A0A087YFC8_POEFO Loading...

CCDC81 HU domain-containing protein

AlphaFold DB , UniProt , Accession A0A087YFC8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 699 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	E	45.6	Very low	48.5	Very low	141 Å²	141	73.8 Å²	73.8	66%	0.659	40%	0.401	S	S	*	.				0	176.9	0	-67.7	61	-128.2	0	0	108.9	S3 N4	E1-S3 WeakPolarHBondContact CB-OG 3.3Å; E1-S3 PolarHBondContact O-N 3Å; E1-N4 PolarHBondContact O-N 3.41Å
2	M	51.9	Low	47.9	Very low	9 Å²	9	72.5 Å²	72.5	4%	0.044	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-27.8	169.6	-78.2	-66.6	-65.3	0	0	112.6	N4 I5 E31 W34 L147 P148	M2-N4 PolarHBondContact O-N 3.43Å; M2-I5 PolarHBondContact O-N 2.95Å; M2-E31 HydrophobicContact CB-CB 4.38Å; M2-E31 HydrophobicContact CB-CG 4.34Å; M2-E31 HydrophobicContact CG-CG 4.39Å; M2-E31 PolarHBondContact N-OE1 3.12Å; M2-W34 HydrophobicContact CE-CB 3.96Å; M2-W34 HydrophobicContact CE-CD2 3.89Å; M2-W34 HydrophobicContact CE-CG 3.59Å; M2-L147 HydrophobicContact CE-CD1 3.7Å; M2-L147 HydrophobicContact SD-CD1 3.62Å; M2-L147 HydrophobicContact SD-CG 4.46Å; M2-P148 HydrophobicContact CG-CG 4.49Å; M2-P148 HydrophobicContact SD-CG 4.38Å
3	S	47.9	Very low	47.9	Very low	36 Å²	36	70.5 Å²	70.5	25%	0.252	41%	0.405	S	S	.	.	H	α-helix	trans	-43.1	-34.5	172.9	-40.4	0	0	0	0	114.3	E1 I5 L6 L7	E1-S3 WeakPolarHBondContact CB-OG 3.3Å; E1-S3 PolarHBondContact O-N 3Å; S3-I5 VanDerWaalsContact C-N 3.3Å; S3-I5 PolarHBondContact O-N 2.61Å; S3-L6 PolarHBondContact O-N 3.2Å; S3-L7 WeakPolarHBondContact O-CB 3.44Å; S3-L7 PolarHBondContact O-N 3.02Å
4	N	53.5	Low	48	Very low	97 Å²	97	74.1 Å²	74.1	52%	0.519	41%	0.413	S	S	.	.	H	α-helix	trans	-63.9	-32.1	-179.8	-73.7	3	0	0	0	112.9	E1 M2 L7 L8	E1-N4 PolarHBondContact O-N 3.41Å; M2-N4 PolarHBondContact O-N 3.43Å; N4-L7 PolarHBondContact O-N 3.09Å; N4-L8 WeakPolarHBondContact O-CB 3.28Å; N4-L8 WeakPolarHBondContact O-CD1 3.38Å; N4-L8 WeakPolarHBondContact O-CG 3.14Å; N4-L8 PolarHBondContact O-N 3.32Å; N4-L8 VanDerWaalsContact O-N 3.09Å
5	I	56.3	Low	47.7	Very low	6 Å²	6	84.3 Å²	84.3	3%	0.031	44%	0.442	C	S	.	.	H	α-helix	trans	-73.1	-33.2	178.8	-63.3	173.4	0	0	0	110.6	M2 S3 T131 I145 L147	M2-I5 PolarHBondContact O-N 2.95Å; S3-I5 VanDerWaalsContact C-N 3.3Å; S3-I5 PolarHBondContact O-N 2.61Å; I5-T131 HydrophobicContact CG2-CG2 4.43Å; I5-I145 HydrophobicContact CD1-CG2 4Å; I5-I145 HydrophobicContact CG1-CG2 4.02Å; I5-L147 HydrophobicContact CD1-CB 4.43Å; I5-L147 HydrophobicContact CD1-CD1 3.51Å
6	L	51.9	Low	47.4	Very low	49 Å²	49	88.4 Å²	88.4	26%	0.257	46%	0.461	S	S	.	.	H	α-helix	trans	-71.5	-41	172.2	-66.8	166	0	0	0	111.5	S3 L8 A9 L20 V30	S3-L6 PolarHBondContact O-N 3.2Å; L6-L8 PolarHBondContact O-N 3.14Å; L6-A9 WeakPolarHBondContact O-CB 3.43Å; L6-A9 PolarHBondContact O-N 3.31Å; L6-L20 HydrophobicContact CD2-CD1 4.24Å; L6-L20 HydrophobicContact CD2-CD2 4.41Å; L6-V30 HydrophobicContact CD1-CB 3.98Å; L6-V30 HydrophobicContact CD1-CG1 4.05Å; L6-V30 HydrophobicContact CD1-CG2 4.1Å
7	L	51.2	Low	47.5	Very low	148 Å²	148	84.8 Å²	84.8	78%	0.775	44%	0.442	S	S	*	.	H	α-helix	trans	-67.6	-21.8	178.4	-143.8	80.4	0	0	0	113.4	S3 N4 A9	S3-L7 WeakPolarHBondContact O-CB 3.44Å; S3-L7 PolarHBondContact O-N 3.02Å; N4-L7 PolarHBondContact O-N 3.09Å; L7-A9 VanDerWaalsContact C-N 3.34Å
8	L	48.9	Very low	47.8	Very low	64 Å²	64	92.3 Å²	92.3	34%	0.335	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-7.2	176.3	-73.6	167.5	0	0	0	113.5	N4 L6	N4-L8 WeakPolarHBondContact O-CB 3.28Å; N4-L8 WeakPolarHBondContact O-CD1 3.38Å; N4-L8 WeakPolarHBondContact O-CG 3.14Å; N4-L8 PolarHBondContact O-N 3.32Å; N4-L8 VanDerWaalsContact O-N 3.09Å; L6-L8 PolarHBondContact O-N 3.14Å
9	A	43.1	Very low	48	Very low	30 Å²	30	88.1 Å²	88.1	25%	0.248	45%	0.446	C	S	.	.	S	Bend	trans	-77.8	120.1	170.3	0	0	0	0	0	110	L6 L7	L6-A9 WeakPolarHBondContact O-CB 3.43Å; L6-A9 PolarHBondContact O-N 3.31Å; L7-A9 VanDerWaalsContact C-N 3.34Å
10	S	41.6	Very low	48.1	Very low	89 Å²	89	84.7 Å²	84.7	62%	0.622	43%	0.429	S	S	*	.			trans	-59.9	146.9	-179.1	-173.6	0	0	0	0	111.9	G12 D13	S10-G12 PolarHBondContact O-N 3.26Å; S10-G12 VanDerWaalsContact O-N 3.09Å; S10-D13 PolarHBondContact O-N 2.95Å
11	E	41.7	Very low	48.2	Very low	143 Å²	143	84.6 Å²	84.6	67%	0.668	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-62	-23.9	-172.2	-58.3	-154	87	0	0	114.3	D13 K14	E11-D13 VanDerWaalsContact C-N 3.3Å; E11-D13 PolarHBondContact O-N 3.23Å; E11-K14 HydrophobicContact CB-CD 4.44Å; E11-K14 WeakPolarHBondContact O-CG 3.34Å; E11-K14 IonicContact OE1-NZ 2.61Å; E11-K14 PolarHBondContact OE1-NZ 3.25Å
12	G	41.7	Very low	48.5	Very low	58 Å²	58	85.6 Å²	85.6	60%	0.598	43%	0.434	S	S	*	.	G	3₁₀ helix	trans	-63	-32.2	173.7	0	0	0	0	0	113.9	S10 K14	S10-G12 PolarHBondContact O-N 3.26Å; S10-G12 VanDerWaalsContact O-N 3.09Å; G12-K14 VanDerWaalsContact C-N 3.32Å; G12-K14 PolarHBondContact O-N 3.45Å
13	D	47.8	Very low	48.5	Very low	47 Å²	47	85.8 Å²	85.8	25%	0.251	44%	0.435	S	S	.	.	G	3₁₀ helix	trans	-82.2	-6.6	-174.2	-84.2	-27.1	0	0	0	114	S10 E11 R15 M16 R137	S10-D13 PolarHBondContact O-N 2.95Å; E11-D13 VanDerWaalsContact C-N 3.3Å; E11-D13 PolarHBondContact O-N 3.23Å; D13-R15 PolarHBondContact O-N 2.72Å; D13-M16 PolarHBondContact O-N 2.72Å; D13-M16 VanDerWaalsContact O-N 3.12Å; D13-R137 VanDerWaalsContact CG-NH1 3.26Å; D13-R137 IonicContact OD2-CZ 3.51Å; D13-R137 IonicContact OD2-NH1 2.72Å; D13-R137 PolarHBondContact OD2-NH1 3.13Å
14	K	48.4	Very low	48.5	Very low	120 Å²	120	88 Å²	88	52%	0.522	45%	0.45	S	S	.	.	G	3₁₀ helix	trans	-55.2	-18.5	175.1	-67.5	174.1	177.2	176.1	0	113.1	E11 G12	E11-K14 HydrophobicContact CB-CD 4.44Å; E11-K14 WeakPolarHBondContact O-CG 3.34Å; E11-K14 IonicContact OE1-NZ 2.61Å; E11-K14 PolarHBondContact OE1-NZ 3.25Å; G12-K14 VanDerWaalsContact C-N 3.32Å; G12-K14 PolarHBondContact O-N 3.45Å
15	R	44.4	Very low	48.4	Very low	227 Å²	227	93 Å²	93	86%	0.857	47%	0.467	S	S	*	.	G	3₁₀ helix	trans	-89.9	-12.2	-178	-59.7	-177.1	-177.5	-177	1.3	115.2	D13	D13-R15 PolarHBondContact O-N 2.72Å
16	M	42.5	Very low	48.3	Very low	150 Å²	150	96.7 Å²	96.7	74%	0.739	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.5	-4.2	-176.2	-70.7	-157	-110.6	0	0	115.1	D13 R18	D13-M16 PolarHBondContact O-N 2.72Å; D13-M16 VanDerWaalsContact O-N 3.12Å; M16-R18 PolarHBondContact O-N 2.67Å
17	L	49.6	Very low	48.7	Very low	27 Å²	27	96.7 Å²	96.7	14%	0.141	49%	0.494	C	S	.	.			trans	-102.3	78.2	-169.2	-59.7	172	0	0	0	111.2	G19 L20 L21 E130	L17-G19 VanDerWaalsContact C-N 3.33Å; L17-G19 PolarHBondContact O-N 3.38Å; L17-L20 HydrophobicContact CB-CB 4.17Å; L17-L20 HydrophobicContact CB-CD1 4.44Å; L17-L20 HydrophobicContact CD1-CD1 4.16Å; L17-L20 PolarHBondContact O-N 2.92Å; L17-L21 VanDerWaalsContact O-CB 3.29Å; L17-L21 WeakPolarHBondContact O-CB 3.4Å; L17-L21 VanDerWaalsContact O-CG 3.25Å; L17-L21 WeakPolarHBondContact O-CG 3.25Å; L17-L21 PolarHBondContact O-N 3.05Å; L17-E130 WeakPolarHBondContact CB-OE2 3.34Å; L17-E130 HydrophobicContact CD2-CB 4.18Å; L17-E130 HydrophobicContact CD2-CG 4.07Å
18	R	53	Low	49.3	Very low	220 Å²	220	93.6 Å²	93.6	83%	0.83	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-30.9	-171.6	-75.5	-167.3	179.1	-160.7	1.4	114.2	M16 E130	M16-R18 PolarHBondContact O-N 2.67Å; R18-E130 PolarHBondContact N-OE1 3.45Å
19	G	50.5	Low	50.6	Low	12 Å²	12	92 Å²	92	12%	0.124	47%	0.474	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-50	176	0	0	0	0	0	112.2	L17 L21 H22 E130	L17-G19 VanDerWaalsContact C-N 3.33Å; L17-G19 PolarHBondContact O-N 3.38Å; G19-L21 PolarHBondContact O-N 2.91Å; G19-H22 PolarHBondContact O-N 3.3Å; G19-E130 PolarHBondContact N-OE1 2.69Å; G19-E130 PolarHBondContact N-OE2 3.18Å
20	L	51.5	Low	52.2	Low	20 Å²	20	90.8 Å²	90.8	11%	0.105	46%	0.464	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-24.5	175.9	-69.2	169	0	0	0	112.4	L6 L17 H22 L23 S24 V30 E130	L6-L20 HydrophobicContact CD2-CD1 4.24Å; L6-L20 HydrophobicContact CD2-CD2 4.41Å; L17-L20 HydrophobicContact CB-CB 4.17Å; L17-L20 HydrophobicContact CB-CD1 4.44Å; L17-L20 HydrophobicContact CD1-CD1 4.16Å; L17-L20 PolarHBondContact O-N 2.92Å; L20-H22 PolarHBondContact O-N 3.07Å; L20-L23 CarbonylContact O-C 3.59Å; L20-L23 PolarHBondContact O-N 2.85Å; L20-S24 VanDerWaalsContact O-CA 3.23Å; L20-S24 WeakPolarHBondContact O-CA 3.1Å; L20-S24 WeakPolarHBondContact O-CB 3.31Å; L20-S24 PolarHBondContact O-N 3.35Å; L20-V30 HydrophobicContact CD2-CG2 3.75Å; L20-E130 WeakPolarHBondContact CB-OE2 3.46Å; L20-E130 HydrophobicContact CD1-CB 3.74Å; L20-E130 HydrophobicContact CG-CB 4.1Å; L20-E130 WeakPolarHBondContact CG-OE2 3.41Å; L20-E130 PolarHBondContact N-OE2 3.37Å
21	L	49.2	Very low	53.9	Low	83 Å²	83	89.5 Å²	89.5	44%	0.435	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-27.2	172.6	-88	165.1	0	0	0	113.4	L17 G19 S24	L17-L21 VanDerWaalsContact O-CB 3.29Å; L17-L21 WeakPolarHBondContact O-CB 3.4Å; L17-L21 VanDerWaalsContact O-CG 3.25Å; L17-L21 WeakPolarHBondContact O-CG 3.25Å; L17-L21 PolarHBondContact O-N 3.05Å; G19-L21 PolarHBondContact O-N 2.91Å; L21-S24 VanDerWaalsContact O-CB 3.3Å; L21-S24 WeakPolarHBondContact O-CB 3.43Å
22	H	51.1	Low	55.8	Low	163 Å²	163	85.5 Å²	85.5	76%	0.755	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-27.2	171.5	-104.9	17.8	0	0	0	113.4	G19 L20 S24	G19-H22 PolarHBondContact O-N 3.3Å; L20-H22 PolarHBondContact O-N 3.07Å; H22-S24 VanDerWaalsContact C-N 3.34Å
23	L	52.6	Low	57.8	Low	13 Å²	13	82.7 Å²	82.7	7%	0.068	41%	0.407	C	S	.	.	S	Bend	trans	-92.4	6	174.7	-58.6	176.4	0	0	0	112.6	L20 K25 N26 D29 V30 I33 Y119 V123 C127	L20-L23 CarbonylContact O-C 3.59Å; L20-L23 PolarHBondContact O-N 2.85Å; L23-K25 PolarHBondContact O-N 3.2Å; L23-N26 PolarHBondContact O-N 3.44Å; L23-D29 HydrophobicContact CD2-CB 4.35Å; L23-V30 HydrophobicContact CD1-CG2 4.36Å; L23-I33 HydrophobicContact CD1-CD1 3.78Å; L23-Y119 HydrophobicContact CD2-CD1 3.79Å; L23-Y119 HydrophobicContact CD2-CE1 3.49Å; L23-Y119 VanDerWaalsContact CD2-CE1 3.49Å; L23-V123 HydrophobicContact CD1-CG1 4.07Å; L23-V123 HydrophobicContact CD2-CG1 3.95Å; L23-V123 HydrophobicContact CG-CG1 4.02Å; L23-C127 HydrophobicContact CD1-CB 3.98Å
24	S	48.2	Very low	59.6	Low	82 Å²	82	80.7 Å²	80.7	57%	0.573	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-5.3	-155.7	-169.5	0	0	0	0	117.1	L20 L21 H22	L20-S24 VanDerWaalsContact O-CA 3.23Å; L20-S24 WeakPolarHBondContact O-CA 3.1Å; L20-S24 WeakPolarHBondContact O-CB 3.31Å; L20-S24 PolarHBondContact O-N 3.35Å; L21-S24 VanDerWaalsContact O-CB 3.3Å; L21-S24 WeakPolarHBondContact O-CB 3.43Å; H22-S24 VanDerWaalsContact C-N 3.34Å
25	K	52.4	Low	61.5	Low	202 Å²	202	76 Å²	76	88%	0.878	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	-20.2	-179.8	-67.7	-173.1	176.2	-178.2	0	113.4	L23	L23-K25 PolarHBondContact O-N 3.2Å
26	N	54.1	Low	63.5	Low	84 Å²	84	66.9 Å²	66.9	45%	0.449	34%	0.344	S	S	.	.			trans	-129.2	109.1	-169.9	-70.4	-6.2	0	0	0	112.7	L23 P28 D29	L23-N26 PolarHBondContact O-N 3.44Å; N26-P28 VanDerWaalsContact C-CD 3.41Å; N26-P28 HydrophobicContact CB-CG 4.17Å; N26-D29 HydrophobicContact CB-CB 4.15Å; N26-D29 VanDerWaalsContact CB-CG 3.48Å; N26-D29 WeakPolarHBondContact CB-OD1 3.29Å; N26-D29 PolarHBondContact ND2-OD1 3.09Å; N26-D29 PolarHBondContact O-N 3.19Å
27	A	58.8	Low	65.6	Low	49 Å²	49	59.8 Å²	59.8	41%	0.405	31%	0.309	S	S	.	.	H	α-helix	trans	-54.4	-38.2	163.3	0	0	0	0	0	115.1	D29 V30 E31	A27-D29 VanDerWaalsContact C-N 3.27Å; A27-D29 PolarHBondContact O-N 3.32Å; A27-V30 PolarHBondContact O-N 2.79Å; A27-E31 PolarHBondContact O-N 3.32Å
28	P	65.1	Low	67.5	Low	82 Å²	82	58.5 Å²	58.5	53%	0.532	30%	0.303	S	S	.	.	H	α-helix	trans	-66.3	-22.8	-179.8	24.3	-35	0	0	0	114.5	N26 V30 E31 C32	N26-P28 VanDerWaalsContact C-CD 3.41Å; N26-P28 HydrophobicContact CB-CG 4.17Å; P28-V30 PolarHBondContact O-N 2.81Å; P28-E31 CarbonylContact O-C 3.57Å; P28-E31 PolarHBondContact O-N 3.35Å; P28-C32 WeakPolarHBondContact O-CB 3.39Å; P28-C32 PolarHBondContact O-N 2.88Å
29	D	75	Confident	69.2	Low	30 Å²	30	52.2 Å²	52.2	16%	0.16	28%	0.281	C	S	.	.	H	α-helix	trans	-64.6	-40.6	179.1	-71.4	37.3	0	0	0	111.4	L23 N26 A27 C32 I33 Y119	L23-D29 HydrophobicContact CD2-CB 4.35Å; N26-D29 HydrophobicContact CB-CB 4.15Å; N26-D29 VanDerWaalsContact CB-CG 3.48Å; N26-D29 WeakPolarHBondContact CB-OD1 3.29Å; N26-D29 PolarHBondContact ND2-OD1 3.09Å; N26-D29 PolarHBondContact O-N 3.19Å; A27-D29 VanDerWaalsContact C-N 3.27Å; A27-D29 PolarHBondContact O-N 3.32Å; D29-C32 WeakPolarHBondContact O-CB 3.3Å; D29-C32 PolarHBondContact O-N 2.61Å; D29-I33 WeakPolarHBondContact O-CG1 3.24Å; D29-I33 PolarHBondContact O-N 3.21Å; D29-I33 VanDerWaalsContact O-N 3.1Å; D29-Y119 VanDerWaalsContact CB-OH 3.28Å; D29-Y119 WeakPolarHBondContact CB-OH 3.23Å; D29-Y119 PolarHBondContact OD2-OH 3.25Å
30	V	76.5	Confident	71	Confident	6 Å²	6	52.3 Å²	52.3	4%	0.036	28%	0.278	C	S	.	.	H	α-helix	trans	-69.7	-38.2	174.5	-179.4	0	0	0	0	111	L6 L20 L23 A27 P28 C32 I33 W34	L6-V30 HydrophobicContact CD1-CB 3.98Å; L6-V30 HydrophobicContact CD1-CG1 4.05Å; L6-V30 HydrophobicContact CD1-CG2 4.1Å; L20-V30 HydrophobicContact CD2-CG2 3.75Å; L23-V30 HydrophobicContact CD1-CG2 4.36Å; A27-V30 PolarHBondContact O-N 2.79Å; P28-V30 PolarHBondContact O-N 2.81Å; V30-C32 VanDerWaalsContact C-N 3.3Å; V30-C32 PolarHBondContact O-N 3.23Å; V30-I33 PolarHBondContact O-N 2.83Å; V30-W34 PolarHBondContact O-N 2.85Å
31	E	78.1	Confident	72.7	Confident	62 Å²	62	51.4 Å²	51.4	29%	0.29	27%	0.273	S	S	.	.	H	α-helix	trans	-69.4	-27.5	175.2	-172.1	158.2	-126.8	0	0	112.7	M2 A27 P28 T35	M2-E31 HydrophobicContact CB-CB 4.38Å; M2-E31 HydrophobicContact CB-CG 4.34Å; M2-E31 HydrophobicContact CG-CG 4.39Å; M2-E31 PolarHBondContact N-OE1 3.12Å; A27-E31 PolarHBondContact O-N 3.32Å; P28-E31 CarbonylContact O-C 3.57Å; P28-E31 PolarHBondContact O-N 3.35Å; E31-T35 WeakPolarHBondContact O-CB 3.32Å; E31-T35 PolarHBondContact O-N 2.83Å; E31-T35 PolarHBondContact O-OG1 2.89Å
32	C	81.6	Confident	74.5	Confident	58 Å²	58	50.8 Å²	50.8	39%	0.392	27%	0.265	S	S	.	.	H	α-helix	trans	-65.6	-51.5	170.3	-173.4	0	0	0	0	110.9	P28 D29 V30 W34 T35 E36	P28-C32 WeakPolarHBondContact O-CB 3.39Å; P28-C32 PolarHBondContact O-N 2.88Å; D29-C32 WeakPolarHBondContact O-CB 3.3Å; D29-C32 PolarHBondContact O-N 2.61Å; V30-C32 VanDerWaalsContact C-N 3.3Å; V30-C32 PolarHBondContact O-N 3.23Å; C32-W34 PolarHBondContact O-N 3.33Å; C32-T35 WeakPolarHBondContact O-CB 3.26Å; C32-T35 PolarHBondContact O-N 3.49Å; C32-T35 VanDerWaalsContact O-N 3.16Å; C32-E36 PolarHBondContact O-N 3.48Å
