A0A077Z0M4_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z0M4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 343 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.3	Very low	33.2	Very low	230 Å²	230	124.8 Å²	124.8	100%	1.133	63%	0.629	S	S	*	*				0	97.5	0	-80.5	-165.9	-168.2	0	0	103.9	I3	M1-I3 PolarHBondContact O-N 2.88Å
2	D	32	Very low	33.2	Very low	163 Å²	163	119.2 Å²	119.2	87%	0.872	62%	0.615	S	S	*	*			trans	-92.5	105.9	-167.4	-60.5	-18.4	0	0	0	107.6
3	I	30.3	Very low	33.3	Very low	120 Å²	120	116.8 Å²	116.8	62%	0.615	60%	0.604	S	S	*	*			trans	-68.1	128.7	171.5	-59	168.7	0	0	0	106.3	M1 I5 D7	M1-I3 PolarHBondContact O-N 2.88Å; I3-I5 PolarHBondContact O-N 3.36Å; I3-D7 HydrophobicContact CG2-CB 4.15Å
4	P	31	Very low	33.3	Very low	76 Å²	76	113.2 Å²	113.2	49%	0.494	59%	0.59	S	S	.	*			trans	-61.5	129.8	179.5	23.5	-30.6	0	0	0	110.1	E6 D7	P4-E6 PolarHBondContact O-N 2.98Å; P4-D7 WeakPolarHBondContact O-CB 3.4Å; P4-D7 PolarHBondContact O-N 2.67Å
5	I	33.9	Very low	33.7	Very low	117 Å²	117	113 Å²	113	60%	0.6	58%	0.584	S	S	*	*	H	α-helix	trans	-56.8	-19.2	-177.3	-67.1	166.6	0	0	0	112.8	I3 D7 E8 F9	I3-I5 PolarHBondContact O-N 3.36Å; I5-D7 VanDerWaalsContact C-N 3.29Å; I5-D7 PolarHBondContact O-N 3.36Å; I5-E8 PolarHBondContact O-N 3.45Å; I5-F9 PolarHBondContact O-N 3.47Å
6	E	33.8	Very low	33.8	Very low	139 Å²	139	113.6 Å²	113.6	65%	0.65	59%	0.588	S	S	*	*	H	α-helix	trans	-59.8	-40	171.6	-68.2	176.2	173.4	0	0	111.2	P4 E8 F9 F10	P4-E6 PolarHBondContact O-N 2.98Å; E6-E8 PolarHBondContact O-N 2.93Å; E6-F9 PolarHBondContact O-N 2.61Å; E6-F10 WeakPolarHBondContact O-CD2 3.27Å; E6-F10 PolarHBondContact O-N 3.25Å
7	D	32.1	Very low	33.8	Very low	88 Å²	88	111.3 Å²	111.3	47%	0.471	57%	0.574	S	S	.	*	H	α-helix	trans	-66.6	-37.5	177.8	-75.8	-24	0	0	0	112	I3 P4 I5 F9 T11	I3-D7 HydrophobicContact CG2-CB 4.15Å; P4-D7 WeakPolarHBondContact O-CB 3.4Å; P4-D7 PolarHBondContact O-N 2.67Å; I5-D7 VanDerWaalsContact C-N 3.29Å; I5-D7 PolarHBondContact O-N 3.36Å; D7-F9 PolarHBondContact O-N 3.21Å; D7-T11 WeakPolarHBondContact O-CB 3.07Å; D7-T11 PolarHBondContact O-N 3.39Å; D7-T11 PolarHBondContact O-OG1 3.43Å
8	E	32.9	Very low	33.9	Very low	131 Å²	131	111.1 Å²	111.1	61%	0.612	57%	0.57	S	S	*	*	H	α-helix	trans	-67.6	-34.7	178.8	-73.6	-171.2	166.2	0	0	112.7	I5 E6 A12	I5-E8 PolarHBondContact O-N 3.45Å; E6-E8 PolarHBondContact O-N 2.93Å; E8-A12 WeakPolarHBondContact O-CB 3.47Å; E8-A12 PolarHBondContact O-N 3.39Å
9	F	33.5	Very low	33.9	Very low	125 Å²	125	108.3 Å²	108.3	55%	0.548	57%	0.565	S	S	.	*	H	α-helix	trans	-72.5	-42.5	177.9	-175.9	-98.5	0	0	0	112	I5 E6 D7 A12 L13	I5-F9 PolarHBondContact O-N 3.47Å; E6-F9 PolarHBondContact O-N 2.61Å; D7-F9 PolarHBondContact O-N 3.21Å; F9-A12 PolarHBondContact O-N 3.37Å; F9-L13 HydrophobicContact CD1-CD1 3.89Å; F9-L13 HydrophobicContact CE1-CD1 3.35Å; F9-L13 HydrophobicContact CZ-CD1 3.75Å; F9-L13 PolarHBondContact O-N 3.45Å
10	F	35.1	Very low	34	Very low	119 Å²	119	105.8 Å²	105.8	52%	0.522	56%	0.561	S	S	.	*	H	α-helix	trans	-66.8	-37.8	174.6	-77.6	-70.5	0	0	0	111.6	E6 A12 L13 T14	E6-F10 WeakPolarHBondContact O-CD2 3.27Å; E6-F10 PolarHBondContact O-N 3.25Å; F10-A12 PolarHBondContact O-N 3.36Å; F10-L13 PolarHBondContact O-N 3.12Å; F10-T14 PolarHBondContact O-N 3.46Å; F10-T14 PolarHBondContact O-OG1 3.25Å; F10-T14 VanDerWaalsContact O-OG1 3.1Å
11	T	36.9	Very low	34	Very low	65 Å²	65	105.5 Å²	105.5	40%	0.399	56%	0.56	S	S	.	*	H	α-helix	trans	-64.6	-37.6	175	-54	0	0	0	0	112	D7 L13 T14 H15	D7-T11 WeakPolarHBondContact O-CB 3.07Å; D7-T11 PolarHBondContact O-N 3.39Å; D7-T11 PolarHBondContact O-OG1 3.43Å; T11-L13 VanDerWaalsContact C-N 3.32Å; T11-L13 PolarHBondContact O-N 3.2Å; T11-T14 VanDerWaalsContact CA-OG1 3.31Å; T11-T14 WeakPolarHBondContact CA-OG1 3.4Å; T11-T14 PolarHBondContact O-OG1 3.05Å; T11-H15 PolarHBondContact O-CD2 3.42Å; T11-H15 PolarHBondContact O-N 3.38Å; T11-H15 VanDerWaalsContact O-N 3.08Å
12	A	33.3	Very low	34.3	Very low	57 Å²	57	102.1 Å²	102.1	47%	0.471	54%	0.541	S	S	.	.	H	α-helix	trans	-70.6	-27.3	176.3	0	0	0	0	0	113.2	E8 F9 F10 L16	E8-A12 WeakPolarHBondContact O-CB 3.47Å; E8-A12 PolarHBondContact O-N 3.39Å; F9-A12 PolarHBondContact O-N 3.37Å; F10-A12 PolarHBondContact O-N 3.36Å; A12-L16 PolarHBondContact O-N 3.35Å
13	L	34.2	Very low	34.5	Very low	88 Å²	88	97.8 Å²	97.8	46%	0.461	53%	0.528	S	S	.	.	H	α-helix	trans	-76.1	-42.5	174.4	-102.2	146.9	0	0	0	111.7	F9 F10 T11 L16 E17	F9-L13 HydrophobicContact CD1-CD1 3.89Å; F9-L13 HydrophobicContact CE1-CD1 3.35Å; F9-L13 HydrophobicContact CZ-CD1 3.75Å; F9-L13 PolarHBondContact O-N 3.45Å; F10-L13 PolarHBondContact O-N 3.12Å; T11-L13 VanDerWaalsContact C-N 3.32Å; T11-L13 PolarHBondContact O-N 3.2Å; L13-L16 PolarHBondContact O-N 3.23Å; L13-E17 PolarHBondContact O-N 2.72Å; L13-E17 VanDerWaalsContact O-N 3.14Å
14	T	34.4	Very low	34.7	Very low	67 Å²	67	94.9 Å²	94.9	41%	0.411	52%	0.522	S	S	.	.	H	α-helix	trans	-64.6	-40.3	175.2	41.9	0	0	0	0	112.4	F10 T11 L16 E17 E18	F10-T14 PolarHBondContact O-N 3.46Å; F10-T14 PolarHBondContact O-OG1 3.25Å; F10-T14 VanDerWaalsContact O-OG1 3.1Å; T11-T14 VanDerWaalsContact CA-OG1 3.31Å; T11-T14 WeakPolarHBondContact CA-OG1 3.4Å; T11-T14 PolarHBondContact O-OG1 3.05Å; T14-L16 VanDerWaalsContact C-N 3.25Å; T14-L16 PolarHBondContact O-N 2.98Å; T14-E17 PolarHBondContact O-N 3.22Å; T14-E18 WeakPolarHBondContact O-CG 3.42Å; T14-E18 PolarHBondContact O-N 3.31Å
15	H	39.2	Very low	34.9	Very low	110 Å²	110	93.7 Å²	93.7	51%	0.509	52%	0.523	S	S	.	.	H	α-helix	trans	-66.9	-24.5	175.1	-74	-47.1	0	0	0	114	T11 E18 A19	T11-H15 PolarHBondContact O-CD2 3.42Å; T11-H15 PolarHBondContact O-N 3.38Å; T11-H15 VanDerWaalsContact O-N 3.08Å; H15-E18 IonicContact CE1-OE2 3.75Å; H15-E18 IonicContact ND1-OE2 3Å; H15-E18 PolarHBondContact ND1-OE2 2.99Å; H15-A19 WeakPolarHBondContact O-CB 3.25Å; H15-A19 PolarHBondContact O-N 3.08Å; H15-A19 VanDerWaalsContact O-N 3.15Å
16	L	34.2	Very low	35	Very low	122 Å²	122	90.9 Å²	90.9	64%	0.639	51%	0.514	S	S	*	.	H	α-helix	trans	-77.5	-31.9	174.4	-115.6	149.2	0	0	0	111.8	A12 L13 T14 A20	A12-L16 PolarHBondContact O-N 3.35Å; L13-L16 PolarHBondContact O-N 3.23Å; T14-L16 VanDerWaalsContact C-N 3.25Å; T14-L16 PolarHBondContact O-N 2.98Å; L16-A20 PolarHBondContact O-N 3.38Å
17	E	33.5	Very low	35.2	Very low	75 Å²	75	91 Å²	91	35%	0.35	52%	0.515	S	S	.	.	H	α-helix	trans	-72	-44	170.3	-83.4	-169.8	116.8	0	0	112	L13 T14 A19 A20 D21 R251	L13-E17 PolarHBondContact O-N 2.72Å; L13-E17 VanDerWaalsContact O-N 3.14Å; T14-E17 PolarHBondContact O-N 3.22Å; E17-A19 VanDerWaalsContact C-N 3.31Å; E17-A19 PolarHBondContact O-N 3.04Å; E17-A20 WeakPolarHBondContact O-CB 3.06Å; E17-A20 PolarHBondContact O-N 3.44Å; E17-D21 PolarHBondContact O-N 3.22Å; E17-R251 IonicContact OE1-CZ 3.45Å; E17-R251 IonicContact OE1-NE 3.23Å; E17-R251 PolarHBondContact OE1-NE 3.47Å; E17-R251 IonicContact OE1-NH2 2.81Å; E17-R251 PolarHBondContact OE1-NH2 2.86Å
18	E	37	Very low	35.6	Very low	107 Å²	107	94 Å²	94	50%	0.5	53%	0.53	S	S	.	.	H	α-helix	trans	-59.8	-40.6	176.1	-74.3	173.8	163.3	0	0	111.7	T14 H15 A20 D21 E22	T14-E18 WeakPolarHBondContact O-CG 3.42Å; T14-E18 PolarHBondContact O-N 3.31Å; H15-E18 IonicContact CE1-OE2 3.75Å; H15-E18 IonicContact ND1-OE2 3Å; H15-E18 PolarHBondContact ND1-OE2 2.99Å; E18-A20 VanDerWaalsContact C-N 3.27Å; E18-A20 PolarHBondContact O-N 2.74Å; E18-D21 PolarHBondContact O-N 2.89Å; E18-E22 WeakPolarHBondContact O-CG 3.47Å; E18-E22 PolarHBondContact O-N 2.98Å
19	A	33.9	Very low	35.8	Very low	59 Å²	59	90.3 Å²	90.3	49%	0.488	52%	0.517	S	S	.	.	H	α-helix	trans	-67.7	-25.5	175.6	0	0	0	0	0	113.4	H15 E17 A23	H15-A19 WeakPolarHBondContact O-CB 3.25Å; H15-A19 PolarHBondContact O-N 3.08Å; H15-A19 VanDerWaalsContact O-N 3.15Å; E17-A19 VanDerWaalsContact C-N 3.31Å; E17-A19 PolarHBondContact O-N 3.04Å; A19-A23 WeakPolarHBondContact O-CB 3.38Å; A19-A23 PolarHBondContact O-N 3.36Å
20	A	34.3	Very low	35.9	Very low	57 Å²	57	90.2 Å²	90.2	47%	0.471	52%	0.516	S	S	.	.	H	α-helix	trans	-79.3	-36.9	174.5	0	0	0	0	0	111.7	L16 E17 E18 A23 A24	L16-A20 PolarHBondContact O-N 3.38Å; E17-A20 WeakPolarHBondContact O-CB 3.06Å; E17-A20 PolarHBondContact O-N 3.44Å; E18-A20 VanDerWaalsContact C-N 3.27Å; E18-A20 PolarHBondContact O-N 2.74Å; A20-A23 PolarHBondContact O-N 3.19Å; A20-A24 PolarHBondContact O-N 3.42Å; A20-A24 VanDerWaalsContact O-N 3.15Å
21	D	36	Very low	35.8	Very low	100 Å²	100	92.4 Å²	92.4	54%	0.535	53%	0.528	S	S	.	.	H	α-helix	trans	-72.3	-36.5	176.3	-76.9	-20.4	0	0	0	112	E17 E18 A23 A24 G25	E17-D21 PolarHBondContact O-N 3.22Å; E18-D21 PolarHBondContact O-N 2.89Å; D21-A23 VanDerWaalsContact C-N 3.33Å; D21-A23 PolarHBondContact O-N 2.61Å; D21-A24 PolarHBondContact O-N 2.91Å; D21-G25 PolarHBondContact O-N 3.18Å
22	E	39.6	Very low	35.7	Very low	159 Å²	159	96.1 Å²	96.1	74%	0.743	55%	0.545	S	S	*	.	H	α-helix	trans	-65.4	-35.1	171.3	-77.5	-172.9	162.6	0	0	112.4	E18 A24 G25	E18-E22 WeakPolarHBondContact O-CG 3.47Å; E18-E22 PolarHBondContact O-N 2.98Å; E22-A24 VanDerWaalsContact C-N 3.3Å; E22-A24 PolarHBondContact O-N 2.83Å; E22-G25 PolarHBondContact O-N 2.86Å
23	A	34.8	Very low	35.7	Very low	72 Å²	72	98.3 Å²	98.3	60%	0.595	55%	0.549	S	S	*	.	H	α-helix	trans	-68.9	-28.4	174.2	0	0	0	0	0	112.7	A19 A20 D21	A19-A23 WeakPolarHBondContact O-CB 3.38Å; A19-A23 PolarHBondContact O-N 3.36Å; A20-A23 PolarHBondContact O-N 3.19Å; D21-A23 VanDerWaalsContact C-N 3.33Å; D21-A23 PolarHBondContact O-N 2.61Å
24	A	34.8	Very low	35.7	Very low	59 Å²	59	101.3 Å²	101.3	49%	0.488	56%	0.56	S	S	.	*	H	α-helix	trans	-80.5	-19.9	174	0	0	0	0	0	113.4	A20 D21 E22	A20-A24 PolarHBondContact O-N 3.42Å; A20-A24 VanDerWaalsContact O-N 3.15Å; D21-A24 PolarHBondContact O-N 2.91Å; E22-A24 VanDerWaalsContact C-N 3.3Å; E22-A24 PolarHBondContact O-N 2.83Å
25	G	34.6	Very low	35.7	Very low	51 Å²	51	109.2 Å²	109.2	53%	0.526	58%	0.582	S	S	.	*	S	Bend	trans	-86.9	-2.2	178.9	0	0	0	0	0	115.9	D21 E22 E27	D21-G25 PolarHBondContact O-N 3.18Å; E22-G25 PolarHBondContact O-N 2.86Å; G25-E27 PolarHBondContact O-N 3.39Å
26	S	36	Very low	35.5	Very low	58 Å²	58	107.3 Å²	107.3	41%	0.406	59%	0.586	S	S	.	*	S	Bend	trans	-55.3	133.3	174.9	171.2	0	0	0	0	111.4	D28 V29	S26-D28 PolarHBondContact O-N 2.96Å; S26-V29 WeakPolarHBondContact O-CB 3.45Å; S26-V29 PolarHBondContact O-N 2.93Å
27	E	39.3	Very low	35.4	Very low	142 Å²	142	103.9 Å²	103.9	66%	0.664	58%	0.58	S	S	*	*	G	3₁₀ helix	trans	-59	-17.6	-172.1	-61.7	-149.5	119.7	0	0	114.4	G25 V29 K30	G25-E27 PolarHBondContact O-N 3.39Å; E27-V29 PolarHBondContact O-N 3.41Å; E27-K30 PolarHBondContact O-N 3.4Å; E27-K30 IonicContact OE1-NZ 2.94Å; E27-K30 PolarHBondContact OE1-NZ 2.91Å
28	D	40.2	Very low	35.4	Very low	150 Å²	150	108.2 Å²	108.2	80%	0.802	60%	0.6	S	S	*	*	G	3₁₀ helix	trans	-71.5	-14.3	172.7	-72.4	-26.1	0	0	0	113.7	S26	S26-D28 PolarHBondContact O-N 2.96Å
29	V	37.8	Very low	35.3	Very low	55 Å²	55	112.1 Å²	112.1	33%	0.333	62%	0.619	S	S	.	*	G	3₁₀ helix	trans	-92.5	-16.7	177.4	-173.8	0	0	0	0	111.8	S26 E27 E31 L32 N33	S26-V29 WeakPolarHBondContact O-CB 3.45Å; S26-V29 PolarHBondContact O-N 2.93Å; E27-V29 PolarHBondContact O-N 3.41Å; V29-E31 PolarHBondContact O-N 2.83Å; V29-L32 PolarHBondContact O-N 3.25Å; V29-N33 PolarHBondContact O-N 2.87Å
30	K	33.9	Very low	35.4	Very low	122 Å²	122	113.6 Å²	113.6	53%	0.53	63%	0.631	S	S	.	*	H	α-helix	trans	-68.7	-30.5	-179.4	-73.8	179.3	-175.7	168	0	113.2	E27	E27-K30 PolarHBondContact O-N 3.4Å; E27-K30 IonicContact OE1-NZ 2.94Å; E27-K30 PolarHBondContact OE1-NZ 2.91Å
31	E	34.7	Very low	35.2	Very low	166 Å²	166	115.4 Å²	115.4	78%	0.776	64%	0.64	S	S	*	*	H	α-helix	trans	-75.7	-26.4	178.6	-77.2	-167.6	152.3	0	0	113.4	V29	V29-E31 PolarHBondContact O-N 2.83Å
32	L	34	Very low	34.9	Very low	143 Å²	143	121.3 Å²	121.3	75%	0.749	66%	0.655	S	S	*	*	H	α-helix	trans	-78.1	-31.4	177.1	-122.6	88.8	0	0	0	112.7	V29 H34	V29-L32 PolarHBondContact O-N 3.25Å; L32-H34 VanDerWaalsContact C-N 3.32Å
33	N	33.7	Very low	34.5	Very low	103 Å²	103	119.5 Å²	119.5	55%	0.551	66%	0.657	S	S	*	*	H	α-helix	trans	-78	-15.8	179.7	-75	-26.9	0	0	0	113.5	V29 W35 A36 G37	V29-N33 PolarHBondContact O-N 2.87Å; N33-W35 PolarHBondContact O-N 3.47Å; N33-A36 PolarHBondContact O-N 2.88Å; N33-G37 PolarHBondContact O-N 3.4Å
34	H	33.9	Very low	34.3	Very low	150 Å²	150	125.6 Å²	125.6	69%	0.694	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	-19	-179.1	-136.8	-54.5	0	0	0	113.7	L32	L32-H34 VanDerWaalsContact C-N 3.32Å
35	W	34.8	Very low	34	Very low	233 Å²	233	130.5 Å²	130.5	88%	0.883	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	-15.5	175.5	-77.4	68.6	0	0	0	113.5	N33	N33-W35 PolarHBondContact O-N 3.47Å
36	A	34.5	Very low	33.8	Very low	71 Å²	71	136.2 Å²	136.2	59%	0.587	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	-21.1	175	0	0	0	0	0	112.9	N33 Q38	N33-A36 PolarHBondContact O-N 2.88Å; A36-Q38 PolarHBondContact O-N 3.39Å
37	G	32.1	Very low	33.4	Very low	50 Å²	50	137.9 Å²	137.9	52%	0.515	72%	0.724	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.5	-4.8	-177.5	0	0	0	0	0	116.2	N33	N33-G37 PolarHBondContact O-N 3.4Å
38	Q	33.4	Very low	32.8	Very low	165 Å²	165	134.4 Å²	134.4	77%	0.771	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.7	-9.9	-174.5	-132.9	171.8	12.1	0	0	114.3	A36	A36-Q38 PolarHBondContact O-N 3.39Å
39	E	35.7	Very low	32.2	Very low	190 Å²	190	133.9 Å²	133.9	89%	0.888	72%	0.723	S	S	*	*	S	Bend	trans	-96.8	-6.7	173.2	-75.4	-174.8	153	0	0	113.7	S41	E39-S41 PolarHBondContact O-N 3.46Å
40	A	34.6	Very low	31.6	Very low	89 Å²	89	142.6 Å²	142.6	74%	0.736	75%	0.751	S	S	*	*	S	Bend	trans	-89.3	9.9	-174	0	0	0	0	0	115.1
41	S	30.7	Very low	31.3	Very low	96 Å²	96	145.2 Å²	145.2	67%	0.671	76%	0.763	S	S	*	*			trans	-111.6	17.3	-169.3	52	0	0	0	0	115.5	E39	E39-S41 PolarHBondContact O-N 3.46Å
42	R	30.1	Very low	30.8	Very low	223 Å²	223	145.4 Å²	145.4	84%	0.842	76%	0.764	S	S	*	*	S	Bend	trans	-91.7	129.3	170.9	-79.9	-173	177.7	177.6	1	111.7
43	P	31.1	Very low	30.5	Very low	122 Å²	122	147.4 Å²	147.4	79%	0.792	77%	0.769	S	S	*	*			trans	-68.2	135.2	179.7	29.1	-32	0	0	0	110	D45	P43-D45 PolarHBondContact O-N 2.85Å
44	F	30.5	Very low	30.2	Very low	200 Å²	200	152.4 Å²	152.4	88%	0.877	78%	0.78	S	S	*	*			trans	-68.2	111.6	177.2	-87.6	-97.5	0	0	0	110.4	L46	F44-L46 PolarHBondContact O-N 2.86Å
45	D	28.7	Very low	29.9	Very low	161 Å²	161	155.5 Å²	155.5	86%	0.861	79%	0.786	S	S	*	*			trans	-73.5	115.6	169.7	-117.4	-26.7	0	0	0	109.7	P43 A47	P43-D45 PolarHBondContact O-N 2.85Å; D45-A47 VanDerWaalsContact C-N 3.26Å; D45-A47 PolarHBondContact O-N 2.94Å
46	L	31.1	Very low	29.5	Very low	171 Å²	171	150.5 Å²	150.5	90%	0.895	77%	0.772	S	S	*	*	S	Bend	trans	-75.7	67.8	175.8	-91.8	94.2	0	0	0	110.9	F44	F44-L46 PolarHBondContact O-N 2.86Å
47	A	27.6	Very low	29.3	Very low	94 Å²	94	151.4 Å²	151.4	78%	0.777	77%	0.772	S	S	*	*	S	Bend	trans	175.7	106.8	156.9	0	0	0	0	0	110	D45	D45-A47 VanDerWaalsContact C-N 3.26Å; D45-A47 PolarHBondContact O-N 2.94Å
48	G	26.1	Very low	29.2	Very low	69 Å²	69	153.7 Å²	153.7	71%	0.711	77%	0.772	S	S	*	*	S	Bend	trans	118.8	130.4	163.9	0	0	0	0	0	113.8
49	N	27.7	Very low	29	Very low	138 Å²	138	156.5 Å²	156.5	74%	0.738	78%	0.777	S	S	*	*			trans	73.3	87.7	166.7	-55.5	-23.8	0	0	0	115.7	F51	N49-F51 HydrophobicContact CB-CD2 4.38Å; N49-F51 HydrophobicContact CB-CE2 4.14Å; N49-F51 WeakPolarHBondContact O-CD2 3.41Å; N49-F51 PolarHBondContact O-N 2.93Å
50	Y	24.7	Very low	28.7	Very low	239 Å²	239	152.7 Å²	152.7	94%	0.937	76%	0.762	S	S	*	*			trans	-49	100.6	153.8	-93	-98.6	0	0	0	109.4	H52	Y50-H52 PolarHBondContact O-N 2.92Å
51	F	27	Very low	28.2	Very low	176 Å²	176	155.3 Å²	155.3	77%	0.772	76%	0.759	S	S	*	*			trans	-78.8	118.5	168.5	-87.4	-88	0	0	0	108.5	N49 H53	N49-F51 HydrophobicContact CB-CD2 4.38Å; N49-F51 HydrophobicContact CB-CE2 4.14Å; N49-F51 WeakPolarHBondContact O-CD2 3.41Å; N49-F51 PolarHBondContact O-N 2.93Å; F51-H53 PolarHBondContact O-N 3.03Å; F51-H53 VanDerWaalsContact O-N 3.08Å
52	H	25.8	Very low	28.1	Very low	171 Å²	171	154.8 Å²	154.8	79%	0.792	75%	0.754	S	S	*	*			trans	-45.6	114.6	165.6	-81.2	-88.8	0	0	0	109.8	Y50 R54	Y50-H52 PolarHBondContact O-N 2.92Å; H52-R54 PolarHBondContact O-N 2.88Å
53	H	26.9	Very low	28	Very low	184 Å²	184	152.6 Å²	152.6	85%	0.852	76%	0.758	S	S	*	*			trans	-64.9	89.1	161.9	-74.9	-69.8	0	0	0	107.6	F51 W55	F51-H53 PolarHBondContact O-N 3.03Å; F51-H53 VanDerWaalsContact O-N 3.08Å; H53-W55 PolarHBondContact O-N 2.94Å; H53-W55 VanDerWaalsContact O-N 3.12Å
54	R	26.9	Very low	27.8	Very low	209 Å²	209	157 Å²	157	79%	0.789	76%	0.76	S	S	*	*			trans	-58.4	115.2	162.9	-85.1	-176.2	-177.8	179	1.9	106.3	H52 H56	H52-R54 PolarHBondContact O-N 2.88Å; R54-H56 PolarHBondContact O-N 2.93Å
55	W	28.2	Very low	27.8	Very low	214 Å²	214	153.1 Å²	153.1	81%	0.811	75%	0.753	S	S	*	*			trans	-38.8	107.9	158	-120.2	70	0	0	0	108.8	H53 P57	H53-W55 PolarHBondContact O-N 2.94Å; H53-W55 VanDerWaalsContact O-N 3.12Å; W55-P57 WeakPolarHBondContact O-CD 3.37Å
56	H	26	Very low	27.9	Very low	129 Å²	129	148.3 Å²	148.3	60%	0.597	74%	0.735	S	S	*	*			trans	-87	115.2	177.6	-103.2	-82.7	0	0	0	108.2	R54 N58	R54-H56 PolarHBondContact O-N 2.93Å; H56-N58 PolarHBondContact O-N 3.38Å
57	P	31.5	Very low	28	Very low	90 Å²	90	145.8 Å²	145.8	58%	0.584	73%	0.729	S	S	*	*	G	3₁₀ helix	trans	-75.1	19.2	-176.7	31.8	-34.9	0	0	0	113.7	W55 Y59	W55-P57 WeakPolarHBondContact O-CD 3.37Å; P57-Y59 VanDerWaalsContact C-N 3.33Å; P57-Y59 PolarHBondContact O-N 3.3Å
58	N	28.6	Very low	28.5	Very low	98 Å²	98	150.8 Å²	150.8	52%	0.524	73%	0.733	S	S	.	*	G	3₁₀ helix	trans	-82.9	-3.8	-170.6	-76.6	-12.4	0	0	0	114.6	H56 L60	H56-N58 PolarHBondContact O-N 3.38Å; N58-L60 PolarHBondContact O-N 3.43Å
59	Y	29.1	Very low	29.2	Very low	224 Å²	224	150.1 Å²	150.1	88%	0.878	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-75.2	2.9	170.8	-65.2	-78.4	0	0	0	113.8	P57	P57-Y59 VanDerWaalsContact C-N 3.33Å; P57-Y59 PolarHBondContact O-N 3.3Å
60	L	29	Very low	30.2	Very low	109 Å²	109	153.7 Å²	153.7	57%	0.571	73%	0.725	S	S	*	*	G	3₁₀ helix	trans	-119.9	20.7	178.2	-69.2	169	0	0	0	113.2	N58 P62 L327	N58-L60 PolarHBondContact O-N 3.43Å; L60-P62 VanDerWaalsContact O-CD 3.3Å; L60-P62 WeakPolarHBondContact O-CD 3.4Å; L60-L327 HydrophobicContact CD1-CD2 3.59Å; L60-L327 HydrophobicContact CD2-CD1 3.46Å; L60-L327 VanDerWaalsContact CD2-CD1 3.46Å; L60-L327 HydrophobicContact CD2-CD2 3.6Å; L60-L327 HydrophobicContact CD2-CG 4.15Å; L60-L327 HydrophobicContact CG-CD2 4.24Å
61	Q	25.6	Very low	31.4	Very low	144 Å²	144	147.5 Å²	147.5	67%	0.673	71%	0.709	S	S	*	*			trans	-65.8	121.5	166.8	-83.7	-170.9	0.2	0	0	108.7	L63	Q61-L63 PolarHBondContact O-N 3.48Å
62	P	27.7	Very low	32.7	Very low	85 Å²	85	149.9 Å²	149.9	55%	0.552	71%	0.712	S	S	*	*			trans	-60.6	112.7	173	24.5	-30.2	0	0	0	107.4	L60 Y64 V65	L60-P62 VanDerWaalsContact O-CD 3.3Å; L60-P62 WeakPolarHBondContact O-CD 3.4Å; P62-Y64 PolarHBondContact O-N 2.85Å; P62-V65 HydrophobicContact CG-CG2 3.9Å
63	L	28.5	Very low	33.9	Very low	178 Å²	178	145.2 Å²	145.2	93%	0.932	70%	0.703	S	S	*	*	S	Bend	trans	-46.7	107.9	164.8	-86.5	138.8	0	0	0	107.1	Q61	Q61-L63 PolarHBondContact O-N 3.48Å
64	Y	27.2	Very low	35.2	Very low	213 Å²	213	139.7 Å²	139.7	84%	0.835	68%	0.682	S	S	*	*			trans	70.2	92.7	179.2	-108.6	-99.1	0	0	0	117.7	P62 A66	P62-Y64 PolarHBondContact O-N 2.85Å; Y64-A66 PolarHBondContact O-N 2.9Å
