; F625-Y756 AromaticContact CE1-CD1 3.7Å; F625-Y756 HydrophobicContact CE1-CD1 3.7Å; F625-Y756 HydrophobicContact CE1-CG 4.21Å; F625-Y756 AromaticContact CE2-CD1 3.52Å; F625-Y756 HydrophobicContact CE2-CD1 3.52Å; F625-Y756 HydrophobicContact CE2-CE1 4.03Å; F625-Y756 HydrophobicContact CE2-CG 4.4Å; F625-Y756 AromaticContact CG-CD1 3.71Å; F625-Y756 HydrophobicContact CG-CD1 3.71Å; F625-Y756 HydrophobicContact CG-CE1 4.19Å; F625-Y756 AromaticContact CZ-CD1 3.58Å; F625-Y756 HydrophobicContact CZ-CD1 3.58Å; F625-Y756 HydrophobicContact CZ-CG 4.11Å; P628-Y756 HydrophobicContact CG-CE1 4Å; R637-Y756 PolarHBondContact NH2-OH 2.9Å; L645-Y756 HydrophobicContact CB-CE1 4.3Å; L645-Y756 HydrophobicContact CB-CE2 3.77Å; L645-Y756 HydrophobicContact CD2-CD1 3.65Å; L645-Y756 HydrophobicContact CD2-CD2 4.1Å; L645-Y756 HydrophobicContact CD2-CE1 3.52Å; L645-Y756 HydrophobicContact CD2-CE2 3.97Å; L645-Y756 HydrophobicContact CD2-CG 3.93Å; E735-Y756 CarbonylContact C-O 3.47Å; E735-Y756 VanDerWaalsContact CA-O 3.32Å; E735-Y756 WeakPolarHBondContact CA-O 3.43Å; F736-Y756 WeakPolarHBondContact CD1-O 3.47Å; F736-Y756 HydrophobicContact CD2-CD2 4.14Å; F736-Y756 HydrophobicContact CD2-CG 4.34Å; F736-Y756 VanDerWaalsContact CE1-CB 3.47Å; F736-Y756 HydrophobicContact CE1-CG 4.45Å; F736-Y756 AromaticContact CE2-CD2 3.74Å; F736-Y756 HydrophobicContact CE2-CD2 3.74Å; F736-Y756 AromaticContact CE2-CG 3.78Å; F736-Y756 HydrophobicContact CE2-CG 3.78Å; F736-Y756 HydrophobicContact CZ-CD2 4.28Å; F736-Y756 AromaticContact CZ-CG 3.85Å; F736-Y756 HydrophobicContact CZ-CG 3.85Å; F736-Y756 PolarHBondContact N-O 3.47Å; F736-Y756 WeakPolarHBondContact O-CB 3.44Å; F736-Y756 PolarHBondContact O-N 3.37Å; D749-Y756 WeakPolarHBondContact OD2-CE2 3.39Å; D749-Y756 PolarHBondContact OD2-OH 3.38Å; D749-Y756 VanDerWaalsContact OD2-OH 3.05Å; N751-Y756 HydrophobicContact CB-CD1 4.13Å; N751-Y756 HydrophobicContact CB-CD2 4.11Å; N751-Y756 HydrophobicContact CB-CE1 3.86Å; N751-Y756 HydrophobicContact CB-CE2 3.83Å; N751-Y756 HydrophobicContact CB-CG 4.25Å
757	I	95.7	Very high	87.4	Confident	36 Å²	36	63.1 Å²	63.1	19%	0.185	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	133	-174.3	-57	177.7	0	0	0	110.5	T624 F625 Q733 L734 E735 Y759	T624-I757 HydrophobicContact CG2-CB 4.16Å; T624-I757 HydrophobicContact CG2-CG2 3.95Å; T624-I757 PolarHBondContact N-O 2.84Å; T624-I757 PolarHBondContact OG1-O 3.12Å; T624-I757 VanDerWaalsContact OG1-O 3.09Å; F625-I757 WeakPolarHBondContact CD1-O 3.45Å; F625-I757 VanDerWaalsContact CE1-O 3.3Å; F625-I757 WeakPolarHBondContact CE1-O 3.39Å; Q733-I757 HydrophobicContact CG-CG2 3.71Å; L734-I757 CarbonylContact O-C 3.52Å; L734-I757 WeakPolarHBondContact O-CA 3.26Å; E735-I757 HydrophobicContact CG-CG1 4.22Å; I757-Y759 HydrophobicContact CG2-CE2 4.19Å
