A0A096MDV2_POEFO Loading...

Sorting nexin 13

AlphaFold DB , UniProt , Accession A0A096MDV2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 664 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	58.6	Low	72.5	Confident	96 Å²	96	58.4 Å²	58.4	47%	0.473	31%	0.308	S	S	.	.				0	-48.2	0	-78.8	-50.9	138	0	0	114.7	I3 L4 K5 F49 V50 V53	M1-I3 VanDerWaalsContact C-N 3.31Å; M1-I3 PolarHBondContact O-N 3.32Å; M1-L4 HydrophobicContact CE-CD1 4.09Å; M1-L4 WeakPolarHBondContact O-CB 3.26Å; M1-L4 PolarHBondContact O-N 3.18Å; M1-L4 HydrophobicContact SD-CD1 4Å; M1-K5 PolarHBondContact O-N 3.02Å; M1-K5 VanDerWaalsContact O-N 3.11Å; M1-F49 HydrophobicContact CG-CE1 4.28Å; M1-F49 HydrophobicContact SD-CE1 4.34Å; M1-V50 HydrophobicContact CE-CB 3.93Å; M1-V50 HydrophobicContact CE-CG1 3.8Å; M1-V50 HydrophobicContact CE-CG2 3.22Å; M1-V53 HydrophobicContact SD-CG1 4.48Å
2	N	59.7	Low	74	Confident	113 Å²	113	53.5 Å²	53.5	60%	0.604	28%	0.282	S	S	*	.	H	α-helix	trans	-56.2	-38.5	-175.1	-62.3	-8.8	0	0	0	114.2	L4 K5 L6	N2-L4 VanDerWaalsContact C-N 3.32Å; N2-L4 PolarHBondContact O-N 3.44Å; N2-K5 PolarHBondContact O-N 3.34Å; N2-L6 VanDerWaalsContact O-CB 3.31Å; N2-L6 WeakPolarHBondContact O-CB 3.41Å; N2-L6 VanDerWaalsContact O-CG 3.23Å; N2-L6 WeakPolarHBondContact O-CG 3.45Å; N2-L6 PolarHBondContact O-N 3.21Å
3	I	70.1	Confident	75	Confident	12 Å²	12	49.4 Å²	49.4	6%	0.062	26%	0.261	C	S	.	.	H	α-helix	trans	-61	-38.9	174.2	-69.6	-60.6	0	0	0	112.5	M1 L6 T7 V575 K578 L582	M1-I3 VanDerWaalsContact C-N 3.31Å; M1-I3 PolarHBondContact O-N 3.32Å; I3-L6 PolarHBondContact O-N 2.85Å; I3-T7 VanDerWaalsContact O-CB 3.28Å; I3-T7 WeakPolarHBondContact O-CB 3.26Å; I3-T7 PolarHBondContact O-N 2.8Å; I3-V575 HydrophobicContact CG2-CG1 3.89Å; I3-K578 HydrophobicContact CD1-CB 3.93Å; I3-K578 HydrophobicContact CG1-CB 4.33Å; I3-K578 HydrophobicContact CG2-CB 4.34Å; I3-K578 HydrophobicContact CG2-CD 4.44Å; I3-L582 HydrophobicContact CD1-CD1 3.23Å; I3-L582 HydrophobicContact CD1-CG 4.22Å; I3-L582 HydrophobicContact CG1-CD1 4.07Å
4	L	70.4	Confident	76.2	Confident	12 Å²	12	51.6 Å²	51.6	6%	0.063	27%	0.269	C	S	.	.	H	α-helix	trans	-70.9	-40.6	179.5	-59.9	177	0	0	0	110.9	M1 N2 L6 L13 V16 V50 V53 V575	M1-L4 HydrophobicContact CE-CD1 4.09Å; M1-L4 WeakPolarHBondContact O-CB 3.26Å; M1-L4 PolarHBondContact O-N 3.18Å; M1-L4 HydrophobicContact SD-CD1 4Å; N2-L4 VanDerWaalsContact C-N 3.32Å; N2-L4 PolarHBondContact O-N 3.44Å; L4-L6 VanDerWaalsContact C-N 3.26Å; L4-L6 PolarHBondContact O-N 3.1Å; L4-L13 HydrophobicContact CB-CD2 4.21Å; L4-L13 HydrophobicContact CD2-CD2 4.26Å; L4-L13 VanDerWaalsContact O-CD2 3.31Å; L4-L13 WeakPolarHBondContact O-CD2 3.43Å; L4-V16 HydrophobicContact CD1-CG1 4.05Å; L4-V16 HydrophobicContact CD2-CB 4.21Å; L4-V16 HydrophobicContact CD2-CG1 4.03Å; L4-V16 HydrophobicContact CD2-CG2 3.95Å; L4-V50 HydrophobicContact CD1-CG1 3.93Å; L4-V53 HydrophobicContact CB-CG1 4.19Å; L4-V575 HydrophobicContact CD2-CG1 3.87Å; L4-V575 HydrophobicContact CD2-CG2 4.46Å
5	K	65.9	Low	77.3	Confident	73 Å²	73	48.3 Å²	48.3	32%	0.317	25%	0.252	S	S	.	.	H	α-helix	trans	-63.7	-34.1	176	-68	-174.1	174.5	-169.5	0	112.4	M1 N2 V53 R57	M1-K5 PolarHBondContact O-N 3.02Å; M1-K5 VanDerWaalsContact O-N 3.11Å; N2-K5 PolarHBondContact O-N 3.34Å; K5-V53 HydrophobicContact CG-CG1 3.75Å; K5-R57 VanDerWaalsContact O-CD 3.27Å; K5-R57 WeakPolarHBondContact O-CD 3.31Å; K5-R57 PolarHBondContact O-NE 3.38Å
6	L	65.3	Low	78.1	Confident	61 Å²	61	46.6 Å²	46.6	32%	0.319	25%	0.245	S	C	.	.	H	α-helix	trans	-104.9	-3.7	-171	-60.7	173	0	0	0	114.4	N2 I3 L4 R599	N2-L6 VanDerWaalsContact O-CB 3.31Å; N2-L6 WeakPolarHBondContact O-CB 3.41Å; N2-L6 VanDerWaalsContact O-CG 3.23Å; N2-L6 WeakPolarHBondContact O-CG 3.45Å; N2-L6 PolarHBondContact O-N 3.21Å; I3-L6 PolarHBondContact O-N 2.85Å; L4-L6 VanDerWaalsContact C-N 3.26Å; L4-L6 PolarHBondContact O-N 3.1Å; L6-R599 PolarHBondContact O-NH2 3.22Å
7	T	73.9	Confident	78.9	Confident	5 Å²	5	46.7 Å²	46.7	3%	0.031	24%	0.242	C	C	.	.			trans	-73.1	141.1	180	-169.8	0	0	0	0	110.5	I3 K9 E12 L13 R57	I3-T7 VanDerWaalsContact O-CB 3.28Å; I3-T7 WeakPolarHBondContact O-CB 3.26Å; I3-T7 PolarHBondContact O-N 2.8Å; T7-K9 PolarHBondContact OG1-N 2.94Å; T7-E12 PolarHBondContact OG1-OE2 3.47Å; T7-L13 HydrophobicContact CG2-CD1 3.7Å; T7-L13 HydrophobicContact CG2-CD2 3.52Å; T7-L13 HydrophobicContact CG2-CG 3.4Å; T7-L13 VanDerWaalsContact CG2-CG 3.4Å; T7-R57 PolarHBondContact O-NE 2.69Å
8	D	75.5	Confident	79.7	Confident	100 Å²	100	48.3 Å²	48.3	54%	0.535	25%	0.251	S	S	.	.			trans	-102.8	5.5	178.7	-52.4	-38.4	0	0	0	111.6	P10 R57	D8-P10 WeakPolarHBondContact O-CD 3.33Å; D8-R57 IonicContact OD1-CZ 3.04Å; D8-R57 IonicContact OD1-NH2 2.64Å; D8-R57 PolarHBondContact OD1-NH2 3.37Å
9	K	82.6	Confident	80.3	Confident	85 Å²	85	48.8 Å²	48.8	37%	0.37	25%	0.252	S	S	.	.			trans	-105.8	103.3	-179.7	-63.5	-167.7	-174.1	-175.5	0	109.6	T7 A11 E12 D607	T7-K9 PolarHBondContact OG1-N 2.94Å; K9-A11 PolarHBondContact O-N 2.98Å; K9-E12 HydrophobicContact CB-CB 4.31Å; K9-E12 HydrophobicContact CB-CG 3.9Å; K9-E12 WeakPolarHBondContact O-CB 3.31Å; K9-E12 PolarHBondContact O-N 3.49Å; K9-D607 IonicContact NZ-OD1 3.49Å
10	P	85.8	Confident	80.8	Confident	50 Å²	50	47 Å²	47	33%	0.325	24%	0.243	S	C	.	.	H	α-helix	trans	-55.1	-37.7	179.8	-26.3	33.9	0	0	0	113.1	D8 E12 L13 E14 L61	D8-P10 WeakPolarHBondContact O-CD 3.33Å; P10-E12 PolarHBondContact O-N 3.11Å; P10-L13 WeakPolarHBondContact O-CB 3.47Å; P10-L13 PolarHBondContact O-N 2.99Å; P10-E14 PolarHBondContact O-N 3.33Å; P10-L61 HydrophobicContact CG-CB 4.45Å; P10-L61 HydrophobicContact CG-CD1 4.04Å
11	A	90.1	Very high	81.3	Confident	35 Å²	35	47.7 Å²	47.7	29%	0.289	25%	0.247	S	C	.	.	H	α-helix	trans	-61.2	-28	177.7	0	0	0	0	0	113.9	K9 A15 M571	K9-A11 PolarHBondContact O-N 2.98Å; A11-A15 WeakPolarHBondContact O-CB 3.48Å; A11-A15 PolarHBondContact O-N 3.31Å; A11-M571 HydrophobicContact CB-CG 4.23Å; A11-M571 HydrophobicContact CB-SD 4.08Å; A11-M571 WeakPolarHBondContact O-CG 3.37Å
12	E	90.4	Very high	82.9	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-71.5	-37.5	173.7	-68.6	179.9	-179.4	0	0	111.1	T7 K9 P10 V16 M571 R574 V575 K578	T7-E12 PolarHBondContact OG1-OE2 3.47Å; K9-E12 HydrophobicContact CB-CB 4.31Å; K9-E12 HydrophobicContact CB-CG 3.9Å; K9-E12 WeakPolarHBondContact O-CB 3.31Å; K9-E12 PolarHBondContact O-N 3.49Å; P10-E12 PolarHBondContact O-N 3.11Å; E12-V16 VanDerWaalsContact O-CG2 3.3Å; E12-V16 WeakPolarHBondContact O-CG2 3.34Å; E12-V16 PolarHBondContact O-N 3.24Å; E12-M571 HydrophobicContact CG-SD 4.26Å; E12-R574 IonicContact OE1-CZ 2.74Å; E12-R574 IonicContact OE1-NE 3.99Å; E12-R574 PolarHBondContact OE1-NE 3.36Å; E12-R574 IonicContact OE1-NH2 3.26Å; E12-R574 PolarHBondContact OE1-NH2 3.27Å; E12-V575 HydrophobicContact CB-CG2 3.82Å; E12-V575 HydrophobicContact CG-CG2 4.33Å; E12-K578 VanDerWaalsContact CD-NZ 3.25Å; E12-K578 IonicContact OE1-NZ 3.42Å; E12-K578 PolarHBondContact OE1-NZ 3.45Å; E12-K578 IonicContact OE2-NZ 3.28Å; E12-K578 PolarHBondContact OE2-NZ 3.24Å
13	L	86.3	Confident	84.3	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-73.8	-42.5	178.8	-65.6	162.5	0	0	0	112.1	L4 T7 P10 V16 K17 C54 R57 I58 L61	L4-L13 HydrophobicContact CB-CD2 4.21Å; L4-L13 HydrophobicContact CD2-CD2 4.26Å; L4-L13 VanDerWaalsContact O-CD2 3.31Å; L4-L13 WeakPolarHBondContact O-CD2 3.43Å; T7-L13 HydrophobicContact CG2-CD1 3.7Å; T7-L13 HydrophobicContact CG2-CD2 3.52Å; T7-L13 HydrophobicContact CG2-CG 3.4Å; T7-L13 VanDerWaalsContact CG2-CG 3.4Å; P10-L13 WeakPolarHBondContact O-CB 3.47Å; P10-L13 PolarHBondContact O-N 2.99Å; L13-V16 PolarHBondContact O-N 3.25Å; L13-K17 VanDerWaalsContact O-CB 3.3Å; L13-K17 WeakPolarHBondContact O-CB 3.19Å; L13-K17 PolarHBondContact O-N 3.04Å; L13-C54 HydrophobicContact CD2-CB 4.4Å; L13-R57 HydrophobicContact CD1-CB 3.85Å; L13-R57 HydrophobicContact CD1-CG 3.4Å; L13-R57 VanDerWaalsContact CD1-CG 3.4Å; L13-R57 HydrophobicContact CD2-CB 4.38Å; L13-R57 HydrophobicContact CD2-CG 4.35Å; L13-I58 HydrophobicContact CB-CD1 3.76Å; L13-I58 HydrophobicContact CB-CG1 3.61Å; L13-I58 HydrophobicContact CD1-CG1 3.9Å; L13-I58 HydrophobicContact CG-CG1 4.38Å; L13-L61 HydrophobicContact CD1-CD1 3.87Å
14	E	92.8	Very high	85.2	Confident	80 Å²	80	45.8 Å²	45.8	37%	0.374	23%	0.232	S	C	.	.	H	α-helix	trans	-60.5	-48.1	176.4	-73.4	179.6	178.5	0	0	110.8	P10 V16 K17 D18 I58	P10-E14 PolarHBondContact O-N 3.33Å; E14-V16 VanDerWaalsContact C-N 3.26Å; E14-V16 PolarHBondContact O-N 3.33Å; E14-K17 WeakPolarHBondContact O-CB 3.42Å; E14-K17 PolarHBondContact O-N 3.01Å; E14-K17 VanDerWaalsContact O-N 3.13Å; E14-D18 WeakPolarHBondContact O-CB 3.49Å; E14-D18 PolarHBondContact O-N 3.45Å; E14-I58 HydrophobicContact CG-CD1 3.88Å
15	A	91.9	Very high	86	Confident	3 Å²	3	50.8 Å²	50.8	3%	0.025	26%	0.259	C	S	.	.	H	α-helix	trans	-63.6	-30.9	-180	0	0	0	0	0	113.7	A11 K19 C568 M571 R572	A11-A15 WeakPolarHBondContact O-CB 3.48Å; A11-A15 PolarHBondContact O-N 3.31Å; A15-K19 PolarHBondContact O-N 3.46Å; A15-C568 HydrophobicContact CB-CB 4.2Å; A15-M571 HydrophobicContact CB-CB 3.46Å; A15-M571 VanDerWaalsContact CB-CB 3.46Å; A15-M571 HydrophobicContact CB-CG 4.3Å; A15-R572 HydrophobicContact CB-CG 4.08Å; A15-R572 WeakPolarHBondContact O-CD 3.21Å; A15-R572 WeakPolarHBondContact O-CG 3.3Å
16	V	90.3	Very high	87	Confident	21 Å²	21	53.3 Å²	53.3	13%	0.127	27%	0.267	C	S	.	.	H	α-helix	trans	-74.9	-45	173.7	172.2	0	0	0	0	110.4	L4 E12 L13 E14 D18 K19 V20 V50 R572 V575	L4-V16 HydrophobicContact CD1-CG1 4.05Å; L4-V16 HydrophobicContact CD2-CB 4.21Å; L4-V16 HydrophobicContact CD2-CG1 4.03Å; L4-V16 HydrophobicContact CD2-CG2 3.95Å; E12-V16 VanDerWaalsContact O-CG2 3.3Å; E12-V16 WeakPolarHBondContact O-CG2 3.34Å; E12-V16 PolarHBondContact O-N 3.24Å; L13-V16 PolarHBondContact O-N 3.25Å; E14-V16 VanDerWaalsContact C-N 3.26Å; E14-V16 PolarHBondContact O-N 3.33Å; V16-D18 VanDerWaalsContact C-N 3.33Å; V16-D18 PolarHBondContact O-N 2.98Å; V16-K19 PolarHBondContact O-N 3.05Å; V16-V20 HydrophobicContact CG1-CG2 4.38Å; V16-V20 VanDerWaalsContact O-CG2 3.29Å; V16-V20 WeakPolarHBondContact O-CG2 3.5Å; V16-V20 PolarHBondContact O-N 2.73Å; V16-V50 HydrophobicContact CG1-CG1 4.28Å; V16-R572 HydrophobicContact CG2-CG 4.21Å; V16-V575 HydrophobicContact CG2-CB 4.44Å; V16-V575 HydrophobicContact CG2-CG1 4.4Å; V16-V575 HydrophobicContact CG2-CG2 4.1Å
17	K	92	Very high	87.9	Confident	48 Å²	48	50.8 Å²	50.8	21%	0.209	25%	0.254	C	S	.	.	H	α-helix	trans	-57.5	-45.1	176.4	-173.5	-166	69.3	173.9	0	111.6	L13 E14 K19 V20 L21 K51 C54 E55	L13-K17 VanDerWaalsContact O-CB 3.3Å; L13-K17 WeakPolarHBondContact O-CB 3.19Å; L13-K17 PolarHBondContact O-N 3.04Å; E14-K17 WeakPolarHBondContact O-CB 3.42Å; E14-K17 PolarHBondContact O-N 3.01Å; E14-K17 VanDerWaalsContact O-N 3.13Å; K17-K19 VanDerWaalsContact C-N 3.35Å; K17-K19 PolarHBondContact O-N 3.46Å; K17-V20 WeakPolarHBondContact O-CB 3.49Å; K17-V20 PolarHBondContact O-N 3.22Å; K17-V20 VanDerWaalsContact O-N 3.16Å; K17-L21 HydrophobicContact CG-CD1 4.38Å; K17-L21 WeakPolarHBondContact O-CG 3.34Å; K17-L21 PolarHBondContact O-N 3.48Å; K17-K51 HydrophobicContact CG-CG 4.49Å; K17-C54 HydrophobicContact CB-CB 4.14Å; K17-E55 HydrophobicContact CD-CG 3.96Å
18	D	92.9	Very high	88.4	Confident	75 Å²	75	57.3 Å²	57.3	40%	0.401	28%	0.278	S	S	.	.	H	α-helix	trans	-63.2	-41.6	-179.1	-65	-13.5	0	0	0	111.4	E14 V16 L21 E22	E14-D18 WeakPolarHBondContact O-CB 3.49Å; E14-D18 PolarHBondContact O-N 3.45Å; V16-D18 VanDerWaalsContact C-N 3.33Å; V16-D18 PolarHBondContact O-N 2.98Å; D18-L21 PolarHBondContact O-N 3.27Å; D18-E22 PolarHBondContact O-N 3.11Å
19	K	92.3	Very high	88.7	Confident	59 Å²	59	56.8 Å²	56.8	26%	0.257	28%	0.282	S	S	.	.	H	α-helix	trans	-68.1	-35.4	174.7	-177.5	53.2	-178.7	151.1	0	112.2	A15 V16 K17 L21 E22 E23	A15-K19 PolarHBondContact O-N 3.46Å; V16-K19 PolarHBondContact O-N 3.05Å; K17-K19 VanDerWaalsContact C-N 3.35Å; K17-K19 PolarHBondContact O-N 3.46Å; K19-L21 VanDerWaalsContact C-N 3.33Å; K19-E22 HydrophobicContact CD-CB 4.42Å; K19-E22 WeakPolarHBondContact CD-OE2 3.49Å; K19-E22 IonicContact NZ-OE1 3.33Å; K19-E22 PolarHBondContact NZ-OE1 3.11Å; K19-E22 IonicContact NZ-OE2 3.11Å; K19-E22 PolarHBondContact O-N 3.22Å; K19-E23 IonicContact NZ-OE2 3.99Å; K19-E23 PolarHBondContact NZ-OE2 3.3Å; K19-E23 VanDerWaalsContact NZ-OE2 3.09Å; K19-E23 WeakPolarHBondContact O-CB 3.18Å; K19-E23 PolarHBondContact O-N 2.89Å
20	V	90.1	Very high	88.4	Confident	12 Å²	12	55.8 Å²	55.8	7%	0.073	28%	0.281	C	S	.	.	H	α-helix	trans	-63.8	-39.7	173.4	167.2	0	0	0	0	111	V16 K17 E23 L24 L47 V50 K51	V16-V20 HydrophobicContact CG1-CG2 4.38Å; V16-V20 VanDerWaalsContact O-CG2 3.29Å; V16-V20 WeakPolarHBondContact O-CG2 3.5Å; V16-V20 PolarHBondContact O-N 2.73Å; K17-V20 WeakPolarHBondContact O-CB 3.49Å; K17-V20 PolarHBondContact O-N 3.22Å; K17-V20 VanDerWaalsContact O-N 3.16Å; V20-E23 PolarHBondContact O-N 3.07Å; V20-L24 HydrophobicContact CG1-CD1 3.95Å; V20-L24 HydrophobicContact CG1-CG 4.39Å; V20-L24 WeakPolarHBondContact O-CB 3.42Å; V20-L24 VanDerWaalsContact O-CG 3.25Å; V20-L24 WeakPolarHBondContact O-CG 3.41Å; V20-L24 PolarHBondContact O-N 3.24Å; V20-L47 HydrophobicContact CG1-CB 4.06Å; V20-L47 HydrophobicContact CG1-CD2 4.21Å; V20-L47 VanDerWaalsContact CG1-O 3.28Å; V20-L47 WeakPolarHBondContact CG1-O 3.43Å; V20-L47 HydrophobicContact CG2-CD2 4.22Å; V20-V50 HydrophobicContact CG2-CB 4.18Å; V20-V50 HydrophobicContact CG2-CG1 3.79Å; V20-K51 HydrophobicContact CG1-CB 4Å
21	L	90.9	Very high	87.3	Confident	62 Å²	62	59.1 Å²	59.1	33%	0.325	30%	0.296	S	S	.	.	H	α-helix	trans	-65.5	-43.4	176	-72.7	171.3	0	0	0	112	K17 D18 K19 E23 L24 L25 K51	K17-L21 HydrophobicContact CG-CD1 4.38Å; K17-L21 WeakPolarHBondContact O-CG 3.34Å; K17-L21 PolarHBondContact O-N 3.48Å; D18-L21 PolarHBondContact O-N 3.27Å; K19-L21 VanDerWaalsContact C-N 3.33Å; L21-E23 VanDerWaalsContact C-N 3.31Å; L21-E23 PolarHBondContact O-N 3.33Å; L21-L24 PolarHBondContact O-N 3.27Å; L21-L25 WeakPolarHBondContact O-CG 3.32Å; L21-L25 PolarHBondContact O-N 2.8Å; L21-K51 HydrophobicContact CD2-CD 3.91Å
22	E	91.6	Very high	85.9	Confident	112 Å²	112	62.6 Å²	62.6	52%	0.523	31%	0.313	S	S	.	.	H	α-helix	trans	-56.9	-46.2	173.6	-172	-164.9	136.2	0	0	111.1	D18 K19 L25 Y26	D18-E22 PolarHBondContact O-N 3.11Å; K19-E22 HydrophobicContact CD-CB 4.42Å; K19-E22 WeakPolarHBondContact CD-OE2 3.49Å; K19-E22 IonicContact NZ-OE1 3.33Å; K19-E22 PolarHBondContact NZ-OE1 3.11Å; K19-E22 IonicContact NZ-OE2 3.11Å; K19-E22 PolarHBondContact O-N 3.22Å; E22-L25 PolarHBondContact O-N 3.49Å; E22-Y26 PolarHBondContact O-N 3.11Å
23	E	89.8	Confident	84.1	Confident	64 Å²	64	67.6 Å²	67.6	30%	0.299	36%	0.355	S	S	.	.	H	α-helix	trans	-68.2	-37.6	179	-155.7	65.6	-154.3	0	0	112.6	K19 V20 L21 Y26 L27 L47	K19-E23 IonicContact NZ-OE2 3.99Å; K19-E23 PolarHBondContact NZ-OE2 3.3Å; K19-E23 VanDerWaalsContact NZ-OE2 3.09Å; K19-E23 WeakPolarHBondContact O-CB 3.18Å; K19-E23 PolarHBondContact O-N 2.89Å; V20-E23 PolarHBondContact O-N 3.07Å; L21-E23 VanDerWaalsContact C-N 3.31Å; L21-E23 PolarHBondContact O-N 3.33Å; E23-Y26 PolarHBondContact O-N 2.98Å; E23-L27 WeakPolarHBondContact O-CB 3.49Å; E23-L27 WeakPolarHBondContact O-CG 3.49Å; E23-L27 PolarHBondContact O-N 3.48Å; E23-L47 HydrophobicContact CB-CD1 3.97Å; E23-L47 HydrophobicContact CG-CD1 3.83Å
24	L	87.9	Confident	83	Confident	4 Å²	4	69.7 Å²	69.7	2%	0.021	38%	0.376	C	S	.	.	H	α-helix	trans	-63.9	-40.2	174.3	-79.1	169.8	0	0	0	111.9	V20 L21 R28 I44 L47 L48 K51	V20-L24 HydrophobicContact CG1-CD1 3.95Å; V20-L24 HydrophobicContact CG1-CG 4.39Å; V20-L24 WeakPolarHBondContact O-CB 3.42Å; V20-L24 VanDerWaalsContact O-CG 3.25Å; V20-L24 WeakPolarHBondContact O-CG 3.41Å; V20-L24 PolarHBondContact O-N 3.24Å; L21-L24 PolarHBondContact O-N 3.27Å; L24-R28 WeakPolarHBondContact O-CB 3.22Å; L24-R28 WeakPolarHBondContact O-CD 3.48Å; L24-R28 WeakPolarHBondContact O-CG 3.45Å; L24-R28 PolarHBondContact O-N 2.98Å; L24-I44 HydrophobicContact CD2-CB 4.31Å; L24-I44 HydrophobicContact CD2-CG1 4.35Å; L24-I44 HydrophobicContact CD2-CG2 3.98Å; L24-L47 HydrophobicContact CD1-CB 4.4Å; L24-L47 HydrophobicContact CD2-CB 3.62Å; L24-L47 HydrophobicContact CD2-CD1 4.15Å; L24-L47 HydrophobicContact CG-CB 3.87Å; L24-L47 HydrophobicContact CG-CD1 4.24Å; L24-L48 HydrophobicContact CD1-CD2 4.03Å; L24-L48 HydrophobicContact CD2-CD2 4.43Å; L24-L48 HydrophobicContact CD2-CG 4.23Å; L24-K51 HydrophobicContact CD1-CD 4.31Å
25	L	88.4	Confident	81.3	Confident	117 Å²	117	73.8 Å²	73.8	61%	0.613	40%	0.401	S	S	*	.	H	α-helix	trans	-65.2	-42.3	175.2	-72.2	170.7	0	0	0	111	L21 E22 R28 S29	L21-L25 WeakPolarHBondContact O-CG 3.32Å; L21-L25 PolarHBondContact O-N 2.8Å; E22-L25 PolarHBondContact O-N 3.49Å; L25-R28 PolarHBondContact O-N 3.48Å; L25-S29 PolarHBondContact O-N 3.47Å
26	Y	87.4	Confident	80.1	Confident	127 Å²	127	79 Å²	79	50%	0.498	43%	0.429	S	S	.	.	H	α-helix	trans	-60.4	-51.2	175.2	177.7	-109.4	0	0	0	111.7	E22 E23 R28 S29 L30	E22-Y26 PolarHBondContact O-N 3.11Å; E23-Y26 PolarHBondContact O-N 2.98Å; Y26-R28 VanDerWaalsContact C-N 3.31Å; Y26-R28 PolarHBondContact O-N 3.27Å; Y26-S29 WeakPolarHBondContact O-CB 3.44Å; Y26-S29 PolarHBondContact O-N 2.91Å; Y26-S29 PolarHBondContact O-OG 3.3Å; Y26-L30 HydrophobicContact CD1-CD1 4.05Å; Y26-L30 HydrophobicContact CE1-CD1 3.53Å; Y26-L30 HydrophobicContact CE1-CG 4.48Å; Y26-L30 HydrophobicContact CE2-CD1 4.38Å; Y26-L30 PolarHBondContact O-N 2.86Å
27	L	84.1	Confident	79.5	Confident	8 Å²	8	80.2 Å²	80.2	4%	0.042	43%	0.433	C	S	.	.	H	α-helix	trans	-63.6	-34.4	178.7	-70.5	172	0	0	0	113.2	E23 S29 L30 I40 Q43 I44 L47	E23-L27 WeakPolarHBondContact O-CB 3.49Å; E23-L27 WeakPolarHBondContact O-CG 3.49Å; E23-L27 PolarHBondContact O-N 3.48Å; L27-S29 VanDerWaalsContact C-N 3.32Å; L27-L30 HydrophobicContact CD2-CD1 4.36Å; L27-L30 PolarHBondContact O-N 2.91Å; L27-I40 HydrophobicContact CB-CG2 4.36Å; L27-Q43 HydrophobicContact CD1-CB 3.92Å; L27-I44 HydrophobicContact CB-CD1 4.25Å; L27-I44 HydrophobicContact CB-CG1 3.91Å; L27-I44 HydrophobicContact CD1-CG1 4.2Å; L27-L47 HydrophobicContact CD1-CD1 3.45Å; L27-L47 VanDerWaalsContact CD1-CD1 3.45Å
28	R	83.1	Confident	78.7	Confident	141 Å²	141	83.1 Å²	83.1	53%	0.532	45%	0.452	S	S	.	.	H	α-helix	trans	-70.2	-27.4	172.9	-74.1	170.2	179.3	-177.6	-2.9	112.9	L24 L25 Y26 L30 D31 I44	L24-R28 WeakPolarHBondContact O-CB 3.22Å; L24-R28 WeakPolarHBondContact O-CD 3.48Å; L24-R28 WeakPolarHBondContact O-CG 3.45Å; L24-R28 PolarHBondContact O-N 2.98Å; L25-R28 PolarHBondContact O-N 3.48Å; Y26-R28 VanDerWaalsContact C-N 3.31Å; Y26-R28 PolarHBondContact O-N 3.27Å; R28-L30 VanDerWaalsContact C-N 3.27Å; R28-D31 WeakPolarHBondContact O-CB 3.4Å; R28-I44 HydrophobicContact CG-CD1 4.26Å
29	S	82.6	Confident	77.9	Confident	90 Å²	90	83.2 Å²	83.2	63%	0.629	45%	0.454	S	S	*	.	H	α-helix	trans	-75.5	-18.3	174.2	75.1	0	0	0	0	113.2	L25 Y26 L27 D31	L25-S29 PolarHBondContact O-N 3.47Å; Y26-S29 WeakPolarHBondContact O-CB 3.44Å; Y26-S29 PolarHBondContact O-N 2.91Å; Y26-S29 PolarHBondContact O-OG 3.3Å; L27-S29 VanDerWaalsContact C-N 3.32Å; S29-D31 VanDerWaalsContact C-N 3.3Å
30	L	75.7	Confident	77.2	Confident	63 Å²	63	81.5 Å²	81.5	33%	0.33	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	4.5	175.7	-66.3	172.3	0	0	0	113.1	Y26 L27 R28 T32 I40	Y26-L30 HydrophobicContact CD1-CD1 4.05Å; Y26-L30 HydrophobicContact CE1-CD1 3.53Å; Y26-L30 HydrophobicContact CE1-CG 4.48Å; Y26-L30 HydrophobicContact CE2-CD1 4.38Å; Y26-L30 PolarHBondContact O-N 2.86Å; L27-L30 HydrophobicContact CD2-CD1 4.36Å; L27-L30 PolarHBondContact O-N 2.91Å; R28-L30 VanDerWaalsContact C-N 3.27Å; L30-T32 VanDerWaalsContact C-N 3.28Å; L30-T32 PolarHBondContact O-N 2.93Å; L30-T32 PolarHBondContact O-OG1 3.3Å; L30-I40 HydrophobicContact CB-CD1 4.37Å
31	D	62	Low	76.6	Confident	120 Å²	120	86.4 Å²	86.4	64%	0.642	47%	0.468	S	S	*	.			trans	-65.9	86.4	179.8	-158.8	16.7	0	0	0	110.1	R28 S29	R28-D31 WeakPolarHBondContact O-CB 3.4Å; S29-D31 VanDerWaalsContact C-N 3.3Å
32	T	61.4	Low	76	Confident	108 Å²	108	88.3 Å²	88.3	66%	0.663	48%	0.479	S	S	*	.			trans	-122.1	137.2	179.5	-11.6	0	0	0	0	107.5	L30 G34	L30-T32 VanDerWaalsContact C-N 3.28Å; L30-T32 PolarHBondContact O-N 2.93Å; L30-T32 PolarHBondContact O-OG1 3.3Å; T32-G34 PolarHBondContact O-N 3.47Å
33	A	53	Low	75.3	Confident	106 Å²	106	87.4 Å²	87.4	88%	0.876	47%	0.474	S	S	*	.	S	Bend	trans	-61.7	102.5	-178.5	0	0	0	0	0	110.9
34	G	62.3	Low	74.7	Confident	43 Å²	43	85.6 Å²	85.6	44%	0.443	47%	0.467	S	S	.	.	S	Bend	trans	-175.1	174.6	179.9	0	0	0	0	0	113.5	T32 D36 I37	T32-G34 PolarHBondContact O-N 3.47Å; G34-D36 PolarHBondContact O-N 3.07Å; G34-I37 WeakPolarHBondContact O-CB 3.47Å; G34-I37 WeakPolarHBondContact O-CG1 3.47Å; G34-I37 PolarHBondContact O-N 3.27Å; G34-I37 VanDerWaalsContact O-N 3.15Å
35	D	57.4	Low	74.1	Confident	166 Å²	166	90 Å²	90	89%	0.888	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-16.3	-172.5	-70.5	-29.7	0	0	0	114.7	I37	D35-I37 VanDerWaalsContact C-N 3.32Å; D35-I37 PolarHBondContact O-N 2.97Å
36	D	67.9	Low	73.4	Confident	114 Å²	114	88 Å²	88	61%	0.61	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-6.8	178	-69.7	-40.8	0	0	0	114.2	G34 N38 V39 I40	G34-D36 PolarHBondContact O-N 3.07Å; D36-N38 PolarHBondContact O-N 3.46Å; D36-V39 PolarHBondContact O-N 3.16Å; D36-I40 HydrophobicContact CB-CD1 4.18Å; D36-I40 WeakPolarHBondContact O-CG1 3.37Å; D36-I40 PolarHBondContact O-N 3.5Å
37	I	76.4	Confident	72.8	Confident	45 Å²	45	83.4 Å²	83.4	23%	0.231	47%	0.47	C	S	.	.	H	α-helix	trans	-54	-40.4	-177.9	-89.2	170.2	0	0	0	112.4	G34 D35 K41	G34-I37 WeakPolarHBondContact O-CB 3.47Å; G34-I37 WeakPolarHBondContact O-CG1 3.47Å; G34-I37 PolarHBondContact O-N 3.27Å; G34-I37 VanDerWaalsContact O-N 3.15Å; D35-I37 VanDerWaalsContact C-N 3.32Å; D35-I37 PolarHBondContact O-N 2.97Å; I37-K41 HydrophobicContact CG2-CD 3.81Å; I37-K41 HydrophobicContact CG2-CG 4.47Å; I37-K41 VanDerWaalsContact O-CB 3.25Å; I37-K41 WeakPolarHBondContact O-CB 3.37Å; I37-K41 WeakPolarHBondContact O-CG 3.34Å; I37-K41 PolarHBondContact O-N 3.32Å
38	N	75.9	Confident	72.3	Confident	110 Å²	110	86.1 Å²	86.1	59%	0.588	48%	0.484	S	S	*	.	H	α-helix	trans	-71.7	-34.9	-178.2	-69.9	-31.1	0	0	0	112	D36 N42	D36-N38 PolarHBondContact O-N 3.46Å; N38-N42 WeakPolarHBondContact O-CB 3.38Å; N38-N42 PolarHBondContact O-N 3.49Å; N38-N42 PolarHBondContact O-ND2 3.06Å
39	V	76.1	Confident	72	Confident	76 Å²	76	84 Å²	84	46%	0.461	48%	0.479	S	S	.	.	H	α-helix	trans	-70	-45.8	176.3	-179.7	0	0	0	0	110.2	D36 N42 Q43	D36-V39 PolarHBondContact O-N 3.16Å; V39-N42 PolarHBondContact O-N 2.9Å; V39-Q43 WeakPolarHBondContact O-CG 3.39Å; V39-Q43 PolarHBondContact O-N 3.37Å
40	I	77.9	Confident	71.7	Confident	24 Å²	24	80.7 Å²	80.7	12%	0.123	46%	0.455	C	S	.	.	H	α-helix	trans	-61.4	-45.7	176.7	-65.6	170	0	0	0	110.2	L27 L30 D36 N42 Q43 I44	L27-I40 HydrophobicContact CB-CG2 4.36Å; L30-I40 HydrophobicContact CB-CD1 4.37Å; D36-I40 HydrophobicContact CB-CD1 4.18Å; D36-I40 WeakPolarHBondContact O-CG1 3.37Å; D36-I40 PolarHBondContact O-N 3.5Å; I40-N42 VanDerWaalsContact C-N 3.35Å; I40-N42 PolarHBondContact O-N 2.95Å; I40-Q43 PolarHBondContact O-N 3.05Å; I40-I44 HydrophobicContact CG2-CD1 3.75Å; I40-I44 HydrophobicContact CG2-CG1 4.35Å; I40-I44 WeakPolarHBondContact O-CB 3.49Å; I40-I44 VanDerWaalsContact O-CG1 3.27Å; I40-I44 WeakPolarHBondContact O-CG1 3.3Å; I40-I44 PolarHBondContact O-N 3.18Å
41	K	77.3	Confident	72	Confident	114 Å²	114	80.1 Å²	80.1	50%	0.496	45%	0.45	S	S	.	.	H	α-helix	trans	-58.4	-43.6	174.6	-78.7	173.9	177.7	174.4	0	112.2	I37 I44 N45	I37-K41 HydrophobicContact CG2-CD 3.81Å; I37-K41 HydrophobicContact CG2-CG 4.47Å; I37-K41 VanDerWaalsContact O-CB 3.25Å; I37-K41 WeakPolarHBondContact O-CB 3.37Å; I37-K41 WeakPolarHBondContact O-CG 3.34Å; I37-K41 PolarHBondContact O-N 3.32Å; K41-I44 PolarHBondContact O-N 3.48Å; K41-N45 WeakPolarHBondContact O-CB 3.44Å; K41-N45 PolarHBondContact O-N 3.17Å; K41-N45 PolarHBondContact O-ND2 2.97Å
42	N	77	Confident	72.6	Confident	102 Å²	102	79.9 Å²	79.9	55%	0.545	44%	0.443	S	S	.	.	H	α-helix	trans	-65.1	-39.6	177.2	-76.6	-22.1	0	0	0	112.8	N38 V39 I40 N45 S46	N38-N42 WeakPolarHBondContact O-CB 3.38Å; N38-N42 PolarHBondContact O-N 3.49Å; N38-N42 PolarHBondContact O-ND2 3.06Å; V39-N42 PolarHBondContact O-N 2.9Å; I40-N42 VanDerWaalsContact C-N 3.35Å; I40-N42 PolarHBondContact O-N 2.95Å; N42-N45 PolarHBondContact O-N 3.43Å; N42-S46 WeakPolarHBondContact O-CB 3.18Å; N42-S46 PolarHBondContact O-N 3.13Å; N42-S46 PolarHBondContact O-OG 3.06Å
43	Q	76.9	Confident	73.3	Confident	93 Å²	93	75.5 Å²	75.5	44%	0.435	42%	0.416	S	S	.	.	H	α-helix	trans	-66.6	-43.5	174.8	-71.9	179	0	0	0	111.6	L27 V39 I40 N45 S46 L47	L27-Q43 HydrophobicContact CD1-CB 3.92Å; V39-Q43 WeakPolarHBondContact O-CG 3.39Å; V39-Q43 PolarHBondContact O-N 3.37Å; I40-Q43 PolarHBondContact O-N 3.05Å; Q43-N45 VanDerWaalsContact C-N 3.34Å; Q43-N45 PolarHBondContact O-N 3.03Å; Q43-S46 WeakPolarHBondContact O-CB 3.3Å; Q43-S46 PolarHBondContact O-N 3.39Å; Q43-L47 WeakPolarHBondContact O-CB 3.26Å; Q43-L47 WeakPolarHBondContact O-CG 3.09Å; Q43-L47 PolarHBondContact O-N 3.13Å
44	I	78.9	Confident	74.5	Confident	27 Å²	27	70.5 Å²	70.5	14%	0.138	37%	0.374	C	S	.	.	H	α-helix	trans	-57.8	-47.5	173.8	-72.3	170.7	0	0	0	110.2	L24 L27 R28 I40 K41 S46 L47 L48	L24-I44 HydrophobicContact CD2-CB 4.31Å; L24-I44 HydrophobicContact CD2-CG1 4.35Å; L24-I44 HydrophobicContact CD2-CG2 3.98Å; L27-I44 HydrophobicContact CB-CD1 4.25Å; L27-I44 HydrophobicContact CB-CG1 3.91Å; L27-I44 HydrophobicContact CD1-CG1 4.2Å; R28-I44 HydrophobicContact CG-CD1 4.26Å; I40-I44 HydrophobicContact CG2-CD1 3.75Å; I40-I44 HydrophobicContact CG2-CG1 4.35Å; I40-I44 WeakPolarHBondContact O-CB 3.49Å; I40-I44 VanDerWaalsContact O-CG1 3.27Å; I40-I44 WeakPolarHBondContact O-CG1 3.3Å; I40-I44 PolarHBondContact O-N 3.18Å; K41-I44 PolarHBondContact O-N 3.48Å; I44-S46 VanDerWaalsContact C-N 3.32Å; I44-S46 PolarHBondContact O-N 2.92Å; I44-L47 PolarHBondContact O-N 3.27Å; I44-L48 HydrophobicContact CG2-CD1 3.83Å; I44-L48 HydrophobicContact CG2-CG 4.23Å; I44-L48 WeakPolarHBondContact O-CB 3.47Å; I44-L48 VanDerWaalsContact O-CG 3.27Å; I44-L48 WeakPolarHBondContact O-CG 3.36Å; I44-L48 PolarHBondContact O-N 3.4Å
45	N	74.1	Confident	75.3	Confident	95 Å²	95	71.3 Å²	71.3	51%	0.508	37%	0.367	S	S	.	.	H	α-helix	trans	-60.2	-42.2	177.8	-72.9	-24.7	0	0	0	112.1	K41 N42 Q43 L48 F49	K41-N45 WeakPolarHBondContact O-CB 3.44Å; K41-N45 PolarHBondContact O-N 3.17Å; K41-N45 PolarHBondContact O-ND2 2.97Å; N42-N45 PolarHBondContact O-N 3.43Å; Q43-N45 VanDerWaalsContact C-N 3.34Å; Q43-N45 PolarHBondContact O-N 3.03Å; N45-L48 PolarHBondContact O-N 3.39Å; N45-F49 PolarHBondContact O-N 3.38Å
46	S	73.3	Confident	76.2	Confident	75 Å²	75	65.7 Å²	65.7	52%	0.524	34%	0.338	S	S	.	.	H	α-helix	trans	-63.5	-42.7	176.8	-59.9	0	0	0	0	111.9	N42 Q43 I44 F49 V50	N42-S46 WeakPolarHBondContact O-CB 3.18Å; N42-S46 PolarHBondContact O-N 3.13Å; N42-S46 PolarHBondContact O-OG 3.06Å; Q43-S46 WeakPolarHBondContact O-CB 3.3Å; Q43-S46 PolarHBondContact O-N 3.39Å; I44-S46 VanDerWaalsContact C-N 3.32Å; I44-S46 PolarHBondContact O-N 2.92Å; S46-F49 WeakPolarHBondContact O-CB 3.3Å; S46-F49 PolarHBondContact O-N 3.09Å; S46-V50 WeakPolarHBondContact O-CG2 3.4Å; S46-V50 PolarHBondContact O-N 3.29Å; S46-V50 VanDerWaalsContact O-N 3.09Å
47	L	76.1	Confident	76.4	Confident	32 Å²	32	62.6 Å²	62.6	17%	0.168	32%	0.318	C	S	.	.	H	α-helix	trans	-69.8	-38.4	177.4	-73.2	173.8	0	0	0	112.5	V20 E23 L24 L27 Q43 I44 F49 V50 K51	V20-L47 HydrophobicContact CG1-CB 4.06Å; V20-L47 HydrophobicContact CG1-CD2 4.21Å; V20-L47 VanDerWaalsContact CG1-O 3.28Å; V20-L47 WeakPolarHBondContact CG1-O 3.43Å; V20-L47 HydrophobicContact CG2-CD2 4.22Å; E23-L47 HydrophobicContact CB-CD1 3.97Å; E23-L47 HydrophobicContact CG-CD1 3.83Å; L24-L47 HydrophobicContact CD1-CB 4.4Å; L24-L47 HydrophobicContact CD2-CB 3.62Å; L24-L47 HydrophobicContact CD2-CD1 4.15Å; L24-L47 HydrophobicContact CG-CB 3.87Å; L24-L47 HydrophobicContact CG-CD1 4.24Å; L27-L47 HydrophobicContact CD1-CD1 3.45Å; L27-L47 VanDerWaalsContact CD1-CD1 3.45Å; Q43-L47 WeakPolarHBondContact O-CB 3.26Å; Q43-L47 WeakPolarHBondContact O-CG 3.09Å; Q43-L47 PolarHBondContact O-N 3.13Å; I44-L47 PolarHBondContact O-N 3.27Å; L47-F49 VanDerWaalsContact C-N 3.27Å; L47-F49 PolarHBondContact O-N 3.48Å; L47-V50 WeakPolarHBondContact O-CB 3.45Å; L47-V50 PolarHBondContact O-N 3.22Å; L47-V50 VanDerWaalsContact O-N 3.16Å; L47-K51 WeakPolarHBondContact O-CB 3.49Å; L47-K51 PolarHBondContact O-N 3.24Å
48	L	73.8	Confident	76.6	Confident	64 Å²	64	61.1 Å²	61.1	34%	0.335	31%	0.311	S	S	.	.	H	α-helix	trans	-60.8	-38.8	172.4	-74.4	173.4	0	0	0	111.4	L24 I44 N45 K51 K52	L24-L48 HydrophobicContact CD1-CD2 4.03Å; L24-L48 HydrophobicContact CD2-CD2 4.43Å; L24-L48 HydrophobicContact CD2-CG 4.23Å; I44-L48 HydrophobicContact CG2-CD1 3.83Å; I44-L48 HydrophobicContact CG2-CG 4.23Å; I44-L48 WeakPolarHBondContact O-CB 3.47Å; I44-L48 VanDerWaalsContact O-CG 3.27Å; I44-L48 WeakPolarHBondContact O-CG 3.36Å; I44-L48 PolarHBondContact O-N 3.4Å; N45-L48 PolarHBondContact O-N 3.39Å; L48-K51 WeakPolarHBondContact O-CB 3.44Å; L48-K51 PolarHBondContact O-N 3.04Å; L48-K52 WeakPolarHBondContact O-CB 3.46Å; L48-K52 PolarHBondContact O-N 2.73Å
49	F	76.2	Confident	76.6	Confident	97 Å²	97	61.9 Å²	61.9	43%	0.425	31%	0.311	S	S	.	.	H	α-helix	trans	-61.9	-46.1	172.2	177.6	-99.8	0	0	0	111.8	M1 N45 S46 L47 K51 K52 V53	M1-F49 HydrophobicContact CG-CE1 4.28Å; M1-F49 HydrophobicContact SD-CE1 4.34Å; N45-F49 PolarHBondContact O-N 3.38Å; S46-F49 WeakPolarHBondContact O-CB 3.3Å; S46-F49 PolarHBondContact O-N 3.09Å; L47-F49 VanDerWaalsContact C-N 3.27Å; L47-F49 PolarHBondContact O-N 3.48Å; F49-K51 VanDerWaalsContact C-N 3.32Å; F49-K51 PolarHBondContact O-N 3.04Å; F49-K52 PolarHBondContact O-N 2.73Å; F49-V53 HydrophobicContact CD1-CG2 4.35Å; F49-V53 HydrophobicContact CE1-CG2 3.94Å; F49-V53 HydrophobicContact CE2-CG2 4.32Å; F49-V53 HydrophobicContact CZ-CG2 3.93Å; F49-V53 WeakPolarHBondContact O-CG2 3.42Å; F49-V53 PolarHBondContact O-N 3.5Å
50	V	75.3	Confident	76.1	Confident	20 Å²	20	63.4 Å²	63.4	12%	0.121	31%	0.308	C	S	.	.	H	α-helix	trans	-59.5	-43.9	176.1	-175.7	0	0	0	0	111.6	M1 L4 V16 V20 S46 L47 V53 C54	M1-V50 HydrophobicContact CE-CB 3.93Å; M1-V50 HydrophobicContact CE-CG1 3.8Å; M1-V50 HydrophobicContact CE-CG2 3.22Å; L4-V50 HydrophobicContact CD1-CG1 3.93Å; V16-V50 HydrophobicContact CG1-CG1 4.28Å; V20-V50 HydrophobicContact CG2-CB 4.18Å; V20-V50 HydrophobicContact CG2-CG1 3.79Å; S46-V50 WeakPolarHBondContact O-CG2 3.4Å; S46-V50 PolarHBondContact O-N 3.29Å; S46-V50 VanDerWaalsContact O-N 3.09Å; L47-V50 WeakPolarHBondContact O-CB 3.45Å; L47-V50 PolarHBondContact O-N 3.22Å; L47-V50 VanDerWaalsContact O-N 3.16Å; V50-V53 PolarHBondContact O-N 3.38Å; V50-C54 PolarHBondContact O-N 3.25Å; V50-C54 PolarHBondContact O-SG 2.91Å
51	K	83	Confident	75.8	Confident	51 Å²	51	64.7 Å²	64.7	22%	0.222	32%	0.315	C	S	.	.	H	α-helix	trans	-57.9	-50.2	175.9	176.7	-178.7	176.1	-71.5	0	110.6	K17 V20 L21 L24 L47 L48 F49 V53 C54 E55	K17-K51 HydrophobicContact CG-CG 4.49Å; V20-K51 HydrophobicContact CG1-CB 4Å; L21-K51 HydrophobicContact CD2-CD 3.91Å; L24-K51 HydrophobicContact CD1-CD 4.31Å; L47-K51 WeakPolarHBondContact O-CB 3.49Å; L47-K51 PolarHBondContact O-N 3.24Å; L48-K51 WeakPolarHBondContact O-CB 3.44Å; L48-K51 PolarHBondContact O-N 3.04Å; F49-K51 VanDerWaalsContact C-N 3.32Å; F49-K51 PolarHBondContact O-N 3.04Å; K51-V53 VanDerWaalsContact C-N 3.34Å; K51-V53 PolarHBondContact O-N 3.19Å; K51-C54 PolarHBondContact O-N 3.35Å; K51-C54 VanDerWaalsContact O-N 3.16Å; K51-E55 WeakPolarHBondContact CE-OE1 3.35Å; K51-E55 HydrophobicContact CG-CG 4.39Å; K51-E55 IonicContact NZ-OE1 2.72Å; K51-E55 PolarHBondContact NZ-OE1 3.18Å; K51-E55 IonicContact NZ-OE2 3.09Å; K51-E55 PolarHBondContact NZ-OE2 3.36Å; K51-E55 WeakPolarHBondContact O-CG 3.48Å; K51-E55 PolarHBondContact O-N 3.18Å
52	K	75.3	Confident	75.6	Confident	115 Å²	115	65.7 Å²	65.7	50%	0.5	32%	0.322	S	S	.	.	H	α-helix	trans	-57.2	-46.6	178	-171.4	176	-177.9	180	0	111.1	L48 F49 C54 E55 T56	L48-K52 WeakPolarHBondContact O-CB 3.46Å; L48-K52 PolarHBondContact O-N 2.73Å; F49-K52 PolarHBondContact O-N 2.73Å; K52-C54 VanDerWaalsContact C-N 3.34Å; K52-C54 PolarHBondContact O-N 3.4Å; K52-E55 PolarHBondContact O-N 3.31Å; K52-T56 WeakPolarHBondContact O-CB 3.39Å; K52-T56 PolarHBondContact O-N 2.89Å; K52-T56 PolarHBondContact O-OG1 3.4Å
53	V	75.5	Confident	75.1	Confident	17 Å²	17	64.1 Å²	64.1	10%	0.103	32%	0.319	C	S	.	.	H	α-helix	trans	-57.8	-45.2	176.9	170.3	0	0	0	0	111.8	M1 L4 K5 F49 V50 K51 R57	M1-V53 HydrophobicContact SD-CG1 4.48Å; L4-V53 HydrophobicContact CB-CG1 4.19Å; K5-V53 HydrophobicContact CG-CG1 3.75Å; F49-V53 HydrophobicContact CD1-CG2 4.35Å; F49-V53 HydrophobicContact CE1-CG2 3.94Å; F49-V53 HydrophobicContact CE2-CG2 4.32Å; F49-V53 HydrophobicContact CZ-CG2 3.93Å; F49-V53 WeakPolarHBondContact O-CG2 3.42Å; F49-V53 PolarHBondContact O-N 3.5Å; V50-V53 PolarHBondContact O-N 3.38Å; K51-V53 VanDerWaalsContact C-N 3.34Å; K51-V53 PolarHBondContact O-N 3.19Å; V53-R57 WeakPolarHBondContact O-CB 3.4Å; V53-R57 PolarHBondContact O-N 2.8Å; V53-R57 VanDerWaalsContact O-N 3.08Å
54	C	77.3	Confident	73.9	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-65.7	-45.7	178.8	-63.7	0	0	0	0	111.7	L13 K17 V50 K51 K52 R57 I58	L13-C54 HydrophobicContact CD2-CB 4.4Å; K17-C54 HydrophobicContact CB-CB 4.14Å; V50-C54 PolarHBondContact O-N 3.25Å; V50-C54 PolarHBondContact O-SG 2.91Å; K51-C54 PolarHBondContact O-N 3.35Å; K51-C54 VanDerWaalsContact O-N 3.16Å; K52-C54 VanDerWaalsContact C-N 3.34Å; K52-C54 PolarHBondContact O-N 3.4Å; C54-R57 PolarHBondContact O-N 3.24Å; C54-I58 WeakPolarHBondContact O-CB 3.23Å; C54-I58 WeakPolarHBondContact O-CD1 3.47Å; C54-I58 WeakPolarHBondContact O-CG1 3.41Å; C54-I58 PolarHBondContact O-N 3.19Å
55	E	81.1	Confident	72.4	Confident	61 Å²	61	69.8 Å²	69.8	29%	0.285	36%	0.361	S	S	.	.	H	α-helix	trans	-62.5	-48.1	179.7	-73.1	174	162.1	0	0	111.8	K17 K51 K52 R57 I58 Q59	K17-E55 HydrophobicContact CD-CG 3.96Å; K51-E55 WeakPolarHBondContact CE-OE1 3.35Å; K51-E55 HydrophobicContact CG-CG 4.39Å; K51-E55 IonicContact NZ-OE1 2.72Å; K51-E55 PolarHBondContact NZ-OE1 3.18Å; K51-E55 IonicContact NZ-OE2 3.09Å; K51-E55 PolarHBondContact NZ-OE2 3.36Å; K51-E55 WeakPolarHBondContact O-CG 3.48Å; K51-E55 PolarHBondContact O-N 3.18Å; K52-E55 PolarHBondContact O-N 3.31Å; E55-R57 VanDerWaalsContact C-N 3.31Å; E55-R57 PolarHBondContact O-N 2.71Å; E55-I58 PolarHBondContact O-N 3.14Å; E55-Q59 WeakPolarHBondContact O-CB 3.49Å; E55-Q59 WeakPolarHBondContact O-CG 3.19Å; E55-Q59 PolarHBondContact O-N 2.87Å
56	T	74.3	Confident	71	Confident	47 Å²	47	71.9 Å²	71.9	29%	0.288	37%	0.368	S	S	.	.	H	α-helix	trans	-59.5	-42.1	176.4	-58.3	0	0	0	0	111.2	K52 R60	K52-T56 WeakPolarHBondContact O-CB 3.39Å; K52-T56 PolarHBondContact O-N 2.89Å; K52-T56 PolarHBondContact O-OG1 3.4Å; T56-R60 VanDerWaalsContact O-CG 3.24Å; T56-R60 WeakPolarHBondContact O-CG 3.41Å; T56-R60 PolarHBondContact O-N 3.39Å
57	R	73.1	Confident	69.8	Low	50 Å²	50	71 Å²	71	19%	0.189	36%	0.359	C	S	.	.	H	α-helix	trans	-69.3	-40.7	178.3	-176.2	59.6	178.2	171.3	-2.6	112.3	K5 T7 D8 L13 V53 C54 E55 R60 L61	K5-R57 VanDerWaalsContact O-CD 3.27Å; K5-R57 WeakPolarHBondContact O-CD 3.31Å; K5-R57 PolarHBondContact O-NE 3.38Å; T7-R57 PolarHBondContact O-NE 2.69Å; D8-R57 IonicContact OD1-CZ 3.04Å; D8-R57 IonicContact OD1-NH2 2.64Å; D8-R57 PolarHBondContact OD1-NH2 3.37Å; L13-R57 HydrophobicContact CD1-CB 3.85Å; L13-R57 HydrophobicContact CD1-CG 3.4Å; L13-R57 VanDerWaalsContact CD1-CG 3.4Å; L13-R57 HydrophobicContact CD2-CB 4.38Å; L13-R57 HydrophobicContact CD2-CG 4.35Å; V53-R57 WeakPolarHBondContact O-CB 3.4Å; V53-R57 PolarHBondContact O-N 2.8Å; V53-R57 VanDerWaalsContact O-N 3.08Å; C54-R57 PolarHBondContact O-N 3.24Å; E55-R57 VanDerWaalsContact C-N 3.31Å; E55-R57 PolarHBondContact O-N 2.71Å; R57-R60 WeakPolarHBondContact O-CB 3.18Å; R57-R60 PolarHBondContact O-N 3.5Å; R57-L61 HydrophobicContact CG-CD1 4.26Å; R57-L61 WeakPolarHBondContact O-CG 3.48Å; R57-L61 PolarHBondContact O-N 3.47Å
58	I	80.6	Confident	68.4	Low	13 Å²	13	73.2 Å²	73.2	7%	0.067	37%	0.371	C	S	.	.	H	α-helix	trans	-60.1	-47.6	175.6	-70.5	164	0	0	0	110.3	L13 E14 C54 E55 R60 L61 Q62	L13-I58 HydrophobicContact CB-CD1 3.76Å; L13-I58 HydrophobicContact CB-CG1 3.61Å; L13-I58 HydrophobicContact CD1-CG1 3.9Å; L13-I58 HydrophobicContact CG-CG1 4.38Å; E14-I58 HydrophobicContact CG-CD1 3.88Å; C54-I58 WeakPolarHBondContact O-CB 3.23Å; C54-I58 WeakPolarHBondContact O-CD1 3.47Å; C54-I58 WeakPolarHBondContact O-CG1 3.41Å; C54-I58 PolarHBondContact O-N 3.19Å; E55-I58 PolarHBondContact O-N 3.14Å; I58-R60 VanDerWaalsContact C-N 3.32Å; I58-R60 PolarHBondContact O-N 3.37Å; I58-L61 PolarHBondContact O-N 2.78Å; I58-L61 VanDerWaalsContact O-N 3.15Å; I58-Q62 HydrophobicContact CG2-CG 4.26Å; I58-Q62 WeakPolarHBondContact O-CB 3.4Å; I58-Q62 WeakPolarHBondContact O-CG 3.39Å; I58-Q62 PolarHBondContact O-N 3.48Å
59	Q	74.8	Confident	67	Low	126 Å²	126	70.4 Å²	70.4	59%	0.589	36%	0.357	S	S	*	.	H	α-helix	trans	-59.9	-41.1	177	-73.7	175.4	-6.5	0	0	112.2	E55 Q62 S63	E55-Q59 WeakPolarHBondContact O-CB 3.49Å; E55-Q59 WeakPolarHBondContact O-CG 3.19Å; E55-Q59 PolarHBondContact O-N 2.87Å; Q59-Q62 PolarHBondContact O-N 3.04Å; Q59-S63 WeakPolarHBondContact O-CB 3.44Å; Q59-S63 PolarHBondContact O-N 3.36Å; Q59-S63 PolarHBondContact O-OG 2.76Å
60	R	66.4	Low	65.5	Low	109 Å²	109	72 Å²	72	41%	0.411	37%	0.369	S	S	.	.	H	α-helix	trans	-59.7	-45.6	173.8	-74.5	173.6	-175.4	-173.6	3.2	111.7	T56 R57 I58 S63	T56-R60 VanDerWaalsContact O-CG 3.24Å; T56-R60 WeakPolarHBondContact O-CG 3.41Å; T56-R60 PolarHBondContact O-N 3.39Å; R57-R60 WeakPolarHBondContact O-CB 3.18Å; R57-R60 PolarHBondContact O-N 3.5Å; I58-R60 VanDerWaalsContact C-N 3.32Å; I58-R60 PolarHBondContact O-N 3.37Å; R60-S63 PolarHBondContact O-OG 3.43Å
61	L	71.3	Confident	64.3	Low	51 Å²	51	78.1 Å²	78.1	27%	0.267	39%	0.394	S	S	.	.	H	α-helix	trans	-68	-35.3	179.7	-68.3	172.3	0	0	0	112.8	P10 L13 R57 I58	P10-L61 HydrophobicContact CG-CB 4.45Å; P10-L61 HydrophobicContact CG-CD1 4.04Å; L13-L61 HydrophobicContact CD1-CD1 3.87Å; R57-L61 HydrophobicContact CG-CD1 4.26Å; R57-L61 WeakPolarHBondContact O-CG 3.48Å; R57-L61 PolarHBondContact O-N 3.47Å; I58-L61 PolarHBondContact O-N 2.78Å; I58-L61 VanDerWaalsContact O-N 3.15Å
62	Q	74	Confident	62.7	Low	135 Å²	135	78 Å²	78	63%	0.631	40%	0.396	S	S	*	.	H	α-helix	trans	-77.8	-34.4	-179.3	-72.7	173.5	-14.9	0	0	113.3	I58 Q59 G64	I58-Q62 HydrophobicContact CG2-CG 4.26Å; I58-Q62 WeakPolarHBondContact O-CB 3.4Å; I58-Q62 WeakPolarHBondContact O-CG 3.39Å; I58-Q62 PolarHBondContact O-N 3.48Å; Q59-Q62 PolarHBondContact O-N 3.04Å; Q62-G64 VanDerWaalsContact C-N 3.28Å; Q62-G64 PolarHBondContact O-N 3.44Å
63	S	65.4	Low	61.2	Low	69 Å²	69	74.1 Å²	74.1	48%	0.483	39%	0.385	S	S	.	.	H	α-helix	trans	-74.4	-16.6	-178.3	59.9	0	0	0	0	113.7	Q59 R60 K65	Q59-S63 WeakPolarHBondContact O-CB 3.44Å; Q59-S63 PolarHBondContact O-N 3.36Å; Q59-S63 PolarHBondContact O-OG 2.76Å; R60-S63 PolarHBondContact O-OG 3.43Å; S63-K65 PolarHBondContact O-N 2.99Å
64	G	53	Low	59.9	Low	72 Å²	72	77.5 Å²	77.5	74%	0.742	42%	0.415	S	S	*	.			trans	61.1	0.7	179.9	0	0	0	0	0	115	Q62	Q62-G64 VanDerWaalsContact C-N 3.28Å; Q62-G64 PolarHBondContact O-N 3.44Å
65	K	46	Very low	58.4	Low	167 Å²	167	80.6 Å²	80.6	73%	0.726	44%	0.437	S	S	*	.			trans	-91.6	114.4	-178.9	-72.6	176.9	-178.6	176.9	0	107.9	S63 V67	S63-K65 PolarHBondContact O-N 2.99Å; K65-V67 PolarHBondContact O-N 3.32Å
66	E	44.9	Very low	56.7	Low	139 Å²	139	79.3 Å²	79.3	65%	0.65	43%	0.43	S	S	*	.			trans	-49.4	137	149.5	-84.6	-161	146.5	0	0	107.1	D68 R221	E66-D68 PolarHBondContact O-N 3.47Å; E66-R221 IonicContact OE1-NH1 3.4Å; E66-R221 PolarHBondContact OE1-NH1 3.02Å; E66-R221 IonicContact OE2-CZ 3.18Å; E66-R221 IonicContact OE2-NH1 3.91Å; E66-R221 PolarHBondContact OE2-NH1 3.49Å; E66-R221 IonicContact OE2-NH2 3.96Å; E66-R221 PolarHBondContact OE2-NH2 2.97Å
67	V	47.7	Very low	55.8	Low	56 Å²	56	80.9 Å²	80.9	34%	0.339	46%	0.456	S	S	.	.			trans	-48.9	117.1	175.6	180	0	0	0	0	107.9	K65 A69 L72	K65-V67 PolarHBondContact O-N 3.32Å; V67-A69 PolarHBondContact O-N 3.39Å; V67-L72 HydrophobicContact CG1-CB 4.3Å; V67-L72 HydrophobicContact CG1-CD1 3.73Å; V67-L72 HydrophobicContact CG1-CD2 3.89Å; V67-L72 HydrophobicContact CG1-CG 4.18Å
68	D	47.3	Very low	54.9	Low	78 Å²	78	88.3 Å²	88.3	42%	0.417	49%	0.49	S	S	.	.			trans	-67.8	84.4	172.6	-169.3	-5.7	0	0	0	106.2	E66 L70 K71 L72	E66-D68 PolarHBondContact O-N 3.47Å; D68-L70 PolarHBondContact O-N 3.15Å; D68-K71 HydrophobicContact CB-CB 4.19Å; D68-K71 HydrophobicContact CB-CD 4.26Å; D68-K71 HydrophobicContact CB-CG 4.31Å; D68-K71 WeakPolarHBondContact O-CA 3.3Å; D68-K71 WeakPolarHBondContact O-CB 3.43Å; D68-K71 PolarHBondContact O-N 3.07Å; D68-K71 VanDerWaalsContact OD2-CD 3.29Å; D68-K71 WeakPolarHBondContact OD2-CD 3.18Å; D68-K71 WeakPolarHBondContact OD2-CE 2.89Å; D68-K71 WeakPolarHBondContact OD2-CG 3.35Å; D68-K71 IonicContact OD2-NZ 2.8Å; D68-L72 PolarHBondContact O-N 3.04Å
69	A	45.4	Very low	54.2	Low	6 Å²	6	89.6 Å²	89.6	5%	0.05	50%	0.496	C	S	.	.	H	α-helix	trans	-57.3	-25.1	-171.8	0	0	0	0	0	111.2	V67 A73 P217 V220 R221	V67-A69 PolarHBondContact O-N 3.39Å; A69-A73 WeakPolarHBondContact O-CB 3.24Å; A69-A73 PolarHBondContact O-N 3.26Å; A69-P217 HydrophobicContact CB-CB 3.9Å; A69-V220 HydrophobicContact CB-CB 4.45Å; A69-R221 HydrophobicContact CB-CG 4.28Å
70	L	44.2	Very low	54	Low	129 Å²	129	86.3 Å²	86.3	68%	0.675	49%	0.487	S	S	*	.	H	α-helix	trans	-69.2	-40.4	172.6	-76.8	152.9	0	0	0	112.5	D68 A74	D68-L70 PolarHBondContact O-N 3.15Å; L70-A74 VanDerWaalsContact O-CB 3.3Å; L70-A74 WeakPolarHBondContact O-CB 2.85Å; L70-A74 PolarHBondContact O-N 3.25Å
71	K	49.6	Very low	54.5	Low	149 Å²	149	85.1 Å²	85.1	65%	0.648	49%	0.492	S	S	*	.	H	α-helix	trans	-70.5	-36.1	173.2	-75.8	-177.5	-177.9	175	0	112.5	D68 S75	D68-K71 HydrophobicContact CB-CB 4.19Å; D68-K71 HydrophobicContact CB-CD 4.26Å; D68-K71 HydrophobicContact CB-CG 4.31Å; D68-K71 WeakPolarHBondContact O-CA 3.3Å; D68-K71 WeakPolarHBondContact O-CB 3.43Å; D68-K71 PolarHBondContact O-N 3.07Å; D68-K71 VanDerWaalsContact OD2-CD 3.29Å; D68-K71 WeakPolarHBondContact OD2-CD 3.18Å; D68-K71 WeakPolarHBondContact OD2-CE 2.89Å; D68-K71 WeakPolarHBondContact OD2-CG 3.35Å; D68-K71 IonicContact OD2-NZ 2.8Å; K71-S75 PolarHBondContact O-N 3.21Å; K71-S75 VanDerWaalsContact O-N 3.12Å; K71-S75 PolarHBondContact O-OG 3.04Å
72	L	48.8	Very low	54.7	Low	50 Å²	50	83.5 Å²	83.5	26%	0.262	48%	0.483	S	S	.	.	H	α-helix	trans	-67.1	-47.3	176.1	-128.9	85.4	0	0	0	110.9	V67 D68 A74 S75 F76 V220 L229	V67-L72 HydrophobicContact CG1-CB 4.3Å; V67-L72 HydrophobicContact CG1-CD1 3.73Å; V67-L72 HydrophobicContact CG1-CD2 3.89Å; V67-L72 HydrophobicContact CG1-CG 4.18Å; D68-L72 PolarHBondContact O-N 3.04Å; L72-A74 VanDerWaalsContact C-N 3.32Å; L72-A74 PolarHBondContact O-N 3.49Å; L72-S75 PolarHBondContact O-N 3.43Å; L72-S75 VanDerWaalsContact O-N 3.11Å; L72-S75 PolarHBondContact O-OG 3.47Å; L72-F76 HydrophobicContact CD2-CD2 4.46Å; L72-F76 HydrophobicContact CD2-CE2 3.97Å; L72-F76 HydrophobicContact CG-CD2 4.17Å; L72-F76 HydrophobicContact CG-CE2 3.79Å; L72-F76 WeakPolarHBondContact O-CD2 3.02Å; L72-F76 PolarHBondContact O-N 3.4Å; L72-V220 HydrophobicContact CB-CG1 4.21Å; L72-V220 HydrophobicContact CD2-CG1 4.42Å; L72-L229 HydrophobicContact CD2-CD1 3.26Å
73	A	43.9	Very low	54.8	Low	33 Å²	33	80 Å²	80	27%	0.273	47%	0.472	S	S	.	.	H	α-helix	trans	-58.3	-42.4	174.6	0	0	0	0	0	112.3	A69 S75 F76 V220	A69-A73 WeakPolarHBondContact O-CB 3.24Å; A69-A73 PolarHBondContact O-N 3.26Å; A73-S75 VanDerWaalsContact C-N 3.26Å; A73-S75 PolarHBondContact O-N 3.05Å; A73-F76 PolarHBondContact O-N 3.14Å; A73-V220 HydrophobicContact CB-CG2 4.07Å
74	A	49.5	Very low	55.4	Low	88 Å²	88	76.8 Å²	76.8	73%	0.727	45%	0.45	S	S	*	.	H	α-helix	trans	-65.5	-27.8	177.5	0	0	0	0	0	113.2	L70 L72	L70-A74 VanDerWaalsContact O-CB 3.3Å; L70-A74 WeakPolarHBondContact O-CB 2.85Å; L70-A74 PolarHBondContact O-N 3.25Å; L72-A74 VanDerWaalsContact C-N 3.32Å; L72-A74 PolarHBondContact O-N 3.49Å
75	S	44.8	Very low	56.3	Low	65 Å²	65	76.8 Å²	76.8	46%	0.455	43%	0.432	S	S	.	.	H	α-helix	trans	-82.1	-21.4	177.5	68.6	0	0	0	0	114.1	K71 L72 A73	K71-S75 PolarHBondContact O-N 3.21Å; K71-S75 VanDerWaalsContact O-N 3.12Å; K71-S75 PolarHBondContact O-OG 3.04Å; L72-S75 PolarHBondContact O-N 3.43Å; L72-S75 VanDerWaalsContact O-N 3.11Å; L72-S75 PolarHBondContact O-OG 3.47Å; A73-S75 VanDerWaalsContact C-N 3.26Å; A73-S75 PolarHBondContact O-N 3.05Å
76	F	45.1	Very low	57.1	Low	33 Å²	33	74 Å²	74	15%	0.145	42%	0.422	C	S	.	.	S	Bend	trans	-111.9	86.5	-175.5	-70.2	-63.1	0	0	0	110.7	L72 A73 L79 L229 K230	L72-F76 HydrophobicContact CD2-CD2 4.46Å; L72-F76 HydrophobicContact CD2-CE2 3.97Å; L72-F76 HydrophobicContact CG-CD2 4.17Å; L72-F76 HydrophobicContact CG-CE2 3.79Å; L72-F76 WeakPolarHBondContact O-CD2 3.02Å; L72-F76 PolarHBondContact O-N 3.4Å; A73-F76 PolarHBondContact O-N 3.14Å; F76-L79 HydrophobicContact CB-CD2 4.01Å; F76-L229 HydrophobicContact CD2-CD1 4.46Å; F76-L229 HydrophobicContact CD2-CD2 4.09Å; F76-L229 HydrophobicContact CE2-CB 4.12Å; F76-L229 HydrophobicContact CE2-CD1 4.09Å; F76-L229 HydrophobicContact CE2-CD2 4.36Å; F76-L229 HydrophobicContact CE2-CG 4.44Å; F76-L229 HydrophobicContact CZ-CB 4.16Å; F76-K230 WeakPolarHBondContact CD1-O 3.41Å; F76-K230 WeakPolarHBondContact CE1-O 3.18Å
77	G	55.1	Low	58.1	Low	81 Å²	81	67.3 Å²	67.3	84%	0.835	39%	0.391	S	S	*	.	S	Bend	trans	-27.6	-95.1	-178.5	0	0	0	0	0	116.8
78	K	56.2	Low	58.8	Low	205 Å²	205	64.9 Å²	64.9	89%	0.891	38%	0.376	S	S	*	.	S	Bend	trans	-93.5	105	176.6	-165.6	176.1	-175.3	178.9	0	109.4
79	L	65.8	Low	59	Low	40 Å²	40	63.8 Å²	63.8	21%	0.209	37%	0.371	C	S	.	.			trans	-58.3	147.9	176.4	-67.6	168.3	0	0	0	111.6	F76 V81 V220 L223 L229	F76-L79 HydrophobicContact CB-CD2 4.01Å; L79-V81 PolarHBondContact O-N 3.27Å; L79-V220 HydrophobicContact CD1-CG2 3.73Å; L79-L223 HydrophobicContact CB-CD1 4.02Å; L79-L223 HydrophobicContact CD2-CD1 4.02Å; L79-L223 HydrophobicContact CG-CD1 4.48Å; L79-L229 HydrophobicContact CD2-CD2 4.03Å
80	C	69.9	Low	59.2	Low	58 Å²	58	67.7 Å²	67.7	39%	0.392	39%	0.388	S	S	.	.			trans	-61.5	130.1	173.5	-171.5	0	0	0	0	109.9	Y219 L223 M228	C80-Y219 WeakPolarHBondContact O-CE1 3.44Å; C80-Y219 PolarHBondContact O-OH 3.38Å; C80-L223 HydrophobicContact CB-CD2 4.2Å; C80-M228 HydrophobicContact CB-CE 4.21Å; C80-M228 WeakPolarHBondContact SG-CE 3.3Å
81	V	77.3	Confident	59.3	Low	84 Å²	84	66.2 Å²	66.2	51%	0.509	38%	0.381	S	S	.	.			trans	-97.5	110	177.3	-177.5	0	0	0	0	108.3	L79 Y210 K214 Y219	L79-V81 PolarHBondContact O-N 3.27Å; V81-Y210 WeakPolarHBondContact CG1-OH 3.23Å; V81-K214 HydrophobicContact CG1-CD 4.06Å; V81-Y219 VanDerWaalsContact CA-OH 3.3Å; V81-Y219 WeakPolarHBondContact CA-OH 3.37Å
82	I	73.8	Confident	59.3	Low	16 Å²	16	62.5 Å²	62.5	8%	0.082	37%	0.368	C	S	.	.			trans	-89.7	118.3	175.4	-56.7	-178.5	0	0	0	107.6	H86 I87 Y210 Y219 M222 L223 L226 M228	I82-H86 HydrophobicContact CG2-CB 3.79Å; I82-I87 HydrophobicContact CB-CD1 4.32Å; I82-I87 HydrophobicContact CB-CG1 4.12Å; I82-I87 HydrophobicContact CG2-CD1 4.43Å; I82-I87 HydrophobicContact CG2-CG1 3.74Å; I82-I87 WeakPolarHBondContact O-CD1 3.36Å; I82-Y210 PolarHBondContact O-OH 2.84Å; I82-Y219 PolarHBondContact N-OH 3.34Å; I82-M222 HydrophobicContact CD1-CE 3.84Å; I82-L223 HydrophobicContact CD1-CD2 3.72Å; I82-L223 HydrophobicContact CG1-CD2 4.03Å; I82-L226 HydrophobicContact CD1-CD1 3.43Å; I82-L226 VanDerWaalsContact CD1-CD1 3.43Å; I82-M228 HydrophobicContact CD1-CE 3.85Å; I82-M228 HydrophobicContact CD1-SD 3.51Å; I82-M228 VanDerWaalsContact CD1-SD 3.51Å; I82-M228 HydrophobicContact CG1-CE 3.75Å; I82-M228 HydrophobicContact CG1-SD 4.12Å