65	V	29.5	Very low	36.1	Very low	120 Å²	120	131.9 Å²	131.9	73%	0.727	66%	0.66	S	S	*	*			trans	-85.6	96.9	150.8	-176.5	0	0	0	0	107.4	P62	P62-V65 HydrophobicContact CG-CG2 3.9Å
66	A	30.7	Very low	37.4	Very low	60 Å²	60	125.5 Å²	125.5	50%	0.496	64%	0.644	S	S	.	*	P	Polyproline II helix	trans	-53.5	137.8	173.7	0	0	0	0	0	110.2	Y64 K68	Y64-A66 PolarHBondContact O-N 2.9Å; A66-K68 PolarHBondContact O-N 3.3Å
67	P	34.5	Very low	39.3	Very low	117 Å²	117	123.3 Å²	123.3	76%	0.76	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-57.4	127.5	179.6	21.8	-31.1	0	0	0	109.5	P69	P67-P69 WeakPolarHBondContact O-CD 3.47Å; P67-P69 VanDerWaalsContact O-N 3.13Å
68	K	37.5	Very low	40.6	Very low	200 Å²	200	124 Å²	124	87%	0.87	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-55	121.1	174.9	-84	-180	178.4	173.4	0	108.1	A66 K70	A66-K68 PolarHBondContact O-N 3.3Å; K68-K70 PolarHBondContact O-N 2.87Å
69	P	39.9	Very low	42	Very low	54 Å²	54	123.8 Å²	123.8	35%	0.351	64%	0.641	S	S	.	*	P	Polyproline II helix	trans	-63.1	132.7	177.7	24.6	-31.6	0	0	0	108.9	P67 N71 V74	P67-P69 WeakPolarHBondContact O-CD 3.47Å; P67-P69 VanDerWaalsContact O-N 3.13Å; P69-N71 PolarHBondContact O-N 3.28Å; P69-V74 HydrophobicContact CB-CB 4.13Å; P69-V74 HydrophobicContact CB-CG1 3.96Å; P69-V74 HydrophobicContact CG-CB 4.42Å; P69-V74 HydrophobicContact CG-CG1 4.28Å
70	K	50	Low	43.8	Very low	213 Å²	213	117.3 Å²	117.3	93%	0.926	62%	0.621	S	S	*	*	S	Bend	trans	-56.6	-23.8	-178.6	-80.1	-179.4	176.1	177.3	0	113.3	K68	K68-K70 PolarHBondContact O-N 2.87Å
71	N	49.8	Very low	45.6	Very low	110 Å²	110	116.4 Å²	116.4	59%	0.588	62%	0.619	S	S	*	*	S	Bend	trans	-96.9	117.5	177.6	-77.1	-19.5	0	0	0	111.4	P69 A73 V74 S75	P69-N71 PolarHBondContact O-N 3.28Å; N71-A73 PolarHBondContact O-N 2.9Å; N71-V74 HydrophobicContact CB-CB 4.3Å; N71-V74 HydrophobicContact CB-CG2 3.87Å; N71-V74 PolarHBondContact O-N 2.95Å; N71-S75 PolarHBondContact O-N 3.42Å
72	R	52.8	Low	47.4	Very low	225 Å²	225	116.6 Å²	116.6	85%	0.849	61%	0.614	S	S	*	*	H	α-helix	trans	-52.5	-36	174.9	-78.1	-175	177.5	-175.1	-0.1	112.7	V74 S75 V76	R72-V74 PolarHBondContact O-N 3.45Å; R72-S75 PolarHBondContact O-N 3.06Å; R72-S75 PolarHBondContact O-OG 3.37Å; R72-V76 WeakPolarHBondContact O-CG2 3.32Å; R72-V76 PolarHBondContact O-N 3.28Å; R72-V76 VanDerWaalsContact O-N 3.15Å
73	A	52	Low	49	Very low	73 Å²	73	115.6 Å²	115.6	60%	0.603	61%	0.608	S	S	*	*	H	α-helix	trans	-62.9	-42	176.9	0	0	0	0	0	112.3	N71 V76 T77	N71-A73 PolarHBondContact O-N 2.9Å; A73-V76 PolarHBondContact O-N 3.22Å; A73-T77 PolarHBondContact O-N 2.77Å; A73-T77 PolarHBondContact O-OG1 3.29Å
74	V	53.3	Low	51.1	Low	68 Å²	68	112.4 Å²	112.4	41%	0.412	59%	0.592	S	S	.	*	H	α-helix	trans	-68.9	-37.3	179.1	-179.3	0	0	0	0	110.8	P69 N71 R72 V76 T77 L78	P69-V74 HydrophobicContact CB-CB 4.13Å; P69-V74 HydrophobicContact CB-CG1 3.96Å; P69-V74 HydrophobicContact CG-CB 4.42Å; P69-V74 HydrophobicContact CG-CG1 4.28Å; N71-V74 HydrophobicContact CB-CB 4.3Å; N71-V74 HydrophobicContact CB-CG2 3.87Å; N71-V74 PolarHBondContact O-N 2.95Å; R72-V74 PolarHBondContact O-N 3.45Å; V74-V76 PolarHBondContact O-N 3Å; V74-T77 PolarHBondContact O-N 3.46Å; V74-L78 VanDerWaalsContact O-CB 3.3Å; V74-L78 WeakPolarHBondContact O-CB 3.16Å; V74-L78 PolarHBondContact O-N 2.84Å
75	S	46.1	Very low	53.1	Low	45 Å²	45	109.4 Å²	109.4	32%	0.315	58%	0.58	S	S	.	*	H	α-helix	trans	-64.8	-40.1	177.1	101.5	0	0	0	0	112	N71 R72 T79	N71-S75 PolarHBondContact O-N 3.42Å; R72-S75 PolarHBondContact O-N 3.06Å; R72-S75 PolarHBondContact O-OG 3.37Å; S75-T79 WeakPolarHBondContact O-CB 3.38Å; S75-T79 PolarHBondContact O-N 3.06Å; S75-T79 PolarHBondContact O-OG1 2.87Å
76	V	55.5	Low	54.7	Low	80 Å²	80	108.9 Å²	108.9	49%	0.485	57%	0.565	S	S	.	*	H	α-helix	trans	-68	-47.4	178.4	174.8	0	0	0	0	110.3	R72 A73 V74 L78 T79 I80	R72-V76 WeakPolarHBondContact O-CG2 3.32Å; R72-V76 PolarHBondContact O-N 3.28Å; R72-V76 VanDerWaalsContact O-N 3.15Å; A73-V76 PolarHBondContact O-N 3.22Å; V74-V76 PolarHBondContact O-N 3Å; V76-L78 VanDerWaalsContact C-N 3.34Å; V76-L78 PolarHBondContact O-N 3.21Å; V76-T79 PolarHBondContact O-N 2.89Å; V76-I80 HydrophobicContact CG1-CD1 3.74Å; V76-I80 HydrophobicContact CG1-CG1 4.41Å; V76-I80 WeakPolarHBondContact O-CG1 3.29Å; V76-I80 PolarHBondContact O-N 3.44Å
77	T	65.9	Low	56.3	Low	84 Å²	84	108.8 Å²	108.8	52%	0.515	57%	0.565	S	S	.	*	H	α-helix	trans	-60.3	-42.6	177.6	-52.5	0	0	0	0	111.9	A73 V74 T79 I80 V81	A73-T77 PolarHBondContact O-N 2.77Å; A73-T77 PolarHBondContact O-OG1 3.29Å; V74-T77 PolarHBondContact O-N 3.46Å; T77-T79 VanDerWaalsContact C-N 3.31Å; T77-T79 PolarHBondContact O-N 2.77Å; T77-I80 PolarHBondContact O-N 2.83Å; T77-V81 HydrophobicContact CG2-CG2 4.33Å; T77-V81 WeakPolarHBondContact O-CB 3.21Å; T77-V81 VanDerWaalsContact O-CG2 3.26Å; T77-V81 WeakPolarHBondContact O-CG2 3.47Å; T77-V81 PolarHBondContact O-N 2.87Å
78	L	60	Low	58.2	Low	105 Å²	105	106.1 Å²	106.1	55%	0.55	55%	0.549	S	S	.	.	H	α-helix	trans	-67.3	-33.7	179.1	-139.9	136	0	0	0	112	V74 V76 R82	V74-L78 VanDerWaalsContact O-CB 3.3Å; V74-L78 WeakPolarHBondContact O-CB 3.16Å; V74-L78 PolarHBondContact O-N 2.84Å; V76-L78 VanDerWaalsContact C-N 3.34Å; V76-L78 PolarHBondContact O-N 3.21Å; L78-R82 WeakPolarHBondContact O-CB 3.22Å; L78-R82 PolarHBondContact O-N 2.93Å
79	T	57.6	Low	59.7	Low	93 Å²	93	99.1 Å²	99.1	57%	0.571	52%	0.52	S	S	*	.	H	α-helix	trans	-69.3	-43.1	174.6	-50.4	0	0	0	0	111.1	S75 V76 T77 R82 S83	S75-T79 WeakPolarHBondContact O-CB 3.38Å; S75-T79 PolarHBondContact O-N 3.06Å; S75-T79 PolarHBondContact O-OG1 2.87Å; V76-T79 PolarHBondContact O-N 2.89Å; T77-T79 VanDerWaalsContact C-N 3.31Å; T77-T79 PolarHBondContact O-N 2.77Å; T79-R82 PolarHBondContact O-N 3.47Å; T79-S83 WeakPolarHBondContact O-CB 3.25Å; T79-S83 PolarHBondContact O-N 3.43Å; T79-S83 PolarHBondContact O-OG 2.89Å
80	I	66.9	Low	60.9	Low	88 Å²	88	98.1 Å²	98.1	45%	0.451	51%	0.514	S	S	.	.	H	α-helix	trans	-63.9	-48.5	176.5	-66.8	167.3	0	0	0	110.3	V76 T77 R82 S83 L84	V76-I80 HydrophobicContact CG1-CD1 3.74Å; V76-I80 HydrophobicContact CG1-CG1 4.41Å; V76-I80 WeakPolarHBondContact O-CG1 3.29Å; V76-I80 PolarHBondContact O-N 3.44Å; T77-I80 PolarHBondContact O-N 2.83Å; I80-R82 VanDerWaalsContact C-N 3.35Å; I80-R82 PolarHBondContact O-N 3.35Å; I80-S83 WeakPolarHBondContact CA-OG 3.3Å; I80-S83 PolarHBondContact O-N 3.18Å; I80-S83 VanDerWaalsContact O-N 3.16Å; I80-S83 PolarHBondContact O-OG 2.8Å; I80-L84 HydrophobicContact CG2-CD1 3.81Å; I80-L84 HydrophobicContact CG2-CG 4.34Å; I80-L84 WeakPolarHBondContact O-CB 3.31Å; I80-L84 WeakPolarHBondContact O-CG 3.47Å; I80-L84 PolarHBondContact O-N 3.21Å
81	V	67.6	Low	61.9	Low	89 Å²	89	93 Å²	93	54%	0.539	50%	0.497	S	S	.	.	H	α-helix	trans	-60.6	-43.4	177.4	172.4	0	0	0	0	111.2	T77 S83 L84 Y85	T77-V81 HydrophobicContact CG2-CG2 4.33Å; T77-V81 WeakPolarHBondContact O-CB 3.21Å; T77-V81 VanDerWaalsContact O-CG2 3.26Å; T77-V81 WeakPolarHBondContact O-CG2 3.47Å; T77-V81 PolarHBondContact O-N 2.87Å; V81-S83 VanDerWaalsContact C-N 3.32Å; V81-S83 PolarHBondContact O-N 3.17Å; V81-L84 PolarHBondContact O-N 2.79Å; V81-Y85 VanDerWaalsContact O-CB 3.31Å; V81-Y85 WeakPolarHBondContact O-CB 3.32Å; V81-Y85 PolarHBondContact O-N 2.91Å
82	R	63.1	Low	63.1	Low	149 Å²	149	91.6 Å²	91.6	56%	0.562	49%	0.492	S	S	*	.	H	α-helix	trans	-66	-35.5	176.8	-164.7	174	-171.5	164.5	2.2	112.1	L78 T79 I80 R86	L78-R82 WeakPolarHBondContact O-CB 3.22Å; L78-R82 PolarHBondContact O-N 2.93Å; T79-R82 PolarHBondContact O-N 3.47Å; I80-R82 VanDerWaalsContact C-N 3.35Å; I80-R82 PolarHBondContact O-N 3.35Å; R82-R86 WeakPolarHBondContact O-CB 3.49Å; R82-R86 WeakPolarHBondContact O-CG 3.4Å; R82-R86 PolarHBondContact O-N 2.84Å
83	S	61.7	Low	64	Low	63 Å²	63	82.5 Å²	82.5	44%	0.441	46%	0.46	S	S	.	.	H	α-helix	trans	-69.3	-41.5	175	76.2	0	0	0	0	112.2	T79 I80 V81 R86 A87	T79-S83 WeakPolarHBondContact O-CB 3.25Å; T79-S83 PolarHBondContact O-N 3.43Å; T79-S83 PolarHBondContact O-OG 2.89Å; I80-S83 WeakPolarHBondContact CA-OG 3.3Å; I80-S83 PolarHBondContact O-N 3.18Å; I80-S83 VanDerWaalsContact O-N 3.16Å; I80-S83 PolarHBondContact O-OG 2.8Å; V81-S83 VanDerWaalsContact C-N 3.32Å; V81-S83 PolarHBondContact O-N 3.17Å; S83-R86 PolarHBondContact O-N 2.81Å; S83-A87 WeakPolarHBondContact O-CB 3.29Å; S83-A87 PolarHBondContact O-N 2.84Å
84	L	71.4	Confident	64.9	Low	112 Å²	112	84.5 Å²	84.5	59%	0.586	46%	0.459	S	S	*	.	H	α-helix	trans	-65.6	-41.8	175.9	-74.9	168.4	0	0	0	111.2	I80 V81 A87 S88	I80-L84 HydrophobicContact CG2-CD1 3.81Å; I80-L84 HydrophobicContact CG2-CG 4.34Å; I80-L84 WeakPolarHBondContact O-CB 3.31Å; I80-L84 WeakPolarHBondContact O-CG 3.47Å; I80-L84 PolarHBondContact O-N 3.21Å; V81-L84 PolarHBondContact O-N 2.79Å; L84-A87 PolarHBondContact O-N 3.1Å; L84-S88 WeakPolarHBondContact O-CB 3.34Å; L84-S88 PolarHBondContact O-N 2.88Å; L84-S88 PolarHBondContact O-OG 2.89Å
85	Y	68.8	Low	66	Low	149 Å²	149	86 Å²	86	58%	0.584	46%	0.464	S	S	*	.	H	α-helix	trans	-63.7	-42.5	174.7	-179.8	-97.1	0	0	0	112	V81 S88 L89	V81-Y85 VanDerWaalsContact O-CB 3.31Å; V81-Y85 WeakPolarHBondContact O-CB 3.32Å; V81-Y85 PolarHBondContact O-N 2.91Å; Y85-S88 PolarHBondContact O-OG 2.96Å; Y85-L89 HydrophobicContact CE1-CD1 3.91Å; Y85-L89 WeakPolarHBondContact O-CB 3.26Å; Y85-L89 PolarHBondContact O-N 2.81Å
86	R	64.1	Low	67.5	Low	109 Å²	109	89 Å²	89	41%	0.411	48%	0.477	S	S	.	.	H	α-helix	trans	-64	-43.9	174.2	-79	179.3	172.4	-175.4	-4.3	111.8	R82 S83 L89 C90	R82-R86 WeakPolarHBondContact O-CB 3.49Å; R82-R86 WeakPolarHBondContact O-CG 3.4Å; R82-R86 PolarHBondContact O-N 2.84Å; S83-R86 PolarHBondContact O-N 2.81Å; R86-L89 PolarHBondContact O-N 2.78Å; R86-C90 WeakPolarHBondContact O-CB 3.19Å; R86-C90 PolarHBondContact O-N 3.12Å; R86-C90 PolarHBondContact O-SG 2.78Å; R86-C90 VanDerWaalsContact O-SG 3.37Å
87	A	65.1	Low	68.2	Low	59 Å²	59	89.1 Å²	89.1	49%	0.488	47%	0.47	S	S	.	.	H	α-helix	trans	-65.2	-41	178.7	0	0	0	0	0	112.1	S83 L84 C90 L91	S83-A87 WeakPolarHBondContact O-CB 3.29Å; S83-A87 PolarHBondContact O-N 2.84Å; L84-A87 PolarHBondContact O-N 3.1Å; A87-C90 WeakPolarHBondContact O-CB 3.34Å; A87-C90 PolarHBondContact O-N 3.26Å; A87-L91 WeakPolarHBondContact O-CB 3.49Å; A87-L91 PolarHBondContact O-N 3.07Å
88	S	72.6	Confident	68.5	Low	61 Å²	61	87.1 Å²	87.1	43%	0.427	46%	0.462	S	S	.	.	H	α-helix	trans	-67.6	-41.5	176.5	66.9	0	0	0	0	111.5	L84 Y85 L91 V92	L84-S88 WeakPolarHBondContact O-CB 3.34Å; L84-S88 PolarHBondContact O-N 2.88Å; L84-S88 PolarHBondContact O-OG 2.89Å; Y85-S88 PolarHBondContact O-OG 2.96Å; S88-L91 PolarHBondContact O-N 2.83Å; S88-V92 WeakPolarHBondContact O-CG2 3.36Å; S88-V92 PolarHBondContact O-N 2.94Å
89	L	68.8	Low	69.3	Low	52 Å²	52	85.4 Å²	85.4	27%	0.272	46%	0.458	S	S	.	.	H	α-helix	trans	-63.5	-43.2	175.7	-165.7	139.9	0	0	0	111	Y85 R86 L91 V92 L93 M316	Y85-L89 HydrophobicContact CE1-CD1 3.91Å; Y85-L89 WeakPolarHBondContact O-CB 3.26Å; Y85-L89 PolarHBondContact O-N 2.81Å; R86-L89 PolarHBondContact O-N 2.78Å; L89-L91 VanDerWaalsContact C-N 3.35Å; L89-L91 PolarHBondContact O-N 3.15Å; L89-V92 PolarHBondContact O-N 3.26Å; L89-L93 HydrophobicContact CD2-CD1 3.49Å; L89-L93 VanDerWaalsContact CD2-CD1 3.49Å; L89-L93 HydrophobicContact CD2-CG 4.47Å; L89-L93 HydrophobicContact CG-CD1 4.31Å; L89-L93 WeakPolarHBondContact O-CB 3.21Å; L89-L93 VanDerWaalsContact O-CD1 3.28Å; L89-L93 WeakPolarHBondContact O-CD1 3.49Å; L89-L93 WeakPolarHBondContact O-CG 3.42Å; L89-L93 PolarHBondContact O-N 3.27Å; L89-M316 HydrophobicContact CD2-SD 4.42Å
90	C	65.4	Low	70.1	Confident	33 Å²	33	84.8 Å²	84.8	22%	0.223	45%	0.448	C	S	.	.	H	α-helix	trans	-54.5	-49.2	169.4	-80.3	0	0	0	0	112.4	R86 A87 V92 L93 I94 L320	R86-C90 WeakPolarHBondContact O-CB 3.19Å; R86-C90 PolarHBondContact O-N 3.12Å; R86-C90 PolarHBondContact O-SG 2.78Å; R86-C90 VanDerWaalsContact O-SG 3.37Å; A87-C90 WeakPolarHBondContact O-CB 3.34Å; A87-C90 PolarHBondContact O-N 3.26Å; C90-V92 PolarHBondContact O-N 2.86Å; C90-L93 PolarHBondContact O-N 3.1Å; C90-I94 WeakPolarHBondContact O-CB 3.3Å; C90-I94 VanDerWaalsContact O-CG1 3.24Å; C90-I94 WeakPolarHBondContact O-CG1 3.21Å; C90-I94 PolarHBondContact O-N 2.96Å; C90-L320 WeakPolarHBondContact SG-CD2 3.42Å
91	L	71.9	Confident	70.1	Confident	106 Å²	106	83.1 Å²	83.1	56%	0.555	44%	0.442	S	S	*	.	H	α-helix	trans	-64.2	-43.1	-176	-166.3	151.8	0	0	0	110.8	A87 S88 L89 L93 I94 L95	A87-L91 WeakPolarHBondContact O-CB 3.49Å; A87-L91 PolarHBondContact O-N 3.07Å; S88-L91 PolarHBondContact O-N 2.83Å; L89-L91 VanDerWaalsContact C-N 3.35Å; L89-L91 PolarHBondContact O-N 3.15Å; L91-L93 VanDerWaalsContact C-N 3.31Å; L91-L93 PolarHBondContact O-N 2.76Å; L91-I94 PolarHBondContact O-N 2.81Å; L91-L95 HydrophobicContact CD2-CD1 3.54Å; L91-L95 HydrophobicContact CD2-CG 4.14Å; L91-L95 WeakPolarHBondContact O-CB 3.37Å; L91-L95 VanDerWaalsContact O-CG 3.31Å; L91-L95 WeakPolarHBondContact O-CG 3.38Å; L91-L95 PolarHBondContact O-N 3.35Å
92	V	74.9	Confident	70.5	Confident	80 Å²	80	84.9 Å²	84.9	49%	0.485	45%	0.448	S	S	.	.	H	α-helix	trans	-59.4	-42.1	174.2	170.8	0	0	0	0	111.2	S88 L89 C90 L95 L96	S88-V92 WeakPolarHBondContact O-CG2 3.36Å; S88-V92 PolarHBondContact O-N 2.94Å; L89-V92 PolarHBondContact O-N 3.26Å; C90-V92 PolarHBondContact O-N 2.86Å; V92-L95 PolarHBondContact O-N 3.05Å; V92-L96 HydrophobicContact CG1-CD1 4.04Å; V92-L96 HydrophobicContact CG1-CG 4.48Å; V92-L96 WeakPolarHBondContact O-CB 3.32Å; V92-L96 VanDerWaalsContact O-CG 3.31Å; V92-L96 WeakPolarHBondContact O-CG 3.16Å; V92-L96 PolarHBondContact O-N 2.97Å
93	L	70.8	Confident	71	Confident	34 Å²	34	83.6 Å²	83.6	18%	0.178	45%	0.451	C	S	.	.	H	α-helix	trans	-72.3	-38	-179.9	-69.1	163.4	0	0	0	113.5	L89 C90 L91 L95 L96 F97 L312 M316	L89-L93 HydrophobicContact CD2-CD1 3.49Å; L89-L93 VanDerWaalsContact CD2-CD1 3.49Å; L89-L93 HydrophobicContact CD2-CG 4.47Å; L89-L93 HydrophobicContact CG-CD1 4.31Å; L89-L93 WeakPolarHBondContact O-CB 3.21Å; L89-L93 VanDerWaalsContact O-CD1 3.28Å; L89-L93 WeakPolarHBondContact O-CD1 3.49Å; L89-L93 WeakPolarHBondContact O-CG 3.42Å; L89-L93 PolarHBondContact O-N 3.27Å; C90-L93 PolarHBondContact O-N 3.1Å; L91-L93 VanDerWaalsContact C-N 3.31Å; L91-L93 PolarHBondContact O-N 2.76Å; L93-L95 VanDerWaalsContact C-N 3.29Å; L93-L96 HydrophobicContact CD2-CD1 4.42Å; L93-L96 PolarHBondContact O-N 3.03Å; L93-F97 VanDerWaalsContact O-CB 3.29Å; L93-F97 WeakPolarHBondContact O-CB 3.46Å; L93-F97 PolarHBondContact O-N 3.21Å; L93-L312 HydrophobicContact CD2-CD2 4.12Å; L93-M316 HydrophobicContact CD1-CE 3.33Å; L93-M316 HydrophobicContact CD1-CG 3.8Å; L93-M316 HydrophobicContact CD1-SD 3.11Å; L93-M316 WeakPolarHBondContact CD1-SD 3.43Å; L93-M316 HydrophobicContact CD2-CE 3.44Å; L93-M316 VanDerWaalsContact CD2-CE 3.44Å; L93-M316 HydrophobicContact CD2-SD 4.35Å; L93-M316 HydrophobicContact CG-CE 3.99Å; L93-M316 HydrophobicContact CG-SD 4.31Å
94	I	71.6	Confident	71.1	Confident	116 Å²	116	82 Å²	82	60%	0.595	44%	0.442	S	S	*	.	H	α-helix	trans	-62.6	-42.1	173	-69.4	164.9	0	0	0	109.4	C90 L91 F97 A98	C90-I94 WeakPolarHBondContact O-CB 3.3Å; C90-I94 VanDerWaalsContact O-CG1 3.24Å; C90-I94 WeakPolarHBondContact O-CG1 3.21Å; C90-I94 PolarHBondContact O-N 2.96Å; L91-I94 PolarHBondContact O-N 2.81Å; I94-F97 PolarHBondContact O-N 3.47Å; I94-A98 VanDerWaalsContact O-CB 3.32Å; I94-A98 WeakPolarHBondContact O-CB 3.5Å; I94-A98 PolarHBondContact O-N 3.48Å
95	L	77.2	Confident	71	Confident	99 Å²	99	80.3 Å²	80.3	52%	0.518	44%	0.439	S	S	.	.	H	α-helix	trans	-63.9	-44.2	174.3	-74.3	174.9	0	0	0	112	L91 V92 L93 F97 A98 C99	L91-L95 HydrophobicContact CD2-CD1 3.54Å; L91-L95 HydrophobicContact CD2-CG 4.14Å; L91-L95 WeakPolarHBondContact O-CB 3.37Å; L91-L95 VanDerWaalsContact O-CG 3.31Å; L91-L95 WeakPolarHBondContact O-CG 3.38Å; L91-L95 PolarHBondContact O-N 3.35Å; V92-L95 PolarHBondContact O-N 3.05Å; L93-L95 VanDerWaalsContact C-N 3.29Å; L95-F97 VanDerWaalsContact C-N 3.33Å; L95-F97 PolarHBondContact O-N 3.23Å; L95-A98 PolarHBondContact O-N 2.92Å; L95-C99 WeakPolarHBondContact O-CB 3.12Å; L95-C99 PolarHBondContact O-N 2.64Å; L95-C99 PolarHBondContact O-SG 3.02Å; L95-C99 VanDerWaalsContact O-SG 3.39Å
96	L	76.2	Confident	71	Confident	109 Å²	109	76.5 Å²	76.5	57%	0.571	43%	0.432	S	S	*	.	H	α-helix	trans	-61.8	-41.6	175.6	-76.6	170.8	0	0	0	111.6	V92 L93 C99 F100	V92-L96 HydrophobicContact CG1-CD1 4.04Å; V92-L96 HydrophobicContact CG1-CG 4.48Å; V92-L96 WeakPolarHBondContact O-CB 3.32Å; V92-L96 VanDerWaalsContact O-CG 3.31Å; V92-L96 WeakPolarHBondContact O-CG 3.16Å; V92-L96 PolarHBondContact O-N 2.97Å; L93-L96 HydrophobicContact CD2-CD1 4.42Å; L93-L96 PolarHBondContact O-N 3.03Å; L96-C99 PolarHBondContact O-N 2.8Å; L96-F100 VanDerWaalsContact O-CB 3.28Å; L96-F100 WeakPolarHBondContact O-CB 3.25Å; L96-F100 PolarHBondContact O-N 3.09Å
97	F	70.7	Confident	71.1	Confident	81 Å²	81	74.4 Å²	74.4	36%	0.355	43%	0.431	S	S	.	.	H	α-helix	trans	-65	-43.5	175.4	-176.6	-100.8	0	0	0	111.5	L93 I94 L95 F100 T101 W306 I313	L93-F97 VanDerWaalsContact O-CB 3.29Å; L93-F97 WeakPolarHBondContact O-CB 3.46Å; L93-F97 PolarHBondContact O-N 3.21Å; I94-F97 PolarHBondContact O-N 3.47Å; L95-F97 VanDerWaalsContact C-N 3.33Å; L95-F97 PolarHBondContact O-N 3.23Å; F97-F100 PolarHBondContact O-N 3Å; F97-T101 WeakPolarHBondContact O-CB 3.13Å; F97-T101 PolarHBondContact O-N 2.87Å; F97-T101 PolarHBondContact O-OG1 2.84Å; F97-W306 AromaticContact CE2-CH2 3.45Å; F97-W306 HydrophobicContact CE2-CH2 3.45Å; F97-W306 VanDerWaalsContact CE2-CH2 3.45Å; F97-W306 AromaticContact CE2-CZ3 3.6Å; F97-W306 HydrophobicContact CE2-CZ3 3.6Å; F97-W306 AromaticContact CZ-CH2 3.47Å; F97-W306 HydrophobicContact CZ-CH2 3.47Å; F97-W306 VanDerWaalsContact CZ-CH2 3.47Å; F97-W306 HydrophobicContact CZ-CZ2 4.44Å; F97-W306 HydrophobicContact CZ-CZ3 4.12Å; F97-I313 HydrophobicContact CD2-CD1 4.28Å; F97-I313 HydrophobicContact CE2-CD1 3.64Å; F97-I313 HydrophobicContact CE2-CG1 4.45Å; F97-I313 HydrophobicContact CZ-CD1 4.08Å
98	A	71.7	Confident	70.6	Confident	42 Å²	42	78.2 Å²	78.2	35%	0.347	43%	0.433	S	S	.	.	H	α-helix	trans	-62.2	-46.7	175.4	0	0	0	0	0	111.5	I94 L95 F100 T101 L102	I94-A98 VanDerWaalsContact O-CB 3.32Å; I94-A98 WeakPolarHBondContact O-CB 3.5Å; I94-A98 PolarHBondContact O-N 3.48Å; L95-A98 PolarHBondContact O-N 2.92Å; A98-F100 VanDerWaalsContact C-N 3.33Å; A98-F100 PolarHBondContact O-N 2.99Å; A98-T101 PolarHBondContact O-N 3.41Å; A98-L102 WeakPolarHBondContact O-CB 3.24Å; A98-L102 WeakPolarHBondContact O-CG 3.45Å; A98-L102 PolarHBondContact O-N 2.8Å
99	C	77.8	Confident	70.1	Confident	69 Å²	69	83.3 Å²	83.3	47%	0.466	45%	0.448	S	S	.	.	H	α-helix	trans	-58.3	-44.5	173.7	-77.4	0	0	0	0	111.6	L95 L96 T101 L102 L103	L95-C99 WeakPolarHBondContact O-CB 3.12Å; L95-C99 PolarHBondContact O-N 2.64Å; L95-C99 PolarHBondContact O-SG 3.02Å; L95-C99 VanDerWaalsContact O-SG 3.39Å; L96-C99 PolarHBondContact O-N 2.8Å; C99-T101 VanDerWaalsContact C-N 3.33Å; C99-T101 PolarHBondContact O-N 2.86Å; C99-L102 PolarHBondContact O-N 2.83Å; C99-L103 WeakPolarHBondContact O-CB 3.49Å; C99-L103 WeakPolarHBondContact O-CD1 3.5Å; C99-L103 WeakPolarHBondContact O-CG 3.27Å; C99-L103 PolarHBondContact O-N 2.74Å