33	I	84.4	Confident	76.2	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-58.5	-46	177.2	-68.8	165.8	0	0	0	111.2	L23 D29 V30 E36 I37 Y119 V124 C127 V128	L23-I33 HydrophobicContact CD1-CD1 3.78Å; D29-I33 WeakPolarHBondContact O-CG1 3.24Å; D29-I33 PolarHBondContact O-N 3.21Å; D29-I33 VanDerWaalsContact O-N 3.1Å; V30-I33 PolarHBondContact O-N 2.83Å; I33-E36 PolarHBondContact O-N 2.86Å; I33-I37 HydrophobicContact CG2-CD1 3.84Å; I33-I37 VanDerWaalsContact O-CG1 3.3Å; I33-I37 WeakPolarHBondContact O-CG1 3.39Å; I33-I37 PolarHBondContact O-N 2.86Å; I33-Y119 HydrophobicContact CD1-CD2 3.88Å; I33-Y119 HydrophobicContact CD1-CE2 4.09Å; I33-Y119 HydrophobicContact CG1-CD2 3.92Å; I33-Y119 HydrophobicContact CG1-CE2 4.03Å; I33-V124 HydrophobicContact CG2-CG1 4.07Å; I33-C127 HydrophobicContact CD1-CB 4.13Å; I33-V128 HydrophobicContact CG2-CG2 4.47Å
34	W	85.3	Confident	77.8	Confident	5 Å²	5	51.9 Å²	51.9	2%	0.019	26%	0.263	C	S	.	.	H	α-helix	trans	-73.3	-25.4	178	-80.7	96.2	0	0	0	114.1	M2 V30 C32 I37 S38 L53 V128 T131 L132 L149	M2-W34 HydrophobicContact CE-CB 3.96Å; M2-W34 HydrophobicContact CE-CD2 3.89Å; M2-W34 HydrophobicContact CE-CG 3.59Å; V30-W34 PolarHBondContact O-N 2.85Å; C32-W34 PolarHBondContact O-N 3.33Å; W34-I37 HydrophobicContact CD2-CD1 4.37Å; W34-I37 HydrophobicContact CE3-CD1 4.45Å; W34-I37 HydrophobicContact CE3-CG2 4.33Å; W34-I37 HydrophobicContact CZ3-CG2 4.4Å; W34-S38 WeakPolarHBondContact O-CB 3.34Å; W34-S38 PolarHBondContact O-N 2.96Å; W34-S38 PolarHBondContact O-OG 2.67Å; W34-L53 HydrophobicContact CZ3-CD1 4.46Å; W34-V128 HydrophobicContact CH2-CG1 4.4Å; W34-V128 HydrophobicContact CZ2-CG1 4.2Å; W34-V128 HydrophobicContact CZ2-CG2 4.48Å; W34-T131 HydrophobicContact CZ2-CG2 3.9Å; W34-T131 PolarHBondContact NE1-OG1 2.79Å; W34-L132 HydrophobicContact CH2-CD2 4.1Å; W34-L132 HydrophobicContact CH2-CG 4.41Å; W34-L132 HydrophobicContact CZ2-CD2 4.45Å; W34-L132 HydrophobicContact CZ2-CG 4.46Å; W34-L149 HydrophobicContact CE3-CD2 4.37Å
35	T	86.9	Confident	79.6	Confident	21 Å²	21	48 Å²	48	13%	0.129	24%	0.236	C	C	.	.	H	α-helix	trans	-62.2	-47.8	166.6	-74.6	0	0	0	0	110.3	E31 C32 S38 F39 K150	E31-T35 WeakPolarHBondContact O-CB 3.32Å; E31-T35 PolarHBondContact O-N 2.83Å; E31-T35 PolarHBondContact O-OG1 2.89Å; C32-T35 WeakPolarHBondContact O-CB 3.26Å; C32-T35 PolarHBondContact O-N 3.49Å; C32-T35 VanDerWaalsContact O-N 3.16Å; T35-S38 WeakPolarHBondContact O-CA 3.3Å; T35-S38 VanDerWaalsContact O-CB 3.29Å; T35-S38 WeakPolarHBondContact O-CB 3.46Å; T35-S38 PolarHBondContact O-N 2.59Å; T35-S38 VanDerWaalsContact O-N 3.1Å; T35-F39 HydrophobicContact CG2-CD2 3.76Å; T35-F39 HydrophobicContact CG2-CE2 3.49Å; T35-F39 VanDerWaalsContact CG2-CE2 3.49Å; T35-F39 WeakPolarHBondContact O-CD2 3.38Å; T35-F39 PolarHBondContact O-N 2.84Å; T35-K150 HydrophobicContact CG2-CD 3.79Å; T35-K150 WeakPolarHBondContact OG1-CD 3.39Å
36	E	86.9	Confident	81.1	Confident	36 Å²	36	40.3 Å²	40.3	17%	0.168	20%	0.204	C	C	.	.	H	α-helix	trans	-71.9	-35.3	-177.8	-169.9	50.8	-141.3	0	0	112.7	C32 I33 S38 F39 Y40 V113 Q116 T117	C32-E36 PolarHBondContact O-N 3.48Å; I33-E36 PolarHBondContact O-N 2.86Å; E36-S38 PolarHBondContact O-N 3.28Å; E36-F39 PolarHBondContact O-N 3.43Å; E36-F39 VanDerWaalsContact O-N 3.13Å; E36-Y40 WeakPolarHBondContact O-CB 3.27Å; E36-Y40 PolarHBondContact O-N 2.89Å; E36-V113 HydrophobicContact CB-CG1 4.3Å; E36-V113 HydrophobicContact CG-CG1 4.05Å; E36-Q116 HydrophobicContact CG-CB 3.84Å; E36-T117 HydrophobicContact CB-CG2 4.09Å; E36-T117 HydrophobicContact CG-CG2 4.18Å
37	I	87.7	Confident	82.5	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-59.2	-37.5	168.5	-67.9	163.8	0	0	0	110.9	I33 W34 Y40 I41 L53 L108 V113 V128	I33-I37 HydrophobicContact CG2-CD1 3.84Å; I33-I37 VanDerWaalsContact O-CG1 3.3Å; I33-I37 WeakPolarHBondContact O-CG1 3.39Å; I33-I37 PolarHBondContact O-N 2.86Å; W34-I37 HydrophobicContact CD2-CD1 4.37Å; W34-I37 HydrophobicContact CE3-CD1 4.45Å; W34-I37 HydrophobicContact CE3-CG2 4.33Å; W34-I37 HydrophobicContact CZ3-CG2 4.4Å; I37-Y40 PolarHBondContact O-N 3.29Å; I37-I41 HydrophobicContact CG2-CD1 3.85Å; I37-I41 WeakPolarHBondContact O-CD1 3.47Å; I37-I41 VanDerWaalsContact O-CG1 3.22Å; I37-I41 WeakPolarHBondContact O-CG1 3.42Å; I37-I41 PolarHBondContact O-N 3.33Å; I37-L53 HydrophobicContact CG2-CD2 4.27Å; I37-L108 HydrophobicContact CD1-CD2 4.44Å; I37-L108 HydrophobicContact CG1-CD2 4.38Å; I37-L108 HydrophobicContact CG2-CD1 4.33Å; I37-L108 HydrophobicContact CG2-CD2 4.39Å; I37-V113 HydrophobicContact CG1-CG1 4.26Å; I37-V113 HydrophobicContact CG1-CG2 4.29Å; I37-V128 HydrophobicContact CD1-CG2 3.29Å
38	S	88.5	Confident	83.5	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.007	20%	0.201	C	C	.	.	H	α-helix	trans	-66.8	-40.4	174.4	-55.6	0	0	0	0	112	W34 T35 E36 R42 K150 I152	W34-S38 WeakPolarHBondContact O-CB 3.34Å; W34-S38 PolarHBondContact O-N 2.96Å; W34-S38 PolarHBondContact O-OG 2.67Å; T35-S38 WeakPolarHBondContact O-CA 3.3Å; T35-S38 VanDerWaalsContact O-CB 3.29Å; T35-S38 WeakPolarHBondContact O-CB 3.46Å; T35-S38 PolarHBondContact O-N 2.59Å; T35-S38 VanDerWaalsContact O-N 3.1Å; E36-S38 PolarHBondContact O-N 3.28Å; S38-R42 WeakPolarHBondContact O-CB 3.46Å; S38-R42 PolarHBondContact O-N 3.5Å; S38-K150 WeakPolarHBondContact CB-O 3.41Å; S38-K150 PolarHBondContact OG-N 3.17Å; S38-I152 VanDerWaalsContact O-CD1 3.27Å; S38-I152 WeakPolarHBondContact O-CD1 3.33Å
39	F	88	Confident	84.4	Confident	88 Å²	88	41.6 Å²	41.6	39%	0.386	19%	0.193	S	C	.	.	H	α-helix	trans	-65.6	-41.8	173.4	-76.3	-59.2	0	0	0	112.6	T35 E36 R42 R43	T35-F39 HydrophobicContact CG2-CD2 3.76Å; T35-F39 HydrophobicContact CG2-CE2 3.49Å; T35-F39 VanDerWaalsContact CG2-CE2 3.49Å; T35-F39 WeakPolarHBondContact O-CD2 3.38Å; T35-F39 PolarHBondContact O-N 2.84Å; E36-F39 PolarHBondContact O-N 3.43Å; E36-F39 VanDerWaalsContact O-N 3.13Å; F39-R42 PolarHBondContact O-N 3.22Å; F39-R43 WeakPolarHBondContact O-CB 3.42Å; F39-R43 PolarHBondContact O-N 3.41Å
40	Y	88.2	Confident	84.9	Confident	14 Å²	14	40.1 Å²	40.1	6%	0.055	19%	0.186	C	C	.	.	H	α-helix	trans	-59.5	-49.4	175	178.3	-91	0	0	0	111.9	E36 I37 R42 R43 Q44 V51 L108 N109 A112 V113	E36-Y40 WeakPolarHBondContact O-CB 3.27Å; E36-Y40 PolarHBondContact O-N 2.89Å; I37-Y40 PolarHBondContact O-N 3.29Å; Y40-R42 VanDerWaalsContact C-N 3.3Å; Y40-R42 PolarHBondContact O-N 3.37Å; Y40-R43 PolarHBondContact O-N 3.25Å; Y40-R43 VanDerWaalsContact O-N 3.17Å; Y40-Q44 HydrophobicContact CD1-CG 4.16Å; Y40-Q44 HydrophobicContact CE1-CG 3.63Å; Y40-Q44 HydrophobicContact CE2-CG 4.08Å; Y40-Q44 VanDerWaalsContact CE2-NE2 3.35Å; Y40-Q44 WeakPolarHBondContact O-CG 3.34Å; Y40-Q44 PolarHBondContact O-N 3.28Å; Y40-V51 HydrophobicContact CE1-CG1 4.15Å; Y40-V51 HydrophobicContact CE1-CG2 4.4Å; Y40-L108 HydrophobicContact CD1-CD1 3.54Å; Y40-L108 HydrophobicContact CE1-CD1 3.81Å; Y40-L108 HydrophobicContact CG-CD1 4.33Å; Y40-N109 HydrophobicContact CE2-CB 4.4Å; Y40-N109 WeakPolarHBondContact OH-CB 3.41Å; Y40-A112 HydrophobicContact CD2-CB 3.95Å; Y40-A112 HydrophobicContact CE2-CB 3.57Å; Y40-V113 HydrophobicContact CG-CG2 4.36Å
41	I	88.1	Confident	85.5	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-59.5	-43.7	177.4	-65.5	160	0	0	0	110.2	I37 R43 Q44 M45 V51 L53 F59 I152	I37-I41 HydrophobicContact CG2-CD1 3.85Å; I37-I41 WeakPolarHBondContact O-CD1 3.47Å; I37-I41 VanDerWaalsContact O-CG1 3.22Å; I37-I41 WeakPolarHBondContact O-CG1 3.42Å; I37-I41 PolarHBondContact O-N 3.33Å; I41-R43 PolarHBondContact O-N 3.28Å; I41-Q44 PolarHBondContact O-N 2.97Å; I41-M45 HydrophobicContact CG2-CG 4.13Å; I41-M45 WeakPolarHBondContact O-CB 3.48Å; I41-M45 WeakPolarHBondContact O-CG 3.37Å; I41-M45 PolarHBondContact O-N 3.04Å; I41-V51 HydrophobicContact CG1-CB 4.3Å; I41-V51 HydrophobicContact CG1-CG1 4.01Å; I41-L53 HydrophobicContact CD1-CD1 4.05Å; I41-L53 HydrophobicContact CD1-CD2 4.23Å; I41-L53 HydrophobicContact CD1-CG 4.35Å; I41-F59 HydrophobicContact CD1-CD2 4.17Å; I41-F59 HydrophobicContact CD1-CE2 3.93Å; I41-F59 HydrophobicContact CG2-CB 4.18Å; I41-F59 HydrophobicContact CG2-CD2 3.89Å; I41-F59 HydrophobicContact CG2-CE2 4.46Å; I41-F59 HydrophobicContact CG2-CG 3.93Å; I41-I152 HydrophobicContact CB-CD1 3.68Å; I41-I152 HydrophobicContact CG2-CD1 3.57Å
42	R	87.3	Confident	86	Confident	70 Å²	70	39.5 Å²	39.5	26%	0.264	18%	0.184	S	C	.	.	H	α-helix	trans	-60.4	-42.9	176.3	-178.6	171.5	-172.3	-156.9	2.5	112.1	S38 F39 Y40 N46 I152 F170	S38-R42 WeakPolarHBondContact O-CB 3.46Å; S38-R42 PolarHBondContact O-N 3.5Å; F39-R42 PolarHBondContact O-N 3.22Å; Y40-R42 VanDerWaalsContact C-N 3.3Å; Y40-R42 PolarHBondContact O-N 3.37Å; R42-N46 WeakPolarHBondContact O-CB 3.33Å; R42-N46 VanDerWaalsContact O-CG 3.28Å; R42-N46 PolarHBondContact O-N 3.29Å; R42-N46 PolarHBondContact O-OD1 3.33Å; R42-I152 HydrophobicContact CB-CD1 4.32Å; R42-I152 HydrophobicContact CB-CG1 4.16Å; R42-F170 HydrophobicContact CB-CE2 4.18Å; R42-F170 HydrophobicContact CG-CD2 4.07Å; R42-F170 HydrophobicContact CG-CE2 3.93Å
43	R	87	Confident	86.3	Confident	172 Å²	172	37 Å²	37	65%	0.649	17%	0.167	S	C	*	.	H	α-helix	trans	-63.4	-46.1	178.1	-172.8	175.8	180	-179.8	0.2	112.1	F39 Y40 I41 L47	F39-R43 WeakPolarHBondContact O-CB 3.42Å; F39-R43 PolarHBondContact O-N 3.41Å; Y40-R43 PolarHBondContact O-N 3.25Å; Y40-R43 VanDerWaalsContact O-N 3.17Å; I41-R43 PolarHBondContact O-N 3.28Å; R43-L47 WeakPolarHBondContact O-CG 3.28Å; R43-L47 PolarHBondContact O-N 3.3Å
44	Q	86	Confident	86.2	Confident	27 Å²	27	41.1 Å²	41.1	13%	0.126	20%	0.196	C	C	.	.	H	α-helix	trans	-68.4	-40.7	178.6	-62.2	-54.1	-32.1	0	0	112.6	Y40 I41 N46 L47 Q48 K49 V51	Y40-Q44 HydrophobicContact CD1-CG 4.16Å; Y40-Q44 HydrophobicContact CE1-CG 3.63Å; Y40-Q44 HydrophobicContact CE2-CG 4.08Å; Y40-Q44 VanDerWaalsContact CE2-NE2 3.35Å; Y40-Q44 WeakPolarHBondContact O-CG 3.34Å; Y40-Q44 PolarHBondContact O-N 3.28Å; I41-Q44 PolarHBondContact O-N 2.97Å; Q44-N46 PolarHBondContact O-N 3.43Å; Q44-L47 CarbonylContact O-C 3.57Å; Q44-L47 WeakPolarHBondContact O-CA 3.39Å; Q44-L47 WeakPolarHBondContact O-CB 3.37Å; Q44-L47 PolarHBondContact O-N 2.85Å; Q44-L47 VanDerWaalsContact O-N 3.08Å; Q44-Q48 PolarHBondContact O-N 2.87Å; Q44-K49 CarbonylContact C-O 3.58Å; Q44-K49 HydrophobicContact CB-CB 4.42Å; Q44-K49 PolarHBondContact O-N 3.41Å; Q44-V51 HydrophobicContact CB-CG2 3.38Å; Q44-V51 HydrophobicContact CG-CG2 3.81Å
45	M	84.9	Confident	85.9	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-62.8	-40.9	177	-71.7	-74.4	-76	0	0	111.5	I41 L47 Q48 K49 F59 F61 P78 F170	I41-M45 HydrophobicContact CG2-CG 4.13Å; I41-M45 WeakPolarHBondContact O-CB 3.48Å; I41-M45 WeakPolarHBondContact O-CG 3.37Å; I41-M45 PolarHBondContact O-N 3.04Å; M45-L47 VanDerWaalsContact C-N 3.28Å; M45-L47 PolarHBondContact O-N 3.35Å; M45-Q48 PolarHBondContact O-N 2.91Å; M45-K49 WeakPolarHBondContact CA-O 3.12Å; M45-K49 PolarHBondContact N-O 2.81Å; M45-F59 HydrophobicContact CE-CB 4.27Å; M45-F59 HydrophobicContact CG-CB 4.5Å; M45-F59 HydrophobicContact SD-CB 3.92Å; M45-F61 HydrophobicContact CB-CZ 4.02Å; M45-F61 HydrophobicContact CE-CD1 4.15Å; M45-F61 HydrophobicContact CE-CE1 3.55Å; M45-F61 HydrophobicContact CE-CE2 3.97Å; M45-F61 HydrophobicContact CE-CZ 3.45Å; M45-F61 VanDerWaalsContact CE-CZ 3.45Å; M45-F61 WeakPolarHBondContact O-CE2 3.25Å; M45-F61 VanDerWaalsContact O-CZ 3.29Å; M45-F61 WeakPolarHBondContact O-CZ 3.28Å; M45-F61 HydrophobicContact SD-CE2 3.9Å; M45-F61 HydrophobicContact SD-CZ 3.86Å; M45-P78 HydrophobicContact CE-CB 3.94Å; M45-F170 HydrophobicContact CB-CZ 4.28Å
46	N	84.3	Confident	85.8	Confident	41 Å²	41	41.7 Å²	41.7	22%	0.219	21%	0.207	C	C	.	.	H	α-helix	trans	-59.5	-39.6	172.4	-74.1	4.2	0	0	0	111.8	R42 Q44 Q48 I174	R42-N46 WeakPolarHBondContact O-CB 3.33Å; R42-N46 VanDerWaalsContact O-CG 3.28Å; R42-N46 PolarHBondContact O-N 3.29Å; R42-N46 PolarHBondContact O-OD1 3.33Å; Q44-N46 PolarHBondContact O-N 3.43Å; N46-Q48 PolarHBondContact O-N 3.47Å; N46-Q48 VanDerWaalsContact O-N 3.08Å; N46-Q48 PolarHBondContact O-NE2 2.81Å; N46-I174 WeakPolarHBondContact OD1-CG1 3.46Å
47	L	83.7	Confident	85.8	Confident	103 Å²	103	40 Å²	40	54%	0.539	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	13.9	173.9	-64.6	170.6	0	0	0	114.3	R43 Q44 M45 K49	R43-L47 WeakPolarHBondContact O-CG 3.28Å; R43-L47 PolarHBondContact O-N 3.3Å; Q44-L47 CarbonylContact O-C 3.57Å; Q44-L47 WeakPolarHBondContact O-CA 3.39Å; Q44-L47 WeakPolarHBondContact O-CB 3.37Å; Q44-L47 PolarHBondContact O-N 2.85Å; Q44-L47 VanDerWaalsContact O-N 3.08Å; M45-L47 VanDerWaalsContact C-N 3.28Å; M45-L47 PolarHBondContact O-N 3.35Å; L47-K49 PolarHBondContact O-N 3.43Å
48	Q	78.9	Confident	85.9	Confident	50 Å²	50	41.4 Å²	41.4	23%	0.234	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.4	23.4	-178.8	-52.4	-60.1	-71.4	0	0	114.5	Q44 M45 N46 H76	Q44-Q48 PolarHBondContact O-N 2.87Å; M45-Q48 PolarHBondContact O-N 2.91Å; N46-Q48 PolarHBondContact O-N 3.47Å; N46-Q48 VanDerWaalsContact O-N 3.08Å; N46-Q48 PolarHBondContact O-NE2 2.81Å; Q48-H76 PolarHBondContact OE1-CD2 3.25Å; Q48-H76 VanDerWaalsContact OE1-CD2 3.26Å
49	K	84.7	Confident	85.9	Confident	88 Å²	88	41.3 Å²	41.3	38%	0.383	21%	0.207	S	C	.	.			trans	-105.8	132.8	176.1	-54.4	-168.9	-178.2	-178.5	0	110.2	Q44 M45 L47 P104 V106	Q44-K49 CarbonylContact C-O 3.58Å; Q44-K49 HydrophobicContact CB-CB 4.42Å; Q44-K49 PolarHBondContact O-N 3.41Å; M45-K49 WeakPolarHBondContact CA-O 3.12Å; M45-K49 PolarHBondContact N-O 2.81Å; L47-K49 PolarHBondContact O-N 3.43Å; K49-P104 CarbonylContact C-O 3.49Å; K49-P104 WeakPolarHBondContact CA-O 3.4Å; K49-P104 HydrophobicContact CG-CG 4.24Å; K49-V106 HydrophobicContact CB-CG2 4.19Å; K49-V106 HydrophobicContact CD-CG2 4Å
50	G	85.3	Confident	85.8	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	154.1	169.2	0	0	0	0	0	111.1	F59 P104 V106	G50-F59 CarbonylContact C-O 3.56Å; G50-F59 WeakPolarHBondContact CA-O 3.43Å; G50-P104 PolarHBondContact N-O 2.84Å; G50-V106 PolarHBondContact O-N 3.3Å
51	V	88.8	Confident	85.5	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	123.3	176.6	-175.9	0	0	0	0	110.8	Y40 I41 Q44 T58 F59 V106	Y40-V51 HydrophobicContact CE1-CG1 4.15Å; Y40-V51 HydrophobicContact CE1-CG2 4.4Å; I41-V51 HydrophobicContact CG1-CB 4.3Å; I41-V51 HydrophobicContact CG1-CG1 4.01Å; Q44-V51 HydrophobicContact CB-CG2 3.38Å; Q44-V51 HydrophobicContact CG-CG2 3.81Å; V51-T58 CarbonylContact O-C 3.54Å; V51-T58 WeakPolarHBondContact O-CA 3.4Å; V51-F59 PolarHBondContact N-O 3.33Å; V51-F59 PolarHBondContact O-N 2.98Å; V51-V106 CarbonylContact C-O 3.4Å; V51-V106 VanDerWaalsContact CA-O 3.32Å; V51-V106 WeakPolarHBondContact CA-O 3.37Å
52	N	89.4	Confident	85	Confident	55 Å²	55	37.5 Å²	37.5	29%	0.294	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	116.2	174.1	-174.7	17.4	0	0	0	110.9	T58 V105 V106 L108	N52-T58 HydrophobicContact CB-CG2 4.07Å; N52-V105 HydrophobicContact CB-CG1 3.9Å; N52-V106 PolarHBondContact N-O 3.35Å; N52-L108 PolarHBondContact O-N 3.2Å