83	P	77.4	Confident	59.3	Low	63 Å²	63	60.1 Å²	60.1	41%	0.409	36%	0.356	S	S	.	.			trans	-53.3	148.1	177.1	-28.7	38.5	0	0	0	113.6	D85 H86 I87	P83-D85 VanDerWaalsContact C-N 3.34Å; P83-D85 WeakPolarHBondContact CB-OD1 3.17Å; P83-D85 PolarHBondContact O-N 3.44Å; P83-H86 WeakPolarHBondContact O-CB 3.26Å; P83-H86 PolarHBondContact O-N 3.48Å; P83-I87 PolarHBondContact O-N 3.48Å; P83-I87 VanDerWaalsContact O-N 3.09Å
84	L	76.9	Confident	59.9	Low	1 Å²	1	59 Å²	59	1%	0.005	35%	0.345	C	S	.	.	H	α-helix	trans	-61.5	-39.7	-174.4	179.2	60.8	0	0	0	112.5	H86 I87 L88 F97 Y200 M203 L204 Y210	L84-H86 VanDerWaalsContact C-N 3.26Å; L84-H86 PolarHBondContact O-N 2.76Å; L84-I87 WeakPolarHBondContact O-CB 3.46Å; L84-I87 PolarHBondContact O-N 3.01Å; L84-I87 VanDerWaalsContact O-N 3.12Å; L84-L88 HydrophobicContact CD1-CD1 4.32Å; L84-L88 HydrophobicContact CD1-CD2 4.45Å; L84-L88 HydrophobicContact CD1-CG 4.08Å; L84-L88 HydrophobicContact CG-CD1 3.95Å; L84-L88 HydrophobicContact CG-CG 4.2Å; L84-L88 WeakPolarHBondContact O-CB 3.24Å; L84-L88 VanDerWaalsContact O-CG 3.24Å; L84-L88 WeakPolarHBondContact O-CG 3.31Å; L84-L88 PolarHBondContact O-N 3.25Å; L84-F97 HydrophobicContact CD1-CD1 4.33Å; L84-F97 HydrophobicContact CD1-CE1 3.71Å; L84-F97 HydrophobicContact CD1-CE2 4.44Å; L84-F97 HydrophobicContact CD1-CZ 3.77Å; L84-Y200 HydrophobicContact CB-CE2 4.47Å; L84-Y200 HydrophobicContact CD2-CD2 4.38Å; L84-Y200 HydrophobicContact CD2-CE2 3.97Å; L84-Y200 HydrophobicContact CG-CE2 4.1Å; L84-M203 HydrophobicContact CD2-CB 3.97Å; L84-L204 HydrophobicContact CB-CD1 4Å; L84-L204 HydrophobicContact CD2-CB 4.05Å; L84-L204 HydrophobicContact CD2-CD1 4.19Å; L84-Y210 HydrophobicContact CB-CD1 4.3Å; L84-Y210 HydrophobicContact CB-CD2 4.28Å; L84-Y210 HydrophobicContact CB-CE1 4.38Å; L84-Y210 HydrophobicContact CB-CE2 4.43Å; L84-Y210 HydrophobicContact CB-CG 4.24Å; L84-Y210 HydrophobicContact CD1-CD2 3.98Å; L84-Y210 HydrophobicContact CD1-CG 4.21Å; L84-Y210 HydrophobicContact CD2-CG 4.49Å
85	D	71.8	Confident	60.1	Low	71 Å²	71	58.5 Å²	58.5	38%	0.38	33%	0.328	S	S	.	.	H	α-helix	trans	-55.7	-39.3	173	61.3	-37.6	0	0	0	112.3	P83 L88 V89	P83-D85 VanDerWaalsContact C-N 3.34Å; P83-D85 WeakPolarHBondContact CB-OD1 3.17Å; P83-D85 PolarHBondContact O-N 3.44Å; D85-L88 PolarHBondContact O-N 3.47Å; D85-V89 VanDerWaalsContact O-CG2 3.28Å; D85-V89 WeakPolarHBondContact O-CG2 3.33Å; D85-V89 PolarHBondContact O-N 3.39Å
86	H	63.3	Low	61	Low	108 Å²	108	57.1 Å²	57.1	50%	0.5	31%	0.314	S	S	.	.	H	α-helix	trans	-72.6	-35.3	176.8	-67.4	73.5	0	0	0	112.1	I82 P83 L84 H90	I82-H86 HydrophobicContact CG2-CB 3.79Å; P83-H86 WeakPolarHBondContact O-CB 3.26Å; P83-H86 PolarHBondContact O-N 3.48Å; L84-H86 VanDerWaalsContact C-N 3.26Å; L84-H86 PolarHBondContact O-N 2.76Å; H86-H90 WeakPolarHBondContact O-CB 3.27Å; H86-H90 PolarHBondContact O-N 3.3Å
87	I	65.6	Low	62.5	Low	0 Å²	0	55.6 Å²	55.6	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-64.7	-43.4	174.6	-67.8	167.5	0	0	0	110.5	I82 P83 L84 V89 H90 A93 L94 F97 Y210 F213 Y219	I82-I87 HydrophobicContact CB-CD1 4.32Å; I82-I87 HydrophobicContact CB-CG1 4.12Å; I82-I87 HydrophobicContact CG2-CD1 4.43Å; I82-I87 HydrophobicContact CG2-CG1 3.74Å; I82-I87 WeakPolarHBondContact O-CD1 3.36Å; P83-I87 PolarHBondContact O-N 3.48Å; P83-I87 VanDerWaalsContact O-N 3.09Å; L84-I87 WeakPolarHBondContact O-CB 3.46Å; L84-I87 PolarHBondContact O-N 3.01Å; L84-I87 VanDerWaalsContact O-N 3.12Å; I87-V89 PolarHBondContact O-N 3.08Å; I87-H90 PolarHBondContact O-N 3.43Å; I87-A93 HydrophobicContact CB-CB 4.36Å; I87-A93 HydrophobicContact CG1-CB 4.28Å; I87-A93 HydrophobicContact CG2-CB 4.21Å; I87-L94 WeakPolarHBondContact O-CA 3.45Å; I87-L94 WeakPolarHBondContact O-CB 3.25Å; I87-L94 PolarHBondContact O-N 3.14Å; I87-F97 HydrophobicContact CG2-CB 3.6Å; I87-F97 HydrophobicContact CG2-CD1 4.19Å; I87-F97 HydrophobicContact CG2-CG 3.93Å; I87-Y210 HydrophobicContact CD1-CD2 4.12Å; I87-Y210 HydrophobicContact CD1-CE2 3.52Å; I87-F213 HydrophobicContact CD1-CD1 4.38Å; I87-F213 HydrophobicContact CD1-CE1 4.07Å; I87-Y219 HydrophobicContact CD1-CE2 4.36Å
88	L	62.2	Low	62.7	Low	5 Å²	5	53 Å²	53	3%	0.026	27%	0.273	C	S	.	.	H	α-helix	trans	-65.7	-20.1	-176.9	-71.6	175.1	0	0	0	114	L84 D85 L94 F97 L110 W113 Y200 M203	L84-L88 HydrophobicContact CD1-CD1 4.32Å; L84-L88 HydrophobicContact CD1-CD2 4.45Å; L84-L88 HydrophobicContact CD1-CG 4.08Å; L84-L88 HydrophobicContact CG-CD1 3.95Å; L84-L88 HydrophobicContact CG-CG 4.2Å; L84-L88 WeakPolarHBondContact O-CB 3.24Å; L84-L88 VanDerWaalsContact O-CG 3.24Å; L84-L88 WeakPolarHBondContact O-CG 3.31Å; L84-L88 PolarHBondContact O-N 3.25Å; D85-L88 PolarHBondContact O-N 3.47Å; L88-L94 HydrophobicContact CD2-CD1 4.11Å; L88-F97 HydrophobicContact CD2-CD1 4.23Å; L88-F97 HydrophobicContact CD2-CE1 4.21Å; L88-L110 HydrophobicContact CD2-CD1 3.36Å; L88-W113 HydrophobicContact CB-CE3 4.17Å; L88-W113 HydrophobicContact CB-CH2 3.98Å; L88-W113 HydrophobicContact CB-CZ3 3.62Å; L88-W113 HydrophobicContact CD1-CD2 3.97Å; L88-W113 HydrophobicContact CD1-CE3 3.82Å; L88-W113 HydrophobicContact CD1-CH2 4.14Å; L88-W113 HydrophobicContact CD1-CZ2 4.16Å; L88-W113 HydrophobicContact CD1-CZ3 3.95Å; L88-W113 HydrophobicContact CD2-CE3 4.1Å; L88-W113 HydrophobicContact CD2-CZ3 4.39Å; L88-W113 HydrophobicContact CG-CE3 4.25Å; L88-W113 HydrophobicContact CG-CZ3 4.19Å; L88-Y200 HydrophobicContact CD1-CD2 3.98Å; L88-Y200 HydrophobicContact CD1-CE2 3.88Å; L88-M203 HydrophobicContact CD1-CE 4.47Å
89	V	52.5	Low	63.1	Low	54 Å²	54	46.1 Å²	46.1	33%	0.327	25%	0.246	S	C	.	.	H	α-helix	trans	-109.8	-19.4	-177.8	-171.1	0	0	0	0	112.3	D85 I87 L421	D85-V89 VanDerWaalsContact O-CG2 3.28Å; D85-V89 WeakPolarHBondContact O-CG2 3.33Å; D85-V89 PolarHBondContact O-N 3.39Å; I87-V89 PolarHBondContact O-N 3.08Å; V89-L421 HydrophobicContact CG1-CB 3.32Å; V89-L421 HydrophobicContact CG1-CD1 3.37Å; V89-L421 HydrophobicContact CG1-CD2 4.01Å; V89-L421 HydrophobicContact CG1-CG 3.7Å
90	H	48.9	Very low	63.9	Low	88 Å²	88	45.6 Å²	45.6	41%	0.407	24%	0.242	S	C	.	.			trans	-91.6	107.7	-178.6	-171.1	-67.4	0	0	0	112.1	H86 I87 I92 A93 L94 L226	H86-H90 WeakPolarHBondContact O-CB 3.27Å; H86-H90 PolarHBondContact O-N 3.3Å; I87-H90 PolarHBondContact O-N 3.43Å; H90-I92 VanDerWaalsContact C-N 3.3Å; H90-I92 PolarHBondContact ND1-N 2.85Å; H90-I92 PolarHBondContact O-N 2.95Å; H90-A93 HydrophobicContact CB-CB 4.04Å; H90-A93 PolarHBondContact ND1-N 3.36Å; H90-A93 WeakPolarHBondContact O-CA 3.4Å; H90-A93 WeakPolarHBondContact O-CB 3.31Å; H90-A93 PolarHBondContact O-N 2.97Å; H90-L94 WeakPolarHBondContact O-CB 3.39Å; H90-L94 PolarHBondContact O-N 3.13Å; H90-L226 WeakPolarHBondContact CE1-CD2 3.33Å
91	N	46.1	Very low	64.1	Low	98 Å²	98	42.8 Å²	42.8	52%	0.524	22%	0.224	S	C	.	.	H	α-helix	trans	-42.8	-45.2	-174.8	-65.4	-14.4	0	0	0	116.1	Q95	N91-Q95 PolarHBondContact O-N 2.88Å
92	I	50.2	Low	63.9	Low	71 Å²	71	44.4 Å²	44.4	36%	0.364	23%	0.225	S	C	.	.	H	α-helix	trans	-69.6	-45.2	178.9	-58.1	176.2	0	0	0	110.7	H90 Q95 F96 E225 L226	H90-I92 VanDerWaalsContact C-N 3.3Å; H90-I92 PolarHBondContact ND1-N 2.85Å; H90-I92 PolarHBondContact O-N 2.95Å; I92-Q95 PolarHBondContact O-N 3.27Å; I92-F96 HydrophobicContact CG2-CD2 4.41Å; I92-F96 HydrophobicContact CG2-CE2 4.01Å; I92-F96 WeakPolarHBondContact O-CD2 3.3Å; I92-E225 HydrophobicContact CG2-CB 4.1Å; I92-E225 HydrophobicContact CG2-CG 3.75Å; I92-L226 HydrophobicContact CB-CD2 3.79Å; I92-L226 HydrophobicContact CD1-CD2 4.34Å; I92-L226 HydrophobicContact CG2-CD2 3.84Å; I92-L226 HydrophobicContact CG2-CG 4.36Å
93	A	50.2	Low	63.7	Low	1 Å²	1	47.9 Å²	47.9	1%	0.008	26%	0.257	C	S	.	.	H	α-helix	trans	-68.5	-40.6	-176.8	0	0	0	0	0	111.3	I87 H90 Q95 F96 F97 M222 L226	I87-A93 HydrophobicContact CB-CB 4.36Å; I87-A93 HydrophobicContact CG1-CB 4.28Å; I87-A93 HydrophobicContact CG2-CB 4.21Å; H90-A93 HydrophobicContact CB-CB 4.04Å; H90-A93 PolarHBondContact ND1-N 3.36Å; H90-A93 WeakPolarHBondContact O-CA 3.4Å; H90-A93 WeakPolarHBondContact O-CB 3.31Å; H90-A93 PolarHBondContact O-N 2.97Å; A93-Q95 VanDerWaalsContact C-N 3.28Å; A93-Q95 PolarHBondContact O-N 3.31Å; A93-F96 PolarHBondContact O-N 2.7Å; A93-F97 PolarHBondContact O-N 3.13Å; A93-F97 VanDerWaalsContact O-N 3.07Å; A93-M222 VanDerWaalsContact CA-SD 3.54Å; A93-M222 HydrophobicContact CB-CG 4.2Å; A93-M222 HydrophobicContact CB-SD 3.59Å; A93-M222 VanDerWaalsContact CB-SD 3.59Å; A93-L226 HydrophobicContact CB-CD1 4.16Å
94	L	56.3	Low	63.5	Low	9 Å²	9	47.4 Å²	47.4	5%	0.047	26%	0.258	C	S	.	.	H	α-helix	trans	-57.8	-40.1	176.2	-169.3	57.8	0	0	0	112.2	I87 L88 H90 F97 M98 L425	I87-L94 WeakPolarHBondContact O-CA 3.45Å; I87-L94 WeakPolarHBondContact O-CB 3.25Å; I87-L94 PolarHBondContact O-N 3.14Å; L88-L94 HydrophobicContact CD2-CD1 4.11Å; H90-L94 WeakPolarHBondContact O-CB 3.39Å; H90-L94 PolarHBondContact O-N 3.13Å; L94-F97 PolarHBondContact O-N 3.17Å; L94-M98 HydrophobicContact CG-CE 4.31Å; L94-M98 HydrophobicContact CG-CG 4.45Å; L94-M98 WeakPolarHBondContact O-CB 3.39Å; L94-M98 VanDerWaalsContact O-CG 3.29Å; L94-M98 WeakPolarHBondContact O-CG 3.31Å; L94-M98 PolarHBondContact O-N 2.95Å; L94-L425 HydrophobicContact CD1-CD1 3.19Å; L94-L425 HydrophobicContact CD1-CG 4.41Å; L94-L425 HydrophobicContact CD2-CB 4.41Å; L94-L425 HydrophobicContact CD2-CD1 3.54Å; L94-L425 HydrophobicContact CD2-CG 4.01Å; L94-L425 HydrophobicContact CG-CD1 3.52Å; L94-L425 HydrophobicContact CG-CG 4.29Å
95	Q	52.3	Low	63.3	Low	78 Å²	78	50.5 Å²	50.5	36%	0.364	29%	0.29	S	S	.	.	H	α-helix	trans	-59	-49.7	176.5	-174.8	64.5	47.3	0	0	112.2	N91 I92 A93 F97 M98 D99	N91-Q95 PolarHBondContact O-N 2.88Å; I92-Q95 PolarHBondContact O-N 3.27Å; A93-Q95 VanDerWaalsContact C-N 3.28Å; A93-Q95 PolarHBondContact O-N 3.31Å; Q95-F97 PolarHBondContact O-N 2.93Å; Q95-M98 HydrophobicContact CB-CE 4.32Å; Q95-M98 PolarHBondContact O-N 3.42Å; Q95-D99 PolarHBondContact NE2-OD1 3.41Å; Q95-D99 PolarHBondContact O-N 3.08Å
96	F	65.2	Low	63.4	Low	36 Å²	36	47.3 Å²	47.3	16%	0.158	27%	0.274	C	S	.	.	H	α-helix	trans	-63.9	-33.9	178.5	-72.8	-83.8	0	0	0	112	I92 A93 F100 F213 L218 R221 M222 E225	I92-F96 HydrophobicContact CG2-CD2 4.41Å; I92-F96 HydrophobicContact CG2-CE2 4.01Å; I92-F96 WeakPolarHBondContact O-CD2 3.3Å; A93-F96 PolarHBondContact O-N 2.7Å; F96-F100 WeakPolarHBondContact O-CB 3.43Å; F96-F100 PolarHBondContact O-N 3.43Å; F96-F100 VanDerWaalsContact O-N 3.1Å; F96-F213 HydrophobicContact CB-CE2 4.3Å; F96-F213 HydrophobicContact CB-CZ 3.96Å; F96-F213 WeakPolarHBondContact O-CE2 3.4Å; F96-L218 HydrophobicContact CD1-CD2 4.43Å; F96-L218 WeakPolarHBondContact CD1-O 3.16Å; F96-R221 HydrophobicContact CD1-CB 4.32Å; F96-R221 HydrophobicContact CE1-CB 3.67Å; F96-R221 HydrophobicContact CZ-CB 4.32Å; F96-M222 HydrophobicContact CB-CB 3.77Å; F96-M222 HydrophobicContact CB-CG 3.99Å; F96-M222 HydrophobicContact CB-SD 4.26Å; F96-M222 HydrophobicContact CD1-CB 4.12Å; F96-M222 HydrophobicContact CD2-CB 3.53Å; F96-M222 HydrophobicContact CD2-CG 3.62Å; F96-M222 HydrophobicContact CE2-CB 4.12Å; F96-M222 HydrophobicContact CE2-CG 4.36Å; F96-M222 HydrophobicContact CG-CB 3.54Å; F96-M222 HydrophobicContact CG-CG 3.98Å; F96-E225 HydrophobicContact CE2-CB 3.99Å; F96-E225 HydrophobicContact CE2-CG 4.29Å; F96-E225 HydrophobicContact CZ-CB 4.16Å
97	F	75.2	Confident	63.8	Low	0 Å²	0	43.7 Å²	43.7	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-72.3	-38.4	175.8	-168.2	-123.5	0	0	0	112.5	L84 I87 L88 A93 L94 Q95 F100 M101 L110 F213	L84-F97 HydrophobicContact CD1-CD1 4.33Å; L84-F97 HydrophobicContact CD1-CE1 3.71Å; L84-F97 HydrophobicContact CD1-CE2 4.44Å; L84-F97 HydrophobicContact CD1-CZ 3.77Å; I87-F97 HydrophobicContact CG2-CB 3.6Å; I87-F97 HydrophobicContact CG2-CD1 4.19Å; I87-F97 HydrophobicContact CG2-CG 3.93Å; L88-F97 HydrophobicContact CD2-CD1 4.23Å; L88-F97 HydrophobicContact CD2-CE1 4.21Å; A93-F97 PolarHBondContact O-N 3.13Å; A93-F97 VanDerWaalsContact O-N 3.07Å; L94-F97 PolarHBondContact O-N 3.17Å; Q95-F97 PolarHBondContact O-N 2.93Å; F97-F100 HydrophobicContact CE2-CD1 4.47Å; F97-F100 PolarHBondContact O-N 2.96Å; F97-M101 HydrophobicContact CD1-CG 4.23Å; F97-M101 HydrophobicContact CD2-CG 4.22Å; F97-M101 HydrophobicContact CE1-CG 3.98Å; F97-M101 HydrophobicContact CE1-SD 4.37Å; F97-M101 HydrophobicContact CE2-CG 3.98Å; F97-M101 HydrophobicContact CE2-SD 4.02Å; F97-M101 HydrophobicContact CG-CG 4.35Å; F97-M101 HydrophobicContact CZ-CE 4.26Å; F97-M101 HydrophobicContact CZ-CG 3.85Å; F97-M101 HydrophobicContact CZ-SD 3.78Å; F97-M101 WeakPolarHBondContact O-CB 3.39Å; F97-M101 WeakPolarHBondContact O-CG 3.42Å; F97-M101 PolarHBondContact O-N 2.95Å; F97-L110 HydrophobicContact CD1-CD1 4.12Å; F97-L110 HydrophobicContact CD1-CD2 4.09Å; F97-L110 HydrophobicContact CE1-CD1 4.01Å; F97-L110 HydrophobicContact CE1-CD2 4.41Å; F97-F213 HydrophobicContact CB-CE1 3.99Å; F97-F213 HydrophobicContact CB-CZ 4.04Å; F97-F213 HydrophobicContact CD2-CB 4.08Å; F97-F213 AromaticContact CD2-CD1 3.39Å; F97-F213 HydrophobicContact CD2-CD1 3.39Å; F97-F213 HydrophobicContact CD2-CD2 4.13Å; F97-F213 AromaticContact CD2-CE1 3.71Å; F97-F213 HydrophobicContact CD2-CE1 3.71Å; F97-F213 HydrophobicContact CD2-CE2 4.42Å; F97-F213 AromaticContact CD2-CG 3.61Å; F97-F213 HydrophobicContact CD2-CG 3.61Å; F97-F213 HydrophobicContact CD2-CZ 4.22Å; F97-F213 HydrophobicContact CE2-CB 3.99Å; F97-F213 AromaticContact CE2-CD1 3.96Å; F97-F213 HydrophobicContact CE2-CD1 3.96Å; F97-F213 HydrophobicContact CE2-CG 4.04Å; F97-F213 HydrophobicContact CG-CD1 4.34Å; F97-F213 HydrophobicContact CG-CE1 4.25Å
98	M	60.6	Low	64.1	Low	28 Å²	28	43.9 Å²	43.9	14%	0.138	26%	0.259	C	S	.	.	H	α-helix	trans	-59.8	-47.5	172.7	-76.1	-171.7	-68.4	0	0	111.5	L94 Q95 F100 M101 Q102 L110 L425	L94-M98 HydrophobicContact CG-CE 4.31Å; L94-M98 HydrophobicContact CG-CG 4.45Å; L94-M98 WeakPolarHBondContact O-CB 3.39Å; L94-M98 VanDerWaalsContact O-CG 3.29Å; L94-M98 WeakPolarHBondContact O-CG 3.31Å; L94-M98 PolarHBondContact O-N 2.95Å; Q95-M98 HydrophobicContact CB-CE 4.32Å; Q95-M98 PolarHBondContact O-N 3.42Å; M98-F100 VanDerWaalsContact C-N 3.3Å; M98-F100 PolarHBondContact O-N 3.45Å; M98-M101 PolarHBondContact O-N 3.32Å; M98-Q102 WeakPolarHBondContact O-CB 3.14Å; M98-Q102 PolarHBondContact O-N 2.89Å; M98-L110 HydrophobicContact CB-CD2 4.45Å; M98-L110 HydrophobicContact CG-CD2 3.8Å; M98-L425 HydrophobicContact CG-CD1 4.14Å; M98-L425 HydrophobicContact CG-CD2 3.8Å; M98-L425 HydrophobicContact CG-CG 4.2Å; M98-L425 HydrophobicContact SD-CD1 4.16Å; M98-L425 HydrophobicContact SD-CD2 3.4Å; M98-L425 WeakPolarHBondContact SD-CD2 3.26Å; M98-L425 HydrophobicContact SD-CG 3.62Å
99	D	64.6	Low	64.9	Low	60 Å²	60	44.4 Å²	44.4	32%	0.321	26%	0.261	S	S	.	.	H	α-helix	trans	-61.8	-40.2	178.7	-64.3	-13.5	0	0	0	110.9	Q95 Q102 A103 L218	Q95-D99 PolarHBondContact NE2-OD1 3.41Å; Q95-D99 PolarHBondContact O-N 3.08Å; D99-Q102 WeakPolarHBondContact O-CB 3.37Å; D99-A103 PolarHBondContact O-N 3.25Å; D99-L218 HydrophobicContact CB-CD1 4.45Å
100	F	80.9	Confident	65.9	Low	28 Å²	28	41.9 Å²	41.9	12%	0.123	25%	0.246	C	C	.	.	H	α-helix	trans	-65.2	-48.1	175.1	177.8	-93.9	0	0	0	112.2	F96 F97 M98 Q102 A103 A104 F209 F213 L218	F96-F100 WeakPolarHBondContact O-CB 3.43Å; F96-F100 PolarHBondContact O-N 3.43Å; F96-F100 VanDerWaalsContact O-N 3.1Å; F97-F100 HydrophobicContact CE2-CD1 4.47Å; F97-F100 PolarHBondContact O-N 2.96Å; M98-F100 VanDerWaalsContact C-N 3.3Å; M98-F100 PolarHBondContact O-N 3.45Å; F100-Q102 PolarHBondContact O-N 3.43Å; F100-A103 PolarHBondContact O-N 3.03Å; F100-A103 VanDerWaalsContact O-N 3.16Å; F100-A104 PolarHBondContact O-N 3.4Å; F100-F209 WeakPolarHBondContact CE1-O 3.42Å; F100-F213 HydrophobicContact CB-CD2 3.53Å; F100-F213 HydrophobicContact CB-CE2 3.85Å; F100-F213 HydrophobicContact CB-CG 4.49Å; F100-F213 HydrophobicContact CD1-CB 3.73Å; F100-F213 AromaticContact CD1-CD2 3.91Å; F100-F213 HydrophobicContact CD1-CD2 3.91Å; F100-F213 HydrophobicContact CD1-CG 4.15Å; F100-F213 HydrophobicContact CD2-CB 4.44Å; F100-F213 AromaticContact CD2-CD2 3.82Å; F100-F213 HydrophobicContact CD2-CD2 3.82Å; F100-F213 HydrophobicContact CE1-CB 3.76Å; F100-F213 HydrophobicContact CE2-CB 4.46Å; F100-F213 HydrophobicContact CG-CB 4.1Å; F100-F213 AromaticContact CG-CD2 3.45Å; F100-F213 HydrophobicContact CG-CD2 3.45Å; F100-F213 VanDerWaalsContact CG-CD2 3.45Å; F100-F213 HydrophobicContact CG-CE2 4.27Å; F100-F213 HydrophobicContact CG-CG 4.16Å; F100-F213 HydrophobicContact CZ-CB 4.14Å; F100-L218 HydrophobicContact CB-CD1 3.97Å; F100-L218 HydrophobicContact CD2-CD1 4.42Å
101	M	75.1	Confident	66.8	Low	0 Å²	0	38 Å²	38	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-65.8	-29.3	180	-67.8	-70.5	-83.2	0	0	111.8	F97 M98 A104 G105 A106 L110 M203 F209	F97-M101 HydrophobicContact CD1-CG 4.23Å; F97-M101 HydrophobicContact CD2-CG 4.22Å; F97-M101 HydrophobicContact CE1-CG 3.98Å; F97-M101 HydrophobicContact CE1-SD 4.37Å; F97-M101 HydrophobicContact CE2-CG 3.98Å; F97-M101 HydrophobicContact CE2-SD 4.02Å; F97-M101 HydrophobicContact CG-CG 4.35Å; F97-M101 HydrophobicContact CZ-CE 4.26Å; F97-M101 HydrophobicContact CZ-CG 3.85Å; F97-M101 HydrophobicContact CZ-SD 3.78Å; F97-M101 WeakPolarHBondContact O-CB 3.39Å; F97-M101 WeakPolarHBondContact O-CG 3.42Å; F97-M101 PolarHBondContact O-N 2.95Å; M98-M101 PolarHBondContact O-N 3.32Å; M101-A104 PolarHBondContact O-N 3.09Å; M101-G105 PolarHBondContact O-N 3.42Å; M101-G105 VanDerWaalsContact O-N 3.13Å; M101-A106 HydrophobicContact CB-CB 4.43Å; M101-A106 HydrophobicContact CE-CB 3.53Å; M101-A106 VanDerWaalsContact CE-O 3.26Å; M101-A106 WeakPolarHBondContact CE-O 3.34Å; M101-A106 PolarHBondContact O-N 2.9Å; M101-A106 HydrophobicContact SD-CB 3.76Å; M101-L110 HydrophobicContact CB-CD2 4.17Å; M101-L110 HydrophobicContact CE-CB 4.13Å; M101-L110 HydrophobicContact CG-CD2 4.08Å; M101-M203 HydrophobicContact CE-CG 4.29Å; M101-M203 HydrophobicContact CE-SD 4.18Å; M101-F209 HydrophobicContact CE-CB 4.29Å; M101-F209 HydrophobicContact CE-CD1 3.74Å; M101-F209 HydrophobicContact CE-CE1 4.44Å; M101-F209 HydrophobicContact CE-CG 4.14Å; M101-F209 HydrophobicContact SD-CB 4.02Å; M101-F209 HydrophobicContact SD-CD1 3.8Å; M101-F209 HydrophobicContact SD-CG 4.27Å
102	Q	72.2	Confident	68.4	Low	117 Å²	117	33.3 Å²	33.3	55%	0.547	20%	0.202	S	C	.	.	H	α-helix	trans	-62.5	-49.1	170.1	-167.4	168.7	18.9	0	0	112.1	M98 D99 F100 A104 G105 Q107	M98-Q102 WeakPolarHBondContact O-CB 3.14Å; M98-Q102 PolarHBondContact O-N 2.89Å; D99-Q102 WeakPolarHBondContact O-CB 3.37Å; F100-Q102 PolarHBondContact O-N 3.43Å; Q102-A104 VanDerWaalsContact C-N 3.28Å; Q102-A104 PolarHBondContact O-N 2.97Å; Q102-G105 PolarHBondContact O-N 3.47Å; Q102-Q107 HydrophobicContact CB-CG 4.18Å; Q102-Q107 HydrophobicContact CG-CG 4.45Å; Q102-Q107 VanDerWaalsContact CG-NE2 3.33Å
103	A	70.3	Confident	69.8	Low	90 Å²	90	31.4 Å²	31.4	74%	0.744	19%	0.191	S	C	*	.	H	α-helix	trans	-65.2	-32.9	178	0	0	0	0	0	112.3	D99 F100 G105	D99-A103 PolarHBondContact O-N 3.25Å; F100-A103 PolarHBondContact O-N 3.03Å; F100-A103 VanDerWaalsContact O-N 3.16Å; A103-G105 VanDerWaalsContact C-N 3.33Å
104	A	74.2	Confident	70.4	Confident	52 Å²	52	31.8 Å²	31.8	43%	0.43	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-6.9	177.9	0	0	0	0	0	114.4	F100 M101 Q102 A106	F100-A104 PolarHBondContact O-N 3.4Å; M101-A104 PolarHBondContact O-N 3.09Å; Q102-A104 VanDerWaalsContact C-N 3.28Å; Q102-A104 PolarHBondContact O-N 2.97Å; A104-A106 VanDerWaalsContact C-N 3.26Å; A104-A106 HydrophobicContact CB-CB 4.3Å; A104-A106 PolarHBondContact O-N 2.88Å
105	G	72.1	Confident	70.7	Confident	67 Å²	67	33 Å²	33	69%	0.691	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.3	19.4	-176.7	0	0	0	0	0	114.5	M101 Q102 A103	M101-G105 PolarHBondContact O-N 3.42Å; M101-G105 VanDerWaalsContact O-N 3.13Å; Q102-G105 PolarHBondContact O-N 3.47Å; A103-G105 VanDerWaalsContact C-N 3.33Å
106	A	74.7	Confident	71.6	Confident	3 Å²	3	29.3 Å²	29.3	3%	0.025	18%	0.183	C	C	.	.			trans	-103.4	23.1	-171.5	0	0	0	0	0	113.5	M101 A104 A108 E109 F209	M101-A106 HydrophobicContact CB-CB 4.43Å; M101-A106 HydrophobicContact CE-CB 3.53Å; M101-A106 VanDerWaalsContact CE-O 3.26Å; M101-A106 WeakPolarHBondContact CE-O 3.34Å; M101-A106 PolarHBondContact O-N 2.9Å; M101-A106 HydrophobicContact SD-CB 3.76Å; A104-A106 VanDerWaalsContact C-N 3.26Å; A104-A106 HydrophobicContact CB-CB 4.3Å; A104-A106 PolarHBondContact O-N 2.88Å; A106-A108 VanDerWaalsContact C-N 3.35Å; A106-A108 PolarHBondContact O-N 3.48Å; A106-E109 WeakPolarHBondContact CA-OE2 3.23Å; A106-E109 VanDerWaalsContact O-OE2 3.05Å; A106-F209 HydrophobicContact CB-CD1 3.44Å; A106-F209 VanDerWaalsContact CB-CD1 3.44Å; A106-F209 HydrophobicContact CB-CE1 3.22Å; A106-F209 HydrophobicContact CB-CZ 4.39Å
107	Q	70.5	Confident	71.8	Confident	32 Å²	32	29.8 Å²	29.8	15%	0.15	19%	0.186	C	C	.	.	H	α-helix	trans	-69.6	-31.6	-168.5	-75.4	-150.9	-52.4	0	0	113.5	Q102 E109 L110 F111	Q102-Q107 HydrophobicContact CB-CG 4.18Å; Q102-Q107 HydrophobicContact CG-CG 4.45Å; Q102-Q107 VanDerWaalsContact CG-NE2 3.33Å; Q107-E109 VanDerWaalsContact C-N 3.35Å; Q107-E109 PolarHBondContact O-N 3.44Å; Q107-L110 PolarHBondContact O-N 2.99Å; Q107-F111 HydrophobicContact CB-CD2 3.91Å; Q107-F111 HydrophobicContact CB-CE2 3.49Å; Q107-F111 VanDerWaalsContact CB-CE2 3.49Å; Q107-F111 HydrophobicContact CB-CZ 4.26Å; Q107-F111 HydrophobicContact CG-CE2 4Å; Q107-F111 HydrophobicContact CG-CZ 4.38Å; Q107-F111 WeakPolarHBondContact O-CB 3.43Å; Q107-F111 WeakPolarHBondContact O-CD2 3.46Å; Q107-F111 VanDerWaalsContact O-CG 3.24Å; Q107-F111 WeakPolarHBondContact O-CG 3.32Å; Q107-F111 PolarHBondContact O-N 2.82Å
108	A	71.3	Confident	70.7	Confident	5 Å²	5	30.6 Å²	30.6	4%	0.041	19%	0.194	C	C	.	.	H	α-helix	trans	-66.1	-39	-176.3	0	0	0	0	0	112.1	A106 F112 P166 V168	A106-A108 VanDerWaalsContact C-N 3.35Å; A106-A108 PolarHBondContact O-N 3.48Å; A108-F112 WeakPolarHBondContact O-CB 3.47Å; A108-F112 PolarHBondContact O-N 2.88Å; A108-P166 HydrophobicContact CB-CB 3.85Å; A108-P166 HydrophobicContact CB-CG 4.01Å; A108-V168 HydrophobicContact CB-CG2 4.29Å
109	E	79.8	Confident	71	Confident	16 Å²	16	29.9 Å²	29.9	8%	0.075	19%	0.19	C	C	.	.	H	α-helix	trans	-63	-48.1	177.7	-66.6	70.8	-159.3	0	0	110.9	A106 Q107 W113 V168 V199 M202 M203	A106-E109 WeakPolarHBondContact CA-OE2 3.23Å; A106-E109 VanDerWaalsContact O-OE2 3.05Å; Q107-E109 VanDerWaalsContact C-N 3.35Å; Q107-E109 PolarHBondContact O-N 3.44Å; E109-W113 PolarHBondContact O-N 3.4Å; E109-V168 HydrophobicContact CG-CG1 4.37Å; E109-V199 HydrophobicContact CB-CG1 4.08Å; E109-V199 VanDerWaalsContact O-CG1 3.25Å; E109-V199 WeakPolarHBondContact O-CG1 3.26Å; E109-M202 HydrophobicContact CB-CE 4.14Å; E109-M202 HydrophobicContact CG-CE 3.33Å; E109-M202 HydrophobicContact CG-SD 4.4Å; E109-M203 HydrophobicContact CB-CG 4.26Å; E109-M203 HydrophobicContact CB-SD 4.44Å
110	L	74.1	Confident	71.4	Confident	1 Å²	1	29.6 Å²	29.6	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-60.9	-61	175.6	-177.5	56.8	0	0	0	108.9	L88 F97 M98 M101 Q107 F112 W113 L114 M203 L425	L88-L110 HydrophobicContact CD2-CD1 3.36Å; F97-L110 HydrophobicContact CD1-CD1 4.12Å; F97-L110 HydrophobicContact CD1-CD2 4.09Å; F97-L110 HydrophobicContact CE1-CD1 4.01Å; F97-L110 HydrophobicContact CE1-CD2 4.41Å; M98-L110 HydrophobicContact CB-CD2 4.45Å; M98-L110 HydrophobicContact CG-CD2 3.8Å; M101-L110 HydrophobicContact CB-CD2 4.17Å; M101-L110 HydrophobicContact CE-CB 4.13Å; M101-L110 HydrophobicContact CG-CD2 4.08Å; Q107-L110 PolarHBondContact O-N 2.99Å; L110-F112 VanDerWaalsContact C-N 3.29Å; L110-F112 PolarHBondContact O-N 3.45Å; L110-W113 VanDerWaalsContact O-CB 3.26Å; L110-W113 WeakPolarHBondContact O-CB 3.34Å; L110-W113 PolarHBondContact O-N 2.94Å; L110-L114 VanDerWaalsContact C-CD1 3.41Å; L110-L114 HydrophobicContact CD1-CD1 4.12Å; L110-L114 HydrophobicContact CG-CD1 4.08Å; L110-L114 WeakPolarHBondContact O-CD1 3.36Å; L110-M203 HydrophobicContact CB-SD 4.25Å; L110-M203 HydrophobicContact CD1-SD 4.17Å; L110-L425 HydrophobicContact CD1-CD1 3.88Å; L110-L425 HydrophobicContact CD2-CD1 4.15Å; L110-L425 HydrophobicContact CD2-CD2 4.25Å; L110-L425 HydrophobicContact CG-CD1 3.94Å; L110-L425 HydrophobicContact CG-CD2 4.1Å
111	F	68.2	Low	70.4	Confident	5 Å²	5	30.1 Å²	30.1	2%	0.022	19%	0.19	C	C	.	.	H	α-helix	trans	-57.8	-35.3	-175.1	-64.8	-40.6	0	0	0	114.7	Q107 W113 L114 T115 Y159 L425 A426 E427 G428	Q107-F111 HydrophobicContact CB-CD2 3.91Å; Q107-F111 HydrophobicContact CB-CE2 3.49Å; Q107-F111 VanDerWaalsContact CB-CE2 3.49Å; Q107-F111 HydrophobicContact CB-CZ 4.26Å; Q107-F111 HydrophobicContact CG-CE2 4Å; Q107-F111 HydrophobicContact CG-CZ 4.38Å; Q107-F111 WeakPolarHBondContact O-CB 3.43Å; Q107-F111 WeakPolarHBondContact O-CD2 3.46Å; Q107-F111 VanDerWaalsContact O-CG 3.24Å; Q107-F111 WeakPolarHBondContact O-CG 3.32Å; Q107-F111 PolarHBondContact O-N 2.82Å; F111-W113 VanDerWaalsContact C-N 3.35Å; F111-L114 HydrophobicContact CD1-CD1 4.49Å; F111-L114 PolarHBondContact O-N 3.19Å; F111-T115 WeakPolarHBondContact O-CB 3.36Å; F111-T115 PolarHBondContact O-N 3.11Å; F111-T115 PolarHBondContact O-OG1 3.19Å; F111-Y159 HydrophobicContact CB-CE1 3.96Å; F111-L425 HydrophobicContact CD1-CD2 3.2Å; F111-L425 HydrophobicContact CE1-CD2 3.15Å; F111-L425 HydrophobicContact CZ-CD2 4.45Å; F111-A426 VanDerWaalsContact CE1-C 3.49Å; F111-A426 VanDerWaalsContact CE1-O 3.29Å; F111-A426 WeakPolarHBondContact CE1-O 3.21Å; F111-E427 WeakPolarHBondContact CE2-O 3.37Å; F111-E427 WeakPolarHBondContact CZ-O 3.44Å; F111-G428 VanDerWaalsContact CE2-CA 3.48Å
112	F	77.9	Confident	69.7	Low	0 Å²	0	33 Å²	33	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-59.8	-46.5	172.8	171.9	-101.6	0	0	0	111.5	A108 L110 L114 T115 V116 V155 Y159 L160 V168 V195 V199	A108-F112 WeakPolarHBondContact O-CB 3.47Å; A108-F112 PolarHBondContact O-N 2.88Å; L110-F112 VanDerWaalsContact C-N 3.29Å; L110-F112 PolarHBondContact O-N 3.45Å; F112-L114 PolarHBondContact O-N 2.81Å; F112-L114 VanDerWaalsContact O-N 3.11Å; F112-T115 PolarHBondContact O-N 3.03Å; F112-V116 HydrophobicContact CD2-CG2 4.16Å; F112-V116 HydrophobicContact CE1-CG2 4.15Å; F112-V116 HydrophobicContact CE2-CG2 3.72Å; F112-V116 HydrophobicContact CZ-CG2 3.72Å; F112-V116 VanDerWaalsContact O-CG2 3.31Å; F112-V116 WeakPolarHBondContact O-CG2 3.28Å; F112-V116 PolarHBondContact O-N 2.74Å; F112-V155 HydrophobicContact CD2-CG1 4.5Å; F112-V155 HydrophobicContact CE2-CG1 4.23Å; F112-Y159 HydrophobicContact CB-CD1 3.96Å; F112-Y159 HydrophobicContact CB-CE1 4.42Å; F112-Y159 HydrophobicContact CB-CG 4.04Å; F112-Y159 HydrophobicContact CD2-CD2 4.05Å; F112-Y159 AromaticContact CD2-CG 3.83Å; F112-Y159 HydrophobicContact CD2-CG 3.83Å; F112-Y159 HydrophobicContact CG-CG 4.42Å; F112-L160 HydrophobicContact CD2-CD2 4.41Å; F112-L160 HydrophobicContact CE2-CD1 3.83Å; F112-L160 HydrophobicContact CE2-CD2 3.93Å; F112-L160 HydrophobicContact CE2-CG 3.88Å; F112-L160 HydrophobicContact CZ-CD1 4.08Å; F112-L160 HydrophobicContact CZ-CD2 4.13Å; F112-L160 HydrophobicContact CZ-CG 4.4Å; F112-V168 HydrophobicContact CB-CG2 3.62Å; F112-V168 HydrophobicContact CD2-CG2 4.41Å; F112-V168 HydrophobicContact CG-CG2 3.96Å; F112-V195 HydrophobicContact CE1-CB 4.49Å; F112-V195 HydrophobicContact CE1-CG1 3.8Å; F112-V195 HydrophobicContact CZ-CB 4.17Å; F112-V195 HydrophobicContact CZ-CG1 3.56Å; F112-V199 HydrophobicContact CD1-CB 4.08Å; F112-V199 HydrophobicContact CD1-CG1 4.1Å; F112-V199 HydrophobicContact CD1-CG2 3.68Å; F112-V199 HydrophobicContact CE1-CB 4.31Å; F112-V199 HydrophobicContact CE1-CG2 3.73Å
113	W	79.6	Confident	69.5	Low	31 Å²	31	27.4 Å²	27.4	12%	0.117	18%	0.182	C	C	.	.	H	α-helix	trans	-53.6	-37	-179.2	-172.7	82.4	0	0	0	112.1	L88 E109 L110 F111 E117 Q196 Y200 M203	L88-W113 HydrophobicContact CB-CE3 4.17Å; L88-W113 HydrophobicContact CB-CH2 3.98Å; L88-W113 HydrophobicContact CB-CZ3 3.62Å; L88-W113 HydrophobicContact CD1-CD2 3.97Å; L88-W113 HydrophobicContact CD1-CE3 3.82Å; L88-W113 HydrophobicContact CD1-CH2 4.14Å; L88-W113 HydrophobicContact CD1-CZ2 4.16Å; L88-W113 HydrophobicContact CD1-CZ3 3.95Å; L88-W113 HydrophobicContact CD2-CE3 4.1Å; L88-W113 HydrophobicContact CD2-CZ3 4.39Å; L88-W113 HydrophobicContact CG-CE3 4.25Å; L88-W113 HydrophobicContact CG-CZ3 4.19Å; E109-W113 PolarHBondContact O-N 3.4Å; L110-W113 VanDerWaalsContact O-CB 3.26Å; L110-W113 WeakPolarHBondContact O-CB 3.34Å; L110-W113 PolarHBondContact O-N 2.94Å; F111-W113 VanDerWaalsContact C-N 3.35Å; W113-E117 HydrophobicContact CD2-CG 4.48Å; W113-E117 HydrophobicContact CE3-CG 4.37Å; W113-E117 HydrophobicContact CH2-CG 3.75Å; W113-E117 HydrophobicContact CZ2-CG 3.95Å; W113-E117 HydrophobicContact CZ3-CG 3.98Å; W113-E117 PolarHBondContact O-N 3.09Å; W113-Q196 HydrophobicContact CG-CG 4.35Å; W113-Q196 PolarHBondContact O-NE2 2.93Å; W113-Y200 AromaticContact NE1-CD2 3.98Å; W113-M203 HydrophobicContact CB-CE 3.85Å; W113-M203 HydrophobicContact CG-CE 3.91Å
114	L	64.2	Low	69.5	Low	9 Å²	9	27.8 Å²	27.8	5%	0.047	17%	0.168	C	C	.	.	H	α-helix	trans	-98.9	-26.4	-171.3	-40.1	105.4	0	0	0	113.1	L110 F111 F112 V116 E117 G118 L425	L110-L114 VanDerWaalsContact C-CD1 3.41Å; L110-L114 HydrophobicContact CD1-CD1 4.12Å; L110-L114 HydrophobicContact CG-CD1 4.08Å; L110-L114 WeakPolarHBondContact O-CD1 3.36Å; F111-L114 HydrophobicContact CD1-CD1 4.49Å; F111-L114 PolarHBondContact O-N 3.19Å; F112-L114 PolarHBondContact O-N 2.81Å; F112-L114 VanDerWaalsContact O-N 3.11Å; L114-V116 PolarHBondContact O-N 2.92Å; L114-E117 PolarHBondContact O-N 3.33Å; L114-G118 PolarHBondContact O-N 2.97Å; L114-L425 HydrophobicContact CB-CB 3.48Å; L114-L425 VanDerWaalsContact CB-CB 3.48Å; L114-L425 HydrophobicContact CB-CG 4.42Å; L114-L425 HydrophobicContact CD1-CB 3.26Å; L114-L425 HydrophobicContact CD1-CD1 3.17Å; L114-L425 HydrophobicContact CD1-CD2 3.34Å; L114-L425 HydrophobicContact CD1-CG 3.31Å; L114-L425 HydrophobicContact CD2-CB 3.3Å; L114-L425 HydrophobicContact CD2-CD1 3.08Å; L114-L425 HydrophobicContact CD2-CG 3.69Å; L114-L425 HydrophobicContact CG-CB 3.34Å; L114-L425 HydrophobicContact CG-CD1 3.47Å; L114-L425 VanDerWaalsContact CG-CD1 3.47Å; L114-L425 HydrophobicContact CG-CD2 4.34Å; L114-L425 HydrophobicContact CG-CG 3.78Å
115	T	62.2	Low	69	Low	35 Å²	35	31.1 Å²	31.1	22%	0.215	18%	0.175	C	C	.	.	H	α-helix	trans	-60.8	-37.9	166	-51.4	0	0	0	0	108.8	F111 F112 Y119 V155 Y159	F111-T115 WeakPolarHBondContact O-CB 3.36Å; F111-T115 PolarHBondContact O-N 3.11Å; F111-T115 PolarHBondContact O-OG1 3.19Å; F112-T115 PolarHBondContact O-N 3.03Å; T115-Y119 VanDerWaalsContact O-CB 3.31Å; T115-Y119 WeakPolarHBondContact O-CB 3.4Å; T115-Y119 PolarHBondContact O-N 3.41Å; T115-V155 HydrophobicContact CG2-CG1 4.47Å; T115-V155 HydrophobicContact CG2-CG2 3.83Å; T115-Y159 HydrophobicContact CG2-CE2 3.95Å; T115-Y159 WeakPolarHBondContact OG1-CE2 3.38Å; T115-Y159 PolarHBondContact OG1-OH 3.12Å
116	V	71.3	Confident	68.6	Low	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-65.5	-45	172.6	172.4	0	0	0	0	112.1	F112 L114 G118 Y119 R120 V155 F192 Q196	F112-V116 HydrophobicContact CD2-CG2 4.16Å; F112-V116 HydrophobicContact CE1-CG2 4.15Å; F112-V116 HydrophobicContact CE2-CG2 3.72Å; F112-V116 HydrophobicContact CZ-CG2 3.72Å; F112-V116 VanDerWaalsContact O-CG2 3.31Å; F112-V116 WeakPolarHBondContact O-CG2 3.28Å; F112-V116 PolarHBondContact O-N 2.74Å; L114-V116 PolarHBondContact O-N 2.92Å; V116-G118 PolarHBondContact O-N 3.47Å; V116-Y119 PolarHBondContact O-N 2.96Å; V116-R120 PolarHBondContact O-N 3.36Å; V116-V155 HydrophobicContact CG2-CG1 4.18Å; V116-F192 HydrophobicContact CB-CB 4.36Å; V116-F192 HydrophobicContact CG1-CB 3.57Å; V116-F192 HydrophobicContact CG1-CD2 4.39Å; V116-F192 HydrophobicContact CG1-CG 4.3Å; V116-F192 HydrophobicContact CG2-CB 3.79Å; V116-F192 HydrophobicContact CG2-CD2 4.27Å; V116-F192 HydrophobicContact CG2-CG 3.95Å; V116-Q196 HydrophobicContact CB-CG 4.21Å; V116-Q196 HydrophobicContact CG1-CB 4.11Å; V116-Q196 VanDerWaalsContact CG1-CD 3.42Å; V116-Q196 HydrophobicContact CG1-CG 3.9Å
117	E	69.1	Low	68.4	Low	47 Å²	47	33 Å²	33	22%	0.22	17%	0.166	C	C	.	.	H	α-helix	trans	-60	-45.2	174.9	-73	-56.1	143.7	0	0	112.2	W113 L114 Y119 R120 V121 Q196	W113-E117 HydrophobicContact CD2-CG 4.48Å; W113-E117 HydrophobicContact CE3-CG 4.37Å; W113-E117 HydrophobicContact CH2-CG 3.75Å; W113-E117 HydrophobicContact CZ2-CG 3.95Å; W113-E117 HydrophobicContact CZ3-CG 3.98Å; W113-E117 PolarHBondContact O-N 3.09Å; L114-E117 PolarHBondContact O-N 3.33Å; E117-Y119 VanDerWaalsContact C-N 3.34Å; E117-Y119 PolarHBondContact O-N 2.94Å; E117-R120 WeakPolarHBondContact O-CB 3.46Å; E117-R120 PolarHBondContact O-N 2.66Å; E117-R120 IonicContact OE1-CZ 3.81Å; E117-R120 IonicContact OE1-NH1 3.1Å; E117-R120 PolarHBondContact OE1-NH1 3.3Å; E117-R120 IonicContact OE1-NH2 3.29Å; E117-R120 IonicContact OE2-CZ 3.13Å; E117-R120 IonicContact OE2-NH1 3.17Å; E117-R120 PolarHBondContact OE2-NH1 2.9Å; E117-V121 WeakPolarHBondContact O-CG2 3.24Å; E117-V121 PolarHBondContact O-N 3.3Å; E117-V121 VanDerWaalsContact O-N 3.11Å; E117-Q196 PolarHBondContact OE1-NE2 3.41Å; E117-Q196 PolarHBondContact OE1-OE1 3.42Å
118	G	51.2	Low	68.3	Low	17 Å²	17	36.5 Å²	36.5	18%	0.175	18%	0.183	C	C	.	.	H	α-helix	trans	-65.2	-36.2	176.8	0	0	0	0	0	113.2	L114 V116 T122	L114-G118 PolarHBondContact O-N 2.97Å; V116-G118 PolarHBondContact O-N 3.47Å; G118-T122 WeakPolarHBondContact O-CB 3.48Å; G118-T122 PolarHBondContact O-N 2.81Å; G118-T122 VanDerWaalsContact O-N 3.09Å; G118-T122 PolarHBondContact O-OG1 3.15Å
119	Y	68	Low	68	Low	13 Å²	13	38.1 Å²	38.1	5%	0.051	20%	0.196	C	C	.	.	H	α-helix	trans	-62.3	-45.8	171.3	166.8	-90.8	0	0	0	111.2	T115 V116 E117 V121 T122 A123 A151 A152 P187 T188 I191 F192	T115-Y119 VanDerWaalsContact O-CB 3.31Å; T115-Y119 WeakPolarHBondContact O-CB 3.4Å; T115-Y119 PolarHBondContact O-N 3.41Å; V116-Y119 PolarHBondContact O-N 2.96Å; E117-Y119 VanDerWaalsContact C-N 3.34Å; E117-Y119 PolarHBondContact O-N 2.94Å; Y119-V121 PolarHBondContact O-N 2.82Å; Y119-T122 PolarHBondContact O-N 3.49Å; Y119-A123 HydrophobicContact CE1-CB 4.14Å; Y119-A123 HydrophobicContact CE2-CB 4.4Å; Y119-A123 VanDerWaalsContact O-CB 3.32Å; Y119-A123 WeakPolarHBondContact O-CB 3.26Å; Y119-A123 PolarHBondContact O-N 2.97Å; Y119-A151 HydrophobicContact CD2-CB 4.21Å; Y119-A151 HydrophobicContact CE2-CB 4.3Å; Y119-A152 HydrophobicContact CE2-CB 3.76Å; Y119-P187 WeakPolarHBondContact OH-CB 3.25Å; Y119-T188 WeakPolarHBondContact CE1-O 3.45Å; Y119-T188 PolarHBondContact OH-O 3.21Å; Y119-I191 HydrophobicContact CE1-CG2 3.73Å; Y119-F192 AromaticContact CD1-CD2 3.75Å; Y119-F192 HydrophobicContact CD1-CD2 3.75Å; Y119-F192 AromaticContact CD1-CE2 3.77Å; Y119-F192 HydrophobicContact CD1-CE2 3.77Å; Y119-F192 HydrophobicContact CD2-CE2 4.49Å; Y119-F192 AromaticContact CE1-CD2 3.95Å; Y119-F192 HydrophobicContact CE1-CD2 3.95Å; Y119-F192 AromaticContact CE1-CE2 3.84Å; Y119-F192 HydrophobicContact CE1-CE2 3.84Å; Y119-F192 HydrophobicContact CG-CD2 4.43Å; Y119-F192 HydrophobicContact CG-CE2 4.13Å
120	R	72.3	Confident	67.3	Low	53 Å²	53	38.6 Å²	38.6	20%	0.2	20%	0.199	C	C	.	.	H	α-helix	trans	-57.4	-48.8	-179.8	-176.8	-174	-70.9	145.6	0.8	111	V116 E117 T122 A123 Q124 P189 D193	V116-R120 PolarHBondContact O-N 3.36Å; E117-R120 WeakPolarHBondContact O-CB 3.46Å; E117-R120 PolarHBondContact O-N 2.66Å; E117-R120 IonicContact OE1-CZ 3.81Å; E117-R120 IonicContact OE1-NH1 3.1Å; E117-R120 PolarHBondContact OE1-NH1 3.3Å; E117-R120 IonicContact OE1-NH2 3.29Å; E117-R120 IonicContact OE2-CZ 3.13Å; E117-R120 IonicContact OE2-NH1 3.17Å; E117-R120 PolarHBondContact OE2-NH1 2.9Å; R120-T122 PolarHBondContact O-N 3.29Å; R120-A123 PolarHBondContact O-N 2.74Å; R120-Q124 WeakPolarHBondContact O-CB 3.43Å; R120-Q124 PolarHBondContact O-N 3.12Å; R120-P189 HydrophobicContact CG-CB 3.88Å; R120-D193 IonicContact CZ-OD1 3.61Å; R120-D193 IonicContact NE-OD1 2.7Å; R120-D193 IonicContact NH2-OD1 3.35Å; R120-D193 PolarHBondContact NH2-OD1 3.44Å; R120-D193 IonicContact NH2-OD2 2.85Å
121	V	60	Low	66.8	Low	40 Å²	40	44.7 Å²	44.7	24%	0.242	23%	0.227	C	C	.	.	H	α-helix	trans	-60.1	-46.6	177.7	175.9	0	0	0	0	111	E117 Y119 A123 Q124 Q125	E117-V121 WeakPolarHBondContact O-CG2 3.24Å; E117-V121 PolarHBondContact O-N 3.3Å; E117-V121 VanDerWaalsContact O-N 3.11Å; Y119-V121 PolarHBondContact O-N 2.82Å; V121-A123 PolarHBondContact O-N 3.2Å; V121-Q124 PolarHBondContact O-N 3.09Å; V121-Q125 WeakPolarHBondContact O-CG 3.36Å; V121-Q125 PolarHBondContact O-N 2.85Å
122	T	60.8	Low	66.3	Low	60 Å²	60	47.6 Å²	47.6	37%	0.368	25%	0.248	S	C	.	.	H	α-helix	trans	-62.5	-43.8	178.9	-57.4	0	0	0	0	111.8	G118 Y119 R120 Q126	G118-T122 WeakPolarHBondContact O-CB 3.48Å; G118-T122 PolarHBondContact O-N 2.81Å; G118-T122 VanDerWaalsContact O-N 3.09Å; G118-T122 PolarHBondContact O-OG1 3.15Å; Y119-T122 PolarHBondContact O-N 3.49Å; R120-T122 PolarHBondContact O-N 3.29Å; T122-Q126 WeakPolarHBondContact O-CB 3.48Å; T122-Q126 WeakPolarHBondContact O-CG 3.32Å; T122-Q126 PolarHBondContact O-N 3.46Å
123	A	67	Low	65.3	Low	0 Å²	0	54 Å²	54	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-64	-43.1	179.2	0	0	0	0	0	111.7	Y119 R120 V121 Q126 L127 L148 P189	Y119-A123 HydrophobicContact CE1-CB 4.14Å; Y119-A123 HydrophobicContact CE2-CB 4.4Å; Y119-A123 VanDerWaalsContact O-CB 3.32Å; Y119-A123 WeakPolarHBondContact O-CB 3.26Å; Y119-A123 PolarHBondContact O-N 2.97Å; R120-A123 PolarHBondContact O-N 2.74Å; V121-A123 PolarHBondContact O-N 3.2Å; A123-Q126 PolarHBondContact O-N 3.14Å; A123-L127 WeakPolarHBondContact O-CB 3.44Å; A123-L127 WeakPolarHBondContact O-CD1 3.31Å; A123-L127 VanDerWaalsContact O-CG 3.26Å; A123-L127 WeakPolarHBondContact O-CG 3.45Å; A123-L127 PolarHBondContact O-N 3.37Å; A123-L148 HydrophobicContact CB-CD2 4.01Å; A123-P189 HydrophobicContact CB-CB 4.02Å; A123-P189 HydrophobicContact CB-CG 3.88Å
124	Q	70.3	Confident	64.2	Low	97 Å²	97	59 Å²	59	45%	0.453	30%	0.297	S	S	.	.	H	α-helix	trans	-63.2	-48.3	177.8	-173.4	175.5	-9.6	0	0	111.7	R120 V121 Q126 L127 E128 P189	R120-Q124 WeakPolarHBondContact O-CB 3.43Å; R120-Q124 PolarHBondContact O-N 3.12Å; V121-Q124 PolarHBondContact O-N 3.09Å; Q124-Q126 VanDerWaalsContact C-N 3.34Å; Q124-Q126 PolarHBondContact O-N 2.9Å; Q124-L127 PolarHBondContact O-N 2.97Å; Q124-E128 WeakPolarHBondContact CG-OE1 3.45Å; Q124-E128 PolarHBondContact NE2-OE1 3.47Å; Q124-E128 WeakPolarHBondContact O-CB 3.42Å; Q124-E128 WeakPolarHBondContact O-CG 3.47Å; Q124-E128 PolarHBondContact O-N 2.9Å; Q124-P189 HydrophobicContact CB-CG 4.38Å
125	Q	65.3	Low	63.9	Low	122 Å²	122	67.5 Å²	67.5	57%	0.57	33%	0.334	S	S	*	.	H	α-helix	trans	-61.1	-41.2	178.8	-71.8	176.7	2.9	0	0	112.5	V121 A129	V121-Q125 WeakPolarHBondContact O-CG 3.36Å; V121-Q125 PolarHBondContact O-N 2.85Å; Q125-A129 WeakPolarHBondContact O-CB 3.35Å; Q125-A129 PolarHBondContact O-N 2.82Å
126	Q	62.7	Low	63.4	Low	57 Å²	57	71.5 Å²	71.5	27%	0.266	35%	0.354	S	S	.	.	H	α-helix	trans	-69.6	-36	178.9	-72.7	-168.4	12	0	0	112.6	T122 A123 Q124 M130 T144 L148	T122-Q126 WeakPolarHBondContact O-CB 3.48Å; T122-Q126 WeakPolarHBondContact O-CG 3.32Å; T122-Q126 PolarHBondContact O-N 3.46Å; A123-Q126 PolarHBondContact O-N 3.14Å; Q124-Q126 VanDerWaalsContact C-N 3.34Å; Q124-Q126 PolarHBondContact O-N 2.9Å; Q126-M130 WeakPolarHBondContact O-CB 3.46Å; Q126-M130 PolarHBondContact O-N 3.47Å; Q126-T144 HydrophobicContact CB-CG2 4Å; Q126-T144 HydrophobicContact CG-CG2 4.45Å; Q126-L148 HydrophobicContact CB-CD1 4.33Å; Q126-L148 HydrophobicContact CB-CD2 4.19Å; Q126-L148 HydrophobicContact CB-CG 4.49Å; Q126-L148 HydrophobicContact CG-CD2 4.46Å; Q126-L148 VanDerWaalsContact OE1-CD2 3.24Å
127	L	70.6	Confident	62.3	Low	53 Å²	53	74.8 Å²	74.8	28%	0.277	39%	0.387	S	S	.	.	H	α-helix	trans	-70.7	-40.4	176.1	-73.5	168.2	0	0	0	112	A123 Q124 M130 Q131 L148 P189	A123-L127 WeakPolarHBondContact O-CB 3.44Å; A123-L127 WeakPolarHBondContact O-CD1 3.31Å; A123-L127 VanDerWaalsContact O-CG 3.26Å; A123-L127 WeakPolarHBondContact O-CG 3.45Å; A123-L127 PolarHBondContact O-N 3.37Å; Q124-L127 PolarHBondContact O-N 2.97Å; L127-M130 WeakPolarHBondContact O-CB 3.26Å; L127-M130 PolarHBondContact O-N 3.22Å; L127-Q131 WeakPolarHBondContact O-CG 3.43Å; L127-Q131 PolarHBondContact O-N 2.82Å; L127-L148 HydrophobicContact CD2-CD1 4.34Å; L127-L148 HydrophobicContact CG-CD1 4.19Å; L127-P189 HydrophobicContact CD1-CG 3.85Å
128	E	67.8	Low	61.5	Low	106 Å²	106	80.8 Å²	80.8	50%	0.495	41%	0.412	S	S	.	.	H	α-helix	trans	-63.5	-43.2	174.5	-73.6	175.4	-171.1	0	0	111.7	Q124 M130 Q131 S132	Q124-E128 WeakPolarHBondContact CG-OE1 3.45Å; Q124-E128 PolarHBondContact NE2-OE1 3.47Å; Q124-E128 WeakPolarHBondContact O-CB 3.42Å; Q124-E128 WeakPolarHBondContact O-CG 3.47Å; Q124-E128 PolarHBondContact O-N 2.9Å; E128-M130 VanDerWaalsContact C-N 3.29Å; E128-M130 PolarHBondContact O-N 3.04Å; E128-Q131 PolarHBondContact O-N 3.48Å; E128-S132 PolarHBondContact O-N 3.33Å
129	A	65.4	Low	61.4	Low	38 Å²	38	89.3 Å²	89.3	31%	0.314	45%	0.445	S	S	.	.	H	α-helix	trans	-60.9	-39	173.9	0	0	0	0	0	112	Q125 S132 W133	Q125-A129 WeakPolarHBondContact O-CB 3.35Å; Q125-A129 PolarHBondContact O-N 2.82Å; A129-S132 PolarHBondContact O-N 2.81Å; A129-W133 PolarHBondContact O-N 3.05Å
130	M	64.7	Low	60.7	Low	27 Å²	27	95.4 Å²	95.4	13%	0.133	47%	0.474	C	S	.	.	H	α-helix	trans	-65.3	-42.1	176.9	-166.4	-179.7	121.2	0	0	112	Q126 L127 E128 S132 W133 Q134 P141 K145	Q126-M130 WeakPolarHBondContact O-CB 3.46Å; Q126-M130 PolarHBondContact O-N 3.47Å; L127-M130 WeakPolarHBondContact O-CB 3.26Å; L127-M130 PolarHBondContact O-N 3.22Å; E128-M130 VanDerWaalsContact C-N 3.29Å; E128-M130 PolarHBondContact O-N 3.04Å; M130-S132 VanDerWaalsContact C-N 3.3Å; M130-S132 PolarHBondContact O-N 3.39Å; M130-W133 PolarHBondContact O-N 3.11Å; M130-Q134 WeakPolarHBondContact O-CB 3.2Å; M130-Q134 PolarHBondContact O-N 3.27Å; M130-P141 HydrophobicContact CE-CB 3.91Å; M130-P141 HydrophobicContact CG-CB 4.45Å; M130-P141 HydrophobicContact SD-CB 4.05Å; M130-K145 HydrophobicContact SD-CG 4.38Å
131	Q	63.8	Low	59.8	Low	128 Å²	128	95.7 Å²	95.7	60%	0.598	48%	0.482	S	S	*	.	H	α-helix	trans	-63.6	-35.4	175.4	-71	178.7	7.7	0	0	112.3	L127 E128	L127-Q131 WeakPolarHBondContact O-CG 3.43Å; L127-Q131 PolarHBondContact O-N 2.82Å; E128-Q131 PolarHBondContact O-N 3.48Å
132	S	57.8	Low	59.7	Low	66 Å²	66	96.5 Å²	96.5	46%	0.462	50%	0.498	S	S	.	.	H	α-helix	trans	-66.2	-42.9	174.2	-168.8	0	0	0	0	111.8	E128 A129 M130 Q134 K135	E128-S132 PolarHBondContact O-N 3.33Å; A129-S132 PolarHBondContact O-N 2.81Å; M130-S132 VanDerWaalsContact C-N 3.3Å; M130-S132 PolarHBondContact O-N 3.39Å; S132-Q134 VanDerWaalsContact C-N 3.33Å; S132-Q134 PolarHBondContact O-N 3.02Å; S132-K135 PolarHBondContact O-N 3.43Å
133	W	58.1	Low	59.7	Low	135 Å²	135	96.3 Å²	96.3	51%	0.511	50%	0.503	S	S	.	.	H	α-helix	trans	-70.9	-28.2	-179.9	-65.4	-15.9	0	0	0	113.6	A129 M130 K135 D136 G137	A129-W133 PolarHBondContact O-N 3.05Å; M130-W133 PolarHBondContact O-N 3.11Å; W133-K135 VanDerWaalsContact C-N 3.26Å; W133-K135 PolarHBondContact O-N 2.95Å; W133-D136 PolarHBondContact O-N 3.19Å; W133-G137 PolarHBondContact O-N 2.7Å
134	Q	56.2	Low	59.4	Low	136 Å²	136	97.3 Å²	97.3	64%	0.636	51%	0.509	S	S	*	.	H	α-helix	trans	-68.7	-27	177.6	-146.2	167.1	-0.3	0	0	112.2	M130 S132	M130-Q134 WeakPolarHBondContact O-CB 3.2Å; M130-Q134 PolarHBondContact O-N 3.27Å; S132-Q134 VanDerWaalsContact C-N 3.33Å; S132-Q134 PolarHBondContact O-N 3.02Å
135	K	57.4	Low	59.3	Low	188 Å²	188	96.3 Å²	96.3	82%	0.817	50%	0.503	S	S	*	.	H	α-helix	trans	-74.6	-25.8	172.6	-71.5	-179.7	177.7	176.7	0	113.5	S132 W133	S132-K135 PolarHBondContact O-N 3.43Å; W133-K135 VanDerWaalsContact C-N 3.26Å; W133-K135 PolarHBondContact O-N 2.95Å
136	D	51.6	Low	59.4	Low	119 Å²	119	92.5 Å²	92.5	64%	0.636	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	6.7	-177.9	-72.7	-25.5	0	0	0	114	W133 K138	W133-D136 PolarHBondContact O-N 3.19Å; D136-K138 PolarHBondContact O-N 3.39Å; D136-K138 VanDerWaalsContact O-N 3.14Å
137	G	48.4	Very low	59.7	Low	68 Å²	68	94.9 Å²	94.9	70%	0.701	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.4	5.5	174.3	0	0	0	0	0	116.2	W133	W133-G137 PolarHBondContact O-N 2.7Å
138	K	51.3	Low	59.6	Low	173 Å²	173	92.6 Å²	92.6	75%	0.752	50%	0.499	S	S	*	.			trans	-86.5	110.2	176.8	-72.4	-175.1	179.2	178.3	0	110.9	D136 Q140	D136-K138 PolarHBondContact O-N 3.39Å; D136-K138 VanDerWaalsContact O-N 3.14Å; K138-Q140 PolarHBondContact O-N 3.47Å
139	K	50.2	Low	60	Low	196 Å²	196	90.6 Å²	90.6	85%	0.852	49%	0.488	S	S	*	.			trans	-77.5	109.3	176	-75.2	-177.8	177.1	178.8	0	111.5
140	Q	53.6	Low	60.3	Low	142 Å²	142	91.7 Å²	91.7	66%	0.664	50%	0.497	S	S	*	.			trans	-153.8	63.6	141.5	-80.3	-136.1	11.9	0	0	113.1	K138	K138-Q140 PolarHBondContact O-N 3.47Å
141	P	53.2	Low	60.4	Low	59 Å²	59	92.5 Å²	92.5	38%	0.383	51%	0.509	S	S	.	.	H	α-helix	trans	-78.2	-16.8	177.9	28.3	-31	0	0	0	114.7	M130 K145	M130-P141 HydrophobicContact CE-CB 3.91Å; M130-P141 HydrophobicContact CG-CB 4.45Å; M130-P141 HydrophobicContact SD-CB 4.05Å; P141-K145 WeakPolarHBondContact O-CG 3.29Å
142	G	57	Low	60.8	Low	56 Å²	56	86.4 Å²	86.4	58%	0.577	48%	0.48	S	S	*	.	H	α-helix	trans	-75.9	-37	-175.1	0	0	0	0	0	114.9	G146	G142-G146 PolarHBondContact O-N 3.02Å
143	A	61	Low	61.7	Low	56 Å²	56	86.3 Å²	86.3	46%	0.463	47%	0.474	S	S	.	.	H	α-helix	trans	-69.2	-41.8	-178	0	0	0	0	0	112.2	G146 L147	A143-G146 PolarHBondContact O-N 2.94Å; A143-L147 PolarHBondContact O-N 3.05Å; A143-L147 VanDerWaalsContact O-N 3.13Å
144	T	61.3	Low	62.4	Low	21 Å²	21	81.4 Å²	81.4	13%	0.129	47%	0.465	C	S	.	.	H	α-helix	trans	-65.1	-43.1	179.2	-45.1	0	0	0	0	112.1	Q126 G146 L147 L148	Q126-T144 HydrophobicContact CB-CG2 4Å; Q126-T144 HydrophobicContact CG-CG2 4.45Å; T144-G146 VanDerWaalsContact C-N 3.3Å; T144-G146 PolarHBondContact O-N 3.32Å; T144-L147 WeakPolarHBondContact O-CB 3.4Å; T144-L147 PolarHBondContact O-N 3.06Å; T144-L147 VanDerWaalsContact O-N 3.17Å; T144-L148 PolarHBondContact O-N 3Å; T144-L148 VanDerWaalsContact O-N 3.13Å
145	K	67.1	Low	63.1	Low	76 Å²	76	75.3 Å²	75.3	33%	0.33	44%	0.438	S	S	.	.	H	α-helix	trans	-61.6	-37.9	174.5	-73.2	-174.6	169	-155.3	0	112.5	M130 P141 L147 L148 K149 D186	M130-K145 HydrophobicContact SD-CG 4.38Å; P141-K145 WeakPolarHBondContact O-CG 3.29Å; K145-L147 VanDerWaalsContact C-N 3.34Å; K145-L147 PolarHBondContact O-N 3.28Å; K145-L148 PolarHBondContact O-N 3.37Å; K145-K149 PolarHBondContact O-N 2.71Å; K145-D186 IonicContact NZ-OD2 3.87Å; K145-D186 PolarHBondContact NZ-OD2 2.85Å
146	G	68.1	Low	64.2	Low	42 Å²	42	68.7 Å²	68.7	43%	0.433	41%	0.408	S	S	.	.	H	α-helix	trans	-61.9	-38.7	174.1	0	0	0	0	0	113.2	G142 A143 T144 K149 A150	G142-G146 PolarHBondContact O-N 3.02Å; A143-G146 PolarHBondContact O-N 2.94Å; T144-G146 VanDerWaalsContact C-N 3.3Å; T144-G146 PolarHBondContact O-N 3.32Å; G146-K149 PolarHBondContact O-N 3.33Å; G146-A150 WeakPolarHBondContact O-CB 3.49Å; G146-A150 PolarHBondContact O-N 3.35Å
147	L	68.6	Low	65.4	Low	107 Å²	107	69.2 Å²	69.2	56%	0.56	41%	0.406	S	S	*	.	H	α-helix	trans	-66.8	-42.2	176.3	-68.9	171	0	0	0	112.3	A143 T144 K145 K149 A150 A151	A143-L147 PolarHBondContact O-N 3.05Å; A143-L147 VanDerWaalsContact O-N 3.13Å; T144-L147 WeakPolarHBondContact O-CB 3.4Å; T144-L147 PolarHBondContact O-N 3.06Å; T144-L147 VanDerWaalsContact O-N 3.17Å; K145-L147 VanDerWaalsContact C-N 3.34Å; K145-L147 PolarHBondContact O-N 3.28Å; L147-K149 VanDerWaalsContact C-N 3.32Å; L147-K149 PolarHBondContact O-N 2.95Å; L147-A150 PolarHBondContact O-N 3.15Å; L147-A151 WeakPolarHBondContact O-CB 3.42Å; L147-A151 PolarHBondContact O-N 3.26Å