100	F	73.6	Confident	70	Confident	81 Å²	81	84.9 Å²	84.9	36%	0.355	46%	0.459	S	S	.	.	H	α-helix	trans	-62.1	-41.9	176.9	-171.5	-95.7	0	0	0	111.9	L96 F97 A98 L103 A104 C305 W306	L96-F100 VanDerWaalsContact O-CB 3.28Å; L96-F100 WeakPolarHBondContact O-CB 3.25Å; L96-F100 PolarHBondContact O-N 3.09Å; F97-F100 PolarHBondContact O-N 3Å; A98-F100 VanDerWaalsContact C-N 3.33Å; A98-F100 PolarHBondContact O-N 2.99Å; F100-L103 PolarHBondContact O-N 2.97Å; F100-A104 VanDerWaalsContact O-CB 3.25Å; F100-A104 WeakPolarHBondContact O-CB 3.28Å; F100-A104 PolarHBondContact O-N 2.82Å; F100-C305 HydrophobicContact CE1-CB 4.45Å; F100-C305 HydrophobicContact CZ-CB 3.8Å; F100-W306 HydrophobicContact CD1-CZ3 4.31Å; F100-W306 HydrophobicContact CE1-CE3 4.25Å; F100-W306 HydrophobicContact CE1-CZ3 4.32Å
101	T	68.1	Low	69.6	Low	52 Å²	52	87.4 Å²	87.4	32%	0.319	47%	0.467	S	S	.	.	H	α-helix	trans	-67.5	-42.7	178.5	-43	0	0	0	0	110.9	F97 A98 C99 L103 A104 C105	F97-T101 WeakPolarHBondContact O-CB 3.13Å; F97-T101 PolarHBondContact O-N 2.87Å; F97-T101 PolarHBondContact O-OG1 2.84Å; A98-T101 PolarHBondContact O-N 3.41Å; C99-T101 VanDerWaalsContact C-N 3.33Å; C99-T101 PolarHBondContact O-N 2.86Å; T101-L103 VanDerWaalsContact C-N 3.33Å; T101-L103 PolarHBondContact O-N 3.49Å; T101-A104 PolarHBondContact O-N 2.77Å; T101-C105 PolarHBondContact O-N 3.08Å; T101-C105 PolarHBondContact O-SG 2.81Å
102	L	74.3	Confident	68.7	Low	127 Å²	127	89.1 Å²	89.1	67%	0.665	47%	0.467	S	S	*	.	H	α-helix	trans	-64.3	-35.1	175.4	-74.6	172.2	0	0	0	112.6	A98 C99 P106	A98-L102 WeakPolarHBondContact O-CB 3.24Å; A98-L102 WeakPolarHBondContact O-CG 3.45Å; A98-L102 PolarHBondContact O-N 2.8Å; C99-L102 PolarHBondContact O-N 2.83Å; L102-P106 WeakPolarHBondContact O-CD 3.42Å
103	L	75.6	Confident	68	Low	121 Å²	121	87.7 Å²	87.7	63%	0.634	46%	0.464	S	S	*	.	H	α-helix	trans	-73.6	-34.5	172.4	-80.1	159.6	0	0	0	112.3	C99 F100 T101 P106 V107	C99-L103 WeakPolarHBondContact O-CB 3.49Å; C99-L103 WeakPolarHBondContact O-CD1 3.5Å; C99-L103 WeakPolarHBondContact O-CG 3.27Å; C99-L103 PolarHBondContact O-N 2.74Å; F100-L103 PolarHBondContact O-N 2.97Å; T101-L103 VanDerWaalsContact C-N 3.33Å; T101-L103 PolarHBondContact O-N 3.49Å; L103-P106 VanDerWaalsContact O-CD 3.25Å; L103-P106 WeakPolarHBondContact O-CD 3.4Å; L103-P106 VanDerWaalsContact O-CG 3.3Å; L103-P106 WeakPolarHBondContact O-CG 3.28Å; L103-V107 WeakPolarHBondContact O-CG2 3.37Å
104	A	63.4	Low	67.5	Low	31 Å²	31	89.6 Å²	89.6	26%	0.256	47%	0.473	S	S	.	.	H	α-helix	trans	-72.5	-29.4	178.4	0	0	0	0	0	112.9	F100 T101 V107 R108	F100-A104 VanDerWaalsContact O-CB 3.25Å; F100-A104 WeakPolarHBondContact O-CB 3.28Å; F100-A104 PolarHBondContact O-N 2.82Å; T101-A104 PolarHBondContact O-N 2.77Å; A104-V107 PolarHBondContact O-N 2.71Å; A104-R108 VanDerWaalsContact O-CB 3.31Å; A104-R108 WeakPolarHBondContact O-CB 3.48Å; A104-R108 PolarHBondContact O-N 3.42Å
105	C	67.6	Low	66.3	Low	75 Å²	75	90.2 Å²	90.2	51%	0.507	47%	0.468	S	S	.	.	H	α-helix	trans	-56.3	-55.7	176.3	-78.1	0	0	0	0	114.2	T101 V107 R108 F109	T101-C105 PolarHBondContact O-N 3.08Å; T101-C105 PolarHBondContact O-SG 2.81Å; C105-V107 VanDerWaalsContact C-N 3.33Å; C105-V107 PolarHBondContact O-N 3.31Å; C105-R108 WeakPolarHBondContact O-CB 3.25Å; C105-R108 PolarHBondContact O-N 2.77Å; C105-F109 PolarHBondContact O-N 3.36Å
106	P	70.6	Confident	65.3	Low	69 Å²	69	92.3 Å²	92.3	45%	0.448	48%	0.475	S	S	.	.	H	α-helix	trans	-66.2	-36.5	178.6	25.8	-33.9	0	0	0	111.4	L102 L103 R108 F109 V110	L102-P106 WeakPolarHBondContact O-CD 3.42Å; L103-P106 VanDerWaalsContact O-CD 3.25Å; L103-P106 WeakPolarHBondContact O-CD 3.4Å; L103-P106 VanDerWaalsContact O-CG 3.3Å; L103-P106 WeakPolarHBondContact O-CG 3.28Å; P106-R108 VanDerWaalsContact C-N 3.33Å; P106-R108 PolarHBondContact O-N 3.22Å; P106-F109 WeakPolarHBondContact O-CB 3.42Å; P106-F109 PolarHBondContact O-N 2.74Å; P106-F109 VanDerWaalsContact O-N 3.11Å; P106-V110 WeakPolarHBondContact O-CG2 3.11Å; P106-V110 PolarHBondContact O-N 3.17Å
107	V	64.8	Low	64.4	Low	65 Å²	65	92.3 Å²	92.3	39%	0.394	48%	0.483	S	S	.	.	H	α-helix	trans	-58.9	-47.9	173.4	177	0	0	0	0	109.7	L103 A104 C105 F109 V110 F111 F302	L103-V107 WeakPolarHBondContact O-CG2 3.37Å; A104-V107 PolarHBondContact O-N 2.71Å; C105-V107 VanDerWaalsContact C-N 3.33Å; C105-V107 PolarHBondContact O-N 3.31Å; V107-F109 VanDerWaalsContact C-N 3.27Å; V107-F109 PolarHBondContact O-N 2.98Å; V107-V110 PolarHBondContact O-N 2.65Å; V107-F111 HydrophobicContact CG1-CD2 3.58Å; V107-F111 HydrophobicContact CG1-CE2 3.64Å; V107-F111 VanDerWaalsContact O-CD2 3.26Å; V107-F111 WeakPolarHBondContact O-CD2 3.3Å; V107-F111 PolarHBondContact O-N 2.79Å; V107-F302 HydrophobicContact CG1-CE1 3.67Å; V107-F302 HydrophobicContact CG1-CZ 3.81Å
108	R	55.2	Low	63.2	Low	140 Å²	140	90.3 Å²	90.3	53%	0.528	48%	0.478	S	S	.	.	H	α-helix	trans	-59.8	-37.4	175.7	-166.9	176.3	179.9	134.2	-2.3	112.2	A104 C105 P106 Y112 F302	A104-R108 VanDerWaalsContact O-CB 3.31Å; A104-R108 WeakPolarHBondContact O-CB 3.48Å; A104-R108 PolarHBondContact O-N 3.42Å; C105-R108 WeakPolarHBondContact O-CB 3.25Å; C105-R108 PolarHBondContact O-N 2.77Å; P106-R108 VanDerWaalsContact C-N 3.33Å; P106-R108 PolarHBondContact O-N 3.22Å; R108-Y112 VanDerWaalsContact O-CB 3.31Å; R108-Y112 WeakPolarHBondContact O-CB 3.42Å; R108-Y112 PolarHBondContact O-N 3.08Å; R108-F302 HydrophobicContact CB-CE2 4.11Å; R108-F302 HydrophobicContact CB-CZ 4.24Å; R108-F302 HydrophobicContact CG-CE2 4.31Å
109	F	62	Low	62.2	Low	168 Å²	168	98 Å²	98	74%	0.737	51%	0.507	S	S	*	.	H	α-helix	trans	-66.3	-44.8	176.4	-147.3	-86.9	0	0	0	111.9	C105 P106 V107 Y112 A113	C105-F109 PolarHBondContact O-N 3.36Å; P106-F109 WeakPolarHBondContact O-CB 3.42Å; P106-F109 PolarHBondContact O-N 2.74Å; P106-F109 VanDerWaalsContact O-N 3.11Å; V107-F109 VanDerWaalsContact C-N 3.27Å; V107-F109 PolarHBondContact O-N 2.98Å; F109-Y112 PolarHBondContact O-N 3.22Å; F109-A113 WeakPolarHBondContact O-CB 3.47Å; F109-A113 PolarHBondContact O-N 3.15Å
110	V	65.6	Low	60.8	Low	84 Å²	84	98.8 Å²	98.8	51%	0.509	51%	0.505	S	S	.	.	H	α-helix	trans	-62	-44.4	174.7	173.6	0	0	0	0	110.8	P106 V107 Y112 A113 L114	P106-V110 WeakPolarHBondContact O-CG2 3.11Å; P106-V110 PolarHBondContact O-N 3.17Å; V107-V110 PolarHBondContact O-N 2.65Å; V110-Y112 VanDerWaalsContact C-N 3.34Å; V110-Y112 PolarHBondContact O-N 3.12Å; V110-A113 PolarHBondContact O-N 2.81Å; V110-L114 HydrophobicContact CG1-CD1 3.9Å; V110-L114 HydrophobicContact CG1-CG 4.38Å; V110-L114 WeakPolarHBondContact O-CB 3.23Å; V110-L114 VanDerWaalsContact O-CG 3.29Å; V110-L114 WeakPolarHBondContact O-CG 3.29Å; V110-L114 PolarHBondContact O-N 3.09Å
111	F	57.1	Low	59.2	Low	87 Å²	87	98.8 Å²	98.8	38%	0.382	51%	0.513	S	S	.	.	H	α-helix	trans	-66.4	-33.9	175.9	-87.9	-89.3	0	0	0	112.6	V107 R115 F123 F302	V107-F111 HydrophobicContact CG1-CD2 3.58Å; V107-F111 HydrophobicContact CG1-CE2 3.64Å; V107-F111 VanDerWaalsContact O-CD2 3.26Å; V107-F111 WeakPolarHBondContact O-CD2 3.3Å; V107-F111 PolarHBondContact O-N 2.79Å; F111-R115 VanDerWaalsContact O-CB 3.29Å; F111-R115 WeakPolarHBondContact O-CB 3.38Å; F111-R115 PolarHBondContact O-N 2.88Å; F111-F123 HydrophobicContact CB-CE1 4.49Å; F111-F123 AromaticContact CD1-CE1 3.75Å; F111-F123 HydrophobicContact CD1-CE1 3.75Å; F111-F123 AromaticContact CD1-CZ 3.58Å; F111-F123 HydrophobicContact CD1-CZ 3.58Å; F111-F123 HydrophobicContact CE1-CZ 4.18Å; F111-F302 HydrophobicContact CD2-CE1 4Å; F111-F302 HydrophobicContact CD2-CZ 4.29Å; F111-F302 HydrophobicContact CE2-CE1 4.13Å; F111-F302 HydrophobicContact CG-CE1 4.49Å
112	Y	54.9	Low	58	Low	141 Å²	141	103 Å²	103	55%	0.553	53%	0.528	S	S	*	.	H	α-helix	trans	-68.5	-40.6	174.4	-153.5	-85.7	0	0	0	111.3	R108 F109 V110 R115 H116	R108-Y112 VanDerWaalsContact O-CB 3.31Å; R108-Y112 WeakPolarHBondContact O-CB 3.42Å; R108-Y112 PolarHBondContact O-N 3.08Å; F109-Y112 PolarHBondContact O-N 3.22Å; V110-Y112 VanDerWaalsContact C-N 3.34Å; V110-Y112 PolarHBondContact O-N 3.12Å; Y112-R115 PolarHBondContact O-N 3.43Å; Y112-H116 AromaticContact CD1-CD2 3.79Å; Y112-H116 AromaticContact CE1-CD2 3.65Å; Y112-H116 AromaticContact CE1-NE2 3.52Å; Y112-H116 PolarHBondContact O-CD2 2.02Å; Y112-H116 PolarHBondContact O-N 3.26Å
113	A	60.1	Low	56.2	Low	51 Å²	51	99 Å²	99	42%	0.421	51%	0.505	S	S	.	.	H	α-helix	trans	-64.8	-45.1	173.3	0	0	0	0	0	111.7	F109 V110 R115 H116 C117	F109-A113 WeakPolarHBondContact O-CB 3.47Å; F109-A113 PolarHBondContact O-N 3.15Å; V110-A113 PolarHBondContact O-N 2.81Å; A113-R115 VanDerWaalsContact C-N 3.32Å; A113-R115 PolarHBondContact O-N 3.25Å; A113-H116 PolarHBondContact O-N 3.25Å; A113-H116 VanDerWaalsContact O-N 3.15Å; A113-C117 PolarHBondContact O-N 2.9Å
114	L	59.4	Low	54.5	Low	73 Å²	73	97.1 Å²	97.1	38%	0.382	50%	0.495	S	S	.	.	H	α-helix	trans	-61.4	-39.1	175.3	-74.9	168.9	0	0	0	112.1	V110 H116 C117 T118 F123	V110-L114 HydrophobicContact CG1-CD1 3.9Å; V110-L114 HydrophobicContact CG1-CG 4.38Å; V110-L114 WeakPolarHBondContact O-CB 3.23Å; V110-L114 VanDerWaalsContact O-CG 3.29Å; V110-L114 WeakPolarHBondContact O-CG 3.29Å; V110-L114 PolarHBondContact O-N 3.09Å; L114-H116 VanDerWaalsContact C-N 3.27Å; L114-H116 PolarHBondContact O-N 3.3Å; L114-C117 PolarHBondContact O-N 3.08Å; L114-T118 WeakPolarHBondContact O-CB 3.42Å; L114-T118 PolarHBondContact O-N 2.82Å; L114-T118 PolarHBondContact O-OG1 2.64Å; L114-F123 HydrophobicContact CB-CE2 4.33Å; L114-F123 HydrophobicContact CB-CZ 4.09Å
115	R	46.3	Very low	53.2	Low	129 Å²	129	99.3 Å²	99.3	49%	0.487	51%	0.507	S	S	.	.	H	α-helix	trans	-61.6	-33.7	175.4	-177.6	174.7	-174.1	-169.3	0.2	112.9	F111 Y112 A113 F123	F111-R115 VanDerWaalsContact O-CB 3.29Å; F111-R115 WeakPolarHBondContact O-CB 3.38Å; F111-R115 PolarHBondContact O-N 2.88Å; Y112-R115 PolarHBondContact O-N 3.43Å; A113-R115 VanDerWaalsContact C-N 3.32Å; A113-R115 PolarHBondContact O-N 3.25Å; R115-F123 HydrophobicContact CB-CD1 3.73Å; R115-F123 HydrophobicContact CB-CE1 3.99Å; R115-F123 HydrophobicContact CB-CG 4.15Å; R115-F123 HydrophobicContact CG-CB 4.13Å; R115-F123 HydrophobicContact CG-CD1 3.94Å; R115-F123 HydrophobicContact CG-CG 4.2Å
116	H	55.8	Low	51.7	Low	143 Å²	143	99.9 Å²	99.9	66%	0.662	51%	0.508	S	S	*	.	H	α-helix	trans	-81.7	-30.2	176.7	-88.2	-74.5	0	0	0	113.1	Y112 A113 L114	Y112-H116 AromaticContact CD1-CD2 3.79Å; Y112-H116 AromaticContact CE1-CD2 3.65Å; Y112-H116 AromaticContact CE1-NE2 3.52Å; Y112-H116 PolarHBondContact O-CD2 2.02Å; Y112-H116 PolarHBondContact O-N 3.26Å; A113-H116 PolarHBondContact O-N 3.25Å; A113-H116 VanDerWaalsContact O-N 3.15Å; L114-H116 VanDerWaalsContact C-N 3.27Å; L114-H116 PolarHBondContact O-N 3.3Å
117	C	57.4	Low	50	Low	110 Å²	110	100.1 Å²	100.1	74%	0.743	50%	0.502	S	S	*	.	H	α-helix	trans	-90.7	-12.9	-178.8	-67	0	0	0	0	114.4	A113 L114	A113-C117 PolarHBondContact O-N 2.9Å; L114-C117 PolarHBondContact O-N 3.08Å
118	T	47	Very low	48.4	Very low	38 Å²	38	102 Å²	102	23%	0.233	50%	0.502	C	S	.	.			trans	-132.9	128.7	-172.5	70.4	0	0	0	0	112.6	L114 I120	L114-T118 WeakPolarHBondContact O-CB 3.42Å; L114-T118 PolarHBondContact O-N 2.82Å; L114-T118 PolarHBondContact O-OG1 2.64Å; T118-I120 HydrophobicContact CG2-CD1 3.91Å; T118-I120 PolarHBondContact O-N 2.93Å; T118-I120 VanDerWaalsContact O-N 3.14Å
119	Q	50	Low	47.2	Very low	205 Å²	205	102.7 Å²	102.7	96%	0.958	51%	0.505	S	S	*	.			trans	-79.3	29.2	168.8	-69.4	-175.5	-10.7	0	0	111.9
120	I	49	Very low	45.9	Very low	84 Å²	84	97 Å²	97	43%	0.431	48%	0.484	S	S	.	.			trans	-68.3	129.7	-175.9	-67.1	164.3	0	0	0	108.9	T118 F122 F123	T118-I120 HydrophobicContact CG2-CD1 3.91Å; T118-I120 PolarHBondContact O-N 2.93Å; T118-I120 VanDerWaalsContact O-N 3.14Å; I120-F122 HydrophobicContact CG2-CB 4.12Å; I120-F122 PolarHBondContact O-N 2.96Å; I120-F123 HydrophobicContact CB-CD2 4.33Å; I120-F123 PolarHBondContact O-N 3.47Å
121	P	39.6	Very low	44.4	Very low	82 Å²	82	98.1 Å²	98.1	53%	0.532	48%	0.483	S	S	.	.	G	3₁₀ helix	trans	-58.7	-21.8	-173.1	18.5	-31	0	0	0	114.5	F123 N124 F127	P121-F123 PolarHBondContact O-N 2.52Å; P121-N124 WeakPolarHBondContact O-CB 3.24Å; P121-N124 PolarHBondContact O-N 3.42Å; P121-F127 WeakPolarHBondContact O-CB 3.37Å
122	F	41.7	Very low	43	Very low	141 Å²	141	97.4 Å²	97.4	62%	0.618	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	-58.1	-25.5	171.6	-101.5	-87.3	0	0	0	114.2	I120 F127	I120-F122 HydrophobicContact CG2-CB 4.12Å; I120-F122 PolarHBondContact O-N 2.96Å; F122-F127 HydrophobicContact CZ-CE1 4.49Å
123	F	38	Very low	42	Very low	43 Å²	43	93.9 Å²	93.9	19%	0.189	48%	0.479	C	S	.	.	G	3₁₀ helix	trans	-94.8	0.2	177.2	-68.9	-76.4	0	0	0	113.5	F111 L114 R115 I120 P121 P125	F111-F123 HydrophobicContact CB-CE1 4.49Å; F111-F123 AromaticContact CD1-CE1 3.75Å; F111-F123 HydrophobicContact CD1-CE1 3.75Å; F111-F123 AromaticContact CD1-CZ 3.58Å; F111-F123 HydrophobicContact CD1-CZ 3.58Å; F111-F123 HydrophobicContact CE1-CZ 4.18Å; L114-F123 HydrophobicContact CB-CE2 4.33Å; L114-F123 HydrophobicContact CB-CZ 4.09Å; R115-F123 HydrophobicContact CB-CD1 3.73Å; R115-F123 HydrophobicContact CB-CE1 3.99Å; R115-F123 HydrophobicContact CB-CG 4.15Å; R115-F123 HydrophobicContact CG-CB 4.13Å; R115-F123 HydrophobicContact CG-CD1 3.94Å; R115-F123 HydrophobicContact CG-CG 4.2Å; I120-F123 HydrophobicContact CB-CD2 4.33Å; I120-F123 PolarHBondContact O-N 3.47Å; P121-F123 PolarHBondContact O-N 2.52Å; F123-P125 WeakPolarHBondContact O-CD 3.4Å
124	N	38.7	Very low	40.8	Very low	81 Å²	81	96.3 Å²	96.3	43%	0.433	49%	0.49	S	S	.	.			trans	-71.9	119.6	175.1	-158.7	-15.3	0	0	0	108.7	P121 T126 F127 R128	P121-N124 WeakPolarHBondContact O-CB 3.24Å; P121-N124 PolarHBondContact O-N 3.42Å; N124-T126 PolarHBondContact ND2-OG1 3.21Å; N124-T126 PolarHBondContact O-N 2.94Å; N124-T126 PolarHBondContact OD1-OG1 2.88Å; N124-F127 HydrophobicContact CB-CB 4.31Å; N124-F127 PolarHBondContact O-N 3.44Å; N124-R128 PolarHBondContact O-N 2.93Å
125	P	35.5	Very low	39.7	Very low	76 Å²	76	94.2 Å²	94.2	49%	0.494	48%	0.479	S	S	.	.	H	α-helix	trans	-57.1	-22.5	-178.5	20.2	-33.2	0	0	0	113.7	F123 R129	F123-P125 WeakPolarHBondContact O-CD 3.4Å; P125-R129 PolarHBondContact O-N 2.94Å
126	T	37.9	Very low	39.2	Very low	87 Å²	87	91.7 Å²	91.7	53%	0.534	47%	0.47	S	S	.	.	H	α-helix	trans	-71.2	-44.7	173.1	44.1	0	0	0	0	112.6	N124 R128 R129 T130	N124-T126 PolarHBondContact ND2-OG1 3.21Å; N124-T126 PolarHBondContact O-N 2.94Å; N124-T126 PolarHBondContact OD1-OG1 2.88Å; T126-R128 VanDerWaalsContact C-N 3.31Å; T126-R128 PolarHBondContact O-N 3.03Å; T126-R129 PolarHBondContact O-N 3.2Å; T126-T130 PolarHBondContact O-N 3.28Å; T126-T130 PolarHBondContact O-OG1 3Å; T126-T130 VanDerWaalsContact O-OG1 3.07Å
127	F	33.5	Very low	38.3	Very low	75 Å²	75	88.5 Å²	88.5	33%	0.329	46%	0.462	S	S	.	.	H	α-helix	trans	-64.3	-36.7	179.9	-164.6	-93.5	0	0	0	112.2	P121 F122 N124 T130 H131	P121-F127 WeakPolarHBondContact O-CB 3.37Å; F122-F127 HydrophobicContact CZ-CE1 4.49Å; N124-F127 HydrophobicContact CB-CB 4.31Å; N124-F127 PolarHBondContact O-N 3.44Å; F127-T130 PolarHBondContact O-OG1 3.11Å; F127-T130 VanDerWaalsContact O-OG1 3.1Å; F127-H131 AromaticContact CD2-CD2 3.68Å; F127-H131 HydrophobicContact CE1-CB 4.45Å; F127-H131 AromaticContact CE1-CD2 3.99Å; F127-H131 AromaticContact CE2-CD2 3.58Å; F127-H131 AromaticContact CE2-NE2 3.87Å; F127-H131 AromaticContact CG-CD2 3.94Å; F127-H131 AromaticContact CZ-CD2 3.74Å; F127-H131 WeakPolarHBondContact O-CB 3.3Å; F127-H131 PolarHBondContact O-CD2 3.4Å; F127-H131 PolarHBondContact O-N 3Å; F127-H131 VanDerWaalsContact O-N 3.13Å
128	R	31.5	Very low	37.4	Very low	103 Å²	103	85.8 Å²	85.8	39%	0.389	44%	0.438	S	S	.	.	H	α-helix	trans	-68.4	-36.1	178.2	-133.2	-172.1	-155.2	-178.3	8.3	113.2	N124 T126 C132 P301	N124-R128 PolarHBondContact O-N 2.93Å; T126-R128 VanDerWaalsContact C-N 3.31Å; T126-R128 PolarHBondContact O-N 3.03Å; R128-C132 HydrophobicContact CG-CB 4.25Å; R128-C132 WeakPolarHBondContact O-CB 3.19Å; R128-C132 PolarHBondContact O-N 3.43Å; R128-C132 VanDerWaalsContact O-N 3.11Å; R128-P301 VanDerWaalsContact CZ-CA 3.5Å; R128-P301 VanDerWaalsContact NH1-CA 3.33Å; R128-P301 VanDerWaalsContact NH2-CB 3.35Å; R128-P301 PolarHBondContact NH2-O 3.3Å
129	R	30.8	Very low	36.9	Very low	156 Å²	156	87 Å²	87	59%	0.589	44%	0.44	S	S	*	.	H	α-helix	trans	-70.1	-39.4	177.8	-84.5	179.9	172.2	169.5	-2.9	111.7	P125 T126 W136	P125-R129 PolarHBondContact O-N 2.94Å; T126-R129 PolarHBondContact O-N 3.2Å; R129-W136 VanDerWaalsContact C-CE3 3.43Å; R129-W136 HydrophobicContact CB-CE3 3.97Å; R129-W136 HydrophobicContact CB-CZ3 3.84Å; R129-W136 WeakPolarHBondContact O-CB 3.3Å
130	T	33.3	Very low	36.2	Very low	47 Å²	47	84.4 Å²	84.4	29%	0.288	43%	0.425	S	S	.	.	H	α-helix	trans	-77.2	-31.3	-178.4	43.6	0	0	0	0	113.9	T126 F127 W136	T126-T130 PolarHBondContact O-N 3.28Å; T126-T130 PolarHBondContact O-OG1 3Å; T126-T130 VanDerWaalsContact O-OG1 3.07Å; F127-T130 PolarHBondContact O-OG1 3.11Å; F127-T130 VanDerWaalsContact O-OG1 3.1Å; T130-W136 HydrophobicContact CG2-CD2 4.22Å; T130-W136 HydrophobicContact CG2-CE3 4.28Å; T130-W136 HydrophobicContact CG2-CH2 3.45Å; T130-W136 VanDerWaalsContact CG2-CH2 3.45Å; T130-W136 HydrophobicContact CG2-CZ2 3.39Å; T130-W136 HydrophobicContact CG2-CZ3 3.91Å
131	H	34.1	Very low	35.4	Very low	109 Å²	109	84.9 Å²	84.9	51%	0.505	43%	0.434	S	S	.	.	H	α-helix	trans	-120.8	-9.1	-167.7	-60.7	-66.1	0	0	0	115.7	F127	F127-H131 AromaticContact CD2-CD2 3.68Å; F127-H131 HydrophobicContact CE1-CB 4.45Å; F127-H131 AromaticContact CE1-CD2 3.99Å; F127-H131 AromaticContact CE2-CD2 3.58Å; F127-H131 AromaticContact CE2-NE2 3.87Å; F127-H131 AromaticContact CG-CD2 3.94Å; F127-H131 AromaticContact CZ-CD2 3.74Å; F127-H131 WeakPolarHBondContact O-CB 3.3Å; F127-H131 PolarHBondContact O-CD2 3.4Å; F127-H131 PolarHBondContact O-N 3Å; F127-H131 VanDerWaalsContact O-N 3.13Å
132	C	28.9	Very low	35	Very low	71 Å²	71	85.2 Å²	85.2	48%	0.48	44%	0.438	S	S	.	.	S	Bend	trans	-125.5	-4.2	-177.1	-56	0	0	0	0	114	R128 P134	R128-C132 HydrophobicContact CG-CB 4.25Å; R128-C132 WeakPolarHBondContact O-CB 3.19Å; R128-C132 PolarHBondContact O-N 3.43Å; R128-C132 VanDerWaalsContact O-N 3.11Å; C132-P134 WeakPolarHBondContact O-CD 3.41Å
133	D	32.6	Very low	34.5	Very low	67 Å²	67	85.1 Å²	85.1	36%	0.358	44%	0.444	S	S	.	.			trans	-99.1	108	175.3	-118.5	-31.8	0	0	0	108.4	L135 W136	D133-L135 PolarHBondContact O-N 3.07Å; D133-W136 HydrophobicContact CB-CB 4.45Å; D133-W136 VanDerWaalsContact O-CB 3.3Å; D133-W136 WeakPolarHBondContact O-CB 3.38Å; D133-W136 PolarHBondContact O-N 3.36Å
134	P	35.3	Very low	34.3	Very low	102 Å²	102	86.4 Å²	86.4	66%	0.662	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-7.5	173.9	26.5	-33.3	0	0	0	112.2	C132	C132-P134 WeakPolarHBondContact O-CD 3.41Å