53	L	87.7	Confident	84.1	Confident	5 Å²	5	36.8 Å²	36.8	3%	0.026	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	100.5	166.4	-65.1	-174.7	0	0	0	109	W34 I37 I41 G55 L56 G57 F59 L108	W34-L53 HydrophobicContact CZ3-CD1 4.46Å; I37-L53 HydrophobicContact CG2-CD2 4.27Å; I41-L53 HydrophobicContact CD1-CD1 4.05Å; I41-L53 HydrophobicContact CD1-CD2 4.23Å; I41-L53 HydrophobicContact CD1-CG 4.35Å; L53-G55 PolarHBondContact O-N 2.9Å; L53-G55 VanDerWaalsContact O-N 3.16Å; L53-L56 HydrophobicContact CB-CB 4.02Å; L53-L56 HydrophobicContact CD1-CD2 3.91Å; L53-L56 PolarHBondContact O-N 2.9Å; L53-G57 WeakPolarHBondContact CB-O 2.99Å; L53-G57 PolarHBondContact N-O 2.96Å; L53-G57 PolarHBondContact O-N 3.46Å; L53-F59 HydrophobicContact CD1-CE2 3.82Å; L53-F59 HydrophobicContact CG-CE2 4.28Å; L53-L108 HydrophobicContact CD2-CB 4.02Å; L53-L108 HydrophobicContact CD2-CD1 4.26Å; L53-L108 HydrophobicContact CD2-CD2 3.78Å; L53-L108 HydrophobicContact CD2-CG 4.24Å
54	S	82.7	Confident	82.8	Confident	87 Å²	87	34 Å²	34	61%	0.608	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.7	118.8	175.7	-62.1	0	0	0	0	111.5	L132	S54-L132 WeakPolarHBondContact O-CD1 3.43Å
55	G	78.8	Confident	81.3	Confident	37 Å²	37	37.2 Å²	37.2	38%	0.381	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.1	-0.6	-178.6	0	0	0	0	0	115.9	L53 L86 H136	L53-G55 PolarHBondContact O-N 2.9Å; L53-G55 VanDerWaalsContact O-N 3.16Å; G55-L86 VanDerWaalsContact O-CD1 3.24Å; G55-L86 WeakPolarHBondContact O-CD1 3.44Å; G55-H136 PolarHBondContact O-NE2 3.36Å
56	L	84.2	Confident	79.6	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.9	-54.8	172.4	-175.9	54.8	0	0	0	112.6	L53 F80 A83 L86 L132 L135 L147 L155 F157	L53-L56 HydrophobicContact CB-CB 4.02Å; L53-L56 HydrophobicContact CD1-CD2 3.91Å; L53-L56 PolarHBondContact O-N 2.9Å; L56-F80 HydrophobicContact CD1-CZ 4.48Å; L56-F80 HydrophobicContact CG-CZ 4.14Å; L56-A83 PolarHBondContact O-N 3.46Å; L56-L86 HydrophobicContact CD1-CD1 4.1Å; L56-L132 HydrophobicContact CB-CD1 4.3Å; L56-L132 HydrophobicContact CB-CD2 3.83Å; L56-L132 HydrophobicContact CD1-CD2 4.39Å; L56-L132 HydrophobicContact CD2-CD2 3.97Å; L56-L132 HydrophobicContact CG-CD2 4.27Å; L56-L135 HydrophobicContact CD1-CD2 3.92Å; L56-L147 HydrophobicContact CD2-CD2 3.89Å; L56-L155 HydrophobicContact CD1-CD2 4.21Å; L56-L155 HydrophobicContact CD2-CD2 4.44Å; L56-F157 HydrophobicContact CD1-CZ 4.22Å
57	G	87.4	Confident	77.6	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	151.4	-177.5	-178	0	0	0	0	0	114.2	L53 I81	L53-G57 WeakPolarHBondContact CB-O 2.99Å; L53-G57 PolarHBondContact N-O 2.96Å; L53-G57 PolarHBondContact O-N 3.46Å; G57-I81 CarbonylContact C-O 3.37Å; G57-I81 WeakPolarHBondContact CA-O 3.47Å
58	T	89	Confident	75.6	Confident	30 Å²	30	46.4 Å²	46.4	18%	0.184	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	124.4	-169.4	-39.1	0	0	0	0	111.7	V51 N52 T60 I81 V105	V51-T58 CarbonylContact O-C 3.54Å; V51-T58 WeakPolarHBondContact O-CA 3.4Å; N52-T58 HydrophobicContact CB-CG2 4.07Å; T58-T60 HydrophobicContact CG2-CG2 3.53Å; T58-I81 PolarHBondContact N-O 3.32Å; T58-I81 PolarHBondContact O-N 3.49Å; T58-V105 HydrophobicContact CG2-CG1 3.47Å; T58-V105 VanDerWaalsContact CG2-CG1 3.47Å; T58-V105 HydrophobicContact CG2-CG2 4.28Å
59	F	88.5	Confident	74.3	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	124.3	165.3	-63.2	-84.9	0	0	0	108.9	I41 M45 G50 V51 L53 F80 L149 M164 F166	I41-F59 HydrophobicContact CD1-CD2 4.17Å; I41-F59 HydrophobicContact CD1-CE2 3.93Å; I41-F59 HydrophobicContact CG2-CB 4.18Å; I41-F59 HydrophobicContact CG2-CD2 3.89Å; I41-F59 HydrophobicContact CG2-CE2 4.46Å; I41-F59 HydrophobicContact CG2-CG 3.93Å; M45-F59 HydrophobicContact CE-CB 4.27Å; M45-F59 HydrophobicContact CG-CB 4.5Å; M45-F59 HydrophobicContact SD-CB 3.92Å; G50-F59 CarbonylContact C-O 3.56Å; G50-F59 WeakPolarHBondContact CA-O 3.43Å; V51-F59 PolarHBondContact N-O 3.33Å; V51-F59 PolarHBondContact O-N 2.98Å; L53-F59 HydrophobicContact CD1-CE2 3.82Å; L53-F59 HydrophobicContact CG-CE2 4.28Å; F59-F80 HydrophobicContact CD1-CB 4.21Å; F59-F80 AromaticContact CD1-CD2 3.86Å; F59-F80 HydrophobicContact CD1-CD2 3.86Å; F59-F80 HydrophobicContact CD2-CD2 4.19Å; F59-F80 HydrophobicContact CE1-CB 4.12Å; F59-F80 AromaticContact CE1-CD2 3.54Å; F59-F80 HydrophobicContact CE1-CD2 3.54Å; F59-F80 HydrophobicContact CE1-CE2 4.36Å; F59-F80 HydrophobicContact CE1-CG 4.15Å; F59-F80 AromaticContact CE2-CD2 3.89Å; F59-F80 HydrophobicContact CE2-CD2 3.89Å; F59-F80 HydrophobicContact CE2-CE2 4.01Å; F59-F80 HydrophobicContact CG-CD2 4.17Å; F59-F80 AromaticContact CZ-CD2 3.55Å; F59-F80 HydrophobicContact CZ-CD2 3.55Å; F59-F80 AromaticContact CZ-CE2 3.9Å; F59-F80 HydrophobicContact CZ-CE2 3.9Å; F59-F80 HydrophobicContact CZ-CG 4.47Å; F59-L149 HydrophobicContact CE1-CD1 4.16Å; F59-L149 HydrophobicContact CE2-CD1 4.46Å; F59-L149 HydrophobicContact CZ-CD1 3.57Å; F59-M164 HydrophobicContact CE1-CE 4.28Å; F59-F166 HydrophobicContact CD1-CE1 4.12Å; F59-F166 HydrophobicContact CD1-CZ 4.18Å; F59-F166 HydrophobicContact CE1-CE1 4.32Å; F59-F166 HydrophobicContact CE1-CZ 4.48Å
60	T	86.2	Confident	72.4	Confident	9 Å²	9	49.9 Å²	49.9	6%	0.055	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	-175.4	-176.9	56.3	0	0	0	0	110.4	T58 I79 I81 V105	T58-T60 HydrophobicContact CG2-CG2 3.53Å; T60-I79 PolarHBondContact N-O 2.94Å; T60-I79 WeakPolarHBondContact O-CG1 3.45Å; T60-I79 PolarHBondContact O-N 3.27Å; T60-I79 VanDerWaalsContact O-O 3.08Å; T60-I79 WeakPolarHBondContact OG1-CG1 3.46Å; T60-I81 WeakPolarHBondContact OG1-CD1 3.44Å; T60-V105 HydrophobicContact CG2-CG2 3.88Å
61	F	83.5	Confident	70.1	Confident	1 Å²	1	59.5 Å²	59.5	0%	0.004	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	132.3	175	-62.7	-71.6	0	0	0	111.2	M45 H76 H77 P78 K100 V103 I174	M45-F61 HydrophobicContact CB-CZ 4.02Å; M45-F61 HydrophobicContact CE-CD1 4.15Å; M45-F61 HydrophobicContact CE-CE1 3.55Å; M45-F61 HydrophobicContact CE-CE2 3.97Å; M45-F61 HydrophobicContact CE-CZ 3.45Å; M45-F61 VanDerWaalsContact CE-CZ 3.45Å; M45-F61 WeakPolarHBondContact O-CE2 3.25Å; M45-F61 VanDerWaalsContact O-CZ 3.29Å; M45-F61 WeakPolarHBondContact O-CZ 3.28Å; M45-F61 HydrophobicContact SD-CE2 3.9Å; M45-F61 HydrophobicContact SD-CZ 3.86Å; F61-H76 HydrophobicContact CB-CB 4.21Å; F61-H76 HydrophobicContact CD1-CB 3.85Å; F61-H76 HydrophobicContact CG-CB 4.11Å; F61-H77 WeakPolarHBondContact CA-O 3.36Å; F61-P78 HydrophobicContact CD1-CB 4.4Å; F61-P78 HydrophobicContact CE1-CB 4.15Å; F61-K100 PolarHBondContact O-N 2.86Å; F61-V103 HydrophobicContact CD2-CG1 4.32Å; F61-I174 HydrophobicContact CE1-CD1 4.14Å; F61-I174 HydrophobicContact CE1-CG2 3.84Å; F61-I174 HydrophobicContact CZ-CD1 4.34Å; F61-I174 HydrophobicContact CZ-CG2 4.18Å
62	S	77.7	Confident	68	Low	12 Å²	12	66.5 Å²	66.5	8%	0.084	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	146.5	154	57.7	0	0	0	0	108.6	H76 H77 L98	S62-H76 PolarHBondContact O-ND1 3.46Å; S62-H77 PolarHBondContact N-O 2.76Å; S62-H77 PolarHBondContact O-N 2.86Å; S62-H77 PolarHBondContact OG-O 3.24Å; S62-L98 WeakPolarHBondContact CB-O 3.36Å
63	L	66.9	Low	66	Low	55 Å²	55	67.3 Å²	67.3	29%	0.288	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	116.4	167.3	178.1	68.6	0	0	0	107.1	N65 N74 K100	L63-N65 WeakPolarHBondContact CD2-OD1 3.38Å; L63-N65 VanDerWaalsContact CG-OD1 3.26Å; L63-N65 WeakPolarHBondContact CG-OD1 3.41Å; L63-N74 HydrophobicContact CD1-CB 3.82Å; L63-K100 HydrophobicContact CB-CB 4.13Å; L63-K100 HydrophobicContact CB-CD 4.12Å; L63-K100 HydrophobicContact CB-CG 4.11Å; L63-K100 HydrophobicContact CD2-CD 4.26Å
64	Q	60	Low	64.5	Low	114 Å²	114	70 Å²	70	53%	0.533	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	108.3	169.8	-163.8	166.6	12.8	0	0	108.2	F66 F75	Q64-F66 PolarHBondContact O-N 3.2Å; Q64-F75 PolarHBondContact N-O 3.42Å; Q64-F75 PolarHBondContact O-N 3.4Å
65	N	54.3	Low	63.4	Low	93 Å²	93	69.6 Å²	69.6	50%	0.497	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	118.4	173.3	-64.2	-3	0	0	0	107.4	L63 N74	L63-N65 WeakPolarHBondContact CD2-OD1 3.38Å; L63-N65 VanDerWaalsContact CG-OD1 3.26Å; L63-N65 WeakPolarHBondContact CG-OD1 3.41Å; N65-N74 PolarHBondContact OD1-OD1 3.18Å
66	F	50.6	Low	62.9	Low	129 Å²	129	68.7 Å²	68.7	57%	0.566	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.9	108	178.2	-157.7	-82.9	0	0	0	109.9	Q64 T68	Q64-F66 PolarHBondContact O-N 3.2Å; F66-T68 VanDerWaalsContact CD1-OG1 3.29Å; F66-T68 WeakPolarHBondContact CD1-OG1 3.13Å; F66-T68 WeakPolarHBondContact CE1-OG1 3.26Å; F66-T68 PolarHBondContact O-N 3.26Å
67	N	41	Very low	62.6	Low	112 Å²	112	72 Å²	72	60%	0.599	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.9	78.4	-173.5	-68	6.5	0	0	0	111.1	G69 F72	N67-G69 PolarHBondContact O-N 3.36Å; N67-F72 WeakPolarHBondContact OD1-CD1 3.36Å; N67-F72 WeakPolarHBondContact OD1-CE1 3.39Å
68	T	42.1	Very low	62.5	Low	98 Å²	98	72 Å²	72	60%	0.601	37%	0.373	S	S	*	.			trans	-82.1	69.8	170.4	-49.2	0	0	0	0	110.6	F66 H70	F66-T68 VanDerWaalsContact CD1-OG1 3.29Å; F66-T68 WeakPolarHBondContact CD1-OG1 3.13Å; F66-T68 WeakPolarHBondContact CE1-OG1 3.26Å; F66-T68 PolarHBondContact O-N 3.26Å; T68-H70 PolarHBondContact O-N 3.03Å
69	G	50.7	Low	62.4	Low	80 Å²	80	70.9 Å²	70.9	83%	0.825	37%	0.366	S	S	*	.	S	Bend	trans	68.5	-46.7	166.6	0	0	0	0	0	118	N67	N67-G69 PolarHBondContact O-N 3.36Å
70	H	44.9	Very low	62.3	Low	130 Å²	130	71 Å²	71	60%	0.602	37%	0.366	S	S	*	.	S	Bend	trans	-142.8	-0.3	-168.1	-126.7	-58.1	0	0	0	115	T68	T68-H70 PolarHBondContact O-N 3.03Å
71	R	38.2	Very low	62.4	Low	203 Å²	203	73.3 Å²	73.3	77%	0.766	38%	0.377	S	S	*	.			trans	-143.5	124.2	177	-68	-172.3	176.8	-175.9	-2.1	111.7	S73	R71-S73 PolarHBondContact O-N 3.16Å
72	F	43.2	Very low	62.5	Low	146 Å²	146	73.9 Å²	73.9	64%	0.64	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.8	84.1	172.4	-65.3	-76.4	0	0	0	111.1	N67 N74	N67-F72 WeakPolarHBondContact OD1-CD1 3.36Å; N67-F72 WeakPolarHBondContact OD1-CE1 3.39Å; F72-N74 VanDerWaalsContact C-N 3.31Å; F72-N74 PolarHBondContact O-N 3.28Å
73	S	48	Very low	62.9	Low	73 Å²	73	74.4 Å²	74.4	51%	0.51	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	81.4	175	-76.2	0	0	0	0	110.8	R71 F75	R71-S73 PolarHBondContact O-N 3.16Å; S73-F75 PolarHBondContact O-N 3.27Å
74	N	56	Low	63.5	Low	60 Å²	60	73.9 Å²	73.9	32%	0.321	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.6	106.2	170.5	-71.8	-7.2	0	0	0	110.3	L63 N65 F72 R178	L63-N74 HydrophobicContact CD1-CB 3.82Å; N65-N74 PolarHBondContact OD1-OD1 3.18Å; F72-N74 VanDerWaalsContact C-N 3.31Å; F72-N74 PolarHBondContact O-N 3.28Å; N74-R178 PolarHBondContact O-NH1 3.23Å
75	F	59.2	Low	64.4	Low	80 Å²	80	77 Å²	77	35%	0.351	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	132.2	173.7	-158	-93.2	0	0	0	110.1	Q64 S73 H77 I171 S175	Q64-F75 PolarHBondContact N-O 3.42Å; Q64-F75 PolarHBondContact O-N 3.4Å; S73-F75 PolarHBondContact O-N 3.27Å; F75-H77 HydrophobicContact CD1-CB 4.16Å; F75-H77 HydrophobicContact CE1-CB 4.36Å; F75-I171 HydrophobicContact CE1-CG2 4.47Å; F75-I171 HydrophobicContact CZ-CG2 4.14Å; F75-S175 WeakPolarHBondContact CZ-OG 3.33Å
76	H	68.4	Low	65.6	Low	17 Å²	17	72.6 Å²	72.6	8%	0.079	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	96.8	169.5	-85	-30.9	0	0	0	108.9	Q48 F61 S62 R178	Q48-H76 PolarHBondContact OE1-CD2 3.25Å; Q48-H76 VanDerWaalsContact OE1-CD2 3.26Å; F61-H76 HydrophobicContact CB-CB 4.21Å; F61-H76 HydrophobicContact CD1-CB 3.85Å; F61-H76 HydrophobicContact CG-CB 4.11Å; S62-H76 PolarHBondContact O-ND1 3.46Å; H76-R178 PolarHBondContact CD2-NH1 2.93Å; H76-R178 PolarHBondContact CD2-NH2 3.02Å; H76-R178 VanDerWaalsContact CG-NH1 3.29Å; H76-R178 PolarHBondContact NE2-NH2 2.77Å
77	H	79.3	Confident	66.9	Low	70 Å²	70	68.6 Å²	68.6	32%	0.324	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	124.4	174.1	-162.1	86.1	0	0	0	108.3	F61 S62 F75 I79	F61-H77 WeakPolarHBondContact CA-O 3.36Å; S62-H77 PolarHBondContact N-O 2.76Å; S62-H77 PolarHBondContact O-N 2.86Å; S62-H77 PolarHBondContact OG-O 3.24Å; F75-H77 HydrophobicContact CD1-CB 4.16Å; F75-H77 HydrophobicContact CE1-CB 4.36Å; H77-I79 PolarHBondContact O-N 2.71Å
78	P	84	Confident	68.7	Low	1 Å²	1	71 Å²	71	1%	0.006	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	130.8	174.3	27.6	-32.8	0	0	0	109	M45 F61 F166 F170 I171	M45-P78 HydrophobicContact CE-CB 3.94Å; F61-P78 HydrophobicContact CD1-CB 4.4Å; F61-P78 HydrophobicContact CE1-CB 4.15Å; P78-F166 HydrophobicContact CB-CD1 4.23Å; P78-F166 HydrophobicContact CB-CD2 4.22Å; P78-F166 HydrophobicContact CB-CE1 4.08Å; P78-F166 HydrophobicContact CB-CE2 4.08Å; P78-F166 HydrophobicContact CB-CG 4.29Å; P78-F166 HydrophobicContact CB-CZ 4.01Å; P78-F166 HydrophobicContact CG-CB 4.39Å; P78-F166 HydrophobicContact CG-CD1 4.29Å; P78-F166 HydrophobicContact CG-CD2 3.98Å; P78-F166 HydrophobicContact CG-CE2 4.34Å; P78-F166 HydrophobicContact CG-CG 3.96Å; P78-F166 WeakPolarHBondContact O-CD2 3.3Å; P78-F166 WeakPolarHBondContact O-CE2 3.35Å; P78-F170 HydrophobicContact CB-CE1 3.88Å; P78-F170 HydrophobicContact CG-CD1 4.36Å; P78-F170 HydrophobicContact CG-CE1 4.06Å; P78-I171 HydrophobicContact CG-CG1 4.09Å
79	I	86.8	Confident	70.2	Confident	5 Å²	5	70.2 Å²	70.2	3%	0.026	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	151.4	175.1	60.4	168.8	0	0	0	109.6	T60 H77 I81 W97 A99	T60-I79 PolarHBondContact N-O 2.94Å; T60-I79 WeakPolarHBondContact O-CG1 3.45Å; T60-I79 PolarHBondContact O-N 3.27Å; T60-I79 VanDerWaalsContact O-O 3.08Å; T60-I79 WeakPolarHBondContact OG1-CG1 3.46Å; H77-I79 PolarHBondContact O-N 2.71Å; I79-I81 HydrophobicContact CD1-CD1 4.08Å; I79-I81 HydrophobicContact CD1-CG1 4.16Å; I79-W97 HydrophobicContact CD1-CB 4.1Å; I79-W97 HydrophobicContact CG2-CB 4.41Å; I79-W97 HydrophobicContact CG2-CG 4.29Å; I79-A99 HydrophobicContact CD1-CB 4.28Å
80	F	88.1	Confident	71.2	Confident	4 Å²	4	68 Å²	68	2%	0.018	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	136	167.4	173.2	-102.9	0	0	0	107.9	L56 F59 L82 Q94 L155 V162 M164 F166	L56-F80 HydrophobicContact CD1-CZ 4.48Å; L56-F80 HydrophobicContact CG-CZ 4.14Å; F59-F80 HydrophobicContact CD1-CB 4.21Å; F59-F80 AromaticContact CD1-CD2 3.86Å; F59-F80 HydrophobicContact CD1-CD2 3.86Å; F59-F80 HydrophobicContact CD2-CD2 4.19Å; F59-F80 HydrophobicContact CE1-CB 4.12Å; F59-F80 AromaticContact CE1-CD2 3.54Å; F59-F80 HydrophobicContact CE1-CD2 3.54Å; F59-F80 HydrophobicContact CE1-CE2 4.36Å; F59-F80 HydrophobicContact CE1-CG 4.15Å; F59-F80 AromaticContact CE2-CD2 3.89Å; F59-F80 HydrophobicContact CE2-CD2 3.89Å; F59-F80 HydrophobicContact CE2-CE2 4.01Å; F59-F80 HydrophobicContact CG-CD2 4.17Å; F59-F80 AromaticContact CZ-CD2 3.55Å; F59-F80 HydrophobicContact CZ-CD2 3.55Å; F59-F80 AromaticContact CZ-CE2 3.9Å; F59-F80 HydrophobicContact CZ-CE2 3.9Å; F59-F80 HydrophobicContact CZ-CG 4.47Å; F80-L82 HydrophobicContact CE1-CB 4.45Å; F80-L82 HydrophobicContact CE1-CD1 4.25Å; F80-Q94 PolarHBondContact O-NE2 2.99Å; F80-L155 HydrophobicContact CD1-CD1 3.72Å; F80-L155 HydrophobicContact CE1-CD1 3.79Å; F80-L155 HydrophobicContact CE1-CD2 4.03Å; F80-L155 HydrophobicContact CG-CD1 4.46Å; F80-L155 HydrophobicContact CZ-CD2 4.06Å; F80-V162 HydrophobicContact CE1-CG1 4.36Å; F80-M164 HydrophobicContact CB-CB 3.8Å; F80-M164 HydrophobicContact CB-CG 4Å; F80-M164 HydrophobicContact CG-CB 4.46Å; F80-F166 HydrophobicContact CB-CZ 4.37Å