148	L	68.9	Low	66.5	Low	5 Å²	5	70.6 Å²	70.6	3%	0.026	40%	0.395	C	S	.	.	H	α-helix	trans	-63.5	-39.7	175.4	-68.2	177.1	0	0	0	111.9	A123 Q126 L127 T144 K145 A151 A152 P187	A123-L148 HydrophobicContact CB-CD2 4.01Å; Q126-L148 HydrophobicContact CB-CD1 4.33Å; Q126-L148 HydrophobicContact CB-CD2 4.19Å; Q126-L148 HydrophobicContact CB-CG 4.49Å; Q126-L148 HydrophobicContact CG-CD2 4.46Å; Q126-L148 VanDerWaalsContact OE1-CD2 3.24Å; L127-L148 HydrophobicContact CD2-CD1 4.34Å; L127-L148 HydrophobicContact CG-CD1 4.19Å; T144-L148 PolarHBondContact O-N 3Å; T144-L148 VanDerWaalsContact O-N 3.13Å; K145-L148 PolarHBondContact O-N 3.37Å; L148-A151 PolarHBondContact O-N 3.25Å; L148-A152 WeakPolarHBondContact O-CB 3.37Å; L148-A152 PolarHBondContact O-N 3.02Å; L148-P187 HydrophobicContact CB-CG 3.95Å
149	K	77.1	Confident	67.6	Low	64 Å²	64	63.3 Å²	63.3	28%	0.278	36%	0.362	S	S	.	.	H	α-helix	trans	-64	-42.8	175	-164	163.6	-174.6	156.4	0	112.3	K145 G146 L147 L153 L182 Q183 P187	K145-K149 PolarHBondContact O-N 2.71Å; G146-K149 PolarHBondContact O-N 3.33Å; L147-K149 VanDerWaalsContact C-N 3.32Å; L147-K149 PolarHBondContact O-N 2.95Å; K149-L153 HydrophobicContact CG-CD1 4.17Å; K149-L153 WeakPolarHBondContact O-CB 3.34Å; K149-L153 VanDerWaalsContact O-CG 3.26Å; K149-L153 WeakPolarHBondContact O-CG 3.45Å; K149-L153 PolarHBondContact O-N 2.91Å; K149-L182 WeakPolarHBondContact CE-O 3.36Å; K149-L182 PolarHBondContact NZ-O 3.32Å; K149-Q183 PolarHBondContact NZ-O 3.47Å; K149-P187 HydrophobicContact CB-CG 4.18Å
150	A	70.5	Confident	69.2	Low	61 Å²	61	54 Å²	54	50%	0.504	32%	0.322	S	S	.	.	H	α-helix	trans	-63.1	-41.3	173.7	0	0	0	0	0	112.4	G146 L147 G154	G146-A150 WeakPolarHBondContact O-CB 3.49Å; G146-A150 PolarHBondContact O-N 3.35Å; L147-A150 PolarHBondContact O-N 3.15Å; A150-G154 PolarHBondContact O-N 2.95Å
151	A	66.9	Low	70.7	Confident	45 Å²	45	48.1 Å²	48.1	37%	0.372	30%	0.297	S	S	.	.	H	α-helix	trans	-65	-47.1	177.8	0	0	0	0	0	112.1	Y119 L147 L148 G154 V155	Y119-A151 HydrophobicContact CD2-CB 4.21Å; Y119-A151 HydrophobicContact CE2-CB 4.3Å; L147-A151 WeakPolarHBondContact O-CB 3.42Å; L147-A151 PolarHBondContact O-N 3.26Å; L148-A151 PolarHBondContact O-N 3.25Å; A151-G154 PolarHBondContact O-N 3.23Å; A151-G154 VanDerWaalsContact O-N 3.16Å; A151-V155 PolarHBondContact O-N 2.79Å
152	A	73.4	Confident	71.8	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-64.9	-40.8	178.7	0	0	0	0	0	112.1	Y119 L148 G154 V155 Y156 L182 P187 F192	Y119-A152 HydrophobicContact CE2-CB 3.76Å; L148-A152 WeakPolarHBondContact O-CB 3.37Å; L148-A152 PolarHBondContact O-N 3.02Å; A152-G154 VanDerWaalsContact C-N 3.3Å; A152-G154 PolarHBondContact O-N 3.02Å; A152-V155 PolarHBondContact O-N 3.08Å; A152-Y156 PolarHBondContact O-N 3.44Å; A152-L182 HydrophobicContact CB-CD2 3.52Å; A152-P187 HydrophobicContact CB-CB 3.85Å; A152-P187 HydrophobicContact CB-CG 4.4Å; A152-F192 HydrophobicContact CB-CE2 4.19Å; A152-F192 HydrophobicContact CB-CZ 4.12Å; A152-F192 WeakPolarHBondContact O-CZ 3.2Å
153	L	76.4	Confident	72.6	Confident	64 Å²	64	58.4 Å²	58.4	34%	0.335	33%	0.326	S	S	.	.	H	α-helix	trans	-62.4	-38.8	172.3	-74.7	168.8	0	0	0	111.7	K149 V155 Y156 E157 L182	K149-L153 HydrophobicContact CG-CD1 4.17Å; K149-L153 WeakPolarHBondContact O-CB 3.34Å; K149-L153 VanDerWaalsContact O-CG 3.26Å; K149-L153 WeakPolarHBondContact O-CG 3.45Å; K149-L153 PolarHBondContact O-N 2.91Å; L153-V155 PolarHBondContact O-N 3.38Å; L153-Y156 PolarHBondContact O-N 3.18Å; L153-E157 WeakPolarHBondContact O-CB 3.48Å; L153-E157 WeakPolarHBondContact O-CG 2.84Å; L153-E157 PolarHBondContact O-N 2.95Å; L153-L182 HydrophobicContact CD2-CB 4.36Å
154	G	71.7	Confident	73.2	Confident	31 Å²	31	56.5 Å²	56.5	32%	0.32	31%	0.31	S	S	.	.	H	α-helix	trans	-58.2	-45.2	174.1	0	0	0	0	0	112.9	A150 A151 A152 E157 Q158	A150-G154 PolarHBondContact O-N 2.95Å; A151-G154 PolarHBondContact O-N 3.23Å; A151-G154 VanDerWaalsContact O-N 3.16Å; A152-G154 VanDerWaalsContact C-N 3.3Å; A152-G154 PolarHBondContact O-N 3.02Å; G154-E157 PolarHBondContact O-N 3.36Å; G154-Q158 WeakPolarHBondContact O-CB 3.16Å; G154-Q158 PolarHBondContact O-N 3.34Å
155	V	70.4	Confident	73.5	Confident	9 Å²	9	59.1 Å²	59.1	6%	0.055	33%	0.329	C	S	.	.	H	α-helix	trans	-63.4	-44	176.2	179.5	0	0	0	0	111.3	F112 T115 V116 A151 A152 L153 Q158 Y159 F192	F112-V155 HydrophobicContact CD2-CG1 4.5Å; F112-V155 HydrophobicContact CE2-CG1 4.23Å; T115-V155 HydrophobicContact CG2-CG1 4.47Å; T115-V155 HydrophobicContact CG2-CG2 3.83Å; V116-V155 HydrophobicContact CG2-CG1 4.18Å; A151-V155 PolarHBondContact O-N 2.79Å; A152-V155 PolarHBondContact O-N 3.08Å; L153-V155 PolarHBondContact O-N 3.38Å; V155-Q158 PolarHBondContact O-N 3.45Å; V155-Y159 HydrophobicContact CG1-CD2 4.35Å; V155-Y159 PolarHBondContact O-N 3.25Å; V155-F192 HydrophobicContact CB-CE1 4.29Å; V155-F192 HydrophobicContact CB-CE2 4.18Å; V155-F192 HydrophobicContact CB-CZ 3.77Å; V155-F192 HydrophobicContact CG1-CD1 4.48Å; V155-F192 HydrophobicContact CG1-CE1 4.02Å; V155-F192 HydrophobicContact CG1-CE2 4.22Å; V155-F192 HydrophobicContact CG1-CZ 3.9Å
156	Y	81.8	Confident	73.5	Confident	48 Å²	48	57.9 Å²	57.9	19%	0.188	33%	0.329	C	S	.	.	H	α-helix	trans	-61.5	-48	177.7	-179.3	-91.4	0	0	0	112.1	A152 L153 Q158 L160 S161 V175 L178 L182	A152-Y156 PolarHBondContact O-N 3.44Å; L153-Y156 PolarHBondContact O-N 3.18Å; Y156-Q158 VanDerWaalsContact C-N 3.35Å; Y156-Q158 PolarHBondContact O-N 2.67Å; Y156-L160 HydrophobicContact CD2-CB 4.16Å; Y156-L160 HydrophobicContact CD2-CD1 4.22Å; Y156-L160 HydrophobicContact CE2-CB 4.35Å; Y156-L160 WeakPolarHBondContact O-CA 3.33Å; Y156-L160 PolarHBondContact O-N 3.28Å; Y156-S161 PolarHBondContact O-N 2.91Å; Y156-V175 HydrophobicContact CE2-CG1 3.95Å; Y156-V175 WeakPolarHBondContact CE2-O 3.32Å; Y156-V175 PolarHBondContact OH-O 3.22Å; Y156-L178 HydrophobicContact CD2-CD2 4.14Å; Y156-L178 HydrophobicContact CD2-CG 4.23Å; Y156-L182 HydrophobicContact CD2-CD1 3.77Å; Y156-L182 HydrophobicContact CG-CD1 3.86Å
157	E	77.3	Confident	74	Confident	130 Å²	130	59.9 Å²	59.9	61%	0.607	32%	0.323	S	S	*	.	H	α-helix	trans	-65.8	-36.9	179.9	-73.5	-169.2	162.1	0	0	112.9	L153 G154 S161	L153-E157 WeakPolarHBondContact O-CB 3.48Å; L153-E157 WeakPolarHBondContact O-CG 2.84Å; L153-E157 PolarHBondContact O-N 2.95Å; G154-E157 PolarHBondContact O-N 3.36Å; E157-S161 WeakPolarHBondContact O-CB 3.38Å
158	Q	71.4	Confident	74.8	Confident	98 Å²	98	55 Å²	55	46%	0.458	30%	0.298	S	S	.	.	H	α-helix	trans	-72.5	-35.6	-176.1	-176.7	173.2	-14.2	0	0	113.4	G154 V155 Y156 A164	G154-Q158 WeakPolarHBondContact O-CB 3.16Å; G154-Q158 PolarHBondContact O-N 3.34Å; V155-Q158 PolarHBondContact O-N 3.45Å; Y156-Q158 VanDerWaalsContact C-N 3.35Å; Y156-Q158 PolarHBondContact O-N 2.67Å; Q158-A164 WeakPolarHBondContact O-CB 3.4Å
159	Y	73.4	Confident	75.5	Confident	19 Å²	19	61 Å²	61	8%	0.075	33%	0.326	C	S	.	.	H	α-helix	trans	-122.1	-27.6	-168.9	-65.7	-75.1	0	0	0	115.3	F111 F112 T115 V155 V168	F111-Y159 HydrophobicContact CB-CE1 3.96Å; F112-Y159 HydrophobicContact CB-CD1 3.96Å; F112-Y159 HydrophobicContact CB-CE1 4.42Å; F112-Y159 HydrophobicContact CB-CG 4.04Å; F112-Y159 HydrophobicContact CD2-CD2 4.05Å; F112-Y159 AromaticContact CD2-CG 3.83Å; F112-Y159 HydrophobicContact CD2-CG 3.83Å; F112-Y159 HydrophobicContact CG-CG 4.42Å; T115-Y159 HydrophobicContact CG2-CE2 3.95Å; T115-Y159 WeakPolarHBondContact OG1-CE2 3.38Å; T115-Y159 PolarHBondContact OG1-OH 3.12Å; V155-Y159 HydrophobicContact CG1-CD2 4.35Å; V155-Y159 PolarHBondContact O-N 3.25Å; Y159-V168 HydrophobicContact CD1-CG2 4.22Å; Y159-V168 HydrophobicContact CG-CG2 4.5Å; Y159-V168 PolarHBondContact O-N 3.32Å
160	L	84.2	Confident	75.9	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115	-27.2	-168.6	-58.3	178.8	0	0	0	113.8	F112 Y156 R167 V168 V175 L178 V195	F112-L160 HydrophobicContact CD2-CD2 4.41Å; F112-L160 HydrophobicContact CE2-CD1 3.83Å; F112-L160 HydrophobicContact CE2-CD2 3.93Å; F112-L160 HydrophobicContact CE2-CG 3.88Å; F112-L160 HydrophobicContact CZ-CD1 4.08Å; F112-L160 HydrophobicContact CZ-CD2 4.13Å; F112-L160 HydrophobicContact CZ-CG 4.4Å; Y156-L160 HydrophobicContact CD2-CB 4.16Å; Y156-L160 HydrophobicContact CD2-CD1 4.22Å; Y156-L160 HydrophobicContact CE2-CB 4.35Å; Y156-L160 WeakPolarHBondContact O-CA 3.33Å; Y156-L160 PolarHBondContact O-N 3.28Å; L160-R167 PolarHBondContact O-NE 3.37Å; L160-R167 VanDerWaalsContact O-NE 3.11Å; L160-R167 PolarHBondContact O-NH2 3.37Å; L160-V168 HydrophobicContact CD2-CB 4.29Å; L160-V175 HydrophobicContact CB-CG1 4.05Å; L160-V175 HydrophobicContact CD2-CG2 4.45Å; L160-L178 HydrophobicContact CD1-CD2 3.43Å; L160-L178 VanDerWaalsContact CD1-CD2 3.43Å; L160-V195 HydrophobicContact CD1-CG1 4.1Å; L160-V195 HydrophobicContact CD2-CG1 3.94Å
161	S	84.1	Confident	76.7	Confident	20 Å²	20	60.9 Å²	60.9	14%	0.14	32%	0.321	C	S	.	.	S	Bend	trans	-57.9	153.2	177.9	173.6	0	0	0	0	112.5	Y156 E157 K163 A164	Y156-S161 PolarHBondContact O-N 2.91Å; E157-S161 WeakPolarHBondContact O-CB 3.38Å; S161-K163 PolarHBondContact O-N 3.1Å; S161-K163 VanDerWaalsContact O-N 3.1Å; S161-K163 PolarHBondContact OG-N 3.09Å; S161-A164 VanDerWaalsContact O-CB 3.26Å; S161-A164 WeakPolarHBondContact O-CB 3.38Å; S161-A164 PolarHBondContact O-N 3.4Å
162	D	77	Confident	77.5	Confident	135 Å²	135	66.3 Å²	66.3	72%	0.722	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-16.1	172.9	-62.1	-40	0	0	0	112.9	R167	D162-R167 IonicContact OD1-CZ 2.85Å; D162-R167 IonicContact OD1-NH1 3.19Å; D162-R167 PolarHBondContact OD1-NH1 2.96Å; D162-R167 IonicContact OD1-NH2 3.31Å; D162-R167 PolarHBondContact OD1-NH2 3.41Å
163	K	74.3	Confident	78.1	Confident	196 Å²	196	74.2 Å²	74.2	85%	0.852	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	-5.1	176.1	-59.9	179.6	-176.9	174	0	113.8	S161	S161-K163 PolarHBondContact O-N 3.1Å; S161-K163 VanDerWaalsContact O-N 3.1Å; S161-K163 PolarHBondContact OG-N 3.09Å
164	A	73.7	Confident	78.7	Confident	16 Å²	16	72.4 Å²	72.4	13%	0.132	36%	0.363	C	S	.	.			trans	-70.5	139.5	-177.5	0	0	0	0	0	111.9	Q158 S161 R167	Q158-A164 WeakPolarHBondContact O-CB 3.4Å; S161-A164 VanDerWaalsContact O-CB 3.26Å; S161-A164 WeakPolarHBondContact O-CB 3.38Å; S161-A164 PolarHBondContact O-N 3.4Å; A164-R167 HydrophobicContact CB-CB 4.19Å; A164-R167 HydrophobicContact CB-CG 4.31Å
165	S	67.6	Low	79.4	Confident	75 Å²	75	71.2 Å²	71.2	52%	0.524	35%	0.35	S	S	.	.	S	Bend	trans	-147.1	110.4	175.1	-170.2	0	0	0	0	110.3
166	P	65.7	Low	80.2	Confident	50 Å²	50	75.7 Å²	75.7	33%	0.325	37%	0.372	S	S	.	.	S	Bend	cis	-78	143.2	0.6	6.7	12.2	0	0	0	111.2	A108 M429	A108-P166 HydrophobicContact CB-CB 3.85Å; A108-P166 HydrophobicContact CB-CG 4.01Å; P166-M429 HydrophobicContact CB-CE 4.42Å; P166-M429 VanDerWaalsContact CD-SD 3.52Å; P166-M429 HydrophobicContact CG-CE 3.66Å; P166-M429 HydrophobicContact CG-CG 4.5Å; P166-M429 HydrophobicContact CG-SD 3.57Å; P166-M429 VanDerWaalsContact CG-SD 3.57Å
167	R	79.6	Confident	80.5	Confident	84 Å²	84	77.8 Å²	77.8	32%	0.317	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-92.3	135.2	179.1	-174	-178	-175.7	170.9	11.4	110.3	L160 D162 A164	L160-R167 PolarHBondContact O-NE 3.37Å; L160-R167 VanDerWaalsContact O-NE 3.11Å; L160-R167 PolarHBondContact O-NH2 3.37Å; D162-R167 IonicContact OD1-CZ 2.85Å; D162-R167 IonicContact OD1-NH1 3.19Å; D162-R167 PolarHBondContact OD1-NH1 2.96Å; D162-R167 IonicContact OD1-NH2 3.31Å; D162-R167 PolarHBondContact OD1-NH2 3.41Å; A164-R167 HydrophobicContact CB-CB 4.19Å; A164-R167 HydrophobicContact CB-CG 4.31Å
168	V	86	Confident	81	Confident	4 Å²	4	72 Å²	72	2%	0.024	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-69.4	131.3	175.8	-173	0	0	0	0	109.8	A108 E109 F112 Y159 L160 V170 V199 M202	A108-V168 HydrophobicContact CB-CG2 4.29Å; E109-V168 HydrophobicContact CG-CG1 4.37Å; F112-V168 HydrophobicContact CB-CG2 3.62Å; F112-V168 HydrophobicContact CD2-CG2 4.41Å; F112-V168 HydrophobicContact CG-CG2 3.96Å; Y159-V168 HydrophobicContact CD1-CG2 4.22Å; Y159-V168 HydrophobicContact CG-CG2 4.5Å; Y159-V168 PolarHBondContact O-N 3.32Å; L160-V168 HydrophobicContact CD2-CB 4.29Å; V168-V170 HydrophobicContact CB-CG2 4.31Å; V168-V170 HydrophobicContact CG1-CG2 3.61Å; V168-V170 PolarHBondContact O-N 2.99Å; V168-V199 HydrophobicContact CG1-CG1 4.31Å; V168-V199 HydrophobicContact CG1-CG2 3.54Å; V168-M202 HydrophobicContact CG1-CE 4.45Å
169	Q	82.1	Confident	81.7	Confident	133 Å²	133	67.8 Å²	67.8	62%	0.621	34%	0.339	S	S	*	.			trans	-80.9	97.8	178.3	-60.8	-166.4	16.7	0	0	110.7
170	V	85.6	Confident	82.2	Confident	26 Å²	26	71.3 Å²	71.3	16%	0.158	36%	0.356	C	S	.	.			trans	-134.1	156.8	174.8	-162.1	0	0	0	0	109.4	V168 K172 L174 V195 K198 V199	V168-V170 HydrophobicContact CB-CG2 4.31Å; V168-V170 HydrophobicContact CG1-CG2 3.61Å; V168-V170 PolarHBondContact O-N 2.99Å; V170-K172 PolarHBondContact O-N 3.09Å; V170-L174 HydrophobicContact CG1-CD1 4.28Å; V170-V195 HydrophobicContact CB-CG1 4.44Å; V170-V195 HydrophobicContact CG1-CG1 4.14Å; V170-V195 HydrophobicContact CG2-CG1 4.07Å; V170-K198 HydrophobicContact CG1-CB 3.92Å; V170-K198 HydrophobicContact CG1-CG 4.46Å; V170-V199 HydrophobicContact CG2-CG2 3.59Å
171	D	87.9	Confident	82.3	Confident	95 Å²	95	75 Å²	75	51%	0.508	37%	0.372	S	S	.	.			trans	-50.9	124.9	178.3	-59.9	-38.6	0	0	0	111.7	E173 L174 V175	D171-E173 PolarHBondContact O-N 3.33Å; D171-L174 HydrophobicContact CB-CD1 4.14Å; D171-L174 HydrophobicContact CB-CG 4.18Å; D171-L174 WeakPolarHBondContact O-CB 3.47Å; D171-L174 PolarHBondContact O-N 3.34Å; D171-V175 PolarHBondContact O-N 3.29Å
172	K	84	Confident	82.4	Confident	160 Å²	160	74.1 Å²	74.1	70%	0.696	37%	0.366	S	S	*	.	H	α-helix	trans	-57.6	-34.8	-175.5	-69.8	-178	178.7	178.8	0	112.8	V170 L174 V175 I176	V170-K172 PolarHBondContact O-N 3.09Å; K172-L174 VanDerWaalsContact C-N 3.33Å; K172-L174 PolarHBondContact O-N 2.86Å; K172-V175 PolarHBondContact O-N 2.73Å; K172-I176 VanDerWaalsContact O-CG1 3.31Å; K172-I176 WeakPolarHBondContact O-CG1 3.29Å; K172-I176 PolarHBondContact O-N 3.43Å
173	E	86.1	Confident	82.5	Confident	166 Å²	166	74.8 Å²	74.8	78%	0.776	36%	0.364	S	S	*	.	H	α-helix	trans	-62.5	-39	178.1	-66.3	-179.3	179.7	0	0	112.3	D171 I176 K177	D171-E173 PolarHBondContact O-N 3.33Å; E173-I176 PolarHBondContact O-N 3.02Å; E173-K177 WeakPolarHBondContact O-CB 3.29Å; E173-K177 PolarHBondContact O-N 3.18Å
174	L	87.9	Confident	82.8	Confident	25 Å²	25	72.8 Å²	72.8	13%	0.131	36%	0.356	C	S	.	.	H	α-helix	trans	-68.1	-38.6	177.9	-66.4	178.9	0	0	0	111.6	V170 D171 K172 K177 L178 E194 V195 K198	V170-L174 HydrophobicContact CG1-CD1 4.28Å; D171-L174 HydrophobicContact CB-CD1 4.14Å; D171-L174 HydrophobicContact CB-CG 4.18Å; D171-L174 WeakPolarHBondContact O-CB 3.47Å; D171-L174 PolarHBondContact O-N 3.34Å; K172-L174 VanDerWaalsContact C-N 3.33Å; K172-L174 PolarHBondContact O-N 2.86Å; L174-K177 PolarHBondContact O-N 3.05Å; L174-L178 WeakPolarHBondContact O-CB 3.49Å; L174-L178 PolarHBondContact O-N 3.1Å; L174-E194 HydrophobicContact CD2-CG 4Å; L174-E194 WeakPolarHBondContact CD2-OE1 3.21Å; L174-V195 HydrophobicContact CB-CG2 4.38Å; L174-K198 HydrophobicContact CD1-CG 3.84Å
175	V	87.9	Confident	83.1	Confident	7 Å²	7	77.4 Å²	77.4	4%	0.042	37%	0.374	C	S	.	.	H	α-helix	trans	-67.5	-40	178	177.6	0	0	0	0	111.5	Y156 L160 D171 K172 G179	Y156-V175 HydrophobicContact CE2-CG1 3.95Å; Y156-V175 WeakPolarHBondContact CE2-O 3.32Å; Y156-V175 PolarHBondContact OH-O 3.22Å; L160-V175 HydrophobicContact CB-CG1 4.05Å; L160-V175 HydrophobicContact CD2-CG2 4.45Å; D171-V175 PolarHBondContact O-N 3.29Å; K172-V175 PolarHBondContact O-N 2.73Å; V175-G179 PolarHBondContact O-N 3.24Å
176	I	86.8	Confident	83.6	Confident	102 Å²	102	77.8 Å²	77.8	52%	0.523	37%	0.371	S	S	.	.	H	α-helix	trans	-64.7	-49.1	175.9	-67.7	165.2	0	0	0	110.1	K172 E173 L178 G179 E180	K172-I176 VanDerWaalsContact O-CG1 3.31Å; K172-I176 WeakPolarHBondContact O-CG1 3.29Å; K172-I176 PolarHBondContact O-N 3.43Å; E173-I176 PolarHBondContact O-N 3.02Å; I176-L178 VanDerWaalsContact C-N 3.3Å; I176-L178 PolarHBondContact O-N 3.34Å; I176-G179 PolarHBondContact O-N 3.13Å; I176-G179 VanDerWaalsContact O-N 3.11Å; I176-E180 PolarHBondContact O-N 2.8Å
177	K	87.9	Confident	84.1	Confident	93 Å²	93	75.8 Å²	75.8	40%	0.404	36%	0.358	S	S	.	.	H	α-helix	trans	-57.9	-40.8	177.9	-174.3	-174.3	177.1	-159.5	0	112.3	E173 L174 K181 E194	E173-K177 WeakPolarHBondContact O-CB 3.29Å; E173-K177 PolarHBondContact O-N 3.18Å; L174-K177 PolarHBondContact O-N 3.05Å; K177-K181 WeakPolarHBondContact O-CG 3.4Å; K177-K181 PolarHBondContact O-N 3.16Å; K177-K181 VanDerWaalsContact O-N 3.11Å; K177-E194 IonicContact NZ-OE1 2.8Å; K177-E194 PolarHBondContact NZ-OE1 3.08Å; K177-E194 IonicContact NZ-OE2 3.13Å; K177-E194 PolarHBondContact NZ-OE2 3.43Å
178	L	88.6	Confident	84.3	Confident	8 Å²	8	74.9 Å²	74.9	4%	0.042	36%	0.362	C	S	.	.	H	α-helix	trans	-66.7	-42.2	175.6	177.3	62.6	0	0	0	112.1	Y156 L160 L174 I176 E180 K181 L182 I191 F192 V195	Y156-L178 HydrophobicContact CD2-CD2 4.14Å; Y156-L178 HydrophobicContact CD2-CG 4.23Å; L160-L178 HydrophobicContact CD1-CD2 3.43Å; L160-L178 VanDerWaalsContact CD1-CD2 3.43Å; L174-L178 WeakPolarHBondContact O-CB 3.49Å; L174-L178 PolarHBondContact O-N 3.1Å; I176-L178 VanDerWaalsContact C-N 3.3Å; I176-L178 PolarHBondContact O-N 3.34Å; L178-E180 VanDerWaalsContact C-N 3.33Å; L178-E180 PolarHBondContact O-N 3.42Å; L178-K181 PolarHBondContact O-N 3.2Å; L178-L182 HydrophobicContact CD1-CD1 4.31Å; L178-L182 HydrophobicContact CD1-CG 4.41Å; L178-L182 HydrophobicContact CG-CD1 4.12Å; L178-L182 WeakPolarHBondContact O-CG 3.41Å; L178-L182 PolarHBondContact O-N 3.42Å; L178-I191 HydrophobicContact CD1-CG1 3.88Å; L178-I191 WeakPolarHBondContact CD1-O 3.44Å; L178-F192 HydrophobicContact CD1-CD1 4.19Å; L178-F192 HydrophobicContact CD1-CE1 4.32Å; L178-F192 HydrophobicContact CD2-CD1 3.62Å; L178-F192 HydrophobicContact CD2-CE1 3.8Å; L178-F192 HydrophobicContact CG-CD1 4.48Å; L178-F192 HydrophobicContact CG-CE1 4.45Å; L178-V195 HydrophobicContact CD2-CG2 3.86Å
179	G	84.8	Confident	84	Confident	10 Å²	10	75.2 Å²	75.2	10%	0.103	36%	0.364	C	S	.	.	H	α-helix	trans	-60.3	-42	176.2	0	0	0	0	0	112.4	V175 I176 L182 Q183	V175-G179 PolarHBondContact O-N 3.24Å; I176-G179 PolarHBondContact O-N 3.13Å; I176-G179 VanDerWaalsContact O-N 3.11Å; G179-L182 PolarHBondContact O-N 2.73Å; G179-Q183 PolarHBondContact O-N 3.05Å
180	E	85.4	Confident	84.3	Confident	93 Å²	93	73.6 Å²	73.6	44%	0.435	36%	0.356	S	S	.	.	H	α-helix	trans	-64.9	-42.1	174.9	-70.7	-167.6	-160.7	0	0	112.8	I176 L178 Q183 K184	I176-E180 PolarHBondContact O-N 2.8Å; L178-E180 VanDerWaalsContact C-N 3.33Å; L178-E180 PolarHBondContact O-N 3.42Å; E180-Q183 PolarHBondContact O-N 2.9Å; E180-K184 WeakPolarHBondContact O-CG 3.16Å; E180-K184 PolarHBondContact O-N 2.97Å; E180-K184 IonicContact OE2-NZ 3.61Å; E180-K184 PolarHBondContact OE2-NZ 3.47Å
181	K	86	Confident	84.3	Confident	78 Å²	78	73.3 Å²	73.3	34%	0.339	35%	0.354	S	S	.	.	H	α-helix	trans	-60.4	-44.1	176.1	-80.9	-176.5	171.4	-172.3	0	112	K177 L178 Q183 K184 E185	K177-K181 WeakPolarHBondContact O-CG 3.4Å; K177-K181 PolarHBondContact O-N 3.16Å; K177-K181 VanDerWaalsContact O-N 3.11Å; L178-K181 PolarHBondContact O-N 3.2Å; K181-Q183 PolarHBondContact O-N 2.91Å; K181-K184 PolarHBondContact O-N 3.37Å; K181-E185 WeakPolarHBondContact O-CB 3.18Å; K181-E185 PolarHBondContact O-N 3.01Å
182	L	84.8	Confident	84.4	Confident	1 Å²	1	68.8 Å²	68.8	1%	0.005	33%	0.33	C	S	.	.	H	α-helix	trans	-62.5	-26.8	178.5	-76.6	165.7	0	0	0	113.4	K149 A152 L153 Y156 L178 G179 P187 I191	K149-L182 WeakPolarHBondContact CE-O 3.36Å; K149-L182 PolarHBondContact NZ-O 3.32Å; A152-L182 HydrophobicContact CB-CD2 3.52Å; L153-L182 HydrophobicContact CD2-CB 4.36Å; Y156-L182 HydrophobicContact CD2-CD1 3.77Å; Y156-L182 HydrophobicContact CG-CD1 3.86Å; L178-L182 HydrophobicContact CD1-CD1 4.31Å; L178-L182 HydrophobicContact CD1-CG 4.41Å; L178-L182 HydrophobicContact CG-CD1 4.12Å; L178-L182 WeakPolarHBondContact O-CG 3.41Å; L178-L182 PolarHBondContact O-N 3.42Å; G179-L182 PolarHBondContact O-N 2.73Å; L182-P187 HydrophobicContact CD2-CB 4.46Å; L182-I191 HydrophobicContact CD2-CD1 3.43Å; L182-I191 VanDerWaalsContact CD2-CD1 3.43Å; L182-I191 HydrophobicContact CD2-CG1 4.32Å; L182-I191 HydrophobicContact CG-CD1 3.94Å
183	Q	80.8	Confident	84.6	Confident	149 Å²	149	63.4 Å²	63.4	70%	0.696	31%	0.308	S	S	*	.	H	α-helix	trans	-81.8	-45	176	-69.4	-177.2	5	0	0	112.1	K149 G179 E180 K181	K149-Q183 PolarHBondContact NZ-O 3.47Å; G179-Q183 PolarHBondContact O-N 3.05Å; E180-Q183 PolarHBondContact O-N 2.9Å; K181-Q183 PolarHBondContact O-N 2.91Å
184	K	80.2	Confident	84.8	Confident	154 Å²	154	59 Å²	59	67%	0.67	29%	0.288	S	S	*	.	H	α-helix	trans	-83.7	-32.2	-170.9	-67.9	170.8	-177.5	166.5	0	114.1	E180 K181	E180-K184 WeakPolarHBondContact O-CG 3.16Å; E180-K184 PolarHBondContact O-N 2.97Å; E180-K184 IonicContact OE2-NZ 3.61Å; E180-K184 PolarHBondContact OE2-NZ 3.47Å; K181-K184 PolarHBondContact O-N 3.37Å
185	E	80.1	Confident	84.8	Confident	112 Å²	112	58 Å²	58	52%	0.523	28%	0.283	S	S	.	.	S	Bend	trans	-116	158.5	-171.4	-64.4	173.5	-167.1	0	0	111.9	K181	K181-E185 WeakPolarHBondContact O-CB 3.18Å; K181-E185 PolarHBondContact O-N 3.01Å
186	D	77.3	Confident	84.8	Confident	84 Å²	84	58.2 Å²	58.2	45%	0.449	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-73.5	133.2	167.5	-81.1	-24	0	0	0	108.4	K145 T188	K145-D186 IonicContact NZ-OD2 3.87Å; K145-D186 PolarHBondContact NZ-OD2 2.85Å; D186-T188 PolarHBondContact O-N 2.97Å
187	P	77.4	Confident	85	Confident	8 Å²	8	60 Å²	60	5%	0.052	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-71.8	128.8	-173	33.6	-40.4	0	0	0	111.3	Y119 L148 K149 A152 L182 I191	Y119-P187 WeakPolarHBondContact OH-CB 3.25Å; L148-P187 HydrophobicContact CB-CG 3.95Å; K149-P187 HydrophobicContact CB-CG 4.18Å; A152-P187 HydrophobicContact CB-CB 3.85Å; A152-P187 HydrophobicContact CB-CG 4.4Å; L182-P187 HydrophobicContact CD2-CB 4.46Å; P187-I191 HydrophobicContact CB-CD1 3.89Å
188	T	83.2	Confident	85.2	Confident	65 Å²	65	59.9 Å²	59.9	40%	0.399	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-95.9	165	176.5	66	0	0	0	0	110.8	Y119 D186 E190 I191	Y119-T188 WeakPolarHBondContact CE1-O 3.45Å; Y119-T188 PolarHBondContact OH-O 3.21Å; D186-T188 PolarHBondContact O-N 2.97Å; T188-E190 WeakPolarHBondContact CB-OE2 3.36Å; T188-E190 PolarHBondContact O-N 2.86Å; T188-E190 PolarHBondContact OG1-OE2 3.24Å; T188-I191 WeakPolarHBondContact O-CB 3.49Å; T188-I191 VanDerWaalsContact O-CG2 3.3Å; T188-I191 WeakPolarHBondContact O-CG2 3.32Å; T188-I191 PolarHBondContact O-N 3.11Å; T188-I191 PolarHBondContact OG1-N 2.99Å
189	P	79.6	Confident	85.2	Confident	10 Å²	10	59.5 Å²	59.5	7%	0.065	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-28.9	173.2	-22.1	32.8	0	0	0	113.2	R120 A123 Q124 L127	R120-P189 HydrophobicContact CG-CB 3.88Å; A123-P189 HydrophobicContact CB-CB 4.02Å; A123-P189 HydrophobicContact CB-CG 3.88Å; Q124-P189 HydrophobicContact CB-CG 4.38Å; L127-P189 HydrophobicContact CD1-CG 3.85Å
190	E	87.7	Confident	85.5	Confident	100 Å²	100	61.9 Å²	61.9	47%	0.467	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	5.9	-175.2	-51.9	74.2	-157	0	0	113.6	T188 F192 D193	T188-E190 WeakPolarHBondContact CB-OE2 3.36Å; T188-E190 PolarHBondContact O-N 2.86Å; T188-E190 PolarHBondContact OG1-OE2 3.24Å; E190-F192 PolarHBondContact O-N 3.04Å; E190-D193 WeakPolarHBondContact CA-OD1 3.27Å; E190-D193 WeakPolarHBondContact O-CB 3.33Å; E190-D193 PolarHBondContact O-N 3.21Å
191	I	86.9	Confident	85.7	Confident	20 Å²	20	60.7 Å²	60.7	10%	0.103	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-27.4	-171	-167.9	159.2	0	0	0	113.6	Y119 L178 L182 P187 T188	Y119-I191 HydrophobicContact CE1-CG2 3.73Å; L178-I191 HydrophobicContact CD1-CG1 3.88Å; L178-I191 WeakPolarHBondContact CD1-O 3.44Å; L182-I191 HydrophobicContact CD2-CD1 3.43Å; L182-I191 VanDerWaalsContact CD2-CD1 3.43Å; L182-I191 HydrophobicContact CD2-CG1 4.32Å; L182-I191 HydrophobicContact CG-CD1 3.94Å; P187-I191 HydrophobicContact CB-CD1 3.89Å; T188-I191 WeakPolarHBondContact O-CB 3.49Å; T188-I191 VanDerWaalsContact O-CG2 3.3Å; T188-I191 WeakPolarHBondContact O-CG2 3.32Å; T188-I191 PolarHBondContact O-N 3.11Å; T188-I191 PolarHBondContact OG1-N 2.99Å
192	F	88.4	Confident	85.9	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-3.1	-178.9	-63.1	-73.5	0	0	0	114.5	V116 Y119 A152 V155 L178 E190 E194 V195 Q196	V116-F192 HydrophobicContact CB-CB 4.36Å; V116-F192 HydrophobicContact CG1-CB 3.57Å; V116-F192 HydrophobicContact CG1-CD2 4.39Å; V116-F192 HydrophobicContact CG1-CG 4.3Å; V116-F192 HydrophobicContact CG2-CB 3.79Å; V116-F192 HydrophobicContact CG2-CD2 4.27Å; V116-F192 HydrophobicContact CG2-CG 3.95Å; Y119-F192 AromaticContact CD1-CD2 3.75Å; Y119-F192 HydrophobicContact CD1-CD2 3.75Å; Y119-F192 AromaticContact CD1-CE2 3.77Å; Y119-F192 HydrophobicContact CD1-CE2 3.77Å; Y119-F192 HydrophobicContact CD2-CE2 4.49Å; Y119-F192 AromaticContact CE1-CD2 3.95Å; Y119-F192 HydrophobicContact CE1-CD2 3.95Å; Y119-F192 AromaticContact CE1-CE2 3.84Å; Y119-F192 HydrophobicContact CE1-CE2 3.84Å; Y119-F192 HydrophobicContact CG-CD2 4.43Å; Y119-F192 HydrophobicContact CG-CE2 4.13Å; A152-F192 HydrophobicContact CB-CE2 4.19Å; A152-F192 HydrophobicContact CB-CZ 4.12Å; A152-F192 WeakPolarHBondContact O-CZ 3.2Å; V155-F192 HydrophobicContact CB-CE1 4.29Å; V155-F192 HydrophobicContact CB-CE2 4.18Å; V155-F192 HydrophobicContact CB-CZ 3.77Å; V155-F192 HydrophobicContact CG1-CD1 4.48Å; V155-F192 HydrophobicContact CG1-CE1 4.02Å; V155-F192 HydrophobicContact CG1-CE2 4.22Å; V155-F192 HydrophobicContact CG1-CZ 3.9Å; L178-F192 HydrophobicContact CD1-CD1 4.19Å; L178-F192 HydrophobicContact CD1-CE1 4.32Å; L178-F192 HydrophobicContact CD2-CD1 3.62Å; L178-F192 HydrophobicContact CD2-CE1 3.8Å; L178-F192 HydrophobicContact CG-CD1 4.48Å; L178-F192 HydrophobicContact CG-CE1 4.45Å; E190-F192 PolarHBondContact O-N 3.04Å; F192-E194 VanDerWaalsContact C-N 3.29Å; F192-E194 PolarHBondContact O-N 3.44Å; F192-E194 VanDerWaalsContact O-N 3.15Å; F192-V195 PolarHBondContact O-N 2.95Å; F192-Q196 WeakPolarHBondContact O-CB 3.3Å; F192-Q196 PolarHBondContact O-N 3.33Å
193	D	89.7	Confident	86.1	Confident	47 Å²	47	58.6 Å²	58.6	25%	0.251	27%	0.273	S	S	.	.	H	α-helix	trans	-55.1	-40	-169.2	-79.4	17.9	0	0	0	113.9	R120 E190 R197	R120-D193 IonicContact CZ-OD1 3.61Å; R120-D193 IonicContact NE-OD1 2.7Å; R120-D193 IonicContact NH2-OD1 3.35Å; R120-D193 PolarHBondContact NH2-OD1 3.44Å; R120-D193 IonicContact NH2-OD2 2.85Å; E190-D193 WeakPolarHBondContact CA-OD1 3.27Å; E190-D193 WeakPolarHBondContact O-CB 3.33Å; E190-D193 PolarHBondContact O-N 3.21Å; D193-R197 VanDerWaalsContact O-CB 3.28Å; D193-R197 WeakPolarHBondContact O-CB 3.32Å; D193-R197 PolarHBondContact O-N 3.23Å
194	E	88.7	Confident	86.6	Confident	74 Å²	74	54.4 Å²	54.4	35%	0.346	26%	0.255	S	S	.	.	H	α-helix	trans	-64.1	-42	-179.2	-165.4	172.1	-172.5	0	0	111.2	L174 K177 F192	L174-E194 HydrophobicContact CD2-CG 4Å; L174-E194 WeakPolarHBondContact CD2-OE1 3.21Å; K177-E194 IonicContact NZ-OE1 2.8Å; K177-E194 PolarHBondContact NZ-OE1 3.08Å; K177-E194 IonicContact NZ-OE2 3.13Å; K177-E194 PolarHBondContact NZ-OE2 3.43Å; F192-E194 VanDerWaalsContact C-N 3.29Å; F192-E194 PolarHBondContact O-N 3.44Å; F192-E194 VanDerWaalsContact O-N 3.15Å
195	V	89.9	Confident	87.1	Confident	4 Å²	4	56 Å²	56	2%	0.024	26%	0.257	C	S	.	.	H	α-helix	trans	-77	-43.1	178.7	-177.5	0	0	0	0	110.6	F112 L160 V170 L174 L178 F192 R197 K198 V199	F112-V195 HydrophobicContact CE1-CB 4.49Å; F112-V195 HydrophobicContact CE1-CG1 3.8Å; F112-V195 HydrophobicContact CZ-CB 4.17Å; F112-V195 HydrophobicContact CZ-CG1 3.56Å; L160-V195 HydrophobicContact CD1-CG1 4.1Å; L160-V195 HydrophobicContact CD2-CG1 3.94Å; V170-V195 HydrophobicContact CB-CG1 4.44Å; V170-V195 HydrophobicContact CG1-CG1 4.14Å; V170-V195 HydrophobicContact CG2-CG1 4.07Å; L174-V195 HydrophobicContact CB-CG2 4.38Å; L178-V195 HydrophobicContact CD2-CG2 3.86Å; F192-V195 PolarHBondContact O-N 2.95Å; V195-R197 VanDerWaalsContact C-N 3.3Å; V195-R197 PolarHBondContact O-N 2.95Å; V195-K198 PolarHBondContact O-N 3.34Å; V195-K198 VanDerWaalsContact O-N 3.14Å; V195-V199 WeakPolarHBondContact O-CG2 3.34Å; V195-V199 PolarHBondContact O-N 3.01Å; V195-V199 VanDerWaalsContact O-N 3.09Å
196	Q	87.4	Confident	87.5	Confident	10 Å²	10	52.8 Å²	52.8	5%	0.047	24%	0.243	C	C	.	.	H	α-helix	trans	-59.7	-40.2	178.8	-165	-165.3	26.7	0	0	111.9	W113 V116 E117 F192 K198 V199 Y200	W113-Q196 HydrophobicContact CG-CG 4.35Å; W113-Q196 PolarHBondContact O-NE2 2.93Å; V116-Q196 HydrophobicContact CB-CG 4.21Å; V116-Q196 HydrophobicContact CG1-CB 4.11Å; V116-Q196 VanDerWaalsContact CG1-CD 3.42Å; V116-Q196 HydrophobicContact CG1-CG 3.9Å; E117-Q196 PolarHBondContact OE1-NE2 3.41Å; E117-Q196 PolarHBondContact OE1-OE1 3.42Å; F192-Q196 WeakPolarHBondContact O-CB 3.3Å; F192-Q196 PolarHBondContact O-N 3.33Å; Q196-K198 PolarHBondContact O-N 3.24Å; Q196-V199 PolarHBondContact O-N 2.79Å; Q196-Y200 PolarHBondContact O-N 2.94Å
197	R	91.2	Very high	88	Confident	141 Å²	141	54.4 Å²	54.4	53%	0.532	25%	0.248	S	C	.	.	H	α-helix	trans	-60.9	-42.7	175.3	-170	-174.4	-52	119	7.4	112	D193 V195 V199 Y200 E201	D193-R197 VanDerWaalsContact O-CB 3.28Å; D193-R197 WeakPolarHBondContact O-CB 3.32Å; D193-R197 PolarHBondContact O-N 3.23Å; V195-R197 VanDerWaalsContact C-N 3.3Å; V195-R197 PolarHBondContact O-N 2.95Å; R197-V199 VanDerWaalsContact C-N 3.35Å; R197-Y200 PolarHBondContact O-N 3.12Å; R197-E201 WeakPolarHBondContact O-CG 2.83Å; R197-E201 PolarHBondContact O-N 3.36Å
198	K	91.1	Very high	88.4	Confident	89 Å²	89	60.7 Å²	60.7	39%	0.387	27%	0.271	S	S	.	.	H	α-helix	trans	-64.2	-40.1	177.4	-72.5	-64.2	-175.5	-173.6	0	112.4	V170 L174 V195 Q196 E201 M202	V170-K198 HydrophobicContact CG1-CB 3.92Å; V170-K198 HydrophobicContact CG1-CG 4.46Å; L174-K198 HydrophobicContact CD1-CG 3.84Å; V195-K198 PolarHBondContact O-N 3.34Å; V195-K198 VanDerWaalsContact O-N 3.14Å; Q196-K198 PolarHBondContact O-N 3.24Å; K198-E201 IonicContact NZ-OE2 3.76Å; K198-E201 PolarHBondContact O-N 2.93Å; K198-M202 WeakPolarHBondContact O-CB 3.35Å; K198-M202 PolarHBondContact O-N 3.39Å
199	V	89.5	Confident	88.7	Confident	0 Å²	0	58 Å²	58	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-67.2	-39.8	176.5	178.8	0	0	0	0	111.4	E109 F112 V168 V170 V195 Q196 R197 M202 M203	E109-V199 HydrophobicContact CB-CG1 4.08Å; E109-V199 VanDerWaalsContact O-CG1 3.25Å; E109-V199 WeakPolarHBondContact O-CG1 3.26Å; F112-V199 HydrophobicContact CD1-CB 4.08Å; F112-V199 HydrophobicContact CD1-CG1 4.1Å; F112-V199 HydrophobicContact CD1-CG2 3.68Å; F112-V199 HydrophobicContact CE1-CB 4.31Å; F112-V199 HydrophobicContact CE1-CG2 3.73Å; V168-V199 HydrophobicContact CG1-CG1 4.31Å; V168-V199 HydrophobicContact CG1-CG2 3.54Å; V170-V199 HydrophobicContact CG2-CG2 3.59Å; V195-V199 WeakPolarHBondContact O-CG2 3.34Å; V195-V199 PolarHBondContact O-N 3.01Å; V195-V199 VanDerWaalsContact O-N 3.09Å; Q196-V199 PolarHBondContact O-N 2.79Å; R197-V199 VanDerWaalsContact C-N 3.35Å; V199-M202 HydrophobicContact CB-CE 4.5Å; V199-M202 HydrophobicContact CG1-CE 4.18Å; V199-M202 HydrophobicContact CG2-CE 4.44Å; V199-M202 PolarHBondContact O-N 3.01Å; V199-M203 HydrophobicContact CG1-CE 4.35Å; V199-M203 WeakPolarHBondContact O-CG 3.26Å; V199-M203 PolarHBondContact O-N 3.3Å
200	Y	90.4	Very high	89.2	Confident	61 Å²	61	58 Å²	58	24%	0.239	25%	0.253	C	S	.	.	H	α-helix	trans	-62.8	-47.1	173.2	179.4	-93.4	0	0	0	112.4	L84 L88 W113 Q196 R197 M202 M203 L204	L84-Y200 HydrophobicContact CB-CE2 4.47Å; L84-Y200 HydrophobicContact CD2-CD2 4.38Å; L84-Y200 HydrophobicContact CD2-CE2 3.97Å; L84-Y200 HydrophobicContact CG-CE2 4.1Å; L88-Y200 HydrophobicContact CD1-CD2 3.98Å; L88-Y200 HydrophobicContact CD1-CE2 3.88Å; W113-Y200 AromaticContact NE1-CD2 3.98Å; Q196-Y200 PolarHBondContact O-N 2.94Å; R197-Y200 PolarHBondContact O-N 3.12Å; Y200-M202 VanDerWaalsContact C-N 3.27Å; Y200-M202 PolarHBondContact O-N 3.24Å; Y200-M203 PolarHBondContact O-N 3.44Å; Y200-L204 HydrophobicContact CE1-CD2 4.03Å; Y200-L204 WeakPolarHBondContact O-CB 3.39Å; Y200-L204 PolarHBondContact O-N 2.72Å
201	E	90.5	Very high	89.3	Confident	68 Å²	68	53.8 Å²	53.8	32%	0.318	23%	0.234	S	C	.	.	H	α-helix	trans	-58.7	-40.3	176.5	-76.7	-178.2	167.2	0	0	111.9	R197 K198 L204 R205	R197-E201 WeakPolarHBondContact O-CG 2.83Å; R197-E201 PolarHBondContact O-N 3.36Å; K198-E201 IonicContact NZ-OE2 3.76Å; K198-E201 PolarHBondContact O-N 2.93Å; E201-L204 PolarHBondContact O-N 3.48Å; E201-R205 WeakPolarHBondContact O-CB 3.43Å; E201-R205 WeakPolarHBondContact O-CG 3.29Å; E201-R205 PolarHBondContact O-N 2.95Å
202	M	89.4	Confident	89.3	Confident	35 Å²	35	54.9 Å²	54.9	17%	0.172	24%	0.243	C	C	.	.	H	α-helix	trans	-61.9	-52.1	174.4	174.6	175.6	56	0	0	111.2	E109 V168 K198 V199 Y200 L204 R205 D206 F209	E109-M202 HydrophobicContact CB-CE 4.14Å; E109-M202 HydrophobicContact CG-CE 3.33Å; E109-M202 HydrophobicContact CG-SD 4.4Å; V168-M202 HydrophobicContact CG1-CE 4.45Å; K198-M202 WeakPolarHBondContact O-CB 3.35Å; K198-M202 PolarHBondContact O-N 3.39Å; V199-M202 HydrophobicContact CB-CE 4.5Å; V199-M202 HydrophobicContact CG1-CE 4.18Å; V199-M202 HydrophobicContact CG2-CE 4.44Å; V199-M202 PolarHBondContact O-N 3.01Å; Y200-M202 VanDerWaalsContact C-N 3.27Å; Y200-M202 PolarHBondContact O-N 3.24Å; M202-L204 PolarHBondContact O-N 3Å; M202-R205 PolarHBondContact O-N 2.76Å; M202-D206 VanDerWaalsContact O-CB 3.25Å; M202-D206 WeakPolarHBondContact O-CB 3.34Å; M202-D206 PolarHBondContact O-N 3.02Å; M202-F209 HydrophobicContact CG-CD2 4.32Å; M202-F209 HydrophobicContact CG-CE2 3.64Å; M202-F209 WeakPolarHBondContact O-CD2 3.46Å; M202-F209 HydrophobicContact SD-CE2 4.28Å
203	M	89.8	Confident	89.3	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-59.1	-32.6	177.5	-72	-169.4	-65	0	0	113.2	L84 L88 M101 E109 L110 W113 V199 Y200 F209 Y210	L84-M203 HydrophobicContact CD2-CB 3.97Å; L88-M203 HydrophobicContact CD1-CE 4.47Å; M101-M203 HydrophobicContact CE-CG 4.29Å; M101-M203 HydrophobicContact CE-SD 4.18Å; E109-M203 HydrophobicContact CB-CG 4.26Å; E109-M203 HydrophobicContact CB-SD 4.44Å; L110-M203 HydrophobicContact CB-SD 4.25Å; L110-M203 HydrophobicContact CD1-SD 4.17Å; W113-M203 HydrophobicContact CB-CE 3.85Å; W113-M203 HydrophobicContact CG-CE 3.91Å; V199-M203 HydrophobicContact CG1-CE 4.35Å; V199-M203 WeakPolarHBondContact O-CG 3.26Å; V199-M203 PolarHBondContact O-N 3.3Å; Y200-M203 PolarHBondContact O-N 3.44Å; M203-F209 WeakPolarHBondContact O-CB 3.5Å; M203-Y210 WeakPolarHBondContact O-CB 3.47Å; M203-Y210 PolarHBondContact O-N 2.93Å
204	L	90.8	Very high	89.1	Confident	61 Å²	61	56.1 Å²	56.1	32%	0.319	25%	0.247	S	C	.	.	H	α-helix	trans	-77.2	-39.1	-178.8	-176.6	66.2	0	0	0	113.1	L84 Y200 E201 M202 Y210	L84-L204 HydrophobicContact CB-CD1 4Å; L84-L204 HydrophobicContact CD2-CB 4.05Å; L84-L204 HydrophobicContact CD2-CD1 4.19Å; Y200-L204 HydrophobicContact CE1-CD2 4.03Å; Y200-L204 WeakPolarHBondContact O-CB 3.39Å; Y200-L204 PolarHBondContact O-N 2.72Å; E201-L204 PolarHBondContact O-N 3.48Å; M202-L204 PolarHBondContact O-N 3Å; L204-Y210 HydrophobicContact CD1-CD1 3.85Å; L204-Y210 HydrophobicContact CD1-CE1 4.09Å
205	R	89.3	Confident	88.8	Confident	186 Å²	186	60 Å²	60	70%	0.702	27%	0.265	S	S	*	.	H	α-helix	trans	-104	-32.3	-167.9	-64.7	-176.5	179.8	-155	2.6	114.7	E201 M202 E207	E201-R205 WeakPolarHBondContact O-CB 3.43Å; E201-R205 WeakPolarHBondContact O-CG 3.29Å; E201-R205 PolarHBondContact O-N 2.95Å; M202-R205 PolarHBondContact O-N 2.76Å; R205-E207 PolarHBondContact O-N 3.07Å
206	D	89.2	Confident	88.3	Confident	45 Å²	45	60.5 Å²	60.5	24%	0.241	27%	0.268	C	S	.	.	S	Bend	trans	-71.9	127.8	-178.2	-175.8	-32.3	0	0	0	109.6	M202 R208 F209 P211	M202-D206 VanDerWaalsContact O-CB 3.25Å; M202-D206 WeakPolarHBondContact O-CB 3.34Å; M202-D206 PolarHBondContact O-N 3.02Å; D206-R208 PolarHBondContact O-N 3.34Å; D206-R208 WeakPolarHBondContact OD1-CB 3.37Å; D206-R208 WeakPolarHBondContact OD1-CG 3.36Å; D206-R208 PolarHBondContact OD1-N 2.93Å; D206-R208 IonicContact OD1-NE 3.01Å; D206-R208 PolarHBondContact OD1-NE 3.41Å; D206-R208 VanDerWaalsContact OD1-NE 3.13Å; D206-R208 IonicContact OD2-CZ 2.73Å; D206-R208 IonicContact OD2-NE 2.95Å; D206-R208 PolarHBondContact OD2-NE 3.03Å; D206-R208 IonicContact OD2-NH2 2.76Å; D206-R208 PolarHBondContact OD2-NH2 3.1Å; D206-F209 HydrophobicContact CB-CD2 3.63Å; D206-F209 HydrophobicContact CB-CE2 3.66Å; D206-F209 PolarHBondContact O-N 2.92Å; D206-F209 VanDerWaalsContact O-N 3.11Å; D206-P211 WeakPolarHBondContact O-CD 3.34Å
207	E	87.1	Confident	87.6	Confident	118 Å²	118	63.1 Å²	63.1	55%	0.551	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-27.5	-176.2	-74.6	-62.9	147.4	0	0	112.9	R205 F209 P211 S212	R205-E207 PolarHBondContact O-N 3.07Å; E207-F209 PolarHBondContact O-N 3.32Å; E207-P211 WeakPolarHBondContact OE2-CB 3.47Å; E207-S212 WeakPolarHBondContact O-CB 3.42Å; E207-S212 PolarHBondContact O-N 3.14Å; E207-S212 PolarHBondContact O-OG 2.84Å
208	R	85.8	Confident	86.6	Confident	140 Å²	140	58.6 Å²	58.6	53%	0.528	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-18.1	-178.5	-63.7	178.1	-68.7	169.4	1.2	114.2	D206	D206-R208 PolarHBondContact O-N 3.34Å; D206-R208 WeakPolarHBondContact OD1-CB 3.37Å; D206-R208 WeakPolarHBondContact OD1-CG 3.36Å; D206-R208 PolarHBondContact OD1-N 2.93Å; D206-R208 IonicContact OD1-NE 3.01Å; D206-R208 PolarHBondContact OD1-NE 3.41Å; D206-R208 VanDerWaalsContact OD1-NE 3.13Å; D206-R208 IonicContact OD2-CZ 2.73Å; D206-R208 IonicContact OD2-NE 2.95Å; D206-R208 PolarHBondContact OD2-NE 3.03Å; D206-R208 IonicContact OD2-NH2 2.76Å; D206-R208 PolarHBondContact OD2-NH2 3.1Å
209	F	89.7	Confident	85.8	Confident	9 Å²	9	54.5 Å²	54.5	4%	0.039	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.1	-112.9	-172	-48	-51	0	0	0	111.7	F100 M101 A106 M202 M203 D206 E207 S212 F213	F100-F209 WeakPolarHBondContact CE1-O 3.42Å; M101-F209 HydrophobicContact CE-CB 4.29Å; M101-F209 HydrophobicContact CE-CD1 3.74Å; M101-F209 HydrophobicContact CE-CE1 4.44Å; M101-F209 HydrophobicContact CE-CG 4.14Å; M101-F209 HydrophobicContact SD-CB 4.02Å; M101-F209 HydrophobicContact SD-CD1 3.8Å; M101-F209 HydrophobicContact SD-CG 4.27Å; A106-F209 HydrophobicContact CB-CD1 3.44Å; A106-F209 VanDerWaalsContact CB-CD1 3.44Å; A106-F209 HydrophobicContact CB-CE1 3.22Å; A106-F209 HydrophobicContact CB-CZ 4.39Å; M202-F209 HydrophobicContact CG-CD2 4.32Å; M202-F209 HydrophobicContact CG-CE2 3.64Å; M202-F209 WeakPolarHBondContact O-CD2 3.46Å; M202-F209 HydrophobicContact SD-CE2 4.28Å; M203-F209 WeakPolarHBondContact O-CB 3.5Å; D206-F209 HydrophobicContact CB-CD2 3.63Å; D206-F209 HydrophobicContact CB-CE2 3.66Å; D206-F209 PolarHBondContact O-N 2.92Å; D206-F209 VanDerWaalsContact O-N 3.11Å; E207-F209 PolarHBondContact O-N 3.32Å; F209-S212 PolarHBondContact O-N 2.86Å; F209-F213 PolarHBondContact O-N 3.49Å
210	Y	90.2	Very high	84.9	Confident	11 Å²	11	54.8 Å²	54.8	4%	0.043	26%	0.256	C	S	.	.	H	α-helix	trans	-59.4	-39.4	-174.4	177.2	-116.8	0	0	0	114.7	V81 I82 L84 I87 M203 L204 F213 K214	V81-Y210 WeakPolarHBondContact CG1-OH 3.23Å; I82-Y210 PolarHBondContact O-OH 2.84Å; L84-Y210 HydrophobicContact CB-CD1 4.3Å; L84-Y210 HydrophobicContact CB-CD2 4.28Å; L84-Y210 HydrophobicContact CB-CE1 4.38Å; L84-Y210 HydrophobicContact CB-CE2 4.43Å; L84-Y210 HydrophobicContact CB-CG 4.24Å; L84-Y210 HydrophobicContact CD1-CD2 3.98Å; L84-Y210 HydrophobicContact CD1-CG 4.21Å; L84-Y210 HydrophobicContact CD2-CG 4.49Å; I87-Y210 HydrophobicContact CD1-CD2 4.12Å; I87-Y210 HydrophobicContact CD1-CE2 3.52Å; M203-Y210 WeakPolarHBondContact O-CB 3.47Å; M203-Y210 PolarHBondContact O-N 2.93Å; L204-Y210 HydrophobicContact CD1-CD1 3.85Å; L204-Y210 HydrophobicContact CD1-CE1 4.09Å; Y210-F213 HydrophobicContact CD2-CD1 4.36Å; Y210-F213 PolarHBondContact O-N 2.74Å; Y210-K214 HydrophobicContact CD2-CG 4.43Å; Y210-K214 HydrophobicContact CE1-CD 3.98Å; Y210-K214 HydrophobicContact CE2-CD 4.18Å; Y210-K214 HydrophobicContact CE2-CG 3.91Å; Y210-K214 WeakPolarHBondContact O-CG 3.36Å; Y210-K214 PolarHBondContact O-N 3.26Å; Y210-K214 VanDerWaalsContact O-N 3.12Å
211	P	90.8	Very high	83.5	Confident	10 Å²	10	55.6 Å²	55.6	7%	0.065	26%	0.259	C	S	.	.	H	α-helix	trans	-57.4	-47.8	173.5	-25	35.6	0	0	0	113.8	D206 E207 K214	D206-P211 WeakPolarHBondContact O-CD 3.34Å; E207-P211 WeakPolarHBondContact OE2-CB 3.47Å; P211-K214 PolarHBondContact O-N 3.32Å
212	S	86.8	Confident	82.6	Confident	43 Å²	43	52.3 Å²	52.3	30%	0.301	24%	0.243	S	C	.	.	H	α-helix	trans	-69	-34.5	175.1	-75	0	0	0	0	112.7	E207 F209 K214 Q215 S216	E207-S212 WeakPolarHBondContact O-CB 3.42Å; E207-S212 PolarHBondContact O-N 3.14Å; E207-S212 PolarHBondContact O-OG 2.84Å; F209-S212 PolarHBondContact O-N 2.86Å; S212-K214 VanDerWaalsContact C-N 3.32Å; S212-K214 PolarHBondContact O-N 3.28Å; S212-Q215 PolarHBondContact O-N 3.42Å; S212-S216 PolarHBondContact O-N 3.28Å
213	F	87.2	Confident	81.3	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-57.5	-45.9	176	179	-128	0	0	0	111.2	I87 F96 F97 F100 F209 Y210 Q215 S216 L218 Y219 M222	I87-F213 HydrophobicContact CD1-CD1 4.38Å; I87-F213 HydrophobicContact CD1-CE1 4.07Å; F96-F213 HydrophobicContact CB-CE2 4.3Å; F96-F213 HydrophobicContact CB-CZ 3.96Å; F96-F213 WeakPolarHBondContact O-CE2 3.4Å; F97-F213 HydrophobicContact CB-CE1 3.99Å; F97-F213 HydrophobicContact CB-CZ 4.04Å; F97-F213 HydrophobicContact CD2-CB 4.08Å; F97-F213 AromaticContact CD2-CD1 3.39Å; F97-F213 HydrophobicContact CD2-CD1 3.39Å; F97-F213 HydrophobicContact CD2-CD2 4.13Å; F97-F213 AromaticContact CD2-CE1 3.71Å; F97-F213 HydrophobicContact CD2-CE1 3.71Å; F97-F213 HydrophobicContact CD2-CE2 4.42Å; F97-F213 AromaticContact CD2-CG 3.61Å; F97-F213 HydrophobicContact CD2-CG 3.61Å; F97-F213 HydrophobicContact CD2-CZ 4.22Å; F97-F213 HydrophobicContact CE2-CB 3.99Å; F97-F213 AromaticContact CE2-CD1 3.96Å; F97-F213 HydrophobicContact CE2-CD1 3.96Å; F97-F213 HydrophobicContact CE2-CG 4.04Å; F97-F213 HydrophobicContact CG-CD1 4.34Å; F97-F213 HydrophobicContact CG-CE1 4.25Å; F100-F213 HydrophobicContact CB-CD2 3.53Å; F100-F213 HydrophobicContact CB-CE2 3.85Å; F100-F213 HydrophobicContact CB-CG 4.49Å; F100-F213 HydrophobicContact CD1-CB 3.73Å; F100-F213 AromaticContact CD1-CD2 3.91Å; F100-F213 HydrophobicContact CD1-CD2 3.91Å; F100-F213 HydrophobicContact CD1-CG 4.15Å; F100-F213 HydrophobicContact CD2-CB 4.44Å; F100-F213 AromaticContact CD2-CD2 3.82Å; F100-F213 HydrophobicContact CD2-CD2 3.82Å; F100-F213 HydrophobicContact CE1-CB 3.76Å; F100-F213 HydrophobicContact CE2-CB 4.46Å; F100-F213 HydrophobicContact CG-CB 4.1Å; F100-F213 AromaticContact CG-CD2 3.45Å; F100-F213 HydrophobicContact CG-CD2 3.45Å; F100-F213 VanDerWaalsContact CG-CD2 3.45Å; F100-F213 HydrophobicContact CG-CE2 4.27Å; F100-F213 HydrophobicContact CG-CG 4.16Å; F100-F213 HydrophobicContact CZ-CB 4.14Å; F209-F213 PolarHBondContact O-N 3.49Å; Y210-F213 HydrophobicContact CD2-CD1 4.36Å; Y210-F213 PolarHBondContact O-N 2.74Å; F213-Q215 PolarHBondContact O-N 2.89Å; F213-Q215 VanDerWaalsContact O-N 3.07Å; F213-S216 VanDerWaalsContact O-CB 3.26Å; F213-S216 WeakPolarHBondContact O-CB 3.49Å; F213-S216 PolarHBondContact O-N 3.23Å; F213-S216 PolarHBondContact O-OG 3.49Å; F213-L218 HydrophobicContact CE2-CB 4.13Å; F213-Y219 AromaticContact CD1-CD2 3.65Å; F213-Y219 HydrophobicContact CD1-CD2 3.65Å; F213-Y219 HydrophobicContact CD1-CE2 4.28Å; F213-Y219 AromaticContact CE1-CD2 3.49Å; F213-Y219 HydrophobicContact CE1-CD2 3.49Å; F213-Y219 VanDerWaalsContact CE1-CD2 3.49Å; F213-Y219 HydrophobicContact CE1-CE2 4.14Å; F213-Y219 HydrophobicContact CG-CD2 4.29Å; F213-Y219 AromaticContact CZ-CD2 3.97Å; F213-Y219 HydrophobicContact CZ-CD2 3.97Å; F213-Y219 WeakPolarHBondContact O-CB 3.36Å; F213-M222 HydrophobicContact CE1-CE 4.27Å; F213-M222 HydrophobicContact CE1-SD 3.98Å; F213-M222 HydrophobicContact CZ-CE 4.45Å; F213-M222 HydrophobicContact CZ-SD 3.85Å
214	K	86	Confident	79.7	Confident	74 Å²	74	52 Å²	52	32%	0.322	25%	0.247	S	C	.	.	H	α-helix	trans	-56.7	-25.6	177.3	-71.9	178.9	-67.8	-179.9	0	114.1	V81 Y210 P211 S212 Y219	V81-K214 HydrophobicContact CG1-CD 4.06Å; Y210-K214 HydrophobicContact CD2-CG 4.43Å; Y210-K214 HydrophobicContact CE1-CD 3.98Å; Y210-K214 HydrophobicContact CE2-CD 4.18Å; Y210-K214 HydrophobicContact CE2-CG 3.91Å; Y210-K214 WeakPolarHBondContact O-CG 3.36Å; Y210-K214 PolarHBondContact O-N 3.26Å; Y210-K214 VanDerWaalsContact O-N 3.12Å; P211-K214 PolarHBondContact O-N 3.32Å; S212-K214 VanDerWaalsContact C-N 3.32Å; S212-K214 PolarHBondContact O-N 3.28Å; K214-Y219 HydrophobicContact CG-CE2 4.21Å
215	Q	82.7	Confident	78	Confident	156 Å²	156	52.6 Å²	52.6	73%	0.729	25%	0.248	S	C	*	.	H	α-helix	trans	-93.9	-6.9	179.6	-57.9	178.4	32.7	0	0	112.3	S212 F213	S212-Q215 PolarHBondContact O-N 3.42Å; F213-Q215 PolarHBondContact O-N 2.89Å; F213-Q215 VanDerWaalsContact O-N 3.07Å
216	S	80.2	Confident	76.3	Confident	13 Å²	13	45.2 Å²	45.2	9%	0.091	22%	0.222	C	C	.	.	S	Bend	trans	-80.8	150.7	-174.7	77.6	0	0	0	0	112.7	S212 F213 L218 Y219	S212-S216 PolarHBondContact O-N 3.28Å; F213-S216 VanDerWaalsContact O-CB 3.26Å; F213-S216 WeakPolarHBondContact O-CB 3.49Å; F213-S216 PolarHBondContact O-N 3.23Å; F213-S216 PolarHBondContact O-OG 3.49Å; S216-L218 PolarHBondContact O-N 3.21Å; S216-L218 PolarHBondContact OG-N 2.92Å; S216-Y219 WeakPolarHBondContact O-CB 3.27Å; S216-Y219 PolarHBondContact O-N 2.84Å; S216-Y219 VanDerWaalsContact O-N 3.11Å; S216-Y219 PolarHBondContact OG-N 3.04Å
217	P	72.6	Confident	74.7	Confident	66 Å²	66	48.9 Å²	48.9	43%	0.429	24%	0.241	S	C	.	.	H	α-helix	trans	-56.8	-29.2	169.7	-26.4	35.6	0	0	0	113.5	A69 Y219 V220 R221	A69-P217 HydrophobicContact CB-CB 3.9Å; P217-Y219 VanDerWaalsContact C-N 3.32Å; P217-Y219 PolarHBondContact O-N 3Å; P217-V220 PolarHBondContact O-N 3.44Å; P217-R221 WeakPolarHBondContact O-CG 3.23Å; P217-R221 PolarHBondContact O-N 3Å
218	L	69.4	Low	73.3	Confident	45 Å²	45	46.7 Å²	46.7	24%	0.236	23%	0.232	C	C	.	.	H	α-helix	trans	-65	-36.4	177.9	-69.3	175.2	0	0	0	111.8	F96 D99 F100 F213 S216 V220 R221 M222	F96-L218 HydrophobicContact CD1-CD2 4.43Å; F96-L218 WeakPolarHBondContact CD1-O 3.16Å; D99-L218 HydrophobicContact CB-CD1 4.45Å; F100-L218 HydrophobicContact CB-CD1 3.97Å; F100-L218 HydrophobicContact CD2-CD1 4.42Å; F213-L218 HydrophobicContact CE2-CB 4.13Å; S216-L218 PolarHBondContact O-N 3.21Å; S216-L218 PolarHBondContact OG-N 2.92Å; L218-V220 VanDerWaalsContact C-N 3.34Å; L218-V220 PolarHBondContact O-N 2.9Å; L218-R221 PolarHBondContact O-N 3.07Å; L218-M222 WeakPolarHBondContact O-CB 3.46Å; L218-M222 PolarHBondContact O-N 3.35Å
219	Y	75.1	Confident	71.9	Confident	3 Å²	3	41.3 Å²	41.3	1%	0.012	21%	0.214	C	C	.	.	H	α-helix	trans	-66.5	-36.1	176.7	-173.1	-95.3	0	0	0	112.4	C80 V81 I82 I87 F213 K214 S216 P217 M222 L223	C80-Y219 WeakPolarHBondContact O-CE1 3.44Å; C80-Y219 PolarHBondContact O-OH 3.38Å; V81-Y219 VanDerWaalsContact CA-OH 3.3Å; V81-Y219 WeakPolarHBondContact CA-OH 3.37Å; I82-Y219 PolarHBondContact N-OH 3.34Å; I87-Y219 HydrophobicContact CD1-CE2 4.36Å; F213-Y219 AromaticContact CD1-CD2 3.65Å; F213-Y219 HydrophobicContact CD1-CD2 3.65Å; F213-Y219 HydrophobicContact CD1-CE2 4.28Å; F213-Y219 AromaticContact CE1-CD2 3.49Å; F213-Y219 HydrophobicContact CE1-CD2 3.49Å; F213-Y219 VanDerWaalsContact CE1-CD2 3.49Å; F213-Y219 HydrophobicContact CE1-CE2 4.14Å; F213-Y219 HydrophobicContact CG-CD2 4.29Å; F213-Y219 AromaticContact CZ-CD2 3.97Å; F213-Y219 HydrophobicContact CZ-CD2 3.97Å; F213-Y219 WeakPolarHBondContact O-CB 3.36Å; K214-Y219 HydrophobicContact CG-CE2 4.21Å; S216-Y219 WeakPolarHBondContact O-CB 3.27Å; S216-Y219 PolarHBondContact O-N 2.84Å; S216-Y219 VanDerWaalsContact O-N 3.11Å; S216-Y219 PolarHBondContact OG-N 3.04Å; P217-Y219 VanDerWaalsContact C-N 3.32Å; P217-Y219 PolarHBondContact O-N 3Å; Y219-M222 HydrophobicContact CD2-CE 3.41Å; Y219-M222 VanDerWaalsContact CD2-CE 3.41Å; Y219-M222 HydrophobicContact CE2-CE 3.3Å; Y219-M222 HydrophobicContact CG-CE 4.15Å; Y219-M222 WeakPolarHBondContact O-CB 3.42Å; Y219-M222 PolarHBondContact O-N 2.91Å; Y219-L223 HydrophobicContact CD1-CD1 4Å; Y219-L223 HydrophobicContact CD1-CG 4.35Å; Y219-L223 HydrophobicContact CE1-CD1 3.62Å; Y219-L223 HydrophobicContact CE1-CD2 4.46Å; Y219-L223 HydrophobicContact CE1-CG 4.05Å; Y219-L223 WeakPolarHBondContact O-CG 3.3Å; Y219-L223 PolarHBondContact O-N 3.4Å