135	L	37.2	Very low	34	Very low	29 Å²	29	90.4 Å²	90.4	15%	0.152	47%	0.468	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	8.6	175.2	-61	173.6	0	0	0	113.6	D133 P137 F138 F139 M260 I297	D133-L135 PolarHBondContact O-N 3.07Å; L135-P137 VanDerWaalsContact C-CD 3.4Å; L135-P137 VanDerWaalsContact C-N 3.31Å; L135-F138 HydrophobicContact CB-CD2 3.85Å; L135-F138 HydrophobicContact CD2-CD2 3.51Å; L135-F138 HydrophobicContact CD2-CE2 3.42Å; L135-F138 VanDerWaalsContact CD2-CE2 3.42Å; L135-F138 HydrophobicContact CD2-CG 4.27Å; L135-F138 HydrophobicContact CD2-CZ 4.16Å; L135-F138 HydrophobicContact CG-CD2 4.3Å; L135-F138 WeakPolarHBondContact O-CA 3.31Å; L135-F138 VanDerWaalsContact O-CB 3.25Å; L135-F138 WeakPolarHBondContact O-CB 3.32Å; L135-F138 WeakPolarHBondContact O-CD2 3.04Å; L135-F138 PolarHBondContact O-N 3.13Å; L135-F139 HydrophobicContact CB-CD2 4.23Å; L135-F139 HydrophobicContact CB-CE2 3.95Å; L135-F139 VanDerWaalsContact O-CD2 3.3Å; L135-F139 WeakPolarHBondContact O-CD2 2.99Å; L135-M260 HydrophobicContact CD2-CE 3.97Å; L135-I297 HydrophobicContact CD1-CD1 3.2Å; L135-I297 HydrophobicContact CD1-CG1 3.69Å
136	W	36.5	Very low	34	Very low	76 Å²	76	91.8 Å²	91.8	29%	0.288	47%	0.471	S	S	.	.	G	3₁₀ helix	trans	-47.5	-42.5	174.8	170.2	-108.5	0	0	0	114.9	R129 T130 D133 F138 F139 P141	R129-W136 VanDerWaalsContact C-CE3 3.43Å; R129-W136 HydrophobicContact CB-CE3 3.97Å; R129-W136 HydrophobicContact CB-CZ3 3.84Å; R129-W136 WeakPolarHBondContact O-CB 3.3Å; T130-W136 HydrophobicContact CG2-CD2 4.22Å; T130-W136 HydrophobicContact CG2-CE3 4.28Å; T130-W136 HydrophobicContact CG2-CH2 3.45Å; T130-W136 VanDerWaalsContact CG2-CH2 3.45Å; T130-W136 HydrophobicContact CG2-CZ2 3.39Å; T130-W136 HydrophobicContact CG2-CZ3 3.91Å; D133-W136 HydrophobicContact CB-CB 4.45Å; D133-W136 VanDerWaalsContact O-CB 3.3Å; D133-W136 WeakPolarHBondContact O-CB 3.38Å; D133-W136 PolarHBondContact O-N 3.36Å; W136-F138 PolarHBondContact O-N 3.1Å; W136-F138 VanDerWaalsContact O-N 3.15Å; W136-F139 CarbonylContact O-C 3.47Å; W136-F139 PolarHBondContact O-N 2.91Å; W136-P141 HydrophobicContact CH2-CG 3.88Å; W136-P141 HydrophobicContact CZ3-CG 4.08Å
137	P	35.9	Very low	33.7	Very low	77 Å²	77	92.6 Å²	92.6	50%	0.5	48%	0.477	S	S	.	.	G	3₁₀ helix	trans	-63.3	-20.8	176.7	20.8	-30.4	0	0	0	113.6	L135 F139	L135-P137 VanDerWaalsContact C-CD 3.4Å; L135-P137 VanDerWaalsContact C-N 3.31Å; P137-F139 VanDerWaalsContact C-N 3.34Å
138	F	38.2	Very low	33.5	Very low	53 Å²	53	100.8 Å²	100.8	23%	0.232	51%	0.506	C	S	.	.	G	3₁₀ helix	trans	-81	-13.1	175.8	-55.8	-94.5	0	0	0	113	L135 W136 Y246 M260	L135-F138 HydrophobicContact CB-CD2 3.85Å; L135-F138 HydrophobicContact CD2-CD2 3.51Å; L135-F138 HydrophobicContact CD2-CE2 3.42Å; L135-F138 VanDerWaalsContact CD2-CE2 3.42Å; L135-F138 HydrophobicContact CD2-CG 4.27Å; L135-F138 HydrophobicContact CD2-CZ 4.16Å; L135-F138 HydrophobicContact CG-CD2 4.3Å; L135-F138 WeakPolarHBondContact O-CA 3.31Å; L135-F138 VanDerWaalsContact O-CB 3.25Å; L135-F138 WeakPolarHBondContact O-CB 3.32Å; L135-F138 WeakPolarHBondContact O-CD2 3.04Å; L135-F138 PolarHBondContact O-N 3.13Å; W136-F138 PolarHBondContact O-N 3.1Å; W136-F138 VanDerWaalsContact O-N 3.15Å; F138-Y246 HydrophobicContact CE1-CD1 4.16Å; F138-Y246 AromaticContact CE1-CE1 3.69Å; F138-Y246 HydrophobicContact CE1-CE1 3.69Å; F138-Y246 HydrophobicContact CZ-CE1 4.1Å; F138-M260 HydrophobicContact CB-SD 4.47Å; F138-M260 HydrophobicContact CD1-CE 3.55Å; F138-M260 HydrophobicContact CD1-SD 3.76Å; F138-M260 HydrophobicContact CD2-CE 4.48Å; F138-M260 HydrophobicContact CE1-CE 3.52Å; F138-M260 HydrophobicContact CE1-SD 4.28Å; F138-M260 HydrophobicContact CE2-CE 4.44Å; F138-M260 HydrophobicContact CG-CE 4.05Å; F138-M260 HydrophobicContact CG-SD 4.22Å; F138-M260 HydrophobicContact CZ-CE 3.97Å
139	F	37.1	Very low	33.5	Very low	64 Å²	64	99.8 Å²	99.8	28%	0.281	52%	0.515	S	S	.	.	G	3₁₀ helix	trans	-127.5	38.6	-174.9	-61.6	-70.8	0	0	0	113.1	L135 W136 P137 P141 F162	L135-F139 HydrophobicContact CB-CD2 4.23Å; L135-F139 HydrophobicContact CB-CE2 3.95Å; L135-F139 VanDerWaalsContact O-CD2 3.3Å; L135-F139 WeakPolarHBondContact O-CD2 2.99Å; W136-F139 CarbonylContact O-C 3.47Å; W136-F139 PolarHBondContact O-N 2.91Å; P137-F139 VanDerWaalsContact C-N 3.34Å; F139-P141 VanDerWaalsContact O-CD 3.27Å; F139-P141 WeakPolarHBondContact O-CD 3.37Å; F139-F162 HydrophobicContact CE1-CE1 4.23Å; F139-F162 AromaticContact CE1-CZ 3.96Å; F139-F162 HydrophobicContact CE1-CZ 3.96Å; F139-F162 AromaticContact CZ-CE1 3.97Å; F139-F162 HydrophobicContact CZ-CE1 3.97Å; F139-F162 HydrophobicContact CZ-CE2 4.36Å; F139-F162 AromaticContact CZ-CZ 3.68Å; F139-F162 HydrophobicContact CZ-CZ 3.68Å
140	K	35	Very low	33.3	Very low	149 Å²	149	99.5 Å²	99.5	65%	0.648	52%	0.52	S	S	*	.			trans	-51.4	118	170.1	-114.9	-178	-177.4	176.3	0	108.7	S142	K140-S142 PolarHBondContact O-N 2.96Å
141	P	32	Very low	33.5	Very low	95 Å²	95	104.1 Å²	104.1	62%	0.617	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.8	16.3	-166.9	-17.1	30.6	0	0	0	115.9	W136 F139	W136-P141 HydrophobicContact CH2-CG 3.88Å; W136-P141 HydrophobicContact CZ3-CG 4.08Å; F139-P141 VanDerWaalsContact O-CD 3.27Å; F139-P141 WeakPolarHBondContact O-CD 3.37Å
142	S	30.8	Very low	33.5	Very low	88 Å²	88	103.7 Å²	103.7	62%	0.615	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.6	-12.1	-159.9	42.3	0	0	0	0	117.3	K140	K140-S142 PolarHBondContact O-N 2.96Å
143	D	31.5	Very low	33.5	Very low	139 Å²	139	103.3 Å²	103.3	74%	0.743	56%	0.558	S	S	*	*	S	Bend	trans	-154.3	15.2	177.3	-83.8	-48	0	0	0	116.2	H145	D143-H145 PolarHBondContact O-N 2.92Å
144	I	35.3	Very low	33.3	Very low	70 Å²	70	105.7 Å²	105.7	36%	0.359	58%	0.577	S	S	.	*			trans	-80.3	87.2	179.9	-52.3	177.1	0	0	0	109.8	L146	I144-L146 HydrophobicContact CG2-CG 4.28Å; I144-L146 PolarHBondContact O-N 3.41Å
145	H	32.3	Very low	32.9	Very low	165 Å²	165	112.9 Å²	112.9	76%	0.764	59%	0.591	S	S	*	*			trans	-69.5	84.3	161.7	-71.7	-68.7	0	0	0	109.2	D143	D143-H145 PolarHBondContact O-N 2.92Å
146	L	35	Very low	32.4	Very low	106 Å²	106	115.7 Å²	115.7	56%	0.555	61%	0.614	S	S	*	*			trans	-52.2	131.7	160.2	-78.3	158.1	0	0	0	107.2	I144 R148	I144-L146 HydrophobicContact CG2-CG 4.28Å; I144-L146 PolarHBondContact O-N 3.41Å; L146-R148 PolarHBondContact O-N 3.44Å
147	P	30.7	Very low	32	Very low	103 Å²	103	119.1 Å²	119.1	67%	0.669	64%	0.638	S	S	*	*			trans	-53.8	112.7	175.8	19.8	-29.5	0	0	0	107.6	S149	P147-S149 VanDerWaalsContact C-N 3.25Å; P147-S149 PolarHBondContact O-N 2.98Å
148	R	30.6	Very low	31.9	Very low	247 Å²	247	119.9 Å²	119.9	93%	0.932	64%	0.636	S	S	*	*			trans	-69.6	89	-178.6	-146.9	178.3	-167.7	169.8	2.2	105.5	L146 E150	L146-R148 PolarHBondContact O-N 3.44Å; R148-E150 PolarHBondContact O-N 3.34Å
149	S	29.7	Very low	31.7	Very low	83 Å²	83	123.4 Å²	123.4	58%	0.58	66%	0.658	S	S	*	*			trans	-59.2	136.6	168.8	49.2	0	0	0	0	108.1	P147	P147-S149 VanDerWaalsContact C-N 3.25Å; P147-S149 PolarHBondContact O-N 2.98Å
150	E	28.4	Very low	31.8	Very low	150 Å²	150	124.3 Å²	124.3	70%	0.701	66%	0.662	S	S	*	*			trans	-49.5	141.8	-176	-73.8	177.7	152.9	0	0	111.8	R148 S152 S153	R148-E150 PolarHBondContact O-N 3.34Å; E150-S152 PolarHBondContact O-N 3.47Å; E150-S153 PolarHBondContact O-N 2.89Å; E150-S153 PolarHBondContact O-OG 3.47Å
151	P	35.7	Very low	32	Very low	143 Å²	143	118.5 Å²	118.5	93%	0.929	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.5	-0.5	-171.1	25.3	-34.5	0	0	0	115.3
152	S	34.8	Very low	32.6	Very low	101 Å²	101	115.1 Å²	115.1	71%	0.706	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.4	-6.8	-176	50.6	0	0	0	0	114.7	E150	E150-S152 PolarHBondContact O-N 3.47Å
153	S	29.7	Very low	33.3	Very low	62 Å²	62	114.2 Å²	114.2	43%	0.434	60%	0.599	S	S	.	*	S	Bend	trans	-88.9	134	178.2	58.5	0	0	0	0	111.6	E150 R155	E150-S153 PolarHBondContact O-N 2.89Å; E150-S153 PolarHBondContact O-OG 3.47Å; S153-R155 PolarHBondContact O-N 3.38Å
154	P	27.6	Very low	34	Very low	117 Å²	117	108.9 Å²	108.9	76%	0.76	57%	0.571	S	S	*	*			trans	-55.2	127.9	174.1	23.9	-31.5	0	0	0	107.5	S156	P154-S156 PolarHBondContact O-N 3.18Å
155	R	27.1	Very low	34.8	Very low	253 Å²	253	105.9 Å²	105.9	96%	0.955	56%	0.555	S	S	*	*			trans	-55.7	81.3	177.2	-75.2	177.7	168.8	167.9	-3.2	109.7	S153 N157	S153-R155 PolarHBondContact O-N 3.38Å; R155-N157 PolarHBondContact O-N 3.34Å
156	S	27.3	Very low	35.6	Very low	89 Å²	89	98.5 Å²	98.5	62%	0.622	52%	0.522	S	S	*	.			trans	-71.1	123.9	170.7	60.8	0	0	0	0	106.2	P154 I158	P154-S156 PolarHBondContact O-N 3.18Å; S156-I158 VanDerWaalsContact C-N 3.33Å; S156-I158 PolarHBondContact O-N 3.3Å
157	N	28	Very low	36.4	Very low	147 Å²	147	93.5 Å²	93.5	79%	0.786	50%	0.496	S	S	*	.			trans	-53.2	98.4	169.7	-71.4	-33.9	0	0	0	108.6	R155 N159	R155-N157 PolarHBondContact O-N 3.34Å; N157-N159 PolarHBondContact O-N 2.81Å
158	I	34.2	Very low	37.3	Very low	93 Å²	93	90.6 Å²	90.6	48%	0.477	47%	0.474	S	S	.	.			trans	-72.6	101.5	171.4	-58	176.2	0	0	0	105.1	S156 F160 T264	S156-I158 VanDerWaalsContact C-N 3.33Å; S156-I158 PolarHBondContact O-N 3.3Å; I158-F160 HydrophobicContact CB-CE1 4.4Å; I158-F160 HydrophobicContact CB-CE2 4.01Å; I158-F160 HydrophobicContact CB-CZ 3.88Å; I158-F160 HydrophobicContact CG2-CD1 4Å; I158-F160 HydrophobicContact CG2-CD2 4.43Å; I158-F160 HydrophobicContact CG2-CE1 3.5Å; I158-F160 VanDerWaalsContact CG2-CE1 3.5Å; I158-F160 HydrophobicContact CG2-CE2 3.96Å; I158-F160 HydrophobicContact CG2-CG 4.46Å; I158-F160 HydrophobicContact CG2-CZ 3.47Å; I158-F160 VanDerWaalsContact CG2-CZ 3.47Å; I158-F160 VanDerWaalsContact O-CD2 3.28Å; I158-F160 WeakPolarHBondContact O-CD2 3.33Å; I158-F160 WeakPolarHBondContact O-CE2 3.07Å; I158-F160 PolarHBondContact O-N 2.8Å; I158-F160 VanDerWaalsContact O-N 3.09Å; I158-T264 HydrophobicContact CG2-CG2 4.23Å
159	N	33.1	Very low	38.3	Very low	128 Å²	128	78.9 Å²	78.9	68%	0.684	43%	0.43	S	S	*	.			trans	-70.6	102.5	173.3	-72.8	-22.6	0	0	0	107.8	N157	N157-N159 PolarHBondContact O-N 2.81Å
160	F	38.3	Very low	39.1	Very low	83 Å²	83	80 Å²	80	36%	0.364	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	142.1	168.9	-59.4	-72.4	0	0	0	109.5	I158 F162 Q262 T264	I158-F160 HydrophobicContact CB-CE1 4.4Å; I158-F160 HydrophobicContact CB-CE2 4.01Å; I158-F160 HydrophobicContact CB-CZ 3.88Å; I158-F160 HydrophobicContact CG2-CD1 4Å; I158-F160 HydrophobicContact CG2-CD2 4.43Å; I158-F160 HydrophobicContact CG2-CE1 3.5Å; I158-F160 VanDerWaalsContact CG2-CE1 3.5Å; I158-F160 HydrophobicContact CG2-CE2 3.96Å; I158-F160 HydrophobicContact CG2-CG 4.46Å; I158-F160 HydrophobicContact CG2-CZ 3.47Å; I158-F160 VanDerWaalsContact CG2-CZ 3.47Å; I158-F160 VanDerWaalsContact O-CD2 3.28Å; I158-F160 WeakPolarHBondContact O-CD2 3.33Å; I158-F160 WeakPolarHBondContact O-CE2 3.07Å; I158-F160 PolarHBondContact O-N 2.8Å; I158-F160 VanDerWaalsContact O-N 3.09Å; F160-F162 HydrophobicContact CB-CE2 4.2Å; F160-Q262 HydrophobicContact CB-CG 4.47Å; F160-Q262 HydrophobicContact CD1-CG 3.98Å; F160-T264 HydrophobicContact CD1-CG2 3.92Å; F160-T264 HydrophobicContact CE1-CG2 3.89Å
161	S	39.1	Very low	39.9	Very low	27 Å²	27	74.1 Å²	74.1	19%	0.189	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	135.1	166.3	-64.4	0	0	0	0	108.5	S263 W265	S161-S263 PolarHBondContact N-O 3.39Å; S161-S263 PolarHBondContact O-N 3.46Å; S161-W265 VanDerWaalsContact OG-CD1 3.29Å; S161-W265 PolarHBondContact OG-NE1 2.78Å
162	F	45.4	Very low	40.5	Very low	23 Å²	23	77 Å²	77	10%	0.101	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	128.3	174.5	-66.1	-92	0	0	0	108	F139 F160 A242 M260 I261 Q262 I297	F139-F162 HydrophobicContact CE1-CE1 4.23Å; F139-F162 AromaticContact CE1-CZ 3.96Å; F139-F162 HydrophobicContact CE1-CZ 3.96Å; F139-F162 AromaticContact CZ-CE1 3.97Å; F139-F162 HydrophobicContact CZ-CE1 3.97Å; F139-F162 HydrophobicContact CZ-CE2 4.36Å; F139-F162 AromaticContact CZ-CZ 3.68Å; F139-F162 HydrophobicContact CZ-CZ 3.68Å; F160-F162 HydrophobicContact CB-CE2 4.2Å; F162-A242 HydrophobicContact CE1-CB 4.12Å; F162-M260 HydrophobicContact CD1-CG 4.14Å; F162-M260 HydrophobicContact CD1-SD 4.02Å; F162-I261 CarbonylContact C-O 3.49Å; F162-I261 WeakPolarHBondContact CA-O 3.41Å; F162-Q262 HydrophobicContact CD1-CB 4.37Å; F162-Q262 HydrophobicContact CE1-CB 4.13Å; F162-Q262 HydrophobicContact CE1-CG 4.23Å; F162-Q262 HydrophobicContact CZ-CG 4.48Å; F162-I297 HydrophobicContact CB-CD1 4.19Å; F162-I297 HydrophobicContact CD2-CD1 3.39Å; F162-I297 HydrophobicContact CD2-CG1 4.13Å; F162-I297 HydrophobicContact CE2-CD1 3.82Å; F162-I297 HydrophobicContact CG-CD1 3.8Å
163	Y	44.7	Very low	41.2	Very low	69 Å²	69	80 Å²	80	27%	0.271	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	121.4	173.5	-68	-90.5	0	0	0	107	M260 I261 S263 L294	Y163-M260 CarbonylContact O-C 3.58Å; Y163-M260 VanDerWaalsContact O-CA 3.3Å; Y163-M260 WeakPolarHBondContact O-CA 3.49Å; Y163-I261 PolarHBondContact N-O 3.47Å; Y163-I261 PolarHBondContact O-N 3.21Å; Y163-S263 VanDerWaalsContact CE2-CB 3.47Å; Y163-L294 HydrophobicContact CD1-CD1 4.01Å; Y163-L294 HydrophobicContact CE1-CD1 3.74Å
164	L	47.6	Very low	42.1	Very low	28 Å²	28	77.7 Å²	77.7	15%	0.147	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	120.8	169.6	-174.6	68.3	0	0	0	107.9	Y246 N258 M260 K293 V295	L164-Y246 HydrophobicContact CD1-CE1 4.24Å; L164-N258 HydrophobicContact CD1-CB 4.21Å; L164-M260 HydrophobicContact CD1-CB 4.4Å; L164-M260 HydrophobicContact CD1-CE 4.44Å; L164-K293 CarbonylContact C-O 3.57Å; L164-K293 PolarHBondContact N-O 3.47Å; L164-K293 CarbonylContact O-C 3.57Å; L164-K293 PolarHBondContact O-N 3.3Å; L164-K293 VanDerWaalsContact O-N 3.09Å; L164-V295 HydrophobicContact CB-CB 4.37Å; L164-V295 HydrophobicContact CB-CG2 3.52Å; L164-V295 HydrophobicContact CD2-CG2 4.02Å; L164-V295 HydrophobicContact CG-CG2 4.44Å
165	L	51.2	Low	43.2	Very low	6 Å²	6	72.9 Å²	72.9	3%	0.031	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	110.2	179.8	172.7	66.6	0	0	0	108.3	N258 I259 P272 L273 L276 I290	L165-N258 CarbonylContact O-C 3.58Å; L165-N258 VanDerWaalsContact O-CA 3.29Å; L165-N258 WeakPolarHBondContact O-CA 3.33Å; L165-I259 HydrophobicContact CB-CB 4.17Å; L165-I259 HydrophobicContact CD2-CB 4.31Å; L165-I259 HydrophobicContact CD2-CD1 4.08Å; L165-I259 PolarHBondContact N-O 2.64Å; L165-I259 PolarHBondContact O-N 3.37Å; L165-P272 HydrophobicContact CD2-CB 3.93Å; L165-L273 HydrophobicContact CD1-CD2 4.31Å; L165-L276 HydrophobicContact CD1-CD1 3.31Å; L165-L276 HydrophobicContact CD2-CD1 3.14Å; L165-L276 HydrophobicContact CD2-CD2 4.24Å; L165-L276 HydrophobicContact CD2-CG 3.71Å; L165-L276 HydrophobicContact CG-CD1 3.58Å; L165-I290 HydrophobicContact CD1-CG2 4.05Å
166	S	49.5	Very low	44.4	Very low	10 Å²	10	67.7 Å²	67.7	7%	0.07	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	122.9	178.9	-58.9	0	0	0	0	109.1	L257 N258 E291	S166-L257 CarbonylContact C-O 3.58Å; S166-L257 WeakPolarHBondContact CA-O 3.42Å; S166-N258 VanDerWaalsContact CB-OD1 3.31Å; S166-N258 WeakPolarHBondContact CB-OD1 3.5Å; S166-N258 PolarHBondContact OG-OD1 2.84Å; S166-E291 PolarHBondContact N-O 2.81Å; S166-E291 PolarHBondContact O-N 3.23Å; S166-E291 VanDerWaalsContact O-N 3.08Å
167	L	50.8	Low	45.6	Very low	1 Å²	1	65.9 Å²	65.9	1%	0.005	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	119.5	175.1	-70	156.3	0	0	0	107.4	C256 L257 I259 L276 V288 I290	L167-C256 CarbonylContact O-C 3.47Å; L167-C256 VanDerWaalsContact O-CA 3.23Å; L167-C256 WeakPolarHBondContact O-CA 3.11Å; L167-L257 HydrophobicContact CB-CB 4.12Å; L167-L257 HydrophobicContact CD1-CB 4.46Å; L167-L257 HydrophobicContact CD1-CD2 3.71Å; L167-L257 HydrophobicContact CD1-CG 4.16Å; L167-L257 PolarHBondContact N-O 3.22Å; L167-L257 PolarHBondContact O-N 3.22Å; L167-I259 HydrophobicContact CD1-CD1 4.12Å; L167-L276 HydrophobicContact CD1-CD1 4.41Å; L167-L276 HydrophobicContact CD1-CD2 3.81Å; L167-L276 HydrophobicContact CD2-CD1 3.86Å; L167-L276 HydrophobicContact CD2-CD2 4.04Å; L167-L276 HydrophobicContact CG-CD1 4.35Å; L167-L276 HydrophobicContact CG-CD2 4.47Å; L167-V288 HydrophobicContact CD2-CG1 3.74Å; L167-I290 HydrophobicContact CD2-CB 4.34Å; L167-I290 HydrophobicContact CD2-CG1 3.71Å; L167-I290 HydrophobicContact CD2-CG2 4.43Å
168	I	50.9	Low	46.8	Very low	43 Å²	43	59.1 Å²	59.1	22%	0.221	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	125.5	174.8	-51.6	179.2	0	0	0	107.4	M254 A289	I168-M254 HydrophobicContact CG2-SD 4.27Å; I168-A289 HydrophobicContact CB-CB 4.44Å; I168-A289 PolarHBondContact N-O 3.39Å
169	L	51.3	Low	47.7	Very low	0 Å²	0	55.9 Å²	55.9	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	116	177.5	-54.7	170.5	0	0	0	106.8	G171 D174 L175 L178 M254 A255 L257	L169-G171 VanDerWaalsContact C-N 3.3Å; L169-D174 HydrophobicContact CB-CB 4.05Å; L169-D174 HydrophobicContact CD2-CB 3.89Å; L169-L175 HydrophobicContact CD1-CB 4.28Å; L169-L175 HydrophobicContact CD1-CD1 3.57Å; L169-L178 HydrophobicContact CD1-CD2 4.26Å; L169-L178 HydrophobicContact CD2-CD2 4.14Å; L169-M254 WeakPolarHBondContact O-CA 3.2Å; L169-A255 WeakPolarHBondContact CA-O 3.33Å; L169-A255 HydrophobicContact CB-CB 4.35Å; L169-A255 VanDerWaalsContact CB-O 3.24Å; L169-A255 WeakPolarHBondContact CB-O 3.05Å; L169-A255 PolarHBondContact N-O 3.45Å; L169-A255 PolarHBondContact O-N 3.11Å; L169-L257 HydrophobicContact CD1-CB 4.36Å
170	E	47	Very low	48.4	Very low	108 Å²	108	56.2 Å²	56.2	51%	0.505	26%	0.257	S	S	.	.	S	Bend	trans	-80.4	-13	-173.8	-72.4	-178	162.4	0	0	112.5	D174 T287	E170-D174 PolarHBondContact N-OD2 2.94Å; E170-T287 WeakPolarHBondContact OE2-CB 3.25Å; E170-T287 PolarHBondContact OE2-OG1 2.88Å
171	G	44.7	Very low	49	Very low	26 Å²	26	53.6 Å²	53.6	27%	0.268	25%	0.247	S	C	.	.	S	Bend	trans	-156.8	171.6	172.3	0	0	0	0	0	115.3	L169 E173 D174	L169-G171 VanDerWaalsContact C-N 3.3Å; G171-E173 PolarHBondContact O-N 3.4Å; G171-D174 PolarHBondContact N-OD2 3.02Å; G171-D174 PolarHBondContact O-N 3.44Å
172	R	48.1	Very low	49.6	Very low	202 Å²	202	53.1 Å²	53.1	76%	0.762	24%	0.242	S	C	*	.	H	α-helix	trans	-62.8	-21.4	174.9	-78	-174.3	171.2	-172.6	-4	113.4	K176	R172-K176 PolarHBondContact O-N 3Å
173	E	50	Low	49.7	Very low	165 Å²	165	54.2 Å²	54.2	77%	0.771	25%	0.247	S	C	*	.	H	α-helix	trans	-71.9	-39.5	175.8	-62	-162.2	161.7	0	0	111.6	G171 L175 K176 E177	G171-E173 PolarHBondContact O-N 3.4Å; E173-L175 VanDerWaalsContact C-N 3.26Å; E173-L175 PolarHBondContact O-N 3.14Å; E173-K176 PolarHBondContact O-N 3.19Å; E173-E177 WeakPolarHBondContact O-CB 3.2Å; E173-E177 PolarHBondContact O-N 2.78Å
174	D	48.9	Very low	49.7	Very low	14 Å²	14	55 Å²	55	8%	0.075	25%	0.253	C	S	.	.	H	α-helix	trans	-62.2	-36.5	176.1	-60.5	-39.6	0	0	0	111.5	L169 E170 G171 E177 L178	L169-D174 HydrophobicContact CB-CB 4.05Å; L169-D174 HydrophobicContact CD2-CB 3.89Å; E170-D174 PolarHBondContact N-OD2 2.94Å; G171-D174 PolarHBondContact N-OD2 3.02Å; G171-D174 PolarHBondContact O-N 3.44Å; D174-E177 PolarHBondContact O-N 3.48Å; D174-L178 WeakPolarHBondContact O-CB 3.39Å; D174-L178 PolarHBondContact O-N 3.49Å
175	L	50.4	Low	49.6	Very low	16 Å²	16	59.6 Å²	59.6	8%	0.084	27%	0.269	C	S	.	.	H	α-helix	trans	-63.4	-46.1	175.5	-171.7	71	0	0	0	111.7	L169 E173 L178 Q179 F225 L247	L169-L175 HydrophobicContact CD1-CB 4.28Å; L169-L175 HydrophobicContact CD1-CD1 3.57Å; E173-L175 VanDerWaalsContact C-N 3.26Å; E173-L175 PolarHBondContact O-N 3.14Å; L175-L178 PolarHBondContact O-N 3.13Å; L175-Q179 WeakPolarHBondContact O-CB 3.2Å; L175-Q179 PolarHBondContact O-N 3.47Å; L175-F225 HydrophobicContact CD1-CD1 3.5Å; L175-F225 VanDerWaalsContact CD1-CD1 3.5Å; L175-F225 HydrophobicContact CD1-CE1 3.31Å; L175-F225 HydrophobicContact CD1-CE2 4.44Å; L175-F225 HydrophobicContact CD1-CG 4.17Å; L175-F225 HydrophobicContact CD1-CZ 3.83Å; L175-F225 HydrophobicContact CG-CD1 4.23Å; L175-F225 HydrophobicContact CG-CE1 4.33Å; L175-F225 HydrophobicContact CG-CG 4.44Å; L175-L247 HydrophobicContact CD1-CD2 3.52Å