81	I	87.1	Confident	72.3	Confident	56 Å²	56	63.7 Å²	63.7	29%	0.287	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	118.3	178.7	-55.6	174.9	0	0	0	107.3	G57 T58 T60 I79 A99	G57-I81 CarbonylContact C-O 3.37Å; G57-I81 WeakPolarHBondContact CA-O 3.47Å; T58-I81 PolarHBondContact N-O 3.32Å; T58-I81 PolarHBondContact O-N 3.49Å; T60-I81 WeakPolarHBondContact OG1-CD1 3.44Å; I79-I81 HydrophobicContact CD1-CD1 4.08Å; I79-I81 HydrophobicContact CD1-CG1 4.16Å; I81-A99 HydrophobicContact CD1-CB 3.88Å
82	L	86.1	Confident	74.2	Confident	13 Å²	13	54.2 Å²	54.2	7%	0.068	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	140	179.1	-172.3	69.3	0	0	0	110.7	F80 G84 L86 L92 F157 V162	F80-L82 HydrophobicContact CE1-CB 4.45Å; F80-L82 HydrophobicContact CE1-CD1 4.25Å; L82-G84 PolarHBondContact O-N 2.89Å; L82-L86 HydrophobicContact CD1-CB 4.16Å; L82-L86 HydrophobicContact CD1-CD1 3.97Å; L82-L86 HydrophobicContact CD2-CB 4.47Å; L82-L86 HydrophobicContact CG-CB 4.15Å; L82-L92 HydrophobicContact CD2-CB 3.6Å; L82-L92 HydrophobicContact CD2-CD1 4.1Å; L82-F157 HydrophobicContact CD1-CE1 4.43Å; L82-V162 HydrophobicContact CD1-CG1 4.46Å; L82-V162 HydrophobicContact CD1-CG2 4.31Å; L82-V162 HydrophobicContact CD2-CG2 3.92Å
83	A	85.6	Confident	75.4	Confident	23 Å²	23	53.7 Å²	53.7	19%	0.19	30%	0.3	C	S	.	.			trans	-60.9	132	175.1	0	0	0	0	0	110.9	L56 K85 L86 S87	L56-A83 PolarHBondContact O-N 3.46Å; A83-K85 VanDerWaalsContact C-N 3.26Å; A83-K85 PolarHBondContact O-N 3.3Å; A83-K85 VanDerWaalsContact O-N 3.17Å; A83-L86 HydrophobicContact CB-CB 4.48Å; A83-L86 WeakPolarHBondContact O-CA 3.24Å; A83-L86 WeakPolarHBondContact O-CB 3.47Å; A83-L86 PolarHBondContact O-N 3.28Å; A83-S87 PolarHBondContact O-N 2.95Å; A83-S87 VanDerWaalsContact O-N 3.1Å
84	G	80.1	Confident	76.6	Confident	45 Å²	45	52.8 Å²	52.8	46%	0.464	29%	0.288	S	S	.	.	H	α-helix	trans	-54	-40.5	-176.3	0	0	0	0	0	113.7	L82 L86 S87 Q88	L82-G84 PolarHBondContact O-N 2.89Å; G84-L86 VanDerWaalsContact C-N 3.32Å; G84-L86 PolarHBondContact O-N 3.44Å; G84-S87 PolarHBondContact O-N 3.48Å; G84-S87 VanDerWaalsContact O-N 3.15Å; G84-Q88 WeakPolarHBondContact O-CB 3.31Å; G84-Q88 VanDerWaalsContact O-CG 3.31Å; G84-Q88 WeakPolarHBondContact O-CG 3.48Å; G84-Q88 PolarHBondContact O-N 3.36Å
85	K	79.5	Confident	77.1	Confident	180 Å²	180	54.8 Å²	54.8	78%	0.783	30%	0.302	S	S	*	.	H	α-helix	trans	-57.4	-40.9	175.2	-63.7	-171.5	176.9	-172.1	0	112.7	A83 S89	A83-K85 VanDerWaalsContact C-N 3.26Å; A83-K85 PolarHBondContact O-N 3.3Å; A83-K85 VanDerWaalsContact O-N 3.17Å; K85-S89 WeakPolarHBondContact O-CB 3.46Å; K85-S89 PolarHBondContact O-N 2.94Å; K85-S89 PolarHBondContact O-OG 3.44Å; K85-S89 VanDerWaalsContact O-OG 3.06Å
86	L	78.2	Confident	77.1	Confident	0 Å²	0	62 Å²	62	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-70.1	-38.4	175.9	-98.7	178.6	0	0	0	112.6	G55 L56 L82 A83 G84 Q88 L90 H136	G55-L86 VanDerWaalsContact O-CD1 3.24Å; G55-L86 WeakPolarHBondContact O-CD1 3.44Å; L56-L86 HydrophobicContact CD1-CD1 4.1Å; L82-L86 HydrophobicContact CD1-CB 4.16Å; L82-L86 HydrophobicContact CD1-CD1 3.97Å; L82-L86 HydrophobicContact CD2-CB 4.47Å; L82-L86 HydrophobicContact CG-CB 4.15Å; A83-L86 HydrophobicContact CB-CB 4.48Å; A83-L86 WeakPolarHBondContact O-CA 3.24Å; A83-L86 WeakPolarHBondContact O-CB 3.47Å; A83-L86 PolarHBondContact O-N 3.28Å; G84-L86 VanDerWaalsContact C-N 3.32Å; G84-L86 PolarHBondContact O-N 3.44Å; L86-Q88 VanDerWaalsContact C-N 3.32Å; L86-L90 HydrophobicContact CD2-CD1 3.58Å; L86-L90 PolarHBondContact O-N 3Å; L86-H136 WeakPolarHBondContact CD2-NE2 3.36Å
87	S	79.3	Confident	76.7	Confident	45 Å²	45	68 Å²	68	32%	0.315	35%	0.349	S	S	.	.	H	α-helix	trans	-65.6	-39.4	177	-168.4	0	0	0	0	111.3	A83 G84 G91 L92	A83-S87 PolarHBondContact O-N 2.95Å; A83-S87 VanDerWaalsContact O-N 3.1Å; G84-S87 PolarHBondContact O-N 3.48Å; G84-S87 VanDerWaalsContact O-N 3.15Å; S87-G91 WeakPolarHBondContact O-CA 3.24Å; S87-G91 PolarHBondContact O-N 3.27Å; S87-L92 PolarHBondContact O-N 2.96Å; S87-L92 VanDerWaalsContact O-N 3.15Å; S87-L92 PolarHBondContact OG-O 3.12Å
88	Q	78.7	Confident	75.6	Confident	162 Å²	162	71.4 Å²	71.4	76%	0.757	37%	0.369	S	S	*	.	H	α-helix	trans	-74.1	-44.2	-179.2	-71.3	166.8	-20.9	0	0	112.5	G84 L86 L90	G84-Q88 WeakPolarHBondContact O-CB 3.31Å; G84-Q88 VanDerWaalsContact O-CG 3.31Å; G84-Q88 WeakPolarHBondContact O-CG 3.48Å; G84-Q88 PolarHBondContact O-N 3.36Å; L86-Q88 VanDerWaalsContact C-N 3.32Å; Q88-L90 PolarHBondContact O-N 3.16Å
89	S	73.8	Confident	74.4	Confident	82 Å²	82	73.9 Å²	73.9	57%	0.573	39%	0.389	S	S	*	.	H	α-helix	trans	-74.6	-22.8	-174.4	65.4	0	0	0	0	114.9	K85	K85-S89 WeakPolarHBondContact O-CB 3.46Å; K85-S89 PolarHBondContact O-N 2.94Å; K85-S89 PolarHBondContact O-OG 3.44Å; K85-S89 VanDerWaalsContact O-OG 3.06Å
90	L	71.8	Confident	72.9	Confident	32 Å²	32	77.2 Å²	77.2	17%	0.168	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.2	12.7	-172.1	-71.1	162.3	0	0	0	113.2	L86 Q88 L92 L139 A140	L86-L90 HydrophobicContact CD2-CD1 3.58Å; L86-L90 PolarHBondContact O-N 3Å; Q88-L90 PolarHBondContact O-N 3.16Å; L90-L92 HydrophobicContact CB-CD1 3.95Å; L90-L92 HydrophobicContact CB-CG 3.74Å; L90-L92 HydrophobicContact CD1-CD1 4.21Å; L90-L92 PolarHBondContact O-N 2.97Å; L90-L139 HydrophobicContact CD1-CB 3.8Å; L90-L139 HydrophobicContact CD1-CD1 4.26Å; L90-L139 HydrophobicContact CD2-CB 4.39Å; L90-A140 HydrophobicContact CD2-CB 3.8Å
91	G	67.8	Low	71	Confident	41 Å²	41	82.4 Å²	82.4	42%	0.423	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.3	22	-178.6	0	0	0	0	0	114.4	S87 H93	S87-G91 WeakPolarHBondContact O-CA 3.24Å; S87-G91 PolarHBondContact O-N 3.27Å; G91-H93 PolarHBondContact O-N 2.88Å
92	L	76.5	Confident	69.6	Low	4 Å²	4	87 Å²	87	2%	0.021	47%	0.467	C	S	.	.			trans	-74.6	111.8	-168.8	-69.8	174.8	0	0	0	111.5	L82 S87 L90 L139 F157 N160 V162	L82-L92 HydrophobicContact CD2-CB 3.6Å; L82-L92 HydrophobicContact CD2-CD1 4.1Å; S87-L92 PolarHBondContact O-N 2.96Å; S87-L92 VanDerWaalsContact O-N 3.15Å; S87-L92 PolarHBondContact OG-O 3.12Å; L90-L92 HydrophobicContact CB-CD1 3.95Å; L90-L92 HydrophobicContact CB-CG 3.74Å; L90-L92 HydrophobicContact CD1-CD1 4.21Å; L90-L92 PolarHBondContact O-N 2.97Å; L92-L139 HydrophobicContact CD1-CD1 4.26Å; L92-F157 HydrophobicContact CD1-CD1 4.31Å; L92-F157 HydrophobicContact CD1-CE1 4.3Å; L92-N160 WeakPolarHBondContact CA-O 3.39Å; L92-N160 HydrophobicContact CD2-CB 4.4Å; L92-V162 HydrophobicContact CB-CG2 4.07Å; L92-V162 HydrophobicContact CD1-CG2 4.21Å; L92-V162 HydrophobicContact CD2-CG2 4.26Å; L92-V162 HydrophobicContact CG-CG2 4.41Å
93	H	69.3	Low	68.9	Low	134 Å²	134	87.5 Å²	87.5	62%	0.62	47%	0.471	S	S	*	.	B	Isolated β-bridge	trans	-85.7	125.4	179	-67	-60.8	0	0	0	111.5	G91 N160 K161 V162	G91-H93 PolarHBondContact O-N 2.88Å; H93-N160 PolarHBondContact N-O 3.16Å; H93-K161 HydrophobicContact CB-CG 4.45Å; H93-K161 VanDerWaalsContact O-CA 3.3Å; H93-K161 WeakPolarHBondContact O-CA 3.5Å; H93-V162 PolarHBondContact O-N 2.96Å; H93-V162 VanDerWaalsContact O-N 3.17Å
94	Q	73.8	Confident	68.5	Low	54 Å²	54	90 Å²	90	25%	0.252	49%	0.485	S	S	.	.			trans	-115.5	145.7	169.8	-161.4	179.4	20.2	0	0	110.3	F80 R96	F80-Q94 PolarHBondContact O-NE2 2.99Å; Q94-R96 PolarHBondContact O-N 3.47Å
95	V	65.1	Low	68.6	Low	103 Å²	103	91.3 Å²	91.3	62%	0.624	48%	0.484	S	S	*	.			trans	-60.7	122.1	167	178.1	0	0	0	0	108.1	W97	V95-W97 HydrophobicContact CG1-CZ2 4.13Å; V95-W97 PolarHBondContact O-N 3.06Å; V95-W97 VanDerWaalsContact O-N 3.07Å; V95-W97 PolarHBondContact O-NE1 3.25Å
96	R	59.8	Low	68.8	Low	230 Å²	230	84.8 Å²	84.8	87%	0.868	46%	0.459	S	S	*	.			trans	-74.7	97.9	-174.8	-175.1	179.1	179.7	177.7	-0.2	110.9	Q94	Q94-R96 PolarHBondContact O-N 3.47Å
97	W	61.2	Low	69.2	Low	145 Å²	145	88.7 Å²	88.7	55%	0.549	48%	0.484	S	S	.	.			trans	-81.5	142	170.7	-58.9	100.4	0	0	0	111.1	I79 V95 A99	I79-W97 HydrophobicContact CD1-CB 4.1Å; I79-W97 HydrophobicContact CG2-CB 4.41Å; I79-W97 HydrophobicContact CG2-CG 4.29Å; V95-W97 HydrophobicContact CG1-CZ2 4.13Å; V95-W97 PolarHBondContact O-N 3.06Å; V95-W97 VanDerWaalsContact O-N 3.07Å; V95-W97 PolarHBondContact O-NE1 3.25Å; W97-A99 PolarHBondContact O-N 3.06Å
98	L	54.6	Low	69.4	Low	141 Å²	141	87.1 Å²	87.1	74%	0.738	47%	0.472	S	S	*	.			trans	-83.7	110.5	170.1	-62.7	170.2	0	0	0	108.8	S62	S62-L98 WeakPolarHBondContact CB-O 3.36Å
99	A	59.8	Low	69.7	Low	52 Å²	52	83.1 Å²	83.1	43%	0.43	46%	0.456	S	S	.	.			trans	-72.1	145.9	172.5	0	0	0	0	0	110.4	I79 I81 W97 A101	I79-A99 HydrophobicContact CD1-CB 4.28Å; I81-A99 HydrophobicContact CD1-CB 3.88Å; W97-A99 PolarHBondContact O-N 3.06Å; A99-A101 PolarHBondContact O-N 3.42Å
100	K	55.1	Low	70.1	Confident	76 Å²	76	81.1 Å²	81.1	33%	0.33	44%	0.437	S	S	.	.			trans	-72.6	123.9	172.3	-171.6	-163.5	-179.3	-164.9	0	109.3	F61 L63 H102 V103	F61-K100 PolarHBondContact O-N 2.86Å; L63-K100 HydrophobicContact CB-CB 4.13Å; L63-K100 HydrophobicContact CB-CD 4.12Å; L63-K100 HydrophobicContact CB-CG 4.11Å; L63-K100 HydrophobicContact CD2-CD 4.26Å; K100-H102 PolarHBondContact O-N 2.74Å; K100-V103 HydrophobicContact CB-CG2 4.03Å; K100-V103 HydrophobicContact CD-CG2 4.09Å; K100-V103 HydrophobicContact CG-CG2 4.49Å
101	A	47.6	Very low	70.3	Confident	113 Å²	113	82 Å²	82	93%	0.934	45%	0.449	S	S	*	.	S	Bend	trans	-58.4	-22.3	-179.1	0	0	0	0	0	114.8	A99	A99-A101 PolarHBondContact O-N 3.42Å
102	H	57.3	Low	70.8	Confident	153 Å²	153	81.4 Å²	81.4	71%	0.708	44%	0.44	S	S	*	.	S	Bend	trans	-113.3	64	-177.8	-164.4	-61.3	0	0	0	111.7	K100	K100-H102 PolarHBondContact O-N 2.74Å
103	V	72.3	Confident	70.8	Confident	23 Å²	23	81.2 Å²	81.2	14%	0.139	44%	0.439	C	S	.	.			trans	-131.6	119.3	167.2	175.6	0	0	0	0	107.7	F61 K100 V105	F61-V103 HydrophobicContact CD2-CG1 4.32Å; K100-V103 HydrophobicContact CB-CG2 4.03Å; K100-V103 HydrophobicContact CD-CG2 4.09Å; K100-V103 HydrophobicContact CG-CG2 4.49Å; V103-V105 PolarHBondContact O-N 2.99Å
104	P	77.3	Confident	71.2	Confident	76 Å²	76	76.7 Å²	76.7	49%	0.494	42%	0.419	S	S	.	.			trans	-68.4	123.5	180	27.9	-33.7	0	0	0	110.3	K49 G50	K49-P104 CarbonylContact C-O 3.49Å; K49-P104 WeakPolarHBondContact CA-O 3.4Å; K49-P104 HydrophobicContact CG-CG 4.24Å; G50-P104 PolarHBondContact N-O 2.84Å
105	V	82	Confident	71.1	Confident	72 Å²	72	81.5 Å²	81.5	44%	0.436	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	124.4	177.4	179.3	0	0	0	0	109.4	N52 T58 T60 V103	N52-V105 HydrophobicContact CB-CG1 3.9Å; T58-V105 HydrophobicContact CG2-CG1 3.47Å; T58-V105 VanDerWaalsContact CG2-CG1 3.47Å; T58-V105 HydrophobicContact CG2-CG2 4.28Å; T60-V105 HydrophobicContact CG2-CG2 3.88Å; V103-V105 PolarHBondContact O-N 2.99Å
106	V	84.6	Confident	71.2	Confident	43 Å²	43	82.9 Å²	82.9	26%	0.261	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	134.7	179.9	-169.9	0	0	0	0	108.7	K49 G50 V51 N52	K49-V106 HydrophobicContact CB-CG2 4.19Å; K49-V106 HydrophobicContact CD-CG2 4Å; G50-V106 PolarHBondContact O-N 3.3Å; V51-V106 CarbonylContact C-O 3.4Å; V51-V106 VanDerWaalsContact CA-O 3.32Å; V51-V106 WeakPolarHBondContact CA-O 3.37Å; N52-V106 PolarHBondContact N-O 3.35Å
107	P	85.6	Confident	71.8	Confident	81 Å²	81	72.5 Å²	72.5	53%	0.526	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	155.5	169.6	29.2	-34.9	0	0	0	110.9	N109	P107-N109 PolarHBondContact O-N 2.9Å
108	L	84.3	Confident	72.4	Confident	12 Å²	12	71.2 Å²	71.2	6%	0.063	41%	0.414	C	S	.	.			trans	-54.8	110.2	173.8	-179.1	64.1	0	0	0	110.8	I37 Y40 N52 L53 F110 V113	I37-L108 HydrophobicContact CD1-CD2 4.44Å; I37-L108 HydrophobicContact CG1-CD2 4.38Å; I37-L108 HydrophobicContact CG2-CD1 4.33Å; I37-L108 HydrophobicContact CG2-CD2 4.39Å; Y40-L108 HydrophobicContact CD1-CD1 3.54Å; Y40-L108 HydrophobicContact CE1-CD1 3.81Å; Y40-L108 HydrophobicContact CG-CD1 4.33Å; N52-L108 PolarHBondContact O-N 3.2Å; L53-L108 HydrophobicContact CD2-CB 4.02Å; L53-L108 HydrophobicContact CD2-CD1 4.26Å; L53-L108 HydrophobicContact CD2-CD2 3.78Å; L53-L108 HydrophobicContact CD2-CG 4.24Å; L108-F110 HydrophobicContact CD2-CD1 4.14Å; L108-F110 HydrophobicContact CD2-CE1 3.59Å; L108-F110 HydrophobicContact CD2-CZ 3.94Å; L108-F110 HydrophobicContact CG-CD1 4.47Å; L108-F110 HydrophobicContact CG-CE1 4.26Å; L108-F110 HydrophobicContact CG-CZ 4.45Å; L108-F110 PolarHBondContact O-N 3.47Å; L108-F110 VanDerWaalsContact O-N 3.15Å; L108-V113 HydrophobicContact CD1-CG2 4.21Å
109	N	84.5	Confident	73.5	Confident	79 Å²	79	67 Å²	67	42%	0.422	39%	0.389	S	S	.	.			trans	-82.2	94.4	176.1	-174.8	-5.8	0	0	0	110	Y40 P107 A111 A112 V113	Y40-N109 HydrophobicContact CE2-CB 4.4Å; Y40-N109 WeakPolarHBondContact OH-CB 3.41Å; P107-N109 PolarHBondContact O-N 2.9Å; N109-A111 PolarHBondContact O-N 2.93Å; N109-A111 WeakPolarHBondContact OD1-CB 3.28Å; N109-A111 PolarHBondContact OD1-N 3.4Å; N109-A112 HydrophobicContact CB-CB 4.23Å; N109-A112 WeakPolarHBondContact O-CB 3.47Å; N109-A112 PolarHBondContact O-N 3.26Å; N109-V113 PolarHBondContact O-N 2.93Å
110	F	81.9	Confident	74.5	Confident	40 Å²	40	67.6 Å²	67.6	18%	0.175	39%	0.389	C	S	.	.	H	α-helix	trans	-52.6	-36.9	175.7	-61.9	-76.1	0	0	0	112.6	L108 A112 V113 L114 V124 E125 V128	L108-F110 HydrophobicContact CD2-CD1 4.14Å; L108-F110 HydrophobicContact CD2-CE1 3.59Å; L108-F110 HydrophobicContact CD2-CZ 3.94Å; L108-F110 HydrophobicContact CG-CD1 4.47Å; L108-F110 HydrophobicContact CG-CE1 4.26Å; L108-F110 HydrophobicContact CG-CZ 4.45Å; L108-F110 PolarHBondContact O-N 3.47Å; L108-F110 VanDerWaalsContact O-N 3.15Å; F110-A112 PolarHBondContact O-N 3.04Å; F110-V113 WeakPolarHBondContact O-CB 3.12Å; F110-V113 PolarHBondContact O-N 3.4Å; F110-L114 WeakPolarHBondContact O-CG 3.48Å; F110-L114 PolarHBondContact O-N 3.46Å; F110-V124 HydrophobicContact CD1-CG1 4.2Å; F110-E125 HydrophobicContact CD1-CB 4.28Å; F110-E125 HydrophobicContact CD1-CG 4.4Å; F110-E125 HydrophobicContact CD2-CG 4.17Å; F110-E125 HydrophobicContact CE1-CB 4.28Å; F110-E125 HydrophobicContact CE1-CG 4.08Å; F110-E125 HydrophobicContact CE2-CG 3.84Å; F110-E125 HydrophobicContact CG-CB 4.48Å; F110-E125 HydrophobicContact CG-CG 4.45Å; F110-E125 HydrophobicContact CZ-CB 4.49Å; F110-E125 HydrophobicContact CZ-CG 3.79Å; F110-V128 HydrophobicContact CE1-CB 4.29Å; F110-V128 HydrophobicContact CE1-CG1 4.49Å; F110-V128 HydrophobicContact CE1-CG2 4.25Å
111	A	76.9	Confident	75.7	Confident	50 Å²	50	70.4 Å²	70.4	41%	0.413	40%	0.398	S	S	.	.	H	α-helix	trans	-65	-24.6	179	0	0	0	0	0	113.8	N109	N109-A111 PolarHBondContact O-N 2.93Å; N109-A111 WeakPolarHBondContact OD1-CB 3.28Å; N109-A111 PolarHBondContact OD1-N 3.4Å