220	V	69.4	Low	69.9	Low	7 Å²	7	49.8 Å²	49.8	4%	0.042	25%	0.25	C	S	.	.	H	α-helix	trans	-70.4	-40.6	175.7	-174.1	0	0	0	0	111.2	A69 L72 A73 L79 P217 L218 M222 L223 A224	A69-V220 HydrophobicContact CB-CB 4.45Å; L72-V220 HydrophobicContact CB-CG1 4.21Å; L72-V220 HydrophobicContact CD2-CG1 4.42Å; A73-V220 HydrophobicContact CB-CG2 4.07Å; L79-V220 HydrophobicContact CD1-CG2 3.73Å; P217-V220 PolarHBondContact O-N 3.44Å; L218-V220 VanDerWaalsContact C-N 3.34Å; L218-V220 PolarHBondContact O-N 2.9Å; V220-M222 VanDerWaalsContact C-N 3.3Å; V220-M222 PolarHBondContact O-N 3.47Å; V220-L223 PolarHBondContact O-N 3.48Å; V220-A224 PolarHBondContact O-N 3.41Å
221	R	60.9	Low	67.5	Low	77 Å²	77	56 Å²	56	29%	0.291	28%	0.28	S	S	.	.	H	α-helix	trans	-61.5	-40.6	172.2	-69.3	177.1	-177.7	-159.3	-3.2	111.3	E66 A69 F96 P217 L218 A224 E225	E66-R221 IonicContact OE1-NH1 3.4Å; E66-R221 PolarHBondContact OE1-NH1 3.02Å; E66-R221 IonicContact OE2-CZ 3.18Å; E66-R221 IonicContact OE2-NH1 3.91Å; E66-R221 PolarHBondContact OE2-NH1 3.49Å; E66-R221 IonicContact OE2-NH2 3.96Å; E66-R221 PolarHBondContact OE2-NH2 2.97Å; A69-R221 HydrophobicContact CB-CG 4.28Å; F96-R221 HydrophobicContact CD1-CB 4.32Å; F96-R221 HydrophobicContact CE1-CB 3.67Å; F96-R221 HydrophobicContact CZ-CB 4.32Å; P217-R221 WeakPolarHBondContact O-CG 3.23Å; P217-R221 PolarHBondContact O-N 3Å; L218-R221 PolarHBondContact O-N 3.07Å; R221-A224 WeakPolarHBondContact O-CB 2.97Å; R221-A224 PolarHBondContact O-N 3.42Å; R221-E225 PolarHBondContact O-N 3.36Å
222	M	73	Confident	64.6	Low	0 Å²	0	59.8 Å²	59.8	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-59.1	-50.7	174.2	-176.7	-168.1	69.3	0	0	111.4	I82 A93 F96 F213 L218 Y219 V220 A224 E225 L226	I82-M222 HydrophobicContact CD1-CE 3.84Å; A93-M222 VanDerWaalsContact CA-SD 3.54Å; A93-M222 HydrophobicContact CB-CG 4.2Å; A93-M222 HydrophobicContact CB-SD 3.59Å; A93-M222 VanDerWaalsContact CB-SD 3.59Å; F96-M222 HydrophobicContact CB-CB 3.77Å; F96-M222 HydrophobicContact CB-CG 3.99Å; F96-M222 HydrophobicContact CB-SD 4.26Å; F96-M222 HydrophobicContact CD1-CB 4.12Å; F96-M222 HydrophobicContact CD2-CB 3.53Å; F96-M222 HydrophobicContact CD2-CG 3.62Å; F96-M222 HydrophobicContact CE2-CB 4.12Å; F96-M222 HydrophobicContact CE2-CG 4.36Å; F96-M222 HydrophobicContact CG-CB 3.54Å; F96-M222 HydrophobicContact CG-CG 3.98Å; F213-M222 HydrophobicContact CE1-CE 4.27Å; F213-M222 HydrophobicContact CE1-SD 3.98Å; F213-M222 HydrophobicContact CZ-CE 4.45Å; F213-M222 HydrophobicContact CZ-SD 3.85Å; L218-M222 WeakPolarHBondContact O-CB 3.46Å; L218-M222 PolarHBondContact O-N 3.35Å; Y219-M222 HydrophobicContact CD2-CE 3.41Å; Y219-M222 VanDerWaalsContact CD2-CE 3.41Å; Y219-M222 HydrophobicContact CE2-CE 3.3Å; Y219-M222 HydrophobicContact CG-CE 4.15Å; Y219-M222 WeakPolarHBondContact O-CB 3.42Å; Y219-M222 PolarHBondContact O-N 2.91Å; V220-M222 VanDerWaalsContact C-N 3.3Å; V220-M222 PolarHBondContact O-N 3.47Å; M222-A224 VanDerWaalsContact C-N 3.25Å; M222-A224 PolarHBondContact O-N 2.93Å; M222-E225 PolarHBondContact O-N 3.29Å; M222-E225 VanDerWaalsContact O-N 3.12Å; M222-L226 HydrophobicContact CE-CD1 4.49Å; M222-L226 HydrophobicContact CG-CD1 3.88Å; M222-L226 HydrophobicContact CG-CG 4.39Å; M222-L226 WeakPolarHBondContact O-CB 3.35Å; M222-L226 VanDerWaalsContact O-CG 3.25Å; M222-L226 WeakPolarHBondContact O-CG 3.13Å; M222-L226 PolarHBondContact O-N 2.87Å; M222-L226 HydrophobicContact SD-CD1 4.46Å
223	L	61.3	Low	61.9	Low	0 Å²	0	62.7 Å²	62.7	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-59.8	-36.6	177.1	-69.7	177.7	0	0	0	112.3	L79 C80 I82 Y219 V220 L226 D227 M228 L229	L79-L223 HydrophobicContact CB-CD1 4.02Å; L79-L223 HydrophobicContact CD2-CD1 4.02Å; L79-L223 HydrophobicContact CG-CD1 4.48Å; C80-L223 HydrophobicContact CB-CD2 4.2Å; I82-L223 HydrophobicContact CD1-CD2 3.72Å; I82-L223 HydrophobicContact CG1-CD2 4.03Å; Y219-L223 HydrophobicContact CD1-CD1 4Å; Y219-L223 HydrophobicContact CD1-CG 4.35Å; Y219-L223 HydrophobicContact CE1-CD1 3.62Å; Y219-L223 HydrophobicContact CE1-CD2 4.46Å; Y219-L223 HydrophobicContact CE1-CG 4.05Å; Y219-L223 WeakPolarHBondContact O-CG 3.3Å; Y219-L223 PolarHBondContact O-N 3.4Å; V220-L223 PolarHBondContact O-N 3.48Å; L223-L226 PolarHBondContact O-N 3.24Å; L223-D227 PolarHBondContact O-N 2.78Å; L223-M228 HydrophobicContact CB-CB 4.49Å; L223-M228 HydrophobicContact CD2-CB 3.94Å; L223-M228 HydrophobicContact CD2-CE 4.42Å; L223-M228 HydrophobicContact CD2-SD 4.46Å; L223-M228 PolarHBondContact O-N 3.34Å; L223-L229 HydrophobicContact CB-CD2 3.69Å; L223-L229 HydrophobicContact CB-CG 3.91Å; L223-L229 HydrophobicContact CD1-CD2 4.18Å; L223-L229 PolarHBondContact O-N 2.84Å
224	A	56.1	Low	59.2	Low	29 Å²	29	72.7 Å²	72.7	24%	0.24	36%	0.364	C	S	.	.	H	α-helix	trans	-64.7	-41.4	175.4	0	0	0	0	0	112	V220 R221 M222 L226 D227 L229	V220-A224 PolarHBondContact O-N 3.41Å; R221-A224 WeakPolarHBondContact O-CB 2.97Å; R221-A224 PolarHBondContact O-N 3.42Å; M222-A224 VanDerWaalsContact C-N 3.25Å; M222-A224 PolarHBondContact O-N 2.93Å; A224-L226 VanDerWaalsContact C-N 3.34Å; A224-D227 PolarHBondContact O-N 2.98Å; A224-L229 HydrophobicContact CB-CD1 3.46Å; A224-L229 VanDerWaalsContact CB-CD1 3.46Å; A224-L229 HydrophobicContact CB-CG 4.31Å
225	E	55	Low	56.5	Low	73 Å²	73	80.4 Å²	80.4	34%	0.341	39%	0.391	S	S	.	.	H	α-helix	trans	-71.9	-32.2	-179.6	-161.9	62.8	-160.7	0	0	112	I92 F96 R221 M222 D227	I92-E225 HydrophobicContact CG2-CB 4.1Å; I92-E225 HydrophobicContact CG2-CG 3.75Å; F96-E225 HydrophobicContact CE2-CB 3.99Å; F96-E225 HydrophobicContact CE2-CG 4.29Å; F96-E225 HydrophobicContact CZ-CB 4.16Å; R221-E225 PolarHBondContact O-N 3.36Å; M222-E225 PolarHBondContact O-N 3.29Å; M222-E225 VanDerWaalsContact O-N 3.12Å; E225-D227 PolarHBondContact O-N 3.42Å
226	L	53.7	Low	53.8	Low	31 Å²	31	75.5 Å²	75.5	16%	0.162	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-0.9	173.6	-64.7	176	0	0	0	113.6	I82 H90 I92 A93 M222 L223 A224 M228	I82-L226 HydrophobicContact CD1-CD1 3.43Å; I82-L226 VanDerWaalsContact CD1-CD1 3.43Å; H90-L226 WeakPolarHBondContact CE1-CD2 3.33Å; I92-L226 HydrophobicContact CB-CD2 3.79Å; I92-L226 HydrophobicContact CD1-CD2 4.34Å; I92-L226 HydrophobicContact CG2-CD2 3.84Å; I92-L226 HydrophobicContact CG2-CG 4.36Å; A93-L226 HydrophobicContact CB-CD1 4.16Å; M222-L226 HydrophobicContact CE-CD1 4.49Å; M222-L226 HydrophobicContact CG-CD1 3.88Å; M222-L226 HydrophobicContact CG-CG 4.39Å; M222-L226 WeakPolarHBondContact O-CB 3.35Å; M222-L226 VanDerWaalsContact O-CG 3.25Å; M222-L226 WeakPolarHBondContact O-CG 3.13Å; M222-L226 PolarHBondContact O-N 2.87Å; M222-L226 HydrophobicContact SD-CD1 4.46Å; L223-L226 PolarHBondContact O-N 3.24Å; A224-L226 VanDerWaalsContact C-N 3.34Å; L226-M228 HydrophobicContact CB-CB 4.28Å; L226-M228 HydrophobicContact CB-CG 3.75Å; L226-M228 HydrophobicContact CB-SD 3.93Å; L226-M228 HydrophobicContact CD1-SD 4.01Å; L226-M228 PolarHBondContact O-N 2.86Å
227	D	55.3	Low	51.5	Low	121 Å²	121	79.9 Å²	79.9	65%	0.647	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	28.5	-174.3	-148.9	24.2	0	0	0	112.8	L223 A224 E225	L223-D227 PolarHBondContact O-N 2.78Å; A224-D227 PolarHBondContact O-N 2.98Å; E225-D227 PolarHBondContact O-N 3.42Å
228	M	58.4	Low	49.9	Very low	73 Å²	73	83.9 Å²	83.9	36%	0.36	43%	0.431	S	S	.	.			trans	-96.5	-0.5	-177.5	-69	-173.9	62.3	0	0	113	C80 I82 L223 L226 K230	C80-M228 HydrophobicContact CB-CE 4.21Å; C80-M228 WeakPolarHBondContact SG-CE 3.3Å; I82-M228 HydrophobicContact CD1-CE 3.85Å; I82-M228 HydrophobicContact CD1-SD 3.51Å; I82-M228 VanDerWaalsContact CD1-SD 3.51Å; I82-M228 HydrophobicContact CG1-CE 3.75Å; I82-M228 HydrophobicContact CG1-SD 4.12Å; L223-M228 HydrophobicContact CB-CB 4.49Å; L223-M228 HydrophobicContact CD2-CB 3.94Å; L223-M228 HydrophobicContact CD2-CE 4.42Å; L223-M228 HydrophobicContact CD2-SD 4.46Å; L223-M228 PolarHBondContact O-N 3.34Å; L226-M228 HydrophobicContact CB-CB 4.28Å; L226-M228 HydrophobicContact CB-CG 3.75Å; L226-M228 HydrophobicContact CB-SD 3.93Å; L226-M228 HydrophobicContact CD1-SD 4.01Å; L226-M228 PolarHBondContact O-N 2.86Å; M228-K230 PolarHBondContact O-N 3.1Å
229	L	57	Low	48.3	Very low	27 Å²	27	89.5 Å²	89.5	14%	0.141	46%	0.461	C	S	.	.			trans	-82.1	91.9	167.8	-64.2	-179.7	0	0	0	108.9	L72 F76 L79 L223 A224 E231	L72-L229 HydrophobicContact CD2-CD1 3.26Å; F76-L229 HydrophobicContact CD2-CD1 4.46Å; F76-L229 HydrophobicContact CD2-CD2 4.09Å; F76-L229 HydrophobicContact CE2-CB 4.12Å; F76-L229 HydrophobicContact CE2-CD1 4.09Å; F76-L229 HydrophobicContact CE2-CD2 4.36Å; F76-L229 HydrophobicContact CE2-CG 4.44Å; F76-L229 HydrophobicContact CZ-CB 4.16Å; L79-L229 HydrophobicContact CD2-CD2 4.03Å; L223-L229 HydrophobicContact CB-CD2 3.69Å; L223-L229 HydrophobicContact CB-CG 3.91Å; L223-L229 HydrophobicContact CD1-CD2 4.18Å; L223-L229 PolarHBondContact O-N 2.84Å; A224-L229 HydrophobicContact CB-CD1 3.46Å; A224-L229 VanDerWaalsContact CB-CD1 3.46Å; A224-L229 HydrophobicContact CB-CG 4.31Å; L229-E231 PolarHBondContact O-N 3.33Å; L229-E231 VanDerWaalsContact O-N 3.12Å
230	K	47.7	Very low	46.2	Very low	186 Å²	186	92.5 Å²	92.5	81%	0.809	49%	0.493	S	S	*	.			trans	-65.4	110.2	168	-71.6	-173.7	176.8	-175.3	0	108.2	F76 M228	F76-K230 WeakPolarHBondContact CD1-O 3.41Å; F76-K230 WeakPolarHBondContact CE1-O 3.18Å; M228-K230 PolarHBondContact O-N 3.1Å
231	E	38.3	Very low	44.4	Very low	142 Å²	142	100.3 Å²	100.3	66%	0.664	53%	0.534	S	S	*	.			trans	-41.9	134.4	165.4	-77.1	175.9	-178.8	0	0	108.7	L229 S233	L229-E231 PolarHBondContact O-N 3.33Å; L229-E231 VanDerWaalsContact O-N 3.12Å; E231-S233 PolarHBondContact O-N 2.9Å
232	P	31.6	Very low	43.2	Very low	90 Å²	90	100.2 Å²	100.2	58%	0.584	56%	0.557	S	S	*	*			trans	-55.8	118.9	168.2	25.5	-31.3	0	0	0	105.2	Y234	P232-Y234 PolarHBondContact O-N 3.27Å
233	S	29.6	Very low	41.2	Very low	104 Å²	104	109.6 Å²	109.6	73%	0.727	60%	0.601	S	S	*	*			trans	-46.8	115.4	171.2	55.9	0	0	0	0	105.4	E231 R235	E231-S233 PolarHBondContact O-N 2.9Å; S233-R235 PolarHBondContact O-N 3.3Å
234	Y	30	Very low	39.7	Very low	210 Å²	210	115.5 Å²	115.5	82%	0.824	64%	0.642	S	S	*	*			trans	-55.9	101	171.4	-160	-93.6	0	0	0	104.2	P232 G236	P232-Y234 PolarHBondContact O-N 3.27Å; Y234-G236 PolarHBondContact O-N 3.19Å
235	R	28.7	Very low	38.3	Very low	236 Å²	236	123.5 Å²	123.5	89%	0.891	67%	0.672	S	S	*	*			trans	-61.9	96.6	161.4	-104.9	-166.8	176.1	-169.5	-1.2	101.8	S233 S237	S233-R235 PolarHBondContact O-N 3.3Å; R235-S237 PolarHBondContact O-N 2.57Å
236	G	27.8	Very low	37.1	Very low	53 Å²	53	127.7 Å²	127.7	55%	0.546	70%	0.697	S	S	.	*			trans	-45.7	120.1	163.1	0	0	0	0	0	105.6	Y234 D238	Y234-G236 PolarHBondContact O-N 3.19Å; G236-D238 PolarHBondContact O-N 2.91Å
237	S	31.5	Very low	36	Very low	105 Å²	105	128.8 Å²	128.8	73%	0.734	72%	0.716	S	S	*	*			trans	-46.5	116.1	155.1	42.7	0	0	0	0	106.4	R235 D239	R235-S237 PolarHBondContact O-N 2.57Å; S237-D239 PolarHBondContact O-N 2.71Å
238	D	39	Very low	34.7	Very low	150 Å²	150	128.4 Å²	128.4	80%	0.802	72%	0.722	S	S	*	*	S	Bend	trans	-29	110.6	166.1	-159.8	21.4	0	0	0	111.2	G236	G236-D238 PolarHBondContact O-N 2.91Å
239	D	34.9	Very low	33.5	Very low	163 Å²	163	131.3 Å²	131.3	87%	0.872	75%	0.747	S	S	*	*			trans	-177.4	97.6	151.2	-87	-25.9	0	0	0	108.8	S237	S237-D239 PolarHBondContact O-N 2.71Å
240	G	31.5	Very low	32.3	Very low	65 Å²	65	136.6 Å²	136.6	67%	0.67	78%	0.78	S	S	*	*	S	Bend	trans	87.1	102.4	147.1	0	0	0	0	0	119.8
241	D	31.8	Very low	31.2	Very low	172 Å²	172	131.2 Å²	131.2	92%	0.92	78%	0.778	S	S	*	*			trans	83	100.1	145.5	-51.9	-18.4	0	0	0	118.5
242	G	35.8	Very low	30.8	Very low	75 Å²	75	129.9 Å²	129.9	77%	0.773	78%	0.784	S	S	*	*			trans	-92.2	156.5	-165.4	0	0	0	0	0	116.3
243	E	30.2	Very low	30.4	Very low	196 Å²	196	133.4 Å²	133.4	92%	0.916	80%	0.797	S	S	*	*			trans	-139.9	127.1	138.8	-73	-156	157.9	0	0	108.9	F245	E243-F245 PolarHBondContact O-N 2.9Å
244	S	30.2	Very low	30.4	Very low	124 Å²	124	135.2 Å²	135.2	87%	0.867	80%	0.799	S	S	*	*			trans	-66	116.5	-175.2	-87.3	0	0	0	0	112.3	N246	S244-N246 PolarHBondContact O-N 2.73Å
245	F	27.4	Very low	30.2	Very low	197 Å²	197	133.2 Å²	133.2	86%	0.864	80%	0.802	S	S	*	*			trans	-77.3	97.4	166	-170.5	-96.6	0	0	0	109.7	E243	E243-F245 PolarHBondContact O-N 2.9Å
246	N	29.7	Very low	29.9	Very low	162 Å²	162	126.8 Å²	126.8	87%	0.866	79%	0.793	S	S	*	*			trans	-99.2	111	165.7	-99.7	-7.9	0	0	0	109.9	S244	S244-N246 PolarHBondContact O-N 2.73Å
247	G	29	Very low	30	Very low	54 Å²	54	131.4 Å²	131.4	56%	0.557	80%	0.804	S	S	*	*			trans	-75.2	145	172.5	0	0	0	0	0	112.7
248	S	28.7	Very low	29.7	Very low	112 Å²	112	133 Å²	133	78%	0.783	80%	0.804	S	S	*	*			trans	125.3	128.9	153.4	-55.3	0	0	0	0	111.6
249	P	32.8	Very low	29.1	Very low	135 Å²	135	132.2 Å²	132.2	88%	0.877	80%	0.8	S	S	*	*			trans	-113.9	86.8	152.3	32.9	-18.8	0	0	0	108.8
250	T	32	Very low	28.7	Very low	137 Å²	137	131.2 Å²	131.2	84%	0.84	79%	0.794	S	S	*	*			trans	-125.5	113.8	147.4	49.9	0	0	0	0	106
251	G	24.3	Very low	28.4	Very low	74 Å²	74	132 Å²	132	76%	0.763	79%	0.79	S	S	*	*			trans	155.4	93.4	177.6	0	0	0	0	0	111.9
252	S	29.6	Very low	28.1	Very low	113 Å²	113	131.3 Å²	131.3	79%	0.79	79%	0.786	S	S	*	*			trans	-13.9	144.4	146.8	-34.3	0	0	0	0	115.4
253	L	24.2	Very low	27.7	Very low	165 Å²	165	132.6 Å²	132.6	86%	0.864	78%	0.783	S	S	*	*				-178.1	145.7	116.4	-91.4	162	0	0	0	111.7
254	N	30.3	Very low	27.5	Very low	141 Å²	141	129.3 Å²	129.3	75%	0.754	78%	0.78	S	S	*	*			trans	-56.4	169	167.5	-63.4	-63.5	0	0	0	113
255	L	24.2	Very low	27.5	Very low	169 Å²	169	131.8 Å²	131.8	89%	0.885	78%	0.777	S	S	*	*			trans	128.8	144.8	156	-72.9	155.1	0	0	0	109.2
256	S	23.3	Very low	27.9	Very low	101 Å²	101	129.1 Å²	129.1	71%	0.706	77%	0.772	S	S	*	*			cis	-167.6	156.4	-16.9	48.8	0	0	0	0	104.6
257	L	29.6	Very low	28.4	Very low	150 Å²	150	128.9 Å²	128.9	79%	0.785	77%	0.766	S	S	*	*			trans	-62.9	153.5	172.9	-160.6	73.3	0	0	0	112.1
258	D	25.2	Very low	29.2	Very low	137 Å²	137	131.2 Å²	131.2	73%	0.733	76%	0.761	S	S	*	*			trans	75.8	134.2	169.3	-55.2	-30.1	0	0	0	116.3
259	D	26.3	Very low	30.4	Very low	134 Å²	134	128.6 Å²	128.6	72%	0.717	74%	0.738	S	S	*	*			cis	-164.9	160.3	19.2	-155.7	-3.7	0	0	0	111.5
260	L	26.1	Very low	32	Very low	143 Å²	143	127.6 Å²	127.6	75%	0.749	72%	0.722	S	S	*	*			trans	74.3	138.2	161.3	-62.1	155	0	0	0	120.5
261	S	25.8	Very low	34.1	Very low	82 Å²	82	121.9 Å²	121.9	57%	0.573	69%	0.686	S	S	*	*			cis	170.1	136.1	-36.5	49	0	0	0	0	106.5
262	N	26.7	Very low	36.9	Very low	157 Å²	157	122.2 Å²	122.2	84%	0.84	67%	0.667	S	S	*	*			trans	66.2	131.6	157	-66.4	-17.1	0	0	0	118.6
263	S	26.3	Very low	39.8	Very low	102 Å²	102	116.8 Å²	116.8	71%	0.713	63%	0.629	S	S	*	*			cis	-169	139.3	12.7	42.8	0	0	0	0	111.1
264	C	25.3	Very low	42.8	Very low	126 Å²	126	112.3 Å²	112.3	85%	0.851	60%	0.603	S	S	*	*	S	Bend	trans	-154.7	134.1	130.9	64.6	0	0	0	0	109.4
265	H	31.6	Very low	45.7	Very low	176 Å²	176	106 Å²	106	82%	0.815	57%	0.569	S	S	*	*			trans	-59.4	131.2	-163	-65.3	-81.3	0	0	0	114
266	D	34.3	Very low	48.6	Very low	141 Å²	141	99.7 Å²	99.7	75%	0.754	54%	0.539	S	S	*	.				89.5	93.3	61	-157.7	17.6	0	0	0	112.5
267	E	40.6	Very low	51.3	Low	158 Å²	158	99.7 Å²	99.7	74%	0.738	53%	0.532	S	S	*	.			trans	-165.3	51.1	151.1	-115.7	-167.1	-161.9	0	0	110.9	L269	E267-L269 PolarHBondContact O-N 2.84Å
268	F	46.5	Very low	54	Low	103 Å²	103	94.1 Å²	94.1	45%	0.452	50%	0.504	S	S	.	.			trans	-87.3	88.5	168.7	-80.4	-77.8	0	0	0	109.8	Q270 V370 K371 I377	F268-Q270 PolarHBondContact O-N 3.47Å; F268-Q270 VanDerWaalsContact O-N 3.15Å; F268-V370 HydrophobicContact CD1-CG1 3.91Å; F268-V370 HydrophobicContact CE1-CG1 3.99Å; F268-K371 HydrophobicContact CD1-CG 4.14Å; F268-K371 HydrophobicContact CD2-CG 4.03Å; F268-K371 HydrophobicContact CE1-CB 4.36Å; F268-K371 HydrophobicContact CE1-CG 3.81Å; F268-K371 HydrophobicContact CE2-CG 3.68Å; F268-K371 HydrophobicContact CG-CG 4.26Å; F268-K371 HydrophobicContact CZ-CB 4.1Å; F268-K371 HydrophobicContact CZ-CG 3.56Å; F268-I377 HydrophobicContact CE1-CD1 4.42Å
269	L	54.3	Low	56.4	Low	56 Å²	56	89.3 Å²	89.3	29%	0.293	49%	0.486	S	S	.	.			trans	-53.8	115.1	169.3	-78.9	156.6	0	0	0	110.4	E267 L271 P300	E267-L269 PolarHBondContact O-N 2.84Å; L269-L271 PolarHBondContact O-N 3.29Å; L269-P300 HydrophobicContact CD2-CG 4.39Å
270	Q	65.1	Low	58.9	Low	115 Å²	115	86.9 Å²	86.9	54%	0.537	48%	0.476	S	S	.	.			trans	-79.4	90.5	-176.5	-163.9	171.9	32.9	0	0	109.8	F268 R298	F268-Q270 PolarHBondContact O-N 3.47Å; F268-Q270 VanDerWaalsContact O-N 3.15Å; Q270-R298 PolarHBondContact O-N 2.97Å
271	L	77.3	Confident	60.8	Low	17 Å²	17	82.5 Å²	82.5	9%	0.089	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	121.6	175.8	-161.1	77.5	0	0	0	109.8	L269 V295 R297 W307 L365 Y381 L384	L269-L271 PolarHBondContact O-N 3.29Å; L271-V295 HydrophobicContact CD1-CG1 3.8Å; L271-V295 HydrophobicContact CD2-CG1 4.3Å; L271-V295 HydrophobicContact CG-CG1 4Å; L271-R297 HydrophobicContact CD1-CB 3.67Å; L271-R297 HydrophobicContact CD1-CG 3.98Å; L271-W307 HydrophobicContact CD1-CH2 4.05Å; L271-L365 HydrophobicContact CB-CD2 4.41Å; L271-L365 HydrophobicContact CD2-CD2 4.12Å; L271-Y381 HydrophobicContact CD1-CE1 3.93Å; L271-Y381 HydrophobicContact CD2-CD1 4.34Å; L271-Y381 HydrophobicContact CD2-CE1 4.02Å; L271-L384 HydrophobicContact CD2-CD1 3.63Å
272	H	83.2	Confident	62.9	Low	80 Å²	80	84 Å²	84	37%	0.37	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	128.6	175.7	179.2	-97.5	0	0	0	109.9	F274 I296	H272-F274 AromaticContact CE1-CD1 3.54Å; H272-F274 AromaticContact ND1-CD1 3.82Å; H272-I296 PolarHBondContact N-O 3.12Å; H272-I296 PolarHBondContact O-N 3.49Å
273	A	89.1	Confident	64	Low	0 Å²	0	80.1 Å²	80.1	0%	0	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	137.9	178.1	0	0	0	0	0	112.1	I293 T294 V295 Q362 L365 L384	A273-I293 HydrophobicContact CB-CG2 4Å; A273-T294 CarbonylContact C-O 3.58Å; A273-T294 VanDerWaalsContact CA-O 3.24Å; A273-T294 WeakPolarHBondContact CA-O 3.42Å; A273-V295 HydrophobicContact CB-CB 4.44Å; A273-V295 HydrophobicContact CB-CG1 4.35Å; A273-V295 HydrophobicContact CB-CG2 4.02Å; A273-Q362 PolarHBondContact O-NE2 3.39Å; A273-L365 HydrophobicContact CB-CD1 3.5Å; A273-L384 HydrophobicContact CB-CD1 3.97Å; A273-L384 HydrophobicContact CB-CD2 4.13Å
274	F	88.4	Confident	65	Low	70 Å²	70	83.9 Å²	83.9	31%	0.307	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	153.7	176.5	66.4	-83.7	0	0	0	111.9	H272 S276 I293 T294 I296 N358	H272-F274 AromaticContact CE1-CD1 3.54Å; H272-F274 AromaticContact ND1-CD1 3.82Å; F274-S276 PolarHBondContact O-N 3.27Å; F274-I293 CarbonylContact O-C 3.43Å; F274-I293 WeakPolarHBondContact O-CA 3.29Å; F274-T294 HydrophobicContact CE1-CG2 4.16Å; F274-T294 HydrophobicContact CZ-CG2 4.18Å; F274-T294 PolarHBondContact N-O 2.89Å; F274-T294 PolarHBondContact O-N 3.49Å; F274-I296 HydrophobicContact CE1-CD1 4.19Å; F274-N358 WeakPolarHBondContact CA-OD1 3.49Å; F274-N358 VanDerWaalsContact CB-OD1 3.32Å; F274-N358 WeakPolarHBondContact CB-OD1 3.37Å
275	I	90.4	Very high	66.2	Low	9 Å²	9	81.2 Å²	81.2	5%	0.046	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	106.5	178.7	-52.3	-178.5	0	0	0	108.9	Y291 A292 I293 F316 K354 L357 N358 L361	I275-Y291 HydrophobicContact CD1-CD1 4.32Å; I275-Y291 HydrophobicContact CG2-CD1 4.09Å; I275-A292 CarbonylContact C-O 3.54Å; I275-A292 WeakPolarHBondContact CA-O 3.27Å; I275-I293 HydrophobicContact CG1-CG1 4.38Å; I275-F316 HydrophobicContact CD1-CZ 4.13Å; I275-K354 HydrophobicContact CB-CG 4.25Å; I275-K354 HydrophobicContact CG2-CG 3.86Å; I275-K354 VanDerWaalsContact O-CE 3.26Å; I275-K354 WeakPolarHBondContact O-CE 3.44Å; I275-L357 HydrophobicContact CD1-CB 3.43Å; I275-L357 VanDerWaalsContact CD1-CB 3.43Å; I275-L357 HydrophobicContact CD1-CD1 4.46Å; I275-N358 HydrophobicContact CD1-CB 4.49Å; I275-N358 HydrophobicContact CG1-CB 4.42Å; I275-N358 PolarHBondContact N-OD1 3.17Å; I275-L361 HydrophobicContact CD1-CD1 4.28Å; I275-L361 HydrophobicContact CG1-CD1 3.83Å
276	S	85.2	Confident	67.5	Low	37 Å²	37	80.5 Å²	80.5	26%	0.259	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	-42.5	-179.6	54.3	0	0	0	0	111.9	F274 A292 T294 K354	F274-S276 PolarHBondContact O-N 3.27Å; S276-A292 PolarHBondContact N-O 3.23Å; S276-A292 PolarHBondContact OG-O 3.43Å; S276-T294 WeakPolarHBondContact CB-OG1 3.41Å; S276-T294 PolarHBondContact OG-OG1 3.11Å; S276-T294 VanDerWaalsContact OG-OG1 3.11Å; S276-K354 PolarHBondContact O-NZ 3.44Å
277	D	80.5	Confident	69.3	Low	101 Å²	101	77.6 Å²	77.6	54%	0.54	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	160.1	-169.4	-155.2	-2.3	0	0	0	113.1	A292	D277-A292 HydrophobicContact CB-CB 4.14Å; D277-A292 PolarHBondContact O-N 3.26Å
278	T	85.4	Confident	71	Confident	33 Å²	33	72.6 Å²	72.6	20%	0.202	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	118.1	179.3	53.4	0	0	0	0	111	L290 Y291 K354	T278-L290 CarbonylContact C-O 3.24Å; T278-L290 WeakPolarHBondContact CA-O 3.27Å; T278-Y291 HydrophobicContact CG2-CD1 3.44Å; T278-Y291 VanDerWaalsContact CG2-CD1 3.44Å; T278-Y291 HydrophobicContact CG2-CE1 3.6Å; T278-Y291 HydrophobicContact CG2-CG 4.47Å; T278-K354 HydrophobicContact CG2-CB 4.01Å; T278-K354 HydrophobicContact CG2-CD 3.85Å; T278-K354 HydrophobicContact CG2-CG 3.87Å
279	G	76.2	Confident	72.7	Confident	35 Å²	35	68.1 Å²	68.1	36%	0.361	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	156.6	175.5	0	0	0	0	0	112.1	A289 L290	G279-A289 CarbonylContact O-C 3.4Å; G279-A289 WeakPolarHBondContact O-CA 3.15Å; G279-L290 PolarHBondContact N-O 3.1Å; G279-L290 PolarHBondContact O-N 3.33Å
280	V	77.9	Confident	74.2	Confident	83 Å²	83	67.2 Å²	67.2	50%	0.503	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	122.9	168.6	-178.5	0	0	0	0	107.9	T287 M345 L350	V280-T287 HydrophobicContact CG1-CG2 4.38Å; V280-M345 HydrophobicContact CG1-SD 4.09Å; V280-M345 HydrophobicContact CG2-SD 4.38Å; V280-L350 HydrophobicContact CG2-CD1 4.24Å
281	C	67.7	Low	75.4	Confident	51 Å²	51	61.7 Å²	61.7	35%	0.345	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	147.7	176.2	-72	0	0	0	0	110.4	T287 Y288 L290	C281-T287 CarbonylContact O-C 3.49Å; C281-T287 WeakPolarHBondContact O-CA 3.49Å; C281-Y288 HydrophobicContact CB-CD2 4.27Å; C281-Y288 HydrophobicContact CB-CE2 3.72Å; C281-Y288 PolarHBondContact N-O 2.84Å; C281-Y288 PolarHBondContact O-N 3.28Å; C281-L290 HydrophobicContact CB-CD1 3.94Å; C281-L290 VanDerWaalsContact SG-CD1 3.54Å
282	N	68.8	Low	76	Confident	114 Å²	114	61.3 Å²	61.3	61%	0.61	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.8	114.8	177.1	-160.5	2.3	0	0	0	108	K286 T287	N282-K286 PolarHBondContact OD1-N 3.32Å; N282-K286 PolarHBondContact OD1-O 3.46Å; N282-T287 HydrophobicContact CB-CG2 3.84Å
283	D	50.8	Low	76.5	Confident	76 Å²	76	57.5 Å²	57.5	41%	0.406	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	130.1	-179.6	-174.7	29.1	0	0	0	109.1	G285 K286 Y288	D283-G285 PolarHBondContact O-N 2.88Å; D283-K286 PolarHBondContact N-O 3.09Å; D283-K286 VanDerWaalsContact N-O 3.11Å; D283-K286 PolarHBondContact O-N 3.01Å; D283-Y288 HydrophobicContact CB-CE1 3.81Å
284	H	45.4	Very low	76.6	Confident	180 Å²	180	58 Å²	58	83%	0.833	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.9	39.8	-177.4	-60.6	-64.6	0	0	0	115.1	K286	H284-K286 VanDerWaalsContact C-N 3.31Å; H284-K286 PolarHBondContact O-N 3.34Å
285	G	51.2	Low	76.7	Confident	71 Å²	71	54.7 Å²	54.7	73%	0.732	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.2	8.5	179.3	0	0	0	0	0	115.2	D283	D283-G285 PolarHBondContact O-N 2.88Å
286	K	59.5	Low	76.5	Confident	161 Å²	161	56.4 Å²	56.4	70%	0.7	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.2	116.6	174.5	-67.5	179.3	-178.1	172.1	0	110.2	N282 D283 H284	N282-K286 PolarHBondContact OD1-N 3.32Å; N282-K286 PolarHBondContact OD1-O 3.46Å; D283-K286 PolarHBondContact N-O 3.09Å; D283-K286 VanDerWaalsContact N-O 3.11Å; D283-K286 PolarHBondContact O-N 3.01Å; H284-K286 VanDerWaalsContact C-N 3.31Å; H284-K286 PolarHBondContact O-N 3.34Å
287	T	70.8	Confident	76.5	Confident	80 Å²	80	58.3 Å²	58.3	49%	0.491	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	131.3	171.8	26.5	0	0	0	0	111.6	V280 C281 N282	V280-T287 HydrophobicContact CG1-CG2 4.38Å; C281-T287 CarbonylContact O-C 3.49Å; C281-T287 WeakPolarHBondContact O-CA 3.49Å; N282-T287 HydrophobicContact CB-CG2 3.84Å
288	Y	78.3	Confident	76.4	Confident	52 Å²	52	59 Å²	59	20%	0.204	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	151.8	174.5	54.5	-102.7	0	0	0	112.3	C281 D283 L290 R312	C281-Y288 HydrophobicContact CB-CD2 4.27Å; C281-Y288 HydrophobicContact CB-CE2 3.72Å; C281-Y288 PolarHBondContact N-O 2.84Å; C281-Y288 PolarHBondContact O-N 3.28Å; D283-Y288 HydrophobicContact CB-CE1 3.81Å; Y288-L290 HydrophobicContact CD2-CD1 4.42Å; Y288-L290 HydrophobicContact CD2-CG 4.04Å; Y288-L290 HydrophobicContact CE2-CD1 3.74Å; Y288-L290 HydrophobicContact CE2-CD2 4.45Å; Y288-L290 HydrophobicContact CE2-CG 3.79Å; Y288-R312 HydrophobicContact CD2-CG 3.82Å; Y288-R312 VanDerWaalsContact CE1-NH1 3.33Å; Y288-R312 HydrophobicContact CE2-CG 4.1Å
289	A	81.2	Confident	76	Confident	10 Å²	10	58.6 Å²	58.6	8%	0.083	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	134.7	171.8	0	0	0	0	0	111.1	G279 Y291 L350	G279-A289 CarbonylContact O-C 3.4Å; G279-A289 WeakPolarHBondContact O-CA 3.15Å; A289-Y291 HydrophobicContact CB-CE2 4.36Å; A289-L350 HydrophobicContact CB-CD1 4.48Å; A289-L350 HydrophobicContact CB-CD2 3.58Å
290	L	85.9	Confident	75.5	Confident	36 Å²	36	62.2 Å²	62.2	19%	0.188	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	133.4	172.1	-88.5	166.6	0	0	0	109.6	T278 G279 C281 Y288 R312	T278-L290 CarbonylContact C-O 3.24Å; T278-L290 WeakPolarHBondContact CA-O 3.27Å; G279-L290 PolarHBondContact N-O 3.1Å; G279-L290 PolarHBondContact O-N 3.33Å; C281-L290 HydrophobicContact CB-CD1 3.94Å; C281-L290 VanDerWaalsContact SG-CD1 3.54Å; Y288-L290 HydrophobicContact CD2-CD1 4.42Å; Y288-L290 HydrophobicContact CD2-CG 4.04Å; Y288-L290 HydrophobicContact CE2-CD1 3.74Å; Y288-L290 HydrophobicContact CE2-CD2 4.45Å; Y288-L290 HydrophobicContact CE2-CG 3.79Å; L290-R312 HydrophobicContact CD2-CG 3.42Å; L290-R312 VanDerWaalsContact CD2-CG 3.42Å; L290-R312 HydrophobicContact CG-CG 3.98Å
291	Y	90.4	Very high	75.3	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	120.8	177.3	-60	-87.9	0	0	0	108.3	I275 T278 A289 R311 F316 R353 K354 L357	I275-Y291 HydrophobicContact CD1-CD1 4.32Å; I275-Y291 HydrophobicContact CG2-CD1 4.09Å; T278-Y291 HydrophobicContact CG2-CD1 3.44Å; T278-Y291 VanDerWaalsContact CG2-CD1 3.44Å; T278-Y291 HydrophobicContact CG2-CE1 3.6Å; T278-Y291 HydrophobicContact CG2-CG 4.47Å; A289-Y291 HydrophobicContact CB-CE2 4.36Å; Y291-R311 WeakPolarHBondContact CB-O 3.2Å; Y291-R311 WeakPolarHBondContact CD2-O 3.24Å; Y291-R311 PolarHBondContact N-O 3.36Å; Y291-R311 PolarHBondContact O-N 3.5Å; Y291-F316 HydrophobicContact CD2-CE2 4.42Å; Y291-R353 WeakPolarHBondContact OH-CD 3.2Å; Y291-K354 HydrophobicContact CE1-CB 4.33Å; Y291-L357 HydrophobicContact CD1-CD1 4.09Å; Y291-L357 HydrophobicContact CD2-CD1 3.97Å; Y291-L357 HydrophobicContact CE1-CD1 3.93Å; Y291-L357 HydrophobicContact CE2-CD1 3.78Å; Y291-L357 HydrophobicContact CG-CD1 4.15Å
292	A	90.2	Very high	75.2	Confident	9 Å²	9	64.5 Å²	64.5	7%	0.074	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	112.7	173.3	0	0	0	0	0	108.9	I275 S276 D277 Y310	I275-A292 CarbonylContact C-O 3.54Å; I275-A292 WeakPolarHBondContact CA-O 3.27Å; S276-A292 PolarHBondContact N-O 3.23Å; S276-A292 PolarHBondContact OG-O 3.43Å; D277-A292 HydrophobicContact CB-CB 4.14Å; D277-A292 PolarHBondContact O-N 3.26Å; A292-Y310 HydrophobicContact CB-CD1 4.03Å; A292-Y310 HydrophobicContact CB-CE1 3.85Å
293	I	93.3	Very high	75.5	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	118.8	179.4	-48.3	174.7	0	0	0	107.6	A273 F274 I275 V295 K308 T309 R311 F316 L361 F383 L384	A273-I293 HydrophobicContact CB-CG2 4Å; F274-I293 CarbonylContact O-C 3.43Å; F274-I293 WeakPolarHBondContact O-CA 3.29Å; I275-I293 HydrophobicContact CG1-CG1 4.38Å; I293-V295 HydrophobicContact CG2-CG2 4.16Å; I293-K308 CarbonylContact O-C 3.59Å; I293-K308 VanDerWaalsContact O-CA 3.3Å; I293-K308 WeakPolarHBondContact O-CA 3.5Å; I293-T309 HydrophobicContact CB-CG2 3.88Å; I293-T309 HydrophobicContact CD1-CG2 4.28Å; I293-T309 HydrophobicContact CG1-CG2 4.47Å; I293-T309 PolarHBondContact N-O 3.47Å; I293-T309 PolarHBondContact O-N 3.06Å; I293-R311 HydrophobicContact CD1-CB 3.98Å; I293-R311 HydrophobicContact CD1-CG 3.59Å; I293-F316 HydrophobicContact CD1-CE1 4.26Å; I293-F316 HydrophobicContact CD1-CE2 4.11Å; I293-F316 HydrophobicContact CD1-CZ 3.49Å; I293-F316 VanDerWaalsContact CD1-CZ 3.49Å; I293-F316 HydrophobicContact CG1-CZ 4.21Å; I293-L361 HydrophobicContact CD1-CD1 4.24Å; I293-L361 HydrophobicContact CG1-CD1 4.45Å; I293-L361 HydrophobicContact CG2-CD1 3.95Å; I293-F383 HydrophobicContact CD1-CE1 4.14Å; I293-L384 HydrophobicContact CD1-CD2 4.38Å; I293-L384 HydrophobicContact CG2-CD2 4.03Å
294	T	90.3	Very high	77	Confident	11 Å²	11	62.7 Å²	62.7	7%	0.067	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	125.9	170	-57.1	0	0	0	0	108.2	A273 F274 S276 I296	A273-T294 CarbonylContact C-O 3.58Å; A273-T294 VanDerWaalsContact CA-O 3.24Å; A273-T294 WeakPolarHBondContact CA-O 3.42Å; F274-T294 HydrophobicContact CE1-CG2 4.16Å; F274-T294 HydrophobicContact CZ-CG2 4.18Å; F274-T294 PolarHBondContact N-O 2.89Å; F274-T294 PolarHBondContact O-N 3.49Å; S276-T294 WeakPolarHBondContact CB-OG1 3.41Å; S276-T294 PolarHBondContact OG-OG1 3.11Å; S276-T294 VanDerWaalsContact OG-OG1 3.11Å; T294-I296 HydrophobicContact CG2-CG1 4.5Å
295	V	90.6	Very high	78.8	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	128.1	-179.4	-171.7	0	0	0	0	108.1	L271 A273 I293 C306 W307 T309 L384	L271-V295 HydrophobicContact CD1-CG1 3.8Å; L271-V295 HydrophobicContact CD2-CG1 4.3Å; L271-V295 HydrophobicContact CG-CG1 4Å; A273-V295 HydrophobicContact CB-CB 4.44Å; A273-V295 HydrophobicContact CB-CG1 4.35Å; A273-V295 HydrophobicContact CB-CG2 4.02Å; I293-V295 HydrophobicContact CG2-CG2 4.16Å; V295-C306 WeakPolarHBondContact O-CA 3.33Å; V295-W307 HydrophobicContact CB-CD2 4.04Å; V295-W307 HydrophobicContact CB-CH2 4.32Å; V295-W307 HydrophobicContact CB-CZ2 3.79Å; V295-W307 HydrophobicContact CG1-CD2 4.45Å; V295-W307 HydrophobicContact CG1-CH2 3.68Å; V295-W307 HydrophobicContact CG1-CZ2 3.38Å; V295-W307 HydrophobicContact CG1-CZ3 4.31Å; V295-W307 HydrophobicContact CG2-CZ2 4.43Å; V295-W307 PolarHBondContact N-O 3.15Å; V295-W307 PolarHBondContact O-N 3.04Å; V295-T309 HydrophobicContact CG2-CG2 4.33Å; V295-L384 HydrophobicContact CG1-CB 4.5Å; V295-L384 HydrophobicContact CG1-CD1 4.49Å; V295-L384 HydrophobicContact CG2-CB 4.07Å; V295-L384 HydrophobicContact CG2-CD2 4.06Å; V295-L384 HydrophobicContact CG2-CG 4.47Å
296	I	87.6	Confident	80.4	Confident	44 Å²	44	58.4 Å²	58.4	23%	0.226	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	120.9	178.3	-56.8	169.4	0	0	0	106.8	H272 F274 T294 E304 D305 C306	H272-I296 PolarHBondContact N-O 3.12Å; H272-I296 PolarHBondContact O-N 3.49Å; F274-I296 HydrophobicContact CE1-CD1 4.19Å; T294-I296 HydrophobicContact CG2-CG1 4.5Å; I296-E304 HydrophobicContact CG2-CB 4.41Å; I296-D305 CarbonylContact C-O 3.6Å; I296-D305 WeakPolarHBondContact CA-O 3.39Å; I296-C306 HydrophobicContact CG1-CB 4.49Å
297	R	84.6	Confident	81.9	Confident	77 Å²	77	53.5 Å²	53.5	29%	0.291	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	122.9	174.4	-178	-171.6	179.1	-168.4	-1.8	108.4	L271 N299 E304 D305 W307	L271-R297 HydrophobicContact CD1-CB 3.67Å; L271-R297 HydrophobicContact CD1-CG 3.98Å; R297-N299 PolarHBondContact NE-OD1 3.14Å; R297-E304 CarbonylContact O-C 3.57Å; R297-E304 WeakPolarHBondContact O-CA 3.49Å; R297-D305 HydrophobicContact CB-CB 4.3Å; R297-D305 PolarHBondContact N-O 3.33Å; R297-D305 PolarHBondContact O-N 3.49Å; R297-W307 HydrophobicContact CB-CH2 4.02Å; R297-W307 HydrophobicContact CB-CZ3 3.8Å
298	R	79.3	Confident	82.6	Confident	115 Å²	115	55 Å²	55	43%	0.434	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	120.1	169.1	-171.4	173.2	-72.3	145.8	-8.1	109.3	Q270 E304	Q270-R298 PolarHBondContact O-N 2.97Å; R298-E304 HydrophobicContact CG-CG 4.44Å; R298-E304 IonicContact CZ-OE1 3.12Å; R298-E304 IonicContact NE-OE1 3.96Å; R298-E304 PolarHBondContact NE-OE1 3.4Å; R298-E304 VanDerWaalsContact NE-OE1 3.11Å; R298-E304 IonicContact NH2-OE1 3.41Å; R298-E304 PolarHBondContact NH2-OE1 3.4Å
299	N	75.8	Confident	83.1	Confident	25 Å²	25	52.5 Å²	52.5	13%	0.134	29%	0.285	C	S	.	.			trans	-83.3	158.6	177.3	-68.8	-38.4	0	0	0	110.5	R297 D301 G302 S303 D305	R297-N299 PolarHBondContact NE-OD1 3.14Å; N299-D301 WeakPolarHBondContact CB-OD1 3.38Å; N299-D301 PolarHBondContact O-N 2.87Å; N299-D301 VanDerWaalsContact O-N 3.15Å; N299-G302 PolarHBondContact O-N 2.68Å; N299-S303 WeakPolarHBondContact CB-OG 3.39Å; N299-S303 PolarHBondContact N-O 2.99Å; N299-S303 PolarHBondContact ND2-OG 3.35Å; N299-S303 VanDerWaalsContact ND2-OG 3.1Å; N299-D305 PolarHBondContact ND2-OD2 3.42Å
300	P	65.8	Low	83.5	Confident	112 Å²	112	58.4 Å²	58.4	73%	0.727	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-19.6	-179.6	-22.1	33.8	0	0	0	114.2	L269 G302	L269-P300 HydrophobicContact CD2-CG 4.39Å; P300-G302 VanDerWaalsContact C-N 3.26Å
301	D	73.3	Confident	83.7	Confident	124 Å²	124	56.9 Å²	56.9	66%	0.663	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-0.2	175.9	65.1	-1.3	0	0	0	113.6	N299 S303	N299-D301 WeakPolarHBondContact CB-OD1 3.38Å; N299-D301 PolarHBondContact O-N 2.87Å; N299-D301 VanDerWaalsContact O-N 3.15Å; D301-S303 VanDerWaalsContact C-N 3.32Å; D301-S303 VanDerWaalsContact CG-OG 3.29Å; D301-S303 VanDerWaalsContact OD1-CB 3.27Å; D301-S303 WeakPolarHBondContact OD1-CB 3.33Å; D301-S303 PolarHBondContact OD1-N 3.26Å; D301-S303 PolarHBondContact OD1-OG 3.07Å; D301-S303 PolarHBondContact OD2-OG 3.44Å
302	G	66.6	Low	83.5	Confident	57 Å²	57	60.5 Å²	60.5	59%	0.588	31%	0.312	S	S	*	.	S	Bend	trans	83.6	0.2	-177.2	0	0	0	0	0	114.6	N299 P300	N299-G302 PolarHBondContact O-N 2.68Å; P300-G302 VanDerWaalsContact C-N 3.26Å
303	S	75.6	Confident	83.3	Confident	45 Å²	45	61.3 Å²	61.3	32%	0.315	31%	0.313	S	S	.	.			trans	-75.1	148.9	172.3	69.1	0	0	0	0	111.5	N299 D301	N299-S303 WeakPolarHBondContact CB-OG 3.39Å; N299-S303 PolarHBondContact N-O 2.99Å; N299-S303 PolarHBondContact ND2-OG 3.35Å; N299-S303 VanDerWaalsContact ND2-OG 3.1Å; D301-S303 VanDerWaalsContact C-N 3.32Å; D301-S303 VanDerWaalsContact CG-OG 3.29Å; D301-S303 VanDerWaalsContact OD1-CB 3.27Å; D301-S303 WeakPolarHBondContact OD1-CB 3.33Å; D301-S303 PolarHBondContact OD1-N 3.26Å; D301-S303 PolarHBondContact OD1-OG 3.07Å; D301-S303 PolarHBondContact OD2-OG 3.44Å
304	E	82.2	Confident	82.7	Confident	108 Å²	108	63.2 Å²	63.2	51%	0.505	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	114.8	177.9	-66.7	-170.9	169.8	0	0	110.6	I296 R297 R298	I296-E304 HydrophobicContact CG2-CB 4.41Å; R297-E304 CarbonylContact O-C 3.57Å; R297-E304 WeakPolarHBondContact O-CA 3.49Å; R298-E304 HydrophobicContact CG-CG 4.44Å; R298-E304 IonicContact CZ-OE1 3.12Å; R298-E304 IonicContact NE-OE1 3.96Å; R298-E304 PolarHBondContact NE-OE1 3.4Å; R298-E304 VanDerWaalsContact NE-OE1 3.11Å; R298-E304 IonicContact NH2-OE1 3.41Å; R298-E304 PolarHBondContact NH2-OE1 3.4Å
305	D	83	Confident	82.5	Confident	72 Å²	72	63.3 Å²	63.3	39%	0.385	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	125.2	171.4	-67.4	-37.9	0	0	0	109.4	I296 R297 N299 W307	I296-D305 CarbonylContact C-O 3.6Å; I296-D305 WeakPolarHBondContact CA-O 3.39Å; R297-D305 HydrophobicContact CB-CB 4.3Å; R297-D305 PolarHBondContact N-O 3.33Å; R297-D305 PolarHBondContact O-N 3.49Å; N299-D305 PolarHBondContact ND2-OD2 3.42Å; D305-W307 HydrophobicContact CB-CE3 4.33Å; D305-W307 HydrophobicContact CB-CZ3 4.09Å
306	C	85.4	Confident	82.4	Confident	89 Å²	89	63.3 Å²	63.3	60%	0.601	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.3	123.2	178.6	-177.2	0	0	0	0	110.9	V295 I296	V295-C306 WeakPolarHBondContact O-CA 3.33Å; I296-C306 HydrophobicContact CG1-CB 4.49Å
307	W	89.3	Confident	82.1	Confident	57 Å²	57	62.4 Å²	62.4	22%	0.216	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	161.6	174.1	69	93	0	0	0	112	L271 V295 R297 D305 L384 N386	L271-W307 HydrophobicContact CD1-CH2 4.05Å; V295-W307 HydrophobicContact CB-CD2 4.04Å; V295-W307 HydrophobicContact CB-CH2 4.32Å; V295-W307 HydrophobicContact CB-CZ2 3.79Å; V295-W307 HydrophobicContact CG1-CD2 4.45Å; V295-W307 HydrophobicContact CG1-CH2 3.68Å; V295-W307 HydrophobicContact CG1-CZ2 3.38Å; V295-W307 HydrophobicContact CG1-CZ3 4.31Å; V295-W307 HydrophobicContact CG2-CZ2 4.43Å; V295-W307 PolarHBondContact N-O 3.15Å; V295-W307 PolarHBondContact O-N 3.04Å; R297-W307 HydrophobicContact CB-CH2 4.02Å; R297-W307 HydrophobicContact CB-CZ3 3.8Å; D305-W307 HydrophobicContact CB-CE3 4.33Å; D305-W307 HydrophobicContact CB-CZ3 4.09Å; W307-L384 PolarHBondContact NE1-O 3.27Å; W307-N386 HydrophobicContact CG-CB 4.48Å
308	K	86.1	Confident	81.9	Confident	111 Å²	111	59.4 Å²	59.4	48%	0.483	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	135.7	173.5	-69.3	-177.2	178.9	178.6	0	110.1	I293 N386	I293-K308 CarbonylContact O-C 3.59Å; I293-K308 VanDerWaalsContact O-CA 3.3Å; I293-K308 WeakPolarHBondContact O-CA 3.5Å; K308-N386 PolarHBondContact O-OD1 2.94Å
309	T	89.9	Confident	82.2	Confident	1 Å²	1	54 Å²	54	1%	0.006	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	151	171.4	-165.8	0	0	0	0	110.2	I293 V295 R311 L384 E385	I293-T309 HydrophobicContact CB-CG2 3.88Å; I293-T309 HydrophobicContact CD1-CG2 4.28Å; I293-T309 HydrophobicContact CG1-CG2 4.47Å; I293-T309 PolarHBondContact N-O 3.47Å; I293-T309 PolarHBondContact O-N 3.06Å; V295-T309 HydrophobicContact CG2-CG2 4.33Å; T309-R311 PolarHBondContact OG1-NH1 3.44Å; T309-R311 PolarHBondContact OG1-NH2 3.15Å; T309-L384 WeakPolarHBondContact CG2-O 3.41Å; T309-E385 PolarHBondContact OG1-O 2.99Å
310	Y	88.7	Confident	82.6	Confident	134 Å²	134	53.9 Å²	53.9	53%	0.525	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	126.3	-174.2	-59.9	-87.7	0	0	0	110.3	A292	A292-Y310 HydrophobicContact CB-CD1 4.03Å; A292-Y310 HydrophobicContact CB-CE1 3.85Å
311	R	89.3	Confident	83.2	Confident	4 Å²	4	49.9 Å²	49.9	2%	0.015	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	138.8	-179	-62.1	-65.7	175.8	-106	4.7	110.8	Y291 I293 T309 D315 F316 F383 E385 K387	Y291-R311 WeakPolarHBondContact CB-O 3.2Å; Y291-R311 WeakPolarHBondContact CD2-O 3.24Å; Y291-R311 PolarHBondContact N-O 3.36Å; Y291-R311 PolarHBondContact O-N 3.5Å; I293-R311 HydrophobicContact CD1-CB 3.98Å; I293-R311 HydrophobicContact CD1-CG 3.59Å; T309-R311 PolarHBondContact OG1-NH1 3.44Å; T309-R311 PolarHBondContact OG1-NH2 3.15Å; R311-D315 HydrophobicContact CB-CB 4.49Å; R311-F316 HydrophobicContact CB-CD2 3.99Å; R311-F316 HydrophobicContact CB-CE2 3.57Å; R311-F316 HydrophobicContact CB-CZ 4.33Å; R311-F316 HydrophobicContact CG-CE2 4.5Å; R311-F383 HydrophobicContact CB-CZ 4.09Å; R311-F383 HydrophobicContact CG-CE1 4.12Å; R311-F383 HydrophobicContact CG-CE2 4.06Å; R311-F383 HydrophobicContact CG-CZ 3.65Å; R311-F383 PolarHBondContact NE-O 2.82Å; R311-F383 PolarHBondContact NH2-O 3.38Å; R311-E385 PolarHBondContact NH2-O 3.33Å; R311-K387 PolarHBondContact NH1-O 2.94Å; R311-K387 PolarHBondContact NH2-O 3.43Å
312	R	87.8	Confident	83.4	Confident	76 Å²	76	46.6 Å²	46.6	29%	0.287	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	160.1	168.4	-59.7	-176.6	-66.5	-170.3	-9.5	109.3	Y288 L290 S314 D315 F316	Y288-R312 HydrophobicContact CD2-CG 3.82Å; Y288-R312 VanDerWaalsContact CE1-NH1 3.33Å; Y288-R312 HydrophobicContact CE2-CG 4.1Å; L290-R312 HydrophobicContact CD2-CG 3.42Å; L290-R312 VanDerWaalsContact CD2-CG 3.42Å; L290-R312 HydrophobicContact CG-CG 3.98Å; R312-S314 PolarHBondContact O-N 3.46Å; R312-S314 VanDerWaalsContact O-N 3.12Å; R312-D315 WeakPolarHBondContact CB-OD2 3.35Å; R312-D315 PolarHBondContact N-OD2 2.92Å; R312-D315 IonicContact NE-OD2 2.95Å; R312-D315 WeakPolarHBondContact O-CA 3.32Å; R312-D315 WeakPolarHBondContact O-CB 3.32Å; R312-D315 PolarHBondContact O-N 3.35Å; R312-F316 WeakPolarHBondContact O-CD2 3.47Å; R312-F316 PolarHBondContact O-N 3.27Å
313	Y	85.1	Confident	83.8	Confident	26 Å²	26	43.9 Å²	43.9	10%	0.102	21%	0.211	C	C	.	.	H	α-helix	trans	-53.1	-36.1	172.9	174.6	-91.7	0	0	0	112.5	D315 F316 H317 L336 P337 G338 K339 L357	Y313-D315 PolarHBondContact O-N 3.2Å; Y313-F316 PolarHBondContact O-N 3.27Å; Y313-H317 HydrophobicContact CE1-CB 4.43Å; Y313-H317 WeakPolarHBondContact O-CB 3.28Å; Y313-H317 PolarHBondContact O-N 2.84Å; Y313-L336 HydrophobicContact CE2-CD2 4.5Å; Y313-P337 HydrophobicContact CE2-CG 4.38Å; Y313-P337 VanDerWaalsContact CE2-O 3.31Å; Y313-P337 WeakPolarHBondContact CE2-O 3.48Å; Y313-P337 PolarHBondContact OH-O 2.98Å; Y313-G338 VanDerWaalsContact OH-C 3.28Å; Y313-K339 HydrophobicContact CE1-CB 3.88Å; Y313-K339 HydrophobicContact CE1-CD 4.29Å; Y313-K339 HydrophobicContact CE1-CG 3.86Å; Y313-K339 PolarHBondContact OH-N 3.2Å; Y313-L357 HydrophobicContact CD2-CD1 4.44Å; Y313-L357 HydrophobicContact CD2-CD2 4.36Å
314	S	80.1	Confident	83.8	Confident	39 Å²	39	42.4 Å²	42.4	27%	0.273	20%	0.2	S	C	.	.	H	α-helix	trans	-59.6	-32.6	175.1	57.1	0	0	0	0	113.2	R312 H317 D318	R312-S314 PolarHBondContact O-N 3.46Å; R312-S314 VanDerWaalsContact O-N 3.12Å; S314-H317 PolarHBondContact O-N 3.05Å; S314-D318 WeakPolarHBondContact O-CB 3.38Å; S314-D318 PolarHBondContact O-N 3.13Å
315	D	85.8	Confident	83.2	Confident	13 Å²	13	42.5 Å²	42.5	7%	0.07	20%	0.201	C	C	.	.	H	α-helix	trans	-79	-38	-176.3	-49	-30.4	0	0	0	109.7	R311 R312 Y313 H317 D318 F319 F383 Y389 K391	R311-D315 HydrophobicContact CB-CB 4.49Å; R312-D315 WeakPolarHBondContact CB-OD2 3.35Å; R312-D315 PolarHBondContact N-OD2 2.92Å; R312-D315 IonicContact NE-OD2 2.95Å; R312-D315 WeakPolarHBondContact O-CA 3.32Å; R312-D315 WeakPolarHBondContact O-CB 3.32Å; R312-D315 PolarHBondContact O-N 3.35Å; Y313-D315 PolarHBondContact O-N 3.2Å; D315-H317 VanDerWaalsContact C-N 3.29Å; D315-H317 PolarHBondContact O-N 3.05Å; D315-D318 PolarHBondContact O-N 3.29Å; D315-F319 VanDerWaalsContact O-CB 3.26Å; D315-F319 WeakPolarHBondContact O-CB 3Å; D315-F319 PolarHBondContact O-N 3.12Å; D315-F383 HydrophobicContact CB-CE2 4.35Å; D315-F383 WeakPolarHBondContact O-CE2 3.27Å; D315-Y389 HydrophobicContact CB-CD1 3.89Å; D315-Y389 HydrophobicContact CB-CG 4.48Å; D315-K391 WeakPolarHBondContact OD1-CE 3.49Å; D315-K391 IonicContact OD1-NZ 2.74Å; D315-K391 PolarHBondContact OD1-NZ 2.71Å; D315-K391 VanDerWaalsContact OD1-NZ 3.1Å
316	F	88.4	Confident	82.3	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-59.7	-39	167.8	-78.8	-88.5	0	0	0	112.4	I275 Y291 I293 R311 R312 Y313 H320 L336 L357 Y360 L361 F383	I275-F316 HydrophobicContact CD1-CZ 4.13Å; Y291-F316 HydrophobicContact CD2-CE2 4.42Å; I293-F316 HydrophobicContact CD1-CE1 4.26Å; I293-F316 HydrophobicContact CD1-CE2 4.11Å; I293-F316 HydrophobicContact CD1-CZ 3.49Å; I293-F316 VanDerWaalsContact CD1-CZ 3.49Å; I293-F316 HydrophobicContact CG1-CZ 4.21Å; R311-F316 HydrophobicContact CB-CD2 3.99Å; R311-F316 HydrophobicContact CB-CE2 3.57Å; R311-F316 HydrophobicContact CB-CZ 4.33Å; R311-F316 HydrophobicContact CG-CE2 4.5Å; R312-F316 WeakPolarHBondContact O-CD2 3.47Å; R312-F316 PolarHBondContact O-N 3.27Å; Y313-F316 PolarHBondContact O-N 3.27Å; F316-H320 VanDerWaalsContact O-CB 3.26Å; F316-H320 WeakPolarHBondContact O-CB 3.4Å; F316-H320 PolarHBondContact O-N 3.4Å; F316-L336 HydrophobicContact CB-CD1 4.1Å; F316-L357 HydrophobicContact CB-CD2 4.16Å; F316-L357 HydrophobicContact CD1-CD2 3.99Å; F316-L357 HydrophobicContact CD2-CD1 4.25Å; F316-L357 HydrophobicContact CD2-CD2 4.37Å; F316-L357 HydrophobicContact CE1-CD2 4.44Å; F316-L357 HydrophobicContact CE2-CD1 4.24Å; F316-L357 HydrophobicContact CG-CD2 3.94Å; F316-Y360 HydrophobicContact CD1-CD1 4.2Å; F316-Y360 HydrophobicContact CD1-CE1 4.24Å; F316-L361 HydrophobicContact CE1-CD1 4.06Å; F316-L361 HydrophobicContact CE1-CD2 3.93Å; F316-L361 HydrophobicContact CE1-CG 3.95Å; F316-L361 HydrophobicContact CZ-CD1 4.23Å; F316-F383 HydrophobicContact CB-CZ 4.47Å; F316-F383 AromaticContact CD1-CE1 3.96Å; F316-F383 HydrophobicContact CD1-CE1 3.96Å; F316-F383 AromaticContact CD1-CZ 3.71Å; F316-F383 HydrophobicContact CD1-CZ 3.71Å; F316-F383 HydrophobicContact CD2-CZ 4.09Å; F316-F383 AromaticContact CE1-CE1 3.81Å; F316-F383 HydrophobicContact CE1-CE1 3.81Å; F316-F383 AromaticContact CE1-CZ 3.91Å; F316-F383 HydrophobicContact CE1-CZ 3.91Å; F316-F383 HydrophobicContact CE2-CZ 4.27Å; F316-F383 AromaticContact CG-CZ 3.82Å; F316-F383 HydrophobicContact CG-CZ 3.82Å; F316-F383 HydrophobicContact CZ-CE1 4.24Å; F316-F383 HydrophobicContact CZ-CZ 4.2Å
317	H	83	Confident	81.6	Confident	25 Å²	25	42 Å²	42	12%	0.116	19%	0.187	C	C	.	.	H	α-helix	trans	-70	-45.9	177.9	179.7	67.5	0	0	0	112.5	Y313 S314 D315 F319 H320 M321 L336 D401	Y313-H317 HydrophobicContact CE1-CB 4.43Å; Y313-H317 WeakPolarHBondContact O-CB 3.28Å; Y313-H317 PolarHBondContact O-N 2.84Å; S314-H317 PolarHBondContact O-N 3.05Å; D315-H317 VanDerWaalsContact C-N 3.29Å; D315-H317 PolarHBondContact O-N 3.05Å; H317-F319 VanDerWaalsContact C-N 3.28Å; H317-F319 PolarHBondContact O-N 3.46Å; H317-H320 PolarHBondContact O-N 3.28Å; H317-M321 WeakPolarHBondContact O-CG 3.42Å; H317-M321 PolarHBondContact O-N 2.82Å; H317-L336 HydrophobicContact CB-CD2 3.83Å; H317-D401 IonicContact CE1-OD2 3.71Å; H317-D401 PolarHBondContact CE1-OD2 3.5Å; H317-D401 IonicContact NE2-OD2 2.71Å; H317-D401 PolarHBondContact NE2-OD2 2.92Å
318	D	79.1	Confident	80.2	Confident	15 Å²	15	47 Å²	47	8%	0.08	21%	0.212	C	C	.	.	H	α-helix	trans	-59.6	-41.6	175.2	-70.9	-22.3	0	0	0	110.6	S314 D315 R322 Y389 K391 R398	S314-D318 WeakPolarHBondContact O-CB 3.38Å; S314-D318 PolarHBondContact O-N 3.13Å; D315-D318 PolarHBondContact O-N 3.29Å; D318-R322 PolarHBondContact O-N 3.27Å; D318-R322 VanDerWaalsContact O-N 3.13Å; D318-Y389 HydrophobicContact CB-CE1 4.21Å; D318-K391 WeakPolarHBondContact OD2-CD 3.4Å; D318-K391 WeakPolarHBondContact OD2-CE 3.34Å; D318-K391 IonicContact OD2-NZ 3.29Å; D318-K391 PolarHBondContact OD2-NZ 3.07Å; D318-R398 WeakPolarHBondContact OD1-CD 3.45Å; D318-R398 WeakPolarHBondContact OD1-CG 3.41Å; D318-R398 IonicContact OD1-NE 3.87Å; D318-R398 PolarHBondContact OD1-NE 3.35Å; D318-R398 VanDerWaalsContact OD1-NE 3.12Å; D318-R398 IonicContact OD2-NE 3.91Å