176	K	51.7	Low	49.1	Very low	144 Å²	144	61.1 Å²	61.1	63%	0.626	28%	0.278	S	S	*	.	H	α-helix	trans	-66.7	-39.3	177.2	-73	-178.5	178.9	179.9	0	111.9	R172 E173 Q179 Y180	R172-K176 PolarHBondContact O-N 3Å; E173-K176 PolarHBondContact O-N 3.19Å; K176-Q179 WeakPolarHBondContact O-CB 3.38Å; K176-Q179 PolarHBondContact O-N 2.71Å; K176-Y180 VanDerWaalsContact O-CB 3.3Å; K176-Y180 WeakPolarHBondContact O-CB 3.36Å; K176-Y180 PolarHBondContact O-N 3Å
177	E	51.9	Low	48.4	Very low	51 Å²	51	65.4 Å²	65.4	24%	0.238	29%	0.292	C	S	.	.	H	α-helix	trans	-66.6	-43.5	176.4	-175.2	166.6	-158.5	0	0	110.9	E173 D174 Q179 Y180 I181	E173-E177 WeakPolarHBondContact O-CB 3.2Å; E173-E177 PolarHBondContact O-N 2.78Å; D174-E177 PolarHBondContact O-N 3.48Å; E177-Q179 VanDerWaalsContact C-N 3.35Å; E177-Q179 PolarHBondContact O-N 3.46Å; E177-Y180 PolarHBondContact O-N 2.58Å; E177-I181 HydrophobicContact CG-CD1 3.81Å; E177-I181 HydrophobicContact CG-CG1 4.37Å; E177-I181 WeakPolarHBondContact O-CB 3.48Å; E177-I181 WeakPolarHBondContact O-CG1 3.38Å; E177-I181 PolarHBondContact O-N 2.89Å
178	L	53.6	Low	47.5	Very low	5 Å²	5	67.3 Å²	67.3	3%	0.026	31%	0.313	C	S	.	.	H	α-helix	trans	-61.2	-43.8	174.1	-175.6	66.3	0	0	0	111.5	L169 D174 L175 I181 L182 F225 L257 I279	L169-L178 HydrophobicContact CD1-CD2 4.26Å; L169-L178 HydrophobicContact CD2-CD2 4.14Å; D174-L178 WeakPolarHBondContact O-CB 3.39Å; D174-L178 PolarHBondContact O-N 3.49Å; L175-L178 PolarHBondContact O-N 3.13Å; L178-I181 PolarHBondContact O-N 3.48Å; L178-L182 HydrophobicContact CD1-CD1 4.1Å; L178-L182 HydrophobicContact CD1-CG 4.33Å; L178-L182 HydrophobicContact CG-CD1 3.88Å; L178-L182 HydrophobicContact CG-CG 4.48Å; L178-L182 WeakPolarHBondContact O-CB 3.46Å; L178-L182 WeakPolarHBondContact O-CG 3.16Å; L178-L182 PolarHBondContact O-N 3.22Å; L178-F225 HydrophobicContact CD2-CZ 4.2Å; L178-F225 HydrophobicContact CG-CZ 4.48Å; L178-L257 HydrophobicContact CD2-CD2 3.46Å; L178-L257 VanDerWaalsContact CD2-CD2 3.46Å; L178-I279 HydrophobicContact CD1-CD1 3.76Å
179	Q	53	Low	46.7	Very low	24 Å²	24	70.6 Å²	70.6	11%	0.112	32%	0.322	C	S	.	.	H	α-helix	trans	-58.1	-48.5	173.6	-170.3	177.6	16.5	0	0	111.6	L175 K176 E177 L182 Q183 F225	L175-Q179 WeakPolarHBondContact O-CB 3.2Å; L175-Q179 PolarHBondContact O-N 3.47Å; K176-Q179 WeakPolarHBondContact O-CB 3.38Å; K176-Q179 PolarHBondContact O-N 2.71Å; E177-Q179 VanDerWaalsContact C-N 3.35Å; E177-Q179 PolarHBondContact O-N 3.46Å; Q179-L182 PolarHBondContact O-N 3.17Å; Q179-Q183 WeakPolarHBondContact O-CB 3.06Å; Q179-Q183 WeakPolarHBondContact O-CG 3.2Å; Q179-Q183 PolarHBondContact O-N 3.44Å; Q179-F225 HydrophobicContact CB-CD2 3.71Å; Q179-F225 HydrophobicContact CB-CE2 3.48Å; Q179-F225 VanDerWaalsContact CB-CE2 3.48Å; Q179-F225 HydrophobicContact CG-CD2 3.64Å; Q179-F225 HydrophobicContact CG-CE2 3.82Å
180	Y	48.8	Very low	45.8	Very low	135 Å²	135	72.8 Å²	72.8	53%	0.529	34%	0.336	S	S	.	.	H	α-helix	trans	-61.3	-46.1	178.3	179.2	-94.7	0	0	0	111.9	K176 E177 Q183 H184	K176-Y180 VanDerWaalsContact O-CB 3.3Å; K176-Y180 WeakPolarHBondContact O-CB 3.36Å; K176-Y180 PolarHBondContact O-N 3Å; E177-Y180 PolarHBondContact O-N 2.58Å; Y180-Q183 PolarHBondContact O-N 3.48Å; Y180-H184 AromaticContact CD2-CD2 3.54Å; Y180-H184 AromaticContact CD2-NE2 3.75Å; Y180-H184 AromaticContact CE1-CD2 3.86Å; Y180-H184 AromaticContact CE2-CD2 3.25Å; Y180-H184 WeakPolarHBondContact CE2-CD2 3.31Å; Y180-H184 AromaticContact CE2-NE2 3.06Å; Y180-H184 WeakPolarHBondContact CE2-NE2 3.28Å; Y180-H184 AromaticContact CG-CD2 3.97Å; Y180-H184 AromaticContact CZ-CD2 3.4Å; Y180-H184 VanDerWaalsContact CZ-CD2 3.4Å; Y180-H184 AromaticContact CZ-CE1 3.93Å; Y180-H184 AromaticContact CZ-NE2 3.37Å; Y180-H184 WeakPolarHBondContact O-CB 3.33Å; Y180-H184 PolarHBondContact O-CD2 3.08Å; Y180-H184 PolarHBondContact O-N 3.38Å
181	I	50	Low	45.2	Very low	29 Å²	29	72.5 Å²	72.5	15%	0.149	34%	0.341	C	S	.	.	H	α-helix	trans	-62	-46.2	178.8	-70.8	168.5	0	0	0	110.6	E177 L178 R185 I279	E177-I181 HydrophobicContact CG-CD1 3.81Å; E177-I181 HydrophobicContact CG-CG1 4.37Å; E177-I181 WeakPolarHBondContact O-CB 3.48Å; E177-I181 WeakPolarHBondContact O-CG1 3.38Å; E177-I181 PolarHBondContact O-N 2.89Å; L178-I181 PolarHBondContact O-N 3.48Å; I181-R185 HydrophobicContact CG2-CG 4.26Å; I181-R185 VanDerWaalsContact O-CB 3.25Å; I181-R185 WeakPolarHBondContact O-CB 3.29Å; I181-R185 WeakPolarHBondContact O-CG 3.15Å; I181-R185 PolarHBondContact O-N 3.08Å; I181-I279 HydrophobicContact CD1-CG2 4.19Å; I181-I279 HydrophobicContact CG2-CG1 4.26Å
182	L	51.5	Low	44.6	Very low	17 Å²	17	75.8 Å²	75.8	9%	0.089	36%	0.36	C	S	.	.	H	α-helix	trans	-65.8	-43.3	179.9	-70.2	170.7	0	0	0	111.4	L178 Q179 V186 L229 L232 L275	L178-L182 HydrophobicContact CD1-CD1 4.1Å; L178-L182 HydrophobicContact CD1-CG 4.33Å; L178-L182 HydrophobicContact CG-CD1 3.88Å; L178-L182 HydrophobicContact CG-CG 4.48Å; L178-L182 WeakPolarHBondContact O-CB 3.46Å; L178-L182 WeakPolarHBondContact O-CG 3.16Å; L178-L182 PolarHBondContact O-N 3.22Å; Q179-L182 PolarHBondContact O-N 3.17Å; L182-V186 VanDerWaalsContact O-CG2 3.29Å; L182-V186 WeakPolarHBondContact O-CG2 3.44Å; L182-V186 PolarHBondContact O-N 3Å; L182-L229 HydrophobicContact CD1-CD1 3.59Å; L182-L232 HydrophobicContact CB-CD1 4.14Å; L182-L275 HydrophobicContact CD2-CD2 4.01Å
183	Q	48.6	Very low	43.8	Very low	45 Å²	45	74 Å²	74	21%	0.21	36%	0.36	C	S	.	.	H	α-helix	trans	-62.9	-46.8	176.2	-74.4	175.3	-6	0	0	112.3	Q179 Y180 R187	Q179-Q183 WeakPolarHBondContact O-CB 3.06Å; Q179-Q183 WeakPolarHBondContact O-CG 3.2Å; Q179-Q183 PolarHBondContact O-N 3.44Å; Y180-Q183 PolarHBondContact O-N 3.48Å; Q183-R187 PolarHBondContact O-N 3.1Å
184	H	45.2	Very low	42.8	Very low	85 Å²	85	70.2 Å²	70.2	39%	0.394	35%	0.353	S	S	.	.	H	α-helix	trans	-71.1	-37.7	-178.4	-88.7	-92.1	0	0	0	113.5	Y180 R187 G188	Y180-H184 AromaticContact CD2-CD2 3.54Å; Y180-H184 AromaticContact CD2-NE2 3.75Å; Y180-H184 AromaticContact CE1-CD2 3.86Å; Y180-H184 AromaticContact CE2-CD2 3.25Å; Y180-H184 WeakPolarHBondContact CE2-CD2 3.31Å; Y180-H184 AromaticContact CE2-NE2 3.06Å; Y180-H184 WeakPolarHBondContact CE2-NE2 3.28Å; Y180-H184 AromaticContact CG-CD2 3.97Å; Y180-H184 AromaticContact CZ-CD2 3.4Å; Y180-H184 VanDerWaalsContact CZ-CD2 3.4Å; Y180-H184 AromaticContact CZ-CE1 3.93Å; Y180-H184 AromaticContact CZ-NE2 3.37Å; Y180-H184 WeakPolarHBondContact O-CB 3.33Å; Y180-H184 PolarHBondContact O-CD2 3.08Å; Y180-H184 PolarHBondContact O-N 3.38Å; H184-R187 WeakPolarHBondContact O-CB 3.37Å; H184-R187 PolarHBondContact O-N 2.61Å; H184-G188 PolarHBondContact O-N 3.19Å; H184-G188 VanDerWaalsContact O-N 3.12Å
185	R	44.9	Very low	41.9	Very low	126 Å²	126	76.7 Å²	76.7	48%	0.475	39%	0.386	S	S	.	.	H	α-helix	trans	-71.8	-30.4	179.2	-71.8	-85.6	-160.9	168.7	5.6	112	I181 G188 K278 D281	I181-R185 HydrophobicContact CG2-CG 4.26Å; I181-R185 VanDerWaalsContact O-CB 3.25Å; I181-R185 WeakPolarHBondContact O-CB 3.29Å; I181-R185 WeakPolarHBondContact O-CG 3.15Å; I181-R185 PolarHBondContact O-N 3.08Å; R185-G188 PolarHBondContact O-N 3.14Å; R185-K278 PolarHBondContact NH2-O 3.49Å; R185-D281 IonicContact NH2-OD2 3.47Å; R185-D281 PolarHBondContact NH2-OD2 2.96Å
186	V	40.5	Very low	41	Very low	37 Å²	37	82.8 Å²	82.8	22%	0.224	42%	0.419	C	S	.	.	H	α-helix	trans	-67.1	-38.7	169.6	170.7	0	0	0	0	111.1	L182 G188 R189 W207 L232	L182-V186 VanDerWaalsContact O-CG2 3.29Å; L182-V186 WeakPolarHBondContact O-CG2 3.44Å; L182-V186 PolarHBondContact O-N 3Å; V186-G188 VanDerWaalsContact C-N 3.28Å; V186-G188 PolarHBondContact O-N 3.32Å; V186-R189 PolarHBondContact O-N 2.89Å; V186-W207 HydrophobicContact CG1-CB 4.37Å; V186-L232 HydrophobicContact CB-CD1 4.45Å; V186-L232 HydrophobicContact CG2-CD1 3.56Å; V186-L232 HydrophobicContact CG2-CD2 4.06Å; V186-L232 HydrophobicContact CG2-CG 3.78Å
187	R	34.1	Very low	40	Very low	100 Å²	100	83.8 Å²	83.8	38%	0.377	43%	0.431	S	S	.	.	H	α-helix	trans	-64.1	-28.6	176	-148.6	175.4	-176.3	163.3	5.6	113.6	Q183 H184 T190	Q183-R187 PolarHBondContact O-N 3.1Å; H184-R187 WeakPolarHBondContact O-CB 3.37Å; H184-R187 PolarHBondContact O-N 2.61Å; R187-T190 PolarHBondContact O-OG1 2.99Å
188	G	33.3	Very low	38.8	Very low	42 Å²	42	86.3 Å²	86.3	43%	0.433	45%	0.454	S	S	.	.	H	α-helix	trans	-79.6	-11.9	179.3	0	0	0	0	0	116.1	H184 R185 V186 T191 S192	H184-G188 PolarHBondContact O-N 3.19Å; H184-G188 VanDerWaalsContact O-N 3.12Å; R185-G188 PolarHBondContact O-N 3.14Å; V186-G188 VanDerWaalsContact C-N 3.28Å; V186-G188 PolarHBondContact O-N 3.32Å; G188-T191 PolarHBondContact O-OG1 2.93Å; G188-S192 PolarHBondContact O-OG 3.14Å
189	R	32.5	Very low	37.5	Very low	112 Å²	112	91.3 Å²	91.3	42%	0.423	49%	0.49	S	S	.	.	H	α-helix	trans	-87.3	-26.8	178	-91.2	-176.6	170	146.4	-4.5	113.7	V186 S192 Q193	V186-R189 PolarHBondContact O-N 2.89Å; R189-S192 PolarHBondContact O-OG 2.96Å; R189-Q193 PolarHBondContact O-N 2.95Å
190	T	33.1	Very low	36.3	Very low	46 Å²	46	95.5 Å²	95.5	28%	0.282	52%	0.522	S	S	.	.	H	α-helix	trans	-78.6	-26.7	-178.3	50.6	0	0	0	0	112.9	R187 S192 S194	R187-T190 PolarHBondContact O-OG1 2.99Å; T190-S192 VanDerWaalsContact C-N 3.31Å; T190-S192 PolarHBondContact O-N 3.22Å; T190-S194 VanDerWaalsContact O-CB 3.27Å; T190-S194 WeakPolarHBondContact O-CB 3.17Å; T190-S194 PolarHBondContact O-N 3.18Å; T190-S194 PolarHBondContact O-OG 3.44Å
191	T	33.4	Very low	35.4	Very low	101 Å²	101	95.3 Å²	95.3	62%	0.62	53%	0.534	S	S	*	.	H	α-helix	trans	-73.9	-21.5	177.8	49.6	0	0	0	0	113.3	G188	G188-T191 PolarHBondContact O-OG1 2.93Å
192	S	32.5	Very low	34.1	Very low	95 Å²	95	106 Å²	106	66%	0.664	57%	0.573	S	S	*	*	H	α-helix	trans	-99.6	-14.5	179.5	43.8	0	0	0	0	114.2	G188 R189 T190	G188-S192 PolarHBondContact O-OG 3.14Å; R189-S192 PolarHBondContact O-OG 2.96Å; T190-S192 VanDerWaalsContact C-N 3.31Å; T190-S192 PolarHBondContact O-N 3.22Å
193	Q	31.9	Very low	33	Very low	164 Å²	164	112.7 Å²	112.7	77%	0.766	61%	0.608	S	S	*	*	H	α-helix	trans	-106.8	-3.5	177.8	-78.2	-175.6	-27.8	0	0	114.9	R189	R189-Q193 PolarHBondContact O-N 2.95Å
194	S	29.4	Very low	32	Very low	87 Å²	87	117.6 Å²	117.6	61%	0.608	63%	0.631	S	S	*	*	S	Bend	trans	-100.7	6.7	-175.1	58.5	0	0	0	0	116.3	T190	T190-S194 VanDerWaalsContact O-CB 3.27Å; T190-S194 WeakPolarHBondContact O-CB 3.17Å; T190-S194 PolarHBondContact O-N 3.18Å; T190-S194 PolarHBondContact O-OG 3.44Å
195	L	29.9	Very low	31.1	Very low	150 Å²	150	115.7 Å²	115.7	79%	0.785	63%	0.626	S	S	*	*	S	Bend	trans	-92.2	-8.4	178.9	-109.7	98.3	0	0	0	115.9
196	N	31.2	Very low	30.5	Very low	143 Å²	143	112.9 Å²	112.9	77%	0.765	62%	0.624	S	S	*	*	S	Bend	trans	-132.3	71.7	-177.2	-77.7	-12.1	0	0	0	111.6
197	N	30.2	Very low	30	Very low	165 Å²	165	115.3 Å²	115.3	88%	0.882	63%	0.63	S	S	*	*			trans	-177	130.3	134.9	-92.5	-16.3	0	0	0	111.8
198	S	26.7	Very low	29.6	Very low	104 Å²	104	114 Å²	114	73%	0.727	63%	0.629	S	S	*	*			trans	-73.4	149.6	-173.8	42.3	0	0	0	0	114.3
199	S	26.3	Very low	29.4	Very low	110 Å²	110	115.3 Å²	115.3	77%	0.769	63%	0.629	S	S	*	*			trans	56.5	84.1	150.8	61.8	0	0	0	0	118.7
200	S	28.6	Very low	29.3	Very low	113 Å²	113	113.1 Å²	113.1	79%	0.79	62%	0.623	S	S	*	*	S	Bend	trans	-175.2	131	130.4	48.7	0	0	0	0	110.1
201	V	28.8	Very low	29.1	Very low	130 Å²	130	111.7 Å²	111.7	79%	0.788	62%	0.616	S	S	*	*			trans	36.8	100	162.8	-168.8	0	0	0	0	116.6	L203	V201-L203 PolarHBondContact O-N 2.9Å
202	R	24.3	Very low	28.9	Very low	254 Å²	254	111.3 Å²	111.3	96%	0.958	61%	0.61	S	S	*	*			trans	-59.5	93.6	172.3	-73.2	-179.4	175.8	175.2	-1.2	111.4
203	L	28.2	Very low	28.9	Very low	157 Å²	157	112.9 Å²	112.9	82%	0.822	61%	0.607	S	S	*	*			trans	-84.5	108.1	157	-85.3	154.7	0	0	0	107.4	V201 P205	V201-L203 PolarHBondContact O-N 2.9Å; L203-P205 WeakPolarHBondContact O-CD 3.36Å
204	Q	26.5	Very low	28.8	Very low	148 Å²	148	107.7 Å²	107.7	69%	0.692	59%	0.592	S	S	*	*			trans	-58.8	122.8	176.2	-161.5	173.8	15	0	0	108.1
205	P	27.6	Very low	28.9	Very low	45 Å²	45	111.6 Å²	111.6	29%	0.292	60%	0.598	S	S	.	*			trans	-65.2	132	-178.1	-14.4	23.2	0	0	0	110.4	L203 W207 L208	L203-P205 WeakPolarHBondContact O-CD 3.36Å; P205-W207 VanDerWaalsContact CB-CD1 3.4Å; P205-W207 HydrophobicContact CB-CD2 3.98Å; P205-W207 HydrophobicContact CB-CG 4.04Å; P205-W207 HydrophobicContact CB-CZ2 3.79Å; P205-W207 PolarHBondContact O-N 3Å; P205-L208 HydrophobicContact CB-CD1 4.47Å; P205-L208 HydrophobicContact CG-CD1 4.02Å; P205-L208 PolarHBondContact O-N 3.28Å
206	P	31.5	Very low	28.7	Very low	68 Å²	68	109 Å²	109	44%	0.442	59%	0.591	S	S	.	*	T	Hydrogen-bonded Turn	trans	-60.6	-18.6	-173.9	20.4	-30.3	0	0	0	113.3	L208 T209 F210	P206-L208 VanDerWaalsContact C-N 3.27Å; P206-L208 PolarHBondContact O-N 3.15Å; P206-T209 PolarHBondContact O-N 3.42Å; P206-T209 PolarHBondContact O-OG1 2.9Å; P206-F210 WeakPolarHBondContact O-CD2 3.21Å
207	W	30	Very low	28.5	Very low	88 Å²	88	106.6 Å²	106.6	33%	0.333	60%	0.6	S	S	.	*	H	α-helix	trans	-67.2	-17.9	172.2	30	91.1	0	0	0	115.2	V186 P205 N235	V186-W207 HydrophobicContact CG1-CB 4.37Å; P205-W207 VanDerWaalsContact CB-CD1 3.4Å; P205-W207 HydrophobicContact CB-CD2 3.98Å; P205-W207 HydrophobicContact CB-CG 4.04Å; P205-W207 HydrophobicContact CB-CZ2 3.79Å; P205-W207 PolarHBondContact O-N 3Å; W207-N235 HydrophobicContact CE3-CB 4.29Å; W207-N235 HydrophobicContact CZ3-CB 3.77Å; W207-N235 VanDerWaalsContact CZ3-CG 3.41Å
208	L	26.3	Very low	28.6	Very low	71 Å²	71	101.3 Å²	101.3	37%	0.372	58%	0.584	S	S	.	*	H	α-helix	trans	-72.2	-32.8	171.1	-93.7	131.8	0	0	0	112.2	P205 P206	P205-L208 HydrophobicContact CB-CD1 4.47Å; P205-L208 HydrophobicContact CG-CD1 4.02Å; P205-L208 PolarHBondContact O-N 3.28Å; P206-L208 VanDerWaalsContact C-N 3.27Å; P206-L208 PolarHBondContact O-N 3.15Å
209	T	28.9	Very low	29	Very low	71 Å²	71	105.7 Å²	105.7	44%	0.436	59%	0.593	S	S	.	*	H	α-helix	trans	-69.4	-34.1	175.2	22.4	0	0	0	0	113.2	P206 A211 D212 Q213	P206-T209 PolarHBondContact O-N 3.42Å; P206-T209 PolarHBondContact O-OG1 2.9Å; T209-A211 VanDerWaalsContact C-N 3.32Å; T209-A211 PolarHBondContact O-N 3.31Å; T209-D212 PolarHBondContact O-N 3.24Å; T209-Q213 WeakPolarHBondContact O-CG 3.31Å; T209-Q213 PolarHBondContact O-N 3.37Å
210	F	29.4	Very low	30	Very low	66 Å²	66	104.1 Å²	104.1	29%	0.289	58%	0.579	S	S	.	*	H	α-helix	trans	-66.7	-34.1	179.1	-75.7	-80.6	0	0	0	113.4	P206 D212 Q213 A214 T231	P206-F210 WeakPolarHBondContact O-CD2 3.21Å; F210-D212 VanDerWaalsContact C-N 3.28Å; F210-D212 PolarHBondContact O-N 3.43Å; F210-Q213 PolarHBondContact O-N 2.9Å; F210-A214 WeakPolarHBondContact O-CB 3.41Å; F210-A214 PolarHBondContact O-N 2.86Å; F210-T231 HydrophobicContact CZ-CG2 4.43Å
211	A	28.8	Very low	31.3	Very low	15 Å²	15	101.2 Å²	101.2	12%	0.124	56%	0.558	C	S	.	*	H	α-helix	trans	-68.6	-27	177	0	0	0	0	0	113.7	T209	T209-A211 VanDerWaalsContact C-N 3.32Å; T209-A211 PolarHBondContact O-N 3.31Å
212	D	29.7	Very low	32.4	Very low	93 Å²	93	99.3 Å²	99.3	50%	0.497	54%	0.544	S	S	.	.	H	α-helix	trans	-88.4	-27.6	176.2	-68.9	-23.7	0	0	0	111.1	T209 F210	T209-D212 PolarHBondContact O-N 3.24Å; F210-D212 VanDerWaalsContact C-N 3.28Å; F210-D212 PolarHBondContact O-N 3.43Å
213	Q	31.8	Very low	33.8	Very low	129 Å²	129	93 Å²	93	60%	0.603	53%	0.529	S	S	*	.	H	α-helix	trans	-75	-34.9	172.7	-72.7	-177.8	-4.3	0	0	113.4	T209 F210 K215 C216	T209-Q213 WeakPolarHBondContact O-CG 3.31Å; T209-Q213 PolarHBondContact O-N 3.37Å; F210-Q213 PolarHBondContact O-N 2.9Å; Q213-K215 PolarHBondContact O-N 2.65Å; Q213-C216 WeakPolarHBondContact O-CB 3.4Å; Q213-C216 PolarHBondContact O-N 2.82Å; Q213-C216 VanDerWaalsContact O-N 3.08Å
214	A	31.5	Very low	35.4	Very low	54 Å²	54	88.6 Å²	88.6	45%	0.446	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-16	175.5	0	0	0	0	0	114	F210 C216	F210-A214 WeakPolarHBondContact O-CB 3.41Å; F210-A214 PolarHBondContact O-N 2.86Å; A214-C216 VanDerWaalsContact C-N 3.34Å
215	K	30.4	Very low	36.9	Very low	170 Å²	170	81.8 Å²	81.8	74%	0.739	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-18.4	170.1	-89.1	-176.1	173.7	-177.8	0	113	Q213 G217	Q213-K215 PolarHBondContact O-N 2.65Å; K215-G217 PolarHBondContact O-N 2.95Å
216	C	25.9	Very low	38.1	Very low	96 Å²	96	82 Å²	82	65%	0.649	47%	0.472	S	S	*	.	S	Bend	trans	-82.9	105.5	171.6	-72.2	0	0	0	0	107.8	Q213 A214 G218	Q213-C216 WeakPolarHBondContact O-CB 3.4Å; Q213-C216 PolarHBondContact O-N 2.82Å; Q213-C216 VanDerWaalsContact O-N 3.08Å; A214-C216 VanDerWaalsContact C-N 3.34Å; C216-G218 PolarHBondContact O-N 3.14Å
217	G	27.1	Very low	39.4	Very low	92 Å²	92	84.9 Å²	84.9	95%	0.948	48%	0.479	S	S	*	.			trans	-65.8	48.8	-178.1	0	0	0	0	0	115.6	K215	K215-G217 PolarHBondContact O-N 2.95Å
218	G	31.4	Very low	40.7	Very low	53 Å²	53	82.1 Å²	82.1	55%	0.546	47%	0.472	S	S	.	.			trans	-89.7	140.4	172.5	0	0	0	0	0	110.7	C216 T220	C216-G218 PolarHBondContact O-N 3.14Å; G218-T220 PolarHBondContact O-N 3.3Å
219	Q	36.9	Very low	42.2	Very low	197 Å²	197	79 Å²	79	92%	0.921	46%	0.456	S	S	*	.			trans	-47.9	97.3	170.1	-70.8	165.3	-9.8	0	0	110.2	S221	Q219-S221 PolarHBondContact O-N 3.19Å
220	T	47.2	Very low	43.4	Very low	76 Å²	76	76.7 Å²	76.7	47%	0.466	44%	0.441	S	S	.	.			trans	-74.3	119	166.2	48.6	0	0	0	0	106.9	G218 D224	G218-T220 PolarHBondContact O-N 3.3Å; T220-D224 WeakPolarHBondContact CA-OD2 2.72Å
221	S	55.1	Low	44.8	Very low	52 Å²	52	75.9 Å²	75.9	36%	0.364	44%	0.441	S	S	.	.			trans	-63.2	158.2	174.7	62	0	0	0	0	110.3	Q219 D223 D224 F225	Q219-S221 PolarHBondContact O-N 3.19Å; S221-D223 PolarHBondContact O-N 3.5Å; S221-D224 PolarHBondContact N-OD2 3.15Å; S221-D224 WeakPolarHBondContact O-CB 3.03Å; S221-D224 PolarHBondContact O-N 3.21Å; S221-D224 PolarHBondContact OG-N 2.8Å; S221-D224 PolarHBondContact OG-OD2 3.01Å; S221-F225 PolarHBondContact O-N 3.29Å
222	D	51.1	Low	46	Very low	90 Å²	90	76.1 Å²	76.1	48%	0.481	44%	0.441	S	S	.	.	H	α-helix	trans	-57.7	-31.3	174.9	-67.8	-37.8	0	0	0	111	F225 E226	D222-F225 PolarHBondContact O-N 2.79Å; D222-E226 PolarHBondContact O-N 3.31Å
223	D	54.6	Low	47.1	Very low	122 Å²	122	72.4 Å²	72.4	65%	0.652	42%	0.42	S	S	*	.	H	α-helix	trans	-63.1	-41.2	173.2	-65	-32.2	0	0	0	112.4	S221 F225 E226 Q227	S221-D223 PolarHBondContact O-N 3.5Å; D223-F225 VanDerWaalsContact C-N 3.27Å; D223-F225 PolarHBondContact O-N 3.24Å; D223-E226 PolarHBondContact O-N 2.86Å; D223-Q227 VanDerWaalsContact O-CB 3.29Å; D223-Q227 WeakPolarHBondContact O-CB 3.08Å; D223-Q227 PolarHBondContact O-N 2.87Å
224	D	61.8	Low	48.1	Very low	65 Å²	65	70.5 Å²	70.5	35%	0.348	41%	0.414	S	S	.	.	H	α-helix	trans	-62.6	-37.1	176.6	-64.3	-41.9	0	0	0	111.1	T220 S221 T228	T220-D224 WeakPolarHBondContact CA-OD2 2.72Å; S221-D224 PolarHBondContact N-OD2 3.15Å; S221-D224 WeakPolarHBondContact O-CB 3.03Å; S221-D224 PolarHBondContact O-N 3.21Å; S221-D224 PolarHBondContact OG-N 2.8Å; S221-D224 PolarHBondContact OG-OD2 3.01Å; D224-T228 WeakPolarHBondContact O-CB 3.45Å; D224-T228 PolarHBondContact O-N 3.15Å; D224-T228 PolarHBondContact O-OG1 3.41Å