758	C	94.6	Very high	87	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	138.9	175.5	-61.8	0	0	0	0	111.2	W621 V622 F648 L734	W621-C758 HydrophobicContact CB-CB 4.06Å; W621-C758 HydrophobicContact CD2-CB 4.49Å; W621-C758 HydrophobicContact CE3-CB 3.97Å; W621-C758 WeakPolarHBondContact CZ3-O 3.49Å; V622-C758 CarbonylContact O-C 3.56Å; V622-C758 VanDerWaalsContact O-CA 3.28Å; V622-C758 WeakPolarHBondContact O-CA 3.35Å; F648-C758 HydrophobicContact CZ-CB 4.38Å; F648-C758 WeakPolarHBondContact CZ-SG 3.49Å; L734-C758 HydrophobicContact CB-CB 4.22Å; L734-C758 HydrophobicContact CD2-CB 4.27Å; L734-C758 HydrophobicContact CG-CB 4.47Å; L734-C758 PolarHBondContact N-O 3.5Å; L734-C758 PolarHBondContact O-N 3.02Å
759	Y	92.4	Very high	86.4	Confident	75 Å²	75	61.8 Å²	61.8	29%	0.294	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	148.6	174.4	-65.8	-68.9	0	0	0	111.4	V622 T624 L732 Q733 I757	V622-Y759 PolarHBondContact N-O 3.41Å; V622-Y759 PolarHBondContact O-N 3.06Å; T624-Y759 HydrophobicContact CG2-CD2 3.64Å; T624-Y759 HydrophobicContact CG2-CE2 3.39Å; L732-Y759 WeakPolarHBondContact O-CD1 3.44Å; Q733-Y759 HydrophobicContact CB-CE1 4.26Å; Q733-Y759 HydrophobicContact CG-CD1 4.46Å; Q733-Y759 HydrophobicContact CG-CE1 4.01Å; Q733-Y759 PolarHBondContact OE1-OH 3.49Å; Q733-Y759 VanDerWaalsContact OE1-OH 3.13Å; I757-Y759 HydrophobicContact CG2-CE2 4.19Å
760	P	88.8	Confident	85.7	Confident	2 Å²	2	65.9 Å²	65.9	1%	0.013	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	140.7	165	-24	34.4	0	0	0	111.8	W621 L653 F731 L732 T762 L763	W621-P760 HydrophobicContact CE3-CG 4.38Å; W621-P760 HydrophobicContact CH2-CG 4.34Å; W621-P760 HydrophobicContact CZ3-CG 3.88Å; L653-P760 HydrophobicContact CD1-CB 4.2Å; L653-P760 HydrophobicContact CD2-CB 3.91Å; L653-P760 HydrophobicContact CD2-CG 4.25Å; F731-P760 HydrophobicContact CB-CG 3.57Å; F731-P760 WeakPolarHBondContact O-CG 3.39Å; L732-P760 WeakPolarHBondContact O-CD 3.39Å; P760-T762 PolarHBondContact O-N 3.32Å; P760-L763 HydrophobicContact CG-CD1 4.47Å; P760-L763 PolarHBondContact O-N 3Å; P760-L763 VanDerWaalsContact O-N 3.12Å
761	S	85.3	Confident	84.9	Confident	37 Å²	37	67.4 Å²	67.4	26%	0.259	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	10.7	178.1	66.9	0	0	0	0	115.3	Q619 K620	Q619-S761 WeakPolarHBondContact CA-OG 3.35Å; K620-S761 PolarHBondContact N-OG 3.43Å; K620-S761 PolarHBondContact O-N 3.37Å
762	T	69.7	Low	84.2	Confident	85 Å²	85	70.9 Å²	70.9	52%	0.521	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-5.9	169.9	24.1	0	0	0	0	113.4	Q619 P760	Q619-T762 HydrophobicContact CG-CG2 3.89Å; Q619-T762 PolarHBondContact OE1-OG1 3.44Å; P760-T762 PolarHBondContact O-N 3.32Å
763	L	56.2	Low	83.5	Confident	104 Å²	104	68.6 Å²	68.6	55%	0.545	35%	0.347	S	S	.	.			trans	-102.2	29.2	177	-76	156.9	0	0	0	112.4	P760	P760-L763 HydrophobicContact CG-CD1 4.47Å; P760-L763 PolarHBondContact O-N 3Å; P760-L763 VanDerWaalsContact O-N 3.12Å
764	Y	41	Very low	82.8	Confident	216 Å²	216	65.9 Å²	65.9	85%	0.847	32%	0.316	S	S	*	.			trans	-141.4	0	-179.6	-85.1	-70.5	0	0	0	111.7	V622	V622-Y764 HydrophobicContact CB-CE2 4.38Å; V622-Y764 HydrophobicContact CG1-CE2 4.07Å

Retrieved 764 of 764 residues in 779.9 ms (Link to these results)

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