319	F	85.7	Confident	78.9	Confident	2 Å²	2	48.1 Å²	48.1	1%	0.009	22%	0.224	C	C	.	.	H	α-helix	trans	-64.2	-47.6	174.9	176.8	-113.7	0	0	0	112.6	D315 H317 M321 R322 I323 L364 Y379 V380 F383	D315-F319 VanDerWaalsContact O-CB 3.26Å; D315-F319 WeakPolarHBondContact O-CB 3Å; D315-F319 PolarHBondContact O-N 3.12Å; H317-F319 VanDerWaalsContact C-N 3.28Å; H317-F319 PolarHBondContact O-N 3.46Å; F319-M321 VanDerWaalsContact C-N 3.35Å; F319-M321 PolarHBondContact O-N 3.21Å; F319-R322 WeakPolarHBondContact O-CB 3.49Å; F319-R322 PolarHBondContact O-N 3.44Å; F319-I323 HydrophobicContact CD1-CD1 4.42Å; F319-I323 HydrophobicContact CD2-CG2 4.17Å; F319-I323 HydrophobicContact CE1-CD1 3.96Å; F319-I323 HydrophobicContact CE1-CG2 4.45Å; F319-I323 HydrophobicContact CE2-CG2 3.66Å; F319-I323 HydrophobicContact CZ-CD1 4.24Å; F319-I323 HydrophobicContact CZ-CG2 3.83Å; F319-I323 PolarHBondContact O-N 3.19Å; F319-L364 HydrophobicContact CE1-CD1 3.73Å; F319-Y379 VanDerWaalsContact CE2-O 3.26Å; F319-Y379 WeakPolarHBondContact CE2-O 3.04Å; F319-V380 HydrophobicContact CZ-CG2 3.99Å; F319-F383 HydrophobicContact CB-CD2 3.59Å; F319-F383 HydrophobicContact CB-CE2 3.74Å; F319-F383 HydrophobicContact CB-CG 4.28Å; F319-F383 HydrophobicContact CD1-CB 4.47Å; F319-F383 HydrophobicContact CD1-CD1 4.18Å; F319-F383 HydrophobicContact CD1-CD2 4.15Å; F319-F383 HydrophobicContact CD1-CE1 4.49Å; F319-F383 HydrophobicContact CD1-CE2 4.46Å; F319-F383 AromaticContact CD1-CG 3.99Å; F319-F383 HydrophobicContact CD1-CG 3.99Å; F319-F383 HydrophobicContact CD2-CB 3.74Å; F319-F383 AromaticContact CD2-CD2 3.95Å; F319-F383 HydrophobicContact CD2-CD2 3.95Å; F319-F383 AromaticContact CD2-CG 3.94Å; F319-F383 HydrophobicContact CD2-CG 3.94Å; F319-F383 HydrophobicContact CE1-CB 4.45Å; F319-F383 HydrophobicContact CE1-CD1 4.35Å; F319-F383 HydrophobicContact CE1-CG 4.31Å; F319-F383 HydrophobicContact CE2-CB 3.72Å; F319-F383 HydrophobicContact CE2-CG 4.26Å; F319-F383 HydrophobicContact CG-CB 4.13Å; F319-F383 HydrophobicContact CG-CD1 4.43Å; F319-F383 AromaticContact CG-CD2 3.62Å; F319-F383 HydrophobicContact CG-CD2 3.62Å; F319-F383 HydrophobicContact CG-CE2 4.12Å; F319-F383 AromaticContact CG-CG 3.79Å; F319-F383 HydrophobicContact CG-CG 3.79Å; F319-F383 HydrophobicContact CZ-CB 4.1Å; F319-F383 HydrophobicContact CZ-CG 4.44Å
320	H	84.1	Confident	77.6	Confident	22 Å²	22	48.2 Å²	48.2	10%	0.102	22%	0.224	C	C	.	.	H	α-helix	trans	-59.5	-43	178.9	-179.7	61.8	0	0	0	112.5	F316 H317 I323 T324 L334 L336 Y360	F316-H320 VanDerWaalsContact O-CB 3.26Å; F316-H320 WeakPolarHBondContact O-CB 3.4Å; F316-H320 PolarHBondContact O-N 3.4Å; H317-H320 PolarHBondContact O-N 3.28Å; H320-I323 VanDerWaalsContact O-CG1 3.31Å; H320-I323 WeakPolarHBondContact O-CG1 3.46Å; H320-I323 PolarHBondContact O-N 3.01Å; H320-T324 WeakPolarHBondContact O-CB 3.47Å; H320-T324 WeakPolarHBondContact O-CG2 3.34Å; H320-T324 PolarHBondContact O-N 2.85Å; H320-T324 PolarHBondContact O-OG1 3.45Å; H320-L334 PolarHBondContact CE1-O 3.46Å; H320-L334 VanDerWaalsContact CE1-O 3.27Å; H320-L336 HydrophobicContact CB-CB 4.38Å; H320-L336 HydrophobicContact CB-CD1 4.47Å; H320-L336 HydrophobicContact CB-CD2 3.99Å; H320-Y360 AromaticContact ND1-CE2 3.64Å; H320-Y360 AromaticContact ND1-CZ 3.86Å; H320-Y360 PolarHBondContact ND1-OH 2.87Å
321	M	78.1	Confident	76.3	Confident	28 Å²	28	45.1 Å²	45.1	14%	0.138	22%	0.219	C	C	.	.	H	α-helix	trans	-61.8	-46.6	175	-72.5	-59.9	-57.7	0	0	111.1	H317 F319 I323 T324 E325	H317-M321 WeakPolarHBondContact O-CG 3.42Å; H317-M321 PolarHBondContact O-N 2.82Å; F319-M321 VanDerWaalsContact C-N 3.35Å; F319-M321 PolarHBondContact O-N 3.21Å; M321-I323 VanDerWaalsContact C-N 3.34Å; M321-I323 PolarHBondContact O-N 3.46Å; M321-T324 PolarHBondContact O-N 3.48Å; M321-T324 PolarHBondContact O-OG1 2.8Å; M321-E325 WeakPolarHBondContact O-CB 3.38Å; M321-E325 VanDerWaalsContact O-CG 3.29Å; M321-E325 WeakPolarHBondContact O-CG 3.4Å; M321-E325 PolarHBondContact O-N 2.94Å
322	R	77.7	Confident	74.8	Confident	54 Å²	54	49.4 Å²	49.4	20%	0.204	25%	0.25	C	C	.	.	H	α-helix	trans	-58.3	-43.9	179.1	-173.9	179.9	-68.8	168.3	4.4	112.3	D318 F319 Q326 Y389 S390 G392	D318-R322 PolarHBondContact O-N 3.27Å; D318-R322 VanDerWaalsContact O-N 3.13Å; F319-R322 WeakPolarHBondContact O-CB 3.49Å; F319-R322 PolarHBondContact O-N 3.44Å; R322-Q326 VanDerWaalsContact O-CG 3.26Å; R322-Q326 WeakPolarHBondContact O-CG 3.42Å; R322-Q326 PolarHBondContact O-N 2.64Å; R322-Y389 PolarHBondContact NH1-OH 3.47Å; R322-S390 PolarHBondContact NH2-O 3.02Å; R322-G392 PolarHBondContact NH2-O 3.5Å
323	I	76.3	Confident	73.7	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-77.3	-32.6	-178.5	65.7	177.9	0	0	0	112.8	F319 H320 M321 Q326 F327 L334 Y360 L364 L376	F319-I323 HydrophobicContact CD1-CD1 4.42Å; F319-I323 HydrophobicContact CD2-CG2 4.17Å; F319-I323 HydrophobicContact CE1-CD1 3.96Å; F319-I323 HydrophobicContact CE1-CG2 4.45Å; F319-I323 HydrophobicContact CE2-CG2 3.66Å; F319-I323 HydrophobicContact CZ-CD1 4.24Å; F319-I323 HydrophobicContact CZ-CG2 3.83Å; F319-I323 PolarHBondContact O-N 3.19Å; H320-I323 VanDerWaalsContact O-CG1 3.31Å; H320-I323 WeakPolarHBondContact O-CG1 3.46Å; H320-I323 PolarHBondContact O-N 3.01Å; M321-I323 VanDerWaalsContact C-N 3.34Å; M321-I323 PolarHBondContact O-N 3.46Å; I323-Q326 PolarHBondContact O-N 3.43Å; I323-F327 HydrophobicContact CB-CD2 4.38Å; I323-F327 WeakPolarHBondContact O-CB 3.21Å; I323-F327 VanDerWaalsContact O-CD2 3.23Å; I323-F327 WeakPolarHBondContact O-CD2 3.42Å; I323-F327 PolarHBondContact O-N 3.44Å; I323-L334 HydrophobicContact CD1-CD1 3.65Å; I323-L334 HydrophobicContact CG1-CD1 4.49Å; I323-Y360 WeakPolarHBondContact CD1-OH 3.29Å; I323-L364 HydrophobicContact CD1-CD2 3.67Å; I323-L376 HydrophobicContact CB-CD1 4.07Å; I323-L376 HydrophobicContact CG2-CD1 3.85Å
324	T	74.3	Confident	73	Confident	14 Å²	14	48.7 Å²	48.7	9%	0.086	25%	0.252	C	S	.	.	H	α-helix	trans	-76.8	-27.6	178.4	50	0	0	0	0	112.9	H320 M321	H320-T324 WeakPolarHBondContact O-CB 3.47Å; H320-T324 WeakPolarHBondContact O-CG2 3.34Å; H320-T324 PolarHBondContact O-N 2.85Å; H320-T324 PolarHBondContact O-OG1 3.45Å; M321-T324 PolarHBondContact O-N 3.48Å; M321-T324 PolarHBondContact O-OG1 2.8Å
325	E	70.4	Confident	72.7	Confident	109 Å²	109	53.7 Å²	53.7	51%	0.509	27%	0.269	S	S	.	.	H	α-helix	trans	-70	-33.7	170.2	-76.1	175	-175.1	0	0	112.7	M321	M321-E325 WeakPolarHBondContact O-CB 3.38Å; M321-E325 VanDerWaalsContact O-CG 3.29Å; M321-E325 WeakPolarHBondContact O-CG 3.4Å; M321-E325 PolarHBondContact O-N 2.94Å
326	Q	63.1	Low	72.5	Confident	116 Å²	116	53.4 Å²	53.4	54%	0.542	27%	0.268	S	S	.	.	H	α-helix	trans	-87.3	-26.9	-179.9	-64.4	-61.1	-52.5	0	0	112.8	R322 I323	R322-Q326 VanDerWaalsContact O-CG 3.26Å; R322-Q326 WeakPolarHBondContact O-CG 3.42Å; R322-Q326 PolarHBondContact O-N 2.64Å; I323-Q326 PolarHBondContact O-N 3.43Å
327	F	72.1	Confident	72	Confident	35 Å²	35	54.3 Å²	54.3	15%	0.154	27%	0.274	C	S	.	.			trans	-130.2	85.7	-176.2	-52.6	-73.2	0	0	0	110.1	I323 N329 L330 T375 L376 Y379	I323-F327 HydrophobicContact CB-CD2 4.38Å; I323-F327 WeakPolarHBondContact O-CB 3.21Å; I323-F327 VanDerWaalsContact O-CD2 3.23Å; I323-F327 WeakPolarHBondContact O-CD2 3.42Å; I323-F327 PolarHBondContact O-N 3.44Å; F327-N329 PolarHBondContact O-N 3.07Å; F327-N329 VanDerWaalsContact O-N 3.14Å; F327-L330 HydrophobicContact CB-CB 4.23Å; F327-L330 HydrophobicContact CB-CD1 3.52Å; F327-L330 HydrophobicContact CB-CG 3.66Å; F327-L330 HydrophobicContact CD2-CD1 3.97Å; F327-L330 HydrophobicContact CG-CD1 3.93Å; F327-L330 WeakPolarHBondContact O-CB 3.47Å; F327-L330 PolarHBondContact O-N 2.76Å; F327-T375 WeakPolarHBondContact CE1-OG1 3.25Å; F327-L376 HydrophobicContact CD2-CD1 4.13Å; F327-L376 HydrophobicContact CE2-CB 4.46Å; F327-L376 HydrophobicContact CE2-CD1 3.99Å; F327-Y379 HydrophobicContact CE2-CD2 4.19Å; F327-Y379 HydrophobicContact CE2-CE2 4.2Å; F327-Y379 HydrophobicContact CZ-CD2 4.43Å; F327-Y379 HydrophobicContact CZ-CE2 4.17Å
328	E	58.6	Low	71.3	Confident	162 Å²	162	55.5 Å²	55.5	76%	0.757	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-56.6	-34	-175.8	-66.3	-174.9	173.1	0	0	112.5	L330 T331	E328-L330 PolarHBondContact O-N 3.23Å; E328-T331 VanDerWaalsContact O-CB 3.3Å; E328-T331 WeakPolarHBondContact O-CB 3.36Å; E328-T331 PolarHBondContact O-N 2.96Å; E328-T331 VanDerWaalsContact O-N 3.16Å; E328-T331 PolarHBondContact O-OG1 3.38Å; E328-T331 VanDerWaalsContact O-OG1 3.09Å
329	N	59.9	Low	70.6	Confident	134 Å²	134	61.3 Å²	61.3	72%	0.717	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-62.8	-24.4	177.9	-58.2	-14.5	0	0	0	113.5	F327 T331 S332	F327-N329 PolarHBondContact O-N 3.07Å; F327-N329 VanDerWaalsContact O-N 3.14Å; N329-T331 VanDerWaalsContact C-N 3.35Å; N329-S332 PolarHBondContact O-OG 2.68Å
330	L	62.4	Low	69.5	Low	4 Å²	4	65.8 Å²	65.8	2%	0.021	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-82.3	-15.2	-179.7	-60.8	-176.2	0	0	0	112.7	F327 E328 S332 I333 L334 M369 L376	F327-L330 HydrophobicContact CB-CB 4.23Å; F327-L330 HydrophobicContact CB-CD1 3.52Å; F327-L330 HydrophobicContact CB-CG 3.66Å; F327-L330 HydrophobicContact CD2-CD1 3.97Å; F327-L330 HydrophobicContact CG-CD1 3.93Å; F327-L330 WeakPolarHBondContact O-CB 3.47Å; F327-L330 PolarHBondContact O-N 2.76Å; E328-L330 PolarHBondContact O-N 3.23Å; L330-S332 VanDerWaalsContact C-N 3.31Å; L330-S332 PolarHBondContact O-N 3.24Å; L330-I333 PolarHBondContact O-N 3.23Å; L330-L334 HydrophobicContact CB-CD1 3.89Å; L330-L334 HydrophobicContact CB-CG 4.46Å; L330-L334 HydrophobicContact CD1-CD1 4.19Å; L330-L334 HydrophobicContact CG-CD1 4.5Å; L330-L334 WeakPolarHBondContact O-CB 3.38Å; L330-L334 PolarHBondContact O-N 3.24Å; L330-M369 HydrophobicContact CD2-CE 3.4Å; L330-L376 HydrophobicContact CD1-CD1 4.09Å; L330-L376 HydrophobicContact CD1-CD2 3.98Å
331	T	61.3	Low	67.5	Low	68 Å²	68	70.7 Å²	70.7	42%	0.417	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-31.3	-176.5	-52.9	0	0	0	0	112.8	E328 N329	E328-T331 VanDerWaalsContact O-CB 3.3Å; E328-T331 WeakPolarHBondContact O-CB 3.36Å; E328-T331 PolarHBondContact O-N 2.96Å; E328-T331 VanDerWaalsContact O-N 3.16Å; E328-T331 PolarHBondContact O-OG1 3.38Å; E328-T331 VanDerWaalsContact O-OG1 3.09Å; N329-T331 VanDerWaalsContact C-N 3.35Å
332	S	56.6	Low	65.6	Low	94 Å²	94	77.8 Å²	77.8	66%	0.657	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-25.1	177.7	55	0	0	0	0	113.1	N329 L330	N329-S332 PolarHBondContact O-OG 2.68Å; L330-S332 VanDerWaalsContact C-N 3.31Å; L330-S332 PolarHBondContact O-N 3.24Å
333	I	65.9	Low	64.6	Low	86 Å²	86	80.4 Å²	80.4	44%	0.441	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-47.2	-172.4	-58.9	171.5	0	0	0	111.1	L330 K335 L363 M369	L330-I333 PolarHBondContact O-N 3.23Å; I333-K335 PolarHBondContact O-N 2.88Å; I333-L363 HydrophobicContact CG2-CD2 4.04Å; I333-L363 WeakPolarHBondContact O-CD2 3.35Å; I333-M369 HydrophobicContact CG2-CE 4.15Å; I333-M369 HydrophobicContact CG2-SD 3.95Å
334	L	70.3	Confident	63.8	Low	1 Å²	1	83.4 Å²	83.4	1%	0.005	43%	0.433	C	S	.	.			trans	-85.1	114.3	-177.8	-69.3	172.9	0	0	0	110.8	H320 I323 L330 Y360 L363 L364	H320-L334 PolarHBondContact CE1-O 3.46Å; H320-L334 VanDerWaalsContact CE1-O 3.27Å; I323-L334 HydrophobicContact CD1-CD1 3.65Å; I323-L334 HydrophobicContact CG1-CD1 4.49Å; L330-L334 HydrophobicContact CB-CD1 3.89Å; L330-L334 HydrophobicContact CB-CG 4.46Å; L330-L334 HydrophobicContact CD1-CD1 4.19Å; L330-L334 HydrophobicContact CG-CD1 4.5Å; L330-L334 WeakPolarHBondContact O-CB 3.38Å; L330-L334 PolarHBondContact O-N 3.24Å; L334-Y360 HydrophobicContact CB-CE2 4.13Å; L334-Y360 HydrophobicContact CD2-CD2 4.4Å; L334-Y360 HydrophobicContact CD2-CE2 4.08Å; L334-L363 HydrophobicContact CD2-CB 4.32Å; L334-L363 HydrophobicContact CD2-CD2 4.07Å; L334-L363 HydrophobicContact CD2-CG 4.26Å; L334-L364 HydrophobicContact CD1-CD2 3.57Å; L334-L364 HydrophobicContact CD1-CG 4.49Å; L334-L364 HydrophobicContact CD2-CD2 3.71Å; L334-L364 HydrophobicContact CD2-CG 3.8Å; L334-L364 HydrophobicContact CG-CD2 4.34Å
335	K	74	Confident	63.2	Low	145 Å²	145	85.5 Å²	85.5	63%	0.63	44%	0.442	S	S	*	.			trans	-113.6	105	175.8	-66	-178	-176.8	176.3	0	110.8	I333	I333-K335 PolarHBondContact O-N 2.88Å
336	L	81.3	Confident	63.4	Low	6 Å²	6	83 Å²	83	3%	0.031	43%	0.432	C	S	.	.	P	Polyproline II helix	trans	-74.4	136.3	171.1	-166.6	77	0	0	0	110.7	Y313 F316 H317 H320 L357 Y360 R412	Y313-L336 HydrophobicContact CE2-CD2 4.5Å; F316-L336 HydrophobicContact CB-CD1 4.1Å; H317-L336 HydrophobicContact CB-CD2 3.83Å; H320-L336 HydrophobicContact CB-CB 4.38Å; H320-L336 HydrophobicContact CB-CD1 4.47Å; H320-L336 HydrophobicContact CB-CD2 3.99Å; L336-L357 HydrophobicContact CD1-CD2 3.87Å; L336-Y360 HydrophobicContact CD1-CD1 4.01Å; L336-Y360 HydrophobicContact CD1-CD2 4.18Å; L336-Y360 HydrophobicContact CD1-CE1 3.96Å; L336-Y360 HydrophobicContact CD1-CE2 4.16Å; L336-Y360 HydrophobicContact CD1-CG 4.12Å; L336-R412 PolarHBondContact O-NH1 2.77Å
337	P	78.3	Confident	63.9	Low	19 Å²	19	87.2 Å²	87.2	12%	0.123	44%	0.443	C	S	.	.	P	Polyproline II helix	trans	-59.9	146.1	175.2	21.7	-32.1	0	0	0	111.7	Y313 D356 L357	Y313-P337 HydrophobicContact CE2-CG 4.38Å; Y313-P337 VanDerWaalsContact CE2-O 3.31Å; Y313-P337 WeakPolarHBondContact CE2-O 3.48Å; Y313-P337 PolarHBondContact OH-O 2.98Å; P337-D356 HydrophobicContact CB-CB 3.83Å; P337-D356 HydrophobicContact CG-CB 3.82Å; P337-L357 HydrophobicContact CG-CD2 3.66Å; P337-L357 HydrophobicContact CG-CG 4Å
338	G	68.5	Low	63.9	Low	50 Å²	50	91.6 Å²	91.6	52%	0.515	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-70.6	155.8	-173.1	0	0	0	0	0	115.5	Y313 R353	Y313-G338 VanDerWaalsContact OH-C 3.28Å; G338-R353 PolarHBondContact O-NH2 3.41Å
339	K	64.4	Low	64.7	Low	138 Å²	138	85.6 Å²	85.6	60%	0.6	44%	0.44	S	S	*	.	P	Polyproline II helix	trans	-84.2	124.8	176.3	-163.9	176.1	-178.7	-178	0	109.8	Y313	Y313-K339 HydrophobicContact CE1-CB 3.88Å; Y313-K339 HydrophobicContact CE1-CD 4.29Å; Y313-K339 HydrophobicContact CE1-CG 3.86Å; Y313-K339 PolarHBondContact OH-N 3.2Å
340	K	61.9	Low	65.7	Low	96 Å²	96	79.9 Å²	79.9	42%	0.417	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-103.8	129.6	177.4	-165	-179.8	-178.7	-174.5	0	109.2	F342 F349	K340-F342 WeakPolarHBondContact CE-O 3.38Å; K340-F342 WeakPolarHBondContact CG-O 3.42Å; K340-F349 HydrophobicContact CB-CE1 3.96Å; K340-F349 HydrophobicContact CB-CE2 4.17Å; K340-F349 HydrophobicContact CB-CZ 3.38Å; K340-F349 HydrophobicContact CD-CD1 4.46Å; K340-F349 HydrophobicContact CD-CD2 4.07Å; K340-F349 HydrophobicContact CD-CE1 3.94Å; K340-F349 HydrophobicContact CD-CE2 3.56Å; K340-F349 HydrophobicContact CD-CG 4.47Å; K340-F349 HydrophobicContact CD-CZ 3.45Å; K340-F349 VanDerWaalsContact CD-CZ 3.45Å; K340-F349 HydrophobicContact CG-CZ 4.05Å
341	T	41.9	Very low	66.5	Low	124 Å²	124	84.2 Å²	84.2	76%	0.761	43%	0.429	S	S	*	.	S	Bend	trans	-97.2	-11.6	-171.6	48.4	0	0	0	0	114.3
342	F	37.8	Very low	67.5	Low	177 Å²	177	87.6 Å²	87.6	78%	0.776	44%	0.438	S	S	*	.	S	Bend	trans	-130.1	139.8	175.3	-100.9	-98.1	0	0	0	110.9	K340 N344	K340-F342 WeakPolarHBondContact CE-O 3.38Å; K340-F342 WeakPolarHBondContact CG-O 3.42Å; F342-N344 PolarHBondContact O-N 3.07Å
343	N	57.5	Low	68.8	Low	109 Å²	109	83.8 Å²	83.8	58%	0.583	41%	0.41	S	S	*	.	S	Bend	trans	52.4	50.2	-178.5	-156.4	23.8	0	0	0	114.4	M345	N343-M345 VanDerWaalsContact C-N 3.35Å
344	N	59.5	Low	69.7	Low	65 Å²	65	81.7 Å²	81.7	35%	0.348	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-2.4	-173.6	66.2	-6.4	0	0	0	114.7	F342 F349	F342-N344 PolarHBondContact O-N 3.07Å; N344-F349 HydrophobicContact CB-CE1 4.23Å
345	M	61.4	Low	70.4	Confident	57 Å²	57	89.3 Å²	89.3	28%	0.281	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.1	6.6	178.1	-62.6	-60.2	120.3	0	0	113	V280 N343	V280-M345 HydrophobicContact CG1-SD 4.09Å; V280-M345 HydrophobicContact CG2-SD 4.38Å; N343-M345 VanDerWaalsContact C-N 3.35Å
346	D	75	Confident	71	Confident	56 Å²	56	85.5 Å²	85.5	30%	0.299	42%	0.417	S	S	.	.			trans	-60.5	135.4	175.9	176.5	81.2	0	0	0	111.4	D348 F349 L350	D346-D348 PolarHBondContact OD2-N 3.39Å; D346-F349 HydrophobicContact CB-CB 3.82Å; D346-F349 WeakPolarHBondContact O-CB 3.38Å; D346-F349 PolarHBondContact O-N 3.07Å; D346-F349 WeakPolarHBondContact OD2-CB 2.99Å; D346-F349 PolarHBondContact OD2-N 3.01Å; D346-L350 WeakPolarHBondContact O-CG 3.37Å; D346-L350 PolarHBondContact O-N 3.31Å
347	R	72.3	Confident	71.4	Confident	206 Å²	206	85.2 Å²	85.2	78%	0.777	42%	0.415	S	S	*	.	H	α-helix	trans	-64.6	-45.2	-171.8	-173.5	-179.7	178.8	-177.4	-0.6	111.9	F349 L350 E351	R347-F349 VanDerWaalsContact C-N 3.26Å; R347-F349 PolarHBondContact O-N 3.12Å; R347-L350 PolarHBondContact O-N 3.36Å; R347-E351 PolarHBondContact O-N 3.49Å
348	D	73	Confident	71.8	Confident	127 Å²	127	86.5 Å²	86.5	68%	0.679	42%	0.421	S	S	*	.	H	α-helix	trans	-65.7	-35.6	178.9	-63.7	-24.1	0	0	0	110.8	D346 K352	D346-D348 PolarHBondContact OD2-N 3.39Å; D348-K352 WeakPolarHBondContact O-CB 3.37Å; D348-K352 PolarHBondContact O-N 3.37Å
349	F	76.1	Confident	72.6	Confident	35 Å²	35	87 Å²	87	15%	0.154	42%	0.421	C	S	.	.	H	α-helix	trans	-67.7	-41.8	174.2	-178.2	-117.2	0	0	0	113.9	K340 N344 D346 R347 K352 R353	K340-F349 HydrophobicContact CB-CE1 3.96Å; K340-F349 HydrophobicContact CB-CE2 4.17Å; K340-F349 HydrophobicContact CB-CZ 3.38Å; K340-F349 HydrophobicContact CD-CD1 4.46Å; K340-F349 HydrophobicContact CD-CD2 4.07Å; K340-F349 HydrophobicContact CD-CE1 3.94Å; K340-F349 HydrophobicContact CD-CE2 3.56Å; K340-F349 HydrophobicContact CD-CG 4.47Å; K340-F349 HydrophobicContact CD-CZ 3.45Å; K340-F349 VanDerWaalsContact CD-CZ 3.45Å; K340-F349 HydrophobicContact CG-CZ 4.05Å; N344-F349 HydrophobicContact CB-CE1 4.23Å; D346-F349 HydrophobicContact CB-CB 3.82Å; D346-F349 WeakPolarHBondContact O-CB 3.38Å; D346-F349 PolarHBondContact O-N 3.07Å; D346-F349 WeakPolarHBondContact OD2-CB 2.99Å; D346-F349 PolarHBondContact OD2-N 3.01Å; R347-F349 VanDerWaalsContact C-N 3.26Å; R347-F349 PolarHBondContact O-N 3.12Å; F349-K352 PolarHBondContact O-N 3.5Å; F349-R353 VanDerWaalsContact CE1-NH2 3.3Å; F349-R353 VanDerWaalsContact O-CB 3.31Å; F349-R353 WeakPolarHBondContact O-CB 3.21Å; F349-R353 PolarHBondContact O-N 2.93Å
350	L	79.8	Confident	73.7	Confident	14 Å²	14	80.8 Å²	80.8	7%	0.073	39%	0.393	C	S	.	.	H	α-helix	trans	-66.8	-39.1	177.3	-72.6	177.4	0	0	0	111.6	V280 A289 D346 R347 R353 K354	V280-L350 HydrophobicContact CG2-CD1 4.24Å; A289-L350 HydrophobicContact CB-CD1 4.48Å; A289-L350 HydrophobicContact CB-CD2 3.58Å; D346-L350 WeakPolarHBondContact O-CG 3.37Å; D346-L350 PolarHBondContact O-N 3.31Å; R347-L350 PolarHBondContact O-N 3.36Å; L350-R353 PolarHBondContact O-N 3.45Å; L350-K354 WeakPolarHBondContact O-CB 3.26Å; L350-K354 PolarHBondContact O-N 3.37Å
351	E	79.5	Confident	74.9	Confident	95 Å²	95	76.3 Å²	76.3	44%	0.444	37%	0.374	S	S	.	.	H	α-helix	trans	-64.7	-45.8	173.7	-76.8	-63.6	164.3	0	0	112.1	R347 R353 K354 K355	R347-E351 PolarHBondContact O-N 3.49Å; E351-R353 VanDerWaalsContact C-N 3.34Å; E351-R353 PolarHBondContact O-N 3.5Å; E351-K354 WeakPolarHBondContact O-CB 3.16Å; E351-K354 PolarHBondContact O-N 2.86Å; E351-K355 PolarHBondContact O-N 3.3Å
352	K	81.9	Confident	77	Confident	139 Å²	139	73.7 Å²	73.7	60%	0.604	35%	0.353	S	S	*	.	H	α-helix	trans	-58.8	-46.4	174.3	-176.7	173	-178.8	173.7	0	111.5	D348 F349 K354 K355 D356	D348-K352 WeakPolarHBondContact O-CB 3.37Å; D348-K352 PolarHBondContact O-N 3.37Å; F349-K352 PolarHBondContact O-N 3.5Å; K352-K354 PolarHBondContact O-N 2.85Å; K352-K355 WeakPolarHBondContact O-CB 3.24Å; K352-K355 PolarHBondContact O-N 2.89Å; K352-D356 VanDerWaalsContact O-CG 3.32Å; K352-D356 PolarHBondContact O-N 3.46Å
353	R	83.9	Confident	79.2	Confident	15 Å²	15	68.3 Å²	68.3	6%	0.057	33%	0.332	C	S	.	.	H	α-helix	trans	-66.9	-36.1	178.8	-177.7	178.9	-79.8	156.6	-13.1	112.4	Y291 G338 F349 L350 E351 K355 D356 L357	Y291-R353 WeakPolarHBondContact OH-CD 3.2Å; G338-R353 PolarHBondContact O-NH2 3.41Å; F349-R353 VanDerWaalsContact CE1-NH2 3.3Å; F349-R353 VanDerWaalsContact O-CB 3.31Å; F349-R353 WeakPolarHBondContact O-CB 3.21Å; F349-R353 PolarHBondContact O-N 2.93Å; L350-R353 PolarHBondContact O-N 3.45Å; E351-R353 VanDerWaalsContact C-N 3.34Å; E351-R353 PolarHBondContact O-N 3.5Å; R353-K355 VanDerWaalsContact C-N 3.32Å; R353-D356 PolarHBondContact O-N 3.04Å; R353-L357 HydrophobicContact CG-CD1 3.94Å; R353-L357 HydrophobicContact CG-CG 4.16Å; R353-L357 WeakPolarHBondContact O-CB 3.09Å; R353-L357 VanDerWaalsContact O-CG 3.3Å; R353-L357 WeakPolarHBondContact O-CG 3.45Å; R353-L357 PolarHBondContact O-N 3.02Å
354	K	85.7	Confident	80.3	Confident	41 Å²	41	63.2 Å²	63.2	18%	0.178	31%	0.305	C	S	.	.	H	α-helix	trans	-56.7	-48.7	172.8	-177.9	-168.8	-176.3	176.7	0	110	I275 S276 T278 Y291 L350 E351 K352 D356 L357 N358	I275-K354 HydrophobicContact CB-CG 4.25Å; I275-K354 HydrophobicContact CG2-CG 3.86Å; I275-K354 VanDerWaalsContact O-CE 3.26Å; I275-K354 WeakPolarHBondContact O-CE 3.44Å; S276-K354 PolarHBondContact O-NZ 3.44Å; T278-K354 HydrophobicContact CG2-CB 4.01Å; T278-K354 HydrophobicContact CG2-CD 3.85Å; T278-K354 HydrophobicContact CG2-CG 3.87Å; Y291-K354 HydrophobicContact CE1-CB 4.33Å; L350-K354 WeakPolarHBondContact O-CB 3.26Å; L350-K354 PolarHBondContact O-N 3.37Å; E351-K354 WeakPolarHBondContact O-CB 3.16Å; E351-K354 PolarHBondContact O-N 2.86Å; K352-K354 PolarHBondContact O-N 2.85Å; K354-D356 PolarHBondContact O-N 3.37Å; K354-L357 PolarHBondContact O-N 3.28Å; K354-N358 WeakPolarHBondContact O-CB 3.43Å; K354-N358 PolarHBondContact O-N 3.1Å
355	K	85.6	Confident	81.3	Confident	161 Å²	161	61 Å²	61	70%	0.7	29%	0.293	S	S	*	.	H	α-helix	trans	-59.5	-45.8	177.5	-170.6	178.4	-179.5	177.9	0	112.1	E351 K352 R353 N358 A359	E351-K355 PolarHBondContact O-N 3.3Å; K352-K355 WeakPolarHBondContact O-CB 3.24Å; K352-K355 PolarHBondContact O-N 2.89Å; R353-K355 VanDerWaalsContact C-N 3.32Å; K355-N358 PolarHBondContact O-N 3.03Å; K355-A359 PolarHBondContact O-N 3.09Å
356	D	85.3	Confident	82.2	Confident	66 Å²	66	61 Å²	61	35%	0.353	29%	0.294	S	S	.	.	H	α-helix	trans	-67	-42	-179.2	-64.8	-18.2	0	0	0	112.4	P337 K352 R353 K354 N358 A359 Y360	P337-D356 HydrophobicContact CB-CB 3.83Å; P337-D356 HydrophobicContact CG-CB 3.82Å; K352-D356 VanDerWaalsContact O-CG 3.32Å; K352-D356 PolarHBondContact O-N 3.46Å; R353-D356 PolarHBondContact O-N 3.04Å; K354-D356 PolarHBondContact O-N 3.37Å; D356-N358 VanDerWaalsContact C-N 3.31Å; D356-A359 PolarHBondContact O-N 2.7Å; D356-Y360 WeakPolarHBondContact O-CB 3.49Å; D356-Y360 PolarHBondContact O-N 3.08Å
357	L	89.3	Confident	81.9	Confident	0 Å²	0	62 Å²	62	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-67.6	-32.9	175.4	-70.3	175	0	0	0	111.9	I275 Y291 Y313 F316 L336 P337 R353 K354 Y360 L361	I275-L357 HydrophobicContact CD1-CB 3.43Å; I275-L357 VanDerWaalsContact CD1-CB 3.43Å; I275-L357 HydrophobicContact CD1-CD1 4.46Å; Y291-L357 HydrophobicContact CD1-CD1 4.09Å; Y291-L357 HydrophobicContact CD2-CD1 3.97Å; Y291-L357 HydrophobicContact CE1-CD1 3.93Å; Y291-L357 HydrophobicContact CE2-CD1 3.78Å; Y291-L357 HydrophobicContact CG-CD1 4.15Å; Y313-L357 HydrophobicContact CD2-CD1 4.44Å; Y313-L357 HydrophobicContact CD2-CD2 4.36Å; F316-L357 HydrophobicContact CB-CD2 4.16Å; F316-L357 HydrophobicContact CD1-CD2 3.99Å; F316-L357 HydrophobicContact CD2-CD1 4.25Å; F316-L357 HydrophobicContact CD2-CD2 4.37Å; F316-L357 HydrophobicContact CE1-CD2 4.44Å; F316-L357 HydrophobicContact CE2-CD1 4.24Å; F316-L357 HydrophobicContact CG-CD2 3.94Å; L336-L357 HydrophobicContact CD1-CD2 3.87Å; P337-L357 HydrophobicContact CG-CD2 3.66Å; P337-L357 HydrophobicContact CG-CG 4Å; R353-L357 HydrophobicContact CG-CD1 3.94Å; R353-L357 HydrophobicContact CG-CG 4.16Å; R353-L357 WeakPolarHBondContact O-CB 3.09Å; R353-L357 VanDerWaalsContact O-CG 3.3Å; R353-L357 WeakPolarHBondContact O-CG 3.45Å; R353-L357 PolarHBondContact O-N 3.02Å; K354-L357 PolarHBondContact O-N 3.28Å; L357-Y360 WeakPolarHBondContact O-CB 3.42Å; L357-Y360 PolarHBondContact O-N 2.82Å; L357-L361 PolarHBondContact O-N 3.47Å
358	N	88	Confident	81.7	Confident	46 Å²	46	59.5 Å²	59.5	25%	0.246	30%	0.301	C	S	.	.	H	α-helix	trans	-66.7	-45.9	174.2	-160	57.9	0	0	0	111	F274 I275 K354 K355 D356 Y360 L361 Q362	F274-N358 WeakPolarHBondContact CA-OD1 3.49Å; F274-N358 VanDerWaalsContact CB-OD1 3.32Å; F274-N358 WeakPolarHBondContact CB-OD1 3.37Å; I275-N358 HydrophobicContact CD1-CB 4.49Å; I275-N358 HydrophobicContact CG1-CB 4.42Å; I275-N358 PolarHBondContact N-OD1 3.17Å; K354-N358 WeakPolarHBondContact O-CB 3.43Å; K354-N358 PolarHBondContact O-N 3.1Å; K355-N358 PolarHBondContact O-N 3.03Å; D356-N358 VanDerWaalsContact C-N 3.31Å; N358-Y360 VanDerWaalsContact C-N 3.25Å; N358-Y360 PolarHBondContact O-N 3.06Å; N358-L361 PolarHBondContact O-N 3.29Å; N358-L361 VanDerWaalsContact O-N 3.13Å; N358-Q362 WeakPolarHBondContact O-CG 3.5Å; N358-Q362 PolarHBondContact O-N 3.39Å
359	A	85.4	Confident	81.5	Confident	61 Å²	61	54.5 Å²	54.5	50%	0.504	27%	0.273	S	S	.	.	H	α-helix	trans	-59.3	-38.1	174.5	0	0	0	0	0	112.2	K355 D356 Q362 L363	K355-A359 PolarHBondContact O-N 3.09Å; D356-A359 PolarHBondContact O-N 2.7Å; A359-Q362 PolarHBondContact O-N 2.65Å; A359-L363 PolarHBondContact O-N 2.8Å
360	Y	87.4	Confident	81	Confident	6 Å²	6	54.1 Å²	54.1	2%	0.024	27%	0.274	C	S	.	.	H	α-helix	trans	-61.4	-43.8	173.6	174.2	-98.5	0	0	0	112.7	F316 H320 I323 L334 L336 D356 L357 N358 L363 L364	F316-Y360 HydrophobicContact CD1-CD1 4.2Å; F316-Y360 HydrophobicContact CD1-CE1 4.24Å; H320-Y360 AromaticContact ND1-CE2 3.64Å; H320-Y360 AromaticContact ND1-CZ 3.86Å; H320-Y360 PolarHBondContact ND1-OH 2.87Å; I323-Y360 WeakPolarHBondContact CD1-OH 3.29Å; L334-Y360 HydrophobicContact CB-CE2 4.13Å; L334-Y360 HydrophobicContact CD2-CD2 4.4Å; L334-Y360 HydrophobicContact CD2-CE2 4.08Å; L336-Y360 HydrophobicContact CD1-CD1 4.01Å; L336-Y360 HydrophobicContact CD1-CD2 4.18Å; L336-Y360 HydrophobicContact CD1-CE1 3.96Å; L336-Y360 HydrophobicContact CD1-CE2 4.16Å; L336-Y360 HydrophobicContact CD1-CG 4.12Å; D356-Y360 WeakPolarHBondContact O-CB 3.49Å; D356-Y360 PolarHBondContact O-N 3.08Å; L357-Y360 WeakPolarHBondContact O-CB 3.42Å; L357-Y360 PolarHBondContact O-N 2.82Å; N358-Y360 VanDerWaalsContact C-N 3.25Å; N358-Y360 PolarHBondContact O-N 3.06Å; Y360-L363 PolarHBondContact O-N 3.23Å; Y360-L364 HydrophobicContact CD1-CD1 3.81Å; Y360-L364 HydrophobicContact CE1-CD1 3.28Å; Y360-L364 HydrophobicContact CE1-CG 4.33Å; Y360-L364 HydrophobicContact CE2-CD1 4.31Å; Y360-L364 WeakPolarHBondContact O-CG 3.29Å; Y360-L364 PolarHBondContact O-N 3.4Å; Y360-L364 VanDerWaalsContact O-N 3.13Å
361	L	87	Confident	80.3	Confident	3 Å²	3	59.3 Å²	59.3	2%	0.016	30%	0.296	C	S	.	.	H	α-helix	trans	-64.6	-40.9	174.7	-73.1	172.9	0	0	0	112.4	I275 I293 F316 L357 N358 L363 L364 L365 F383 L384	I275-L361 HydrophobicContact CD1-CD1 4.28Å; I275-L361 HydrophobicContact CG1-CD1 3.83Å; I293-L361 HydrophobicContact CD1-CD1 4.24Å; I293-L361 HydrophobicContact CG1-CD1 4.45Å; I293-L361 HydrophobicContact CG2-CD1 3.95Å; F316-L361 HydrophobicContact CE1-CD1 4.06Å; F316-L361 HydrophobicContact CE1-CD2 3.93Å; F316-L361 HydrophobicContact CE1-CG 3.95Å; F316-L361 HydrophobicContact CZ-CD1 4.23Å; L357-L361 PolarHBondContact O-N 3.47Å; N358-L361 PolarHBondContact O-N 3.29Å; N358-L361 VanDerWaalsContact O-N 3.13Å; L361-L363 VanDerWaalsContact C-N 3.3Å; L361-L363 PolarHBondContact O-N 3.03Å; L361-L364 PolarHBondContact O-N 2.99Å; L361-L365 WeakPolarHBondContact O-CB 3.35Å; L361-L365 WeakPolarHBondContact O-CG 3.08Å; L361-L365 PolarHBondContact O-N 2.92Å; L361-F383 HydrophobicContact CD2-CE1 4.38Å; L361-L384 HydrophobicContact CD2-CD2 4.34Å
362	Q	86.1	Confident	79.6	Confident	69 Å²	69	58.5 Å²	58.5	32%	0.322	31%	0.305	S	S	.	.	H	α-helix	trans	-63.7	-36.4	177.6	-64.4	-55.4	-43.5	0	0	112	A273 N358 A359 N366	A273-Q362 PolarHBondContact O-NE2 3.39Å; N358-Q362 WeakPolarHBondContact O-CG 3.5Å; N358-Q362 PolarHBondContact O-N 3.39Å; A359-Q362 PolarHBondContact O-N 2.65Å; Q362-N366 PolarHBondContact O-N 2.81Å; Q362-N366 VanDerWaalsContact O-N 3.1Å
363	L	82.9	Confident	78.9	Confident	63 Å²	63	53 Å²	53	33%	0.33	29%	0.285	S	S	.	.	H	α-helix	trans	-68.7	-41.7	176.5	-160.2	66	0	0	0	111.5	I333 L334 A359 Y360 L361 L365 N366 M369	I333-L363 HydrophobicContact CG2-CD2 4.04Å; I333-L363 WeakPolarHBondContact O-CD2 3.35Å; L334-L363 HydrophobicContact CD2-CB 4.32Å; L334-L363 HydrophobicContact CD2-CD2 4.07Å; L334-L363 HydrophobicContact CD2-CG 4.26Å; A359-L363 PolarHBondContact O-N 2.8Å; Y360-L363 PolarHBondContact O-N 3.23Å; L361-L363 VanDerWaalsContact C-N 3.3Å; L361-L363 PolarHBondContact O-N 3.03Å; L363-L365 VanDerWaalsContact C-N 3.31Å; L363-L365 PolarHBondContact O-N 2.74Å; L363-N366 WeakPolarHBondContact O-CB 3.14Å; L363-N366 PolarHBondContact O-N 2.7Å; L363-M369 HydrophobicContact CD1-SD 4.35Å; L363-M369 HydrophobicContact CG-SD 3.92Å
364	L	80.8	Confident	78.3	Confident	2 Å²	2	55.9 Å²	55.9	1%	0.01	31%	0.305	C	S	.	.	H	α-helix	trans	-62.9	-35.7	176.1	-78.8	168.1	0	0	0	113.8	F319 I323 L334 Y360 L361 L376	F319-L364 HydrophobicContact CE1-CD1 3.73Å; I323-L364 HydrophobicContact CD1-CD2 3.67Å; L334-L364 HydrophobicContact CD1-CD2 3.57Å; L334-L364 HydrophobicContact CD1-CG 4.49Å; L334-L364 HydrophobicContact CD2-CD2 3.71Å; L334-L364 HydrophobicContact CD2-CG 3.8Å; L334-L364 HydrophobicContact CG-CD2 4.34Å; Y360-L364 HydrophobicContact CD1-CD1 3.81Å; Y360-L364 HydrophobicContact CE1-CD1 3.28Å; Y360-L364 HydrophobicContact CE1-CG 4.33Å; Y360-L364 HydrophobicContact CE2-CD1 4.31Å; Y360-L364 WeakPolarHBondContact O-CG 3.29Å; Y360-L364 PolarHBondContact O-N 3.4Å; Y360-L364 VanDerWaalsContact O-N 3.13Å; L361-L364 PolarHBondContact O-N 2.99Å; L364-L376 HydrophobicContact CD2-CD2 4.38Å
365	L	81.2	Confident	77.7	Confident	20 Å²	20	58.2 Å²	58.2	11%	0.105	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	6.2	-178	-64.2	173.8	0	0	0	112.7	L271 A273 L361 L363 P367 V380 L384	L271-L365 HydrophobicContact CB-CD2 4.41Å; L271-L365 HydrophobicContact CD2-CD2 4.12Å; A273-L365 HydrophobicContact CB-CD1 3.5Å; L361-L365 WeakPolarHBondContact O-CB 3.35Å; L361-L365 WeakPolarHBondContact O-CG 3.08Å; L361-L365 PolarHBondContact O-N 2.92Å; L363-L365 VanDerWaalsContact C-N 3.31Å; L363-L365 PolarHBondContact O-N 2.74Å; L365-P367 WeakPolarHBondContact O-CD 3.44Å; L365-V380 HydrophobicContact CD2-CG1 3.6Å; L365-L384 HydrophobicContact CD1-CD1 4.24Å; L365-L384 HydrophobicContact CD2-CD1 4.17Å
366	N	80.5	Confident	77.4	Confident	57 Å²	57	50.7 Å²	50.7	31%	0.305	29%	0.29	S	S	.	.			trans	-60.6	125.2	177.8	-179	-21.4	0	0	0	109.1	Q362 L363 E368 M369 V370	Q362-N366 PolarHBondContact O-N 2.81Å; Q362-N366 VanDerWaalsContact O-N 3.1Å; L363-N366 WeakPolarHBondContact O-CB 3.14Å; L363-N366 PolarHBondContact O-N 2.7Å; N366-E368 PolarHBondContact O-N 3.01Å; N366-E368 VanDerWaalsContact O-N 3.1Å; N366-E368 PolarHBondContact OD1-N 2.91Å; N366-M369 HydrophobicContact CB-CB 4.13Å; N366-M369 HydrophobicContact CB-CG 4.09Å; N366-M369 WeakPolarHBondContact O-CA 3.21Å; N366-M369 WeakPolarHBondContact O-CB 2.92Å; N366-M369 PolarHBondContact O-N 3.4Å; N366-V370 WeakPolarHBondContact O-CG2 2.96Å; N366-V370 PolarHBondContact O-N 3.39Å
367	P	68.5	Low	77	Confident	77 Å²	77	49.8 Å²	49.8	50%	0.5	29%	0.285	S	S	.	.	H	α-helix	trans	-51	-35.8	179.7	-28.6	35	0	0	0	114	L365 K371	L365-P367 WeakPolarHBondContact O-CD 3.44Å; P367-K371 VanDerWaalsContact O-CB 3.29Å; P367-K371 WeakPolarHBondContact O-CB 3.48Å; P367-K371 WeakPolarHBondContact O-CD 3.45Å; P367-K371 WeakPolarHBondContact O-CG 3.47Å; P367-K371 PolarHBondContact O-N 3.41Å
368	E	67.9	Low	76.5	Confident	152 Å²	152	53.9 Å²	53.9	71%	0.71	31%	0.311	S	S	*	.	H	α-helix	trans	-71.3	-36.7	177.2	-63.7	-164.2	173.8	0	0	112.6	N366 K371 A372	N366-E368 PolarHBondContact O-N 3.01Å; N366-E368 VanDerWaalsContact O-N 3.1Å; N366-E368 PolarHBondContact OD1-N 2.91Å; E368-K371 PolarHBondContact O-N 3.21Å; E368-A372 VanDerWaalsContact O-CB 3.27Å; E368-A372 WeakPolarHBondContact O-CB 3.36Å; E368-A372 PolarHBondContact O-N 3.36Å
369	M	68.3	Low	76.3	Confident	22 Å²	22	55.6 Å²	55.6	11%	0.108	32%	0.315	C	S	.	.	H	α-helix	trans	-69.9	-39.3	175.7	-73.5	-149.7	61.5	0	0	112.2	L330 I333 L363 N366 K371 A372 C373	L330-M369 HydrophobicContact CD2-CE 3.4Å; I333-M369 HydrophobicContact CG2-CE 4.15Å; I333-M369 HydrophobicContact CG2-SD 3.95Å; L363-M369 HydrophobicContact CD1-SD 4.35Å; L363-M369 HydrophobicContact CG-SD 3.92Å; N366-M369 HydrophobicContact CB-CB 4.13Å; N366-M369 HydrophobicContact CB-CG 4.09Å; N366-M369 WeakPolarHBondContact O-CA 3.21Å; N366-M369 WeakPolarHBondContact O-CB 2.92Å; N366-M369 PolarHBondContact O-N 3.4Å; M369-K371 VanDerWaalsContact C-N 3.34Å; M369-A372 PolarHBondContact O-N 3.37Å; M369-C373 PolarHBondContact O-N 3.08Å; M369-C373 VanDerWaalsContact O-N 3.07Å
370	V	67.3	Low	76.2	Confident	27 Å²	27	53.2 Å²	53.2	16%	0.164	29%	0.294	C	S	.	.	H	α-helix	trans	-68.3	-36.8	177.1	176.4	0	0	0	0	110.8	F268 N366 C373 I377	F268-V370 HydrophobicContact CD1-CG1 3.91Å; F268-V370 HydrophobicContact CE1-CG1 3.99Å; N366-V370 WeakPolarHBondContact O-CG2 2.96Å; N366-V370 PolarHBondContact O-N 3.39Å; V370-C373 CarbonylContact O-C 3.55Å; V370-I377 HydrophobicContact CG1-CD1 3.57Å; V370-I377 HydrophobicContact CG1-CG1 3.7Å
371	K	64.4	Low	76	Confident	124 Å²	124	55.9 Å²	55.9	54%	0.539	31%	0.305	S	S	.	.	H	α-helix	trans	-66.5	-44.3	171.8	-77	172.9	-179.6	-172.2	0	112.8	F268 P367 E368 M369 C373	F268-K371 HydrophobicContact CD1-CG 4.14Å; F268-K371 HydrophobicContact CD2-CG 4.03Å; F268-K371 HydrophobicContact CE1-CB 4.36Å; F268-K371 HydrophobicContact CE1-CG 3.81Å; F268-K371 HydrophobicContact CE2-CG 3.68Å; F268-K371 HydrophobicContact CG-CG 4.26Å; F268-K371 HydrophobicContact CZ-CB 4.1Å; F268-K371 HydrophobicContact CZ-CG 3.56Å; P367-K371 VanDerWaalsContact O-CB 3.29Å; P367-K371 WeakPolarHBondContact O-CB 3.48Å; P367-K371 WeakPolarHBondContact O-CD 3.45Å; P367-K371 WeakPolarHBondContact O-CG 3.47Å; P367-K371 PolarHBondContact O-N 3.41Å; E368-K371 PolarHBondContact O-N 3.21Å; M369-K371 VanDerWaalsContact C-N 3.34Å; K371-C373 VanDerWaalsContact C-N 3.26Å; K371-C373 PolarHBondContact O-N 3.47Å
372	A	64.1	Low	75.8	Confident	77 Å²	77	57.6 Å²	57.6	64%	0.636	31%	0.314	S	S	*	.	H	α-helix	trans	-69.6	-21.8	-179.7	0	0	0	0	0	113.4	E368 M369	E368-A372 VanDerWaalsContact O-CB 3.27Å; E368-A372 WeakPolarHBondContact O-CB 3.36Å; E368-A372 PolarHBondContact O-N 3.36Å; M369-A372 PolarHBondContact O-N 3.37Å
373	C	68.4	Low	75.9	Confident	25 Å²	25	54.3 Å²	54.3	17%	0.169	30%	0.298	C	S	.	.			trans	-139.7	73.6	-178.1	-71.4	0	0	0	0	112.3	M369 V370 K371 T375 L376	M369-C373 PolarHBondContact O-N 3.08Å; M369-C373 VanDerWaalsContact O-N 3.07Å; V370-C373 CarbonylContact O-C 3.55Å; K371-C373 VanDerWaalsContact C-N 3.26Å; K371-C373 PolarHBondContact O-N 3.47Å; C373-T375 PolarHBondContact O-N 3.16Å; C373-T375 VanDerWaalsContact O-N 3.15Å; C373-L376 HydrophobicContact CB-CB 4.14Å; C373-L376 WeakPolarHBondContact O-CB 3.36Å; C373-L376 PolarHBondContact O-N 3.24Å
374	P	70	Confident	76.2	Confident	75 Å²	75	51.4 Å²	51.4	49%	0.487	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-60.8	-28.1	-178.7	-23.2	34.1	0	0	0	113.7	L376 I377	P374-L376 PolarHBondContact O-N 3.22Å; P374-I377 WeakPolarHBondContact O-CB 3.47Å; P374-I377 WeakPolarHBondContact O-CG1 3.44Å; P374-I377 PolarHBondContact O-N 3.01Å
375	T	74.6	Confident	76.4	Confident	90 Å²	90	55.7 Å²	55.7	55%	0.552	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-70.7	-11.7	177.3	49.6	0	0	0	0	114	F327 C373 Y379	F327-T375 WeakPolarHBondContact CE1-OG1 3.25Å; C373-T375 PolarHBondContact O-N 3.16Å; C373-T375 VanDerWaalsContact O-N 3.15Å; T375-Y379 WeakPolarHBondContact O-CD2 3.45Å; T375-Y379 WeakPolarHBondContact O-CE2 3.4Å
376	L	77.5	Confident	76.4	Confident	2 Å²	2	60 Å²	60	1%	0.01	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-75.9	-27.7	173.4	-178.9	62.1	0	0	0	112	I323 F327 L330 L364 C373 P374 Y379 V380	I323-L376 HydrophobicContact CB-CD1 4.07Å; I323-L376 HydrophobicContact CG2-CD1 3.85Å; F327-L376 HydrophobicContact CD2-CD1 4.13Å; F327-L376 HydrophobicContact CE2-CB 4.46Å; F327-L376 HydrophobicContact CE2-CD1 3.99Å; L330-L376 HydrophobicContact CD1-CD1 4.09Å; L330-L376 HydrophobicContact CD1-CD2 3.98Å; L364-L376 HydrophobicContact CD2-CD2 4.38Å; C373-L376 HydrophobicContact CB-CB 4.14Å; C373-L376 WeakPolarHBondContact O-CB 3.36Å; C373-L376 PolarHBondContact O-N 3.24Å; P374-L376 PolarHBondContact O-N 3.22Å; L376-Y379 WeakPolarHBondContact O-CB 3.38Å; L376-Y379 PolarHBondContact O-N 3.23Å; L376-Y379 VanDerWaalsContact O-N 3.13Å; L376-V380 HydrophobicContact CD1-CG2 4.26Å; L376-V380 HydrophobicContact CD2-CG2 4.47Å; L376-V380 HydrophobicContact CG-CG2 3.89Å; L376-V380 PolarHBondContact O-N 3.48Å
377	I	77.3	Confident	76.3	Confident	48 Å²	48	61.3 Å²	61.3	25%	0.246	33%	0.329	C	S	.	.	H	α-helix	trans	-54.8	-49.4	-171.2	-64.9	174.1	0	0	0	112.6	F268 V370 P374 Y379 V380 Y381	F268-I377 HydrophobicContact CE1-CD1 4.42Å; V370-I377 HydrophobicContact CG1-CD1 3.57Å; V370-I377 HydrophobicContact CG1-CG1 3.7Å; P374-I377 WeakPolarHBondContact O-CB 3.47Å; P374-I377 WeakPolarHBondContact O-CG1 3.44Å; P374-I377 PolarHBondContact O-N 3.01Å; I377-Y379 PolarHBondContact O-N 2.89Å; I377-V380 PolarHBondContact O-N 3.39Å; I377-V380 VanDerWaalsContact O-N 3.16Å; I377-Y381 HydrophobicContact CG2-CD2 3.44Å; I377-Y381 VanDerWaalsContact CG2-CD2 3.44Å; I377-Y381 HydrophobicContact CG2-CE2 3.38Å; I377-Y381 WeakPolarHBondContact O-CD2 3.45Å; I377-Y381 PolarHBondContact O-N 3.11Å
378	P	79.9	Confident	76.4	Confident	85 Å²	85	62.1 Å²	62.1	55%	0.552	34%	0.342	S	S	*	.	H	α-helix	trans	-60.3	-33.2	-178.9	-23.8	35.3	0	0	0	113.5	D382	P378-D382 PolarHBondContact O-N 3.42Å
379	Y	82.2	Confident	76.8	Confident	82 Å²	82	55.8 Å²	55.8	32%	0.322	31%	0.312	S	S	.	.	H	α-helix	trans	-72.1	-40	178.9	-63.1	-83.4	0	0	0	111.9	F319 F327 T375 L376 I377 F383	F319-Y379 VanDerWaalsContact CE2-O 3.26Å; F319-Y379 WeakPolarHBondContact CE2-O 3.04Å; F327-Y379 HydrophobicContact CE2-CD2 4.19Å; F327-Y379 HydrophobicContact CE2-CE2 4.2Å; F327-Y379 HydrophobicContact CZ-CD2 4.43Å; F327-Y379 HydrophobicContact CZ-CE2 4.17Å; T375-Y379 WeakPolarHBondContact O-CD2 3.45Å; T375-Y379 WeakPolarHBondContact O-CE2 3.4Å; L376-Y379 WeakPolarHBondContact O-CB 3.38Å; L376-Y379 PolarHBondContact O-N 3.23Å; L376-Y379 VanDerWaalsContact O-N 3.13Å; I377-Y379 PolarHBondContact O-N 2.89Å; Y379-F383 PolarHBondContact O-N 2.88Å
380	V	84.6	Confident	76.6	Confident	11 Å²	11	57.8 Å²	57.8	7%	0.067	33%	0.328	C	S	.	.	H	α-helix	trans	-66.1	-41.5	176.6	175.7	0	0	0	0	110.4	F319 L365 L376 I377 F383 L384	F319-V380 HydrophobicContact CZ-CG2 3.99Å; L365-V380 HydrophobicContact CD2-CG1 3.6Å; L376-V380 HydrophobicContact CD1-CG2 4.26Å; L376-V380 HydrophobicContact CD2-CG2 4.47Å; L376-V380 HydrophobicContact CG-CG2 3.89Å; L376-V380 PolarHBondContact O-N 3.48Å; I377-V380 PolarHBondContact O-N 3.39Å; I377-V380 VanDerWaalsContact O-N 3.16Å; V380-F383 PolarHBondContact O-N 3.27Å; V380-L384 HydrophobicContact CG1-CD1 3.79Å; V380-L384 HydrophobicContact CG1-CG 4.4Å; V380-L384 WeakPolarHBondContact O-CB 3.47Å; V380-L384 WeakPolarHBondContact O-CG 3.38Å; V380-L384 PolarHBondContact O-N 3.02Å
381	Y	82.5	Confident	76.3	Confident	63 Å²	63	60.2 Å²	60.2	25%	0.247	34%	0.336	C	S	.	.	H	α-helix	trans	-61.7	-48.5	174.3	-87.8	-77.8	0	0	0	112.3	L271 I377 F383 L384 E385	L271-Y381 HydrophobicContact CD1-CE1 3.93Å; L271-Y381 HydrophobicContact CD2-CD1 4.34Å; L271-Y381 HydrophobicContact CD2-CE1 4.02Å; I377-Y381 HydrophobicContact CG2-CD2 3.44Å; I377-Y381 VanDerWaalsContact CG2-CD2 3.44Å; I377-Y381 HydrophobicContact CG2-CE2 3.38Å; I377-Y381 WeakPolarHBondContact O-CD2 3.45Å; I377-Y381 PolarHBondContact O-N 3.11Å; Y381-F383 PolarHBondContact O-N 2.88Å; Y381-L384 CarbonylContact O-C 3.56Å; Y381-L384 PolarHBondContact O-N 3.41Å; Y381-E385 WeakPolarHBondContact O-CB 3.4Å; Y381-E385 PolarHBondContact O-N 2.97Å
382	D	83.6	Confident	75.8	Confident	38 Å²	38	56.2 Å²	56.2	20%	0.203	33%	0.331	C	S	.	.	H	α-helix	trans	-58.9	-36.1	177	-177.3	65.9	0	0	0	112	P378 K387	P378-D382 PolarHBondContact O-N 3.42Å; D382-K387 WeakPolarHBondContact OD1-CE 3.44Å; D382-K387 IonicContact OD1-NZ 3.27Å; D382-K387 PolarHBondContact OD1-NZ 2.74Å
383	F	87.9	Confident	74.8	Confident	1 Å²	1	62.7 Å²	62.7	0%	0.004	35%	0.345	C	S	.	.	H	α-helix	trans	-72.2	-33.2	175.5	-175	-102.1	0	0	0	113.3	I293 R311 D315 F316 F319 L361 Y379 V380 Y381 Y389	I293-F383 HydrophobicContact CD1-CE1 4.14Å; R311-F383 HydrophobicContact CB-CZ 4.09Å; R311-F383 HydrophobicContact CG-CE1 4.12Å; R311-F383 HydrophobicContact CG-CE2 4.06Å; R311-F383 HydrophobicContact CG-CZ 3.65Å; R311-F383 PolarHBondContact NE-O 2.82Å; R311-F383 PolarHBondContact NH2-O 3.38Å; D315-F383 HydrophobicContact CB-CE2 4.35Å; D315-F383 WeakPolarHBondContact O-CE2 3.27Å; F316-F383 HydrophobicContact CB-CZ 4.47Å; F316-F383 AromaticContact CD1-CE1 3.96Å; F316-F383 HydrophobicContact CD1-CE1 3.96Å; F316-F383 AromaticContact CD1-CZ 3.71Å; F316-F383 HydrophobicContact CD1-CZ 3.71Å; F316-F383 HydrophobicContact CD2-CZ 4.09Å; F316-F383 AromaticContact CE1-CE1 3.81Å; F316-F383 HydrophobicContact CE1-CE1 3.81Å; F316-F383 AromaticContact CE1-CZ 3.91Å; F316-F383 HydrophobicContact CE1-CZ 3.91Å; F316-F383 HydrophobicContact CE2-CZ 4.27Å; F316-F383 AromaticContact CG-CZ 3.82Å; F316-F383 HydrophobicContact CG-CZ 3.82Å; F316-F383 HydrophobicContact CZ-CE1 4.24Å; F316-F383 HydrophobicContact CZ-CZ 4.2Å; F319-F383 HydrophobicContact CB-CD2 3.59Å; F319-F383 HydrophobicContact CB-CE2 3.74Å; F319-F383 HydrophobicContact CB-CG 4.28Å; F319-F383 HydrophobicContact CD1-CB 4.47Å; F319-F383 HydrophobicContact CD1-CD1 4.18Å; F319-F383 HydrophobicContact CD1-CD2 4.15Å; F319-F383 HydrophobicContact CD1-CE1 4.49Å; F319-F383 HydrophobicContact CD1-CE2 4.46Å; F319-F383 AromaticContact CD1-CG 3.99Å; F319-F383 HydrophobicContact CD1-CG 3.99Å; F319-F383 HydrophobicContact CD2-CB 3.74Å; F319-F383 AromaticContact CD2-CD2 3.95Å; F319-F383 HydrophobicContact CD2-CD2 3.95Å; F319-F383 AromaticContact CD2-CG 3.94Å; F319-F383 HydrophobicContact CD2-CG 3.94Å; F319-F383 HydrophobicContact CE1-CB 4.45Å; F319-F383 HydrophobicContact CE1-CD1 4.35Å; F319-F383 HydrophobicContact CE1-CG 4.31Å; F319-F383 HydrophobicContact CE2-CB 3.72Å; F319-F383 HydrophobicContact CE2-CG 4.26Å; F319-F383 HydrophobicContact CG-CB 4.13Å; F319-F383 HydrophobicContact CG-CD1 4.43Å; F319-F383 AromaticContact CG-CD2 3.62Å; F319-F383 HydrophobicContact CG-CD2 3.62Å; F319-F383 HydrophobicContact CG-CE2 4.12Å; F319-F383 AromaticContact CG-CG 3.79Å; F319-F383 HydrophobicContact CG-CG 3.79Å; F319-F383 HydrophobicContact CZ-CB 4.1Å; F319-F383 HydrophobicContact CZ-CG 4.44Å; L361-F383 HydrophobicContact CD2-CE1 4.38Å; Y379-F383 PolarHBondContact O-N 2.88Å; V380-F383 PolarHBondContact O-N 3.27Å; Y381-F383 PolarHBondContact O-N 2.88Å; F383-Y389 HydrophobicContact CB-CE2 4.25Å; F383-Y389 AromaticContact CD2-CD2 3.78Å; F383-Y389 HydrophobicContact CD2-CD2 3.78Å; F383-Y389 HydrophobicContact CD2-CE1 4.41Å; F383-Y389 AromaticContact CD2-CE2 3.64Å; F383-Y389 HydrophobicContact CD2-CE2 3.64Å; F383-Y389 HydrophobicContact CD2-CG 4.25Å; F383-Y389 AromaticContact CD2-CZ 3.97Å; F383-Y389 HydrophobicContact CG-CE2 4.45Å
384	L	88.3	Confident	73.5	Confident	2 Å²	2	62.6 Å²	62.6	1%	0.01	35%	0.347	C	S	.	.	H	α-helix	trans	-93	-7.7	-177.8	-68.3	179.2	0	0	0	114	L271 A273 I293 V295 W307 T309 L361 L365 V380 Y381	L271-L384 HydrophobicContact CD2-CD1 3.63Å; A273-L384 HydrophobicContact CB-CD1 3.97Å; A273-L384 HydrophobicContact CB-CD2 4.13Å; I293-L384 HydrophobicContact CD1-CD2 4.38Å; I293-L384 HydrophobicContact CG2-CD2 4.03Å; V295-L384 HydrophobicContact CG1-CB 4.5Å; V295-L384 HydrophobicContact CG1-CD1 4.49Å; V295-L384 HydrophobicContact CG2-CB 4.07Å; V295-L384 HydrophobicContact CG2-CD2 4.06Å; V295-L384 HydrophobicContact CG2-CG 4.47Å; W307-L384 PolarHBondContact NE1-O 3.27Å; T309-L384 WeakPolarHBondContact CG2-O 3.41Å; L361-L384 HydrophobicContact CD2-CD2 4.34Å; L365-L384 HydrophobicContact CD1-CD1 4.24Å; L365-L384 HydrophobicContact CD2-CD1 4.17Å; V380-L384 HydrophobicContact CG1-CD1 3.79Å; V380-L384 HydrophobicContact CG1-CG 4.4Å; V380-L384 WeakPolarHBondContact O-CB 3.47Å; V380-L384 WeakPolarHBondContact O-CG 3.38Å; V380-L384 PolarHBondContact O-N 3.02Å; Y381-L384 CarbonylContact O-C 3.56Å; Y381-L384 PolarHBondContact O-N 3.41Å
385	E	84.8	Confident	72.1	Confident	91 Å²	91	65 Å²	65	43%	0.425	35%	0.352	S	S	.	.	S	Bend	trans	-62.8	149.4	179.3	-164.2	171.7	-171.9	0	0	112.4	T309 R311 Y381 K387	T309-E385 PolarHBondContact OG1-O 2.99Å; R311-E385 PolarHBondContact NH2-O 3.33Å; Y381-E385 WeakPolarHBondContact O-CB 3.4Å; Y381-E385 PolarHBondContact O-N 2.97Å; E385-K387 HydrophobicContact CB-CD 4.41Å; E385-K387 HydrophobicContact CB-CG 4.23Å; E385-K387 HydrophobicContact CG-CD 4.21Å; E385-K387 HydrophobicContact CG-CG 4.27Å; E385-K387 PolarHBondContact O-N 3.15Å; E385-K387 WeakPolarHBondContact OE2-CD 3.41Å; E385-K387 WeakPolarHBondContact OE2-CE 3.37Å; E385-K387 IonicContact OE2-NZ 3.7Å; E385-K387 PolarHBondContact OE2-NZ 3.29Å
386	N	82	Confident	70.4	Confident	112 Å²	112	68.2 Å²	68.2	60%	0.599	36%	0.359	S	S	*	.	S	Bend	trans	-76.7	60.4	177.2	-168.9	10.1	0	0	0	111.9	W307 K308	W307-N386 HydrophobicContact CG-CB 4.48Å; K308-N386 PolarHBondContact O-OD1 2.94Å
387	K	79.1	Confident	68.7	Low	84 Å²	84	69.1 Å²	69.1	37%	0.365	37%	0.366	S	S	.	.	S	Bend	trans	-142.6	163.9	174	68.9	-172.8	-174.7	-162.1	0	110.7	R311 D382 E385 Y389	R311-K387 PolarHBondContact NH1-O 2.94Å; R311-K387 PolarHBondContact NH2-O 3.43Å; D382-K387 WeakPolarHBondContact OD1-CE 3.44Å; D382-K387 IonicContact OD1-NZ 3.27Å; D382-K387 PolarHBondContact OD1-NZ 2.74Å; E385-K387 HydrophobicContact CB-CD 4.41Å; E385-K387 HydrophobicContact CB-CG 4.23Å; E385-K387 HydrophobicContact CG-CD 4.21Å; E385-K387 HydrophobicContact CG-CG 4.27Å; E385-K387 PolarHBondContact O-N 3.15Å; E385-K387 WeakPolarHBondContact OE2-CD 3.41Å; E385-K387 WeakPolarHBondContact OE2-CE 3.37Å; E385-K387 IonicContact OE2-NZ 3.7Å; E385-K387 PolarHBondContact OE2-NZ 3.29Å; K387-Y389 PolarHBondContact O-N 2.74Å
388	A	70.6	Confident	67.3	Low	93 Å²	93	69.9 Å²	69.9	77%	0.769	37%	0.366	S	S	*	.			trans	-61.6	128.5	169.2	0	0	0	0	0	109.5	S390	A388-S390 PolarHBondContact O-N 3.27Å
389	Y	76.3	Confident	65.6	Low	20 Å²	20	69.7 Å²	69.7	8%	0.078	36%	0.357	C	S	.	.			trans	-65.7	121.6	-175.7	-177.8	-116.1	0	0	0	111.5	D315 D318 R322 F383 K387 K391	D315-Y389 HydrophobicContact CB-CD1 3.89Å; D315-Y389 HydrophobicContact CB-CG 4.48Å; D318-Y389 HydrophobicContact CB-CE1 4.21Å; R322-Y389 PolarHBondContact NH1-OH 3.47Å; F383-Y389 HydrophobicContact CB-CE2 4.25Å; F383-Y389 AromaticContact CD2-CD2 3.78Å; F383-Y389 HydrophobicContact CD2-CD2 3.78Å; F383-Y389 HydrophobicContact CD2-CE1 4.41Å; F383-Y389 AromaticContact CD2-CE2 3.64Å; F383-Y389 HydrophobicContact CD2-CE2 3.64Å; F383-Y389 HydrophobicContact CD2-CG 4.25Å; F383-Y389 AromaticContact CD2-CZ 3.97Å; F383-Y389 HydrophobicContact CG-CE2 4.45Å; K387-Y389 PolarHBondContact O-N 2.74Å; Y389-K391 PolarHBondContact O-N 3.39Å
390	S	64.2	Low	63.6	Low	64 Å²	64	69.9 Å²	69.9	45%	0.448	36%	0.362	S	S	.	.			trans	-81.7	112.1	-176.9	77.2	0	0	0	0	111.8	R322 A388 G392	R322-S390 PolarHBondContact NH2-O 3.02Å; A388-S390 PolarHBondContact O-N 3.27Å; S390-G392 PolarHBondContact O-N 3.32Å
391	K	61.1	Low	61.3	Low	77 Å²	77	69.7 Å²	69.7	34%	0.335	36%	0.361	S	S	.	.			trans	-79.5	60	-179.9	-59	-174.7	-179.8	-152.7	0	111.6	D315 D318 Y389	D315-K391 WeakPolarHBondContact OD1-CE 3.49Å; D315-K391 IonicContact OD1-NZ 2.74Å; D315-K391 PolarHBondContact OD1-NZ 2.71Å; D315-K391 VanDerWaalsContact OD1-NZ 3.1Å; D318-K391 WeakPolarHBondContact OD2-CD 3.4Å; D318-K391 WeakPolarHBondContact OD2-CE 3.34Å; D318-K391 IonicContact OD2-NZ 3.29Å; D318-K391 PolarHBondContact OD2-NZ 3.07Å; Y389-K391 PolarHBondContact O-N 3.39Å
392	G	54	Low	59.4	Low	41 Å²	41	71 Å²	71	42%	0.423	38%	0.376	S	S	.	.			trans	-54.3	139.1	171.2	0	0	0	0	0	112.2	R322 S390 G394	R322-G392 PolarHBondContact NH2-O 3.5Å; S390-G392 PolarHBondContact O-N 3.32Å; G392-G394 PolarHBondContact O-N 3.11Å
393	K	42	Very low	57.1	Low	213 Å²	213	75.3 Å²	75.3	93%	0.926	39%	0.393	S	S	*	.	S	Bend	trans	35.7	0.4	173	-70.6	-172.6	-178.9	177.8	0	120.7	E395	K393-E395 PolarHBondContact O-N 3.49Å
394	G	41.9	Very low	54.8	Low	22 Å²	22	77.9 Å²	77.9	23%	0.227	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	2.3	-172.2	0	0	0	0	0	115.5	G392 F396 A397 R398	G392-G394 PolarHBondContact O-N 3.11Å; G394-F396 PolarHBondContact O-N 3.36Å; G394-A397 PolarHBondContact O-N 2.96Å; G394-R398 PolarHBondContact O-N 3.25Å