225	F	57.3	Low	49	Very low	5 Å²	5	71.5 Å²	71.5	2%	0.022	41%	0.412	C	S	.	.	H	α-helix	trans	-71	-46.4	178.8	177.4	-101.5	0	0	0	111.9	L175 L178 Q179 S221 D222 D223 Q227 T228 L229 L247	L175-F225 HydrophobicContact CD1-CD1 3.5Å; L175-F225 VanDerWaalsContact CD1-CD1 3.5Å; L175-F225 HydrophobicContact CD1-CE1 3.31Å; L175-F225 HydrophobicContact CD1-CE2 4.44Å; L175-F225 HydrophobicContact CD1-CG 4.17Å; L175-F225 HydrophobicContact CD1-CZ 3.83Å; L175-F225 HydrophobicContact CG-CD1 4.23Å; L175-F225 HydrophobicContact CG-CE1 4.33Å; L175-F225 HydrophobicContact CG-CG 4.44Å; L178-F225 HydrophobicContact CD2-CZ 4.2Å; L178-F225 HydrophobicContact CG-CZ 4.48Å; Q179-F225 HydrophobicContact CB-CD2 3.71Å; Q179-F225 HydrophobicContact CB-CE2 3.48Å; Q179-F225 VanDerWaalsContact CB-CE2 3.48Å; Q179-F225 HydrophobicContact CG-CD2 3.64Å; Q179-F225 HydrophobicContact CG-CE2 3.82Å; S221-F225 PolarHBondContact O-N 3.29Å; D222-F225 PolarHBondContact O-N 2.79Å; D223-F225 VanDerWaalsContact C-N 3.27Å; D223-F225 PolarHBondContact O-N 3.24Å; F225-Q227 VanDerWaalsContact C-N 3.33Å; F225-Q227 PolarHBondContact O-N 2.79Å; F225-T228 PolarHBondContact O-N 2.77Å; F225-L229 HydrophobicContact CE1-CD2 4.3Å; F225-L229 HydrophobicContact CZ-CD2 4.36Å; F225-L229 WeakPolarHBondContact O-CB 3.19Å; F225-L229 PolarHBondContact O-N 3.33Å; F225-L247 HydrophobicContact CD1-CD1 3.41Å; F225-L247 VanDerWaalsContact CD1-CD1 3.41Å; F225-L247 HydrophobicContact CD1-CD2 4.09Å; F225-L247 HydrophobicContact CD1-CG 4.33Å; F225-L247 HydrophobicContact CE1-CD1 3.76Å; F225-L247 HydrophobicContact CE1-CD2 4.08Å; F225-L247 HydrophobicContact CE1-CG 4.38Å
226	E	54.2	Low	49.6	Very low	48 Å²	48	65.8 Å²	65.8	22%	0.224	39%	0.393	C	S	.	.	H	α-helix	trans	-58.4	-46.6	175.3	-178.8	169.9	147.5	0	0	111.1	D222 D223 L229 N230 L247	D222-E226 PolarHBondContact O-N 3.31Å; D223-E226 PolarHBondContact O-N 2.86Å; E226-L229 PolarHBondContact O-N 2.78Å; E226-N230 WeakPolarHBondContact CG-ND2 3.3Å; E226-N230 WeakPolarHBondContact O-CB 3.26Å; E226-N230 PolarHBondContact O-N 3.48Å; E226-N230 PolarHBondContact O-ND2 2.91Å; E226-N230 VanDerWaalsContact O-ND2 3.1Å; E226-L247 HydrophobicContact CB-CD1 3.84Å; E226-L247 HydrophobicContact CG-CD1 4.49Å; E226-L247 PolarHBondContact OE2-N 3.41Å; E226-L247 VanDerWaalsContact OE2-N 3.15Å
227	Q	59	Low	50.6	Low	130 Å²	130	63.1 Å²	63.1	61%	0.607	37%	0.371	S	S	*	.	H	α-helix	trans	-65	-40.6	178.8	-169.9	175.7	5.6	0	0	111.7	D223 F225 L229 N230 T231	D223-Q227 VanDerWaalsContact O-CB 3.29Å; D223-Q227 WeakPolarHBondContact O-CB 3.08Å; D223-Q227 PolarHBondContact O-N 2.87Å; F225-Q227 VanDerWaalsContact C-N 3.33Å; F225-Q227 PolarHBondContact O-N 2.79Å; Q227-L229 VanDerWaalsContact C-N 3.34Å; Q227-N230 PolarHBondContact O-N 3.31Å; Q227-T231 WeakPolarHBondContact O-CB 3.31Å; Q227-T231 PolarHBondContact O-N 3.39Å; Q227-T231 PolarHBondContact O-OG1 3Å
228	T	55.8	Low	51.3	Low	30 Å²	30	63.6 Å²	63.6	18%	0.184	36%	0.357	C	S	.	.	H	α-helix	trans	-61.8	-43.4	175.1	-63.7	0	0	0	0	111.1	D224 F225 T231 L232	D224-T228 WeakPolarHBondContact O-CB 3.45Å; D224-T228 PolarHBondContact O-N 3.15Å; D224-T228 PolarHBondContact O-OG1 3.41Å; F225-T228 PolarHBondContact O-N 2.77Å; T228-T231 PolarHBondContact O-N 2.82Å; T228-L232 WeakPolarHBondContact O-CB 3.37Å; T228-L232 PolarHBondContact O-N 3.27Å
229	L	57.7	Low	51.7	Low	5 Å²	5	69.2 Å²	69.2	3%	0.026	37%	0.369	C	S	.	.	H	α-helix	trans	-69.1	-41.3	-179.5	-173.9	58.9	0	0	0	112.1	L182 F225 E226 Q227 T231 L232 L233 A245 L257	L182-L229 HydrophobicContact CD1-CD1 3.59Å; F225-L229 HydrophobicContact CE1-CD2 4.3Å; F225-L229 HydrophobicContact CZ-CD2 4.36Å; F225-L229 WeakPolarHBondContact O-CB 3.19Å; F225-L229 PolarHBondContact O-N 3.33Å; E226-L229 PolarHBondContact O-N 2.78Å; Q227-L229 VanDerWaalsContact C-N 3.34Å; L229-T231 VanDerWaalsContact C-N 3.34Å; L229-L232 WeakPolarHBondContact O-CB 3.4Å; L229-L232 PolarHBondContact O-N 3.35Å; L229-L233 HydrophobicContact CG-CD1 4.45Å; L229-L233 WeakPolarHBondContact O-CB 3.31Å; L229-L233 WeakPolarHBondContact O-CG 3.34Å; L229-L233 PolarHBondContact O-N 3.15Å; L229-A245 HydrophobicContact CB-CB 4.23Å; L229-A245 HydrophobicContact CD2-CB 3.4Å; L229-A245 VanDerWaalsContact CD2-CB 3.4Å; L229-A245 HydrophobicContact CG-CB 3.58Å; L229-L257 HydrophobicContact CD2-CD1 3.26Å; L229-L257 HydrophobicContact CD2-CD2 3.53Å; L229-L257 HydrophobicContact CD2-CG 3.99Å
230	N	54.7	Low	52.1	Low	23 Å²	23	60.1 Å²	60.1	12%	0.123	33%	0.328	C	S	.	.	H	α-helix	trans	-61.2	-43.2	173	-82	-46.8	0	0	0	111.7	E226 Q227 L232 L233 L234 R244 A245	E226-N230 WeakPolarHBondContact CG-ND2 3.3Å; E226-N230 WeakPolarHBondContact O-CB 3.26Å; E226-N230 PolarHBondContact O-N 3.48Å; E226-N230 PolarHBondContact O-ND2 2.91Å; E226-N230 VanDerWaalsContact O-ND2 3.1Å; Q227-N230 PolarHBondContact O-N 3.31Å; N230-L232 VanDerWaalsContact C-N 3.31Å; N230-L232 PolarHBondContact O-N 2.82Å; N230-L233 PolarHBondContact O-N 2.83Å; N230-L234 WeakPolarHBondContact O-CB 3.24Å; N230-L234 VanDerWaalsContact O-CG 3.31Å; N230-L234 WeakPolarHBondContact O-CG 3.2Å; N230-L234 PolarHBondContact O-N 3Å; N230-R244 WeakPolarHBondContact OD1-CG 3.28Å; N230-A245 PolarHBondContact ND2-O 3.47Å; N230-A245 PolarHBondContact OD1-N 3.25Å; N230-A245 PolarHBondContact OD1-O 2.81Å; N230-A245 VanDerWaalsContact OD1-O 3.12Å
231	T	58.1	Low	51.9	Low	48 Å²	48	58.8 Å²	58.8	29%	0.294	32%	0.321	S	S	.	.	H	α-helix	trans	-61.9	-41	175	-55.5	0	0	0	0	111.2	F210 Q227 T228 L229 N235	F210-T231 HydrophobicContact CZ-CG2 4.43Å; Q227-T231 WeakPolarHBondContact O-CB 3.31Å; Q227-T231 PolarHBondContact O-N 3.39Å; Q227-T231 PolarHBondContact O-OG1 3Å; T228-T231 PolarHBondContact O-N 2.82Å; L229-T231 VanDerWaalsContact C-N 3.34Å; T231-N235 WeakPolarHBondContact O-CB 3.38Å; T231-N235 PolarHBondContact O-N 3.32Å; T231-N235 PolarHBondContact O-ND2 3.03Å
232	L	54.7	Low	51.6	Low	21 Å²	21	57.1 Å²	57.1	11%	0.11	31%	0.311	C	S	.	.	H	α-helix	trans	-65.7	-40.8	177.2	-171.4	150	0	0	0	112.2	L182 V186 T228 L229 N230 N235 C236	L182-L232 HydrophobicContact CB-CD1 4.14Å; V186-L232 HydrophobicContact CB-CD1 4.45Å; V186-L232 HydrophobicContact CG2-CD1 3.56Å; V186-L232 HydrophobicContact CG2-CD2 4.06Å; V186-L232 HydrophobicContact CG2-CG 3.78Å; T228-L232 WeakPolarHBondContact O-CB 3.37Å; T228-L232 PolarHBondContact O-N 3.27Å; L229-L232 WeakPolarHBondContact O-CB 3.4Å; L229-L232 PolarHBondContact O-N 3.35Å; N230-L232 VanDerWaalsContact C-N 3.31Å; N230-L232 PolarHBondContact O-N 2.82Å; L232-N235 PolarHBondContact O-N 2.95Å; L232-C236 WeakPolarHBondContact O-CB 3.24Å; L232-C236 PolarHBondContact O-N 3.36Å; L232-C236 PolarHBondContact O-SG 2.91Å
233	L	52.5	Low	51.5	Low	14 Å²	14	53.2 Å²	53.2	7%	0.073	29%	0.29	C	S	.	.	H	α-helix	trans	-64.7	-46.7	175.7	-75.1	172.1	0	0	0	111.6	L229 N230 N235 C236 Q237 A245 I259	L229-L233 HydrophobicContact CG-CD1 4.45Å; L229-L233 WeakPolarHBondContact O-CB 3.31Å; L229-L233 WeakPolarHBondContact O-CG 3.34Å; L229-L233 PolarHBondContact O-N 3.15Å; N230-L233 PolarHBondContact O-N 2.83Å; L233-N235 VanDerWaalsContact C-N 3.28Å; L233-N235 PolarHBondContact O-N 3.38Å; L233-C236 PolarHBondContact O-N 3.38Å; L233-Q237 PolarHBondContact O-N 3.15Å; L233-A245 HydrophobicContact CD1-CB 3.54Å; L233-I259 HydrophobicContact CD1-CG2 3.89Å; L233-I259 HydrophobicContact CD2-CG2 4.22Å
234	L	53.6	Low	51.3	Low	90 Å²	90	53.5 Å²	53.5	47%	0.471	28%	0.282	S	S	.	.	H	α-helix	trans	-59.2	-39.5	176.4	-73.6	168.2	0	0	0	111.9	N230 Q237 P238	N230-L234 WeakPolarHBondContact O-CB 3.24Å; N230-L234 VanDerWaalsContact O-CG 3.31Å; N230-L234 WeakPolarHBondContact O-CG 3.2Å; N230-L234 PolarHBondContact O-N 3Å; L234-Q237 CarbonylContact O-C 3.28Å; L234-Q237 VanDerWaalsContact O-C 3.28Å; L234-P238 WeakPolarHBondContact O-CA 3.46Å
235	N	49.1	Very low	50.9	Low	74 Å²	74	50.4 Å²	50.4	40%	0.396	27%	0.266	S	S	.	.	H	α-helix	trans	-72.7	-34.3	178	-71.2	-32.7	0	0	0	113.2	W207 T231 L232 L233	W207-N235 HydrophobicContact CE3-CB 4.29Å; W207-N235 HydrophobicContact CZ3-CB 3.77Å; W207-N235 VanDerWaalsContact CZ3-CG 3.41Å; T231-N235 WeakPolarHBondContact O-CB 3.38Å; T231-N235 PolarHBondContact O-N 3.32Å; T231-N235 PolarHBondContact O-ND2 3.03Å; L232-N235 PolarHBondContact O-N 2.95Å; L233-N235 VanDerWaalsContact C-N 3.28Å; L233-N235 PolarHBondContact O-N 3.38Å
236	C	42.7	Very low	50.6	Low	51 Å²	51	53 Å²	53	35%	0.345	28%	0.276	S	S	.	.	H	α-helix	trans	-77.8	-26.1	177.3	-70.1	0	0	0	0	112.8	L232 L233	L232-C236 WeakPolarHBondContact O-CB 3.24Å; L232-C236 PolarHBondContact O-N 3.36Å; L232-C236 PolarHBondContact O-SG 2.91Å; L233-C236 PolarHBondContact O-N 3.38Å
237	Q	47.5	Very low	50.5	Low	39 Å²	39	52.4 Å²	52.4	18%	0.182	27%	0.274	C	S	.	.			trans	-134.8	75.3	-180	-65.2	-170.5	-27.3	0	0	110.5	L233 L234 H239 A240 S243	L233-Q237 PolarHBondContact O-N 3.15Å; L234-Q237 CarbonylContact O-C 3.28Å; L234-Q237 VanDerWaalsContact O-C 3.28Å; Q237-H239 PolarHBondContact O-N 3.48Å; Q237-A240 HydrophobicContact CB-CB 3.58Å; Q237-A240 HydrophobicContact CG-CB 4.43Å; Q237-A240 PolarHBondContact O-N 3.21Å; Q237-S243 PolarHBondContact OE1-OG 3.49Å; Q237-S243 VanDerWaalsContact OE1-OG 3.1Å
238	P	41.8	Very low	49.9	Very low	102 Å²	102	47.5 Å²	47.5	66%	0.662	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-17.8	178.9	23.2	-32.8	0	0	0	113.2	L234	L234-P238 WeakPolarHBondContact O-CA 3.46Å
239	H	41	Very low	49.6	Very low	171 Å²	171	53 Å²	53	79%	0.792	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-3.8	175.8	-60.7	-52.1	0	0	0	114.3	Q237	Q237-H239 PolarHBondContact O-N 3.48Å
240	A	45.3	Very low	48.7	Very low	7 Å²	7	55.3 Å²	55.3	6%	0.058	29%	0.294	C	S	.	.			trans	-107.7	62.8	-177.8	0	0	0	0	0	110.8	Q237 A242 S243	Q237-A240 HydrophobicContact CB-CB 3.58Å; Q237-A240 HydrophobicContact CG-CB 4.43Å; Q237-A240 PolarHBondContact O-N 3.21Å; A240-A242 PolarHBondContact O-N 3.42Å; A240-S243 WeakPolarHBondContact CB-OG 3.27Å; A240-S243 PolarHBondContact O-N 3.05Å
241	S	43.1	Very low	48.1	Very low	48 Å²	48	59.7 Å²	59.7	34%	0.336	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-9.2	174.2	55.5	0	0	0	0	114
242	A	47.1	Very low	47.3	Very low	17 Å²	17	62.1 Å²	62.1	14%	0.14	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.8	7.5	173.5	0	0	0	0	0	114.2	F162 A240 Q262	F162-A242 HydrophobicContact CE1-CB 4.12Å; A240-A242 PolarHBondContact O-N 3.42Å; A242-Q262 HydrophobicContact CB-CB 4.07Å; A242-Q262 HydrophobicContact CB-CG 4.48Å
243	S	49.7	Very low	46.7	Very low	7 Å²	7	67.2 Å²	67.2	5%	0.049	36%	0.355	C	S	.	.			trans	-82.1	122.6	170.9	-69.4	0	0	0	0	110	Q237 A240 M260 I261 Q262	Q237-S243 PolarHBondContact OE1-OG 3.49Å; Q237-S243 VanDerWaalsContact OE1-OG 3.1Å; A240-S243 WeakPolarHBondContact CB-OG 3.27Å; A240-S243 PolarHBondContact O-N 3.05Å; S243-M260 CarbonylContact C-O 3.41Å; S243-M260 WeakPolarHBondContact CA-O 3.29Å; S243-I261 WeakPolarHBondContact OG-CA 3.42Å; S243-Q262 PolarHBondContact OG-N 2.89Å
244	R	51	Low	46.2	Very low	129 Å²	129	69.2 Å²	69.2	49%	0.487	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	132.5	-177.8	-164.4	172	-177.8	154.6	0.2	110.7	N230 M260	N230-R244 WeakPolarHBondContact OD1-CG 3.28Å; R244-M260 PolarHBondContact N-O 3.44Å; R244-M260 PolarHBondContact O-N 3.47Å
245	A	52.5	Low	45.9	Very low	0 Å²	0	66.3 Å²	66.3	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	142.6	165.4	0	0	0	0	0	110.2	L229 N230 L233 L257 N258 I259	L229-A245 HydrophobicContact CB-CB 4.23Å; L229-A245 HydrophobicContact CD2-CB 3.4Å; L229-A245 VanDerWaalsContact CD2-CB 3.4Å; L229-A245 HydrophobicContact CG-CB 3.58Å; N230-A245 PolarHBondContact ND2-O 3.47Å; N230-A245 PolarHBondContact OD1-N 3.25Å; N230-A245 PolarHBondContact OD1-O 2.81Å; N230-A245 VanDerWaalsContact OD1-O 3.12Å; L233-A245 HydrophobicContact CD1-CB 3.54Å; A245-L257 HydrophobicContact CB-CD1 4.08Å; A245-N258 CarbonylContact C-O 3.49Å; A245-N258 VanDerWaalsContact CA-O 3.25Å; A245-N258 WeakPolarHBondContact CA-O 3.29Å; A245-I259 HydrophobicContact CB-CG1 4.27Å
246	Y	51.4	Low	45.9	Very low	58 Å²	58	63 Å²	63	23%	0.227	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	145	169.8	61.5	-83.7	0	0	0	109.6	F138 L164 N258	F138-Y246 HydrophobicContact CE1-CD1 4.16Å; F138-Y246 AromaticContact CE1-CE1 3.69Å; F138-Y246 HydrophobicContact CE1-CE1 3.69Å; F138-Y246 HydrophobicContact CZ-CE1 4.1Å; L164-Y246 HydrophobicContact CD1-CE1 4.24Å; Y246-N258 HydrophobicContact CD1-CB 3.79Å; Y246-N258 WeakPolarHBondContact CD1-O 3.45Å; Y246-N258 HydrophobicContact CD2-CB 3.84Å; Y246-N258 HydrophobicContact CE1-CB 3.31Å; Y246-N258 HydrophobicContact CE2-CB 3.39Å; Y246-N258 WeakPolarHBondContact CE2-ND2 3.35Å; Y246-N258 HydrophobicContact CG-CB 4.04Å; Y246-N258 PolarHBondContact N-O 3.3Å; Y246-N258 PolarHBondContact O-N 3.47Å; Y246-N258 WeakPolarHBondContact OH-CB 3.44Å
247	L	52.1	Low	46.5	Very low	37 Å²	37	60.6 Å²	60.6	19%	0.194	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	133	169	-73.1	103.9	0	0	0	109.9	L175 F225 E226 A255 C256 L257	L175-L247 HydrophobicContact CD1-CD2 3.52Å; F225-L247 HydrophobicContact CD1-CD1 3.41Å; F225-L247 VanDerWaalsContact CD1-CD1 3.41Å; F225-L247 HydrophobicContact CD1-CD2 4.09Å; F225-L247 HydrophobicContact CD1-CG 4.33Å; F225-L247 HydrophobicContact CE1-CD1 3.76Å; F225-L247 HydrophobicContact CE1-CD2 4.08Å; F225-L247 HydrophobicContact CE1-CG 4.38Å; E226-L247 HydrophobicContact CB-CD1 3.84Å; E226-L247 HydrophobicContact CG-CD1 4.49Å; E226-L247 PolarHBondContact OE2-N 3.41Å; E226-L247 VanDerWaalsContact OE2-N 3.15Å; L247-A255 HydrophobicContact CD2-CB 4.39Å; L247-C256 CarbonylContact C-O 3.43Å; L247-C256 WeakPolarHBondContact CA-O 3.25Å; L247-L257 HydrophobicContact CD1-CD1 4.33Å; L247-L257 HydrophobicContact CG-CD1 4.17Å
248	S	47.6	Very low	46.8	Very low	27 Å²	27	59.3 Å²	59.3	19%	0.189	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	137.4	170.2	61	0	0	0	0	108.8	C250 C256 N258	S248-C250 PolarHBondContact O-N 3.23Å; S248-C256 PolarHBondContact N-O 3.46Å; S248-C256 WeakPolarHBondContact O-CA 3.32Å; S248-C256 WeakPolarHBondContact O-CB 3.07Å; S248-C256 PolarHBondContact O-N 2.82Å; S248-C256 WeakPolarHBondContact OG-CB 3.34Å; S248-C256 PolarHBondContact OG-O 3.29Å; S248-N258 PolarHBondContact OG-ND2 2.84Å
249	Q	48.4	Very low	47.3	Very low	144 Å²	144	55 Å²	55	67%	0.673	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76	121.2	170.7	-165.8	169.2	10.6	0	0	108.9	R251 S252	Q249-R251 WeakPolarHBondContact CG-O 3.08Å; Q249-S252 PolarHBondContact NE2-O 3.21Å
250	C	39.3	Very low	47.8	Very low	55 Å²	55	47.2 Å²	47.2	37%	0.372	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	-36.2	179.4	-82.8	0	0	0	0	111.8	S248 M254 C256	S248-C250 PolarHBondContact O-N 3.23Å; C250-M254 HydrophobicContact CB-CB 4.44Å; C250-M254 PolarHBondContact N-O 2.96Å; C250-C256 HydrophobicContact CB-CB 4.2Å; C250-C256 WeakPolarHBondContact CB-SG 3.39Å; C250-C256 WeakPolarHBondContact SG-CB 3.13Å; C250-C256 CovalentContact SG-SG 2.02Å; C250-C256 PolarHBondContact SG-SG 2.98Å
251	R	41.5	Very low	48.1	Very low	114 Å²	114	47.1 Å²	47.1	43%	0.43	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	171.5	170.7	-63.9	-165.2	-174.4	178.5	-10.4	109.3	E17 Q249 N253 M254	E17-R251 IonicContact OE1-CZ 3.45Å; E17-R251 IonicContact OE1-NE 3.23Å; E17-R251 PolarHBondContact OE1-NE 3.47Å; E17-R251 IonicContact OE1-NH2 2.81Å; E17-R251 PolarHBondContact OE1-NH2 2.86Å; Q249-R251 WeakPolarHBondContact CG-O 3.08Å; R251-N253 PolarHBondContact O-N 3.23Å; R251-M254 HydrophobicContact CB-CB 4.35Å; R251-M254 HydrophobicContact CB-CE 3.69Å; R251-M254 VanDerWaalsContact CD-CE 3.4Å; R251-M254 HydrophobicContact CG-CE 3.63Å; R251-M254 PolarHBondContact N-O 3.31Å; R251-M254 PolarHBondContact O-N 2.85Å
252	S	41.9	Very low	48.4	Very low	100 Å²	100	46 Å²	46	70%	0.699	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-46.7	-32	-174.2	53.5	0	0	0	0	115	Q249	Q249-S252 PolarHBondContact NE2-O 3.21Å
253	N	42.5	Very low	48.2	Very low	128 Å²	128	46.1 Å²	46.1	68%	0.684	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-117.6	3	179.2	-64.3	-20.7	0	0	0	114.7	R251	R251-N253 PolarHBondContact O-N 3.23Å
254	M	41.3	Very low	47.7	Very low	55 Å²	55	47.3 Å²	47.3	27%	0.271	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	123.1	-175.6	-66.8	-166.8	-82.8	0	0	111.3	I168 L169 C250 R251	I168-M254 HydrophobicContact CG2-SD 4.27Å; L169-M254 WeakPolarHBondContact O-CA 3.2Å; C250-M254 HydrophobicContact CB-CB 4.44Å; C250-M254 PolarHBondContact N-O 2.96Å; R251-M254 HydrophobicContact CB-CB 4.35Å; R251-M254 HydrophobicContact CB-CE 3.69Å; R251-M254 VanDerWaalsContact CD-CE 3.4Å; R251-M254 HydrophobicContact CG-CE 3.63Å; R251-M254 PolarHBondContact N-O 3.31Å; R251-M254 PolarHBondContact O-N 2.85Å
255	A	46.4	Very low	46.9	Very low	29 Å²	29	50.7 Å²	50.7	24%	0.24	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	134.1	173.6	0	0	0	0	0	109.3	L169 L247	L169-A255 WeakPolarHBondContact CA-O 3.33Å; L169-A255 HydrophobicContact CB-CB 4.35Å; L169-A255 VanDerWaalsContact CB-O 3.24Å; L169-A255 WeakPolarHBondContact CB-O 3.05Å; L169-A255 PolarHBondContact N-O 3.45Å; L169-A255 PolarHBondContact O-N 3.11Å; L247-A255 HydrophobicContact CD2-CB 4.39Å
256	C	50.8	Low	45.9	Very low	4 Å²	4	55 Å²	55	3%	0.027	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	114	175.7	-75.1	0	0	0	0	109.1	L167 L247 S248 C250	L167-C256 CarbonylContact O-C 3.47Å; L167-C256 VanDerWaalsContact O-CA 3.23Å; L167-C256 WeakPolarHBondContact O-CA 3.11Å; L247-C256 CarbonylContact C-O 3.43Å; L247-C256 WeakPolarHBondContact CA-O 3.25Å; S248-C256 PolarHBondContact N-O 3.46Å; S248-C256 WeakPolarHBondContact O-CA 3.32Å; S248-C256 WeakPolarHBondContact O-CB 3.07Å; S248-C256 PolarHBondContact O-N 2.82Å; S248-C256 WeakPolarHBondContact OG-CB 3.34Å; S248-C256 PolarHBondContact OG-O 3.29Å; C250-C256 HydrophobicContact CB-CB 4.2Å; C250-C256 WeakPolarHBondContact CB-SG 3.39Å; C250-C256 WeakPolarHBondContact SG-CB 3.13Å; C250-C256 CovalentContact SG-SG 2.02Å; C250-C256 PolarHBondContact SG-SG 2.98Å
257	L	55.1	Low	45	Very low	1 Å²	1	56.7 Å²	56.7	1%	0.005	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	114	170.9	169.1	64.6	0	0	0	109.2	S166 L167 L169 L178 L229 A245 L247 I259	S166-L257 CarbonylContact C-O 3.58Å; S166-L257 WeakPolarHBondContact CA-O 3.42Å; L167-L257 HydrophobicContact CB-CB 4.12Å; L167-L257 HydrophobicContact CD1-CB 4.46Å; L167-L257 HydrophobicContact CD1-CD2 3.71Å; L167-L257 HydrophobicContact CD1-CG 4.16Å; L167-L257 PolarHBondContact N-O 3.22Å; L167-L257 PolarHBondContact O-N 3.22Å; L169-L257 HydrophobicContact CD1-CB 4.36Å; L178-L257 HydrophobicContact CD2-CD2 3.46Å; L178-L257 VanDerWaalsContact CD2-CD2 3.46Å; L229-L257 HydrophobicContact CD2-CD1 3.26Å; L229-L257 HydrophobicContact CD2-CD2 3.53Å; L229-L257 HydrophobicContact CD2-CG 3.99Å; A245-L257 HydrophobicContact CB-CD1 4.08Å; L247-L257 HydrophobicContact CD1-CD1 4.33Å; L247-L257 HydrophobicContact CG-CD1 4.17Å; L257-I259 HydrophobicContact CD1-CG1 4.21Å; L257-I259 HydrophobicContact CD2-CD1 4.09Å; L257-I259 HydrophobicContact CD2-CG1 4.29Å; L257-I259 HydrophobicContact CG-CD1 4.33Å; L257-I259 HydrophobicContact CG-CG1 4Å