112	A	76.6	Confident	77.2	Confident	28 Å²	28	70.4 Å²	70.4	23%	0.231	38%	0.382	C	S	.	.	H	α-helix	trans	-81.2	-26.2	173.2	0	0	0	0	0	112.8	Y40 N109 F110	Y40-A112 HydrophobicContact CD2-CB 3.95Å; Y40-A112 HydrophobicContact CE2-CB 3.57Å; N109-A112 HydrophobicContact CB-CB 4.23Å; N109-A112 WeakPolarHBondContact O-CB 3.47Å; N109-A112 PolarHBondContact O-N 3.26Å; F110-A112 PolarHBondContact O-N 3.04Å
113	V	77.9	Confident	78.2	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-73.7	-39.7	171.9	179.1	0	0	0	0	110.1	E36 I37 Y40 L108 N109 F110 Q115 Q116 T117 V124	E36-V113 HydrophobicContact CB-CG1 4.3Å; E36-V113 HydrophobicContact CG-CG1 4.05Å; I37-V113 HydrophobicContact CG1-CG1 4.26Å; I37-V113 HydrophobicContact CG1-CG2 4.29Å; Y40-V113 HydrophobicContact CG-CG2 4.36Å; L108-V113 HydrophobicContact CD1-CG2 4.21Å; N109-V113 PolarHBondContact O-N 2.93Å; F110-V113 WeakPolarHBondContact O-CB 3.12Å; F110-V113 PolarHBondContact O-N 3.4Å; V113-Q115 VanDerWaalsContact C-N 3.26Å; V113-Q115 PolarHBondContact O-N 2.86Å; V113-Q116 PolarHBondContact O-N 2.86Å; V113-T117 HydrophobicContact CG1-CG2 4.35Å; V113-T117 PolarHBondContact O-N 3.42Å; V113-T117 PolarHBondContact O-OG1 3.06Å; V113-V124 HydrophobicContact CG1-CG1 4.13Å
114	L	77	Confident	78.7	Confident	39 Å²	39	63 Å²	63	20%	0.204	35%	0.348	C	S	.	.	H	α-helix	trans	-58	-34.9	177.3	-67.8	170.3	0	0	0	113.5	F110 Q116 T117 Y119 S120 R121 V124	F110-L114 WeakPolarHBondContact O-CG 3.48Å; F110-L114 PolarHBondContact O-N 3.46Å; L114-Q116 PolarHBondContact O-N 3.29Å; L114-T117 PolarHBondContact O-N 2.85Å; L114-Y119 WeakPolarHBondContact CD2-O 3.38Å; L114-S120 VanDerWaalsContact CD2-C 3.43Å; L114-R121 HydrophobicContact CD1-CB 3.56Å; L114-R121 HydrophobicContact CD1-CG 4.07Å; L114-V124 HydrophobicContact CD2-CB 4.21Å; L114-V124 HydrophobicContact CD2-CG2 3.66Å
115	Q	72.2	Confident	79	Confident	156 Å²	156	61.7 Å²	61.7	73%	0.729	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-14.2	178.1	-73.9	-177.5	-10.6	0	0	113.8	V113	V113-Q115 VanDerWaalsContact C-N 3.26Å; V113-Q115 PolarHBondContact O-N 2.86Å
116	Q	65.9	Low	78.9	Confident	131 Å²	131	58.3 Å²	58.3	61%	0.612	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122	8.4	-178.3	-54	-65.1	-85.6	0	0	112.6	E36 V113 L114	E36-Q116 HydrophobicContact CG-CB 3.84Å; V113-Q116 PolarHBondContact O-N 2.86Å; L114-Q116 PolarHBondContact O-N 3.29Å
117	T	73	Confident	78.8	Confident	13 Å²	13	56.3 Å²	56.3	8%	0.08	30%	0.302	C	S	.	.	S	Bend	trans	-135.8	143.7	-179.8	62.5	0	0	0	0	111.7	E36 V113 L114 Y119	E36-T117 HydrophobicContact CB-CG2 4.09Å; E36-T117 HydrophobicContact CG-CG2 4.18Å; V113-T117 HydrophobicContact CG1-CG2 4.35Å; V113-T117 PolarHBondContact O-N 3.42Å; V113-T117 PolarHBondContact O-OG1 3.06Å; L114-T117 PolarHBondContact O-N 2.85Å; T117-Y119 PolarHBondContact O-N 3.48Å; T117-Y119 VanDerWaalsContact O-N 3.11Å
118	P	73.8	Confident	78.7	Confident	117 Å²	117	52.9 Å²	52.9	76%	0.76	28%	0.28	S	S	*	.	S	Bend	trans	-77.1	7.5	-176	33.8	-38.2	0	0	0	115
119	Y	78	Confident	78.7	Confident	54 Å²	54	58.6 Å²	58.6	21%	0.212	30%	0.301	C	S	.	.	S	Bend	trans	-98.1	162.2	-172.7	-53.2	-70	0	0	0	112.2	L23 D29 I33 L114 T117 V123	L23-Y119 HydrophobicContact CD2-CD1 3.79Å; L23-Y119 HydrophobicContact CD2-CE1 3.49Å; L23-Y119 VanDerWaalsContact CD2-CE1 3.49Å; D29-Y119 VanDerWaalsContact CB-OH 3.28Å; D29-Y119 WeakPolarHBondContact CB-OH 3.23Å; D29-Y119 PolarHBondContact OD2-OH 3.25Å; I33-Y119 HydrophobicContact CD1-CD2 3.88Å; I33-Y119 HydrophobicContact CD1-CE2 4.09Å; I33-Y119 HydrophobicContact CG1-CD2 3.92Å; I33-Y119 HydrophobicContact CG1-CE2 4.03Å; L114-Y119 WeakPolarHBondContact CD2-O 3.38Å; T117-Y119 PolarHBondContact O-N 3.48Å; T117-Y119 VanDerWaalsContact O-N 3.11Å; Y119-V123 HydrophobicContact CD1-CG1 4.42Å; Y119-V123 HydrophobicContact CG-CG1 4.46Å
120	S	79.8	Confident	78.5	Confident	63 Å²	63	56 Å²	56	44%	0.441	29%	0.286	S	S	.	.			trans	-79.6	162	173.6	70.1	0	0	0	0	112.4	L114 D122 V123 V124	L114-S120 VanDerWaalsContact CD2-C 3.43Å; S120-D122 VanDerWaalsContact C-N 3.27Å; S120-D122 PolarHBondContact O-N 3.26Å; S120-V123 PolarHBondContact O-N 3.22Å; S120-V123 WeakPolarHBondContact OG-CG2 3.28Å; S120-V124 PolarHBondContact O-N 3.21Å
121	R	80.7	Confident	78.5	Confident	136 Å²	136	54.3 Å²	54.3	51%	0.513	28%	0.279	S	S	.	.	H	α-helix	trans	-50.4	-48.9	179.7	-177.6	175.6	168.7	173	-6.2	112.2	L114 V123 V124 E125	L114-R121 HydrophobicContact CD1-CB 3.56Å; L114-R121 HydrophobicContact CD1-CG 4.07Å; R121-V123 VanDerWaalsContact C-N 3.32Å; R121-V123 PolarHBondContact O-N 3.37Å; R121-V124 PolarHBondContact O-N 3.15Å; R121-E125 IonicContact NE-OE2 2.94Å; R121-E125 IonicContact NH2-OE2 3.99Å; R121-E125 WeakPolarHBondContact O-CB 3.37Å; R121-E125 PolarHBondContact O-N 3.36Å
122	D	78.9	Confident	78.8	Confident	112 Å²	112	52.5 Å²	52.5	60%	0.599	26%	0.262	S	S	*	.	H	α-helix	trans	-76	-26.7	-169.3	-43	-66.3	0	0	0	111.4	S120 G126	S120-D122 VanDerWaalsContact C-N 3.27Å; S120-D122 PolarHBondContact O-N 3.26Å; D122-G126 WeakPolarHBondContact O-CA 3.21Å; D122-G126 PolarHBondContact O-N 2.68Å
123	V	80.1	Confident	79.1	Confident	21 Å²	21	53.1 Å²	53.1	13%	0.127	27%	0.268	C	S	.	.	H	α-helix	trans	-70.8	-44.3	170.1	172.3	0	0	0	0	111	L23 Y119 S120 R121 C127	L23-V123 HydrophobicContact CD1-CG1 4.07Å; L23-V123 HydrophobicContact CD2-CG1 3.95Å; L23-V123 HydrophobicContact CG-CG1 4.02Å; Y119-V123 HydrophobicContact CD1-CG1 4.42Å; Y119-V123 HydrophobicContact CG-CG1 4.46Å; S120-V123 PolarHBondContact O-N 3.22Å; S120-V123 WeakPolarHBondContact OG-CG2 3.28Å; R121-V123 VanDerWaalsContact C-N 3.32Å; R121-V123 PolarHBondContact O-N 3.37Å; V123-C127 WeakPolarHBondContact O-CB 3.31Å; V123-C127 PolarHBondContact O-N 3.33Å
124	V	81	Confident	79.1	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-66.5	-46.7	176.6	176.6	0	0	0	0	111.2	I33 F110 V113 L114 S120 R121 C127 V128	I33-V124 HydrophobicContact CG2-CG1 4.07Å; F110-V124 HydrophobicContact CD1-CG1 4.2Å; V113-V124 HydrophobicContact CG1-CG1 4.13Å; L114-V124 HydrophobicContact CD2-CB 4.21Å; L114-V124 HydrophobicContact CD2-CG2 3.66Å; S120-V124 PolarHBondContact O-N 3.21Å; R121-V124 PolarHBondContact O-N 3.15Å; V124-C127 PolarHBondContact O-N 2.89Å; V124-V128 WeakPolarHBondContact O-CG2 3.44Å; V124-V128 PolarHBondContact O-N 3.01Å
125	E	84.3	Confident	79.3	Confident	49 Å²	49	51.9 Å²	51.9	23%	0.229	26%	0.262	C	S	.	.	H	α-helix	trans	-65.3	-41.5	178.4	-162.8	-168.6	103.7	0	0	111.5	F110 R121 V128 R129	F110-E125 HydrophobicContact CD1-CB 4.28Å; F110-E125 HydrophobicContact CD1-CG 4.4Å; F110-E125 HydrophobicContact CD2-CG 4.17Å; F110-E125 HydrophobicContact CE1-CB 4.28Å; F110-E125 HydrophobicContact CE1-CG 4.08Å; F110-E125 HydrophobicContact CE2-CG 3.84Å; F110-E125 HydrophobicContact CG-CB 4.48Å; F110-E125 HydrophobicContact CG-CG 4.45Å; F110-E125 HydrophobicContact CZ-CB 4.49Å; F110-E125 HydrophobicContact CZ-CG 3.79Å; R121-E125 IonicContact NE-OE2 2.94Å; R121-E125 IonicContact NH2-OE2 3.99Å; R121-E125 WeakPolarHBondContact O-CB 3.37Å; R121-E125 PolarHBondContact O-N 3.36Å; E125-V128 PolarHBondContact O-N 3.44Å; E125-R129 VanDerWaalsContact O-CB 3.24Å; E125-R129 WeakPolarHBondContact O-CB 3.43Å; E125-R129 PolarHBondContact O-N 3.4Å; E125-R129 IonicContact OE1-CZ 3.62Å; E125-R129 IonicContact OE1-NH1 2.59Å; E125-R129 PolarHBondContact OE1-NH1 3.48Å
126	G	80.5	Confident	79.7	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.01	24%	0.241	C	C	.	.	H	α-helix	trans	-60.3	-49.3	173	0	0	0	0	0	112.5	D122 V128 R129 E130	D122-G126 WeakPolarHBondContact O-CA 3.21Å; D122-G126 PolarHBondContact O-N 2.68Å; G126-V128 PolarHBondContact O-N 3.24Å; G126-R129 PolarHBondContact O-N 3.48Å; G126-E130 VanDerWaalsContact O-CB 3.28Å; G126-E130 WeakPolarHBondContact O-CB 3.27Å; G126-E130 WeakPolarHBondContact O-CG 3.4Å; G126-E130 PolarHBondContact O-N 3.42Å
127	C	82.1	Confident	80.4	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-56.7	-45.4	176.7	178.9	0	0	0	0	112.2	L23 I33 V123 V124 T131	L23-C127 HydrophobicContact CD1-CB 3.98Å; I33-C127 HydrophobicContact CD1-CB 4.13Å; V123-C127 WeakPolarHBondContact O-CB 3.31Å; V123-C127 PolarHBondContact O-N 3.33Å; V124-C127 PolarHBondContact O-N 2.89Å; C127-T131 VanDerWaalsContact O-CB 3.28Å; C127-T131 WeakPolarHBondContact O-CB 3.28Å; C127-T131 PolarHBondContact O-N 3.3Å; C127-T131 PolarHBondContact O-OG1 3.2Å
128	V	83.6	Confident	80.5	Confident	9 Å²	9	45 Å²	45	6%	0.055	23%	0.226	C	C	.	.	H	α-helix	trans	-65.1	-48.8	176.2	173.8	0	0	0	0	111.4	I33 W34 I37 F110 V124 E125 G126 E130 T131 L132	I33-V128 HydrophobicContact CG2-CG2 4.47Å; W34-V128 HydrophobicContact CH2-CG1 4.4Å; W34-V128 HydrophobicContact CZ2-CG1 4.2Å; W34-V128 HydrophobicContact CZ2-CG2 4.48Å; I37-V128 HydrophobicContact CD1-CG2 3.29Å; F110-V128 HydrophobicContact CE1-CB 4.29Å; F110-V128 HydrophobicContact CE1-CG1 4.49Å; F110-V128 HydrophobicContact CE1-CG2 4.25Å; V124-V128 WeakPolarHBondContact O-CG2 3.44Å; V124-V128 PolarHBondContact O-N 3.01Å; E125-V128 PolarHBondContact O-N 3.44Å; G126-V128 PolarHBondContact O-N 3.24Å; V128-E130 VanDerWaalsContact C-N 3.35Å; V128-E130 PolarHBondContact O-N 3.1Å; V128-T131 PolarHBondContact O-N 3Å; V128-L132 HydrophobicContact CG1-CD1 4.08Å; V128-L132 WeakPolarHBondContact O-CB 3.5Å; V128-L132 VanDerWaalsContact O-CG 3.31Å; V128-L132 WeakPolarHBondContact O-CG 3.44Å; V128-L132 PolarHBondContact O-N 3.48Å
129	R	83.7	Confident	80.8	Confident	132 Å²	132	40 Å²	40	50%	0.498	19%	0.193	S	C	.	.	H	α-helix	trans	-58.7	-44.3	179	173.8	170.3	54.5	-117.8	0.4	112.1	E125 G126 L132 A133	E125-R129 VanDerWaalsContact O-CB 3.24Å; E125-R129 WeakPolarHBondContact O-CB 3.43Å; E125-R129 PolarHBondContact O-N 3.4Å; E125-R129 IonicContact OE1-CZ 3.62Å; E125-R129 IonicContact OE1-NH1 2.59Å; E125-R129 PolarHBondContact OE1-NH1 3.48Å; G126-R129 PolarHBondContact O-N 3.48Å; R129-L132 PolarHBondContact O-N 3.06Å; R129-A133 WeakPolarHBondContact O-CB 3.31Å; R129-A133 PolarHBondContact O-N 3.07Å
130	E	80.9	Confident	80.8	Confident	25 Å²	25	40.7 Å²	40.7	12%	0.117	21%	0.21	C	C	.	.	H	α-helix	trans	-74.4	-37.5	-179.2	-71.2	174.4	-165.4	0	0	112.1	L17 R18 G19 L20 G126 V128 L132 A133 A134	L17-E130 WeakPolarHBondContact CB-OE2 3.34Å; L17-E130 HydrophobicContact CD2-CB 4.18Å; L17-E130 HydrophobicContact CD2-CG 4.07Å; R18-E130 PolarHBondContact N-OE1 3.45Å; G19-E130 PolarHBondContact N-OE1 2.69Å; G19-E130 PolarHBondContact N-OE2 3.18Å; L20-E130 WeakPolarHBondContact CB-OE2 3.46Å; L20-E130 HydrophobicContact CD1-CB 3.74Å; L20-E130 HydrophobicContact CG-CB 4.1Å; L20-E130 WeakPolarHBondContact CG-OE2 3.41Å; L20-E130 PolarHBondContact N-OE2 3.37Å; G126-E130 VanDerWaalsContact O-CB 3.28Å; G126-E130 WeakPolarHBondContact O-CB 3.27Å; G126-E130 WeakPolarHBondContact O-CG 3.4Å; G126-E130 PolarHBondContact O-N 3.42Å; V128-E130 VanDerWaalsContact C-N 3.35Å; V128-E130 PolarHBondContact O-N 3.1Å; E130-L132 VanDerWaalsContact C-N 3.33Å; E130-L132 PolarHBondContact O-N 3.37Å; E130-A133 PolarHBondContact O-N 2.82Å; E130-A134 WeakPolarHBondContact O-CB 3.42Å; E130-A134 PolarHBondContact O-N 3.15Å
131	T	80.8	Confident	80.6	Confident	4 Å²	4	40.6 Å²	40.6	3%	0.025	21%	0.209	C	C	.	.	H	α-helix	trans	-61.5	-42.1	171.1	-54.8	0	0	0	0	111	I5 W34 C127 V128 A134 L135	I5-T131 HydrophobicContact CG2-CG2 4.43Å; W34-T131 HydrophobicContact CZ2-CG2 3.9Å; W34-T131 PolarHBondContact NE1-OG1 2.79Å; C127-T131 VanDerWaalsContact O-CB 3.28Å; C127-T131 WeakPolarHBondContact O-CB 3.28Å; C127-T131 PolarHBondContact O-N 3.3Å; C127-T131 PolarHBondContact O-OG1 3.2Å; V128-T131 PolarHBondContact O-N 3Å; T131-A134 PolarHBondContact O-N 3.28Å; T131-L135 WeakPolarHBondContact O-CB 3.49Å; T131-L135 PolarHBondContact O-N 2.88Å
132	L	84.8	Confident	80	Confident	12 Å²	12	40.6 Å²	40.6	6%	0.063	22%	0.215	C	C	.	.	H	α-helix	trans	-68.3	-39.6	176	-68.9	179.1	0	0	0	111.8	W34 S54 L56 V128 R129 E130 A134 L135 H136	W34-L132 HydrophobicContact CH2-CD2 4.1Å; W34-L132 HydrophobicContact CH2-CG 4.41Å; W34-L132 HydrophobicContact CZ2-CD2 4.45Å; W34-L132 HydrophobicContact CZ2-CG 4.46Å; S54-L132 WeakPolarHBondContact O-CD1 3.43Å; L56-L132 HydrophobicContact CB-CD1 4.3Å; L56-L132 HydrophobicContact CB-CD2 3.83Å; L56-L132 HydrophobicContact CD1-CD2 4.39Å; L56-L132 HydrophobicContact CD2-CD2 3.97Å; L56-L132 HydrophobicContact CG-CD2 4.27Å; V128-L132 HydrophobicContact CG1-CD1 4.08Å; V128-L132 WeakPolarHBondContact O-CB 3.5Å; V128-L132 VanDerWaalsContact O-CG 3.31Å; V128-L132 WeakPolarHBondContact O-CG 3.44Å; V128-L132 PolarHBondContact O-N 3.48Å; R129-L132 PolarHBondContact O-N 3.06Å; E130-L132 VanDerWaalsContact C-N 3.33Å; E130-L132 PolarHBondContact O-N 3.37Å; L132-A134 VanDerWaalsContact C-N 3.3Å; L132-A134 PolarHBondContact O-N 3.46Å; L132-L135 HydrophobicContact CD2-CD2 4.12Å; L132-L135 WeakPolarHBondContact O-CB 3.31Å; L132-L135 PolarHBondContact O-N 3Å; L132-H136 PolarHBondContact O-CD2 3.18Å; L132-H136 PolarHBondContact O-N 2.79Å
133	A	82.4	Confident	79.6	Confident	42 Å²	42	41.1 Å²	41.1	35%	0.347	21%	0.209	S	C	.	.	H	α-helix	trans	-64.4	-31.9	173.4	0	0	0	0	0	113	R129 E130 R137	R129-A133 WeakPolarHBondContact O-CB 3.31Å; R129-A133 PolarHBondContact O-N 3.07Å; E130-A133 PolarHBondContact O-N 2.82Å; A133-R137 PolarHBondContact O-N 2.91Å; A133-R137 PolarHBondContact O-NE 2.92Å
134	A	78.6	Confident	79.5	Confident	10 Å²	10	45 Å²	45	8%	0.083	23%	0.226	C	C	.	.	H	α-helix	trans	-68.9	-45	169.8	0	0	0	0	0	111.7	E130 T131 L132 H136 R137 A138	E130-A134 WeakPolarHBondContact O-CB 3.42Å; E130-A134 PolarHBondContact O-N 3.15Å; T131-A134 PolarHBondContact O-N 3.28Å; L132-A134 VanDerWaalsContact C-N 3.3Å; L132-A134 PolarHBondContact O-N 3.46Å; A134-H136 PolarHBondContact O-N 3.36Å; A134-R137 PolarHBondContact O-N 2.7Å; A134-A138 WeakPolarHBondContact O-CB 3.48Å; A134-A138 PolarHBondContact O-N 3.33Å
135	L	81.4	Confident	79.5	Confident	2 Å²	2	45.2 Å²	45.2	1%	0.01	23%	0.227	C	C	.	.	H	α-helix	trans	-58.6	-43.8	175	177.7	62.2	0	0	0	112	L56 T131 L132 A138 L139 I145 F157	L56-L135 HydrophobicContact CD1-CD2 3.92Å; T131-L135 WeakPolarHBondContact O-CB 3.49Å; T131-L135 PolarHBondContact O-N 2.88Å; L132-L135 HydrophobicContact CD2-CD2 4.12Å; L132-L135 WeakPolarHBondContact O-CB 3.31Å; L132-L135 PolarHBondContact O-N 3Å; L135-A138 PolarHBondContact O-N 3.41Å; L135-L139 HydrophobicContact CD1-CD1 4.06Å; L135-L139 HydrophobicContact CD1-CG 4.14Å; L135-L139 HydrophobicContact CG-CD1 3.99Å; L135-L139 HydrophobicContact CG-CG 4.48Å; L135-L139 WeakPolarHBondContact O-CB 3.24Å; L135-L139 VanDerWaalsContact O-CG 3.24Å; L135-L139 WeakPolarHBondContact O-CG 3.36Å; L135-L139 PolarHBondContact O-N 2.69Å; L135-I145 HydrophobicContact CD1-CB 4.46Å; L135-I145 HydrophobicContact CD1-CD1 3.82Å; L135-I145 HydrophobicContact CD1-CG2 3.81Å; L135-F157 HydrophobicContact CD1-CE2 4.42Å