395	E	40.5	Very low	52.3	Low	127 Å²	127	80.2 Å²	80.2	59%	0.593	42%	0.421	S	S	*	.	H	α-helix	trans	-62.7	-33.5	170.5	-92.1	-160.8	142.7	0	0	112.9	K393 R398 K399	K393-E395 PolarHBondContact O-N 3.49Å; E395-R398 IonicContact OE1-NH1 2.72Å; E395-K399 PolarHBondContact O-N 3.48Å
396	F	39	Very low	49.9	Very low	157 Å²	157	80.1 Å²	80.1	69%	0.689	43%	0.428	S	S	*	.	H	α-helix	trans	-69.6	-44.6	178	-170.1	-102.9	0	0	0	111.4	G394 R398 K399 I400	G394-F396 PolarHBondContact O-N 3.36Å; F396-R398 PolarHBondContact O-N 2.96Å; F396-K399 PolarHBondContact O-N 2.85Å; F396-I400 HydrophobicContact CD1-CD1 3.97Å; F396-I400 HydrophobicContact CE1-CD1 3.53Å; F396-I400 HydrophobicContact CZ-CD1 3.94Å; F396-I400 PolarHBondContact O-N 2.83Å
397	A	41.7	Very low	47.6	Very low	20 Å²	20	80 Å²	80	17%	0.165	43%	0.427	C	S	.	.	H	α-helix	trans	-63.4	-39.2	174.5	0	0	0	0	0	112	G394 K399 I400 D401	G394-A397 PolarHBondContact O-N 2.96Å; A397-K399 PolarHBondContact O-N 3.37Å; A397-I400 PolarHBondContact O-N 3.11Å; A397-D401 VanDerWaalsContact O-CB 3.26Å; A397-D401 WeakPolarHBondContact O-CB 3.3Å; A397-D401 PolarHBondContact O-N 3.43Å
398	R	47.5	Very low	45.5	Very low	64 Å²	64	81.8 Å²	81.8	24%	0.242	43%	0.432	C	S	.	.	H	α-helix	trans	-63	-36.4	176.4	-96.7	-170.1	-76	105.3	-4.3	114.4	D318 G394 E395 F396 T402	D318-R398 WeakPolarHBondContact OD1-CD 3.45Å; D318-R398 WeakPolarHBondContact OD1-CG 3.41Å; D318-R398 IonicContact OD1-NE 3.87Å; D318-R398 PolarHBondContact OD1-NE 3.35Å; D318-R398 VanDerWaalsContact OD1-NE 3.12Å; D318-R398 IonicContact OD2-NE 3.91Å; G394-R398 PolarHBondContact O-N 3.25Å; E395-R398 IonicContact OE1-NH1 2.72Å; F396-R398 PolarHBondContact O-N 2.96Å; R398-T402 WeakPolarHBondContact O-CB 3.24Å; R398-T402 PolarHBondContact O-N 3.34Å; R398-T402 PolarHBondContact O-OG1 2.68Å
399	K	43.8	Very low	43.7	Very low	82 Å²	82	80.8 Å²	80.8	36%	0.357	42%	0.419	S	S	.	.	H	α-helix	trans	-70.2	-46.5	177.1	-76.1	-177	-177.3	178.5	0	109.8	E395 F396 A397 D401 T402 F403 Y534	E395-K399 PolarHBondContact O-N 3.48Å; F396-K399 PolarHBondContact O-N 2.85Å; A397-K399 PolarHBondContact O-N 3.37Å; K399-D401 PolarHBondContact O-N 2.87Å; K399-T402 PolarHBondContact O-N 3.08Å; K399-F403 WeakPolarHBondContact O-CD2 3.32Å; K399-F403 PolarHBondContact O-N 2.88Å; K399-Y534 HydrophobicContact CD-CE1 4.42Å; K399-Y534 PolarHBondContact NZ-OH 2.99Å
400	I	40.3	Very low	41.7	Very low	85 Å²	85	83.1 Å²	83.1	44%	0.436	44%	0.438	S	S	.	.	H	α-helix	trans	-60.7	-45	175	-68.4	174.7	0	0	0	111.2	F396 A397 T402 F403 V404	F396-I400 HydrophobicContact CD1-CD1 3.97Å; F396-I400 HydrophobicContact CE1-CD1 3.53Å; F396-I400 HydrophobicContact CZ-CD1 3.94Å; F396-I400 PolarHBondContact O-N 2.83Å; A397-I400 PolarHBondContact O-N 3.11Å; I400-T402 VanDerWaalsContact C-N 3.34Å; I400-T402 PolarHBondContact O-N 3.46Å; I400-F403 CarbonylContact O-C 3.51Å; I400-F403 WeakPolarHBondContact O-CA 3.38Å; I400-F403 WeakPolarHBondContact O-CB 3.32Å; I400-F403 PolarHBondContact O-N 3.45Å; I400-V404 HydrophobicContact CG2-CG1 4.48Å; I400-V404 WeakPolarHBondContact O-CG2 3.36Å; I400-V404 PolarHBondContact O-N 3.03Å
401	D	36.9	Very low	40.2	Very low	7 Å²	7	86 Å²	86	4%	0.037	45%	0.446	C	S	.	.	H	α-helix	trans	-71.9	-22.3	-179.4	-150.4	54.5	0	0	0	113.2	H317 A397 K399 V404 N405 R408	H317-D401 IonicContact CE1-OD2 3.71Å; H317-D401 PolarHBondContact CE1-OD2 3.5Å; H317-D401 IonicContact NE2-OD2 2.71Å; H317-D401 PolarHBondContact NE2-OD2 2.92Å; A397-D401 VanDerWaalsContact O-CB 3.26Å; A397-D401 WeakPolarHBondContact O-CB 3.3Å; A397-D401 PolarHBondContact O-N 3.43Å; K399-D401 PolarHBondContact O-N 2.87Å; D401-V404 HydrophobicContact CB-CG2 4.45Å; D401-V404 WeakPolarHBondContact OD1-CG2 3.38Å; D401-N405 WeakPolarHBondContact O-CA 3.37Å; D401-N405 WeakPolarHBondContact O-CB 3.4Å; D401-N405 PolarHBondContact O-N 3.38Å; D401-N405 PolarHBondContact O-ND2 3.19Å; D401-N405 PolarHBondContact OD2-ND2 2.83Å; D401-R408 IonicContact OD1-NH1 3.6Å; D401-R408 PolarHBondContact OD1-NH1 3.42Å
402	T	41.6	Very low	39	Very low	92 Å²	92	88.4 Å²	88.4	56%	0.564	45%	0.453	S	S	*	.	H	α-helix	trans	-75	-27.8	169.1	-54.6	0	0	0	0	111.8	R398 K399 I400	R398-T402 WeakPolarHBondContact O-CB 3.24Å; R398-T402 PolarHBondContact O-N 3.34Å; R398-T402 PolarHBondContact O-OG1 2.68Å; K399-T402 PolarHBondContact O-N 3.08Å; I400-T402 VanDerWaalsContact C-N 3.34Å; I400-T402 PolarHBondContact O-N 3.46Å
403	F	36.3	Very low	38.1	Very low	128 Å²	128	93 Å²	93	56%	0.561	47%	0.468	S	S	*	.	H	α-helix	trans	-82.1	-28	172.3	-71.5	-68.8	0	0	0	113.1	K399 I400	K399-F403 WeakPolarHBondContact O-CD2 3.32Å; K399-F403 PolarHBondContact O-N 2.88Å; I400-F403 CarbonylContact O-C 3.51Å; I400-F403 WeakPolarHBondContact O-CA 3.38Å; I400-F403 WeakPolarHBondContact O-CB 3.32Å; I400-F403 PolarHBondContact O-N 3.45Å
404	V	39.5	Very low	37.5	Very low	55 Å²	55	87.7 Å²	87.7	33%	0.333	45%	0.448	S	S	.	.	H	α-helix	trans	-100.2	-13.4	179.1	-56.8	0	0	0	0	114.6	I400 D401 L407 R408	I400-V404 HydrophobicContact CG2-CG1 4.48Å; I400-V404 WeakPolarHBondContact O-CG2 3.36Å; I400-V404 PolarHBondContact O-N 3.03Å; D401-V404 HydrophobicContact CB-CG2 4.45Å; D401-V404 WeakPolarHBondContact OD1-CG2 3.38Å; V404-L407 CarbonylContact O-C 3.6Å; V404-L407 WeakPolarHBondContact O-CA 3.3Å; V404-L407 WeakPolarHBondContact O-CB 3.38Å; V404-L407 PolarHBondContact O-N 2.88Å; V404-R408 WeakPolarHBondContact O-CB 3.38Å; V404-R408 PolarHBondContact O-N 3.39Å
405	N	35	Very low	36.9	Very low	51 Å²	51	90.9 Å²	90.9	27%	0.273	47%	0.467	S	S	.	.	H	α-helix	trans	-67.2	-28.9	177.3	-94.7	-46.7	0	0	0	115.9	D401 L407 R408 S409	D401-N405 WeakPolarHBondContact O-CA 3.37Å; D401-N405 WeakPolarHBondContact O-CB 3.4Å; D401-N405 PolarHBondContact O-N 3.38Å; D401-N405 PolarHBondContact O-ND2 3.19Å; D401-N405 PolarHBondContact OD2-ND2 2.83Å; N405-L407 PolarHBondContact O-N 2.86Å; N405-R408 PolarHBondContact O-N 3.01Å; N405-S409 WeakPolarHBondContact O-CB 3.15Å; N405-S409 PolarHBondContact O-N 3.15Å; N405-S409 PolarHBondContact O-OG 2.84Å
406	P	34.5	Very low	36.5	Very low	89 Å²	89	92.5 Å²	92.5	58%	0.578	48%	0.479	S	S	*	.	H	α-helix	trans	-63.4	-26.2	168.1	-21.3	33.3	0	0	0	112.6
407	L	34.3	Very low	36.1	Very low	108 Å²	108	87.7 Å²	87.7	57%	0.565	47%	0.469	S	S	*	.	H	α-helix	trans	-85.1	-39.5	174.9	-67.9	161.8	0	0	0	111.5	V404 N405 S410 M411	V404-L407 CarbonylContact O-C 3.6Å; V404-L407 WeakPolarHBondContact O-CA 3.3Å; V404-L407 WeakPolarHBondContact O-CB 3.38Å; V404-L407 PolarHBondContact O-N 2.88Å; N405-L407 PolarHBondContact O-N 2.86Å; L407-S410 WeakPolarHBondContact O-CB 3.47Å; L407-S410 PolarHBondContact O-N 3.5Å; L407-M411 PolarHBondContact O-N 3.44Å
408	R	34.8	Very low	35.6	Very low	123 Å²	123	90.2 Å²	90.2	46%	0.464	48%	0.482	S	S	.	.	H	α-helix	trans	-75.4	-29	-177.9	-145.4	175.3	-171.4	162.7	1.8	113.5	D401 V404 N405 M411 R412	D401-R408 IonicContact OD1-NH1 3.6Å; D401-R408 PolarHBondContact OD1-NH1 3.42Å; V404-R408 WeakPolarHBondContact O-CB 3.38Å; V404-R408 PolarHBondContact O-N 3.39Å; N405-R408 PolarHBondContact O-N 3.01Å; R408-M411 WeakPolarHBondContact O-CB 3.25Å; R408-M411 PolarHBondContact O-N 3.37Å; R408-R412 PolarHBondContact O-N 3.29Å
409	S	31.8	Very low	34.9	Very low	72 Å²	72	97.8 Å²	97.8	50%	0.503	52%	0.517	S	S	.	.	H	α-helix	trans	-77.4	-28.1	171.5	67.1	0	0	0	0	112.9	N405 M411 R412	N405-S409 WeakPolarHBondContact O-CB 3.15Å; N405-S409 PolarHBondContact O-N 3.15Å; N405-S409 PolarHBondContact O-OG 2.84Å; S409-M411 PolarHBondContact O-N 3.47Å; S409-R412 PolarHBondContact O-N 3.44Å
410	S	34.7	Very low	34.3	Very low	69 Å²	69	97.6 Å²	97.6	48%	0.483	53%	0.525	S	S	.	.	H	α-helix	trans	-62.2	-36.1	168	-140.7	0	0	0	0	110.6	L407 M414	L407-S410 WeakPolarHBondContact O-CB 3.47Å; L407-S410 PolarHBondContact O-N 3.5Å; S410-M414 WeakPolarHBondContact O-CB 3.3Å; S410-M414 WeakPolarHBondContact O-CG 3.41Å; S410-M414 PolarHBondContact O-N 3.03Å; S410-M414 VanDerWaalsContact O-N 3.16Å
411	M	33.8	Very low	33.7	Very low	125 Å²	125	99.6 Å²	99.6	62%	0.616	54%	0.536	S	S	*	.	H	α-helix	trans	-71.5	-23.8	176.5	-73.8	178.3	148.5	0	0	115.5	L407 R408 S409 S415	L407-M411 PolarHBondContact O-N 3.44Å; R408-M411 WeakPolarHBondContact O-CB 3.25Å; R408-M411 PolarHBondContact O-N 3.37Å; S409-M411 PolarHBondContact O-N 3.47Å; M411-S415 PolarHBondContact O-N 3.24Å; M411-S415 VanDerWaalsContact O-N 3.08Å
412	R	36	Very low	33.5	Very low	126 Å²	126	103.3 Å²	103.3	48%	0.475	56%	0.561	S	S	.	*	H	α-helix	trans	-84.3	-27.1	179.3	-125.8	-179.6	-149.7	167.4	6.3	113.7	L336 R408 S409	L336-R412 PolarHBondContact O-NH1 2.77Å; R408-R412 PolarHBondContact O-N 3.29Å; S409-R412 PolarHBondContact O-N 3.44Å
413	N	33.1	Very low	33	Very low	138 Å²	138	102.3 Å²	102.3	74%	0.738	55%	0.552	S	S	*	*	H	α-helix	trans	-81.9	-24.9	169.1	-70.1	-9.3	0	0	0	111.7
414	M	31.3	Very low	32.9	Very low	101 Å²	101	97.9 Å²	97.9	50%	0.498	54%	0.537	S	S	.	.	H	α-helix	trans	-81.6	-11.4	171.3	-75.9	177.9	84.1	0	0	114.8	S410 N416 A417 V418	S410-M414 WeakPolarHBondContact O-CB 3.3Å; S410-M414 WeakPolarHBondContact O-CG 3.41Å; S410-M414 PolarHBondContact O-N 3.03Å; S410-M414 VanDerWaalsContact O-N 3.16Å; M414-N416 PolarHBondContact O-N 3.36Å; M414-A417 PolarHBondContact O-N 3.41Å; M414-V418 HydrophobicContact CE-CG2 3.74Å; M414-V418 PolarHBondContact O-N 3.12Å
415	S	29.4	Very low	32.3	Very low	90 Å²	90	96 Å²	96	63%	0.629	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-14.9	173.7	-178.3	0	0	0	0	113.4	M411	M411-S415 PolarHBondContact O-N 3.24Å; M411-S415 VanDerWaalsContact O-N 3.08Å
416	N	31	Very low	32	Very low	160 Å²	160	94.6 Å²	94.6	86%	0.856	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	-2.3	169.4	-74.7	-6.1	0	0	0	112.8	M414	M414-N416 PolarHBondContact O-N 3.36Å
417	A	30.8	Very low	31.9	Very low	57 Å²	57	92.7 Å²	92.7	47%	0.471	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.1	9.3	-168.9	0	0	0	0	0	115.3	M414 S420	M414-A417 PolarHBondContact O-N 3.41Å; A417-S420 PolarHBondContact O-OG 3.31Å
418	V	31.2	Very low	31.5	Very low	73 Å²	73	88.7 Å²	88.7	44%	0.442	49%	0.489	S	S	.	.			trans	-146	114.5	171.6	172.8	0	0	0	0	109.4	M414 S420	M414-V418 HydrophobicContact CE-CG2 3.74Å; M414-V418 PolarHBondContact O-N 3.12Å; V418-S420 VanDerWaalsContact CA-N 3.29Å; V418-S420 WeakPolarHBondContact CG1-O 3.24Å
419	K	32.8	Very low	31.2	Very low	223 Å²	223	87.1 Å²	87.1	97%	0.97	49%	0.488	S	S	*	.	S	Bend	cis	50.3	-2.3	-13.6	-84.2	-167.1	-179.6	-176.7	0	124.1
420	S	31.3	Very low	31	Very low	77 Å²	77	88.8 Å²	88.8	54%	0.538	49%	0.492	S	S	.	.	S	Bend	trans	-154.7	104	174.4	45.3	0	0	0	0	108.9	A417 V418	A417-S420 PolarHBondContact O-OG 3.31Å; V418-S420 VanDerWaalsContact CA-N 3.29Å; V418-S420 WeakPolarHBondContact CG1-O 3.24Å
421	L	26.9	Very low	30.9	Very low	127 Å²	127	94.5 Å²	94.5	67%	0.665	51%	0.508	S	S	*	.			trans	-61.6	159.3	-170.2	-82.4	140.8	0	0	0	113	V89	V89-L421 HydrophobicContact CG1-CB 3.32Å; V89-L421 HydrophobicContact CG1-CD1 3.37Å; V89-L421 HydrophobicContact CG1-CD2 4.01Å; V89-L421 HydrophobicContact CG1-CG 3.7Å
422	P	33	Very low	31	Very low	85 Å²	85	93.6 Å²	93.6	55%	0.552	51%	0.509	S	S	*	.			trans	-84	-177	-174	6.6	14.1	0	0	0	112.5
423	D	31.2	Very low	30.8	Very low	71 Å²	71	92.6 Å²	92.6	38%	0.38	52%	0.522	S	S	.	.			trans	-45.4	-163.2	174.5	-50	-62.2	0	0	0	112.7	H591	D423-H591 VanDerWaalsContact CA-NE2 3.34Å; D423-H591 WeakPolarHBondContact CA-NE2 3.44Å; D423-H591 VanDerWaalsContact CB-NE2 3.34Å; D423-H591 WeakPolarHBondContact CB-NE2 3.32Å; D423-H591 PolarHBondContact O-CE1 3.16Å; D423-H591 PolarHBondContact O-NE2 2.94Å
424	S	34	Very low	30.7	Very low	36 Å²	36	92.8 Å²	92.8	25%	0.252	52%	0.523	S	S	.	.			cis	-173.3	132.8	16.1	161.1	0	0	0	0	100.5	H591	S424-H591 WeakPolarHBondContact CB-CD2 3.39Å; S424-H591 VanDerWaalsContact CB-NE2 3.27Å; S424-H591 WeakPolarHBondContact CB-NE2 3.46Å; S424-H591 PolarHBondContact N-CE1 3.09Å; S424-H591 VanDerWaalsContact N-CE1 3.33Å; S424-H591 PolarHBondContact N-NE2 3.19Å; S424-H591 VanDerWaalsContact N-NE2 3.1Å
425	L	27.4	Very low	30.6	Very low	14 Å²	14	94.4 Å²	94.4	7%	0.073	53%	0.533	C	S	.	.			trans	-143.8	135.8	174.3	-166.1	171.1	0	0	0	108.8	L94 M98 L110 F111 L114	L94-L425 HydrophobicContact CD1-CD1 3.19Å; L94-L425 HydrophobicContact CD1-CG 4.41Å; L94-L425 HydrophobicContact CD2-CB 4.41Å; L94-L425 HydrophobicContact CD2-CD1 3.54Å; L94-L425 HydrophobicContact CD2-CG 4.01Å; L94-L425 HydrophobicContact CG-CD1 3.52Å; L94-L425 HydrophobicContact CG-CG 4.29Å; M98-L425 HydrophobicContact CG-CD1 4.14Å; M98-L425 HydrophobicContact CG-CD2 3.8Å; M98-L425 HydrophobicContact CG-CG 4.2Å; M98-L425 HydrophobicContact SD-CD1 4.16Å; M98-L425 HydrophobicContact SD-CD2 3.4Å; M98-L425 WeakPolarHBondContact SD-CD2 3.26Å; M98-L425 HydrophobicContact SD-CG 3.62Å; L110-L425 HydrophobicContact CD1-CD1 3.88Å; L110-L425 HydrophobicContact CD2-CD1 4.15Å; L110-L425 HydrophobicContact CD2-CD2 4.25Å; L110-L425 HydrophobicContact CG-CD1 3.94Å; L110-L425 HydrophobicContact CG-CD2 4.1Å; F111-L425 HydrophobicContact CD1-CD2 3.2Å; F111-L425 HydrophobicContact CE1-CD2 3.15Å; F111-L425 HydrophobicContact CZ-CD2 4.45Å; L114-L425 HydrophobicContact CB-CB 3.48Å; L114-L425 VanDerWaalsContact CB-CB 3.48Å; L114-L425 HydrophobicContact CB-CG 4.42Å; L114-L425 HydrophobicContact CD1-CB 3.26Å; L114-L425 HydrophobicContact CD1-CD1 3.17Å; L114-L425 HydrophobicContact CD1-CD2 3.34Å; L114-L425 HydrophobicContact CD1-CG 3.31Å; L114-L425 HydrophobicContact CD2-CB 3.3Å; L114-L425 HydrophobicContact CD2-CD1 3.08Å; L114-L425 HydrophobicContact CD2-CG 3.69Å; L114-L425 HydrophobicContact CG-CB 3.34Å; L114-L425 HydrophobicContact CG-CD1 3.47Å; L114-L425 VanDerWaalsContact CG-CD1 3.47Å; L114-L425 HydrophobicContact CG-CD2 4.34Å; L114-L425 HydrophobicContact CG-CG 3.78Å
426	A	28.5	Very low	30.8	Very low	23 Å²	23	97.7 Å²	97.7	19%	0.19	54%	0.541	C	S	.	.			trans	-132.6	131	-148.9	0	0	0	0	0	106	F111 W503	F111-A426 VanDerWaalsContact CE1-C 3.49Å; F111-A426 VanDerWaalsContact CE1-O 3.29Å; F111-A426 WeakPolarHBondContact CE1-O 3.21Å; A426-W503 HydrophobicContact CB-CE3 4.37Å; A426-W503 HydrophobicContact CB-CH2 3.04Å; A426-W503 HydrophobicContact CB-CZ2 4.06Å; A426-W503 HydrophobicContact CB-CZ3 3.24Å
427	E	31.8	Very low	30.9	Very low	48 Å²	48	93.1 Å²	93.1	22%	0.224	53%	0.531	C	S	.	.			trans	96.3	93.3	142.6	-154.2	153.7	-139.9	0	0	119	F111 N501 W503 L504	F111-E427 WeakPolarHBondContact CE2-O 3.37Å; F111-E427 WeakPolarHBondContact CZ-O 3.44Å; E427-N501 WeakPolarHBondContact OE1-CB 3.31Å; E427-N501 PolarHBondContact OE2-ND2 3.45Å; E427-W503 HydrophobicContact CB-CD2 3.94Å; E427-W503 HydrophobicContact CB-CE3 3.53Å; E427-W503 HydrophobicContact CB-CH2 4.45Å; E427-W503 HydrophobicContact CB-CZ3 3.87Å; E427-W503 VanDerWaalsContact CD-CE3 3.48Å; E427-W503 HydrophobicContact CG-CB 4.12Å; E427-W503 HydrophobicContact CG-CD2 3.88Å; E427-W503 HydrophobicContact CG-CE3 3.58Å; E427-W503 HydrophobicContact CG-CG 4.14Å; E427-W503 HydrophobicContact CG-CZ3 4.39Å; E427-W503 WeakPolarHBondContact OE1-CB 3.23Å; E427-L504 PolarHBondContact OE1-N 2.66Å
428	G	26.5	Very low	31.1	Very low	25 Å²	25	100.2 Å²	100.2	26%	0.258	55%	0.545	S	S	.	.			trans	-175.1	109.9	144	0	0	0	0	0	112.9	F111	F111-G428 VanDerWaalsContact CE2-CA 3.48Å
429	M	29.2	Very low	31	Very low	89 Å²	89	104.7 Å²	104.7	44%	0.438	56%	0.563	S	S	.	*			trans	-177.9	83.1	132.6	-162.6	74.9	156.7	0	0	110.2	P166 K431	P166-M429 HydrophobicContact CB-CE 4.42Å; P166-M429 VanDerWaalsContact CD-SD 3.52Å; P166-M429 HydrophobicContact CG-CE 3.66Å; P166-M429 HydrophobicContact CG-CG 4.5Å; P166-M429 HydrophobicContact CG-SD 3.57Å; P166-M429 VanDerWaalsContact CG-SD 3.57Å; M429-K431 PolarHBondContact O-N 2.56Å
430	N	28.2	Very low	31	Very low	108 Å²	108	98.7 Å²	98.7	58%	0.578	55%	0.55	S	S	*	.			trans	-83.9	100.6	158.3	-75.8	-31.4	0	0	0	107.5
431	K	31.3	Very low	31.1	Very low	188 Å²	188	102.5 Å²	102.5	82%	0.817	56%	0.559	S	S	*	*			trans	-170.5	10.1	161.6	-107.5	168	-164.9	-172.7	0	117.8	M429	M429-K431 PolarHBondContact O-N 2.56Å
432	V	35.5	Very low	31.4	Very low	106 Å²	106	107.6 Å²	107.6	64%	0.642	57%	0.569	S	S	*	*			trans	-122.5	51.8	-178.6	-170.7	0	0	0	0	111.8
433	S	32.3	Very low	31.2	Very low	106 Å²	106	110.6 Å²	110.6	74%	0.741	58%	0.58	S	S	*	*			trans	-84.4	-21	-179.7	-172.5	0	0	0	0	113.7
434	D	30.6	Very low	31.3	Very low	142 Å²	142	109.7 Å²	109.7	76%	0.759	59%	0.587	S	S	*	*	S	Bend	trans	-101.6	-1.5	-159.6	-70.1	-10.3	0	0	0	116.5
435	N	30.1	Very low	31.3	Very low	134 Å²	134	115.8 Å²	115.8	72%	0.717	61%	0.612	S	S	*	*	S	Bend	trans	-115.9	-7.8	-175.4	-90	9.8	0	0	0	116.6
436	M	33	Very low	31.4	Very low	160 Å²	160	122.7 Å²	122.7	79%	0.788	65%	0.649	S	S	*	*	G	3₁₀ helix	trans	-86.5	-5.7	-177.3	-160.9	72	150.3	0	0	113.6	R438	M436-R438 VanDerWaalsContact C-N 3.28Å; M436-R438 PolarHBondContact O-N 2.82Å
437	G	32.5	Very low	31.7	Very low	63 Å²	63	129 Å²	129	65%	0.649	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-71.7	-11.5	-179	0	0	0	0	0	115.5
438	R	35.3	Very low	31.7	Very low	206 Å²	206	135.7 Å²	135.7	78%	0.777	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-106.3	4.7	-170.6	-63.2	-168	-133.6	-116.9	2	116	M436	M436-R438 VanDerWaalsContact C-N 3.28Å; M436-R438 PolarHBondContact O-N 2.82Å
439	M	29.9	Very low	31.9	Very low	167 Å²	167	143 Å²	143	82%	0.823	73%	0.734	S	S	*	*	S	Bend	trans	-109.4	-6.3	177.5	-71.4	-175.9	176	0	0	113.8
440	S	31.8	Very low	31.7	Very low	97 Å²	97	146 Å²	146	68%	0.678	75%	0.751	S	S	*	*	S	Bend	trans	-80.1	-22.9	177.5	-164.6	0	0	0	0	113.4	R442	S440-R442 VanDerWaalsContact C-N 3.34Å; S440-R442 PolarHBondContact O-N 3.12Å
441	E	33.3	Very low	31.7	Very low	158 Å²	158	148.8 Å²	148.8	74%	0.738	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	-14.9	-175.7	-89.9	179.5	154.3	0	0	115.2
442	R	32.9	Very low	31.5	Very low	234 Å²	234	149.6 Å²	149.6	88%	0.883	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94	-7.2	-176.1	-71.3	-171.7	-178.8	179.9	0.4	115.1	S440	S440-R442 VanDerWaalsContact C-N 3.34Å; S440-R442 PolarHBondContact O-N 3.12Å
443	L	29.6	Very low	31.1	Very low	148 Å²	148	154.1 Å²	154.1	78%	0.775	78%	0.779	S	S	*	*	S	Bend	trans	-105.3	-7.2	179.4	-159.9	62.6	0	0	0	113.1	Q445	L443-Q445 PolarHBondContact O-N 2.87Å
444	G	33.4	Very low	30.7	Very low	51 Å²	51	153.8 Å²	153.8	53%	0.526	78%	0.783	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.4	5.8	-176.5	0	0	0	0	0	116.5
445	Q	33.6	Very low	30.5	Very low	165 Å²	165	153 Å²	153	77%	0.771	79%	0.785	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.3	-15.8	-174.7	-76.7	-177.6	-11.8	0	0	115.3	L443	L443-Q445 PolarHBondContact O-N 2.87Å
446	D	30.1	Very low	30.5	Very low	159 Å²	159	152.9 Å²	152.9	85%	0.85	79%	0.792	S	S	*	*	S	Bend	trans	-99	4.9	-173.9	-77.1	-30.5	0	0	0	115.8
447	I	35.3	Very low	30.2	Very low	155 Å²	155	153.4 Å²	153.4	80%	0.795	80%	0.797	S	S	*	*	S	Bend	trans	-124.4	41.9	-176	-42.1	178.9	0	0	0	111.7
448	K	30.2	Very low	30	Very low	189 Å²	189	158.2 Å²	158.2	82%	0.822	81%	0.807	S	S	*	*	S	Bend	trans	-112.3	5.1	175.9	-83.8	-169.2	177.1	-177.6	0	115.5
449	Q	31.3	Very low	29.6	Very low	179 Å²	179	154.3 Å²	154.3	84%	0.836	81%	0.808	S	S	*	*	S	Bend	trans	-112.2	-2.3	-168.8	-78.8	-166.3	-17.7	0	0	118.6
450	N	26	Very low	29.6	Very low	152 Å²	152	155.9 Å²	155.9	81%	0.813	81%	0.811	S	S	*	*	S	Bend	trans	-149.7	108.7	176.6	-79.3	-41.5	0	0	0	106.7
451	I	27.8	Very low	29.3	Very low	165 Å²	165	156.1 Å²	156.1	85%	0.846	81%	0.812	S	S	*	*				-166.9	118.7	62	-79.9	142.7	0	0	0	107.4
452	F	26.3	Very low	29.2	Very low	206 Å²	206	156.7 Å²	156.7	90%	0.904	82%	0.82	S	S	*	*			trans	-89.4	127.3	166.1	-118.9	-91.7	0	0	0	108.7
453	K	26.6	Very low	29.1	Very low	201 Å²	201	152.5 Å²	152.5	87%	0.874	81%	0.814	S	S	*	*			trans	158.5	108.6	133	-87.2	170.9	-177.6	-177.9	0	111.7
454	A	24.1	Very low	29.1	Very low	98 Å²	98	150.7 Å²	150.7	81%	0.81	81%	0.805	S	S	*	*			trans	-119.2	145.9	157.6	0	0	0	0	0	108.9
455	P	26.5	Very low	29.1	Very low	126 Å²	126	153.6 Å²	153.6	82%	0.818	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-82.3	163.1	169.5	-1.7	21	0	0	0	112.3
456	P	30.5	Very low	29	Very low	132 Å²	132	152.1 Å²	152.1	86%	0.857	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-90.4	158.9	-155.2	32.3	-28.2	0	0	0	116.3
457	L	28.1	Very low	29.3	Very low	170 Å²	170	152.3 Å²	152.3	89%	0.89	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-62.9	148.7	-176.7	-62.1	159.7	0	0	0	114.7
458	L	26.9	Very low	29.2	Very low	164 Å²	164	148.4 Å²	148.4	86%	0.859	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-86.5	143	151.5	-74.8	169.2	0	0	0	109.5
459	P	28.2	Very low	29.6	Very low	124 Å²	124	149.1 Å²	149.1	81%	0.805	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-78.4	127.5	-174.3	3.4	13.4	0	0	0	110.9
460	K	28.3	Very low	30.1	Very low	201 Å²	201	146.6 Å²	146.6	87%	0.874	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-78.2	132.3	164.8	-76	-178.2	176.5	175	0	108.9
461	S	27.2	Very low	30.7	Very low	101 Å²	101	141.7 Å²	141.7	71%	0.706	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-60.3	137.5	173.7	49.3	0	0	0	0	111.9	I463	S461-I463 PolarHBondContact O-N 2.78Å
462	D	30.8	Very low	31.1	Very low	170 Å²	170	136.7 Å²	136.7	91%	0.909	74%	0.744	S	S	*	*			trans	-53.4	114	176.8	-66.6	-51.5	0	0	0	111.9
463	I	29.4	Very low	31.8	Very low	147 Å²	147	136.2 Å²	136.2	75%	0.754	74%	0.744	S	S	*	*			trans	-107.3	127.7	166	-61.8	174.7	0	0	0	107.3	S461	S461-I463 PolarHBondContact O-N 2.78Å
464	D	31.1	Very low	32.4	Very low	110 Å²	110	132.5 Å²	132.5	59%	0.588	73%	0.733	S	S	*	*			trans	-44.3	126.3	-177.8	-162.6	-7.9	0	0	0	113.9	E466 H467	D464-E466 PolarHBondContact O-N 3.42Å; D464-E466 VanDerWaalsContact O-N 3.09Å; D464-H467 PolarHBondContact O-N 3.42Å
465	P	33	Very low	33.1	Very low	112 Å²	112	133.4 Å²	133.4	73%	0.727	72%	0.724	S	S	*	*	G	3₁₀ helix	trans	-59	-20.4	-176.6	-25.4	33.7	0	0	0	115.7	H467	P465-H467 PolarHBondContact O-N 2.92Å
466	E	31.8	Very low	33.9	Very low	134 Å²	134	134.1 Å²	134.1	63%	0.626	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-75.8	-18.7	-178.3	-78.9	-137.2	133.5	0	0	114.5	D464	D464-E466 PolarHBondContact O-N 3.42Å; D464-E466 VanDerWaalsContact O-N 3.09Å
467	H	36.5	Very low	34.7	Very low	163 Å²	163	134.5 Å²	134.5	76%	0.755	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-88.8	-2.9	179.6	-105.7	-87.9	0	0	0	114.1	D464 P465 R469	D464-H467 PolarHBondContact O-N 3.42Å; P465-H467 PolarHBondContact O-N 2.92Å; H467-R469 PolarHBondContact O-N 3.06Å
468	C	33.1	Very low	35.7	Very low	72 Å²	72	128.6 Å²	128.6	49%	0.486	69%	0.687	S	S	.	*			trans	-94	22.5	-177.4	-115.5	0	0	0	0	114.7	V470 S471	C468-V470 PolarHBondContact O-N 3.27Å; C468-S471 PolarHBondContact O-N 2.81Å; C468-S471 PolarHBondContact O-OG 3.49Å; C468-S471 PolarHBondContact SG-OG 3.49Å
469	R	38.4	Very low	36.8	Very low	205 Å²	205	125.7 Å²	125.7	77%	0.774	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62	-13.9	-179.6	-80.8	-172.2	161	118.2	0.3	114.8	H467	H467-R469 PolarHBondContact O-N 3.06Å
470	V	41	Very low	38	Very low	125 Å²	125	127.6 Å²	127.6	76%	0.758	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	-10.2	177	-172.2	0	0	0	0	112.4	C468	C468-V470 PolarHBondContact O-N 3.27Å
471	S	38.6	Very low	39.8	Very low	50 Å²	50	119.6 Å²	119.6	35%	0.35	64%	0.643	S	S	.	*	S	Bend	trans	-124.9	59	180	42.4	0	0	0	0	110.6	C468 Q473	C468-S471 PolarHBondContact O-N 2.81Å; C468-S471 PolarHBondContact O-OG 3.49Å; C468-S471 PolarHBondContact SG-OG 3.49Å; S471-Q473 PolarHBondContact O-N 3.05Å
472	A	36.4	Very low	42	Very low	60 Å²	60	120.1 Å²	120.1	50%	0.496	64%	0.637	S	S	.	*			trans	-59.1	124.1	168.1	0	0	0	0	0	109.8	L474	A472-L474 PolarHBondContact O-N 3.27Å
473	Q	41.6	Very low	43.9	Very low	196 Å²	196	112.8 Å²	112.8	92%	0.916	60%	0.598	S	S	*	*			trans	-56.5	118.9	174.9	-73.3	161.5	-35.6	0	0	110.4	S471	S471-Q473 PolarHBondContact O-N 3.05Å
474	L	39.7	Very low	45.9	Very low	122 Å²	122	106.1 Å²	106.1	64%	0.639	56%	0.564	S	S	*	*			trans	-141.7	116.5	169	-72.3	174.9	0	0	0	108.5	A472	A472-L474 PolarHBondContact O-N 3.27Å
475	D	38.9	Very low	47.9	Very low	117 Å²	117	105.9 Å²	105.9	63%	0.626	56%	0.555	S	S	*	*			trans	35.5	116	166.5	-155.8	26.3	0	0	0	118.6	N477	D475-N477 PolarHBondContact O-N 2.87Å
476	D	42.7	Very low	50.1	Low	142 Å²	142	104.4 Å²	104.4	76%	0.759	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	4.9	-173.1	-65.4	-26.7	0	0	0	115.7
477	N	47.3	Very low	52.3	Low	139 Å²	139	101.8 Å²	101.8	74%	0.743	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	0.3	-177.3	-69.9	-48.8	0	0	0	114.4	D475	D475-N477 PolarHBondContact O-N 2.87Å
478	V	48.9	Very low	54.1	Low	46 Å²	46	95.1 Å²	95.1	28%	0.279	50%	0.502	S	S	.	.			trans	-121.4	21.4	-177.1	-160.7	0	0	0	0	112.7	D480 L484	V478-D480 PolarHBondContact O-N 3.41Å; V478-D480 VanDerWaalsContact O-N 3.11Å; V478-L484 HydrophobicContact CG1-CD2 4.38Å
479	D	49.3	Very low	56.3	Low	104 Å²	104	93.8 Å²	93.8	56%	0.556	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-8.5	-171.4	-91.9	-22	0	0	0	116	N481	D479-N481 PolarHBondContact O-N 3.39Å
480	D	55	Low	58.5	Low	163 Å²	163	89.3 Å²	89.3	87%	0.872	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	3.5	-171.4	-65.6	-24.8	0	0	0	115.9	V478	V478-D480 PolarHBondContact O-N 3.41Å; V478-D480 VanDerWaalsContact O-N 3.11Å
481	N	65.8	Low	60.3	Low	33 Å²	33	84.2 Å²	84.2	18%	0.176	45%	0.449	C	S	.	.			trans	-148	88.9	177.8	-148.2	-79.1	0	0	0	115.2	D479 P483 L484 R485 I516	D479-N481 PolarHBondContact O-N 3.39Å; N481-P483 WeakPolarHBondContact OD1-CD 3.46Å; N481-L484 HydrophobicContact CB-CB 3.94Å; N481-L484 WeakPolarHBondContact O-CB 3.35Å; N481-L484 PolarHBondContact O-N 2.97Å; N481-L484 PolarHBondContact OD1-N 2.75Å; N481-R485 PolarHBondContact O-N 2.87Å; N481-I516 WeakPolarHBondContact ND2-CG2 3.07Å
482	I	72.8	Confident	62.1	Low	113 Å²	113	82.1 Å²	82.1	58%	0.579	43%	0.434	S	S	*	.	H	α-helix	trans	-52	-45.4	177.3	-62.1	168	0	0	0	113	L484 R485 V486	I482-L484 PolarHBondContact O-N 3.04Å; I482-R485 WeakPolarHBondContact O-CB 3.33Å; I482-R485 PolarHBondContact O-N 3.06Å; I482-V486 HydrophobicContact CG2-CG2 4.44Å; I482-V486 WeakPolarHBondContact O-CG2 3.41Å; I482-V486 PolarHBondContact O-N 2.87Å; I482-V486 VanDerWaalsContact O-N 3.08Å
483	P	70.9	Confident	64.4	Low	16 Å²	16	84.9 Å²	84.9	10%	0.104	44%	0.436	C	S	.	.	H	α-helix	trans	-58.8	-43.1	177.4	-26.8	35.3	0	0	0	113.9	N481 R485 V486 M487 I524 I528	N481-P483 WeakPolarHBondContact OD1-CD 3.46Å; P483-R485 VanDerWaalsContact C-N 3.28Å; P483-R485 PolarHBondContact O-N 3.02Å; P483-V486 PolarHBondContact O-N 2.73Å; P483-M487 WeakPolarHBondContact O-CG 3.31Å; P483-M487 PolarHBondContact O-N 2.77Å; P483-I524 HydrophobicContact CB-CG2 4.41Å; P483-I528 HydrophobicContact CB-CD1 3.83Å; P483-I528 HydrophobicContact CG-CD1 3.85Å
484	L	70.4	Confident	66.4	Low	7 Å²	7	76.7 Å²	76.7	4%	0.037	40%	0.4	C	S	.	.	H	α-helix	trans	-56.1	-46	175.3	179.6	53.6	0	0	0	111.2	V478 N481 I482 M487 L488 L512 Q513 I516	V478-L484 HydrophobicContact CG1-CD2 4.38Å; N481-L484 HydrophobicContact CB-CB 3.94Å; N481-L484 WeakPolarHBondContact O-CB 3.35Å; N481-L484 PolarHBondContact O-N 2.97Å; N481-L484 PolarHBondContact OD1-N 2.75Å; I482-L484 PolarHBondContact O-N 3.04Å; L484-M487 PolarHBondContact O-N 2.97Å; L484-L488 HydrophobicContact CD1-CD1 3.77Å; L484-L488 HydrophobicContact CD1-CG 4.17Å; L484-L488 HydrophobicContact CG-CD1 3.9Å; L484-L488 WeakPolarHBondContact O-CB 3.29Å; L484-L488 WeakPolarHBondContact O-CG 3.37Å; L484-L488 PolarHBondContact O-N 2.89Å; L484-L512 HydrophobicContact CD1-CB 3.42Å; L484-L512 VanDerWaalsContact CD1-CB 3.42Å; L484-L512 HydrophobicContact CD1-CD1 4.4Å; L484-Q513 HydrophobicContact CD1-CG 4.26Å; L484-Q513 HydrophobicContact CD2-CG 3.48Å; L484-Q513 VanDerWaalsContact CD2-CG 3.48Å; L484-I516 HydrophobicContact CB-CD1 3.37Å; L484-I516 HydrophobicContact CD1-CD1 3.66Å; L484-I516 HydrophobicContact CD2-CD1 4.38Å; L484-I516 HydrophobicContact CG-CD1 3.94Å
485	R	73.6	Confident	68.2	Low	105 Å²	105	71.8 Å²	71.8	40%	0.396	37%	0.373	S	S	.	.	H	α-helix	trans	-61.7	-46.5	-178.9	-173.4	172.3	70.9	-176.1	2.5	111.4	N481 I482 P483 L488 L489	N481-R485 PolarHBondContact O-N 2.87Å; I482-R485 WeakPolarHBondContact O-CB 3.33Å; I482-R485 PolarHBondContact O-N 3.06Å; P483-R485 VanDerWaalsContact C-N 3.28Å; P483-R485 PolarHBondContact O-N 3.02Å; R485-L488 PolarHBondContact O-N 3.45Å; R485-L489 HydrophobicContact CG-CD1 4.43Å; R485-L489 WeakPolarHBondContact O-CG 3.5Å; R485-L489 PolarHBondContact O-N 3.36Å; R485-L489 VanDerWaalsContact O-N 3.08Å
486	V	80	Confident	69.7	Low	81 Å²	81	67.5 Å²	67.5	49%	0.491	35%	0.35	S	S	.	.	H	α-helix	trans	-65.2	-43.8	179.2	175.9	0	0	0	0	111.3	I482 P483 L488 L489 L490	I482-V486 HydrophobicContact CG2-CG2 4.44Å; I482-V486 WeakPolarHBondContact O-CG2 3.41Å; I482-V486 PolarHBondContact O-N 2.87Å; I482-V486 VanDerWaalsContact O-N 3.08Å; P483-V486 PolarHBondContact O-N 2.73Å; V486-L488 VanDerWaalsContact C-N 3.33Å; V486-L488 PolarHBondContact O-N 2.94Å; V486-L489 PolarHBondContact O-N 3.3Å; V486-L490 WeakPolarHBondContact O-CB 3.49Å; V486-L490 PolarHBondContact O-N 2.87Å
487	M	76.5	Confident	70.9	Confident	78 Å²	78	60.8 Å²	60.8	38%	0.384	31%	0.314	S	S	.	.	H	α-helix	trans	-62.2	-41	177.4	-73.3	-171.8	-179.7	0	0	111.9	P483 L484 L490 M491 L512	P483-M487 WeakPolarHBondContact O-CG 3.31Å; P483-M487 PolarHBondContact O-N 2.77Å; L484-M487 PolarHBondContact O-N 2.97Å; M487-L490 PolarHBondContact O-N 2.92Å; M487-M491 WeakPolarHBondContact O-CB 3.33Å; M487-M491 VanDerWaalsContact O-CG 3.29Å; M487-M491 WeakPolarHBondContact O-CG 3.28Å; M487-M491 PolarHBondContact O-N 3.47Å; M487-L512 HydrophobicContact CB-CD1 3.97Å; M487-L512 HydrophobicContact SD-CD2 4.09Å
488	L	74.9	Confident	71.4	Confident	24 Å²	24	58.5 Å²	58.5	13%	0.126	30%	0.298	C	S	.	.	H	α-helix	trans	-63.9	-45.6	177.3	-80.5	165.8	0	0	0	112.8	L484 R485 V486 L490 M491 D492 I508 K509 L512	L484-L488 HydrophobicContact CD1-CD1 3.77Å; L484-L488 HydrophobicContact CD1-CG 4.17Å; L484-L488 HydrophobicContact CG-CD1 3.9Å; L484-L488 WeakPolarHBondContact O-CB 3.29Å; L484-L488 WeakPolarHBondContact O-CG 3.37Å; L484-L488 PolarHBondContact O-N 2.89Å; R485-L488 PolarHBondContact O-N 3.45Å; V486-L488 VanDerWaalsContact C-N 3.33Å; V486-L488 PolarHBondContact O-N 2.94Å; L488-L490 VanDerWaalsContact C-N 3.29Å; L488-L490 PolarHBondContact O-N 2.66Å; L488-M491 PolarHBondContact O-N 3.29Å; L488-D492 WeakPolarHBondContact O-CB 3.43Å; L488-D492 PolarHBondContact O-N 3.4Å; L488-I508 HydrophobicContact CD2-CG2 4.18Å; L488-K509 HydrophobicContact CD1-CB 4.45Å; L488-K509 HydrophobicContact CD1-CG 3.96Å; L488-K509 HydrophobicContact CD2-CB 3.73Å; L488-K509 HydrophobicContact CD2-CG 4.18Å; L488-L512 HydrophobicContact CD2-CD1 3.88Å; L488-L512 HydrophobicContact CG-CD1 3.92Å
489	L	80.7	Confident	71.5	Confident	44 Å²	44	64 Å²	64	23%	0.23	32%	0.321	C	S	.	.	H	α-helix	trans	-61.3	-40.5	176.8	-71.7	172.5	0	0	0	111.7	R485 V486 E493	R485-L489 HydrophobicContact CG-CD1 4.43Å; R485-L489 WeakPolarHBondContact O-CG 3.5Å; R485-L489 PolarHBondContact O-N 3.36Å; R485-L489 VanDerWaalsContact O-N 3.08Å; V486-L489 PolarHBondContact O-N 3.3Å; L489-E493 PolarHBondContact O-N 2.85Å
490	L	83.2	Confident	71.5	Confident	110 Å²	110	65.5 Å²	65.5	58%	0.576	32%	0.322	S	S	*	.	H	α-helix	trans	-64.7	-46.9	176.6	-177.3	66.4	0	0	0	111.3	V486 M487 L488 D492 E493 V494	V486-L490 WeakPolarHBondContact O-CB 3.49Å; V486-L490 PolarHBondContact O-N 2.87Å; M487-L490 PolarHBondContact O-N 2.92Å; L488-L490 VanDerWaalsContact C-N 3.29Å; L488-L490 PolarHBondContact O-N 2.66Å; L490-D492 VanDerWaalsContact C-N 3.33Å; L490-D492 PolarHBondContact O-N 3.43Å; L490-E493 PolarHBondContact O-N 2.78Å; L490-V494 HydrophobicContact CD1-CG2 3.92Å; L490-V494 HydrophobicContact CG-CG2 4.13Å; L490-V494 WeakPolarHBondContact O-CB 3.3Å; L490-V494 WeakPolarHBondContact O-CG2 3.33Å; L490-V494 PolarHBondContact O-N 3.46Å
491	M	78.3	Confident	71.5	Confident	18 Å²	18	59.6 Å²	59.6	9%	0.089	29%	0.291	C	S	.	.	H	α-helix	trans	-65.7	-37.3	180	-70.6	-172.4	77	0	0	112.2	M487 L488 E493 F495 L497 I508 L512 L589 I593	M487-M491 WeakPolarHBondContact O-CB 3.33Å; M487-M491 VanDerWaalsContact O-CG 3.29Å; M487-M491 WeakPolarHBondContact O-CG 3.28Å; M487-M491 PolarHBondContact O-N 3.47Å; L488-M491 PolarHBondContact O-N 3.29Å; M491-E493 VanDerWaalsContact C-N 3.32Å; M491-E493 PolarHBondContact O-N 2.99Å; M491-F495 HydrophobicContact CB-CD2 4.15Å; M491-F495 HydrophobicContact CB-CE2 4.46Å; M491-F495 HydrophobicContact CE-CD2 4.21Å; M491-F495 HydrophobicContact CE-CE2 3.89Å; M491-F495 HydrophobicContact CG-CD2 4.4Å; M491-F495 HydrophobicContact CG-CE2 4.22Å; M491-F495 WeakPolarHBondContact O-CB 3.21Å; M491-F495 WeakPolarHBondContact O-CD2 3.37Å; M491-F495 PolarHBondContact O-N 3.42Å; M491-L497 HydrophobicContact CB-CD1 4.14Å; M491-L497 WeakPolarHBondContact O-CD1 3.26Å; M491-I508 HydrophobicContact CB-CG2 4.03Å; M491-I508 HydrophobicContact CE-CB 4.19Å; M491-I508 HydrophobicContact CE-CD1 3.7Å; M491-I508 HydrophobicContact CE-CG1 3.73Å; M491-I508 HydrophobicContact CE-CG2 3.4Å; M491-I508 VanDerWaalsContact CE-CG2 3.4Å; M491-I508 HydrophobicContact CG-CG2 4.3Å; M491-I508 HydrophobicContact SD-CG2 3.3Å; M491-I508 WeakPolarHBondContact SD-CG2 3.38Å; M491-L512 HydrophobicContact SD-CD1 3.7Å; M491-L512 HydrophobicContact SD-CD2 4.42Å; M491-L512 HydrophobicContact SD-CG 4.32Å; M491-L589 HydrophobicContact CE-CD1 3.99Å; M491-L589 HydrophobicContact CE-CD2 4.07Å; M491-L589 HydrophobicContact CE-CG 4.46Å; M491-I593 HydrophobicContact CE-CD1 3.74Å
492	D	78	Confident	71.1	Confident	6 Å²	6	62 Å²	62	3%	0.032	30%	0.301	C	S	.	.	H	α-helix	trans	-55.3	-47.6	173.1	-84.8	-8.9	0	0	0	112	L488 L490 D496 L497 K498 R505	L488-D492 WeakPolarHBondContact O-CB 3.43Å; L488-D492 PolarHBondContact O-N 3.4Å; L490-D492 VanDerWaalsContact C-N 3.33Å; L490-D492 PolarHBondContact O-N 3.43Å; D492-D496 CarbonylContact O-C 3.54Å; D492-D496 WeakPolarHBondContact O-CA 3.46Å; D492-D496 PolarHBondContact O-N 3.02Å; D492-D496 VanDerWaalsContact O-N 3.08Å; D492-L497 PolarHBondContact O-N 3.12Å; D492-K498 HydrophobicContact CB-CD 4.33Å; D492-K498 HydrophobicContact CB-CG 4.06Å; D492-K498 WeakPolarHBondContact OD2-CE 3.24Å; D492-R505 VanDerWaalsContact OD1-CD 3.31Å; D492-R505 WeakPolarHBondContact OD1-CD 3.49Å; D492-R505 VanDerWaalsContact OD1-CG 3.23Å; D492-R505 WeakPolarHBondContact OD1-CG 3.37Å; D492-R505 IonicContact OD1-CZ 2.73Å; D492-R505 IonicContact OD1-NE 3.86Å; D492-R505 PolarHBondContact OD1-NE 3.35Å; D492-R505 IonicContact OD2-CZ 2.69Å; D492-R505 IonicContact OD2-NE 3.21Å; D492-R505 PolarHBondContact OD2-NE 2.88Å; D492-R505 IonicContact OD2-NH2 2.92Å; D492-R505 PolarHBondContact OD2-NH2 3.43Å
493	E	83.5	Confident	70.3	Confident	119 Å²	119	59.7 Å²	59.7	56%	0.556	29%	0.285	S	S	*	.	H	α-helix	trans	-74.8	-44.7	-176.5	-165.2	62.8	-150.1	0	0	112	L489 L490 M491 R604	L489-E493 PolarHBondContact O-N 2.85Å; L490-E493 PolarHBondContact O-N 2.78Å; M491-E493 VanDerWaalsContact C-N 3.32Å; M491-E493 PolarHBondContact O-N 2.99Å; E493-R604 PolarHBondContact O-NH1 2.82Å
494	V	84.4	Confident	69.7	Low	24 Å²	24	59 Å²	59	15%	0.145	28%	0.28	C	S	.	.	H	α-helix	trans	-64.7	-47.2	-178	170.9	0	0	0	0	110.6	L490 G601 V605	L490-V494 HydrophobicContact CD1-CG2 3.92Å; L490-V494 HydrophobicContact CG-CG2 4.13Å; L490-V494 WeakPolarHBondContact O-CB 3.3Å; L490-V494 WeakPolarHBondContact O-CG2 3.33Å; L490-V494 PolarHBondContact O-N 3.46Å; V494-G601 WeakPolarHBondContact O-CA 3.5Å; V494-V605 HydrophobicContact CB-CG2 4.41Å; V494-V605 HydrophobicContact CG1-CG2 3.9Å; V494-V605 HydrophobicContact CG2-CG2 3.78Å
495	F	77.7	Confident	69.4	Low	18 Å²	18	61.8 Å²	61.8	8%	0.079	29%	0.29	C	S	.	.	H	α-helix	trans	-99.7	7.1	-173.9	-56.9	-69.6	0	0	0	114	M491 L497 M585 I593 T597	M491-F495 HydrophobicContact CB-CD2 4.15Å; M491-F495 HydrophobicContact CB-CE2 4.46Å; M491-F495 HydrophobicContact CE-CD2 4.21Å; M491-F495 HydrophobicContact CE-CE2 3.89Å; M491-F495 HydrophobicContact CG-CD2 4.4Å; M491-F495 HydrophobicContact CG-CE2 4.22Å; M491-F495 WeakPolarHBondContact O-CB 3.21Å; M491-F495 WeakPolarHBondContact O-CD2 3.37Å; M491-F495 PolarHBondContact O-N 3.42Å; F495-L497 VanDerWaalsContact C-N 3.26Å; F495-L497 HydrophobicContact CB-CD1 4.36Å; F495-L497 HydrophobicContact CB-CD2 3.6Å; F495-L497 HydrophobicContact CB-CG 3.8Å; F495-L497 PolarHBondContact O-N 3.26Å; F495-M585 HydrophobicContact CZ-SD 4.28Å; F495-I593 HydrophobicContact CD1-CD1 4.24Å; F495-I593 HydrophobicContact CD1-CG2 3.8Å; F495-I593 HydrophobicContact CD2-CD1 3.87Å; F495-I593 HydrophobicContact CE1-CD1 3.92Å; F495-I593 HydrophobicContact CE1-CG2 4.09Å; F495-I593 HydrophobicContact CE2-CD1 3.51Å; F495-I593 HydrophobicContact CG-CD1 4.22Å; F495-I593 HydrophobicContact CG-CG2 4.21Å; F495-I593 HydrophobicContact CZ-CD1 3.54Å; F495-T597 HydrophobicContact CB-CG2 4.27Å
496	D	70.9	Confident	69	Low	28 Å²	28	65.5 Å²	65.5	15%	0.15	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.2	33.9	177.5	-143.6	32.5	0	0	0	113.7	D492 K498 E499 K500 R604	D492-D496 CarbonylContact O-C 3.54Å; D492-D496 WeakPolarHBondContact O-CA 3.46Å; D492-D496 PolarHBondContact O-N 3.02Å; D492-D496 VanDerWaalsContact O-N 3.08Å; D496-K498 PolarHBondContact O-N 3.32Å; D496-E499 PolarHBondContact O-N 2.98Å; D496-K500 PolarHBondContact O-N 2.84Å; D496-K500 WeakPolarHBondContact OD2-CE 3.43Å; D496-K500 IonicContact OD2-NZ 3.45Å; D496-K500 PolarHBondContact OD2-NZ 3.35Å; D496-R604 VanDerWaalsContact CB-NH1 3.26Å; D496-R604 IonicContact OD1-CZ 3.88Å; D496-R604 IonicContact OD1-NH1 2.66Å; D496-R604 PolarHBondContact OD1-NH1 3.38Å; D496-R604 IonicContact OD1-NH2 3.63Å; D496-R604 PolarHBondContact OD1-NH2 3.43Å; D496-R604 IonicContact OD2-CZ 2.73Å; D496-R604 IonicContact OD2-NH1 2.94Å; D496-R604 IonicContact OD2-NH2 2.87Å; D496-R604 PolarHBondContact OD2-NH2 3.4Å
497	L	66.4	Low	68	Low	0 Å²	0	63.9 Å²	63.9	0%	0	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-19.3	-168.6	-52.3	174.3	0	0	0	113.3	M491 D492 F495 N501 L504 R505 I508	M491-L497 HydrophobicContact CB-CD1 4.14Å; M491-L497 WeakPolarHBondContact O-CD1 3.26Å; D492-L497 PolarHBondContact O-N 3.12Å; F495-L497 VanDerWaalsContact C-N 3.26Å; F495-L497 HydrophobicContact CB-CD1 4.36Å; F495-L497 HydrophobicContact CB-CD2 3.6Å; F495-L497 HydrophobicContact CB-CG 3.8Å; F495-L497 PolarHBondContact O-N 3.26Å; L497-N501 CarbonylContact O-C 3.55Å; L497-L504 HydrophobicContact CD2-CB 4.11Å; L497-L504 HydrophobicContact CD2-CD2 3.37Å; L497-L504 HydrophobicContact CD2-CG 3.57Å; L497-R505 HydrophobicContact CB-CB 3.88Å; L497-R505 HydrophobicContact CB-CG 4.05Å; L497-I508 HydrophobicContact CD1-CD1 3.36Å; L497-I508 HydrophobicContact CD2-CD1 3.97Å; L497-I508 HydrophobicContact CG-CD1 4.31Å
498	K	58.4	Low	67.4	Low	91 Å²	91	60.1 Å²	60.1	40%	0.396	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-32.7	-179	-73.2	178.5	179.4	167.9	0	113.2	D492 D496 Q502	D492-K498 HydrophobicContact CB-CD 4.33Å; D492-K498 HydrophobicContact CB-CG 4.06Å; D492-K498 WeakPolarHBondContact OD2-CE 3.24Å; D496-K498 PolarHBondContact O-N 3.32Å; K498-Q502 PolarHBondContact O-NE2 3.43Å
499	E	51.7	Low	67	Low	163 Å²	163	62.9 Å²	62.9	76%	0.762	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.1	-29.3	-172.4	-66.9	-172.1	171.7	0	0	113.4	D496	D496-E499 PolarHBondContact O-N 2.98Å
500	K	49	Very low	66.1	Low	135 Å²	135	63.9 Å²	63.9	59%	0.587	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.9	-44.7	-169.7	-67.8	174.4	-177.9	147.2	0	114	D496	D496-K500 PolarHBondContact O-N 2.84Å; D496-K500 WeakPolarHBondContact OD2-CE 3.43Å; D496-K500 IonicContact OD2-NZ 3.45Å; D496-K500 PolarHBondContact OD2-NZ 3.35Å
501	N	55.2	Low	65.2	Low	39 Å²	39	61.3 Å²	61.3	21%	0.209	28%	0.277	C	S	.	.			trans	-132.2	71.9	-168.3	-71.2	14.8	0	0	0	112.4	E427 L497 W503 L504 R505	E427-N501 WeakPolarHBondContact OE1-CB 3.31Å; E427-N501 PolarHBondContact OE2-ND2 3.45Å; L497-N501 CarbonylContact O-C 3.55Å; N501-W503 PolarHBondContact O-N 3.29Å; N501-L504 HydrophobicContact CB-CB 3.65Å; N501-L504 HydrophobicContact CB-CD2 4.27Å; N501-L504 WeakPolarHBondContact O-CB 3.46Å; N501-L504 PolarHBondContact O-N 3.26Å; N501-L504 VanDerWaalsContact O-N 3.13Å; N501-R505 PolarHBondContact O-N 2.95Å
502	Q	57.1	Low	64.7	Low	83 Å²	83	61.1 Å²	61.1	39%	0.388	28%	0.277	S	S	.	.	H	α-helix	trans	-60.9	-27.9	176.3	-71.3	-69.5	-23.1	0	0	113.1	K498 R505 R506	K498-Q502 PolarHBondContact O-NE2 3.43Å; Q502-R505 WeakPolarHBondContact O-CB 3.27Å; Q502-R506 PolarHBondContact O-N 3.34Å; Q502-R506 VanDerWaalsContact O-N 3.14Å
503	W	55.7	Low	64.1	Low	65 Å²	65	62.9 Å²	62.9	25%	0.246	29%	0.285	C	S	.	.	H	α-helix	trans	-67.2	-48.3	172.7	174.7	95.6	0	0	0	110.8	A426 E427 N501 R505 R506 N507	A426-W503 HydrophobicContact CB-CE3 4.37Å; A426-W503 HydrophobicContact CB-CH2 3.04Å; A426-W503 HydrophobicContact CB-CZ2 4.06Å; A426-W503 HydrophobicContact CB-CZ3 3.24Å; E427-W503 HydrophobicContact CB-CD2 3.94Å; E427-W503 HydrophobicContact CB-CE3 3.53Å; E427-W503 HydrophobicContact CB-CH2 4.45Å; E427-W503 HydrophobicContact CB-CZ3 3.87Å; E427-W503 VanDerWaalsContact CD-CE3 3.48Å; E427-W503 HydrophobicContact CG-CB 4.12Å; E427-W503 HydrophobicContact CG-CD2 3.88Å; E427-W503 HydrophobicContact CG-CE3 3.58Å; E427-W503 HydrophobicContact CG-CG 4.14Å; E427-W503 HydrophobicContact CG-CZ3 4.39Å; E427-W503 WeakPolarHBondContact OE1-CB 3.23Å; N501-W503 PolarHBondContact O-N 3.29Å; W503-R505 VanDerWaalsContact C-N 3.29Å; W503-R505 PolarHBondContact O-N 3.21Å; W503-R506 WeakPolarHBondContact O-CB 3.4Å; W503-R506 PolarHBondContact O-N 3.07Å; W503-R506 VanDerWaalsContact O-N 3.09Å; W503-N507 WeakPolarHBondContact CH2-ND2 3.37Å; W503-N507 WeakPolarHBondContact CZ2-ND2 3.43Å; W503-N507 WeakPolarHBondContact CZ3-ND2 3.17Å; W503-N507 PolarHBondContact O-N 2.86Å
504	L	57.3	Low	63.1	Low	1 Å²	1	63.6 Å²	63.6	1%	0.005	29%	0.288	C	S	.	.	H	α-helix	trans	-60.5	-40.4	176.2	179.4	57.4	0	0	0	111.7	E427 L497 N501 R506 N507 I508 I592 I593 T597	E427-L504 PolarHBondContact OE1-N 2.66Å; L497-L504 HydrophobicContact CD2-CB 4.11Å; L497-L504 HydrophobicContact CD2-CD2 3.37Å; L497-L504 HydrophobicContact CD2-CG 3.57Å; N501-L504 HydrophobicContact CB-CB 3.65Å; N501-L504 HydrophobicContact CB-CD2 4.27Å; N501-L504 WeakPolarHBondContact O-CB 3.46Å; N501-L504 PolarHBondContact O-N 3.26Å; N501-L504 VanDerWaalsContact O-N 3.13Å; L504-R506 VanDerWaalsContact C-N 3.32Å; L504-R506 PolarHBondContact O-N 3.01Å; L504-N507 PolarHBondContact O-N 3.28Å; L504-I508 HydrophobicContact CD1-CD1 3.84Å; L504-I508 HydrophobicContact CD1-CG1 4.17Å; L504-I508 HydrophobicContact CD2-CD1 4.46Å; L504-I508 HydrophobicContact CG-CD1 3.74Å; L504-I508 HydrophobicContact CG-CG1 4.5Å; L504-I508 WeakPolarHBondContact O-CB 3.43Å; L504-I508 WeakPolarHBondContact O-CG1 3.31Å; L504-I508 PolarHBondContact O-N 3.5Å; L504-I592 WeakPolarHBondContact CD1-O 3.36Å; L504-I593 HydrophobicContact CD1-CG1 4.36Å; L504-I593 HydrophobicContact CD2-CG2 4.21Å; L504-T597 HydrophobicContact CD2-CG2 3.85Å
505	R	66.1	Low	62.1	Low	65 Å²	65	66.6 Å²	66.6	25%	0.245	30%	0.303	C	S	.	.	H	α-helix	trans	-54.1	-46.9	172.5	-165.6	173	-176.8	-148.9	0	112.7	D492 L497 N501 Q502 W503 K509	D492-R505 VanDerWaalsContact OD1-CD 3.31Å; D492-R505 WeakPolarHBondContact OD1-CD 3.49Å; D492-R505 VanDerWaalsContact OD1-CG 3.23Å; D492-R505 WeakPolarHBondContact OD1-CG 3.37Å; D492-R505 IonicContact OD1-CZ 2.73Å; D492-R505 IonicContact OD1-NE 3.86Å; D492-R505 PolarHBondContact OD1-NE 3.35Å; D492-R505 IonicContact OD2-CZ 2.69Å; D492-R505 IonicContact OD2-NE 3.21Å; D492-R505 PolarHBondContact OD2-NE 2.88Å; D492-R505 IonicContact OD2-NH2 2.92Å; D492-R505 PolarHBondContact OD2-NH2 3.43Å; L497-R505 HydrophobicContact CB-CB 3.88Å; L497-R505 HydrophobicContact CB-CG 4.05Å; N501-R505 PolarHBondContact O-N 2.95Å; Q502-R505 WeakPolarHBondContact O-CB 3.27Å; W503-R505 VanDerWaalsContact C-N 3.29Å; W503-R505 PolarHBondContact O-N 3.21Å; R505-K509 WeakPolarHBondContact O-CB 3.43Å; R505-K509 PolarHBondContact O-N 3.38Å
506	R	63.3	Low	61.4	Low	183 Å²	183	66.2 Å²	66.2	69%	0.691	30%	0.301	S	S	*	.	H	α-helix	trans	-67.7	-37.4	-179.6	-167.2	173.2	-179.2	178.5	-1.7	111.7	Q502 W503 L504 K509 N510	Q502-R506 PolarHBondContact O-N 3.34Å; Q502-R506 VanDerWaalsContact O-N 3.14Å; W503-R506 WeakPolarHBondContact O-CB 3.4Å; W503-R506 PolarHBondContact O-N 3.07Å; W503-R506 VanDerWaalsContact O-N 3.09Å; L504-R506 VanDerWaalsContact C-N 3.32Å; L504-R506 PolarHBondContact O-N 3.01Å; R506-K509 WeakPolarHBondContact O-CB 3.49Å; R506-K509 PolarHBondContact O-N 3.22Å; R506-N510 WeakPolarHBondContact O-CB 3.22Å; R506-N510 PolarHBondContact O-N 3.38Å; R506-N510 PolarHBondContact O-ND2 3.23Å
507	N	60.6	Low	60.9	Low	47 Å²	47	74 Å²	74	25%	0.251	33%	0.329	S	S	.	.	H	α-helix	trans	-69.7	-42.4	175.9	-76.1	-20.4	0	0	0	113.2	W503 L504 K509 N510 L511	W503-N507 WeakPolarHBondContact CH2-ND2 3.37Å; W503-N507 WeakPolarHBondContact CZ2-ND2 3.43Å; W503-N507 WeakPolarHBondContact CZ3-ND2 3.17Å; W503-N507 PolarHBondContact O-N 2.86Å; L504-N507 PolarHBondContact O-N 3.28Å; N507-K509 VanDerWaalsContact C-N 3.28Å; N507-K509 PolarHBondContact O-N 3.49Å; N507-N510 PolarHBondContact O-N 2.65Å; N507-L511 VanDerWaalsContact O-CB 3.27Å; N507-L511 WeakPolarHBondContact O-CB 3.26Å; N507-L511 PolarHBondContact O-N 2.98Å
508	I	63.7	Low	60.4	Low	0 Å²	0	77.9 Å²	77.9	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-59.7	-42.9	172.3	-74.1	164	0	0	0	110.4	L488 M491 L497 L504 L511 L512 I593	L488-I508 HydrophobicContact CD2-CG2 4.18Å; M491-I508 HydrophobicContact CB-CG2 4.03Å; M491-I508 HydrophobicContact CE-CB 4.19Å; M491-I508 HydrophobicContact CE-CD1 3.7Å; M491-I508 HydrophobicContact CE-CG1 3.73Å; M491-I508 HydrophobicContact CE-CG2 3.4Å; M491-I508 VanDerWaalsContact CE-CG2 3.4Å; M491-I508 HydrophobicContact CG-CG2 4.3Å; M491-I508 HydrophobicContact SD-CG2 3.3Å; M491-I508 WeakPolarHBondContact SD-CG2 3.38Å; L497-I508 HydrophobicContact CD1-CD1 3.36Å; L497-I508 HydrophobicContact CD2-CD1 3.97Å; L497-I508 HydrophobicContact CG-CD1 4.31Å; L504-I508 HydrophobicContact CD1-CD1 3.84Å; L504-I508 HydrophobicContact CD1-CG1 4.17Å; L504-I508 HydrophobicContact CD2-CD1 4.46Å; L504-I508 HydrophobicContact CG-CD1 3.74Å; L504-I508 HydrophobicContact CG-CG1 4.5Å; L504-I508 WeakPolarHBondContact O-CB 3.43Å; L504-I508 WeakPolarHBondContact O-CG1 3.31Å; L504-I508 PolarHBondContact O-N 3.5Å; I508-L511 PolarHBondContact O-N 3.49Å; I508-L512 HydrophobicContact CG2-CD1 3.84Å; I508-L512 HydrophobicContact CG2-CG 4.33Å; I508-L512 VanDerWaalsContact O-CB 3.31Å; I508-L512 WeakPolarHBondContact O-CB 3.4Å; I508-L512 VanDerWaalsContact O-CG 3.24Å; I508-L512 WeakPolarHBondContact O-CG 3.47Å; I508-L512 PolarHBondContact O-N 3.45Å; I508-I593 HydrophobicContact CD1-CD1 4.31Å; I508-I593 HydrophobicContact CD1-CG1 4.1Å; I508-I593 HydrophobicContact CG1-CG1 4.49Å
509	K	65.6	Low	60.2	Low	82 Å²	82	76 Å²	76	36%	0.357	36%	0.356	S	S	.	.	H	α-helix	trans	-58.4	-49	173.3	-175.8	176.9	179.1	-179.2	0	112.6	L488 R505 R506 N507 Q513	L488-K509 HydrophobicContact CD1-CB 4.45Å; L488-K509 HydrophobicContact CD1-CG 3.96Å; L488-K509 HydrophobicContact CD2-CB 3.73Å; L488-K509 HydrophobicContact CD2-CG 4.18Å; R505-K509 WeakPolarHBondContact O-CB 3.43Å; R505-K509 PolarHBondContact O-N 3.38Å; R506-K509 WeakPolarHBondContact O-CB 3.49Å; R506-K509 PolarHBondContact O-N 3.22Å; N507-K509 VanDerWaalsContact C-N 3.28Å; N507-K509 PolarHBondContact O-N 3.49Å; K509-Q513 VanDerWaalsContact O-CB 3.3Å; K509-Q513 WeakPolarHBondContact O-CB 3.48Å; K509-Q513 WeakPolarHBondContact O-CG 3.3Å; K509-Q513 PolarHBondContact O-N 3.44Å
510	N	62.3	Low	60.3	Low	64 Å²	64	77 Å²	77	34%	0.342	36%	0.355	S	S	.	.	H	α-helix	trans	-65.2	-42.5	-179.8	-69.4	-17.8	0	0	0	111.7	R506 N507 Q513 Q514	R506-N510 WeakPolarHBondContact O-CB 3.22Å; R506-N510 PolarHBondContact O-N 3.38Å; R506-N510 PolarHBondContact O-ND2 3.23Å; N507-N510 PolarHBondContact O-N 2.65Å; N510-Q513 PolarHBondContact O-N 2.84Å; N510-Q514 WeakPolarHBondContact O-CB 3.26Å; N510-Q514 VanDerWaalsContact O-CG 3.3Å; N510-Q514 WeakPolarHBondContact O-CG 3.49Å; N510-Q514 PolarHBondContact O-N 3.42Å