258	N	52.5	Low	43.8	Very low	12 Å²	12	66.7 Å²	66.7	6%	0.064	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	124.5	176.6	-63.8	-67.6	0	0	0	109.9	L164 L165 S166 A245 Y246 S248	L164-N258 HydrophobicContact CD1-CB 4.21Å; L165-N258 CarbonylContact O-C 3.58Å; L165-N258 VanDerWaalsContact O-CA 3.29Å; L165-N258 WeakPolarHBondContact O-CA 3.33Å; S166-N258 VanDerWaalsContact CB-OD1 3.31Å; S166-N258 WeakPolarHBondContact CB-OD1 3.5Å; S166-N258 PolarHBondContact OG-OD1 2.84Å; A245-N258 CarbonylContact C-O 3.49Å; A245-N258 VanDerWaalsContact CA-O 3.25Å; A245-N258 WeakPolarHBondContact CA-O 3.29Å; Y246-N258 HydrophobicContact CD1-CB 3.79Å; Y246-N258 WeakPolarHBondContact CD1-O 3.45Å; Y246-N258 HydrophobicContact CD2-CB 3.84Å; Y246-N258 HydrophobicContact CE1-CB 3.31Å; Y246-N258 HydrophobicContact CE2-CB 3.39Å; Y246-N258 WeakPolarHBondContact CE2-ND2 3.35Å; Y246-N258 HydrophobicContact CG-CB 4.04Å; Y246-N258 PolarHBondContact N-O 3.3Å; Y246-N258 PolarHBondContact O-N 3.47Å; Y246-N258 WeakPolarHBondContact OH-CB 3.44Å; S248-N258 PolarHBondContact OG-ND2 2.84Å
259	I	52.9	Low	42.9	Very low	12 Å²	12	67 Å²	67	6%	0.062	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	107.5	179.2	-52.9	176.8	0	0	0	107.4	L165 L167 L233 A245 L257 I261	L165-I259 HydrophobicContact CB-CB 4.17Å; L165-I259 HydrophobicContact CD2-CB 4.31Å; L165-I259 HydrophobicContact CD2-CD1 4.08Å; L165-I259 PolarHBondContact N-O 2.64Å; L165-I259 PolarHBondContact O-N 3.37Å; L167-I259 HydrophobicContact CD1-CD1 4.12Å; L233-I259 HydrophobicContact CD1-CG2 3.89Å; L233-I259 HydrophobicContact CD2-CG2 4.22Å; A245-I259 HydrophobicContact CB-CG1 4.27Å; L257-I259 HydrophobicContact CD1-CG1 4.21Å; L257-I259 HydrophobicContact CD2-CD1 4.09Å; L257-I259 HydrophobicContact CD2-CG1 4.29Å; L257-I259 HydrophobicContact CG-CD1 4.33Å; L257-I259 HydrophobicContact CG-CG1 4Å; I259-I261 HydrophobicContact CG2-CD1 3.56Å; I259-I261 HydrophobicContact CG2-CG1 3.83Å
260	M	52.1	Low	42	Very low	7 Å²	7	65.6 Å²	65.6	3%	0.034	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	126.3	168.9	-170.9	173.3	-69.1	0	0	108.7	L135 F138 F162 Y163 L164 S243 R244	L135-M260 HydrophobicContact CD2-CE 3.97Å; F138-M260 HydrophobicContact CB-SD 4.47Å; F138-M260 HydrophobicContact CD1-CE 3.55Å; F138-M260 HydrophobicContact CD1-SD 3.76Å; F138-M260 HydrophobicContact CD2-CE 4.48Å; F138-M260 HydrophobicContact CE1-CE 3.52Å; F138-M260 HydrophobicContact CE1-SD 4.28Å; F138-M260 HydrophobicContact CE2-CE 4.44Å; F138-M260 HydrophobicContact CG-CE 4.05Å; F138-M260 HydrophobicContact CG-SD 4.22Å; F138-M260 HydrophobicContact CZ-CE 3.97Å; F162-M260 HydrophobicContact CD1-CG 4.14Å; F162-M260 HydrophobicContact CD1-SD 4.02Å; Y163-M260 CarbonylContact O-C 3.58Å; Y163-M260 VanDerWaalsContact O-CA 3.3Å; Y163-M260 WeakPolarHBondContact O-CA 3.49Å; L164-M260 HydrophobicContact CD1-CB 4.4Å; L164-M260 HydrophobicContact CD1-CE 4.44Å; S243-M260 CarbonylContact C-O 3.41Å; S243-M260 WeakPolarHBondContact CA-O 3.29Å; R244-M260 PolarHBondContact N-O 3.44Å; R244-M260 PolarHBondContact O-N 3.47Å
261	I	51.8	Low	41.7	Very low	6 Å²	6	65.5 Å²	65.5	3%	0.031	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	122.9	177.6	-76.5	159.6	0	0	0	110.5	F162 Y163 S243 I259 S263 P272	F162-I261 CarbonylContact C-O 3.49Å; F162-I261 WeakPolarHBondContact CA-O 3.41Å; Y163-I261 PolarHBondContact N-O 3.47Å; Y163-I261 PolarHBondContact O-N 3.21Å; S243-I261 WeakPolarHBondContact OG-CA 3.42Å; I259-I261 HydrophobicContact CG2-CD1 3.56Å; I259-I261 HydrophobicContact CG2-CG1 3.83Å; I261-S263 PolarHBondContact O-N 2.86Å; I261-P272 HydrophobicContact CB-CG 4.23Å; I261-P272 HydrophobicContact CD1-CB 3.25Å; I261-P272 HydrophobicContact CD1-CG 3.34Å; I261-P272 HydrophobicContact CG1-CG 4.36Å; I261-P272 HydrophobicContact CG2-CG 4.26Å
262	Q	48.2	Very low	41.6	Very low	23 Å²	23	60.9 Å²	60.9	11%	0.107	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	119.5	167.1	-174	-176.2	11.2	0	0	108	F160 F162 A242 S243	F160-Q262 HydrophobicContact CB-CG 4.47Å; F160-Q262 HydrophobicContact CD1-CG 3.98Å; F162-Q262 HydrophobicContact CD1-CB 4.37Å; F162-Q262 HydrophobicContact CE1-CB 4.13Å; F162-Q262 HydrophobicContact CE1-CG 4.23Å; F162-Q262 HydrophobicContact CZ-CG 4.48Å; A242-Q262 HydrophobicContact CB-CB 4.07Å; A242-Q262 HydrophobicContact CB-CG 4.48Å; S243-Q262 PolarHBondContact OG-N 2.89Å
263	S	43.7	Very low	41.4	Very low	20 Å²	20	59.8 Å²	59.8	14%	0.14	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	129.3	173.8	160.3	0	0	0	0	108.7	S161 Y163 I261	S161-S263 PolarHBondContact N-O 3.39Å; S161-S263 PolarHBondContact O-N 3.46Å; Y163-S263 VanDerWaalsContact CE2-CB 3.47Å; I261-S263 PolarHBondContact O-N 2.86Å
264	T	39.8	Very low	41.2	Very low	33 Å²	33	59.5 Å²	59.5	20%	0.202	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	135.4	162.5	62.5	0	0	0	0	106.4	I158 F160 S266 D267	I158-T264 HydrophobicContact CG2-CG2 4.23Å; F160-T264 HydrophobicContact CD1-CG2 3.92Å; F160-T264 HydrophobicContact CE1-CG2 3.89Å; T264-S266 VanDerWaalsContact CB-OG 3.3Å; T264-S266 WeakPolarHBondContact CB-OG 3.48Å; T264-S266 PolarHBondContact O-N 3.28Å; T264-S266 PolarHBondContact OG1-OG 3.39Å; T264-D267 PolarHBondContact O-N 3.46Å; T264-D267 PolarHBondContact OG1-OD2 2.82Å
265	W	33.8	Very low	41.1	Very low	200 Å²	200	60 Å²	60	76%	0.758	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-11.2	178.6	-84.4	64.2	0	0	0	113.7	S161	S161-W265 VanDerWaalsContact OG-CD1 3.29Å; S161-W265 PolarHBondContact OG-NE1 2.78Å
266	S	30.1	Very low	40.9	Very low	90 Å²	90	59 Å²	59	63%	0.629	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-16.8	170.8	35.4	0	0	0	0	115.9	T264 R268	T264-S266 VanDerWaalsContact CB-OG 3.3Å; T264-S266 WeakPolarHBondContact CB-OG 3.48Å; T264-S266 PolarHBondContact O-N 3.28Å; T264-S266 PolarHBondContact OG1-OG 3.39Å; S266-R268 PolarHBondContact O-N 2.84Å
267	D	32.3	Very low	40.3	Very low	94 Å²	94	61.9 Å²	61.9	50%	0.503	31%	0.312	S	S	.	.			trans	-79.9	66.2	-179.2	-70.5	-46	0	0	0	111.7	T264 G269	T264-D267 PolarHBondContact O-N 3.46Å; T264-D267 PolarHBondContact OG1-OD2 2.82Å; D267-G269 PolarHBondContact O-N 2.81Å
268	R	27.3	Very low	39.4	Very low	246 Å²	246	66.8 Å²	66.8	93%	0.928	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	8.6	176.6	-73.7	-176	172.8	178.9	-0.9	115.2	S266	S266-R268 PolarHBondContact O-N 2.84Å
269	G	28.4	Very low	38.9	Very low	34 Å²	34	67.1 Å²	67.1	35%	0.351	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.8	-32.3	-168.1	0	0	0	0	0	116.5	D267	D267-G269 PolarHBondContact O-N 2.81Å
270	F	30.3	Very low	38.2	Very low	114 Å²	114	71 Å²	71	50%	0.5	36%	0.359	S	S	.	.			trans	-130.4	68.1	-163.9	-81.4	-91.3	0	0	0	111.6	P272	F270-P272 WeakPolarHBondContact O-CD 3.25Å
271	C	34.1	Very low	37.5	Very low	54 Å²	54	75.7 Å²	75.7	37%	0.365	38%	0.384	S	S	.	.			trans	-70.7	128.7	164.5	-162.3	0	0	0	0	108.2	L273 K274	C271-L273 HydrophobicContact CB-CB 4.37Å; C271-L273 PolarHBondContact O-N 3.39Å; C271-L273 VanDerWaalsContact SG-CB 3.58Å; C271-K274 WeakPolarHBondContact O-CA 3.34Å; C271-K274 VanDerWaalsContact O-CB 3.24Å; C271-K274 WeakPolarHBondContact O-CB 3.26Å; C271-K274 PolarHBondContact O-N 3.21Å
272	P	37.8	Very low	36.9	Very low	16 Å²	16	80.6 Å²	80.6	10%	0.104	41%	0.411	C	S	.	.	H	α-helix	trans	-49.3	-29.8	167.7	8.8	-23.4	0	0	0	113.5	L165 I261 F270 K274 L275 L276	L165-P272 HydrophobicContact CD2-CB 3.93Å; I261-P272 HydrophobicContact CB-CG 4.23Å; I261-P272 HydrophobicContact CD1-CB 3.25Å; I261-P272 HydrophobicContact CD1-CG 3.34Å; I261-P272 HydrophobicContact CG1-CG 4.36Å; I261-P272 HydrophobicContact CG2-CG 4.26Å; F270-P272 WeakPolarHBondContact O-CD 3.25Å; P272-K274 PolarHBondContact O-N 3.29Å; P272-L275 WeakPolarHBondContact O-CA 3.33Å; P272-L275 VanDerWaalsContact O-CB 3.26Å; P272-L275 WeakPolarHBondContact O-CB 3.46Å; P272-L275 PolarHBondContact O-N 2.86Å; P272-L276 PolarHBondContact O-N 3.36Å
273	L	38	Very low	36.3	Very low	77 Å²	77	85.4 Å²	85.4	40%	0.403	44%	0.444	S	S	.	.	H	α-helix	trans	-60.2	-27.8	172.6	-59.5	173	0	0	0	113	L165 C271 S277 P292	L165-L273 HydrophobicContact CD1-CD2 4.31Å; C271-L273 HydrophobicContact CB-CB 4.37Å; C271-L273 PolarHBondContact O-N 3.39Å; C271-L273 VanDerWaalsContact SG-CB 3.58Å; L273-S277 WeakPolarHBondContact O-CA 2.89Å; L273-S277 WeakPolarHBondContact O-CB 3.3Å; L273-S277 PolarHBondContact O-N 3.49Å; L273-S277 PolarHBondContact O-OG 3.37Å; L273-P292 HydrophobicContact CD2-CB 4.12Å
274	K	38.4	Very low	35.9	Very low	123 Å²	123	88.1 Å²	88.1	54%	0.535	46%	0.463	S	S	.	.	H	α-helix	trans	-76.1	-25.4	172.2	-115.5	-178	-173.2	178	0	112.8	C271 P272 S277	C271-K274 WeakPolarHBondContact O-CA 3.34Å; C271-K274 VanDerWaalsContact O-CB 3.24Å; C271-K274 WeakPolarHBondContact O-CB 3.26Å; C271-K274 PolarHBondContact O-N 3.21Å; P272-K274 PolarHBondContact O-N 3.29Å; K274-S277 PolarHBondContact O-OG 3.43Å
275	L	39.9	Very low	35.8	Very low	65 Å²	65	94.7 Å²	94.7	34%	0.34	49%	0.488	S	S	.	.	H	α-helix	trans	-74.6	-41.7	173.4	-144.5	107.9	0	0	0	109.2	L182 P272	L182-L275 HydrophobicContact CD2-CD2 4.01Å; P272-L275 WeakPolarHBondContact O-CA 3.33Å; P272-L275 VanDerWaalsContact O-CB 3.26Å; P272-L275 WeakPolarHBondContact O-CB 3.46Å; P272-L275 PolarHBondContact O-N 2.86Å
276	L	41.3	Very low	35.8	Very low	7 Å²	7	86.9 Å²	86.9	4%	0.037	47%	0.47	C	S	.	.	H	α-helix	trans	-78.6	-34.6	178	-64.6	-171.7	0	0	0	115.1	L165 L167 P272 K278 I279 I290	L165-L276 HydrophobicContact CD1-CD1 3.31Å; L165-L276 HydrophobicContact CD2-CD1 3.14Å; L165-L276 HydrophobicContact CD2-CD2 4.24Å; L165-L276 HydrophobicContact CD2-CG 3.71Å; L165-L276 HydrophobicContact CG-CD1 3.58Å; L167-L276 HydrophobicContact CD1-CD1 4.41Å; L167-L276 HydrophobicContact CD1-CD2 3.81Å; L167-L276 HydrophobicContact CD2-CD1 3.86Å; L167-L276 HydrophobicContact CD2-CD2 4.04Å; L167-L276 HydrophobicContact CG-CD1 4.35Å; L167-L276 HydrophobicContact CG-CD2 4.47Å; P272-L276 PolarHBondContact O-N 3.36Å; L276-K278 PolarHBondContact O-N 2.96Å; L276-I279 HydrophobicContact CD2-CD1 3.43Å; L276-I279 VanDerWaalsContact CD2-CD1 3.43Å; L276-I279 VanDerWaalsContact O-CB 3.28Å; L276-I279 WeakPolarHBondContact O-CB 3.34Å; L276-I279 PolarHBondContact O-N 3.22Å; L276-I290 HydrophobicContact CB-CD1 4.08Å; L276-I290 HydrophobicContact CD1-CD1 4.39Å; L276-I290 HydrophobicContact CD1-CG1 4.39Å; L276-I290 HydrophobicContact CD1-CG2 3.64Å
277	S	38.1	Very low	36.2	Very low	66 Å²	66	85.5 Å²	85.5	46%	0.462	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-17.9	177.1	71.6	0	0	0	0	112.3	L273 K274	L273-S277 WeakPolarHBondContact O-CA 2.89Å; L273-S277 WeakPolarHBondContact O-CB 3.3Å; L273-S277 PolarHBondContact O-N 3.49Å; L273-S277 PolarHBondContact O-OG 3.37Å; K274-S277 PolarHBondContact O-OG 3.43Å
278	K	36.8	Very low	36.3	Very low	104 Å²	104	82.8 Å²	82.8	45%	0.452	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-6	174.6	-69.4	-175.4	176	-169.4	0	113.4	R185 L276	R185-K278 PolarHBondContact NH2-O 3.49Å; L276-K278 PolarHBondContact O-N 2.96Å
279	I	40.9	Very low	36.9	Very low	19 Å²	19	73 Å²	73	10%	0.097	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-31.4	171.7	-60.4	-178.5	0	0	0	109.7	L178 I181 L276 D281	L178-I279 HydrophobicContact CD1-CD1 3.76Å; I181-I279 HydrophobicContact CD1-CG2 4.19Å; I181-I279 HydrophobicContact CG2-CG1 4.26Å; L276-I279 HydrophobicContact CD2-CD1 3.43Å; L276-I279 VanDerWaalsContact CD2-CD1 3.43Å; L276-I279 VanDerWaalsContact O-CB 3.28Å; L276-I279 WeakPolarHBondContact O-CB 3.34Å; L276-I279 PolarHBondContact O-N 3.22Å; I279-D281 PolarHBondContact O-N 3.45Å
280	V	38.8	Very low	37.5	Very low	93 Å²	93	74.1 Å²	74.1	56%	0.564	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-11.4	-178.8	-174.2	0	0	0	0	113.6	N282 I290	V280-N282 PolarHBondContact O-N 3.42Å; V280-I290 HydrophobicContact CG2-CD1 4.22Å
281	D	37.6	Very low	37.9	Very low	106 Å²	106	72.7 Å²	72.7	57%	0.567	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-5.9	179.6	-71.5	-28.8	0	0	0	114.1	R185 I279 P283	R185-D281 IonicContact NH2-OD2 3.47Å; R185-D281 PolarHBondContact NH2-OD2 2.96Å; I279-D281 PolarHBondContact O-N 3.45Å; D281-P283 WeakPolarHBondContact O-CD 3.41Å
282	N	39	Very low	38.1	Very low	108 Å²	108	73.7 Å²	73.7	58%	0.578	41%	0.414	S	S	*	.			trans	-119.1	78.9	170.4	-112.1	-11.7	0	0	0	110.5	V280 S284	V280-N282 PolarHBondContact O-N 3.42Å; N282-S284 PolarHBondContact O-N 3.36Å
283	P	36.1	Very low	38.1	Very low	124 Å²	124	77.7 Å²	77.7	81%	0.805	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	12.4	-174	29.7	-36.7	0	0	0	114.7	D281	D281-P283 WeakPolarHBondContact O-CD 3.41Å
284	S	35.3	Very low	38	Very low	77 Å²	77	79.8 Å²	79.8	54%	0.538	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	-9.5	-164.5	55.9	0	0	0	0	116.3	N282	N282-S284 PolarHBondContact O-N 3.36Å
285	K	38.1	Very low	37.6	Very low	171 Å²	171	76.1 Å²	76.1	74%	0.743	43%	0.429	S	S	*	.	S	Bend	trans	-144.8	-10.5	-167.5	-71.4	-167.6	177.5	-174.9	0	120.3
286	G	33.6	Very low	37.1	Very low	36 Å²	36	77.1 Å²	77.1	37%	0.371	44%	0.438	S	S	.	.			trans	-139.6	136.7	-179.4	0	0	0	0	0	114.3	V288	G286-V288 VanDerWaalsContact C-N 3.3Å; G286-V288 PolarHBondContact O-N 2.84Å
287	T	37.4	Very low	36.7	Very low	61 Å²	61	79.8 Å²	79.8	37%	0.374	45%	0.451	S	S	.	.			trans	-86	65.6	175.5	40	0	0	0	0	110.5	E170 A289	E170-T287 WeakPolarHBondContact OE2-CB 3.25Å; E170-T287 PolarHBondContact OE2-OG1 2.88Å; T287-A289 PolarHBondContact O-N 3.29Å
288	V	36.3	Very low	36.2	Very low	37 Å²	37	80.8 Å²	80.8	22%	0.224	45%	0.451	C	S	.	.			trans	-81.9	103.2	178.6	-175.6	0	0	0	0	110.1	L167 G286 I290	L167-V288 HydrophobicContact CD2-CG1 3.74Å; G286-V288 VanDerWaalsContact C-N 3.3Å; G286-V288 PolarHBondContact O-N 2.84Å; V288-I290 HydrophobicContact CG1-CG1 4.12Å
289	A	39.4	Very low	36	Very low	41 Å²	41	81.7 Å²	81.7	34%	0.339	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	117.5	167.9	0	0	0	0	0	109.7	I168 T287	I168-A289 HydrophobicContact CB-CB 4.44Å; I168-A289 PolarHBondContact N-O 3.39Å; T287-A289 PolarHBondContact O-N 3.29Å
290	I	41	Very low	35.4	Very low	58 Å²	58	82.5 Å²	82.5	30%	0.297	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	109.5	177.5	-57.5	169.8	0	0	0	108.5	L165 L167 L276 V280 V288 P292	L165-I290 HydrophobicContact CD1-CG2 4.05Å; L167-I290 HydrophobicContact CD2-CB 4.34Å; L167-I290 HydrophobicContact CD2-CG1 3.71Å; L167-I290 HydrophobicContact CD2-CG2 4.43Å; L276-I290 HydrophobicContact CB-CD1 4.08Å; L276-I290 HydrophobicContact CD1-CD1 4.39Å; L276-I290 HydrophobicContact CD1-CG1 4.39Å; L276-I290 HydrophobicContact CD1-CG2 3.64Å; V280-I290 HydrophobicContact CG2-CD1 4.22Å; V288-I290 HydrophobicContact CG1-CG1 4.12Å; I290-P292 WeakPolarHBondContact O-CD 3.32Å
291	E	38.2	Very low	35.2	Very low	84 Å²	84	79.7 Å²	79.7	39%	0.393	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	102.2	171.6	-72.5	-162.3	162.7	0	0	111	S166 K293	S166-E291 PolarHBondContact N-O 2.81Å; S166-E291 PolarHBondContact O-N 3.23Å; S166-E291 VanDerWaalsContact O-N 3.08Å; E291-K293 PolarHBondContact O-N 2.82Å; E291-K293 WeakPolarHBondContact OE2-CE 3.29Å; E291-K293 IonicContact OE2-NZ 2.81Å; E291-K293 PolarHBondContact OE2-NZ 2.85Å
292	P	37.8	Very low	35	Very low	74 Å²	74	76.9 Å²	76.9	48%	0.481	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	114.4	170.9	28.7	-31.2	0	0	0	110.3	L273 I290	L273-P292 HydrophobicContact CD2-CB 4.12Å; I290-P292 WeakPolarHBondContact O-CD 3.32Å
293	K	38.8	Very low	34.6	Very low	101 Å²	101	73.8 Å²	73.8	44%	0.439	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	110.9	173	-74.8	176.2	-179.4	153.6	0	110.2	L164 E291 V295	L164-K293 CarbonylContact C-O 3.57Å; L164-K293 PolarHBondContact N-O 3.47Å; L164-K293 CarbonylContact O-C 3.57Å; L164-K293 PolarHBondContact O-N 3.3Å; L164-K293 VanDerWaalsContact O-N 3.09Å; E291-K293 PolarHBondContact O-N 2.82Å; E291-K293 WeakPolarHBondContact OE2-CE 3.29Å; E291-K293 IonicContact OE2-NZ 2.81Å; E291-K293 PolarHBondContact OE2-NZ 2.85Å; K293-V295 PolarHBondContact O-N 3.32Å
294	L	34.7	Very low	34.4	Very low	120 Å²	120	73.6 Å²	73.6	63%	0.628	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.7	113.6	172.7	-174.6	73	0	0	0	109.1	Y163 V296	Y163-L294 HydrophobicContact CD1-CD1 4.01Å; Y163-L294 HydrophobicContact CE1-CD1 3.74Å; L294-V296 HydrophobicContact CD2-CG2 3.93Å; L294-V296 HydrophobicContact CG-CG2 4.02Å
295	V	31.5	Very low	34.4	Very low	47 Å²	47	72.9 Å²	72.9	29%	0.285	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	100.7	175.7	-179.6	0	0	0	0	109	L164 K293 I297	L164-V295 HydrophobicContact CB-CB 4.37Å; L164-V295 HydrophobicContact CB-CG2 3.52Å; L164-V295 HydrophobicContact CD2-CG2 4.02Å; L164-V295 HydrophobicContact CG-CG2 4.44Å; K293-V295 PolarHBondContact O-N 3.32Å; V295-I297 HydrophobicContact CG1-CG1 4.27Å; V295-I297 PolarHBondContact O-N 3.4Å
296	V	28.7	Very low	34.4	Very low	86 Å²	86	67.8 Å²	67.8	52%	0.521	40%	0.397	S	S	.	.			trans	-86.3	107	174.6	-176.6	0	0	0	0	109.1	L294 L298	L294-V296 HydrophobicContact CD2-CG2 3.93Å; L294-V296 HydrophobicContact CG-CG2 4.02Å; V296-L298 HydrophobicContact CG1-CD1 4.1Å; V296-L298 HydrophobicContact CG1-CG 4.09Å; V296-L298 PolarHBondContact O-N 2.93Å
297	I	32.6	Very low	34.4	Very low	62 Å²	62	69.3 Å²	69.3	32%	0.318	40%	0.399	S	S	.	.			trans	-85.3	104.7	171.9	-52.1	174.4	0	0	0	108.4	L135 F162 V295	L135-I297 HydrophobicContact CD1-CD1 3.2Å; L135-I297 HydrophobicContact CD1-CG1 3.69Å; F162-I297 HydrophobicContact CB-CD1 4.19Å; F162-I297 HydrophobicContact CD2-CD1 3.39Å; F162-I297 HydrophobicContact CD2-CG1 4.13Å; F162-I297 HydrophobicContact CE2-CD1 3.82Å; F162-I297 HydrophobicContact CG-CD1 3.8Å; V295-I297 HydrophobicContact CG1-CG1 4.27Å; V295-I297 PolarHBondContact O-N 3.4Å
298	L	28.8	Very low	34.4	Very low	88 Å²	88	75.3 Å²	75.3	46%	0.461	42%	0.415	S	S	.	.			trans	-97.1	126.2	171.1	-84.9	153	0	0	0	109.2	V296 C300 I310	V296-L298 HydrophobicContact CG1-CD1 4.1Å; V296-L298 HydrophobicContact CG1-CG 4.09Å; V296-L298 PolarHBondContact O-N 2.93Å; L298-C300 PolarHBondContact O-N 3.42Å; L298-I310 HydrophobicContact CB-CD1 4.06Å; L298-I310 HydrophobicContact CD1-CD1 3.46Å; L298-I310 VanDerWaalsContact CD1-CD1 3.46Å; L298-I310 HydrophobicContact CD1-CG1 4.03Å; L298-I310 HydrophobicContact CG-CD1 4.37Å
299	P	30.8	Very low	34.5	Very low	122 Å²	122	74.1 Å²	74.1	79%	0.792	41%	0.409	S	S	*	.			trans	-66.2	102.6	177.2	26.3	-32.3	0	0	0	108.9
300	C	28.6	Very low	34.5	Very low	37 Å²	37	74.1 Å²	74.1	25%	0.25	40%	0.403	C	S	.	.			trans	-113.6	125.1	179.8	-153.4	0	0	0	0	113.5	L298 F302 W306	L298-C300 PolarHBondContact O-N 3.42Å; C300-F302 PolarHBondContact O-N 3.01Å; C300-F302 VanDerWaalsContact O-N 3.13Å; C300-F302 PolarHBondContact SG-N 3.41Å; C300-W306 HydrophobicContact CB-CB 3.66Å; C300-W306 HydrophobicContact CB-CG 3.93Å; C300-W306 WeakPolarHBondContact SG-CB 3.28Å
301	P	34.3	Very low	34.5	Very low	33 Å²	33	78.6 Å²	78.6	21%	0.214	42%	0.42	C	S	.	.	S	Bend	trans	-67.9	-0.6	168.2	25.5	-30.7	0	0	0	114.9	R128	R128-P301 VanDerWaalsContact CZ-CA 3.5Å; R128-P301 VanDerWaalsContact NH1-CA 3.33Å; R128-P301 VanDerWaalsContact NH2-CB 3.35Å; R128-P301 PolarHBondContact NH2-O 3.3Å
302	F	33.3	Very low	34.7	Very low	47 Å²	47	79 Å²	79	21%	0.206	43%	0.425	C	S	.	.	S	Bend	trans	-130.8	75.5	-179.2	-57.6	-79.4	0	0	0	109.6	V107 R108 F111 C300 N304 C305 W306	V107-F302 HydrophobicContact CG1-CE1 3.67Å; V107-F302 HydrophobicContact CG1-CZ 3.81Å; R108-F302 HydrophobicContact CB-CE2 4.11Å; R108-F302 HydrophobicContact CB-CZ 4.24Å; R108-F302 HydrophobicContact CG-CE2 4.31Å; F111-F302 HydrophobicContact CD2-CE1 4Å; F111-F302 HydrophobicContact CD2-CZ 4.29Å; F111-F302 HydrophobicContact CE2-CE1 4.13Å; F111-F302 HydrophobicContact CG-CE1 4.49Å; C300-F302 PolarHBondContact O-N 3.01Å; C300-F302 VanDerWaalsContact O-N 3.13Å; C300-F302 PolarHBondContact SG-N 3.41Å; F302-N304 PolarHBondContact O-N 3.19Å; F302-C305 HydrophobicContact CB-CB 3.96Å; F302-C305 PolarHBondContact O-N 2.91Å; F302-C305 VanDerWaalsContact O-N 3.14Å; F302-W306 PolarHBondContact O-N 2.95Å