136	H	80.1	Confident	79.4	Confident	59 Å²	59	47.1 Å²	47.1	27%	0.273	23%	0.234	S	C	.	.	H	α-helix	trans	-60.6	-45.8	177.6	-76.2	-143.9	0	0	0	111.7	G55 L86 L132 A134 L139 A140	G55-H136 PolarHBondContact O-NE2 3.36Å; L86-H136 WeakPolarHBondContact CD2-NE2 3.36Å; L132-H136 PolarHBondContact O-CD2 3.18Å; L132-H136 PolarHBondContact O-N 2.79Å; A134-H136 PolarHBondContact O-N 3.36Å; H136-L139 PolarHBondContact O-N 2.81Å; H136-A140 PolarHBondContact O-N 2.95Å
137	R	79.3	Confident	79.6	Confident	91 Å²	91	47.1 Å²	47.1	34%	0.343	23%	0.234	S	C	.	.	H	α-helix	trans	-64	-40.2	174.9	-76.1	173.7	-72.8	164.2	-3.5	112.7	D13 A133 A134 L139 A140 S141	D13-R137 VanDerWaalsContact CG-NH1 3.26Å; D13-R137 IonicContact OD2-CZ 3.51Å; D13-R137 IonicContact OD2-NH1 2.72Å; D13-R137 PolarHBondContact OD2-NH1 3.13Å; A133-R137 PolarHBondContact O-N 2.91Å; A133-R137 PolarHBondContact O-NE 2.92Å; A134-R137 PolarHBondContact O-N 2.7Å; R137-L139 VanDerWaalsContact C-N 3.33Å; R137-L139 PolarHBondContact O-N 2.9Å; R137-A140 PolarHBondContact O-N 3.15Å; R137-S141 PolarHBondContact O-N 3.36Å; R137-S141 PolarHBondContact O-OG 3.32Å
138	A	76	Confident	79.5	Confident	6 Å²	6	49.5 Å²	49.5	5%	0.05	25%	0.249	C	C	.	.	H	α-helix	trans	-69	-31.6	178.3	0	0	0	0	0	112.3	A134 L135 S141 R143 I145	A134-A138 WeakPolarHBondContact O-CB 3.48Å; A134-A138 PolarHBondContact O-N 3.33Å; L135-A138 PolarHBondContact O-N 3.41Å; A138-S141 PolarHBondContact O-OG 3.38Å; A138-S141 VanDerWaalsContact O-OG 3.07Å; A138-R143 PolarHBondContact O-N 3.15Å; A138-I145 HydrophobicContact CB-CD1 3.43Å; A138-I145 VanDerWaalsContact CB-CD1 3.43Å
139	L	79.4	Confident	79.6	Confident	11 Å²	11	49.3 Å²	49.3	6%	0.058	25%	0.248	C	C	.	.	H	α-helix	trans	-72.8	-35.4	170.7	-68.4	169.5	0	0	0	112.4	L90 L92 L135 H136 R137 S141 E142 I145 F157	L90-L139 HydrophobicContact CD1-CB 3.8Å; L90-L139 HydrophobicContact CD1-CD1 4.26Å; L90-L139 HydrophobicContact CD2-CB 4.39Å; L92-L139 HydrophobicContact CD1-CD1 4.26Å; L135-L139 HydrophobicContact CD1-CD1 4.06Å; L135-L139 HydrophobicContact CD1-CG 4.14Å; L135-L139 HydrophobicContact CG-CD1 3.99Å; L135-L139 HydrophobicContact CG-CG 4.48Å; L135-L139 WeakPolarHBondContact O-CB 3.24Å; L135-L139 VanDerWaalsContact O-CG 3.24Å; L135-L139 WeakPolarHBondContact O-CG 3.36Å; L135-L139 PolarHBondContact O-N 2.69Å; H136-L139 PolarHBondContact O-N 2.81Å; R137-L139 VanDerWaalsContact C-N 3.33Å; R137-L139 PolarHBondContact O-N 2.9Å; L139-S141 PolarHBondContact O-N 3.17Å; L139-E142 PolarHBondContact O-N 3.13Å; L139-I145 HydrophobicContact CD2-CD1 3.9Å; L139-I145 HydrophobicContact CG-CD1 4.03Å; L139-F157 HydrophobicContact CD1-CD1 3.88Å; L139-F157 HydrophobicContact CD1-CE1 3.8Å; L139-F157 HydrophobicContact CD1-CG 4.47Å; L139-F157 HydrophobicContact CD1-CZ 4.3Å; L139-F157 HydrophobicContact CD2-CB 3.49Å; L139-F157 VanDerWaalsContact CD2-CB 3.49Å; L139-F157 HydrophobicContact CD2-CD1 3.52Å; L139-F157 HydrophobicContact CD2-CD2 4.23Å; L139-F157 HydrophobicContact CD2-CE1 4.28Å; L139-F157 HydrophobicContact CD2-CG 3.51Å; L139-F157 HydrophobicContact CG-CD1 4.38Å
140	A	78.5	Confident	79.6	Confident	69 Å²	69	49.1 Å²	49.1	57%	0.57	25%	0.251	S	S	*	.	H	α-helix	trans	-64.7	-19.3	175	0	0	0	0	0	113.7	L90 H136 R137 E142	L90-A140 HydrophobicContact CD2-CB 3.8Å; H136-A140 PolarHBondContact O-N 2.95Å; R137-A140 PolarHBondContact O-N 3.15Å; A140-E142 VanDerWaalsContact C-N 3.34Å
141	S	75.3	Confident	79.5	Confident	61 Å²	61	49.6 Å²	49.6	43%	0.427	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	22	172.7	47.2	0	0	0	0	113.2	R137 A138 L139 R143	R137-S141 PolarHBondContact O-N 3.36Å; R137-S141 PolarHBondContact O-OG 3.32Å; A138-S141 PolarHBondContact O-OG 3.38Å; A138-S141 VanDerWaalsContact O-OG 3.07Å; L139-S141 PolarHBondContact O-N 3.17Å; S141-R143 WeakPolarHBondContact O-CG 3.3Å; S141-R143 PolarHBondContact O-N 3.2Å
142	E	67.9	Low	79.6	Confident	136 Å²	136	49.4 Å²	49.4	64%	0.636	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	12.7	177.9	-55.8	-153.8	132.4	0	0	116.1	L139 A140 N160	L139-E142 PolarHBondContact O-N 3.13Å; A140-E142 VanDerWaalsContact C-N 3.34Å; E142-N160 PolarHBondContact OE1-ND2 2.75Å
143	R	70.8	Confident	79.7	Confident	124 Å²	124	49 Å²	49	47%	0.468	26%	0.261	S	S	.	.			trans	-67.8	141.6	-174.4	-60.4	-173.6	172.3	174.1	-5	111.4	A138 S141 I145	A138-R143 PolarHBondContact O-N 3.15Å; S141-R143 WeakPolarHBondContact O-CG 3.3Å; S141-R143 PolarHBondContact O-N 3.2Å; R143-I145 HydrophobicContact CB-CG1 4.46Å; R143-I145 PolarHBondContact O-N 3.1Å
144	H	79.1	Confident	80	Confident	103 Å²	103	49.9 Å²	49.9	48%	0.477	26%	0.261	S	S	.	.			trans	-78.1	113.6	175.6	-65.2	-0.6	0	0	0	110.5	F157 R158 N159	H144-F157 WeakPolarHBondContact CA-O 3.5Å; H144-R158 HydrophobicContact CB-CG 4.41Å; H144-N159 PolarHBondContact CE1-OD1 2.84Å; H144-N159 PolarHBondContact NE2-OD1 2.95Å
145	I	80.8	Confident	80.4	Confident	4 Å²	4	49.4 Å²	49.4	2%	0.021	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	140	-172.1	-59.1	170.1	0	0	0	110.8	I5 L135 A138 L139 R143 S156 F157	I5-I145 HydrophobicContact CD1-CG2 4Å; I5-I145 HydrophobicContact CG1-CG2 4.02Å; L135-I145 HydrophobicContact CD1-CB 4.46Å; L135-I145 HydrophobicContact CD1-CD1 3.82Å; L135-I145 HydrophobicContact CD1-CG2 3.81Å; A138-I145 HydrophobicContact CB-CD1 3.43Å; A138-I145 VanDerWaalsContact CB-CD1 3.43Å; L139-I145 HydrophobicContact CD2-CD1 3.9Å; L139-I145 HydrophobicContact CG-CD1 4.03Å; R143-I145 HydrophobicContact CB-CG1 4.46Å; R143-I145 PolarHBondContact O-N 3.1Å; I145-S156 WeakPolarHBondContact O-CA 3.15Å; I145-F157 HydrophobicContact CB-CB 4.5Å; I145-F157 HydrophobicContact CB-CD2 4.36Å; I145-F157 PolarHBondContact N-O 3.38Å; I145-F157 VanDerWaalsContact N-O 3.15Å; I145-F157 PolarHBondContact O-N 3.11Å
146	F	82.4	Confident	80.6	Confident	89 Å²	89	49.9 Å²	49.9	39%	0.39	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	120.3	173.2	-50.8	-77.9	0	0	0	108.4	P148 V154 L155 R158	F146-P148 VanDerWaalsContact O-CD 3.31Å; F146-P148 WeakPolarHBondContact O-CD 3.47Å; F146-V154 HydrophobicContact CB-CG1 4.2Å; F146-L155 WeakPolarHBondContact CA-O 3.42Å; F146-R158 HydrophobicContact CE1-CG 4.42Å; F146-R158 VanDerWaalsContact CE1-NE 3.34Å; F146-R158 HydrophobicContact CZ-CG 4.39Å; F146-R158 VanDerWaalsContact CZ-NE 3.28Å
147	L	83.1	Confident	80.8	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.005	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	96	176.5	-178.7	81.9	0	0	0	107.6	M2 I5 L56 L149 L155	M2-L147 HydrophobicContact CE-CD1 3.7Å; M2-L147 HydrophobicContact SD-CD1 3.62Å; M2-L147 HydrophobicContact SD-CG 4.46Å; I5-L147 HydrophobicContact CD1-CB 4.43Å; I5-L147 HydrophobicContact CD1-CD1 3.51Å; L56-L147 HydrophobicContact CD2-CD2 3.89Å; L147-L149 HydrophobicContact CD2-CD2 4.29Å; L147-L149 HydrophobicContact CG-CD2 4.38Å; L147-L155 HydrophobicContact CB-CB 4.22Å; L147-L155 HydrophobicContact CD2-CB 4.44Å; L147-L155 HydrophobicContact CD2-CD2 3.99Å; L147-L155 PolarHBondContact N-O 2.91Å; L147-L155 PolarHBondContact O-N 2.92Å
148	P	81.4	Confident	80.9	Confident	50 Å²	50	49.7 Å²	49.7	33%	0.325	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	124.7	177	30.4	-33.3	0	0	0	110.5	M2 F146 V154	M2-P148 HydrophobicContact CG-CG 4.49Å; M2-P148 HydrophobicContact SD-CG 4.38Å; F146-P148 VanDerWaalsContact O-CD 3.31Å; F146-P148 WeakPolarHBondContact O-CD 3.47Å; P148-V154 HydrophobicContact CB-CG2 4.47Å
149	L	84.2	Confident	80.9	Confident	4 Å²	4	55.1 Å²	55.1	2%	0.021	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	107.6	176.6	-64.3	175.4	0	0	0	109	W34 F59 L147 G151 I152 G153 M164	W34-L149 HydrophobicContact CE3-CD2 4.37Å; F59-L149 HydrophobicContact CE1-CD1 4.16Å; F59-L149 HydrophobicContact CE2-CD1 4.46Å; F59-L149 HydrophobicContact CZ-CD1 3.57Å; L147-L149 HydrophobicContact CD2-CD2 4.29Å; L147-L149 HydrophobicContact CG-CD2 4.38Å; L149-G151 PolarHBondContact O-N 2.9Å; L149-I152 HydrophobicContact CB-CB 4.1Å; L149-I152 PolarHBondContact O-N 3.16Å; L149-G153 PolarHBondContact N-O 3.06Å; L149-G153 PolarHBondContact O-N 2.97Å; L149-G153 VanDerWaalsContact O-O 3.12Å; L149-M164 HydrophobicContact CD1-CE 4.35Å
150	K	83.9	Confident	80.9	Confident	128 Å²	128	57.3 Å²	57.3	56%	0.557	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	121.3	-167.5	-164.8	170.5	178.5	179.3	0	110.9	T35 S38 I152	T35-K150 HydrophobicContact CG2-CD 3.79Å; T35-K150 WeakPolarHBondContact OG1-CD 3.39Å; S38-K150 WeakPolarHBondContact CB-O 3.41Å; S38-K150 PolarHBondContact OG-N 3.17Å; K150-I152 VanDerWaalsContact C-N 3.27Å; K150-I152 PolarHBondContact O-N 2.87Å
151	G	78.6	Confident	81.1	Confident	35 Å²	35	60.7 Å²	60.7	36%	0.361	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.7	2.7	-177.3	0	0	0	0	0	116.2	L149	L149-G151 PolarHBondContact O-N 2.9Å
152	I	84.1	Confident	81.6	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.6	-49.8	175.2	-62.8	-179.6	0	0	0	111.3	S38 I41 R42 L149 K150 M164 F166 S167 F170	S38-I152 VanDerWaalsContact O-CD1 3.27Å; S38-I152 WeakPolarHBondContact O-CD1 3.33Å; I41-I152 HydrophobicContact CB-CD1 3.68Å; I41-I152 HydrophobicContact CG2-CD1 3.57Å; R42-I152 HydrophobicContact CB-CD1 4.32Å; R42-I152 HydrophobicContact CB-CG1 4.16Å; L149-I152 HydrophobicContact CB-CB 4.1Å; L149-I152 PolarHBondContact O-N 3.16Å; K150-I152 VanDerWaalsContact C-N 3.27Å; K150-I152 PolarHBondContact O-N 2.87Å; I152-M164 HydrophobicContact CG2-CE 3.69Å; I152-F166 HydrophobicContact CG2-CD1 3.71Å; I152-F166 HydrophobicContact CG2-CE1 3.8Å; I152-F166 CarbonylContact O-C 3.51Å; I152-F166 WeakPolarHBondContact O-CA 3.43Å; I152-S167 PolarHBondContact O-N 2.95Å; I152-F170 HydrophobicContact CB-CE2 4.45Å; I152-F170 HydrophobicContact CG1-CD2 4.19Å; I152-F170 HydrophobicContact CG1-CE2 3.9Å; I152-F170 HydrophobicContact CG1-CZ 4.36Å; I152-F170 HydrophobicContact CG2-CD1 4.38Å; I152-F170 HydrophobicContact CG2-CE1 4.06Å; I152-F170 HydrophobicContact CG2-CE2 4.3Å; I152-F170 HydrophobicContact CG2-CZ 4Å
153	G	86.4	Confident	82.4	Confident	5 Å²	5	57 Å²	57	5%	0.052	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	154.7	-159	-173.5	0	0	0	0	0	113.8	L149 K165	L149-G153 PolarHBondContact N-O 3.06Å; L149-G153 PolarHBondContact O-N 2.97Å; L149-G153 VanDerWaalsContact O-O 3.12Å; G153-K165 CarbonylContact C-O 3.59Å; G153-K165 WeakPolarHBondContact CA-O 3.33Å
154	V	88.2	Confident	83.2	Confident	60 Å²	60	52.3 Å²	52.3	36%	0.364	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	123.2	177.3	-175.8	0	0	0	0	110	F146 P148 M164 K165	F146-V154 HydrophobicContact CB-CG1 4.2Å; P148-V154 HydrophobicContact CB-CG2 4.47Å; V154-M164 VanDerWaalsContact C-SD 3.55Å; V154-K165 PolarHBondContact N-O 2.85Å; V154-K165 PolarHBondContact O-N 3.05Å
155	L	87.1	Confident	83.6	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	131.9	168.6	-178.7	65.8	0	0	0	108.6	L56 F80 F146 L147 F157 V162 M164	L56-L155 HydrophobicContact CD1-CD2 4.21Å; L56-L155 HydrophobicContact CD2-CD2 4.44Å; F80-L155 HydrophobicContact CD1-CD1 3.72Å; F80-L155 HydrophobicContact CE1-CD1 3.79Å; F80-L155 HydrophobicContact CE1-CD2 4.03Å; F80-L155 HydrophobicContact CG-CD1 4.46Å; F80-L155 HydrophobicContact CZ-CD2 4.06Å; F146-L155 WeakPolarHBondContact CA-O 3.42Å; L147-L155 HydrophobicContact CB-CB 4.22Å; L147-L155 HydrophobicContact CD2-CB 4.44Å; L147-L155 HydrophobicContact CD2-CD2 3.99Å; L147-L155 PolarHBondContact N-O 2.91Å; L147-L155 PolarHBondContact O-N 2.92Å; L155-F157 HydrophobicContact CD2-CE2 3.76Å; L155-F157 HydrophobicContact CD2-CZ 3.74Å; L155-F157 HydrophobicContact CG-CE2 3.78Å; L155-F157 HydrophobicContact CG-CZ 4.08Å; L155-V162 HydrophobicContact CD1-CG1 3.73Å; L155-M164 HydrophobicContact CB-SD 3.74Å; L155-M164 HydrophobicContact CD1-CB 3.92Å; L155-M164 HydrophobicContact CD1-SD 4.21Å
156	S	86.1	Confident	83.9	Confident	11 Å²	11	54.7 Å²	54.7	8%	0.077	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	136.6	-174.7	61.7	0	0	0	0	112.3	I145 Q163	I145-S156 WeakPolarHBondContact O-CA 3.15Å; S156-Q163 PolarHBondContact N-O 2.91Å; S156-Q163 PolarHBondContact O-N 2.86Å; S156-Q163 PolarHBondContact OG-O 3.19Å
157	F	85	Confident	84.1	Confident	4 Å²	4	52.6 Å²	52.6	2%	0.018	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	116.1	178.1	-58.9	-99	0	0	0	107.9	L56 L82 L92 L135 L139 H144 I145 L155 V162	L56-F157 HydrophobicContact CD1-CZ 4.22Å; L82-F157 HydrophobicContact CD1-CE1 4.43Å; L92-F157 HydrophobicContact CD1-CD1 4.31Å; L92-F157 HydrophobicContact CD1-CE1 4.3Å; L135-F157 HydrophobicContact CD1-CE2 4.42Å; L139-F157 HydrophobicContact CD1-CD1 3.88Å; L139-F157 HydrophobicContact CD1-CE1 3.8Å; L139-F157 HydrophobicContact CD1-CG 4.47Å; L139-F157 HydrophobicContact CD1-CZ 4.3Å; L139-F157 HydrophobicContact CD2-CB 3.49Å; L139-F157 VanDerWaalsContact CD2-CB 3.49Å; L139-F157 HydrophobicContact CD2-CD1 3.52Å; L139-F157 HydrophobicContact CD2-CD2 4.23Å; L139-F157 HydrophobicContact CD2-CE1 4.28Å; L139-F157 HydrophobicContact CD2-CG 3.51Å; L139-F157 HydrophobicContact CG-CD1 4.38Å; H144-F157 WeakPolarHBondContact CA-O 3.5Å; I145-F157 HydrophobicContact CB-CB 4.5Å; I145-F157 HydrophobicContact CB-CD2 4.36Å; I145-F157 PolarHBondContact N-O 3.38Å; I145-F157 VanDerWaalsContact N-O 3.15Å; I145-F157 PolarHBondContact O-N 3.11Å; L155-F157 HydrophobicContact CD2-CE2 3.76Å; L155-F157 HydrophobicContact CD2-CZ 3.74Å; L155-F157 HydrophobicContact CG-CE2 3.78Å; L155-F157 HydrophobicContact CG-CZ 4.08Å; F157-V162 HydrophobicContact CD1-CB 4.49Å; F157-V162 HydrophobicContact CD1-CG1 4.29Å; F157-V162 HydrophobicContact CD1-CG2 3.62Å; F157-V162 HydrophobicContact CE1-CG1 4.01Å; F157-V162 HydrophobicContact CE1-CG2 3.75Å; F157-V162 HydrophobicContact CZ-CG1 4.44Å
158	R	81.4	Confident	84	Confident	143 Å²	143	61.7 Å²	61.7	54%	0.54	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	135.9	178.1	-65.9	-171.6	-177.3	-159.6	-1.5	110	H144 F146 N160 K161	H144-R158 HydrophobicContact CB-CG 4.41Å; F146-R158 HydrophobicContact CE1-CG 4.42Å; F146-R158 VanDerWaalsContact CE1-NE 3.34Å; F146-R158 HydrophobicContact CZ-CG 4.39Å; F146-R158 VanDerWaalsContact CZ-NE 3.28Å; R158-N160 VanDerWaalsContact C-N 3.25Å; R158-N160 PolarHBondContact O-N 2.86Å; R158-K161 PolarHBondContact N-O 3.27Å; R158-K161 WeakPolarHBondContact O-CA 3.31Å; R158-K161 WeakPolarHBondContact O-CB 3.14Å; R158-K161 PolarHBondContact O-N 3.41Å
159	N	75.6	Confident	84.1	Confident	120 Å²	120	64.7 Å²	64.7	64%	0.642	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.9	47.9	173.2	-52.7	27.9	0	0	0	112	H144 K161	H144-N159 PolarHBondContact CE1-OD1 2.84Å; H144-N159 PolarHBondContact NE2-OD1 2.95Å; N159-K161 PolarHBondContact O-N 2.77Å
160	N	78.8	Confident	84	Confident	57 Å²	57	64.6 Å²	64.6	31%	0.305	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	52	26.4	-175.7	-55.9	-13.2	0	0	0	114.7	L92 H93 E142 R158	L92-N160 WeakPolarHBondContact CA-O 3.39Å; L92-N160 HydrophobicContact CD2-CB 4.4Å; H93-N160 PolarHBondContact N-O 3.16Å; E142-N160 PolarHBondContact OE1-ND2 2.75Å; R158-N160 VanDerWaalsContact C-N 3.25Å; R158-N160 PolarHBondContact O-N 2.86Å