511	L	64.8	Low	60.7	Low	56 Å²	56	71.4 Å²	71.4	29%	0.293	34%	0.336	S	S	.	.	H	α-helix	trans	-62.4	-50.4	176.9	-175.3	104	0	0	0	111.1	N507 I508 Q513 Q514 L515 L589 I592	N507-L511 VanDerWaalsContact O-CB 3.27Å; N507-L511 WeakPolarHBondContact O-CB 3.26Å; N507-L511 PolarHBondContact O-N 2.98Å; I508-L511 PolarHBondContact O-N 3.49Å; L511-Q513 VanDerWaalsContact C-N 3.29Å; L511-Q513 PolarHBondContact O-N 3.28Å; L511-Q514 PolarHBondContact O-N 3.1Å; L511-L515 WeakPolarHBondContact O-CB 3.49Å; L511-L515 PolarHBondContact O-N 3.29Å; L511-L589 HydrophobicContact CD2-CD1 4.13Å; L511-I592 HydrophobicContact CD1-CD1 3.4Å; L511-I592 HydrophobicContact CD2-CD1 4Å; L511-I592 HydrophobicContact CG-CD1 4.29Å
512	L	67.1	Low	60.9	Low	15 Å²	15	75.9 Å²	75.9	8%	0.079	36%	0.36	C	S	.	.	H	α-helix	trans	-62.3	-38.9	177.6	-70.7	175.2	0	0	0	111.1	L484 M487 L488 M491 I508 L515 I516	L484-L512 HydrophobicContact CD1-CB 3.42Å; L484-L512 VanDerWaalsContact CD1-CB 3.42Å; L484-L512 HydrophobicContact CD1-CD1 4.4Å; M487-L512 HydrophobicContact CB-CD1 3.97Å; M487-L512 HydrophobicContact SD-CD2 4.09Å; L488-L512 HydrophobicContact CD2-CD1 3.88Å; L488-L512 HydrophobicContact CG-CD1 3.92Å; M491-L512 HydrophobicContact SD-CD1 3.7Å; M491-L512 HydrophobicContact SD-CD2 4.42Å; M491-L512 HydrophobicContact SD-CG 4.32Å; I508-L512 HydrophobicContact CG2-CD1 3.84Å; I508-L512 HydrophobicContact CG2-CG 4.33Å; I508-L512 VanDerWaalsContact O-CB 3.31Å; I508-L512 WeakPolarHBondContact O-CB 3.4Å; I508-L512 VanDerWaalsContact O-CG 3.24Å; I508-L512 WeakPolarHBondContact O-CG 3.47Å; I508-L512 PolarHBondContact O-N 3.45Å; L512-L515 PolarHBondContact O-N 2.91Å; L512-I516 WeakPolarHBondContact O-CB 3.39Å; L512-I516 WeakPolarHBondContact O-CD1 3.33Å; L512-I516 WeakPolarHBondContact O-CG1 3.45Å; L512-I516 PolarHBondContact O-N 2.93Å
513	Q	65.6	Low	61.3	Low	43 Å²	43	75 Å²	75	20%	0.201	36%	0.36	C	S	.	.	H	α-helix	trans	-63.5	-44.1	173	-84.2	-178.9	-27.3	0	0	112.5	L484 K509 N510 L511 I516 R517	L484-Q513 HydrophobicContact CD1-CG 4.26Å; L484-Q513 HydrophobicContact CD2-CG 3.48Å; L484-Q513 VanDerWaalsContact CD2-CG 3.48Å; K509-Q513 VanDerWaalsContact O-CB 3.3Å; K509-Q513 WeakPolarHBondContact O-CB 3.48Å; K509-Q513 WeakPolarHBondContact O-CG 3.3Å; K509-Q513 PolarHBondContact O-N 3.44Å; N510-Q513 PolarHBondContact O-N 2.84Å; L511-Q513 VanDerWaalsContact C-N 3.29Å; L511-Q513 PolarHBondContact O-N 3.28Å; Q513-I516 PolarHBondContact O-N 3.44Å; Q513-R517 VanDerWaalsContact O-CB 3.26Å; Q513-R517 WeakPolarHBondContact O-CB 3.35Å; Q513-R517 WeakPolarHBondContact O-CG 3.36Å; Q513-R517 PolarHBondContact O-N 3.34Å
514	Q	62.9	Low	61.9	Low	133 Å²	133	73.2 Å²	73.2	62%	0.621	36%	0.355	S	S	*	.	H	α-helix	trans	-63.9	-43.3	177	-77.9	176.8	0.6	0	0	111.2	N510 L511 I516 R517 A518	N510-Q514 WeakPolarHBondContact O-CB 3.26Å; N510-Q514 VanDerWaalsContact O-CG 3.3Å; N510-Q514 WeakPolarHBondContact O-CG 3.49Å; N510-Q514 PolarHBondContact O-N 3.42Å; L511-Q514 PolarHBondContact O-N 3.1Å; Q514-I516 VanDerWaalsContact C-N 3.35Å; Q514-I516 PolarHBondContact O-N 3.27Å; Q514-R517 PolarHBondContact O-N 2.85Å; Q514-A518 WeakPolarHBondContact O-CB 3.4Å; Q514-A518 PolarHBondContact O-N 3.41Å
515	L	62.5	Low	62.5	Low	88 Å²	88	76.9 Å²	76.9	46%	0.461	38%	0.375	S	S	.	.	H	α-helix	trans	-63.8	-41.2	179.1	-171.4	134.5	0	0	0	111.5	L511 L512 T519 I524	L511-L515 WeakPolarHBondContact O-CB 3.49Å; L511-L515 PolarHBondContact O-N 3.29Å; L512-L515 PolarHBondContact O-N 2.91Å; L515-T519 WeakPolarHBondContact O-CB 3.38Å; L515-T519 VanDerWaalsContact O-CG2 3.3Å; L515-T519 WeakPolarHBondContact O-CG2 3.26Å; L515-T519 PolarHBondContact O-N 2.99Å; L515-T519 VanDerWaalsContact O-N 3.12Å; L515-T519 PolarHBondContact O-OG1 2.89Å; L515-I524 HydrophobicContact CD2-CD1 3.77Å
516	I	63.6	Low	63	Low	9 Å²	9	82.1 Å²	82.1	5%	0.046	40%	0.395	C	S	.	.	H	α-helix	trans	-72.3	-39	177.5	-67.3	171.8	0	0	0	111.8	N481 L484 L512 Q513 Q514 T519 Y520 G521 I524	N481-I516 WeakPolarHBondContact ND2-CG2 3.07Å; L484-I516 HydrophobicContact CB-CD1 3.37Å; L484-I516 HydrophobicContact CD1-CD1 3.66Å; L484-I516 HydrophobicContact CD2-CD1 4.38Å; L484-I516 HydrophobicContact CG-CD1 3.94Å; L512-I516 WeakPolarHBondContact O-CB 3.39Å; L512-I516 WeakPolarHBondContact O-CD1 3.33Å; L512-I516 WeakPolarHBondContact O-CG1 3.45Å; L512-I516 PolarHBondContact O-N 2.93Å; Q513-I516 PolarHBondContact O-N 3.44Å; Q514-I516 VanDerWaalsContact C-N 3.35Å; Q514-I516 PolarHBondContact O-N 3.27Å; I516-T519 PolarHBondContact O-OG1 2.87Å; I516-Y520 PolarHBondContact O-N 3.26Å; I516-G521 PolarHBondContact O-N 3.34Å; I516-G521 VanDerWaalsContact O-N 3.14Å; I516-I524 HydrophobicContact CB-CD1 4.39Å; I516-I524 HydrophobicContact CG1-CD1 3.71Å
517	R	59.4	Low	63.6	Low	193 Å²	193	79.4 Å²	79.4	73%	0.728	39%	0.388	S	S	*	.	H	α-helix	trans	-67.5	-42	175.1	-73.9	174.3	-179.1	-157.7	0.1	111.9	Q513 Q514 T519 Y520	Q513-R517 VanDerWaalsContact O-CB 3.26Å; Q513-R517 WeakPolarHBondContact O-CB 3.35Å; Q513-R517 WeakPolarHBondContact O-CG 3.36Å; Q513-R517 PolarHBondContact O-N 3.34Å; Q514-R517 PolarHBondContact O-N 2.85Å; R517-T519 VanDerWaalsContact C-N 3.3Å; R517-T519 PolarHBondContact O-N 2.9Å; R517-Y520 PolarHBondContact O-N 3.45Å
518	A	56.4	Low	64.4	Low	80 Å²	80	80.6 Å²	80.6	66%	0.661	39%	0.393	S	S	*	.	H	α-helix	trans	-68.5	-28.3	179.7	0	0	0	0	0	112.9	Q514	Q514-A518 WeakPolarHBondContact O-CB 3.4Å; Q514-A518 PolarHBondContact O-N 3.41Å
519	T	54.5	Low	65.2	Low	51 Å²	51	83.7 Å²	83.7	31%	0.313	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	3.4	-179.2	51.8	0	0	0	0	114.2	L515 I516 R517 T523 I524	L515-T519 WeakPolarHBondContact O-CB 3.38Å; L515-T519 VanDerWaalsContact O-CG2 3.3Å; L515-T519 WeakPolarHBondContact O-CG2 3.26Å; L515-T519 PolarHBondContact O-N 2.99Å; L515-T519 VanDerWaalsContact O-N 3.12Å; L515-T519 PolarHBondContact O-OG1 2.89Å; I516-T519 PolarHBondContact O-OG1 2.87Å; R517-T519 VanDerWaalsContact C-N 3.3Å; R517-T519 PolarHBondContact O-N 2.9Å; T519-T523 VanDerWaalsContact O-CB 3.23Å; T519-T523 WeakPolarHBondContact O-CB 3.47Å; T519-T523 PolarHBondContact O-OG1 2.87Å; T519-I524 WeakPolarHBondContact OG1-CD1 3.47Å
520	Y	54.5	Low	66.1	Low	184 Å²	184	83.7 Å²	83.7	72%	0.722	42%	0.416	S	S	*	.			trans	51.6	99.9	-163.6	-62.8	-98.3	0	0	0	109.1	I516 R517 D522 T523	I516-Y520 PolarHBondContact O-N 3.26Å; R517-Y520 PolarHBondContact O-N 3.45Å; Y520-D522 CarbonylContact O-C 3.6Å; Y520-D522 PolarHBondContact O-N 2.89Å; Y520-T523 PolarHBondContact O-N 3Å; Y520-T523 PolarHBondContact O-OG1 3.4Å
521	G	56.4	Low	67.1	Low	19 Å²	19	84.9 Å²	84.9	20%	0.196	42%	0.419	C	S	.	.	T	Hydrogen-bonded Turn	trans	-42.6	-26.5	-168.1	0	0	0	0	0	117.1	I516 T523 I524 N525	I516-G521 PolarHBondContact O-N 3.34Å; I516-G521 VanDerWaalsContact O-N 3.14Å; G521-T523 VanDerWaalsContact C-N 3.31Å; G521-T523 PolarHBondContact O-N 3.48Å; G521-I524 PolarHBondContact O-N 2.98Å; G521-N525 PolarHBondContact O-N 3.31Å
522	D	60.1	Low	68.1	Low	132 Å²	132	85.4 Å²	85.4	71%	0.706	43%	0.425	S	S	*	.	H	α-helix	trans	-54.2	-36.1	168.9	-63.3	-24.9	0	0	0	114.6	Y520 R526	Y520-D522 CarbonylContact O-C 3.6Å; Y520-D522 PolarHBondContact O-N 2.89Å; D522-R526 WeakPolarHBondContact O-CB 3.37Å; D522-R526 PolarHBondContact O-N 3.19Å
523	T	64.4	Low	69	Low	66 Å²	66	89 Å²	89	41%	0.405	44%	0.444	S	S	.	.	H	α-helix	trans	-67.9	-41.3	-179.4	-52.5	0	0	0	0	111.9	T519 Y520 G521 K527	T519-T523 VanDerWaalsContact O-CB 3.23Å; T519-T523 WeakPolarHBondContact O-CB 3.47Å; T519-T523 PolarHBondContact O-OG1 2.87Å; Y520-T523 PolarHBondContact O-N 3Å; Y520-T523 PolarHBondContact O-OG1 3.4Å; G521-T523 VanDerWaalsContact C-N 3.31Å; G521-T523 PolarHBondContact O-N 3.48Å; T523-K527 WeakPolarHBondContact O-CB 3.5Å; T523-K527 WeakPolarHBondContact O-CG 3.34Å; T523-K527 PolarHBondContact O-N 3.39Å
524	I	67.9	Low	70.2	Confident	26 Å²	26	90.6 Å²	90.6	13%	0.133	45%	0.449	C	S	.	.	H	α-helix	trans	-69.1	-45.3	177.5	-71	171.7	0	0	0	109.5	P483 L515 I516 T519 G521 R526 K527 I528	P483-I524 HydrophobicContact CB-CG2 4.41Å; L515-I524 HydrophobicContact CD2-CD1 3.77Å; I516-I524 HydrophobicContact CB-CD1 4.39Å; I516-I524 HydrophobicContact CG1-CD1 3.71Å; T519-I524 WeakPolarHBondContact OG1-CD1 3.47Å; G521-I524 PolarHBondContact O-N 2.98Å; I524-R526 VanDerWaalsContact C-N 3.35Å; I524-R526 PolarHBondContact O-N 2.92Å; I524-K527 PolarHBondContact O-N 2.94Å; I524-I528 HydrophobicContact CG2-CD1 3.96Å; I524-I528 WeakPolarHBondContact O-CG1 3.27Å; I524-I528 PolarHBondContact O-N 3.42Å
525	N	71.8	Confident	71.2	Confident	79 Å²	79	87.7 Å²	87.7	42%	0.422	44%	0.436	S	S	.	.	H	α-helix	trans	-60	-46.5	177.2	-167.7	44.1	0	0	0	111.3	G521 K527 I528 V529	G521-N525 PolarHBondContact O-N 3.31Å; N525-K527 VanDerWaalsContact C-N 3.34Å; N525-K527 PolarHBondContact O-N 2.96Å; N525-I528 WeakPolarHBondContact O-CB 3.31Å; N525-I528 PolarHBondContact O-N 3.1Å; N525-I528 VanDerWaalsContact O-N 3.15Å; N525-V529 WeakPolarHBondContact O-CG2 3.43Å; N525-V529 PolarHBondContact O-N 3.45Å
526	R	75.6	Confident	72.4	Confident	175 Å²	175	87.6 Å²	87.6	66%	0.66	44%	0.439	S	S	*	.	H	α-helix	trans	-59.1	-42.9	174.8	-175.9	172.7	-178.7	156.3	3.5	112	D522 I524 I528 V529 D530	D522-R526 WeakPolarHBondContact O-CB 3.37Å; D522-R526 PolarHBondContact O-N 3.19Å; I524-R526 VanDerWaalsContact C-N 3.35Å; I524-R526 PolarHBondContact O-N 2.92Å; R526-I528 VanDerWaalsContact C-N 3.33Å; R526-I528 PolarHBondContact O-N 3.15Å; R526-V529 PolarHBondContact O-N 2.98Å; R526-D530 VanDerWaalsContact O-CB 3.29Å; R526-D530 WeakPolarHBondContact O-CB 3.48Å; R526-D530 PolarHBondContact O-N 3.4Å
527	K	76.1	Confident	73.8	Confident	126 Å²	126	88.1 Å²	88.1	55%	0.548	44%	0.444	S	S	.	.	H	α-helix	trans	-62.9	-38	175.3	-82.2	-173.6	176.5	-175.6	0	113.1	T523 I524 N525 H531	T523-K527 WeakPolarHBondContact O-CB 3.5Å; T523-K527 WeakPolarHBondContact O-CG 3.34Å; T523-K527 PolarHBondContact O-N 3.39Å; I524-K527 PolarHBondContact O-N 2.94Å; N525-K527 VanDerWaalsContact C-N 3.34Å; N525-K527 PolarHBondContact O-N 2.96Å; K527-H531 VanDerWaalsContact O-CB 3.26Å; K527-H531 WeakPolarHBondContact O-CB 3.42Å; K527-H531 PolarHBondContact O-N 3.22Å
528	I	78	Confident	75.4	Confident	71 Å²	71	83.7 Å²	83.7	36%	0.364	44%	0.44	S	S	.	.	H	α-helix	trans	-63.8	-49	175.9	-67.9	165	0	0	0	109.2	P483 I524 N525 R526 H531 V532	P483-I528 HydrophobicContact CB-CD1 3.83Å; P483-I528 HydrophobicContact CG-CD1 3.85Å; I524-I528 HydrophobicContact CG2-CD1 3.96Å; I524-I528 WeakPolarHBondContact O-CG1 3.27Å; I524-I528 PolarHBondContact O-N 3.42Å; N525-I528 WeakPolarHBondContact O-CB 3.31Å; N525-I528 PolarHBondContact O-N 3.1Å; N525-I528 VanDerWaalsContact O-N 3.15Å; R526-I528 VanDerWaalsContact C-N 3.33Å; R526-I528 PolarHBondContact O-N 3.15Å; I528-H531 PolarHBondContact O-N 2.95Å; I528-V532 WeakPolarHBondContact O-CG2 3.24Å; I528-V532 PolarHBondContact O-N 3.29Å
529	V	80.5	Confident	77.2	Confident	65 Å²	65	86 Å²	86	39%	0.394	44%	0.437	S	S	.	.	H	α-helix	trans	-60.9	-51.9	177.8	175.6	0	0	0	0	111	N525 R526 H531 V532 D533	N525-V529 WeakPolarHBondContact O-CG2 3.43Å; N525-V529 PolarHBondContact O-N 3.45Å; R526-V529 PolarHBondContact O-N 2.98Å; V529-H531 PolarHBondContact O-N 3.02Å; V529-H531 VanDerWaalsContact O-N 3.12Å; V529-V532 CarbonylContact O-C 3.54Å; V529-V532 PolarHBondContact O-N 3Å; V529-D533 WeakPolarHBondContact O-CB 3.06Å; V529-D533 PolarHBondContact O-N 3.45Å
530	D	84.5	Confident	79.1	Confident	82 Å²	82	85.4 Å²	85.4	44%	0.439	43%	0.431	S	S	.	.	H	α-helix	trans	-55.1	-35.2	177.4	-68.8	-16.6	0	0	0	111.6	R526 Y534	R526-D530 VanDerWaalsContact O-CB 3.29Å; R526-D530 WeakPolarHBondContact O-CB 3.48Å; R526-D530 PolarHBondContact O-N 3.4Å; D530-Y534 VanDerWaalsContact O-CB 3.27Å; D530-Y534 WeakPolarHBondContact O-CB 3.17Å; D530-Y534 PolarHBondContact O-N 3.23Å
531	H	82.9	Confident	80.8	Confident	90 Å²	90	79.8 Å²	79.8	42%	0.417	42%	0.416	S	S	.	.	H	α-helix	trans	-73.8	-41.3	177.1	-167.3	68.5	0	0	0	112.5	K527 I528 V529 Y534 M535	K527-H531 VanDerWaalsContact O-CB 3.26Å; K527-H531 WeakPolarHBondContact O-CB 3.42Å; K527-H531 PolarHBondContact O-N 3.22Å; I528-H531 PolarHBondContact O-N 2.95Å; V529-H531 PolarHBondContact O-N 3.02Å; V529-H531 VanDerWaalsContact O-N 3.12Å; H531-Y534 PolarHBondContact O-N 3.32Å; H531-M535 WeakPolarHBondContact O-CB 3.32Å; H531-M535 WeakPolarHBondContact O-CG 3.41Å; H531-M535 PolarHBondContact O-N 3.24Å
532	V	85.6	Confident	82.5	Confident	66 Å²	66	81.6 Å²	81.6	40%	0.4	43%	0.429	S	S	.	.	H	α-helix	trans	-64.5	-45.5	174.7	172.4	0	0	0	0	110.3	I528 V529 Y534 M535 T536	I528-V532 WeakPolarHBondContact O-CG2 3.24Å; I528-V532 PolarHBondContact O-N 3.29Å; V529-V532 CarbonylContact O-C 3.54Å; V529-V532 PolarHBondContact O-N 3Å; V532-Y534 VanDerWaalsContact C-N 3.28Å; V532-Y534 PolarHBondContact O-N 3.49Å; V532-M535 HydrophobicContact CG2-CE 4.31Å; V532-M535 PolarHBondContact O-N 3.19Å; V532-T536 HydrophobicContact CG1-CG2 4.35Å; V532-T536 WeakPolarHBondContact O-CB 3.48Å; V532-T536 WeakPolarHBondContact O-CG2 3.47Å; V532-T536 PolarHBondContact O-N 2.97Å; V532-T536 PolarHBondContact O-OG1 3.38Å
533	D	86.7	Confident	84	Confident	91 Å²	91	78.8 Å²	78.8	49%	0.487	41%	0.411	S	S	.	.	H	α-helix	trans	-59.9	-40.7	175.8	-71.1	-13.6	0	0	0	111.1	V529 T536 S537	V529-D533 WeakPolarHBondContact O-CB 3.06Å; V529-D533 PolarHBondContact O-N 3.45Å; D533-T536 CarbonylContact O-C 3.6Å; D533-T536 PolarHBondContact O-N 3.28Å; D533-T536 PolarHBondContact O-OG1 3.32Å; D533-S537 PolarHBondContact O-N 3.08Å
534	Y	90.3	Very high	85.2	Confident	77 Å²	77	80.7 Å²	80.7	30%	0.302	41%	0.412	S	S	.	.	H	α-helix	trans	-63.3	-50.6	172.6	169.4	-106.6	0	0	0	112.1	K399 D530 H531 V532 T536 S537 Q540	K399-Y534 HydrophobicContact CD-CE1 4.42Å; K399-Y534 PolarHBondContact NZ-OH 2.99Å; D530-Y534 VanDerWaalsContact O-CB 3.27Å; D530-Y534 WeakPolarHBondContact O-CB 3.17Å; D530-Y534 PolarHBondContact O-N 3.23Å; H531-Y534 PolarHBondContact O-N 3.32Å; V532-Y534 VanDerWaalsContact C-N 3.28Å; V532-Y534 PolarHBondContact O-N 3.49Å; Y534-T536 PolarHBondContact O-N 2.89Å; Y534-S537 VanDerWaalsContact O-CB 3.32Å; Y534-S537 WeakPolarHBondContact O-CB 2.97Å; Y534-S537 PolarHBondContact O-N 2.69Å; Y534-S537 VanDerWaalsContact O-N 3.14Å; Y534-S537 PolarHBondContact O-OG 2.95Å; Y534-Q540 HydrophobicContact CD2-CG 4.32Å; Y534-Q540 HydrophobicContact CE1-CG 4.23Å; Y534-Q540 HydrophobicContact CE2-CG 3.82Å; Y534-Q540 VanDerWaalsContact CZ-CD 3.42Å; Y534-Q540 WeakPolarHBondContact O-CG 3.37Å; Y534-Q540 VanDerWaalsContact OH-CD 3.23Å; Y534-Q540 PolarHBondContact OH-NE2 2.72Å; Y534-Q540 VanDerWaalsContact OH-NE2 3.1Å; Y534-Q540 PolarHBondContact OH-OE1 2.77Å
535	M	83.9	Confident	86.2	Confident	71 Å²	71	83.8 Å²	83.8	35%	0.35	43%	0.432	S	S	.	.	H	α-helix	trans	-63.4	-29.1	-179.4	-73.3	-170.1	-59.5	0	0	112.5	H531 V532 Q540 Y544	H531-M535 WeakPolarHBondContact O-CB 3.32Å; H531-M535 WeakPolarHBondContact O-CG 3.41Å; H531-M535 PolarHBondContact O-N 3.24Å; V532-M535 HydrophobicContact CG2-CE 4.31Å; V532-M535 PolarHBondContact O-N 3.19Å; M535-Q540 WeakPolarHBondContact O-CB 3.36Å; M535-Y544 VanDerWaalsContact O-CE2 3.29Å; M535-Y544 WeakPolarHBondContact O-CE2 3.39Å
536	T	87.7	Confident	87	Confident	86 Å²	86	84.7 Å²	84.7	53%	0.528	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	6.3	179	58.9	0	0	0	0	113	V532 D533 Y534	V532-T536 HydrophobicContact CG1-CG2 4.35Å; V532-T536 WeakPolarHBondContact O-CB 3.48Å; V532-T536 WeakPolarHBondContact O-CG2 3.47Å; V532-T536 PolarHBondContact O-N 2.97Å; V532-T536 PolarHBondContact O-OG1 3.38Å; D533-T536 CarbonylContact O-C 3.6Å; D533-T536 PolarHBondContact O-N 3.28Å; D533-T536 PolarHBondContact O-OG1 3.32Å; Y534-T536 PolarHBondContact O-N 2.89Å
537	S	92.8	Very high	87.8	Confident	20 Å²	20	81.8 Å²	81.8	14%	0.14	42%	0.424	C	S	.	.	S	Bend	trans	-63.7	150.1	179.2	94.8	0	0	0	0	110.9	D533 Y534 E539 Q540 V541	D533-S537 PolarHBondContact O-N 3.08Å; Y534-S537 VanDerWaalsContact O-CB 3.32Å; Y534-S537 WeakPolarHBondContact O-CB 2.97Å; Y534-S537 PolarHBondContact O-N 2.69Å; Y534-S537 VanDerWaalsContact O-N 3.14Å; Y534-S537 PolarHBondContact O-OG 2.95Å; S537-E539 VanDerWaalsContact CB-OE2 3.32Å; S537-E539 WeakPolarHBondContact CB-OE2 3.4Å; S537-E539 PolarHBondContact O-N 3.12Å; S537-E539 VanDerWaalsContact O-N 3.08Å; S537-E539 PolarHBondContact OG-OE2 3.11Å; S537-Q540 PolarHBondContact O-N 3.43Å; S537-Q540 PolarHBondContact OG-N 3.18Å; S537-V541 WeakPolarHBondContact O-CG2 3.34Å; S537-V541 PolarHBondContact O-N 3.28Å
538	P	93.3	Very high	88.3	Confident	101 Å²	101	81.5 Å²	81.5	66%	0.656	42%	0.423	S	S	*	.	H	α-helix	trans	-52.1	-35.7	179.2	-27.6	35.5	0	0	0	113.3	A542	P538-A542 WeakPolarHBondContact O-CB 3.46Å; P538-A542 PolarHBondContact O-N 2.73Å
539	E	93.6	Very high	88.9	Confident	128 Å²	128	84.3 Å²	84.3	60%	0.598	43%	0.429	S	S	*	.	H	α-helix	trans	-69.1	-43.4	178.4	-55.2	73.8	-159.1	0	0	112.2	S537 E543	S537-E539 VanDerWaalsContact CB-OE2 3.32Å; S537-E539 WeakPolarHBondContact CB-OE2 3.4Å; S537-E539 PolarHBondContact O-N 3.12Å; S537-E539 VanDerWaalsContact O-N 3.08Å; S537-E539 PolarHBondContact OG-OE2 3.11Å; E539-E543 WeakPolarHBondContact O-CB 3.45Å; E539-E543 PolarHBondContact O-N 2.97Å
540	Q	93.6	Very high	89.4	Confident	39 Å²	39	84.1 Å²	84.1	18%	0.182	43%	0.426	C	S	.	.	H	α-helix	trans	-67.4	-43.7	176.8	-68.9	-48.8	-70.4	0	0	111.1	Y534 M535 S537 A542 E543 Y544	Y534-Q540 HydrophobicContact CD2-CG 4.32Å; Y534-Q540 HydrophobicContact CE1-CG 4.23Å; Y534-Q540 HydrophobicContact CE2-CG 3.82Å; Y534-Q540 VanDerWaalsContact CZ-CD 3.42Å; Y534-Q540 WeakPolarHBondContact O-CG 3.37Å; Y534-Q540 VanDerWaalsContact OH-CD 3.23Å; Y534-Q540 PolarHBondContact OH-NE2 2.72Å; Y534-Q540 VanDerWaalsContact OH-NE2 3.1Å; Y534-Q540 PolarHBondContact OH-OE1 2.77Å; M535-Q540 WeakPolarHBondContact O-CB 3.36Å; S537-Q540 PolarHBondContact O-N 3.43Å; S537-Q540 PolarHBondContact OG-N 3.18Å; Q540-A542 VanDerWaalsContact C-N 3.34Å; Q540-A542 PolarHBondContact O-N 2.73Å; Q540-E543 CarbonylContact O-C 3.54Å; Q540-E543 PolarHBondContact O-N 3.36Å; Q540-E543 VanDerWaalsContact O-N 3.15Å; Q540-Y544 HydrophobicContact CB-CE2 3.99Å; Q540-Y544 WeakPolarHBondContact O-CD1 3.3Å; Q540-Y544 VanDerWaalsContact O-CD2 3.29Å; Q540-Y544 WeakPolarHBondContact O-CD2 3.5Å; Q540-Y544 PolarHBondContact O-N 3.11Å
541	V	90.4	Very high	89.6	Confident	66 Å²	66	84.1 Å²	84.1	40%	0.4	43%	0.432	S	S	.	.	H	α-helix	trans	-60.9	-44.6	176.5	176.2	0	0	0	0	110.6	S537 E543 Y544 V545	S537-V541 WeakPolarHBondContact O-CG2 3.34Å; S537-V541 PolarHBondContact O-N 3.28Å; V541-E543 VanDerWaalsContact C-N 3.31Å; V541-E543 PolarHBondContact O-N 2.95Å; V541-Y544 PolarHBondContact O-N 3.2Å; V541-V545 HydrophobicContact CG1-CG2 4.41Å; V541-V545 VanDerWaalsContact O-CG2 3.32Å; V541-V545 WeakPolarHBondContact O-CG2 3.43Å; V541-V545 PolarHBondContact O-N 3.31Å
542	A	92.3	Very high	89.8	Confident	57 Å²	57	85.8 Å²	85.8	47%	0.471	44%	0.436	S	S	.	.	H	α-helix	trans	-59.2	-41.6	174.8	0	0	0	0	0	112	P538 Q540 V545 K546	P538-A542 WeakPolarHBondContact O-CB 3.46Å; P538-A542 PolarHBondContact O-N 2.73Å; Q540-A542 VanDerWaalsContact C-N 3.34Å; Q540-A542 PolarHBondContact O-N 2.73Å; A542-V545 PolarHBondContact O-N 2.8Å; A542-K546 VanDerWaalsContact O-CB 3.24Å; A542-K546 WeakPolarHBondContact O-CB 3.29Å; A542-K546 PolarHBondContact O-N 3.42Å
543	E	92.7	Very high	90.2	Very high	73 Å²	73	87.8 Å²	87.8	34%	0.341	44%	0.436	S	S	.	.	H	α-helix	trans	-67.4	-37.2	176.3	-175.8	63.8	-172.1	0	0	112.4	E539 Q540 V541 K546 K547	E539-E543 WeakPolarHBondContact O-CB 3.45Å; E539-E543 PolarHBondContact O-N 2.97Å; Q540-E543 CarbonylContact O-C 3.54Å; Q540-E543 PolarHBondContact O-N 3.36Å; Q540-E543 VanDerWaalsContact O-N 3.15Å; V541-E543 VanDerWaalsContact C-N 3.31Å; V541-E543 PolarHBondContact O-N 2.95Å; E543-K546 PolarHBondContact O-N 3.15Å; E543-K547 HydrophobicContact CG-CD 4.38Å; E543-K547 WeakPolarHBondContact O-CB 3.36Å; E543-K547 WeakPolarHBondContact O-CG 3.26Å; E543-K547 PolarHBondContact O-N 2.95Å; E543-K547 VanDerWaalsContact OE1-CE 3.22Å; E543-K547 WeakPolarHBondContact OE1-CE 3.41Å; E543-K547 IonicContact OE1-NZ 3.45Å
544	Y	89.3	Confident	90.3	Very high	106 Å²	106	86 Å²	86	42%	0.416	43%	0.429	S	S	.	.	H	α-helix	trans	-65.9	-44.5	174.5	-58.5	-27.3	0	0	0	111.5	M535 Q540 V541 K546 K547 F548	M535-Y544 VanDerWaalsContact O-CE2 3.29Å; M535-Y544 WeakPolarHBondContact O-CE2 3.39Å; Q540-Y544 HydrophobicContact CB-CE2 3.99Å; Q540-Y544 WeakPolarHBondContact O-CD1 3.3Å; Q540-Y544 VanDerWaalsContact O-CD2 3.29Å; Q540-Y544 WeakPolarHBondContact O-CD2 3.5Å; Q540-Y544 PolarHBondContact O-N 3.11Å; V541-Y544 PolarHBondContact O-N 3.2Å; Y544-K546 VanDerWaalsContact C-N 3.33Å; Y544-K547 PolarHBondContact O-N 3.17Å; Y544-F548 VanDerWaalsContact O-CB 3.32Å; Y544-F548 WeakPolarHBondContact O-CB 3.41Å; Y544-F548 PolarHBondContact O-N 2.96Å
545	V	88.1	Confident	90.2	Very high	91 Å²	91	90.2 Å²	90.2	55%	0.552	46%	0.457	S	S	*	.	H	α-helix	trans	-62.3	-43.1	175.1	172	0	0	0	0	110.5	V541 A542 F548 R549	V541-V545 HydrophobicContact CG1-CG2 4.41Å; V541-V545 VanDerWaalsContact O-CG2 3.32Å; V541-V545 WeakPolarHBondContact O-CG2 3.43Å; V541-V545 PolarHBondContact O-N 3.31Å; A542-V545 PolarHBondContact O-N 2.8Å; V545-F548 PolarHBondContact O-N 3.12Å; V545-R549 WeakPolarHBondContact O-CB 3.46Å; V545-R549 PolarHBondContact O-N 3.24Å
546	K	90.1	Very high	90.5	Very high	98 Å²	98	89.8 Å²	89.8	43%	0.426	47%	0.471	S	S	.	.	H	α-helix	trans	-60.9	-49.2	175.9	-178.1	-179.5	175.7	-171.7	0	111.4	A542 E543 Y544 F548 R549 D550	A542-K546 VanDerWaalsContact O-CB 3.24Å; A542-K546 WeakPolarHBondContact O-CB 3.29Å; A542-K546 PolarHBondContact O-N 3.42Å; E543-K546 PolarHBondContact O-N 3.15Å; Y544-K546 VanDerWaalsContact C-N 3.33Å; K546-F548 VanDerWaalsContact C-N 3.32Å; K546-F548 PolarHBondContact O-N 2.98Å; K546-R549 PolarHBondContact O-N 3.09Å; K546-D550 WeakPolarHBondContact CG-OD2 3.31Å; K546-D550 WeakPolarHBondContact O-CB 3.44Å; K546-D550 PolarHBondContact O-N 3.16Å
547	K	90.8	Very high	90.6	Very high	114 Å²	114	91.6 Å²	91.6	50%	0.496	48%	0.476	S	S	.	.	H	α-helix	trans	-60.7	-41.3	176.3	-77.7	174.3	179.9	165.8	0	112.2	E543 Y544 S551	E543-K547 HydrophobicContact CG-CD 4.38Å; E543-K547 WeakPolarHBondContact O-CB 3.36Å; E543-K547 WeakPolarHBondContact O-CG 3.26Å; E543-K547 PolarHBondContact O-N 2.95Å; E543-K547 VanDerWaalsContact OE1-CE 3.22Å; E543-K547 WeakPolarHBondContact OE1-CE 3.41Å; E543-K547 IonicContact OE1-NZ 3.45Å; Y544-K547 PolarHBondContact O-N 3.17Å; K547-S551 VanDerWaalsContact O-CB 3.27Å; K547-S551 WeakPolarHBondContact O-CB 3.38Å; K547-S551 PolarHBondContact O-N 3.24Å; K547-S551 PolarHBondContact O-OG 3.39Å
548	F	87.3	Confident	90.6	Very high	119 Å²	119	96 Å²	96	52%	0.522	50%	0.497	S	S	.	.	H	α-helix	trans	-61	-51.9	175.4	177.5	-93.5	0	0	0	110.7	Y544 V545 K546 D550 S551 Y552 W553	Y544-F548 VanDerWaalsContact O-CB 3.32Å; Y544-F548 WeakPolarHBondContact O-CB 3.41Å; Y544-F548 PolarHBondContact O-N 2.96Å; V545-F548 PolarHBondContact O-N 3.12Å; K546-F548 VanDerWaalsContact C-N 3.32Å; K546-F548 PolarHBondContact O-N 2.98Å; F548-D550 PolarHBondContact O-N 3.38Å; F548-S551 PolarHBondContact O-N 2.95Å; F548-Y552 HydrophobicContact CD2-CD2 4.15Å; F548-Y552 AromaticContact CD2-CE2 3.96Å; F548-Y552 HydrophobicContact CD2-CE2 3.96Å; F548-Y552 HydrophobicContact CE1-CD2 4.46Å; F548-Y552 AromaticContact CE2-CD2 3.86Å; F548-Y552 HydrophobicContact CE2-CD2 3.86Å; F548-Y552 AromaticContact CE2-CE2 3.47Å; F548-Y552 HydrophobicContact CE2-CE2 3.47Å; F548-Y552 VanDerWaalsContact CE2-CE2 3.47Å; F548-Y552 HydrophobicContact CZ-CD2 4.03Å; F548-Y552 AromaticContact CZ-CE2 3.94Å; F548-Y552 HydrophobicContact CZ-CE2 3.94Å; F548-Y552 WeakPolarHBondContact O-CD2 3.32Å; F548-Y552 PolarHBondContact O-N 3.31Å; F548-W553 HydrophobicContact CE1-CZ3 4.39Å
549	R	90.6	Very high	90.3	Very high	130 Å²	130	93 Å²	93	49%	0.491	48%	0.482	S	S	.	.	H	α-helix	trans	-55.9	-51.1	175.9	-179.4	-160.8	67.9	-169.7	1.6	111.2	V545 K546 S551 Y552 W553	V545-R549 WeakPolarHBondContact O-CB 3.46Å; V545-R549 PolarHBondContact O-N 3.24Å; K546-R549 PolarHBondContact O-N 3.09Å; R549-S551 PolarHBondContact O-N 2.91Å; R549-Y552 PolarHBondContact O-N 3.45Å; R549-W553 CarbonylContact O-C 3.57Å; R549-W553 WeakPolarHBondContact O-CA 3.15Å; R549-W553 PolarHBondContact O-N 3.03Å
550	D	90.7	Very high	90.1	Very high	62 Å²	62	95.6 Å²	95.6	33%	0.332	49%	0.494	S	S	.	.	H	α-helix	trans	-70.4	-21.5	-175	-64.5	-12.1	0	0	0	112.3	K546 F548 P554	K546-D550 WeakPolarHBondContact CG-OD2 3.31Å; K546-D550 WeakPolarHBondContact O-CB 3.44Å; K546-D550 PolarHBondContact O-N 3.16Å; F548-D550 PolarHBondContact O-N 3.38Å; D550-P554 WeakPolarHBondContact O-CA 3.49Å; D550-P554 WeakPolarHBondContact O-CD 3.45Å
551	S	89.4	Confident	89.7	Confident	82 Å²	82	100.2 Å²	100.2	57%	0.573	53%	0.525	S	S	*	.	H	α-helix	trans	-77	-37.2	174.4	-60.8	0	0	0	0	112.7	K547 F548 R549 A559	K547-S551 VanDerWaalsContact O-CB 3.27Å; K547-S551 WeakPolarHBondContact O-CB 3.38Å; K547-S551 PolarHBondContact O-N 3.24Å; K547-S551 PolarHBondContact O-OG 3.39Å; F548-S551 PolarHBondContact O-N 2.95Å; R549-S551 PolarHBondContact O-N 2.91Å; S551-A559 WeakPolarHBondContact O-CB 3.35Å
552	Y	87.4	Confident	89.1	Confident	124 Å²	124	102 Å²	102	49%	0.486	54%	0.537	S	S	.	.	H	α-helix	trans	-93	-32.1	-179.7	-81.2	-95.4	0	0	0	112.8	F548 R549 L558 A559	F548-Y552 HydrophobicContact CD2-CD2 4.15Å; F548-Y552 AromaticContact CD2-CE2 3.96Å; F548-Y552 HydrophobicContact CD2-CE2 3.96Å; F548-Y552 HydrophobicContact CE1-CD2 4.46Å; F548-Y552 AromaticContact CE2-CD2 3.86Å; F548-Y552 HydrophobicContact CE2-CD2 3.86Å; F548-Y552 AromaticContact CE2-CE2 3.47Å; F548-Y552 HydrophobicContact CE2-CE2 3.47Å; F548-Y552 VanDerWaalsContact CE2-CE2 3.47Å; F548-Y552 HydrophobicContact CZ-CD2 4.03Å; F548-Y552 AromaticContact CZ-CE2 3.94Å; F548-Y552 HydrophobicContact CZ-CE2 3.94Å; F548-Y552 WeakPolarHBondContact O-CD2 3.32Å; F548-Y552 PolarHBondContact O-N 3.31Å; R549-Y552 PolarHBondContact O-N 3.45Å; Y552-L558 CarbonylContact O-C 3.56Å; Y552-L558 VanDerWaalsContact O-CA 3.32Å; Y552-L558 WeakPolarHBondContact O-CA 3.41Å; Y552-A559 PolarHBondContact O-N 3.35Å
553	W	93	Very high	88.8	Confident	109 Å²	109	105 Å²	105	41%	0.413	55%	0.552	S	S	.	*	S	Bend	trans	-131.8	63.8	-179.5	-63.5	-85.6	0	0	0	111.7	F548 R549 N555 G556 I557 L558	F548-W553 HydrophobicContact CE1-CZ3 4.39Å; R549-W553 CarbonylContact O-C 3.57Å; R549-W553 WeakPolarHBondContact O-CA 3.15Å; R549-W553 PolarHBondContact O-N 3.03Å; W553-N555 PolarHBondContact O-N 3.47Å; W553-G556 PolarHBondContact O-N 3.18Å; W553-I557 CarbonylContact C-O 3.55Å; W553-I557 WeakPolarHBondContact CA-O 3.34Å; W553-L558 HydrophobicContact CZ2-CD1 4.28Å
554	P	90.2	Very high	88.3	Confident	53 Å²	53	113.3 Å²	113.3	34%	0.344	58%	0.58	S	S	.	*	G	3₁₀ helix	trans	-55	124.4	171.9	24.7	-34.9	0	0	0	109.7	D550 G556 I557 A559	D550-P554 WeakPolarHBondContact O-CA 3.49Å; D550-P554 WeakPolarHBondContact O-CD 3.45Å; P554-G556 PolarHBondContact O-N 3.13Å; P554-G556 VanDerWaalsContact O-N 3.11Å; P554-I557 WeakPolarHBondContact CD-O 3.49Å; P554-I557 PolarHBondContact O-N 3.26Å; P554-I557 VanDerWaalsContact O-N 3.09Å; P554-A559 HydrophobicContact CG-CB 4.05Å
555	N	87.6	Confident	88	Confident	165 Å²	165	115 Å²	115	88%	0.882	59%	0.586	S	S	*	*	G	3₁₀ helix	trans	55.3	25.4	-175.7	-52.2	-42.2	0	0	0	114.4	W553 I557	W553-N555 PolarHBondContact O-N 3.47Å; N555-I557 VanDerWaalsContact C-N 3.33Å
556	G	89	Confident	88.1	Confident	62 Å²	62	114.8 Å²	114.8	64%	0.639	58%	0.582	S	S	*	*	G	3₁₀ helix	trans	83.2	2.7	-179.5	0	0	0	0	0	115	W553 P554	W553-G556 PolarHBondContact O-N 3.18Å; P554-G556 PolarHBondContact O-N 3.13Å; P554-G556 VanDerWaalsContact O-N 3.11Å
557	I	90.9	Very high	88	Confident	124 Å²	124	116.1 Å²	116.1	64%	0.636	59%	0.588	S	S	*	*	S	Bend	trans	-107.4	133.1	179.7	-56.6	173.1	0	0	0	108.7	W553 P554 N555 A559	W553-I557 CarbonylContact C-O 3.55Å; W553-I557 WeakPolarHBondContact CA-O 3.34Å; P554-I557 WeakPolarHBondContact CD-O 3.49Å; P554-I557 PolarHBondContact O-N 3.26Å; P554-I557 VanDerWaalsContact O-N 3.09Å; N555-I557 VanDerWaalsContact C-N 3.33Å; I557-A559 PolarHBondContact O-N 3.34Å
558	L	91.7	Very high	87.9	Confident	113 Å²	113	113 Å²	113	59%	0.592	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-54.2	125.4	178.3	-174.4	71.9	0	0	0	110.2	Y552 W553 E560	Y552-L558 CarbonylContact O-C 3.56Å; Y552-L558 VanDerWaalsContact O-CA 3.32Å; Y552-L558 WeakPolarHBondContact O-CA 3.41Å; W553-L558 HydrophobicContact CZ2-CD1 4.28Å; L558-E560 PolarHBondContact O-N 2.72Å
559	A	88.8	Confident	87.9	Confident	39 Å²	39	110.5 Å²	110.5	32%	0.322	57%	0.571	S	S	.	*	P	Polyproline II helix	trans	-60	133.6	-178.7	0	0	0	0	0	110.6	S551 Y552 P554 I557	S551-A559 WeakPolarHBondContact O-CB 3.35Å; Y552-A559 PolarHBondContact O-N 3.35Å; P554-A559 HydrophobicContact CG-CB 4.05Å; I557-A559 PolarHBondContact O-N 3.34Å
560	E	89	Confident	87.9	Confident	182 Å²	182	110.4 Å²	110.4	85%	0.85	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-62.8	149.7	171.6	-66.9	-173.4	171.4	0	0	110.5	L558 P562	L558-E560 PolarHBondContact O-N 2.72Å; E560-P562 VanDerWaalsContact O-CD 3.27Å; E560-P562 WeakPolarHBondContact O-CD 3.44Å; E560-P562 VanDerWaalsContact O-N 3.14Å
561	T	84	Confident	88	Confident	136 Å²	136	109.2 Å²	109.2	83%	0.834	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-64.8	118.2	177.2	-60.8	0	0	0	0	108.7
562	P	79.4	Confident	88	Confident	103 Å²	103	109.4 Å²	109.4	67%	0.669	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-63.3	144.8	-178.9	24.4	-32.5	0	0	0	110.2	E560	E560-P562 VanDerWaalsContact O-CD 3.27Å; E560-P562 WeakPolarHBondContact O-CD 3.44Å; E560-P562 VanDerWaalsContact O-N 3.14Å
563	P	84.4	Confident	88.1	Confident	120 Å²	120	106 Å²	106	78%	0.779	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-60	146.5	179	25.1	-33.7	0	0	0	110.5	R565	P563-R565 PolarHBondContact O-N 3.38Å
564	R	82.9	Confident	88	Confident	248 Å²	248	102.3 Å²	102.3	94%	0.936	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-60.6	127.2	176.5	-75.3	-172.3	176.8	-176.8	1.5	109.3	D566	R564-D566 PolarHBondContact O-N 3Å
565	R	82.6	Confident	87.8	Confident	142 Å²	142	100.6 Å²	100.6	54%	0.536	52%	0.518	S	S	.	.	P	Polyproline II helix	trans	-59.8	129.1	177.8	-63.5	-173.3	69.9	-175.7	3.3	110.7	P563 R570 T573	P563-R565 PolarHBondContact O-N 3.38Å; R565-R570 HydrophobicContact CB-CG 3.92Å; R565-R570 PolarHBondContact O-NE 2.9Å; R565-R570 VanDerWaalsContact O-NE 3.1Å; R565-T573 PolarHBondContact NH2-OG1 3.41Å
566	D	89.8	Confident	87.7	Confident	85 Å²	85	95.2 Å²	95.2	46%	0.455	50%	0.497	S	S	.	.	P	Polyproline II helix	trans	-56.7	150.6	176.3	173.7	52.2	0	0	0	112.3	R564 C568 I569 R570	R564-D566 PolarHBondContact O-N 3Å; D566-C568 WeakPolarHBondContact OD2-CA 3.34Å; D566-C568 VanDerWaalsContact OD2-CB 3.28Å; D566-C568 WeakPolarHBondContact OD2-CB 3.46Å; D566-C568 PolarHBondContact OD2-N 3.25Å; D566-I569 HydrophobicContact CB-CB 4.3Å; D566-I569 HydrophobicContact CB-CD1 3.96Å; D566-I569 HydrophobicContact CB-CG1 4.04Å; D566-I569 PolarHBondContact O-N 2.87Å; D566-I569 PolarHBondContact OD2-N 3.31Å; D566-R570 WeakPolarHBondContact O-CG 3.48Å; D566-R570 PolarHBondContact O-N 3.25Å; D566-R570 PolarHBondContact O-NE 3.26Å
567	K	89.7	Confident	87.7	Confident	127 Å²	127	93.9 Å²	93.9	55%	0.552	48%	0.48	S	S	*	.	H	α-helix	trans	-61.1	-44.1	-179.3	-172.3	-176.4	175.1	-169.9	0	111.4	R570 M571	K567-R570 WeakPolarHBondContact O-CB 3.27Å; K567-R570 PolarHBondContact O-N 3.35Å; K567-M571 WeakPolarHBondContact O-CG 3.3Å; K567-M571 PolarHBondContact O-N 3.04Å
568	C	87.2	Confident	87.4	Confident	48 Å²	48	88.5 Å²	88.5	32%	0.324	45%	0.452	S	S	.	.	H	α-helix	trans	-67.7	-39.6	-179.8	-68.6	0	0	0	0	111.2	A15 D566 R570 M571 R572	A15-C568 HydrophobicContact CB-CB 4.2Å; D566-C568 WeakPolarHBondContact OD2-CA 3.34Å; D566-C568 VanDerWaalsContact OD2-CB 3.28Å; D566-C568 WeakPolarHBondContact OD2-CB 3.46Å; D566-C568 PolarHBondContact OD2-N 3.25Å; C568-R570 VanDerWaalsContact C-N 3.33Å; C568-R570 PolarHBondContact O-N 3.27Å; C568-M571 PolarHBondContact O-N 2.8Å; C568-R572 WeakPolarHBondContact O-CG 3.47Å; C568-R572 PolarHBondContact O-N 3.4Å
569	I	88.6	Confident	87	Confident	67 Å²	67	86.7 Å²	86.7	34%	0.344	45%	0.445	S	S	.	.	H	α-helix	trans	-59.5	-45	172.6	-63.7	178.5	0	0	0	110.9	D566 R572 T573	D566-I569 HydrophobicContact CB-CB 4.3Å; D566-I569 HydrophobicContact CB-CD1 3.96Å; D566-I569 HydrophobicContact CB-CG1 4.04Å; D566-I569 PolarHBondContact O-N 2.87Å; D566-I569 PolarHBondContact OD2-N 3.31Å; I569-R572 PolarHBondContact O-N 3.02Å; I569-T573 WeakPolarHBondContact O-CB 3.39Å; I569-T573 PolarHBondContact O-N 3.34Å; I569-T573 PolarHBondContact O-OG1 2.97Å
570	R	89.6	Confident	86.8	Confident	128 Å²	128	88.5 Å²	88.5	48%	0.483	46%	0.456	S	S	.	.	H	α-helix	trans	-60.2	-47.5	177	-75.5	-178.6	-72.6	165.7	-0.8	111.2	R565 D566 K567 C568 T573 R574	R565-R570 HydrophobicContact CB-CG 3.92Å; R565-R570 PolarHBondContact O-NE 2.9Å; R565-R570 VanDerWaalsContact O-NE 3.1Å; D566-R570 WeakPolarHBondContact O-CG 3.48Å; D566-R570 PolarHBondContact O-N 3.25Å; D566-R570 PolarHBondContact O-NE 3.26Å; K567-R570 WeakPolarHBondContact O-CB 3.27Å; K567-R570 PolarHBondContact O-N 3.35Å; C568-R570 VanDerWaalsContact C-N 3.33Å; C568-R570 PolarHBondContact O-N 3.27Å; R570-T573 WeakPolarHBondContact O-CB 3.5Å; R570-T573 PolarHBondContact O-N 3.49Å; R570-R574 WeakPolarHBondContact O-CG 3.2Å; R570-R574 PolarHBondContact O-N 3.38Å
571	M	92.1	Very high	86.6	Confident	36 Å²	36	82.5 Å²	82.5	18%	0.177	43%	0.429	C	S	.	.	H	α-helix	trans	-61.7	-44.9	179.9	-69.2	-48.9	108.2	0	0	112.6	A11 E12 A15 K567 C568 T573 R574 V575	A11-M571 HydrophobicContact CB-CG 4.23Å; A11-M571 HydrophobicContact CB-SD 4.08Å; A11-M571 WeakPolarHBondContact O-CG 3.37Å; E12-M571 HydrophobicContact CG-SD 4.26Å; A15-M571 HydrophobicContact CB-CB 3.46Å; A15-M571 VanDerWaalsContact CB-CB 3.46Å; A15-M571 HydrophobicContact CB-CG 4.3Å; K567-M571 WeakPolarHBondContact O-CG 3.3Å; K567-M571 PolarHBondContact O-N 3.04Å; C568-M571 PolarHBondContact O-N 2.8Å; M571-T573 VanDerWaalsContact C-N 3.34Å; M571-T573 PolarHBondContact O-N 3.13Å; M571-R574 WeakPolarHBondContact O-CB 3.17Å; M571-R574 PolarHBondContact O-N 3.04Å; M571-V575 PolarHBondContact O-N 3.13Å
572	R	89.6	Confident	86.2	Confident	86 Å²	86	78.1 Å²	78.1	33%	0.325	40%	0.4	S	S	.	.	H	α-helix	trans	-62.3	-40.3	174.3	-71.4	-175	-72.9	138.7	-10	112.5	A15 V16 C568 I569 R574 V575 A576	A15-R572 HydrophobicContact CB-CG 4.08Å; A15-R572 WeakPolarHBondContact O-CD 3.21Å; A15-R572 WeakPolarHBondContact O-CG 3.3Å; V16-R572 HydrophobicContact CG2-CG 4.21Å; C568-R572 WeakPolarHBondContact O-CG 3.47Å; C568-R572 PolarHBondContact O-N 3.4Å; I569-R572 PolarHBondContact O-N 3.02Å; R572-R574 VanDerWaalsContact C-N 3.27Å; R572-R574 PolarHBondContact O-N 2.92Å; R572-V575 WeakPolarHBondContact O-CB 3.47Å; R572-V575 PolarHBondContact O-N 2.81Å; R572-V575 VanDerWaalsContact O-N 3.15Å; R572-A576 PolarHBondContact O-N 3.3Å
573	T	89.4	Confident	85.9	Confident	54 Å²	54	76.3 Å²	76.3	33%	0.331	40%	0.401	S	S	.	.	H	α-helix	trans	-63	-35.1	176.6	-54.4	0	0	0	0	111.6	R565 I569 R570 M571 A576 A577	R565-T573 PolarHBondContact NH2-OG1 3.41Å; I569-T573 WeakPolarHBondContact O-CB 3.39Å; I569-T573 PolarHBondContact O-N 3.34Å; I569-T573 PolarHBondContact O-OG1 2.97Å; R570-T573 WeakPolarHBondContact O-CB 3.5Å; R570-T573 PolarHBondContact O-N 3.49Å; M571-T573 VanDerWaalsContact C-N 3.34Å; M571-T573 PolarHBondContact O-N 3.13Å; T573-A576 PolarHBondContact O-N 2.84Å; T573-A577 VanDerWaalsContact O-CB 3.26Å; T573-A577 WeakPolarHBondContact O-CB 3.43Å; T573-A577 PolarHBondContact O-N 2.99Å
574	R	91	Very high	85.6	Confident	31 Å²	31	76.6 Å²	76.6	12%	0.117	40%	0.395	C	S	.	.	H	α-helix	trans	-62.6	-44	173.7	-65.4	171.6	63.1	79.3	5.6	111.5	E12 R570 M571 R572 A577 K578 F606 D607 Q610	E12-R574 IonicContact OE1-CZ 2.74Å; E12-R574 IonicContact OE1-NE 3.99Å; E12-R574 PolarHBondContact OE1-NE 3.36Å; E12-R574 IonicContact OE1-NH2 3.26Å; E12-R574 PolarHBondContact OE1-NH2 3.27Å; R570-R574 WeakPolarHBondContact O-CG 3.2Å; R570-R574 PolarHBondContact O-N 3.38Å; M571-R574 WeakPolarHBondContact O-CB 3.17Å; M571-R574 PolarHBondContact O-N 3.04Å; R572-R574 VanDerWaalsContact C-N 3.27Å; R572-R574 PolarHBondContact O-N 2.92Å; R574-A577 PolarHBondContact O-N 3.21Å; R574-K578 WeakPolarHBondContact O-CB 3.36Å; R574-K578 VanDerWaalsContact O-CG 3.24Å; R574-K578 WeakPolarHBondContact O-CG 3.48Å; R574-K578 PolarHBondContact O-N 3.22Å; R574-F606 HydrophobicContact CB-CZ 3.85Å; R574-F606 HydrophobicContact CG-CZ 3.98Å; R574-D607 IonicContact NH2-OD1 2.91Å; R574-Q610 VanDerWaalsContact NH1-CD 3.29Å
575	V	85.8	Confident	84.9	Confident	16 Å²	16	66.6 Å²	66.6	10%	0.097	36%	0.359	C	S	.	.	H	α-helix	trans	-61.6	-45.8	176.5	173	0	0	0	0	111	I3 L4 E12 V16 M571 R572 K578 T579	I3-V575 HydrophobicContact CG2-CG1 3.89Å; L4-V575 HydrophobicContact CD2-CG1 3.87Å; L4-V575 HydrophobicContact CD2-CG2 4.46Å; E12-V575 HydrophobicContact CB-CG2 3.82Å; E12-V575 HydrophobicContact CG-CG2 4.33Å; V16-V575 HydrophobicContact CG2-CB 4.44Å; V16-V575 HydrophobicContact CG2-CG1 4.4Å; V16-V575 HydrophobicContact CG2-CG2 4.1Å; M571-V575 PolarHBondContact O-N 3.13Å; R572-V575 WeakPolarHBondContact O-CB 3.47Å; R572-V575 PolarHBondContact O-N 2.81Å; R572-V575 VanDerWaalsContact O-N 3.15Å; V575-K578 PolarHBondContact O-N 3.33Å; V575-T579 WeakPolarHBondContact O-CB 3.5Å; V575-T579 PolarHBondContact O-N 2.9Å; V575-T579 PolarHBondContact O-OG1 3.11Å
576	A	86.6	Confident	84.2	Confident	53 Å²	53	62.8 Å²	62.8	44%	0.438	35%	0.353	S	S	.	.	H	α-helix	trans	-60.9	-49.2	176.6	0	0	0	0	0	111.4	R572 T573 K578 T579 S580	R572-A576 PolarHBondContact O-N 3.3Å; T573-A576 PolarHBondContact O-N 2.84Å; A576-K578 PolarHBondContact O-N 2.94Å; A576-T579 WeakPolarHBondContact O-CA 3.39Å; A576-T579 WeakPolarHBondContact O-CB 3.41Å; A576-T579 PolarHBondContact O-N 2.87Å; A576-T579 VanDerWaalsContact O-N 3.07Å; A576-S580 PolarHBondContact O-N 3.39Å; A576-S580 PolarHBondContact O-OG 3.25Å
577	A	88.1	Confident	82.7	Confident	34 Å²	34	63.9 Å²	63.9	28%	0.281	36%	0.358	S	S	.	.	H	α-helix	trans	-60.7	-43.6	179	0	0	0	0	0	112.6	T573 R574 T579 S580 L581 F606	T573-A577 VanDerWaalsContact O-CB 3.26Å; T573-A577 WeakPolarHBondContact O-CB 3.43Å; T573-A577 PolarHBondContact O-N 2.99Å; R574-A577 PolarHBondContact O-N 3.21Å; A577-T579 VanDerWaalsContact C-N 3.29Å; A577-T579 PolarHBondContact O-N 2.92Å; A577-S580 PolarHBondContact O-N 2.89Å; A577-L581 WeakPolarHBondContact O-CB 3.23Å; A577-L581 VanDerWaalsContact O-CG 3.3Å; A577-L581 WeakPolarHBondContact O-CG 3.37Å; A577-L581 PolarHBondContact O-N 2.87Å; A577-F606 HydrophobicContact CB-CD2 4.39Å; A577-F606 HydrophobicContact CB-CE2 3.76Å
578	K	86.3	Confident	81.2	Confident	11 Å²	11	63.4 Å²	63.4	5%	0.048	36%	0.358	C	S	.	.	H	α-helix	trans	-60.4	-40	173.6	-72.4	175.5	176.3	-179.8	0	111.7	I3 E12 R574 V575 A576 L582 L603 F606	I3-K578 HydrophobicContact CD1-CB 3.93Å; I3-K578 HydrophobicContact CG1-CB 4.33Å; I3-K578 HydrophobicContact CG2-CB 4.34Å; I3-K578 HydrophobicContact CG2-CD 4.44Å; E12-K578 VanDerWaalsContact CD-NZ 3.25Å; E12-K578 IonicContact OE1-NZ 3.42Å; E12-K578 PolarHBondContact OE1-NZ 3.45Å; E12-K578 IonicContact OE2-NZ 3.28Å; E12-K578 PolarHBondContact OE2-NZ 3.24Å; R574-K578 WeakPolarHBondContact O-CB 3.36Å; R574-K578 VanDerWaalsContact O-CG 3.24Å; R574-K578 WeakPolarHBondContact O-CG 3.48Å; R574-K578 PolarHBondContact O-N 3.22Å; V575-K578 PolarHBondContact O-N 3.33Å; A576-K578 PolarHBondContact O-N 2.94Å; K578-L582 WeakPolarHBondContact O-CG 3.36Å; K578-L582 PolarHBondContact O-N 2.88Å; K578-L603 HydrophobicContact CB-CD2 4.06Å; K578-L603 HydrophobicContact CD-CD2 3.76Å; K578-L603 HydrophobicContact CG-CD2 3.57Å; K578-F606 HydrophobicContact CD-CD1 4.49Å; K578-F606 HydrophobicContact CD-CE1 4.23Å; K578-F606 VanDerWaalsContact CE-CE1 3.41Å; K578-F606 HydrophobicContact CG-CD1 3.96Å; K578-F606 HydrophobicContact CG-CD2 4.33Å; K578-F606 HydrophobicContact CG-CE1 3.9Å; K578-F606 HydrophobicContact CG-CE2 4.31Å; K578-F606 HydrophobicContact CG-CG 4.15Å; K578-F606 HydrophobicContact CG-CZ 4.09Å
579	T	81.7	Confident	79.9	Confident	74 Å²	74	62.5 Å²	62.5	45%	0.454	35%	0.35	S	S	.	.	H	α-helix	trans	-65	-46.8	177.9	-55.7	0	0	0	0	110.9	V575 A576 A577 L582 G583	V575-T579 WeakPolarHBondContact O-CB 3.5Å; V575-T579 PolarHBondContact O-N 2.9Å; V575-T579 PolarHBondContact O-OG1 3.11Å; A576-T579 WeakPolarHBondContact O-CA 3.39Å; A576-T579 WeakPolarHBondContact O-CB 3.41Å; A576-T579 PolarHBondContact O-N 2.87Å; A576-T579 VanDerWaalsContact O-N 3.07Å; A577-T579 VanDerWaalsContact C-N 3.29Å; A577-T579 PolarHBondContact O-N 2.92Å; T579-L582 PolarHBondContact O-N 3.43Å; T579-G583 PolarHBondContact O-N 3.41Å
580	S	84.8	Confident	78.5	Confident	77 Å²	77	63.1 Å²	63.1	54%	0.538	35%	0.35	S	S	.	.	H	α-helix	trans	-62.3	-44.7	176.3	-58.2	0	0	0	0	112	A576 A577 L582 G583 I584	A576-S580 PolarHBondContact O-N 3.39Å; A576-S580 PolarHBondContact O-OG 3.25Å; A577-S580 PolarHBondContact O-N 2.89Å; S580-L582 PolarHBondContact O-N 3.34Å; S580-G583 PolarHBondContact O-N 3.24Å; S580-G583 VanDerWaalsContact O-N 3.11Å; S580-I584 WeakPolarHBondContact O-CG1 3.47Å; S580-I584 PolarHBondContact O-N 3.33Å; S580-I584 VanDerWaalsContact O-N 3.08Å
581	L	84.6	Confident	77	Confident	57 Å²	57	58.9 Å²	58.9	30%	0.298	34%	0.336	S	S	.	.	H	α-helix	trans	-62.6	-41.1	178.9	-75.9	172.1	0	0	0	112.5	A577 G583 I584 I602 F606	A577-L581 WeakPolarHBondContact O-CB 3.23Å; A577-L581 VanDerWaalsContact O-CG 3.3Å; A577-L581 WeakPolarHBondContact O-CG 3.37Å; A577-L581 PolarHBondContact O-N 2.87Å; L581-G583 VanDerWaalsContact C-N 3.3Å; L581-G583 PolarHBondContact O-N 2.9Å; L581-I584 HydrophobicContact CD2-CD1 4.36Å; L581-I584 PolarHBondContact O-N 3.29Å; L581-I602 HydrophobicContact CB-CG2 3.61Å; L581-F606 HydrophobicContact CD1-CB 3.74Å; L581-F606 HydrophobicContact CD1-CD2 3.67Å; L581-F606 HydrophobicContact CD1-CG 4.14Å
582	L	77.2	Confident	75.2	Confident	43 Å²	43	58.9 Å²	58.9	23%	0.225	34%	0.336	C	S	.	.	H	α-helix	trans	-67	-32.4	173.6	-71.6	-175.5	0	0	0	112.5	I3 K578 T579 S580 I584 M585 R599 I602	I3-L582 HydrophobicContact CD1-CD1 3.23Å; I3-L582 HydrophobicContact CD1-CG 4.22Å; I3-L582 HydrophobicContact CG1-CD1 4.07Å; K578-L582 WeakPolarHBondContact O-CG 3.36Å; K578-L582 PolarHBondContact O-N 2.88Å; T579-L582 PolarHBondContact O-N 3.43Å; S580-L582 PolarHBondContact O-N 3.34Å; L582-I584 VanDerWaalsContact C-N 3.3Å; L582-M585 PolarHBondContact O-N 3.21Å; L582-R599 HydrophobicContact CD2-CB 4.33Å; L582-R599 HydrophobicContact CD2-CG 4.47Å; L582-I602 HydrophobicContact CD2-CB 3.95Å; L582-I602 HydrophobicContact CD2-CD1 3.86Å; L582-I602 HydrophobicContact CD2-CG2 3.93Å
583	G	72.4	Confident	73.9	Confident	66 Å²	66	55.1 Å²	55.1	68%	0.68	32%	0.322	S	S	*	.	H	α-helix	trans	-73.8	-17.1	177.5	0	0	0	0	0	114.4	T579 S580 L581 M585	T579-G583 PolarHBondContact O-N 3.41Å; S580-G583 PolarHBondContact O-N 3.24Å; S580-G583 VanDerWaalsContact O-N 3.11Å; L581-G583 VanDerWaalsContact C-N 3.3Å; L581-G583 PolarHBondContact O-N 2.9Å; G583-M585 PolarHBondContact O-N 3.47Å
584	I	78.9	Confident	72.4	Confident	126 Å²	126	53.7 Å²	53.7	65%	0.646	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-21.3	174.6	-70.9	165.7	0	0	0	111.2	S580 L581 L582 P586	S580-I584 WeakPolarHBondContact O-CG1 3.47Å; S580-I584 PolarHBondContact O-N 3.33Å; S580-I584 VanDerWaalsContact O-N 3.08Å; L581-I584 HydrophobicContact CD2-CD1 4.36Å; L581-I584 PolarHBondContact O-N 3.29Å; L582-I584 VanDerWaalsContact C-N 3.3Å; I584-P586 WeakPolarHBondContact O-CD 3.16Å
585	M	67.4	Low	71	Confident	37 Å²	37	54.9 Å²	54.9	18%	0.182	34%	0.335	C	S	.	.	S	Bend	trans	-76.9	117.5	-177	-162.4	80.4	-84.1	0	0	111.5	F495 L582 G583 D587 L589 K590 T598 I602	F495-M585 HydrophobicContact CZ-SD 4.28Å; L582-M585 PolarHBondContact O-N 3.21Å; G583-M585 PolarHBondContact O-N 3.47Å; M585-D587 PolarHBondContact O-N 3.25Å; M585-L589 HydrophobicContact CE-CB 4.13Å; M585-L589 HydrophobicContact CE-CD2 3.19Å; M585-L589 HydrophobicContact CE-CG 4.2Å; M585-L589 HydrophobicContact SD-CD2 3.71Å; M585-L589 HydrophobicContact SD-CG 4.46Å; M585-K590 HydrophobicContact CG-CB 4.32Å; M585-T598 HydrophobicContact CB-CG2 4.3Å; M585-T598 HydrophobicContact CG-CG2 3.73Å; M585-T598 HydrophobicContact SD-CG2 4.32Å; M585-I602 HydrophobicContact CB-CD1 3.76Å; M585-I602 HydrophobicContact CG-CD1 4.12Å; M585-I602 HydrophobicContact SD-CD1 4.08Å
586	P	68.3	Low	69.8	Low	63 Å²	63	57.3 Å²	57.3	41%	0.409	35%	0.347	S	S	.	.			trans	-51.5	137.1	167.6	8.6	-25.6	0	0	0	111.9	I584 E588 L589 K590	I584-P586 WeakPolarHBondContact O-CD 3.16Å; P586-E588 WeakPolarHBondContact CB-OE2 3.04Å; P586-E588 PolarHBondContact O-N 3.16Å; P586-L589 HydrophobicContact CG-CB 4.2Å; P586-L589 PolarHBondContact O-N 3.02Å; P586-L589 VanDerWaalsContact O-N 3.09Å; P586-K590 PolarHBondContact O-N 3.41Å
587	D	57.7	Low	69	Low	107 Å²	107	56.4 Å²	56.4	57%	0.572	34%	0.337	S	S	*	.	H	α-helix	trans	-61.6	-32.2	-177.8	-75.6	-44.3	0	0	0	111.1	M585 L589 K590 H591	M585-D587 PolarHBondContact O-N 3.25Å; D587-L589 PolarHBondContact O-N 3.38Å; D587-K590 WeakPolarHBondContact O-CB 3.26Å; D587-K590 PolarHBondContact O-N 3.34Å; D587-H591 WeakPolarHBondContact O-CB 3.37Å; D587-H591 PolarHBondContact O-N 2.98Å
588	E	58.6	Low	68.4	Low	118 Å²	118	55 Å²	55	55%	0.551	32%	0.324	S	S	*	.	H	α-helix	trans	-61.7	-42.9	175.3	-57.6	76.9	-168.5	0	0	111.5	P586 H591 I592	P586-E588 WeakPolarHBondContact CB-OE2 3.04Å; P586-E588 PolarHBondContact O-N 3.16Å; E588-H591 WeakPolarHBondContact O-CB 3.46Å; E588-H591 PolarHBondContact O-N 3.09Å; E588-I592 VanDerWaalsContact O-CD1 3.32Å; E588-I592 WeakPolarHBondContact O-CD1 3.44Å; E588-I592 VanDerWaalsContact O-CG1 3.32Å; E588-I592 WeakPolarHBondContact O-CG1 3.37Å; E588-I592 PolarHBondContact O-N 2.91Å; E588-I592 VanDerWaalsContact O-N 3.11Å
589	L	59	Low	67.9	Low	29 Å²	29	56.2 Å²	56.2	15%	0.152	33%	0.329	C	S	.	.	H	α-helix	trans	-72.9	-39.3	178.9	-163.2	70.9	0	0	0	111	M491 L511 M585 P586 D587 H591 I592 I593	M491-L589 HydrophobicContact CE-CD1 3.99Å; M491-L589 HydrophobicContact CE-CD2 4.07Å; M491-L589 HydrophobicContact CE-CG 4.46Å; L511-L589 HydrophobicContact CD2-CD1 4.13Å; M585-L589 HydrophobicContact CE-CB 4.13Å; M585-L589 HydrophobicContact CE-CD2 3.19Å; M585-L589 HydrophobicContact CE-CG 4.2Å; M585-L589 HydrophobicContact SD-CD2 3.71Å; M585-L589 HydrophobicContact SD-CG 4.46Å; P586-L589 HydrophobicContact CG-CB 4.2Å; P586-L589 PolarHBondContact O-N 3.02Å; P586-L589 VanDerWaalsContact O-N 3.09Å; D587-L589 PolarHBondContact O-N 3.38Å; L589-H591 PolarHBondContact O-N 3.11Å; L589-I592 PolarHBondContact O-N 3.44Å; L589-I593 HydrophobicContact CD1-CD1 4.06Å; L589-I593 HydrophobicContact CD1-CG1 4.42Å; L589-I593 HydrophobicContact CD2-CD1 3.86Å; L589-I593 HydrophobicContact CG-CD1 3.56Å; L589-I593 HydrophobicContact CG-CG1 4.16Å; L589-I593 VanDerWaalsContact O-CB 3.27Å; L589-I593 WeakPolarHBondContact O-CB 3.33Å; L589-I593 WeakPolarHBondContact O-CG1 3.24Å; L589-I593 PolarHBondContact O-N 3.14Å
590	K	59.7	Low	67.8	Low	80 Å²	80	58.7 Å²	58.7	35%	0.348	33%	0.333	S	S	.	.	H	α-helix	trans	-59.6	-31	173.6	-179.7	179.7	171	-165.9	0	112.2	M585 P586 D587 G594 T598	M585-K590 HydrophobicContact CG-CB 4.32Å; P586-K590 PolarHBondContact O-N 3.41Å; D587-K590 WeakPolarHBondContact O-CB 3.26Å; D587-K590 PolarHBondContact O-N 3.34Å; K590-G594 CarbonylContact O-C 3.58Å; K590-G594 VanDerWaalsContact O-C 3.24Å; K590-G594 VanDerWaalsContact O-CA 3.27Å; K590-G594 WeakPolarHBondContact O-CA 3.41Å; K590-G594 PolarHBondContact O-N 2.96Å; K590-T598 WeakPolarHBondContact CA-OG1 3.5Å; K590-T598 HydrophobicContact CB-CG2 4.22Å; K590-T598 HydrophobicContact CG-CG2 4.08Å