303	G	31.2	Very low	34.9	Very low	43 Å²	43	79.5 Å²	79.5	44%	0.443	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-13.6	-167.3	0	0	0	0	0	117.6	T307	G303-T307 PolarHBondContact O-OG1 3.44Å
304	N	32.5	Very low	34.8	Very low	121 Å²	121	77.9 Å²	77.9	65%	0.647	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.6	-28.9	175.2	-75.1	-12.7	0	0	0	114.1	F302 T307 R308	F302-N304 PolarHBondContact O-N 3.19Å; N304-T307 VanDerWaalsContact CA-OG1 3.24Å; N304-T307 WeakPolarHBondContact CA-OG1 3.4Å; N304-T307 PolarHBondContact O-OG1 2.88Å; N304-R308 WeakPolarHBondContact O-CB 3.24Å; N304-R308 WeakPolarHBondContact O-CG 3.47Å; N304-R308 PolarHBondContact O-N 2.95Å
305	C	35.1	Very low	34.9	Very low	61 Å²	61	74.9 Å²	74.9	41%	0.412	41%	0.412	S	S	.	.	H	α-helix	trans	-74.4	-37.1	-179	-83.7	0	0	0	0	111.9	F100 F302 A309	F100-C305 HydrophobicContact CE1-CB 4.45Å; F100-C305 HydrophobicContact CZ-CB 3.8Å; F302-C305 HydrophobicContact CB-CB 3.96Å; F302-C305 PolarHBondContact O-N 2.91Å; F302-C305 VanDerWaalsContact O-N 3.14Å; C305-A309 PolarHBondContact O-N 3.43Å
306	W	38.2	Very low	35.2	Very low	65 Å²	65	74.2 Å²	74.2	25%	0.246	41%	0.407	C	S	.	.	H	α-helix	trans	-87.5	-32.8	-175.4	-142.2	-143.1	0	0	0	113.4	F97 F100 C300 F302 R308 A309 I310	F97-W306 AromaticContact CE2-CH2 3.45Å; F97-W306 HydrophobicContact CE2-CH2 3.45Å; F97-W306 VanDerWaalsContact CE2-CH2 3.45Å; F97-W306 AromaticContact CE2-CZ3 3.6Å; F97-W306 HydrophobicContact CE2-CZ3 3.6Å; F97-W306 AromaticContact CZ-CH2 3.47Å; F97-W306 HydrophobicContact CZ-CH2 3.47Å; F97-W306 VanDerWaalsContact CZ-CH2 3.47Å; F97-W306 HydrophobicContact CZ-CZ2 4.44Å; F97-W306 HydrophobicContact CZ-CZ3 4.12Å; F100-W306 HydrophobicContact CD1-CZ3 4.31Å; F100-W306 HydrophobicContact CE1-CE3 4.25Å; F100-W306 HydrophobicContact CE1-CZ3 4.32Å; C300-W306 HydrophobicContact CB-CB 3.66Å; C300-W306 HydrophobicContact CB-CG 3.93Å; C300-W306 WeakPolarHBondContact SG-CB 3.28Å; F302-W306 PolarHBondContact O-N 2.95Å; W306-R308 VanDerWaalsContact C-N 3.3Å; W306-R308 PolarHBondContact O-N 2.83Å; W306-A309 HydrophobicContact CD2-CB 4.33Å; W306-A309 HydrophobicContact CE3-CB 3.3Å; W306-A309 HydrophobicContact CZ3-CB 3.44Å; W306-A309 VanDerWaalsContact CZ3-CB 3.44Å; W306-A309 PolarHBondContact O-N 3.37Å; W306-I310 HydrophobicContact CG-CD1 4.44Å; W306-I310 WeakPolarHBondContact O-CB 3.48Å; W306-I310 WeakPolarHBondContact O-CD1 3.34Å; W306-I310 WeakPolarHBondContact O-CG1 3.43Å; W306-I310 PolarHBondContact O-N 3.46Å
307	T	34.1	Very low	35.7	Very low	68 Å²	68	75.1 Å²	75.1	42%	0.417	41%	0.405	S	S	.	.	H	α-helix	trans	-58.6	-41.6	163.8	28.6	0	0	0	0	111.4	G303 N304 K311	G303-T307 PolarHBondContact O-OG1 3.44Å; N304-T307 VanDerWaalsContact CA-OG1 3.24Å; N304-T307 WeakPolarHBondContact CA-OG1 3.4Å; N304-T307 PolarHBondContact O-OG1 2.88Å; T307-K311 VanDerWaalsContact O-CB 3.27Å; T307-K311 WeakPolarHBondContact O-CB 3.42Å; T307-K311 VanDerWaalsContact O-CG 3.29Å; T307-K311 WeakPolarHBondContact O-CG 3.15Å; T307-K311 PolarHBondContact O-N 2.86Å
308	R	36	Very low	35.8	Very low	186 Å²	186	76.1 Å²	76.1	70%	0.702	41%	0.411	S	S	*	.	H	α-helix	trans	-64.4	-46.2	172.5	-76.4	177.6	-171	-171.5	2.8	112.2	N304 W306 K311 L312	N304-R308 WeakPolarHBondContact O-CB 3.24Å; N304-R308 WeakPolarHBondContact O-CG 3.47Å; N304-R308 PolarHBondContact O-N 2.95Å; W306-R308 VanDerWaalsContact C-N 3.3Å; W306-R308 PolarHBondContact O-N 2.83Å; R308-K311 PolarHBondContact O-N 3.21Å; R308-L312 VanDerWaalsContact O-CB 3.28Å; R308-L312 WeakPolarHBondContact O-CB 3.46Å; R308-L312 PolarHBondContact O-N 2.97Å
309	A	37.8	Very low	36.2	Very low	13 Å²	13	76 Å²	76	11%	0.107	41%	0.41	C	S	.	.	H	α-helix	trans	-64.4	-39.1	177.6	0	0	0	0	0	113.3	C305 W306 L312 I313	C305-A309 PolarHBondContact O-N 3.43Å; W306-A309 HydrophobicContact CD2-CB 4.33Å; W306-A309 HydrophobicContact CE3-CB 3.3Å; W306-A309 HydrophobicContact CZ3-CB 3.44Å; W306-A309 VanDerWaalsContact CZ3-CB 3.44Å; W306-A309 PolarHBondContact O-N 3.37Å; A309-L312 CarbonylContact O-C 3.59Å; A309-L312 WeakPolarHBondContact O-CB 3.28Å; A309-L312 PolarHBondContact O-N 2.86Å; A309-I313 VanDerWaalsContact O-CG1 3.24Å; A309-I313 WeakPolarHBondContact O-CG1 3.41Å; A309-I313 PolarHBondContact O-N 3.43Å
310	I	40.7	Very low	36.4	Very low	40 Å²	40	73.5 Å²	73.5	21%	0.205	39%	0.389	C	S	.	.	H	α-helix	trans	-69.5	-43.8	175.7	-66.8	160.3	0	0	0	110.3	L298 W306 L312 I313 C314	L298-I310 HydrophobicContact CB-CD1 4.06Å; L298-I310 HydrophobicContact CD1-CD1 3.46Å; L298-I310 VanDerWaalsContact CD1-CD1 3.46Å; L298-I310 HydrophobicContact CD1-CG1 4.03Å; L298-I310 HydrophobicContact CG-CD1 4.37Å; W306-I310 HydrophobicContact CG-CD1 4.44Å; W306-I310 WeakPolarHBondContact O-CB 3.48Å; W306-I310 WeakPolarHBondContact O-CD1 3.34Å; W306-I310 WeakPolarHBondContact O-CG1 3.43Å; W306-I310 PolarHBondContact O-N 3.46Å; I310-L312 PolarHBondContact O-N 2.7Å; I310-I313 PolarHBondContact O-N 2.84Å; I310-I313 VanDerWaalsContact O-N 3.15Å; I310-C314 WeakPolarHBondContact O-CB 3.11Å; I310-C314 PolarHBondContact O-N 3.35Å; I310-C314 PolarHBondContact O-SG 2.97Å
311	K	41.2	Very low	36.6	Very low	152 Å²	152	73.8 Å²	73.8	66%	0.661	39%	0.392	S	S	*	.	H	α-helix	trans	-56.4	-39.1	170.8	-80.8	-176.7	177.5	-172.4	0	111.1	T307 R308 S315	T307-K311 VanDerWaalsContact O-CB 3.27Å; T307-K311 WeakPolarHBondContact O-CB 3.42Å; T307-K311 VanDerWaalsContact O-CG 3.29Å; T307-K311 WeakPolarHBondContact O-CG 3.15Å; T307-K311 PolarHBondContact O-N 2.86Å; R308-K311 PolarHBondContact O-N 3.21Å; K311-S315 WeakPolarHBondContact O-CB 3.37Å; K311-S315 PolarHBondContact O-N 3.42Å
312	L	41.6	Very low	36.3	Very low	94 Å²	94	72.9 Å²	72.9	49%	0.492	39%	0.389	S	S	.	.	H	α-helix	trans	-69.5	-42	176.8	-148.9	136.3	0	0	0	111.1	L93 R308 A309 I310 S315 M316	L93-L312 HydrophobicContact CD2-CD2 4.12Å; R308-L312 VanDerWaalsContact O-CB 3.28Å; R308-L312 WeakPolarHBondContact O-CB 3.46Å; R308-L312 PolarHBondContact O-N 2.97Å; A309-L312 CarbonylContact O-C 3.59Å; A309-L312 WeakPolarHBondContact O-CB 3.28Å; A309-L312 PolarHBondContact O-N 2.86Å; I310-L312 PolarHBondContact O-N 2.7Å; L312-S315 PolarHBondContact O-N 2.87Å; L312-M316 HydrophobicContact CD2-CE 4.07Å; L312-M316 HydrophobicContact CD2-CG 4.22Å; L312-M316 VanDerWaalsContact O-CB 3.25Å; L312-M316 WeakPolarHBondContact O-CB 3.31Å; L312-M316 WeakPolarHBondContact O-CG 3.49Å; L312-M316 PolarHBondContact O-N 3.43Å
313	I	42.7	Very low	36.3	Very low	83 Å²	83	75.7 Å²	75.7	43%	0.426	41%	0.412	S	S	.	.	H	α-helix	trans	-64.9	-43.3	174.9	-69	161.1	0	0	0	111.6	F97 A309 I310 M316 H317	F97-I313 HydrophobicContact CD2-CD1 4.28Å; F97-I313 HydrophobicContact CE2-CD1 3.64Å; F97-I313 HydrophobicContact CE2-CG1 4.45Å; F97-I313 HydrophobicContact CZ-CD1 4.08Å; A309-I313 VanDerWaalsContact O-CG1 3.24Å; A309-I313 WeakPolarHBondContact O-CG1 3.41Å; A309-I313 PolarHBondContact O-N 3.43Å; I310-I313 PolarHBondContact O-N 2.84Å; I310-I313 VanDerWaalsContact O-N 3.15Å; I313-M316 CarbonylContact O-C 3.58Å; I313-M316 PolarHBondContact O-N 3.35Å; I313-H317 WeakPolarHBondContact O-CB 3.46Å; I313-H317 PolarHBondContact O-N 2.91Å
314	C	36.2	Very low	36.1	Very low	68 Å²	68	77.3 Å²	77.3	46%	0.459	42%	0.421	S	S	.	.	H	α-helix	trans	-67.2	-43.5	176.8	-66.4	0	0	0	0	111.1	I310 M316 H317 D318	I310-C314 WeakPolarHBondContact O-CB 3.11Å; I310-C314 PolarHBondContact O-N 3.35Å; I310-C314 PolarHBondContact O-SG 2.97Å; C314-M316 VanDerWaalsContact C-N 3.29Å; C314-M316 PolarHBondContact O-N 3.45Å; C314-H317 CarbonylContact O-C 3.59Å; C314-H317 WeakPolarHBondContact O-CB 3.39Å; C314-H317 PolarHBondContact O-N 3.3Å; C314-H317 VanDerWaalsContact O-N 3.15Å; C314-D318 VanDerWaalsContact O-CG 3.31Å; C314-D318 PolarHBondContact O-N 3.16Å
315	S	37	Very low	35.8	Very low	56 Å²	56	73.2 Å²	73.2	39%	0.392	40%	0.402	S	S	.	.	H	α-helix	trans	-61.9	-37.9	172.8	179	0	0	0	0	111.5	K311 L312 D318 I319	K311-S315 WeakPolarHBondContact O-CB 3.37Å; K311-S315 PolarHBondContact O-N 3.42Å; L312-S315 PolarHBondContact O-N 2.87Å; S315-D318 PolarHBondContact O-N 2.64Å; S315-I319 WeakPolarHBondContact O-CB 3.31Å; S315-I319 WeakPolarHBondContact O-CD1 3.44Å; S315-I319 WeakPolarHBondContact O-CG1 3.37Å; S315-I319 PolarHBondContact O-N 3.43Å
316	M	38.6	Very low	35.4	Very low	34 Å²	34	74.3 Å²	74.3	17%	0.167	40%	0.403	C	S	.	.	H	α-helix	trans	-69.6	-36.7	173.7	-71.6	-55.5	164.9	0	0	112.3	L89 L93 L312 I313 C314 D318 I319 L320	L89-M316 HydrophobicContact CD2-SD 4.42Å; L93-M316 HydrophobicContact CD1-CE 3.33Å; L93-M316 HydrophobicContact CD1-CG 3.8Å; L93-M316 HydrophobicContact CD1-SD 3.11Å; L93-M316 WeakPolarHBondContact CD1-SD 3.43Å; L93-M316 HydrophobicContact CD2-CE 3.44Å; L93-M316 VanDerWaalsContact CD2-CE 3.44Å; L93-M316 HydrophobicContact CD2-SD 4.35Å; L93-M316 HydrophobicContact CG-CE 3.99Å; L93-M316 HydrophobicContact CG-SD 4.31Å; L312-M316 HydrophobicContact CD2-CE 4.07Å; L312-M316 HydrophobicContact CD2-CG 4.22Å; L312-M316 VanDerWaalsContact O-CB 3.25Å; L312-M316 WeakPolarHBondContact O-CB 3.31Å; L312-M316 WeakPolarHBondContact O-CG 3.49Å; L312-M316 PolarHBondContact O-N 3.43Å; I313-M316 CarbonylContact O-C 3.58Å; I313-M316 PolarHBondContact O-N 3.35Å; C314-M316 VanDerWaalsContact C-N 3.29Å; C314-M316 PolarHBondContact O-N 3.45Å; M316-D318 VanDerWaalsContact C-N 3.31Å; M316-I319 HydrophobicContact CE-CD1 4.33Å; M316-I319 PolarHBondContact O-N 2.94Å; M316-I319 HydrophobicContact SD-CD1 3.89Å; M316-L320 HydrophobicContact CB-CD1 4.41Å; M316-L320 WeakPolarHBondContact O-CB 3.33Å; M316-L320 WeakPolarHBondContact O-CD1 3.2Å; M316-L320 WeakPolarHBondContact O-CG 3.32Å; M316-L320 PolarHBondContact O-N 3.07Å
317	H	38.9	Very low	34.9	Very low	105 Å²	105	74.3 Å²	74.3	49%	0.486	41%	0.408	S	S	.	.	H	α-helix	trans	-61.5	-42.3	170.4	-174.3	-85.5	0	0	0	110.1	I313 C314 L320 S321	I313-H317 WeakPolarHBondContact O-CB 3.46Å; I313-H317 PolarHBondContact O-N 2.91Å; C314-H317 CarbonylContact O-C 3.59Å; C314-H317 WeakPolarHBondContact O-CB 3.39Å; C314-H317 PolarHBondContact O-N 3.3Å; C314-H317 VanDerWaalsContact O-N 3.15Å; H317-L320 PolarHBondContact O-N 3.39Å; H317-S321 WeakPolarHBondContact O-CB 3.34Å; H317-S321 PolarHBondContact O-N 3.15Å; H317-S321 PolarHBondContact O-OG 3.48Å
318	D	33.8	Very low	34.5	Very low	83 Å²	83	71.9 Å²	71.9	44%	0.444	40%	0.396	S	S	.	.	H	α-helix	trans	-66.4	-39.7	176.4	-67.1	-20.1	0	0	0	112.5	C314 S315 M316 G322 L326	C314-D318 VanDerWaalsContact O-CG 3.31Å; C314-D318 PolarHBondContact O-N 3.16Å; S315-D318 PolarHBondContact O-N 2.64Å; M316-D318 VanDerWaalsContact C-N 3.31Å; D318-G322 VanDerWaalsContact O-CA 3.32Å; D318-G322 WeakPolarHBondContact O-CA 3.17Å; D318-G322 PolarHBondContact O-N 3.19Å; D318-L326 WeakPolarHBondContact OD1-CD1 3.43Å
319	I	37.3	Very low	34	Very low	86 Å²	86	67.3 Å²	67.3	44%	0.441	40%	0.398	S	S	.	.	H	α-helix	trans	-69.3	-40.6	177.1	-69.6	160.7	0	0	0	111.7	S315 M316	S315-I319 WeakPolarHBondContact O-CB 3.31Å; S315-I319 WeakPolarHBondContact O-CD1 3.44Å; S315-I319 WeakPolarHBondContact O-CG1 3.37Å; S315-I319 PolarHBondContact O-N 3.43Å; M316-I319 HydrophobicContact CE-CD1 4.33Å; M316-I319 PolarHBondContact O-N 2.94Å; M316-I319 HydrophobicContact SD-CD1 3.89Å
320	L	34.8	Very low	33.6	Very low	68 Å²	68	70.8 Å²	70.8	36%	0.356	42%	0.418	S	S	.	.	H	α-helix	trans	-79.5	-35.6	-175.2	-71.5	169	0	0	0	112.9	C90 M316 H317	C90-L320 WeakPolarHBondContact SG-CD2 3.42Å; M316-L320 HydrophobicContact CB-CD1 4.41Å; M316-L320 WeakPolarHBondContact O-CB 3.33Å; M316-L320 WeakPolarHBondContact O-CD1 3.2Å; M316-L320 WeakPolarHBondContact O-CG 3.32Å; M316-L320 PolarHBondContact O-N 3.07Å; H317-L320 PolarHBondContact O-N 3.39Å
321	S	32.2	Very low	32.8	Very low	43 Å²	43	75.3 Å²	75.3	30%	0.301	44%	0.442	S	S	.	.	H	α-helix	trans	-94.9	-17.5	-173.3	-35.7	0	0	0	0	110	H317 S325	H317-S321 WeakPolarHBondContact O-CB 3.34Å; H317-S321 PolarHBondContact O-N 3.15Å; H317-S321 PolarHBondContact O-OG 3.48Å; S321-S325 WeakPolarHBondContact CA-OG 3.48Å; S321-S325 VanDerWaalsContact CB-CB 3.44Å; S321-S325 WeakPolarHBondContact CB-OG 3.19Å; S321-S325 WeakPolarHBondContact O-CB 3.33Å; S321-S325 PolarHBondContact O-OG 3.38Å
322	G	28.9	Very low	31.9	Very low	15 Å²	15	75.2 Å²	75.2	16%	0.155	44%	0.444	C	S	.	.			trans	68.1	165.7	-179.2	0	0	0	0	0	111.5	D318 A324 S325	D318-G322 VanDerWaalsContact O-CA 3.32Å; D318-G322 WeakPolarHBondContact O-CA 3.17Å; D318-G322 PolarHBondContact O-N 3.19Å; G322-A324 PolarHBondContact O-N 3.4Å; G322-S325 PolarHBondContact O-N 3.4Å; G322-S325 VanDerWaalsContact O-N 3.14Å; G322-S325 PolarHBondContact O-OG 3.18Å
323	P	32.7	Very low	31.1	Very low	105 Å²	105	80.9 Å²	80.9	68%	0.682	46%	0.458	S	S	*	.	H	α-helix	trans	-57.6	-20.2	175.6	21.6	-30.8	0	0	0	112.6	L327	P323-L327 VanDerWaalsContact O-CD1 3.26Å; P323-L327 WeakPolarHBondContact O-CD1 3.31Å; P323-L327 PolarHBondContact O-N 3.5Å
324	A	27.2	Very low	30.2	Very low	78 Å²	78	88.6 Å²	88.6	65%	0.645	48%	0.482	S	S	*	.	H	α-helix	trans	-75.3	-19.2	180	0	0	0	0	0	115.3	G322 G328	G322-A324 PolarHBondContact O-N 3.4Å; A324-G328 VanDerWaalsContact O-CA 3.31Å; A324-G328 WeakPolarHBondContact O-CA 3.35Å; A324-G328 PolarHBondContact O-N 2.94Å
325	S	26.1	Very low	29.6	Very low	34 Å²	34	93.5 Å²	93.5	24%	0.238	50%	0.496	C	S	.	.	H	α-helix	trans	-94.8	-20.6	179.9	61.9	0	0	0	0	113.7	S321 G322 A329	S321-S325 WeakPolarHBondContact CA-OG 3.48Å; S321-S325 VanDerWaalsContact CB-CB 3.44Å; S321-S325 WeakPolarHBondContact CB-OG 3.19Å; S321-S325 WeakPolarHBondContact O-CB 3.33Å; S321-S325 PolarHBondContact O-OG 3.38Å; G322-S325 PolarHBondContact O-N 3.4Å; G322-S325 VanDerWaalsContact O-N 3.14Å; G322-S325 PolarHBondContact O-OG 3.18Å; S325-A329 WeakPolarHBondContact O-CB 3.41Å; S325-A329 PolarHBondContact O-N 3.17Å
326	L	28.2	Very low	29	Very low	84 Å²	84	96 Å²	96	44%	0.44	51%	0.51	S	S	.	.	H	α-helix	trans	-80.1	-37.7	167.7	-104.1	154.4	0	0	0	109.3	D318 T330	D318-L326 WeakPolarHBondContact OD1-CD1 3.43Å; L326-T330 WeakPolarHBondContact O-CB 3.39Å; L326-T330 WeakPolarHBondContact O-CG2 3.37Å; L326-T330 PolarHBondContact O-N 3.06Å; L326-T330 PolarHBondContact O-OG1 2.86Å
327	L	27.4	Very low	28.4	Very low	66 Å²	66	99.8 Å²	99.8	35%	0.346	54%	0.535	S	S	.	.	H	α-helix	trans	-69.1	-30.2	164.5	-87.5	114.1	0	0	0	113.3	L60 P323 L331	L60-L327 HydrophobicContact CD1-CD2 3.59Å; L60-L327 HydrophobicContact CD2-CD1 3.46Å; L60-L327 VanDerWaalsContact CD2-CD1 3.46Å; L60-L327 HydrophobicContact CD2-CD2 3.6Å; L60-L327 HydrophobicContact CD2-CG 4.15Å; L60-L327 HydrophobicContact CG-CD2 4.24Å; P323-L327 VanDerWaalsContact O-CD1 3.26Å; P323-L327 WeakPolarHBondContact O-CD1 3.31Å; P323-L327 PolarHBondContact O-N 3.5Å; L327-L331 HydrophobicContact CD2-CD1 4.41Å; L327-L331 VanDerWaalsContact O-CB 3.28Å; L327-L331 WeakPolarHBondContact O-CB 3.3Å; L327-L331 PolarHBondContact O-N 2.95Å
328	G	25.1	Very low	27.9	Very low	16 Å²	16	104.2 Å²	104.2	17%	0.165	55%	0.548	C	S	.	.	H	α-helix	trans	-73.5	-42.6	173.5	0	0	0	0	0	112.7	A324 T330 E332	A324-G328 VanDerWaalsContact O-CA 3.31Å; A324-G328 WeakPolarHBondContact O-CA 3.35Å; A324-G328 PolarHBondContact O-N 2.94Å; G328-T330 VanDerWaalsContact C-N 3.32Å; G328-T330 PolarHBondContact O-N 3.33Å; G328-E332 WeakPolarHBondContact O-CA 3.47Å; G328-E332 WeakPolarHBondContact O-CB 3.26Å; G328-E332 WeakPolarHBondContact O-CG 3.45Å; G328-E332 PolarHBondContact O-N 2.97Å
329	A	25.9	Very low	27.5	Very low	90 Å²	90	107.7 Å²	107.7	74%	0.744	57%	0.566	S	S	*	*	H	α-helix	trans	-78.9	-13.6	176.7	0	0	0	0	0	113.6	S325	S325-A329 WeakPolarHBondContact O-CB 3.41Å; S325-A329 PolarHBondContact O-N 3.17Å
330	T	28.1	Very low	27	Very low	87 Å²	87	111.1 Å²	111.1	53%	0.534	59%	0.586	S	S	.	*	H	α-helix	trans	-104.7	-11.1	174.3	61.1	0	0	0	0	114.5	L326 G328	L326-T330 WeakPolarHBondContact O-CB 3.39Å; L326-T330 WeakPolarHBondContact O-CG2 3.37Å; L326-T330 PolarHBondContact O-N 3.06Å; L326-T330 PolarHBondContact O-OG1 2.86Å; G328-T330 VanDerWaalsContact C-N 3.32Å; G328-T330 PolarHBondContact O-N 3.33Å
331	L	24.5	Very low	26.7	Very low	135 Å²	135	111.8 Å²	111.8	71%	0.707	60%	0.601	S	S	*	*	H	α-helix	trans	-134.7	0.4	176.7	-88.8	147.2	0	0	0	115.8	L327 R333	L327-L331 HydrophobicContact CD2-CD1 4.41Å; L327-L331 VanDerWaalsContact O-CB 3.28Å; L327-L331 WeakPolarHBondContact O-CB 3.3Å; L327-L331 PolarHBondContact O-N 2.95Å; L331-R333 PolarHBondContact O-N 3.48Å; L331-R333 VanDerWaalsContact O-N 3.08Å
332	E	23.7	Very low	26.4	Very low	150 Å²	150	116.6 Å²	116.6	70%	0.701	62%	0.622	S	S	*	*	S	Bend	trans	-78.9	95.6	166.3	-71.5	-169.3	140.8	0	0	112	G328	G328-E332 WeakPolarHBondContact O-CA 3.47Å; G328-E332 WeakPolarHBondContact O-CB 3.26Å; G328-E332 WeakPolarHBondContact O-CG 3.45Å; G328-E332 PolarHBondContact O-N 2.97Å
333	R	24.5	Very low	26.5	Very low	212 Å²	212	129.1 Å²	129.1	80%	0.8	67%	0.672	S	S	*	*			trans	56	74.9	130.8	-63	178	175.8	-175	1	116.1	L331	L331-R333 PolarHBondContact O-N 3.48Å; L331-R333 VanDerWaalsContact O-N 3.08Å
334	R	23.8	Very low	26.2	Very low	245 Å²	245	130.4 Å²	130.4	93%	0.925	67%	0.672	S	S	*	*				-99.1	93.3	119.2	-77	-163.9	-179.1	-165.9	1.7	107.5
335	K	23.2	Very low	26.1	Very low	172 Å²	172	133.1 Å²	133.1	75%	0.748	67%	0.673	S	S	*	*			trans	-42.5	126.4	151.1	-82.9	-176.1	173.8	-177.5	0	105.9	V337	K335-V337 VanDerWaalsContact C-N 3.3Å; K335-V337 PolarHBondContact O-N 3.02Å
336	P	24.7	Very low	26.1	Very low	107 Å²	107	138.6 Å²	138.6	70%	0.695	70%	0.697	S	S	*	*			trans	-62.3	101.6	172.8	25.5	-30.2	0	0	0	106.6	W338	P336-W338 HydrophobicContact CB-CB 4.21Å; P336-W338 PolarHBondContact O-N 2.99Å
337	V	24.8	Very low	26	Very low	114 Å²	114	141.8 Å²	141.8	69%	0.691	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	65	157.7	-175.6	0	0	0	0	105.8	K335	K335-V337 VanDerWaalsContact C-N 3.3Å; K335-V337 PolarHBondContact O-N 3.02Å
338	W	28.1	Very low	25.9	Very low	199 Å²	199	146.6 Å²	146.6	75%	0.754	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.9	7.8	179.4	-88	65.5	0	0	0	111.9	P336	P336-W338 HydrophobicContact CB-CB 4.21Å; P336-W338 PolarHBondContact O-N 2.99Å
339	N	25.8	Very low	26	Very low	155 Å²	155	155.3 Å²	155.3	83%	0.829	77%	0.773	S	S	*	*	S	Bend	trans	-110.9	4.5	170.1	-92.1	1.5	0	0	0	114.9
340	D	27.4	Very low	26	Very low	159 Å²	159	159.9 Å²	159.9	85%	0.85	78%	0.776	S	S	*	*	S	Bend	trans	-119.1	10.4	175.6	-76.8	-31	0	0	0	113.9
341	A	27.5	Very low	25.8	Very low	82 Å²	82	165.5 Å²	165.5	68%	0.678	79%	0.794	S	S	*	*	S	Bend	trans	-119.8	14.4	177.8	0	0	0	0	0	113.7
342	I	27.8	Very low	26	Very low	144 Å²	144	168.1 Å²	168.1	74%	0.738	80%	0.801	S	S	*	*			trans	-128.3	74.1	172.6	-54.2	178.1	0	0	0	107.5
343	K	30.2	Very low	26.2	Very low	278 Å²	278	169.7 Å²	169.7	100%	1.209	81%	0.811	S	S	*	*			trans	-143.4	0	151.1	-116.6	-171.8	-176.7	-178.5	0	107.5

Retrieved 343 of 343 residues in 52.4 ms (Link to these results)

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