161	K	82.9	Confident	84	Confident	139 Å²	139	60.3 Å²	60.3	60%	0.604	30%	0.295	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.6	140	173.6	-66.3	171.4	-173.9	176.8	0	111.3	H93 R158 N159	H93-K161 HydrophobicContact CB-CG 4.45Å; H93-K161 VanDerWaalsContact O-CA 3.3Å; H93-K161 WeakPolarHBondContact O-CA 3.5Å; R158-K161 PolarHBondContact N-O 3.27Å; R158-K161 WeakPolarHBondContact O-CA 3.31Å; R158-K161 WeakPolarHBondContact O-CB 3.14Å; R158-K161 PolarHBondContact O-N 3.41Å; N159-K161 PolarHBondContact O-N 2.77Å
162	V	84.9	Confident	84	Confident	10 Å²	10	61.6 Å²	61.6	6%	0.061	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	121.8	179	-173.6	0	0	0	0	110.6	F80 L82 L92 H93 L155 F157	F80-V162 HydrophobicContact CE1-CG1 4.36Å; L82-V162 HydrophobicContact CD1-CG1 4.46Å; L82-V162 HydrophobicContact CD1-CG2 4.31Å; L82-V162 HydrophobicContact CD2-CG2 3.92Å; L92-V162 HydrophobicContact CB-CG2 4.07Å; L92-V162 HydrophobicContact CD1-CG2 4.21Å; L92-V162 HydrophobicContact CD2-CG2 4.26Å; L92-V162 HydrophobicContact CG-CG2 4.41Å; H93-V162 PolarHBondContact O-N 2.96Å; H93-V162 VanDerWaalsContact O-N 3.17Å; L155-V162 HydrophobicContact CD1-CG1 3.73Å; F157-V162 HydrophobicContact CD1-CB 4.49Å; F157-V162 HydrophobicContact CD1-CG1 4.29Å; F157-V162 HydrophobicContact CD1-CG2 3.62Å; F157-V162 HydrophobicContact CE1-CG1 4.01Å; F157-V162 HydrophobicContact CE1-CG2 3.75Å; F157-V162 HydrophobicContact CZ-CG1 4.44Å
163	Q	84.8	Confident	83.7	Confident	109 Å²	109	63.2 Å²	63.2	51%	0.509	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	117.3	175.6	-177.3	173.8	60.9	0	0	110.6	S156 K165	S156-Q163 PolarHBondContact N-O 2.91Å; S156-Q163 PolarHBondContact O-N 2.86Å; S156-Q163 PolarHBondContact OG-O 3.19Å; Q163-K165 HydrophobicContact CG-CG 4.19Å
164	M	87.9	Confident	83.3	Confident	26 Å²	26	63.2 Å²	63.2	13%	0.128	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	134	164.5	-177.2	57.1	-175.1	0	0	109.5	F59 F80 L149 I152 V154 L155 F166	F59-M164 HydrophobicContact CE1-CE 4.28Å; F80-M164 HydrophobicContact CB-CB 3.8Å; F80-M164 HydrophobicContact CB-CG 4Å; F80-M164 HydrophobicContact CG-CB 4.46Å; L149-M164 HydrophobicContact CD1-CE 4.35Å; I152-M164 HydrophobicContact CG2-CE 3.69Å; V154-M164 VanDerWaalsContact C-SD 3.55Å; L155-M164 HydrophobicContact CB-SD 3.74Å; L155-M164 HydrophobicContact CD1-CB 3.92Å; L155-M164 HydrophobicContact CD1-SD 4.21Å; M164-F166 HydrophobicContact CB-CE2 4.29Å; M164-F166 HydrophobicContact CE-CD1 3.7Å; M164-F166 HydrophobicContact CE-CE1 3.64Å; M164-F166 HydrophobicContact CE-CG 4.36Å; M164-F166 HydrophobicContact CE-CZ 4.25Å; M164-F166 HydrophobicContact CG-CD1 4.32Å; M164-F166 HydrophobicContact CG-CD2 4.02Å; M164-F166 HydrophobicContact CG-CE1 3.91Å; M164-F166 HydrophobicContact CG-CE2 3.56Å; M164-F166 HydrophobicContact CG-CG 4.37Å; M164-F166 HydrophobicContact CG-CZ 3.52Å
165	K	87.9	Confident	82.3	Confident	125 Å²	125	62.2 Å²	62.2	54%	0.543	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	104.2	171.7	-66.1	-174.2	-177.3	179.9	0	109.1	G153 V154 Q163	G153-K165 CarbonylContact C-O 3.59Å; G153-K165 WeakPolarHBondContact CA-O 3.33Å; V154-K165 PolarHBondContact N-O 2.85Å; V154-K165 PolarHBondContact O-N 3.05Å; Q163-K165 HydrophobicContact CG-CG 4.19Å
166	F	87.3	Confident	81.1	Confident	32 Å²	32	67.5 Å²	67.5	14%	0.14	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	142.2	176.3	-65.2	-77.9	0	0	0	111.4	F59 P78 F80 I152 M164 F170 I171	F59-F166 HydrophobicContact CD1-CE1 4.12Å; F59-F166 HydrophobicContact CD1-CZ 4.18Å; F59-F166 HydrophobicContact CE1-CE1 4.32Å; F59-F166 HydrophobicContact CE1-CZ 4.48Å; P78-F166 HydrophobicContact CB-CD1 4.23Å; P78-F166 HydrophobicContact CB-CD2 4.22Å; P78-F166 HydrophobicContact CB-CE1 4.08Å; P78-F166 HydrophobicContact CB-CE2 4.08Å; P78-F166 HydrophobicContact CB-CG 4.29Å; P78-F166 HydrophobicContact CB-CZ 4.01Å; P78-F166 HydrophobicContact CG-CB 4.39Å; P78-F166 HydrophobicContact CG-CD1 4.29Å; P78-F166 HydrophobicContact CG-CD2 3.98Å; P78-F166 HydrophobicContact CG-CE2 4.34Å; P78-F166 HydrophobicContact CG-CG 3.96Å; P78-F166 WeakPolarHBondContact O-CD2 3.3Å; P78-F166 WeakPolarHBondContact O-CE2 3.35Å; F80-F166 HydrophobicContact CB-CZ 4.37Å; I152-F166 HydrophobicContact CG2-CD1 3.71Å; I152-F166 HydrophobicContact CG2-CE1 3.8Å; I152-F166 CarbonylContact O-C 3.51Å; I152-F166 WeakPolarHBondContact O-CA 3.43Å; M164-F166 HydrophobicContact CB-CE2 4.29Å; M164-F166 HydrophobicContact CE-CD1 3.7Å; M164-F166 HydrophobicContact CE-CE1 3.64Å; M164-F166 HydrophobicContact CE-CG 4.36Å; M164-F166 HydrophobicContact CE-CZ 4.25Å; M164-F166 HydrophobicContact CG-CD1 4.32Å; M164-F166 HydrophobicContact CG-CD2 4.02Å; M164-F166 HydrophobicContact CG-CE1 3.91Å; M164-F166 HydrophobicContact CG-CE2 3.56Å; M164-F166 HydrophobicContact CG-CG 4.37Å; M164-F166 HydrophobicContact CG-CZ 3.52Å; F166-F170 HydrophobicContact CB-CD1 4.2Å; F166-F170 AromaticContact CD1-CD1 3.73Å; F166-F170 HydrophobicContact CD1-CD1 3.73Å; F166-F170 AromaticContact CD1-CE1 3.48Å; F166-F170 HydrophobicContact CD1-CE1 3.48Å; F166-F170 VanDerWaalsContact CD1-CE1 3.48Å; F166-F170 AromaticContact CE1-CE1 3.88Å; F166-F170 HydrophobicContact CE1-CE1 3.88Å; F166-F170 HydrophobicContact CG-CD1 4.31Å; F166-F170 HydrophobicContact CG-CE1 4.33Å; F166-I171 HydrophobicContact CB-CD1 4.07Å; F166-I171 HydrophobicContact CB-CG1 4.05Å
167	S	86.3	Confident	79.8	Confident	46 Å²	46	69 Å²	69	32%	0.322	33%	0.331	S	S	.	.			trans	-68.2	143.4	174.8	-65.6	0	0	0	0	110.8	I152 D169 F170 I171	I152-S167 PolarHBondContact O-N 2.95Å; S167-D169 VanDerWaalsContact C-N 3.26Å; S167-D169 PolarHBondContact O-N 3.16Å; S167-F170 WeakPolarHBondContact O-CB 3.48Å; S167-F170 PolarHBondContact O-N 2.86Å; S167-I171 PolarHBondContact O-N 3.15Å
168	R	81.9	Confident	78.5	Confident	192 Å²	192	71.7 Å²	71.7	73%	0.725	34%	0.341	S	S	*	.	H	α-helix	trans	-57.1	-42	179.4	-173.7	176.9	-176.8	175.8	0.6	111.8	F170 I171 N172	R168-F170 VanDerWaalsContact C-N 3.29Å; R168-F170 PolarHBondContact O-N 3.36Å; R168-I171 PolarHBondContact O-N 2.83Å; R168-N172 PolarHBondContact O-N 2.85Å; R168-N172 PolarHBondContact O-OD1 3.12Å
169	D	81.9	Confident	77.2	Confident	113 Å²	113	70.7 Å²	70.7	60%	0.604	34%	0.343	S	S	*	.	H	α-helix	trans	-65.6	-34.3	-177.1	-37.3	-50.5	0	0	0	111.5	S167 T173	S167-D169 VanDerWaalsContact C-N 3.26Å; S167-D169 PolarHBondContact O-N 3.16Å; D169-T173 WeakPolarHBondContact O-CG2 3.17Å; D169-T173 PolarHBondContact O-N 3.02Å; D169-T173 PolarHBondContact O-OG1 3.05Å
170	F	82.8	Confident	76.1	Confident	2 Å²	2	69.2 Å²	69.2	1%	0.009	34%	0.338	C	S	.	.	H	α-helix	trans	-64.8	-48.7	173.2	177	-104.5	0	0	0	111.2	R42 M45 P78 I152 F166 S167 R168 N172 T173 I174	R42-F170 HydrophobicContact CB-CE2 4.18Å; R42-F170 HydrophobicContact CG-CD2 4.07Å; R42-F170 HydrophobicContact CG-CE2 3.93Å; M45-F170 HydrophobicContact CB-CZ 4.28Å; P78-F170 HydrophobicContact CB-CE1 3.88Å; P78-F170 HydrophobicContact CG-CD1 4.36Å; P78-F170 HydrophobicContact CG-CE1 4.06Å; I152-F170 HydrophobicContact CB-CE2 4.45Å; I152-F170 HydrophobicContact CG1-CD2 4.19Å; I152-F170 HydrophobicContact CG1-CE2 3.9Å; I152-F170 HydrophobicContact CG1-CZ 4.36Å; I152-F170 HydrophobicContact CG2-CD1 4.38Å; I152-F170 HydrophobicContact CG2-CE1 4.06Å; I152-F170 HydrophobicContact CG2-CE2 4.3Å; I152-F170 HydrophobicContact CG2-CZ 4Å; F166-F170 HydrophobicContact CB-CD1 4.2Å; F166-F170 AromaticContact CD1-CD1 3.73Å; F166-F170 HydrophobicContact CD1-CD1 3.73Å; F166-F170 AromaticContact CD1-CE1 3.48Å; F166-F170 HydrophobicContact CD1-CE1 3.48Å; F166-F170 VanDerWaalsContact CD1-CE1 3.48Å; F166-F170 AromaticContact CE1-CE1 3.88Å; F166-F170 HydrophobicContact CE1-CE1 3.88Å; F166-F170 HydrophobicContact CG-CD1 4.31Å; F166-F170 HydrophobicContact CG-CE1 4.33Å; S167-F170 WeakPolarHBondContact O-CB 3.48Å; S167-F170 PolarHBondContact O-N 2.86Å; R168-F170 VanDerWaalsContact C-N 3.29Å; R168-F170 PolarHBondContact O-N 3.36Å; F170-N172 VanDerWaalsContact C-N 3.33Å; F170-N172 PolarHBondContact O-N 3.02Å; F170-T173 PolarHBondContact O-N 3.21Å; F170-T173 PolarHBondContact O-OG1 2.81Å; F170-I174 HydrophobicContact CD1-CD1 3.93Å; F170-I174 HydrophobicContact CD2-CD1 4.22Å; F170-I174 HydrophobicContact CE1-CD1 3.51Å; F170-I174 HydrophobicContact CE2-CD1 3.81Å; F170-I174 HydrophobicContact CG-CD1 4.28Å; F170-I174 HydrophobicContact CZ-CD1 3.45Å; F170-I174 VanDerWaalsContact CZ-CD1 3.45Å; F170-I174 PolarHBondContact O-N 2.86Å; F170-I174 VanDerWaalsContact O-N 3.15Å
171	I	83.9	Confident	74.8	Confident	38 Å²	38	71 Å²	71	20%	0.195	35%	0.347	C	S	.	.	H	α-helix	trans	-60.6	-42.6	177	-59.5	169.5	0	0	0	111.1	F75 P78 F166 S167 R168 S175	F75-I171 HydrophobicContact CE1-CG2 4.47Å; F75-I171 HydrophobicContact CZ-CG2 4.14Å; P78-I171 HydrophobicContact CG-CG1 4.09Å; F166-I171 HydrophobicContact CB-CD1 4.07Å; F166-I171 HydrophobicContact CB-CG1 4.05Å; S167-I171 PolarHBondContact O-N 3.15Å; R168-I171 PolarHBondContact O-N 2.83Å; I171-S175 PolarHBondContact O-N 2.79Å; I171-S175 VanDerWaalsContact O-N 3.13Å; I171-S175 PolarHBondContact O-OG 3.14Å
172	N	78.4	Confident	73.2	Confident	62 Å²	62	68.9 Å²	68.9	33%	0.332	34%	0.338	S	S	.	.	H	α-helix	trans	-59.1	-53.4	174.8	-75.4	15.6	0	0	0	111	R168 F170 I174 S175 E176	R168-N172 PolarHBondContact O-N 2.85Å; R168-N172 PolarHBondContact O-OD1 3.12Å; F170-N172 VanDerWaalsContact C-N 3.33Å; F170-N172 PolarHBondContact O-N 3.02Å; N172-I174 VanDerWaalsContact C-N 3.3Å; N172-I174 PolarHBondContact O-N 3.07Å; N172-S175 CarbonylContact O-C 3.58Å; N172-S175 WeakPolarHBondContact O-CA 3.32Å; N172-S175 WeakPolarHBondContact O-CB 3.49Å; N172-S175 PolarHBondContact O-N 3.38Å; N172-E176 WeakPolarHBondContact O-CG 3.34Å; N172-E176 PolarHBondContact O-N 3.47Å
173	T	78.9	Confident	71.2	Confident	34 Å²	34	72.7 Å²	72.7	21%	0.209	36%	0.358	C	S	.	.	H	α-helix	trans	-60.4	-35.5	-177.2	51.6	0	0	0	0	113.8	D169 F170 S175 T177	D169-T173 WeakPolarHBondContact O-CG2 3.17Å; D169-T173 PolarHBondContact O-N 3.02Å; D169-T173 PolarHBondContact O-OG1 3.05Å; F170-T173 PolarHBondContact O-N 3.21Å; F170-T173 PolarHBondContact O-OG1 2.81Å; T173-S175 VanDerWaalsContact C-N 3.33Å; T173-T177 WeakPolarHBondContact O-CB 3.23Å; T173-T177 PolarHBondContact O-N 3.13Å; T173-T177 VanDerWaalsContact O-N 3.07Å; T173-T177 PolarHBondContact O-OG1 3.24Å
174	I	76.3	Confident	69.4	Low	4 Å²	4	70.6 Å²	70.6	2%	0.021	36%	0.356	C	S	.	.	H	α-helix	trans	-68.7	-33.7	174.3	-69.5	166.7	0	0	0	111.6	N46 F61 F170 N172	N46-I174 WeakPolarHBondContact OD1-CG1 3.46Å; F61-I174 HydrophobicContact CE1-CD1 4.14Å; F61-I174 HydrophobicContact CE1-CG2 3.84Å; F61-I174 HydrophobicContact CZ-CD1 4.34Å; F61-I174 HydrophobicContact CZ-CG2 4.18Å; F170-I174 HydrophobicContact CD1-CD1 3.93Å; F170-I174 HydrophobicContact CD2-CD1 4.22Å; F170-I174 HydrophobicContact CE1-CD1 3.51Å; F170-I174 HydrophobicContact CE2-CD1 3.81Å; F170-I174 HydrophobicContact CG-CD1 4.28Å; F170-I174 HydrophobicContact CZ-CD1 3.45Å; F170-I174 VanDerWaalsContact CZ-CD1 3.45Å; F170-I174 PolarHBondContact O-N 2.86Å; F170-I174 VanDerWaalsContact O-N 3.15Å; N172-I174 VanDerWaalsContact C-N 3.3Å; N172-I174 PolarHBondContact O-N 3.07Å
175	S	67.3	Low	67.3	Low	40 Å²	40	73.2 Å²	73.2	28%	0.28	38%	0.377	S	S	.	.	H	α-helix	trans	-73	-44.6	177.3	-54.1	0	0	0	0	111.7	F75 I171 N172 T173 R178	F75-S175 WeakPolarHBondContact CZ-OG 3.33Å; I171-S175 PolarHBondContact O-N 2.79Å; I171-S175 VanDerWaalsContact O-N 3.13Å; I171-S175 PolarHBondContact O-OG 3.14Å; N172-S175 CarbonylContact O-C 3.58Å; N172-S175 WeakPolarHBondContact O-CA 3.32Å; N172-S175 WeakPolarHBondContact O-CB 3.49Å; N172-S175 PolarHBondContact O-N 3.38Å; T173-S175 VanDerWaalsContact C-N 3.33Å; S175-R178 VanDerWaalsContact O-CB 3.29Å; S175-R178 WeakPolarHBondContact O-CB 3.45Å; S175-R178 PolarHBondContact O-N 3.41Å; S175-R178 VanDerWaalsContact O-N 3.17Å
176	E	63.7	Low	65.1	Low	110 Å²	110	74.7 Å²	74.7	51%	0.514	39%	0.387	S	S	.	.	H	α-helix	trans	-64.9	-43.1	179.6	-70.7	157.3	-164.7	0	0	111.8	N172 R178 Q179 T180	N172-E176 WeakPolarHBondContact O-CG 3.34Å; N172-E176 PolarHBondContact O-N 3.47Å; E176-R178 PolarHBondContact O-N 2.99Å; E176-R178 VanDerWaalsContact O-N 3.11Å; E176-Q179 WeakPolarHBondContact O-CB 3.17Å; E176-Q179 PolarHBondContact O-N 2.97Å; E176-T180 PolarHBondContact O-N 3.15Å
177	T	58.2	Low	63.1	Low	42 Å²	42	83.3 Å²	83.3	26%	0.258	42%	0.419	S	S	.	.	H	α-helix	trans	-59	-23.8	174.8	-54.2	0	0	0	0	112.4	T173 T180 L181	T173-T177 WeakPolarHBondContact O-CB 3.23Å; T173-T177 PolarHBondContact O-N 3.13Å; T173-T177 VanDerWaalsContact O-N 3.07Å; T173-T177 PolarHBondContact O-OG1 3.24Å; T177-T180 PolarHBondContact O-OG1 3.02Å; T177-L181 HydrophobicContact CG2-CD1 4.02Å; T177-L181 WeakPolarHBondContact O-CB 3.37Å; T177-L181 WeakPolarHBondContact O-CG 3.47Å; T177-L181 PolarHBondContact O-N 2.75Å
178	R	56.9	Low	60.9	Low	61 Å²	61	85.4 Å²	85.4	23%	0.23	44%	0.439	C	S	.	.	H	α-helix	trans	-78	-32.4	176.9	-161.7	-173.7	-163.7	131	31.7	113.1	N74 H76 S175 E176 K182	N74-R178 PolarHBondContact O-NH1 3.23Å; H76-R178 PolarHBondContact CD2-NH1 2.93Å; H76-R178 PolarHBondContact CD2-NH2 3.02Å; H76-R178 VanDerWaalsContact CG-NH1 3.29Å; H76-R178 PolarHBondContact NE2-NH2 2.77Å; S175-R178 VanDerWaalsContact O-CB 3.29Å; S175-R178 WeakPolarHBondContact O-CB 3.45Å; S175-R178 PolarHBondContact O-N 3.41Å; S175-R178 VanDerWaalsContact O-N 3.17Å; E176-R178 PolarHBondContact O-N 2.99Å; E176-R178 VanDerWaalsContact O-N 3.11Å; R178-K182 PolarHBondContact O-N 3.2Å; R178-K182 VanDerWaalsContact O-N 3.1Å
179	Q	55	Low	58.7	Low	123 Å²	123	79.7 Å²	79.7	58%	0.575	44%	0.439	S	S	*	.	H	α-helix	trans	-63.7	-55.9	179	-166.1	68.3	46.7	0	0	108.7	E176 L181 K182 D183	E176-Q179 WeakPolarHBondContact O-CB 3.17Å; E176-Q179 PolarHBondContact O-N 2.97Å; Q179-L181 PolarHBondContact O-N 3.46Å; Q179-K182 WeakPolarHBondContact O-CB 3.47Å; Q179-K182 PolarHBondContact O-N 2.97Å; Q179-K182 VanDerWaalsContact O-N 3.14Å; Q179-D183 PolarHBondContact O-N 2.8Å
180	T	51.5	Low	56.4	Low	88 Å²	88	79.1 Å²	79.1	54%	0.54	44%	0.444	S	S	.	.	H	α-helix	trans	-60.5	-40.6	179.8	54.2	0	0	0	0	113.5	E176 T177 D183 S184	E176-T180 PolarHBondContact O-N 3.15Å; T177-T180 PolarHBondContact O-OG1 3.02Å; T180-D183 PolarHBondContact O-N 3.13Å; T180-S184 PolarHBondContact O-N 3.33Å; T180-S184 PolarHBondContact O-OG 3.26Å
181	L	52.7	Low	54.1	Low	95 Å²	95	85 Å²	85	50%	0.497	49%	0.486	S	S	.	.	H	α-helix	trans	-69.4	-30.1	177	-76.4	174.1	0	0	0	113.8	T177 Q179 S184 S185	T177-L181 HydrophobicContact CG2-CD1 4.02Å; T177-L181 WeakPolarHBondContact O-CB 3.37Å; T177-L181 WeakPolarHBondContact O-CG 3.47Å; T177-L181 PolarHBondContact O-N 2.75Å; Q179-L181 PolarHBondContact O-N 3.46Å; L181-S184 WeakPolarHBondContact CA-OG 3.39Å; L181-S184 PolarHBondContact O-OG 3.46Å; L181-S184 VanDerWaalsContact O-OG 3.1Å; L181-S185 VanDerWaalsContact O-CB 3.3Å; L181-S185 WeakPolarHBondContact O-CB 3.3Å; L181-S185 PolarHBondContact O-N 3.17Å; L181-S185 VanDerWaalsContact O-N 3.13Å