591	H	57.3	Low	67.7	Low	38 Å²	38	55.1 Å²	55.1	18%	0.176	31%	0.309	C	S	.	.	H	α-helix	trans	-75.6	-38.9	178.2	-163	46.9	0	0	0	113.9	D423 S424 D587 E588 L589	D423-H591 VanDerWaalsContact CA-NE2 3.34Å; D423-H591 WeakPolarHBondContact CA-NE2 3.44Å; D423-H591 VanDerWaalsContact CB-NE2 3.34Å; D423-H591 WeakPolarHBondContact CB-NE2 3.32Å; D423-H591 PolarHBondContact O-CE1 3.16Å; D423-H591 PolarHBondContact O-NE2 2.94Å; S424-H591 WeakPolarHBondContact CB-CD2 3.39Å; S424-H591 VanDerWaalsContact CB-NE2 3.27Å; S424-H591 WeakPolarHBondContact CB-NE2 3.46Å; S424-H591 PolarHBondContact N-CE1 3.09Å; S424-H591 VanDerWaalsContact N-CE1 3.33Å; S424-H591 PolarHBondContact N-NE2 3.19Å; S424-H591 VanDerWaalsContact N-NE2 3.1Å; D587-H591 WeakPolarHBondContact O-CB 3.37Å; D587-H591 PolarHBondContact O-N 2.98Å; E588-H591 WeakPolarHBondContact O-CB 3.46Å; E588-H591 PolarHBondContact O-N 3.09Å; L589-H591 PolarHBondContact O-N 3.11Å
592	I	55.7	Low	67.7	Low	37 Å²	37	53.2 Å²	53.2	19%	0.19	30%	0.299	C	S	.	.	H	α-helix	trans	-72.1	-40.2	175.1	-65.2	155.4	0	0	0	111.1	L504 L511 E588 L589	L504-I592 WeakPolarHBondContact CD1-O 3.36Å; L511-I592 HydrophobicContact CD1-CD1 3.4Å; L511-I592 HydrophobicContact CD2-CD1 4Å; L511-I592 HydrophobicContact CG-CD1 4.29Å; E588-I592 VanDerWaalsContact O-CD1 3.32Å; E588-I592 WeakPolarHBondContact O-CD1 3.44Å; E588-I592 VanDerWaalsContact O-CG1 3.32Å; E588-I592 WeakPolarHBondContact O-CG1 3.37Å; E588-I592 PolarHBondContact O-N 2.91Å; E588-I592 VanDerWaalsContact O-N 3.11Å; L589-I592 PolarHBondContact O-N 3.44Å
593	I	62.4	Low	68.2	Low	6 Å²	6	52 Å²	52	3%	0.031	29%	0.293	C	S	.	.	H	α-helix	trans	-81.9	-26.9	-175.9	-63.6	-177.7	0	0	0	111.9	M491 F495 L504 I508 L589 T597 T598	M491-I593 HydrophobicContact CE-CD1 3.74Å; F495-I593 HydrophobicContact CD1-CD1 4.24Å; F495-I593 HydrophobicContact CD1-CG2 3.8Å; F495-I593 HydrophobicContact CD2-CD1 3.87Å; F495-I593 HydrophobicContact CE1-CD1 3.92Å; F495-I593 HydrophobicContact CE1-CG2 4.09Å; F495-I593 HydrophobicContact CE2-CD1 3.51Å; F495-I593 HydrophobicContact CG-CD1 4.22Å; F495-I593 HydrophobicContact CG-CG2 4.21Å; F495-I593 HydrophobicContact CZ-CD1 3.54Å; L504-I593 HydrophobicContact CD1-CG1 4.36Å; L504-I593 HydrophobicContact CD2-CG2 4.21Å; I508-I593 HydrophobicContact CD1-CD1 4.31Å; I508-I593 HydrophobicContact CD1-CG1 4.1Å; I508-I593 HydrophobicContact CG1-CG1 4.49Å; L589-I593 HydrophobicContact CD1-CD1 4.06Å; L589-I593 HydrophobicContact CD1-CG1 4.42Å; L589-I593 HydrophobicContact CD2-CD1 3.86Å; L589-I593 HydrophobicContact CG-CD1 3.56Å; L589-I593 HydrophobicContact CG-CG1 4.16Å; L589-I593 VanDerWaalsContact O-CB 3.27Å; L589-I593 WeakPolarHBondContact O-CB 3.33Å; L589-I593 WeakPolarHBondContact O-CG1 3.24Å; L589-I593 PolarHBondContact O-N 3.14Å; I593-T597 HydrophobicContact CG2-CG2 3.68Å; I593-T597 VanDerWaalsContact O-CB 3.23Å; I593-T597 WeakPolarHBondContact O-CB 3.46Å; I593-T597 PolarHBondContact O-OG1 3.26Å; I593-T598 WeakPolarHBondContact CB-OG1 3.47Å; I593-T598 VanDerWaalsContact CG2-OG1 3.3Å; I593-T598 WeakPolarHBondContact CG2-OG1 3.11Å
594	G	56.9	Low	68.9	Low	24 Å²	24	53.5 Å²	53.5	25%	0.247	28%	0.278	C	S	.	.			trans	88.2	144.8	-171.5	0	0	0	0	0	111.7	K590 D596 T598	K590-G594 CarbonylContact O-C 3.58Å; K590-G594 VanDerWaalsContact O-C 3.24Å; K590-G594 VanDerWaalsContact O-CA 3.27Å; K590-G594 WeakPolarHBondContact O-CA 3.41Å; K590-G594 PolarHBondContact O-N 2.96Å; G594-D596 PolarHBondContact O-N 2.97Å; G594-T598 WeakPolarHBondContact O-CB 3.3Å; G594-T598 PolarHBondContact O-N 3.31Å; G594-T598 PolarHBondContact O-OG1 2.91Å
595	A	62.1	Low	69.3	Low	57 Å²	57	49.6 Å²	49.6	47%	0.471	26%	0.259	S	S	.	.	H	α-helix	trans	-63.2	-38.7	-172.7	0	0	0	0	0	113.1	R599	A595-R599 WeakPolarHBondContact O-CB 3.38Å; A595-R599 PolarHBondContact O-N 2.85Å
596	D	60.8	Low	70.5	Confident	67 Å²	67	48.3 Å²	48.3	36%	0.358	25%	0.253	S	S	.	.	H	α-helix	trans	-76.3	-43.1	-179.7	-173.5	58.2	0	0	0	112.4	G594 T598 R599 K600	G594-D596 PolarHBondContact O-N 2.97Å; D596-T598 VanDerWaalsContact C-N 3.33Å; D596-T598 PolarHBondContact O-N 2.85Å; D596-R599 PolarHBondContact O-N 2.87Å; D596-R599 IonicContact OD1-NH1 2.8Å; D596-K600 WeakPolarHBondContact O-CB 3.47Å; D596-K600 WeakPolarHBondContact O-CG 3.29Å; D596-K600 PolarHBondContact O-N 2.72Å; D596-K600 WeakPolarHBondContact OD2-CD 3.43Å; D596-K600 WeakPolarHBondContact OD2-CE 3.38Å; D596-K600 IonicContact OD2-NZ 2.73Å; D596-K600 PolarHBondContact OD2-NZ 2.94Å
597	T	70	Confident	71.4	Confident	34 Å²	34	48.5 Å²	48.5	21%	0.209	25%	0.25	C	S	.	.	H	α-helix	trans	-62	-43	174	-51	0	0	0	0	111	F495 L504 I593 R599 K600 G601	F495-T597 HydrophobicContact CB-CG2 4.27Å; L504-T597 HydrophobicContact CD2-CG2 3.85Å; I593-T597 HydrophobicContact CG2-CG2 3.68Å; I593-T597 VanDerWaalsContact O-CB 3.23Å; I593-T597 WeakPolarHBondContact O-CB 3.46Å; I593-T597 PolarHBondContact O-OG1 3.26Å; T597-R599 VanDerWaalsContact C-N 3.35Å; T597-R599 PolarHBondContact O-N 2.73Å; T597-K600 PolarHBondContact O-N 2.64Å; T597-G601 PolarHBondContact O-N 3.06Å
598	T	75.1	Confident	72.9	Confident	4 Å²	4	47.6 Å²	47.6	3%	0.025	24%	0.244	C	C	.	.	H	α-helix	trans	-59.1	-48.3	174	-62.2	0	0	0	0	110.7	M585 K590 I593 G594 D596 G601 I602	M585-T598 HydrophobicContact CB-CG2 4.3Å; M585-T598 HydrophobicContact CG-CG2 3.73Å; M585-T598 HydrophobicContact SD-CG2 4.32Å; K590-T598 WeakPolarHBondContact CA-OG1 3.5Å; K590-T598 HydrophobicContact CB-CG2 4.22Å; K590-T598 HydrophobicContact CG-CG2 4.08Å; I593-T598 WeakPolarHBondContact CB-OG1 3.47Å; I593-T598 VanDerWaalsContact CG2-OG1 3.3Å; I593-T598 WeakPolarHBondContact CG2-OG1 3.11Å; G594-T598 WeakPolarHBondContact O-CB 3.3Å; G594-T598 PolarHBondContact O-N 3.31Å; G594-T598 PolarHBondContact O-OG1 2.91Å; D596-T598 VanDerWaalsContact C-N 3.33Å; D596-T598 PolarHBondContact O-N 2.85Å; T598-G601 PolarHBondContact O-N 3.06Å; T598-I602 HydrophobicContact CG2-CD1 3.6Å; T598-I602 HydrophobicContact CG2-CG1 4.44Å; T598-I602 WeakPolarHBondContact O-CB 3.49Å; T598-I602 VanDerWaalsContact O-CG1 3.24Å; T598-I602 WeakPolarHBondContact O-CG1 3.28Å; T598-I602 PolarHBondContact O-N 3.44Å
599	R	75.3	Confident	74.4	Confident	36 Å²	36	47.1 Å²	47.1	14%	0.136	24%	0.24	C	C	.	.	H	α-helix	trans	-60.3	-52.1	177.6	176	-177.6	166.7	-80.3	-2.6	111.2	L6 L582 A595 D596 T597 G601 I602 L603	L6-R599 PolarHBondContact O-NH2 3.22Å; L582-R599 HydrophobicContact CD2-CB 4.33Å; L582-R599 HydrophobicContact CD2-CG 4.47Å; A595-R599 WeakPolarHBondContact O-CB 3.38Å; A595-R599 PolarHBondContact O-N 2.85Å; D596-R599 PolarHBondContact O-N 2.87Å; D596-R599 IonicContact OD1-NH1 2.8Å; T597-R599 VanDerWaalsContact C-N 3.35Å; T597-R599 PolarHBondContact O-N 2.73Å; R599-G601 VanDerWaalsContact C-N 3.33Å; R599-G601 PolarHBondContact O-N 3.01Å; R599-I602 PolarHBondContact O-N 3.3Å; R599-L603 HydrophobicContact CG-CD1 3.73Å; R599-L603 HydrophobicContact CG-CG 4.23Å; R599-L603 VanDerWaalsContact O-CB 3.24Å; R599-L603 WeakPolarHBondContact O-CB 3.49Å; R599-L603 WeakPolarHBondContact O-CG 3.33Å; R599-L603 PolarHBondContact O-N 3.43Å
600	K	79.1	Confident	75.9	Confident	126 Å²	126	49.9 Å²	49.9	55%	0.548	25%	0.252	S	S	.	.	H	α-helix	trans	-58.5	-44.3	179.6	-77.7	172.5	174.6	161.3	0	111.3	D596 T597 L603 R604	D596-K600 WeakPolarHBondContact O-CB 3.47Å; D596-K600 WeakPolarHBondContact O-CG 3.29Å; D596-K600 PolarHBondContact O-N 2.72Å; D596-K600 WeakPolarHBondContact OD2-CD 3.43Å; D596-K600 WeakPolarHBondContact OD2-CE 3.38Å; D596-K600 IonicContact OD2-NZ 2.73Å; D596-K600 PolarHBondContact OD2-NZ 2.94Å; T597-K600 PolarHBondContact O-N 2.64Å; K600-L603 PolarHBondContact O-N 2.83Å; K600-R604 WeakPolarHBondContact O-CB 3.28Å; K600-R604 PolarHBondContact O-N 2.87Å
601	G	82.9	Confident	77.4	Confident	3 Å²	3	52.2 Å²	52.2	3%	0.031	26%	0.26	C	S	.	.	H	α-helix	trans	-67.8	-44.6	-179.4	0	0	0	0	0	113.2	V494 T597 T598 R599 L603 R604 V605	V494-G601 WeakPolarHBondContact O-CA 3.5Å; T597-G601 PolarHBondContact O-N 3.06Å; T598-G601 PolarHBondContact O-N 3.06Å; R599-G601 VanDerWaalsContact C-N 3.33Å; R599-G601 PolarHBondContact O-N 3.01Å; G601-L603 VanDerWaalsContact C-N 3.34Å; G601-L603 PolarHBondContact O-N 3.32Å; G601-R604 WeakPolarHBondContact O-CB 3.41Å; G601-R604 PolarHBondContact O-N 2.84Å; G601-V605 PolarHBondContact O-N 3.13Å; G601-V605 VanDerWaalsContact O-N 3.13Å
602	I	85.7	Confident	79	Confident	17 Å²	17	56.9 Å²	56.9	9%	0.087	28%	0.282	C	S	.	.	H	α-helix	trans	-65.2	-40.7	175.7	-67.7	171.4	0	0	0	111.1	L581 L582 M585 T598 R599 R604 V605 F606	L581-I602 HydrophobicContact CB-CG2 3.61Å; L582-I602 HydrophobicContact CD2-CB 3.95Å; L582-I602 HydrophobicContact CD2-CD1 3.86Å; L582-I602 HydrophobicContact CD2-CG2 3.93Å; M585-I602 HydrophobicContact CB-CD1 3.76Å; M585-I602 HydrophobicContact CG-CD1 4.12Å; M585-I602 HydrophobicContact SD-CD1 4.08Å; T598-I602 HydrophobicContact CG2-CD1 3.6Å; T598-I602 HydrophobicContact CG2-CG1 4.44Å; T598-I602 WeakPolarHBondContact O-CB 3.49Å; T598-I602 VanDerWaalsContact O-CG1 3.24Å; T598-I602 WeakPolarHBondContact O-CG1 3.28Å; T598-I602 PolarHBondContact O-N 3.44Å; R599-I602 PolarHBondContact O-N 3.3Å; I602-R604 VanDerWaalsContact C-N 3.31Å; I602-R604 PolarHBondContact O-N 2.83Å; I602-V605 PolarHBondContact O-N 2.91Å; I602-F606 PolarHBondContact O-N 2.94Å
603	L	86.4	Confident	80.7	Confident	18 Å²	18	58.8 Å²	58.8	9%	0.094	30%	0.296	C	S	.	.	H	α-helix	trans	-68.1	-30.6	175.9	-68.9	-177.7	0	0	0	112.3	K578 R599 K600 G601 F606 D607	K578-L603 HydrophobicContact CB-CD2 4.06Å; K578-L603 HydrophobicContact CD-CD2 3.76Å; K578-L603 HydrophobicContact CG-CD2 3.57Å; R599-L603 HydrophobicContact CG-CD1 3.73Å; R599-L603 HydrophobicContact CG-CG 4.23Å; R599-L603 VanDerWaalsContact O-CB 3.24Å; R599-L603 WeakPolarHBondContact O-CB 3.49Å; R599-L603 WeakPolarHBondContact O-CG 3.33Å; R599-L603 PolarHBondContact O-N 3.43Å; K600-L603 PolarHBondContact O-N 2.83Å; G601-L603 VanDerWaalsContact C-N 3.34Å; G601-L603 PolarHBondContact O-N 3.32Å; L603-F606 WeakPolarHBondContact O-CB 3.38Å; L603-F606 PolarHBondContact O-N 3.03Å; L603-D607 WeakPolarHBondContact O-CB 3.47Å; L603-D607 PolarHBondContact O-N 3.43Å
604	R	87.2	Confident	82	Confident	97 Å²	97	63.8 Å²	63.8	37%	0.366	32%	0.321	S	S	.	.	H	α-helix	trans	-61.3	-45.7	171	173.8	-177.7	-89.2	-179.8	-4	110.8	E493 D496 K600 G601 I602 F606 D607 M608	E493-R604 PolarHBondContact O-NH1 2.82Å; D496-R604 VanDerWaalsContact CB-NH1 3.26Å; D496-R604 IonicContact OD1-CZ 3.88Å; D496-R604 IonicContact OD1-NH1 2.66Å; D496-R604 PolarHBondContact OD1-NH1 3.38Å; D496-R604 IonicContact OD1-NH2 3.63Å; D496-R604 PolarHBondContact OD1-NH2 3.43Å; D496-R604 IonicContact OD2-CZ 2.73Å; D496-R604 IonicContact OD2-NH1 2.94Å; D496-R604 IonicContact OD2-NH2 2.87Å; D496-R604 PolarHBondContact OD2-NH2 3.4Å; K600-R604 WeakPolarHBondContact O-CB 3.28Å; K600-R604 PolarHBondContact O-N 2.87Å; G601-R604 WeakPolarHBondContact O-CB 3.41Å; G601-R604 PolarHBondContact O-N 2.84Å; I602-R604 VanDerWaalsContact C-N 3.31Å; I602-R604 PolarHBondContact O-N 2.83Å; R604-F606 VanDerWaalsContact C-N 3.32Å; R604-F606 PolarHBondContact O-N 2.81Å; R604-D607 PolarHBondContact O-N 2.96Å; R604-M608 WeakPolarHBondContact O-CB 3.49Å; R604-M608 PolarHBondContact O-N 3.01Å
605	V	88.7	Confident	83.6	Confident	43 Å²	43	64.8 Å²	64.8	26%	0.261	32%	0.32	S	S	.	.	H	α-helix	trans	-59.6	-46	174.3	177.1	0	0	0	0	110.5	V494 G601 I602 D607 M608 F609	V494-V605 HydrophobicContact CB-CG2 4.41Å; V494-V605 HydrophobicContact CG1-CG2 3.9Å; V494-V605 HydrophobicContact CG2-CG2 3.78Å; G601-V605 PolarHBondContact O-N 3.13Å; G601-V605 VanDerWaalsContact O-N 3.13Å; I602-V605 PolarHBondContact O-N 2.91Å; V605-D607 PolarHBondContact O-N 2.71Å; V605-M608 WeakPolarHBondContact O-CB 3.42Å; V605-M608 PolarHBondContact O-N 3.3Å; V605-F609 HydrophobicContact CG1-CD2 4.12Å; V605-F609 HydrophobicContact CG1-CE2 3.91Å; V605-F609 VanDerWaalsContact O-CD2 3.25Å; V605-F609 WeakPolarHBondContact O-CD2 3.5Å; V605-F609 PolarHBondContact O-N 3.28Å
606	F	90.9	Very high	84.9	Confident	11 Å²	11	68.8 Å²	68.8	5%	0.048	32%	0.323	C	S	.	.	H	α-helix	trans	-58.1	-48.3	176.6	175.8	-99.5	0	0	0	112.2	R574 A577 K578 L581 I602 L603 R604 F609 Q610	R574-F606 HydrophobicContact CB-CZ 3.85Å; R574-F606 HydrophobicContact CG-CZ 3.98Å; A577-F606 HydrophobicContact CB-CD2 4.39Å; A577-F606 HydrophobicContact CB-CE2 3.76Å; K578-F606 HydrophobicContact CD-CD1 4.49Å; K578-F606 HydrophobicContact CD-CE1 4.23Å; K578-F606 VanDerWaalsContact CE-CE1 3.41Å; K578-F606 HydrophobicContact CG-CD1 3.96Å; K578-F606 HydrophobicContact CG-CD2 4.33Å; K578-F606 HydrophobicContact CG-CE1 3.9Å; K578-F606 HydrophobicContact CG-CE2 4.31Å; K578-F606 HydrophobicContact CG-CG 4.15Å; K578-F606 HydrophobicContact CG-CZ 4.09Å; L581-F606 HydrophobicContact CD1-CB 3.74Å; L581-F606 HydrophobicContact CD1-CD2 3.67Å; L581-F606 HydrophobicContact CD1-CG 4.14Å; I602-F606 PolarHBondContact O-N 2.94Å; L603-F606 WeakPolarHBondContact O-CB 3.38Å; L603-F606 PolarHBondContact O-N 3.03Å; R604-F606 VanDerWaalsContact C-N 3.32Å; R604-F606 PolarHBondContact O-N 2.81Å; F606-F609 PolarHBondContact O-N 2.86Å; F606-Q610 HydrophobicContact CD1-CG 4.35Å; F606-Q610 HydrophobicContact CE1-CG 4.1Å; F606-Q610 HydrophobicContact CZ-CG 4.45Å; F606-Q610 VanDerWaalsContact O-CG 3.3Å; F606-Q610 WeakPolarHBondContact O-CG 3.22Å; F606-Q610 PolarHBondContact O-N 2.91Å; F606-Q610 PolarHBondContact O-NE2 3.25Å
607	D	88.8	Confident	86.2	Confident	67 Å²	67	70.8 Å²	70.8	36%	0.358	33%	0.326	S	S	.	.	H	α-helix	trans	-69.1	-33	-178.1	-77.3	-33.3	0	0	0	112.4	K9 R574 L603 R604 V605 F609 Q610	K9-D607 IonicContact NZ-OD1 3.49Å; R574-D607 IonicContact NH2-OD1 2.91Å; L603-D607 WeakPolarHBondContact O-CB 3.47Å; L603-D607 PolarHBondContact O-N 3.43Å; R604-D607 PolarHBondContact O-N 2.96Å; V605-D607 PolarHBondContact O-N 2.71Å; D607-F609 VanDerWaalsContact C-N 3.32Å; D607-F609 PolarHBondContact O-N 3.16Å; D607-Q610 WeakPolarHBondContact O-CA 3.39Å; D607-Q610 WeakPolarHBondContact O-CB 3.39Å; D607-Q610 PolarHBondContact O-N 3.44Å
608	M	88.6	Confident	87.1	Confident	87 Å²	87	72.8 Å²	72.8	43%	0.429	34%	0.335	S	S	.	.	H	α-helix	trans	-55.5	-47.9	169.8	-177	-160.9	74.4	0	0	110.6	R604 V605 Q610 Y611	R604-M608 WeakPolarHBondContact O-CB 3.49Å; R604-M608 PolarHBondContact O-N 3.01Å; V605-M608 WeakPolarHBondContact O-CB 3.42Å; V605-M608 PolarHBondContact O-N 3.3Å; M608-Q610 PolarHBondContact O-N 3.45Å; M608-Q610 VanDerWaalsContact O-N 3.12Å; M608-Y611 PolarHBondContact O-N 3Å
609	F	89.7	Confident	87.8	Confident	109 Å²	109	77 Å²	77	48%	0.478	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-4.5	176	-75.5	-65.8	0	0	0	114.1	V605 F606 D607 N615	V605-F609 HydrophobicContact CG1-CD2 4.12Å; V605-F609 HydrophobicContact CG1-CE2 3.91Å; V605-F609 VanDerWaalsContact O-CD2 3.25Å; V605-F609 WeakPolarHBondContact O-CD2 3.5Å; V605-F609 PolarHBondContact O-N 3.28Å; F606-F609 PolarHBondContact O-N 2.86Å; D607-F609 VanDerWaalsContact C-N 3.32Å; D607-F609 PolarHBondContact O-N 3.16Å; F609-N615 PolarHBondContact O-ND2 2.82Å
610	Q	90.6	Very high	88.3	Confident	86 Å²	86	80.5 Å²	80.5	40%	0.402	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-11.5	171.2	-49.9	-50.8	-64.5	0	0	112.4	R574 F606 D607 M608 Q612	R574-Q610 VanDerWaalsContact NH1-CD 3.29Å; F606-Q610 HydrophobicContact CD1-CG 4.35Å; F606-Q610 HydrophobicContact CE1-CG 4.1Å; F606-Q610 HydrophobicContact CZ-CG 4.45Å; F606-Q610 VanDerWaalsContact O-CG 3.3Å; F606-Q610 WeakPolarHBondContact O-CG 3.22Å; F606-Q610 PolarHBondContact O-N 2.91Å; F606-Q610 PolarHBondContact O-NE2 3.25Å; D607-Q610 WeakPolarHBondContact O-CA 3.39Å; D607-Q610 WeakPolarHBondContact O-CB 3.39Å; D607-Q610 PolarHBondContact O-N 3.44Å; M608-Q610 PolarHBondContact O-N 3.45Å; M608-Q610 VanDerWaalsContact O-N 3.12Å; Q610-Q612 PolarHBondContact O-N 3.38Å; Q610-Q612 VanDerWaalsContact O-N 3.15Å
611	Y	91.9	Very high	88.8	Confident	129 Å²	129	77.5 Å²	77.5	51%	0.506	37%	0.367	S	S	.	.			trans	-84	93.7	-177.3	-165.4	-103.5	0	0	0	111.8	M608 P613 M614 N615	M608-Y611 PolarHBondContact O-N 3Å; Y611-P613 HydrophobicContact CD1-CB 4.3Å; Y611-P613 HydrophobicContact CD1-CG 4.34Å; Y611-P613 HydrophobicContact CE1-CB 3.73Å; Y611-P613 HydrophobicContact CE1-CG 3.83Å; Y611-P613 HydrophobicContact CE2-CG 4.46Å; Y611-M614 HydrophobicContact CD1-CB 3.61Å; Y611-M614 HydrophobicContact CD1-CG 3.34Å; Y611-M614 HydrophobicContact CD1-SD 3.46Å; Y611-M614 WeakPolarHBondContact CD1-SD 3.46Å; Y611-M614 HydrophobicContact CE1-CB 4.28Å; Y611-M614 HydrophobicContact CE1-CG 3.63Å; Y611-M614 HydrophobicContact CE1-SD 3.91Å; Y611-M614 HydrophobicContact CG-SD 4.25Å; Y611-M614 PolarHBondContact O-N 2.88Å; Y611-N615 PolarHBondContact O-N 3.42Å
612	Q	89.9	Confident	89	Confident	137 Å²	137	84.3 Å²	84.3	64%	0.64	40%	0.396	S	S	*	.	H	α-helix	trans	-53.1	-42.6	-174	-174.5	-176.1	0.4	0	0	114.7	Q610 N615 R616	Q610-Q612 PolarHBondContact O-N 3.38Å; Q610-Q612 VanDerWaalsContact O-N 3.15Å; Q612-N615 PolarHBondContact O-N 3.35Å; Q612-R616 WeakPolarHBondContact O-CB 3.32Å; Q612-R616 PolarHBondContact O-N 3.42Å
613	P	91.6	Very high	89	Confident	77 Å²	77	87.7 Å²	87.7	50%	0.5	41%	0.413	S	S	.	.	H	α-helix	trans	-64.3	-41.6	179.2	-22.3	34.1	0	0	0	113.5	Y611 R616 R617	Y611-P613 HydrophobicContact CD1-CB 4.3Å; Y611-P613 HydrophobicContact CD1-CG 4.34Å; Y611-P613 HydrophobicContact CE1-CB 3.73Å; Y611-P613 HydrophobicContact CE1-CG 3.83Å; Y611-P613 HydrophobicContact CE2-CG 4.46Å; P613-R616 PolarHBondContact O-N 2.87Å; P613-R617 PolarHBondContact O-N 3.41Å
614	M	89.3	Confident	89.1	Confident	110 Å²	110	88.5 Å²	88.5	54%	0.542	42%	0.417	S	S	.	.	H	α-helix	trans	-68.3	-42.8	176.7	-73.7	164.6	79.4	0	0	111	Y611 R616 R617 L618	Y611-M614 HydrophobicContact CD1-CB 3.61Å; Y611-M614 HydrophobicContact CD1-CG 3.34Å; Y611-M614 HydrophobicContact CD1-SD 3.46Å; Y611-M614 WeakPolarHBondContact CD1-SD 3.46Å; Y611-M614 HydrophobicContact CE1-CB 4.28Å; Y611-M614 HydrophobicContact CE1-CG 3.63Å; Y611-M614 HydrophobicContact CE1-SD 3.91Å; Y611-M614 HydrophobicContact CG-SD 4.25Å; Y611-M614 PolarHBondContact O-N 2.88Å; M614-R616 VanDerWaalsContact C-N 3.27Å; M614-R616 PolarHBondContact O-N 2.72Å; M614-R617 PolarHBondContact O-N 2.91Å; M614-R617 VanDerWaalsContact O-N 3.15Å; M614-L618 WeakPolarHBondContact O-CB 3.38Å; M614-L618 PolarHBondContact O-N 3.24Å
615	N	90.8	Very high	89.1	Confident	45 Å²	45	85.2 Å²	85.2	24%	0.241	41%	0.413	C	S	.	.	H	α-helix	trans	-58.9	-41.4	176.2	-68.1	-18.7	0	0	0	111.7	F609 Y611 Q612 L618 V619	F609-N615 PolarHBondContact O-ND2 2.82Å; Y611-N615 PolarHBondContact O-N 3.42Å; Q612-N615 PolarHBondContact O-N 3.35Å; N615-L618 PolarHBondContact O-N 2.88Å; N615-V619 WeakPolarHBondContact O-CG2 3.22Å; N615-V619 PolarHBondContact O-N 3Å
616	R	90.3	Very high	88.9	Confident	141 Å²	141	88.7 Å²	88.7	53%	0.532	43%	0.425	S	S	.	.	H	α-helix	trans	-62	-46.3	175.8	179.5	-179.6	-74.7	-152.9	-1.5	111.1	Q612 P613 M614 L618 V619 Y620	Q612-R616 WeakPolarHBondContact O-CB 3.32Å; Q612-R616 PolarHBondContact O-N 3.42Å; P613-R616 PolarHBondContact O-N 2.87Å; M614-R616 VanDerWaalsContact C-N 3.27Å; M614-R616 PolarHBondContact O-N 2.72Å; R616-L618 VanDerWaalsContact C-N 3.34Å; R616-L618 PolarHBondContact O-N 2.99Å; R616-V619 PolarHBondContact O-N 3.45Å; R616-Y620 HydrophobicContact CG-CD2 4.02Å; R616-Y620 HydrophobicContact CG-CE1 4.42Å; R616-Y620 HydrophobicContact CG-CE2 3.4Å; R616-Y620 VanDerWaalsContact CG-CE2 3.4Å; R616-Y620 WeakPolarHBondContact O-CD2 3.27Å; R616-Y620 PolarHBondContact O-N 3.4Å
617	R	88.2	Confident	88.7	Confident	110 Å²	110	90 Å²	90	42%	0.415	43%	0.432	S	S	.	.	H	α-helix	trans	-62.1	-43.3	176.8	-180	55.9	177.1	146.3	-2.4	111.3	P613 M614 V619 Y620 V621 E624 H644	P613-R617 PolarHBondContact O-N 3.41Å; M614-R617 PolarHBondContact O-N 2.91Å; M614-R617 VanDerWaalsContact O-N 3.15Å; R617-V619 VanDerWaalsContact C-N 3.34Å; R617-V619 PolarHBondContact O-N 3.23Å; R617-Y620 PolarHBondContact O-N 3.44Å; R617-Y620 VanDerWaalsContact O-N 3.15Å; R617-V621 HydrophobicContact CG-CG2 4.35Å; R617-V621 WeakPolarHBondContact O-CG2 3.47Å; R617-V621 PolarHBondContact O-N 2.99Å; R617-E624 IonicContact NH1-OE1 2.64Å; R617-E624 PolarHBondContact NH1-OE1 2.92Å; R617-E624 IonicContact NH1-OE2 2.73Å; R617-E624 PolarHBondContact NH1-OE2 3.1Å; R617-H644 PolarHBondContact NH1-CE1 2.9Å; R617-H644 VanDerWaalsContact NH1-CE1 3.32Å
618	L	87.9	Confident	88.6	Confident	76 Å²	76	90.6 Å²	90.6	40%	0.398	43%	0.433	S	S	.	.	H	α-helix	trans	-57.5	-46.3	177.9	-176.7	64.8	0	0	0	111.4	M614 N615 R616 Y620 V621 F622	M614-L618 WeakPolarHBondContact O-CB 3.38Å; M614-L618 PolarHBondContact O-N 3.24Å; N615-L618 PolarHBondContact O-N 2.88Å; R616-L618 VanDerWaalsContact C-N 3.34Å; R616-L618 PolarHBondContact O-N 2.99Å; L618-Y620 PolarHBondContact O-N 3.29Å; L618-V621 PolarHBondContact O-N 3.2Å; L618-F622 HydrophobicContact CD1-CD2 4.08Å; L618-F622 HydrophobicContact CD1-CE2 3.54Å; L618-F622 HydrophobicContact CD1-CZ 4.29Å; L618-F622 HydrophobicContact CD2-CE2 4.22Å; L618-F622 HydrophobicContact CG-CD2 3.94Å; L618-F622 HydrophobicContact CG-CE2 3.64Å; L618-F622 WeakPolarHBondContact O-CD2 3.44Å; L618-F622 PolarHBondContact O-N 3.16Å
619	V	89.3	Confident	88.5	Confident	92 Å²	92	91.8 Å²	91.8	56%	0.558	45%	0.445	S	S	*	.	H	α-helix	trans	-60.9	-43	175.3	170.8	0	0	0	0	111.6	N615 R616 R617 F622 L623	N615-V619 WeakPolarHBondContact O-CG2 3.22Å; N615-V619 PolarHBondContact O-N 3Å; R616-V619 PolarHBondContact O-N 3.45Å; R617-V619 VanDerWaalsContact C-N 3.34Å; R617-V619 PolarHBondContact O-N 3.23Å; V619-F622 PolarHBondContact O-N 3.21Å; V619-L623 WeakPolarHBondContact O-CB 3.42Å; V619-L623 PolarHBondContact O-N 2.93Å
620	Y	87.1	Confident	88.1	Confident	109 Å²	109	91.7 Å²	91.7	43%	0.427	45%	0.448	S	S	.	.	H	α-helix	trans	-64.3	-40.2	176.9	-65.1	-28	0	0	0	112.5	R616 R617 L618 F622 L623 E624	R616-Y620 HydrophobicContact CG-CD2 4.02Å; R616-Y620 HydrophobicContact CG-CE1 4.42Å; R616-Y620 HydrophobicContact CG-CE2 3.4Å; R616-Y620 VanDerWaalsContact CG-CE2 3.4Å; R616-Y620 WeakPolarHBondContact O-CD2 3.27Å; R616-Y620 PolarHBondContact O-N 3.4Å; R617-Y620 PolarHBondContact O-N 3.44Å; R617-Y620 VanDerWaalsContact O-N 3.15Å; L618-Y620 PolarHBondContact O-N 3.29Å; Y620-F622 PolarHBondContact O-N 3.02Å; Y620-L623 PolarHBondContact O-N 3.15Å; Y620-E624 WeakPolarHBondContact O-CB 3.33Å; Y620-E624 VanDerWaalsContact O-CG 3.23Å; Y620-E624 WeakPolarHBondContact O-CG 3.34Å; Y620-E624 PolarHBondContact O-N 3.05Å
621	V	88.9	Confident	88	Confident	64 Å²	64	91.5 Å²	91.5	39%	0.388	45%	0.445	S	S	.	.	H	α-helix	trans	-61.7	-44.1	175.7	171.2	0	0	0	0	111.1	R617 L618 L623 E624 G625	R617-V621 HydrophobicContact CG-CG2 4.35Å; R617-V621 WeakPolarHBondContact O-CG2 3.47Å; R617-V621 PolarHBondContact O-N 2.99Å; L618-V621 PolarHBondContact O-N 3.2Å; V621-L623 VanDerWaalsContact C-N 3.34Å; V621-L623 PolarHBondContact O-N 3.13Å; V621-E624 PolarHBondContact O-N 3.42Å; V621-G625 PolarHBondContact O-N 3Å
622	F	86.6	Confident	87.7	Confident	146 Å²	146	90.1 Å²	90.1	64%	0.64	45%	0.452	S	S	*	.	H	α-helix	trans	-63.8	-39.8	175.3	-79.2	-60.8	0	0	0	112.5	L618 V619 Y620 F626	L618-F622 HydrophobicContact CD1-CD2 4.08Å; L618-F622 HydrophobicContact CD1-CE2 3.54Å; L618-F622 HydrophobicContact CD1-CZ 4.29Å; L618-F622 HydrophobicContact CD2-CE2 4.22Å; L618-F622 HydrophobicContact CG-CD2 3.94Å; L618-F622 HydrophobicContact CG-CE2 3.64Å; L618-F622 WeakPolarHBondContact O-CD2 3.44Å; L618-F622 PolarHBondContact O-N 3.16Å; V619-F622 PolarHBondContact O-N 3.21Å; Y620-F622 PolarHBondContact O-N 3.02Å; F622-F626 VanDerWaalsContact O-CB 3.3Å; F622-F626 WeakPolarHBondContact O-CB 3.49Å; F622-F626 PolarHBondContact O-N 3.1Å
623	L	86.5	Confident	87.6	Confident	87 Å²	87	90.1 Å²	90.1	46%	0.455	45%	0.452	S	S	.	.	H	α-helix	trans	-66.3	-41.8	177.8	-176.8	64.2	0	0	0	111.8	V619 Y620 V621 F626 L627	V619-L623 WeakPolarHBondContact O-CB 3.42Å; V619-L623 PolarHBondContact O-N 2.93Å; Y620-L623 PolarHBondContact O-N 3.15Å; V621-L623 VanDerWaalsContact C-N 3.34Å; V621-L623 PolarHBondContact O-N 3.13Å; L623-F626 PolarHBondContact O-N 2.86Å; L623-L627 HydrophobicContact CD1-CG 4.42Å; L623-L627 HydrophobicContact CG-CD1 4.2Å; L623-L627 WeakPolarHBondContact O-CB 3.35Å; L623-L627 VanDerWaalsContact O-CG 3.27Å; L623-L627 WeakPolarHBondContact O-CG 3.45Å; L623-L627 PolarHBondContact O-N 2.98Å
624	E	88.6	Confident	87.3	Confident	36 Å²	36	93 Å²	93	17%	0.168	45%	0.454	C	S	.	.	H	α-helix	trans	-57.5	-52.8	174.8	-74.4	166.4	-175.3	0	0	110.3	R617 Y620 V621 F626 L627 E628 F640 H644	R617-E624 IonicContact NH1-OE1 2.64Å; R617-E624 PolarHBondContact NH1-OE1 2.92Å; R617-E624 IonicContact NH1-OE2 2.73Å; R617-E624 PolarHBondContact NH1-OE2 3.1Å; Y620-E624 WeakPolarHBondContact O-CB 3.33Å; Y620-E624 VanDerWaalsContact O-CG 3.23Å; Y620-E624 WeakPolarHBondContact O-CG 3.34Å; Y620-E624 PolarHBondContact O-N 3.05Å; V621-E624 PolarHBondContact O-N 3.42Å; E624-F626 VanDerWaalsContact C-N 3.33Å; E624-F626 PolarHBondContact O-N 2.77Å; E624-L627 PolarHBondContact O-N 2.8Å; E624-E628 PolarHBondContact O-N 3.46Å; E624-F640 HydrophobicContact CB-CD2 3.99Å; E624-F640 HydrophobicContact CB-CE2 3.63Å; E624-F640 HydrophobicContact CB-CZ 4Å; E624-F640 HydrophobicContact CG-CD1 4.05Å; E624-F640 HydrophobicContact CG-CD2 3.96Å; E624-F640 HydrophobicContact CG-CE1 3.93Å; E624-F640 HydrophobicContact CG-CE2 3.8Å; E624-F640 HydrophobicContact CG-CG 4.09Å; E624-F640 HydrophobicContact CG-CZ 3.81Å; E624-H644 IonicContact OE1-CD2 3.77Å; E624-H644 IonicContact OE1-CE1 2.7Å; E624-H644 PolarHBondContact OE1-CE1 3.49Å; E624-H644 VanDerWaalsContact OE1-CE1 3.26Å; E624-H644 IonicContact OE1-NE2 3.95Å; E624-H644 PolarHBondContact OE1-NE2 2.96Å; E624-H644 IonicContact OE2-NE2 3.68Å; E624-H644 PolarHBondContact OE2-NE2 3.07Å
625	G	86.2	Confident	87.3	Confident	28 Å²	28	94.3 Å²	94.3	29%	0.289	46%	0.457	S	S	.	.	H	α-helix	trans	-63.1	-35.9	177.7	0	0	0	0	0	113.6	V621 T629	V621-G625 PolarHBondContact O-N 3Å; G625-T629 WeakPolarHBondContact O-CB 3.49Å; G625-T629 PolarHBondContact O-N 2.82Å; G625-T629 PolarHBondContact O-OG1 3.09Å
626	F	84.9	Confident	87.1	Confident	115 Å²	115	94 Å²	94	50%	0.504	45%	0.453	S	S	.	.	H	α-helix	trans	-63.5	-45.5	174.2	176.5	-95.2	0	0	0	111.8	F622 L623 E624 T629 M630	F622-F626 VanDerWaalsContact O-CB 3.3Å; F622-F626 WeakPolarHBondContact O-CB 3.49Å; F622-F626 PolarHBondContact O-N 3.1Å; L623-F626 PolarHBondContact O-N 2.86Å; E624-F626 VanDerWaalsContact C-N 3.33Å; E624-F626 PolarHBondContact O-N 2.77Å; F626-T629 PolarHBondContact O-N 3.05Å; F626-M630 HydrophobicContact CD1-CG 4.34Å; F626-M630 HydrophobicContact CD2-CG 4.03Å; F626-M630 HydrophobicContact CE1-CG 3.96Å; F626-M630 HydrophobicContact CE2-CG 3.61Å; F626-M630 HydrophobicContact CE2-SD 4.34Å; F626-M630 HydrophobicContact CG-CG 4.38Å; F626-M630 HydrophobicContact CZ-CG 3.58Å; F626-M630 HydrophobicContact CZ-SD 4.46Å; F626-M630 WeakPolarHBondContact O-CB 3.25Å; F626-M630 WeakPolarHBondContact O-CG 3.38Å; F626-M630 PolarHBondContact O-N 3.33Å
627	L	86.2	Confident	86.9	Confident	40 Å²	40	90.6 Å²	90.6	21%	0.209	45%	0.449	C	S	.	.	H	α-helix	trans	-65	-42.5	179.3	-71.6	172.3	0	0	0	111.7	L623 E624 T629 F631 F636 F640	L623-L627 HydrophobicContact CD1-CG 4.42Å; L623-L627 HydrophobicContact CG-CD1 4.2Å; L623-L627 WeakPolarHBondContact O-CB 3.35Å; L623-L627 VanDerWaalsContact O-CG 3.27Å; L623-L627 WeakPolarHBondContact O-CG 3.45Å; L623-L627 PolarHBondContact O-N 2.98Å; E624-L627 PolarHBondContact O-N 2.8Å; L627-T629 VanDerWaalsContact C-N 3.3Å; L627-T629 PolarHBondContact O-N 2.95Å; L627-F631 HydrophobicContact CD2-CD2 3.94Å; L627-F631 HydrophobicContact CD2-CE2 4.04Å; L627-F631 WeakPolarHBondContact O-CB 3.27Å; L627-F631 PolarHBondContact O-N 3.32Å; L627-F636 HydrophobicContact CB-CD1 4.34Å; L627-F636 HydrophobicContact CB-CD2 4.27Å; L627-F636 HydrophobicContact CB-CE1 4.39Å; L627-F636 HydrophobicContact CB-CE2 4.33Å; L627-F636 HydrophobicContact CB-CG 4.29Å; L627-F636 HydrophobicContact CB-CZ 4.39Å; L627-F636 HydrophobicContact CD1-CE1 4.22Å; L627-F636 HydrophobicContact CD2-CZ 4.38Å; L627-F640 HydrophobicContact CB-CZ 4.28Å; L627-F640 HydrophobicContact CD1-CZ 4.09Å
628	E	88.2	Confident	86.8	Confident	78 Å²	78	90.9 Å²	90.9	36%	0.364	46%	0.456	S	S	.	.	H	α-helix	trans	-60.4	-40.9	174.9	-74.9	173.2	179.5	0	0	112.2	E624 F636 P637 F640	E624-E628 PolarHBondContact O-N 3.46Å; E628-F636 HydrophobicContact CG-CB 4.02Å; E628-P637 HydrophobicContact CG-CG 4.12Å; E628-F640 HydrophobicContact CG-CD2 4.46Å; E628-F640 HydrophobicContact CG-CE2 3.9Å; E628-F640 VanDerWaalsContact OE1-CD2 3.29Å; E628-F640 WeakPolarHBondContact OE1-CD2 3.36Å
629	T	85.2	Confident	86.7	Confident	112 Å²	112	91.2 Å²	91.2	69%	0.687	46%	0.458	S	S	*	.	H	α-helix	trans	-75	-42.6	-177.1	-54.1	0	0	0	0	112.4	G625 F626 L627	G625-T629 WeakPolarHBondContact O-CB 3.49Å; G625-T629 PolarHBondContact O-N 2.82Å; G625-T629 PolarHBondContact O-OG1 3.09Å; F626-T629 PolarHBondContact O-N 3.05Å; L627-T629 VanDerWaalsContact C-N 3.3Å; L627-T629 PolarHBondContact O-N 2.95Å
630	M	81.4	Confident	86.6	Confident	108 Å²	108	87.9 Å²	87.9	53%	0.532	44%	0.436	S	S	.	.	H	α-helix	trans	-79.3	-26.9	-176.9	-73.8	-66.1	-64.8	0	0	113.4	F626	F626-M630 HydrophobicContact CD1-CG 4.34Å; F626-M630 HydrophobicContact CD2-CG 4.03Å; F626-M630 HydrophobicContact CE1-CG 3.96Å; F626-M630 HydrophobicContact CE2-CG 3.61Å; F626-M630 HydrophobicContact CE2-SD 4.34Å; F626-M630 HydrophobicContact CG-CG 4.38Å; F626-M630 HydrophobicContact CZ-CG 3.58Å; F626-M630 HydrophobicContact CZ-SD 4.46Å; F626-M630 WeakPolarHBondContact O-CB 3.25Å; F626-M630 WeakPolarHBondContact O-CG 3.38Å; F626-M630 PolarHBondContact O-N 3.33Å
631	F	88.7	Confident	86.5	Confident	81 Å²	81	88 Å²	88	36%	0.355	45%	0.447	S	S	.	.			trans	-131.6	55.4	-172	-58.6	-68.1	0	0	0	111.9	L627 Q633 Y634 F636	L627-F631 HydrophobicContact CD2-CD2 3.94Å; L627-F631 HydrophobicContact CD2-CE2 4.04Å; L627-F631 WeakPolarHBondContact O-CB 3.27Å; L627-F631 PolarHBondContact O-N 3.32Å; F631-Q633 VanDerWaalsContact C-OE1 3.23Å; F631-Q633 PolarHBondContact O-N 2.87Å; F631-Q633 VanDerWaalsContact O-N 3.1Å; F631-Y634 HydrophobicContact CB-CD2 3.72Å; F631-Y634 HydrophobicContact CB-CE2 4.26Å; F631-Y634 HydrophobicContact CD1-CE2 4.31Å; F631-Y634 HydrophobicContact CG-CD2 4.49Å; F631-Y634 PolarHBondContact O-N 3.39Å; F631-F636 HydrophobicContact CB-CD2 4.2Å; F631-F636 HydrophobicContact CB-CE2 3.59Å; F631-F636 HydrophobicContact CD2-CE2 4.38Å; F631-F636 HydrophobicContact CG-CE2 4.33Å
632	P	86	Confident	86.3	Confident	100 Å²	100	92.4 Å²	92.4	65%	0.649	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-20.8	-173.5	27.5	-37.1	0	0	0	113.8	Y634	P632-Y634 PolarHBondContact O-N 3.01Å
633	Q	87.1	Confident	86	Confident	137 Å²	137	91.1 Å²	91.1	64%	0.64	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-14.2	176.7	67.3	-84.2	26.7	0	0	113.6	F631	F631-Q633 VanDerWaalsContact C-OE1 3.23Å; F631-Q633 PolarHBondContact O-N 2.87Å; F631-Q633 VanDerWaalsContact O-N 3.1Å
634	Y	86.8	Confident	85.8	Confident	137 Å²	137	91.7 Å²	91.7	54%	0.537	46%	0.461	S	S	.	.	S	Bend	trans	-98	147.1	177.8	-65.6	-90.8	0	0	0	110.9	F631 P632 F636	F631-Y634 HydrophobicContact CB-CD2 3.72Å; F631-Y634 HydrophobicContact CB-CE2 4.26Å; F631-Y634 HydrophobicContact CD1-CE2 4.31Å; F631-Y634 HydrophobicContact CG-CD2 4.49Å; F631-Y634 PolarHBondContact O-N 3.39Å; P632-Y634 PolarHBondContact O-N 3.01Å; Y634-F636 VanDerWaalsContact CB-CE2 3.45Å; Y634-F636 HydrophobicContact CD2-CE2 4.2Å; Y634-F636 AromaticContact CG-CE2 3.99Å; Y634-F636 HydrophobicContact CG-CE2 3.99Å; Y634-F636 PolarHBondContact O-N 2.87Å
635	K	87.8	Confident	85.3	Confident	139 Å²	139	93.2 Å²	93.2	60%	0.604	48%	0.475	S	S	*	.			trans	-78.2	47.6	-179.6	-67.5	166.8	156.6	-102.9	0	112.6	E638 L639	K635-E638 HydrophobicContact CB-CB 4.29Å; K635-E638 HydrophobicContact CB-CG 4.34Å; K635-E638 WeakPolarHBondContact CD-OE2 3.25Å; K635-E638 VanDerWaalsContact NZ-CD 3.3Å; K635-E638 IonicContact NZ-OE1 3.9Å; K635-E638 PolarHBondContact NZ-OE1 2.89Å; K635-E638 IonicContact NZ-OE2 3.06Å; K635-E638 PolarHBondContact NZ-OE2 3.34Å; K635-E638 PolarHBondContact O-N 3.41Å; K635-L639 PolarHBondContact O-N 3.39Å; K635-L639 VanDerWaalsContact O-N 3.09Å
636	F	87.2	Confident	84.7	Confident	37 Å²	37	100.7 Å²	100.7	16%	0.162	49%	0.494	C	S	.	.	H	α-helix	trans	-57.5	-43.4	178.1	-78	-63.7	0	0	0	113.3	L627 E628 F631 Y634 E638 L639 F640	L627-F636 HydrophobicContact CB-CD1 4.34Å; L627-F636 HydrophobicContact CB-CD2 4.27Å; L627-F636 HydrophobicContact CB-CE1 4.39Å; L627-F636 HydrophobicContact CB-CE2 4.33Å; L627-F636 HydrophobicContact CB-CG 4.29Å; L627-F636 HydrophobicContact CB-CZ 4.39Å; L627-F636 HydrophobicContact CD1-CE1 4.22Å; L627-F636 HydrophobicContact CD2-CZ 4.38Å; E628-F636 HydrophobicContact CG-CB 4.02Å; F631-F636 HydrophobicContact CB-CD2 4.2Å; F631-F636 HydrophobicContact CB-CE2 3.59Å; F631-F636 HydrophobicContact CD2-CE2 4.38Å; F631-F636 HydrophobicContact CG-CE2 4.33Å; Y634-F636 VanDerWaalsContact CB-CE2 3.45Å; Y634-F636 HydrophobicContact CD2-CE2 4.2Å; Y634-F636 AromaticContact CG-CE2 3.99Å; Y634-F636 HydrophobicContact CG-CE2 3.99Å; Y634-F636 PolarHBondContact O-N 2.87Å; F636-E638 PolarHBondContact O-N 2.84Å; F636-L639 HydrophobicContact CD1-CD2 4.41Å; F636-L639 WeakPolarHBondContact O-CB 3.34Å; F636-L639 PolarHBondContact O-N 3.24Å; F636-L639 VanDerWaalsContact O-N 3.1Å; F636-F640 HydrophobicContact CB-CD2 4.35Å; F636-F640 HydrophobicContact CB-CE2 3.73Å; F636-F640 HydrophobicContact CB-CZ 3.86Å; F636-F640 HydrophobicContact CD1-CE1 4.09Å; F636-F640 HydrophobicContact CD1-CE2 4.48Å; F636-F640 AromaticContact CD1-CZ 3.74Å; F636-F640 HydrophobicContact CD1-CZ 3.74Å; F636-F640 HydrophobicContact CG-CZ 4.11Å; F636-F640 HydrophobicContact CG-CE2 4.44Å; F636-F640 PolarHBondContact O-N 2.93Å; F636-F640 WeakPolarHBondContact O-CG 3.27Å; F636-F640 VanDerWaalsContact O-CD2 3.26Å; F636-F640 WeakPolarHBondContact O-CD2 3.43Å
637	P	85.3	Confident	84.2	Confident	70 Å²	70	97.9 Å²	97.9	46%	0.455	49%	0.489	S	S	.	.	H	α-helix	trans	-58.5	-45.1	177.5	-26.4	35.3	0	0	0	112.9	E628 L639 F640 V641	E628-P637 HydrophobicContact CG-CG 4.12Å; P637-L639 VanDerWaalsContact C-N 3.3Å; P637-L639 PolarHBondContact O-N 3.29Å; P637-F640 PolarHBondContact O-N 3.24Å; P637-V641 VanDerWaalsContact O-CG2 3.31Å; P637-V641 WeakPolarHBondContact O-CG2 3.14Å; P637-V641 PolarHBondContact O-N 3.23Å
638	E	87.2	Confident	83.6	Confident	116 Å²	116	99.7 Å²	99.7	54%	0.542	50%	0.504	S	S	.	.	H	α-helix	trans	-62.2	-39.4	176.9	-62	175.8	-161.9	0	0	111.4	K635 F636 K642	K635-E638 HydrophobicContact CB-CB 4.29Å; K635-E638 HydrophobicContact CB-CG 4.34Å; K635-E638 WeakPolarHBondContact CD-OE2 3.25Å; K635-E638 VanDerWaalsContact NZ-CD 3.3Å; K635-E638 IonicContact NZ-OE1 3.9Å; K635-E638 PolarHBondContact NZ-OE1 2.89Å; K635-E638 IonicContact NZ-OE2 3.06Å; K635-E638 PolarHBondContact NZ-OE2 3.34Å; K635-E638 PolarHBondContact O-N 3.41Å; F636-E638 PolarHBondContact O-N 2.84Å; E638-K642 VanDerWaalsContact O-N 3.12Å; E638-K642 PolarHBondContact O-N 2.87Å; E638-K642 WeakPolarHBondContact O-CB 3.29Å
639	L	86.4	Confident	82.8	Confident	84 Å²	84	105.8 Å²	105.8	44%	0.44	52%	0.523	S	S	.	.	H	α-helix	trans	-67.2	-43.3	178.1	-174.8	69.2	0	0	0	111.7	K635 F636 P637 K642 L643	K635-L639 PolarHBondContact O-N 3.39Å; K635-L639 VanDerWaalsContact O-N 3.09Å; F636-L639 HydrophobicContact CD1-CD2 4.41Å; F636-L639 WeakPolarHBondContact O-CB 3.34Å; F636-L639 PolarHBondContact O-N 3.24Å; F636-L639 VanDerWaalsContact O-N 3.1Å; P637-L639 VanDerWaalsContact C-N 3.3Å; P637-L639 PolarHBondContact O-N 3.29Å; L639-K642 WeakPolarHBondContact O-CB 3.49Å; L639-K642 PolarHBondContact O-N 3.26Å; L639-L643 HydrophobicContact CD1-CD1 4.48Å; L639-L643 HydrophobicContact CD2-CD1 4.35Å; L639-L643 HydrophobicContact CG-CD1 3.86Å; L639-L643 WeakPolarHBondContact O-CB 3.36Å; L639-L643 PolarHBondContact O-N 3.25Å
640	F	87.2	Confident	82.3	Confident	22 Å²	22	104.6 Å²	104.6	10%	0.096	52%	0.515	C	S	.	.	H	α-helix	trans	-66.8	-42.7	178.9	-60.4	-31.1	0	0	0	111.6	E624 L627 E628 F636 P637 K642 L643 H644	E624-F640 HydrophobicContact CB-CD2 3.99Å; E624-F640 HydrophobicContact CB-CE2 3.63Å; E624-F640 HydrophobicContact CB-CZ 4Å; E624-F640 HydrophobicContact CG-CD1 4.05Å; E624-F640 HydrophobicContact CG-CD2 3.96Å; E624-F640 HydrophobicContact CG-CE1 3.93Å; E624-F640 HydrophobicContact CG-CE2 3.8Å; E624-F640 HydrophobicContact CG-CG 4.09Å; E624-F640 HydrophobicContact CG-CZ 3.81Å; L627-F640 HydrophobicContact CB-CZ 4.28Å; L627-F640 HydrophobicContact CD1-CZ 4.09Å; E628-F640 HydrophobicContact CG-CD2 4.46Å; E628-F640 HydrophobicContact CG-CE2 3.9Å; E628-F640 VanDerWaalsContact OE1-CD2 3.29Å; E628-F640 WeakPolarHBondContact OE1-CD2 3.36Å; F636-F640 HydrophobicContact CB-CD2 4.35Å; F636-F640 HydrophobicContact CB-CE2 3.73Å; F636-F640 HydrophobicContact CB-CZ 3.86Å; F636-F640 HydrophobicContact CD1-CE1 4.09Å; F636-F640 HydrophobicContact CD1-CE2 4.48Å; F636-F640 AromaticContact CD1-CZ 3.74Å; F636-F640 HydrophobicContact CD1-CZ 3.74Å; F636-F640 HydrophobicContact CG-CZ 4.11Å; F636-F640 HydrophobicContact CG-CE2 4.44Å; F636-F640 PolarHBondContact O-N 2.93Å; F636-F640 WeakPolarHBondContact O-CG 3.27Å; F636-F640 VanDerWaalsContact O-CD2 3.26Å; F636-F640 WeakPolarHBondContact O-CD2 3.43Å; P637-F640 PolarHBondContact O-N 3.24Å; F640-K642 PolarHBondContact O-N 3.3Å; F640-L643 HydrophobicContact CD1-CD1 4.2Å; F640-L643 VanDerWaalsContact O-N 3.14Å; F640-L643 PolarHBondContact O-N 3.37Å; F640-H644 WeakPolarHBondContact O-CB 3.32Å; F640-H644 PolarHBondContact O-CD2 2.92Å; F640-H644 PolarHBondContact O-N 3.07Å
641	V	84.2	Confident	81.9	Confident	110 Å²	110	104 Å²	104	67%	0.667	51%	0.511	S	S	*	.	H	α-helix	trans	-55.6	-43.5	172.1	171	0	0	0	0	110.4	P637 S645	P637-V641 VanDerWaalsContact O-CG2 3.31Å; P637-V641 WeakPolarHBondContact O-CG2 3.14Å; P637-V641 PolarHBondContact O-N 3.23Å; V641-S645 WeakPolarHBondContact O-CB 3.44Å; V641-S645 PolarHBondContact O-N 3Å
642	K	83.6	Confident	81.3	Confident	158 Å²	158	108.3 Å²	108.3	69%	0.687	53%	0.525	S	S	*	.	H	α-helix	trans	-66.5	-41.5	176.3	-170.7	178.4	-179.5	179.8	0	112.9	E638 L639 F640 S645	E638-K642 VanDerWaalsContact O-N 3.12Å; E638-K642 PolarHBondContact O-N 2.87Å; E638-K642 WeakPolarHBondContact O-CB 3.29Å; L639-K642 WeakPolarHBondContact O-CB 3.49Å; L639-K642 PolarHBondContact O-N 3.26Å; F640-K642 PolarHBondContact O-N 3.3Å; K642-S645 PolarHBondContact O-N 2.85Å; K642-S645 PolarHBondContact O-OG 3.31Å
643	L	81.4	Confident	80.7	Confident	119 Å²	119	111.1 Å²	111.1	62%	0.623	52%	0.524	S	S	*	.	H	α-helix	trans	-65.2	-40.6	178.1	-88.1	153.2	0	0	0	112.7	L639 F640	L639-L643 HydrophobicContact CD1-CD1 4.48Å; L639-L643 HydrophobicContact CD2-CD1 4.35Å; L639-L643 HydrophobicContact CG-CD1 3.86Å; L639-L643 WeakPolarHBondContact O-CB 3.36Å; L639-L643 PolarHBondContact O-N 3.25Å; F640-L643 HydrophobicContact CD1-CD1 4.2Å; F640-L643 VanDerWaalsContact O-N 3.14Å; F640-L643 PolarHBondContact O-N 3.37Å
644	H	81.6	Confident	80.1	Confident	99 Å²	99	107 Å²	107	46%	0.458	51%	0.51	S	S	.	.	H	α-helix	trans	-82.5	-14.7	178.7	-66.2	-55.8	0	0	0	112.9	R617 E624 F640 R646	R617-H644 PolarHBondContact NH1-CE1 2.9Å; R617-H644 VanDerWaalsContact NH1-CE1 3.32Å; E624-H644 IonicContact OE1-CD2 3.77Å; E624-H644 IonicContact OE1-CE1 2.7Å; E624-H644 PolarHBondContact OE1-CE1 3.49Å; E624-H644 VanDerWaalsContact OE1-CE1 3.26Å; E624-H644 IonicContact OE1-NE2 3.95Å; E624-H644 PolarHBondContact OE1-NE2 2.96Å; E624-H644 IonicContact OE2-NE2 3.68Å; E624-H644 PolarHBondContact OE2-NE2 3.07Å; F640-H644 WeakPolarHBondContact O-CB 3.32Å; F640-H644 PolarHBondContact O-CD2 2.92Å; F640-H644 PolarHBondContact O-N 3.07Å; H644-R646 PolarHBondContact O-N 2.82Å
645	S	79.4	Confident	79.6	Confident	68 Å²	68	106.2 Å²	106.2	48%	0.476	51%	0.511	S	S	.	.	S	Bend	trans	-61.1	134.5	174.7	76.6	0	0	0	0	111	V641 K642 S647	V641-S645 WeakPolarHBondContact O-CB 3.44Å; V641-S645 PolarHBondContact O-N 3Å; K642-S645 PolarHBondContact O-N 2.85Å; K642-S645 PolarHBondContact O-OG 3.31Å; S645-S647 PolarHBondContact O-N 3.38Å
646	R	72.5	Confident	78.9	Confident	184 Å²	184	106.8 Å²	106.8	69%	0.694	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-64.7	129.9	175.7	-71.9	-172.9	177.8	-172.1	0.9	109.1	H644 Q651	H644-R646 PolarHBondContact O-N 2.82Å; R646-Q651 HydrophobicContact CB-CG 4.05Å
647	S	74.9	Confident	78.1	Confident	56 Å²	56	109.3 Å²	109.3	39%	0.392	53%	0.529	S	S	.	.	P	Polyproline II helix	trans	-50.9	132.8	176	176.6	0	0	0	0	110.8	S645 R649 V650 Q651	S645-S647 PolarHBondContact O-N 3.38Å; S647-R649 PolarHBondContact O-N 2.85Å; S647-R649 PolarHBondContact OG-N 2.72Å; S647-V650 PolarHBondContact O-N 3.22Å; S647-Q651 PolarHBondContact O-N 3.06Å; S647-Q651 VanDerWaalsContact O-N 3.1Å
648	P	73.4	Confident	77.5	Confident	79 Å²	79	111.9 Å²	111.9	51%	0.513	54%	0.535	S	S	.	.	H	α-helix	trans	-55	-27.5	176.7	-26.8	33.7	0	0	0	113.1	R652	P648-R652 VanDerWaalsContact O-N 3.08Å; P648-R652 PolarHBondContact O-N 3.34Å; P648-R652 VanDerWaalsContact O-CG 3.24Å; P648-R652 WeakPolarHBondContact O-CB 3.38Å; P648-R652 WeakPolarHBondContact O-CG 3.18Å
649	R	72.1	Confident	76.5	Confident	206 Å²	206	109.5 Å²	109.5	78%	0.777	53%	0.531	S	S	*	.	H	α-helix	trans	-68.3	-40.8	176	-65.2	-178	179.2	174.2	-0.5	112.1	S647 Y653	S647-R649 PolarHBondContact O-N 2.85Å; S647-R649 PolarHBondContact OG-N 2.72Å; R649-Y653 WeakPolarHBondContact O-CB 3.45Å; R649-Y653 PolarHBondContact O-N 3.21Å
650	V	73.1	Confident	75.3	Confident	86 Å²	86	108.8 Å²	108.8	52%	0.521	53%	0.533	S	S	.	.	H	α-helix	trans	-72.1	-39	179.1	177.3	0	0	0	0	110.8	S647 Y653 S654	S647-V650 PolarHBondContact O-N 3.22Å; V650-Y653 PolarHBondContact O-N 3.32Å; V650-S654 WeakPolarHBondContact O-CB 3.11Å; V650-S654 PolarHBondContact O-N 3.18Å
651	Q	74.2	Confident	73.8	Confident	95 Å²	95	112.1 Å²	112.1	44%	0.444	56%	0.559	S	S	.	*	H	α-helix	trans	-60.5	-47.7	172.8	-76.5	178.1	-17	0	0	111.8	R646 S647 Y653 S654 Q655	R646-Q651 HydrophobicContact CB-CG 4.05Å; S647-Q651 PolarHBondContact O-N 3.06Å; S647-Q651 VanDerWaalsContact O-N 3.1Å; Q651-Y653 VanDerWaalsContact C-N 3.31Å; Q651-Y653 PolarHBondContact O-N 2.96Å; Q651-S654 PolarHBondContact O-N 3.41Å; Q651-Q655 WeakPolarHBondContact O-CB 3.18Å; Q651-Q655 VanDerWaalsContact O-CG 3.32Å; Q651-Q655 WeakPolarHBondContact O-CG 3.32Å; Q651-Q655 PolarHBondContact O-N 2.98Å
652	R	75.8	Confident	72.4	Confident	173 Å²	173	114.1 Å²	114.1	65%	0.653	57%	0.565	S	S	*	*	H	α-helix	trans	-61	-37.9	176.6	-73.4	175.2	-169	176.5	3.6	112.8	P648 K656	P648-R652 VanDerWaalsContact O-N 3.08Å; P648-R652 PolarHBondContact O-N 3.34Å; P648-R652 VanDerWaalsContact O-CG 3.24Å; P648-R652 WeakPolarHBondContact O-CB 3.38Å; P648-R652 WeakPolarHBondContact O-CG 3.18Å; R652-K656 WeakPolarHBondContact O-CG 3.27Å; R652-K656 PolarHBondContact O-N 3.07Å
653	Y	74.4	Confident	71	Confident	158 Å²	158	115.5 Å²	115.5	62%	0.62	57%	0.571	S	S	*	*	H	α-helix	trans	-68.5	-43.1	176.7	-175.5	-105.1	0	0	0	112.1	R649 V650 Q651 K656 L657	R649-Y653 WeakPolarHBondContact O-CB 3.45Å; R649-Y653 PolarHBondContact O-N 3.21Å; V650-Y653 PolarHBondContact O-N 3.32Å; Q651-Y653 VanDerWaalsContact C-N 3.31Å; Q651-Y653 PolarHBondContact O-N 2.96Å; Y653-K656 PolarHBondContact O-N 3.23Å; Y653-L657 PolarHBondContact O-N 3.15Å; Y653-L657 HydrophobicContact CG-CD1 4.48Å; Y653-L657 HydrophobicContact CE2-CD1 4.5Å; Y653-L657 HydrophobicContact CE1-CD1 3.2Å; Y653-L657 HydrophobicContact CD1-CD1 3.66Å; Y653-L657 HydrophobicContact CE1-CG 4.4Å
654	S	73.4	Confident	69.2	Low	50 Å²	50	124.1 Å²	124.1	35%	0.35	60%	0.595	S	S	.	*	H	α-helix	trans	-66.2	-38.4	177.5	-162.9	0	0	0	0	112.1	V650 Q651 L657 Q658	V650-S654 WeakPolarHBondContact O-CB 3.11Å; V650-S654 PolarHBondContact O-N 3.18Å; Q651-S654 PolarHBondContact O-N 3.41Å; S654-L657 PolarHBondContact O-N 3.01Å; S654-Q658 WeakPolarHBondContact O-CG 3.44Å; S654-Q658 PolarHBondContact O-N 3.06Å
655	Q	75.6	Confident	68.5	Low	121 Å²	121	125.4 Å²	125.4	57%	0.565	60%	0.602	S	S	*	*	H	α-helix	trans	-63.9	-41	172	-74.7	173.3	-12.9	0	0	112	Q651 Q658 S659	Q651-Q655 WeakPolarHBondContact O-CB 3.18Å; Q651-Q655 VanDerWaalsContact O-CG 3.32Å; Q651-Q655 WeakPolarHBondContact O-CG 3.32Å; Q651-Q655 PolarHBondContact O-N 2.98Å; Q655-Q658 PolarHBondContact O-N 3.45Å; Q655-S659 WeakPolarHBondContact O-CB 3.45Å; Q655-S659 PolarHBondContact O-N 3.15Å; Q655-S659 PolarHBondContact O-OG 2.61Å
656	K	74.9	Confident	68	Low	152 Å²	152	128.4 Å²	128.4	66%	0.661	61%	0.609	S	S	*	*	H	α-helix	trans	-61.1	-45.4	173.1	-83.1	-175	175.7	-173	0	111.9	R652 Y653 S659 S660	R652-K656 WeakPolarHBondContact O-CG 3.27Å; R652-K656 PolarHBondContact O-N 3.07Å; Y653-K656 PolarHBondContact O-N 3.23Å; K656-S659 PolarHBondContact O-OG 2.9Å; K656-S659 PolarHBondContact O-N 3.15Å; K656-S659 WeakPolarHBondContact CA-OG 3.39Å; K656-S660 PolarHBondContact O-N 3.1Å; K656-S660 PolarHBondContact O-OG 2.85Å
657	L	70.5	Confident	67.7	Low	90 Å²	90	125.3 Å²	125.3	47%	0.471	60%	0.604	S	S	.	*	H	α-helix	trans	-60.4	-44.4	176.4	-96.4	153.6	0	0	0	113	Y653 S654 S660 S661	Y653-L657 PolarHBondContact O-N 3.15Å; Y653-L657 HydrophobicContact CG-CD1 4.48Å; Y653-L657 HydrophobicContact CE2-CD1 4.5Å; Y653-L657 HydrophobicContact CE1-CD1 3.2Å; Y653-L657 HydrophobicContact CD1-CD1 3.66Å; Y653-L657 HydrophobicContact CE1-CG 4.4Å; S654-L657 PolarHBondContact O-N 3.01Å; L657-S660 WeakPolarHBondContact CA-OG 3.48Å; L657-S660 PolarHBondContact O-N 3.11Å; L657-S660 PolarHBondContact O-OG 3.25Å; L657-S661 PolarHBondContact O-N 3.02Å
658	Q	71.1	Confident	67.3	Low	123 Å²	123	129.4 Å²	129.4	58%	0.575	62%	0.617	S	S	*	*	H	α-helix	trans	-64.3	-42.2	175.1	-75.2	177.8	-17.4	0	0	111.5	S654 Q655 S660 S661 L662	S654-Q658 WeakPolarHBondContact O-CG 3.44Å; S654-Q658 PolarHBondContact O-N 3.06Å; Q655-Q658 PolarHBondContact O-N 3.45Å; Q658-S660 VanDerWaalsContact C-N 3.29Å; Q658-S660 PolarHBondContact O-N 2.63Å; Q658-S661 PolarHBondContact O-N 2.88Å; Q658-L662 PolarHBondContact O-N 2.96Å
659	S	67.7	Low	66.9	Low	66 Å²	66	132.6 Å²	132.6	46%	0.462	62%	0.623	S	S	.	*	H	α-helix	trans	-66.3	-28.1	177.2	74.2	0	0	0	0	113.7	Q655 K656	Q655-S659 WeakPolarHBondContact O-CB 3.45Å; Q655-S659 PolarHBondContact O-N 3.15Å; Q655-S659 PolarHBondContact O-OG 2.61Å; K656-S659 PolarHBondContact O-OG 2.9Å; K656-S659 PolarHBondContact O-N 3.15Å; K656-S659 WeakPolarHBondContact CA-OG 3.39Å
660	S	60.1	Low	66.6	Low	69 Å²	69	127.7 Å²	127.7	48%	0.483	61%	0.613	S	S	.	*	H	α-helix	trans	-80.8	-28.4	173.9	53.4	0	0	0	0	113.4	K656 L657 Q658 K663	K656-S660 PolarHBondContact O-N 3.1Å; K656-S660 PolarHBondContact O-OG 2.85Å; L657-S660 WeakPolarHBondContact CA-OG 3.48Å; L657-S660 PolarHBondContact O-N 3.11Å; L657-S660 PolarHBondContact O-OG 3.25Å; Q658-S660 VanDerWaalsContact C-N 3.29Å; Q658-S660 PolarHBondContact O-N 2.63Å; S660-K663 PolarHBondContact O-N 2.77Å
661	S	56.1	Low	66.1	Low	92 Å²	92	130.6 Å²	130.6	64%	0.643	62%	0.619	S	S	*	*	H	α-helix	trans	-77.3	-23.3	177.3	-168.1	0	0	0	0	113.1	L657 Q658 K663	L657-S661 PolarHBondContact O-N 3.02Å; Q658-S661 PolarHBondContact O-N 2.88Å; S661-K663 VanDerWaalsContact C-N 3.29Å
662	L	55.8	Low	65.5	Low	152 Å²	152	133.4 Å²	133.4	80%	0.796	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	-3.7	174.6	-79.1	154.6	0	0	0	113.2	Q658	Q658-L662 PolarHBondContact O-N 2.96Å
663	K	52.9	Low	64.6	Low	187 Å²	187	130.1 Å²	130.1	81%	0.813	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.3	13.1	178.7	-76.4	-171.4	175.8	-173.6	0	113.6	S660 S661	S660-K663 PolarHBondContact O-N 2.77Å; S661-K663 VanDerWaalsContact C-N 3.29Å
664	R	43.2	Very low	63.7	Low	301 Å²	301	127.5 Å²	127.5	100%	1.136	63%	0.632	S	S	*	*			trans	-112.7	0	173.8	-101.6	-171.9	179.8	-179.2	0	111.5

Retrieved 664 of 664 residues in 693.7 ms (Link to these results)

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