182	K	49.5	Very low	51.5	Low	95 Å²	95	88.1 Å²	88.1	41%	0.413	51%	0.511	S	S	.	.	H	α-helix	trans	-68.8	-45.3	169	-85.2	-171	167.3	-164.8	0	110.8	R178 Q179 S184 S185 M186	R178-K182 PolarHBondContact O-N 3.2Å; R178-K182 VanDerWaalsContact O-N 3.1Å; Q179-K182 WeakPolarHBondContact O-CB 3.47Å; Q179-K182 PolarHBondContact O-N 2.97Å; Q179-K182 VanDerWaalsContact O-N 3.14Å; K182-S184 VanDerWaalsContact C-N 3.29Å; K182-S184 PolarHBondContact O-N 3.07Å; K182-S185 PolarHBondContact O-N 2.88Å; K182-S185 VanDerWaalsContact O-N 3.13Å; K182-M186 WeakPolarHBondContact O-CG 3.22Å; K182-M186 PolarHBondContact O-N 3.3Å
183	D	43.3	Very low	49.3	Very low	89 Å²	89	90.6 Å²	90.6	48%	0.476	53%	0.533	S	S	.	.	H	α-helix	trans	-67.8	-29.8	-175.8	-59.6	-23.7	0	0	0	111.9	Q179 T180	Q179-D183 PolarHBondContact O-N 2.8Å; T180-D183 PolarHBondContact O-N 3.13Å
184	S	45.7	Very low	47.1	Very low	66 Å²	66	97.1 Å²	97.1	46%	0.462	57%	0.566	S	S	.	*	H	α-helix	trans	-74.5	-41	168.2	63.1	0	0	0	0	112.8	T180 L181 K182 M186 R187	T180-S184 PolarHBondContact O-N 3.33Å; T180-S184 PolarHBondContact O-OG 3.26Å; L181-S184 WeakPolarHBondContact CA-OG 3.39Å; L181-S184 PolarHBondContact O-OG 3.46Å; L181-S184 VanDerWaalsContact O-OG 3.1Å; K182-S184 VanDerWaalsContact C-N 3.29Å; K182-S184 PolarHBondContact O-N 3.07Å; S184-M186 VanDerWaalsContact C-N 3.32Å; S184-M186 PolarHBondContact O-N 2.96Å; S184-R187 PolarHBondContact O-N 2.99Å
185	S	44.5	Very low	44.9	Very low	81 Å²	81	102.4 Å²	102.4	57%	0.566	60%	0.603	S	S	*	*	H	α-helix	trans	-62.3	-37.8	179	-175.3	0	0	0	0	112.5	L181 K182 R187 A188	L181-S185 VanDerWaalsContact O-CB 3.3Å; L181-S185 WeakPolarHBondContact O-CB 3.3Å; L181-S185 PolarHBondContact O-N 3.17Å; L181-S185 VanDerWaalsContact O-N 3.13Å; K182-S185 PolarHBondContact O-N 2.88Å; K182-S185 VanDerWaalsContact O-N 3.13Å; S185-R187 PolarHBondContact O-N 2.89Å; S185-A188 PolarHBondContact O-N 2.83Å
186	M	41.3	Very low	43	Very low	156 Å²	156	106.4 Å²	106.4	77%	0.768	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	-13.2	179.3	-69.3	-66.3	170.9	0	0	113.5	K182 S184	K182-M186 WeakPolarHBondContact O-CG 3.22Å; K182-M186 PolarHBondContact O-N 3.3Å; S184-M186 VanDerWaalsContact C-N 3.32Å; S184-M186 PolarHBondContact O-N 2.96Å
187	R	44.8	Very low	41.2	Very low	213 Å²	213	104.9 Å²	104.9	80%	0.804	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	-13.1	176.7	-162.2	175.7	-67.6	-140.7	-0.6	113.4	S184 S185	S184-R187 PolarHBondContact O-N 2.99Å; S185-R187 PolarHBondContact O-N 2.89Å
188	A	39.7	Very low	39.7	Very low	90 Å²	90	112.3 Å²	112.3	74%	0.744	68%	0.677	S	S	*	*	S	Bend	trans	-85.4	-9.8	-179.4	0	0	0	0	0	114.2	S185 S190	S185-A188 PolarHBondContact O-N 2.83Å; A188-S190 PolarHBondContact O-N 3.25Å
189	G	36.8	Very low	38.3	Very low	71 Å²	71	115.1 Å²	115.1	73%	0.732	70%	0.7	S	S	*	*	S	Bend	trans	-89.4	17.8	-176.4	0	0	0	0	0	115.6
190	S	33.1	Very low	36.9	Very low	101 Å²	101	114.5 Å²	114.5	71%	0.706	71%	0.705	S	S	*	*			trans	-139	91.3	-176.3	-57.7	0	0	0	0	110.8	A188	A188-S190 PolarHBondContact O-N 3.25Å
191	S	35.2	Very low	35.6	Very low	127 Å²	127	118.8 Å²	118.8	89%	0.888	72%	0.719	S	S	*	*			trans	-89.6	102.4	-178.4	53.3	0	0	0	0	112
192	S	29.7	Very low	34.5	Very low	102 Å²	102	121.7 Å²	121.7	71%	0.713	73%	0.734	S	S	*	*			trans	-155.5	88.9	164.4	63.1	0	0	0	0	113.1
193	S	32.4	Very low	33.3	Very low	115 Å²	115	126.8 Å²	126.8	80%	0.804	76%	0.76	S	S	*	*			trans	69.3	157.8	144.7	-39.9	0	0	0	0	117.8
194	L	31.5	Very low	32.4	Very low	170 Å²	170	133.8 Å²	133.8	89%	0.89	78%	0.779	S	S	*	*			cis	-128.4	170.4	0.1	-83.1	173.7	0	0	0	111.2
195	S	29.7	Very low	32.1	Very low	116 Å²	116	135.4 Å²	135.4	81%	0.811	79%	0.788	S	S	*	*			trans	-85.1	149.4	-177.1	-46.6	0	0	0	0	115.3
196	S	27.8	Very low	31.2	Very low	123 Å²	123	139.6 Å²	139.6	86%	0.86	80%	0.799	S	S	*	*			trans	-141.6	133.6	130	-79.5	0	0	0	0	105.5
197	G	26.1	Very low	30.5	Very low	78 Å²	78	138.3 Å²	138.3	80%	0.804	80%	0.8	S	S	*	*				75.9	104.7	77.6	0	0	0	0	0	107.7
198	E	26.2	Very low	29.5	Very low	198 Å²	198	132.1 Å²	132.1	93%	0.925	79%	0.794	S	S	*	*			cis	-148.1	173.5	45.3	-151.1	171.9	163.7	0	0	113.6
199	V	27.3	Very low	28.8	Very low	120 Å²	120	134 Å²	134	73%	0.727	80%	0.8	S	S	*	*			trans	-90.3	150.6	171.2	-156.6	0	0	0	0	106
200	T	25.5	Very low	28.2	Very low	110 Å²	110	141.4 Å²	141.4	68%	0.675	81%	0.806	S	S	*	*				-175.9	156.5	59.7	-41.4	0	0	0	0	111.3
201	E	25.4	Very low	27.9	Very low	178 Å²	178	142.6 Å²	142.6	83%	0.832	81%	0.809	S	S	*	*			trans	77.1	163.9	142.8	-106.3	163.7	-165.1	0	0	123.6
202	L	28.5	Very low	27.5	Very low	156 Å²	156	141.8 Å²	141.8	82%	0.817	80%	0.803	S	S	*	*			trans	-102.5	141.4	-172.9	-65.4	69.6	0	0	0	110
203	Q	25.5	Very low	27.3	Very low	203 Å²	203	144.7 Å²	144.7	95%	0.949	81%	0.81	S	S	*	*			trans	-164.7	159.1	131.6	-114.8	172.2	12.3	0	0	114.5
204	R	23.6	Very low	27.2	Very low	236 Å²	236	145.4 Å²	145.4	89%	0.891	81%	0.812	S	S	*	*			trans	-168.7	150.8	176.3	-161.1	-172.1	-175.8	146.2	5.8	108.6
205	P	38.7	Very low	26.8	Very low	100 Å²	100	141.7 Å²	141.7	65%	0.649	81%	0.806	S	S	*	*			cis	-121.1	-179	-49.6	38.7	-25.1	0	0	0	111.1
206	Q	25.5	Very low	26.7	Very low	168 Å²	168	144.1 Å²	144.1	79%	0.785	81%	0.808	S	S	*	*				167.7	145.8	129.8	-92.7	171.3	37.4	0	0	113.7
207	T	26.9	Very low	26.5	Very low	130 Å²	130	144.1 Å²	144.1	80%	0.798	80%	0.803	S	S	*	*			trans	43.7	154.4	149.3	55	0	0	0	0	123.4
208	A	24.9	Very low	26.4	Very low	82 Å²	82	145.1 Å²	145.1	68%	0.678	80%	0.797	S	S	*	*			cis	-177.1	148.1	-26.2	0	0	0	0	0	110.6
209	C	25.1	Very low	26.4	Very low	129 Å²	129	143.3 Å²	143.3	87%	0.872	79%	0.793	S	S	*	*			trans	66	156.5	166.2	-67.4	0	0	0	0	117.2
210	R	24.3	Very low	26.3	Very low	227 Å²	227	145.2 Å²	145.2	86%	0.857	79%	0.794	S	S	*	*			cis	-144.4	141.6	5.2	-117.9	170	176.3	173.7	-2.5	107.6
211	V	27	Very low	26.5	Very low	127 Å²	127	147.2 Å²	147.2	77%	0.77	81%	0.806	S	S	*	*				59	123.6	94.8	179	0	0	0	0	113.1
212	S	25.1	Very low	26.5	Very low	109 Å²	109	145.1 Å²	145.1	76%	0.762	80%	0.801	S	S	*	*			cis	-147.9	176.1	37.3	-52.5	0	0	0	0	115.8
213	L	25.8	Very low	26.4	Very low	164 Å²	164	143.8 Å²	143.8	86%	0.859	80%	0.795	S	S	*	*			trans	-105.9	164.4	156.7	-68.8	168.9	0	0	0	110.1
214	P	29.9	Very low	26.7	Very low	129 Å²	129	144 Å²	144	84%	0.838	79%	0.792	S	S	*	*				-141.4	-177.9	89.7	37.9	-21.9	0	0	0	114.4
215	A	23.8	Very low	26.9	Very low	93 Å²	93	136 Å²	136	77%	0.769	78%	0.783	S	S	*	*			trans	-122	166.4	-178.3	0	0	0	0	0	112.1
216	I	27.2	Very low	26.4	Very low	166 Å²	166	139.8 Å²	139.8	85%	0.851	80%	0.796	S	S	*	*			trans	-167.6	133.2	151.4	-107.2	155.2	0	0	0	113.9
217	V	23.7	Very low	26.5	Very low	124 Å²	124	134.9 Å²	134.9	75%	0.752	79%	0.79	S	S	*	*			trans	49.1	107.6	147.4	-175.2	0	0	0	0	122.9
218	S	25.6	Very low	26.8	Very low	99 Å²	99	137.1 Å²	137.1	69%	0.692	79%	0.789	S	S	*	*			trans	-9.5	143.4	135.1	163.7	0	0	0	0	121.1
219	L	25.4	Very low	27	Very low	160 Å²	160	139.4 Å²	139.4	84%	0.838	79%	0.79	S	S	*	*				-149.4	174.7	129.5	-138.3	85.2	0	0	0	113
220	Q	25.6	Very low	27.2	Very low	159 Å²	159	137.2 Å²	137.2	74%	0.743	79%	0.789	S	S	*	*			trans	-98.8	165.2	-171.6	-53.9	151.1	-72.3	0	0	112.7
221	T	28.3	Very low	27.3	Very low	152 Å²	152	129.8 Å²	129.8	93%	0.933	78%	0.783	S	S	*	*			trans	-153.5	165.2	145.9	22.2	0	0	0	0	111.7
222	D	25.8	Very low	27.2	Very low	134 Å²	134	131.4 Å²	131.4	72%	0.717	79%	0.788	S	S	*	*			trans	-113.6	152.6	-160.3	-104.2	-70.7	0	0	0	116
223	N	27.8	Very low	27.2	Very low	129 Å²	129	132.6 Å²	132.6	69%	0.69	79%	0.79	S	S	*	*			trans	20.6	137.7	141.8	-79	-76.8	0	0	0	124.1
224	K	31.4	Very low	27.1	Very low	207 Å²	207	132.1 Å²	132.1	90%	0.9	79%	0.787	S	S	*	*			trans	87.2	129.7	136.8	-79.7	176.5	175.7	178.7	0	123.1
225	G	26.5	Very low	28.2	Very low	68 Å²	68	130.9 Å²	130.9	70%	0.701	78%	0.78	S	S	*	*			trans	130.7	151	147.2	0	0	0	0	0	114.6
226	I	29.1	Very low	28.2	Very low	180 Å²	180	132.2 Å²	132.2	92%	0.923	78%	0.783	S	S	*	*			cis	-159.2	155.4	-6.2	-107.3	157.2	0	0	0	109.2
227	G	28	Very low	28.3	Very low	64 Å²	64	127.4 Å²	127.4	66%	0.66	78%	0.775	S	S	*	*			trans	127	116.3	169.5	0	0	0	0	0	112.5
228	K	33.5	Very low	28.6	Very low	178 Å²	178	128.3 Å²	128.3	77%	0.774	78%	0.775	S	S	*	*			cis	69.7	134.2	43.2	-64	-174.5	147.6	-83.5	0	114.1
229	D	29.2	Very low	29.1	Very low	129 Å²	129	129.6 Å²	129.6	69%	0.69	77%	0.77	S	S	*	*			cis	-162.5	155.6	-10.5	-101.7	-25.4	0	0	0	110.7
230	G	28.2	Very low	29.4	Very low	83 Å²	83	131.7 Å²	131.7	86%	0.856	77%	0.767	S	S	*	*			trans	77.9	160.8	164.3	0	0	0	0	0	117.8
231	G	25.9	Very low	29.6	Very low	71 Å²	71	128 Å²	128	73%	0.732	76%	0.759	S	S	*	*			cis	162.1	128.7	-12.6	0	0	0	0	0	115.6
232	N	26	Very low	29.8	Very low	161 Å²	161	129.8 Å²	129.8	86%	0.861	75%	0.754	S	S	*	*			trans	78.9	124.7	152.1	-67.8	-12.4	0	0	0	123.7
233	V	24.5	Very low	29.9	Very low	135 Å²	135	131.2 Å²	131.2	82%	0.818	75%	0.754	S	S	*	*				100.3	136.1	126.8	165	0	0	0	0	122.7
234	L	24.6	Very low	29.9	Very low	153 Å²	153	130.9 Å²	130.9	80%	0.801	75%	0.752	S	S	*	*			trans	-49	-176.4	164.5	-101	67.9	0	0	0	116.7
235	P	52.3	Low	29.7	Very low	104 Å²	104	128.6 Å²	128.6	68%	0.675	74%	0.744	S	S	*	*			cis	-138.3	-156.6	-20.3	34.6	-12.5	0	0	0	113.4
236	S	24.4	Very low	30.3	Very low	120 Å²	120	130.7 Å²	130.7	84%	0.839	75%	0.746	S	S	*	*			trans	92.7	135.2	160.9	-52.7	0	0	0	0	116.6
237	G	27.7	Very low	30.2	Very low	66 Å²	66	126 Å²	126	68%	0.68	73%	0.734	S	S	*	*			cis	179.9	172.4	-7.6	0	0	0	0	0	113.1
238	D	30.9	Very low	30.2	Very low	142 Å²	142	131.8 Å²	131.8	76%	0.759	74%	0.744	S	S	*	*			trans	48	156.5	143.6	-74.5	17.5	0	0	0	123
239	Q	36.7	Very low	30.7	Very low	126 Å²	126	127.9 Å²	127.9	59%	0.589	74%	0.737	S	S	*	*			cis	-169.3	174	-22.2	-104.7	-171.9	110.3	0	0	104.3
240	R	31.2	Very low	30.7	Very low	204 Å²	204	127.3 Å²	127.3	77%	0.77	73%	0.734	S	S	*	*			cis	-168.2	174	6.8	-118.2	-177.4	-160	169.4	14.7	105.9
241	S	30.6	Very low	30.8	Very low	82 Å²	82	130.2 Å²	130.2	57%	0.573	73%	0.725	S	S	*	*			cis	-171.8	144.6	-20	-145.9	0	0	0	0	109.5
242	K	31.4	Very low	30.9	Very low	189 Å²	189	134.4 Å²	134.4	82%	0.822	73%	0.725	S	S	*	*			trans	67.7	158.3	163.3	-53.1	168.7	-174.7	-178.2	0	115
243	K	27.2	Very low	31	Very low	164 Å²	164	134.4 Å²	134.4	71%	0.713	72%	0.724	S	S	*	*			cis	-149.8	-176.4	-5.7	-129.7	169.5	161.8	-77.1	0	105.5
244	D	27.9	Very low	31.1	Very low	123 Å²	123	133.1 Å²	133.1	66%	0.658	72%	0.72	S	S	*	*			cis	-157.2	-175.5	10.8	-138.2	-28.8	0	0	0	111.7
245	E	27.5	Very low	31.7	Very low	158 Å²	158	134 Å²	134	74%	0.738	73%	0.725	S	S	*	*			trans	-92.6	173.4	163.6	-119.9	-143.9	109.9	0	0	111.1	A247	E245-A247 PolarHBondContact OE1-N 3.01Å
246	P	39.3	Very low	31.1	Very low	112 Å²	112	134.3 Å²	134.3	73%	0.727	73%	0.727	S	S	*	*			cis	-149.1	-179.4	31.8	45.6	-25.2	0	0	0	119.8
247	A	26.8	Very low	31.9	Very low	83 Å²	83	134.4 Å²	134.4	69%	0.686	73%	0.725	S	S	*	*			trans	77.3	156	139	0	0	0	0	0	123.6	E245	E245-A247 PolarHBondContact OE1-N 3.01Å
248	Q	28.1	Very low	32.4	Very low	185 Å²	185	142.4 Å²	142.4	86%	0.864	74%	0.735	S	S	*	*			trans	-97.6	-163.7	176.2	-52.3	-172.4	-84.2	0	0	110
249	P	45.3	Very low	32.4	Very low	96 Å²	96	144 Å²	144	62%	0.623	74%	0.737	S	S	*	*			cis	-145.5	-175.6	1.7	44	-23.3	0	0	0	118.5
250	D	28.1	Very low	32.3	Very low	116 Å²	116	144.7 Å²	144.7	62%	0.62	75%	0.745	S	S	*	*			trans	65.7	154.7	143.6	-77.7	-43.3	0	0	0	121.6
251	H	31.1	Very low	32.3	Very low	144 Å²	144	144.2 Å²	144.2	67%	0.667	75%	0.751	S	S	*	*			cis	-130.4	153.2	-4.9	-92.4	-32.9	0	0	0	108.4
252	Q	28.2	Very low	32.2	Very low	159 Å²	159	146.4 Å²	146.4	74%	0.743	76%	0.761	S	S	*	*				42.8	139.3	88.9	-48.5	-167.6	41.2	0	0	114.6
253	I	28	Very low	32.2	Very low	162 Å²	162	145.3 Å²	145.3	83%	0.831	76%	0.763	S	S	*	*				-145.3	150	51	-75.3	162.2	0	0	0	112.7
254	S	26.1	Very low	32.3	Very low	107 Å²	107	148.8 Å²	148.8	75%	0.748	77%	0.772	S	S	*	*			trans	-95.9	152.8	176.9	-58.9	0	0	0	0	114
255	L	37.6	Very low	32.4	Very low	172 Å²	172	149.9 Å²	149.9	90%	0.901	78%	0.777	S	S	*	*			trans	-66.9	136.1	158.4	-72.6	161.8	0	0	0	110.6
256	P	38.1	Very low	32.6	Very low	110 Å²	110	150.6 Å²	150.6	71%	0.714	79%	0.785	S	S	*	*				-147.6	-160.4	124.5	36.1	-15.9	0	0	0	111.8
257	P	42.2	Very low	32.5	Very low	123 Å²	123	152 Å²	152	80%	0.799	79%	0.787	S	S	*	*				-125.5	-167.8	-72.3	40.2	-26	0	0	0	113.1
258	R	38.3	Very low	33.6	Very low	233 Å²	233	153.5 Å²	153.5	88%	0.879	79%	0.789	S	S	*	*			trans	-63.4	154.5	172.9	-64.3	176	172.6	-178.6	-3.8	113.1
259	H	31.5	Very low	33.7	Very low	176 Å²	176	153.3 Å²	153.3	82%	0.815	79%	0.788	S	S	*	*			trans	-136.9	146.2	151.2	-145.4	-77.3	0	0	0	111.4
260	N	33.8	Very low	32.9	Very low	140 Å²	140	154.9 Å²	154.9	75%	0.749	80%	0.796	S	S	*	*			trans	-90.1	155.2	169.5	-62.8	-28.8	0	0	0	109.8
261	Q	31.5	Very low	32.9	Very low	194 Å²	194	160 Å²	160	91%	0.907	81%	0.807	S	S	*	*			trans	-152.1	157	156.1	-117.2	174.3	35	0	0	112.6
262	T	28	Very low	32.9	Very low	128 Å²	128	162 Å²	162	79%	0.785	81%	0.814	S	S	*	*			trans	-115.2	142.1	-167.2	-53	0	0	0	0	110.6
263	I	32	Very low	33	Very low	166 Å²	166	160.6 Å²	160.6	85%	0.851	81%	0.811	S	S	*	*			trans	-123.5	153	165	-62.8	-174.8	0	0	0	109.1
264	R	29.3	Very low	32.9	Very low	238 Å²	238	161.4 Å²	161.4	90%	0.898	81%	0.809	S	S	*	*			trans	-94.1	164.7	-160.2	-62.2	175	175.9	170.4	-3.2	114.3
265	N	30.7	Very low	33.1	Very low	146 Å²	146	162.6 Å²	162.6	78%	0.781	81%	0.807	S	S	*	*			trans	-72.9	159.7	173.1	-54.7	-24.7	0	0	0	112.8
266	L	31.4	Very low	32.6	Very low	172 Å²	172	163.6 Å²	163.6	90%	0.901	80%	0.799	S	S	*	*			trans	-164	78.7	152.5	-110.8	167	0	0	0	111.9
267	D	35.9	Very low	32.2	Very low	143 Å²	143	167.2 Å²	167.2	77%	0.765	81%	0.807	S	S	*	*			trans	47.9	160	137.8	-75.1	30.4	0	0	0	124.7
268	P	50.8	Low	31.6	Very low	113 Å²	113	167.1 Å²	167.1	73%	0.734	80%	0.795	S	S	*	*			trans	-134.7	159.9	-143.2	42.6	-26.3	0	0	0	119
269	E	29.5	Very low	31.1	Very low	181 Å²	181	162.3 Å²	162.3	85%	0.846	80%	0.796	S	S	*	*			trans	-142.3	164	147.5	-68.4	-155.4	151.8	0	0	108.8
270	T	29.2	Very low	31	Very low	129 Å²	129	164.8 Å²	164.8	79%	0.791	80%	0.798	S	S	*	*			cis	-137.2	169.7	7	-30.1	0	0	0	0	111.2
271	R	27.8	Very low	30.8	Very low	224 Å²	224	163.2 Å²	163.2	85%	0.845	80%	0.798	S	S	*	*			trans	-93.5	166.2	-171.1	-159.1	177.3	-170.5	174.2	2.2	112.8
272	K	30.6	Very low	30.8	Very low	185 Å²	185	165.3 Å²	165.3	80%	0.804	80%	0.798	S	S	*	*			trans	90.5	140.9	173.4	-55.2	166.6	-173.9	174.4	0	113.9
273	N	30.2	Very low	31.7	Very low	130 Å²	130	163.9 Å²	163.9	70%	0.695	79%	0.791	S	S	*	*			cis	-152.1	171.8	0.9	-114.8	2.1	0	0	0	112.8
274	F	26.3	Very low	31.5	Very low	179 Å²	179	166.2 Å²	166.2	79%	0.785	79%	0.79	S	S	*	*			trans	-17.8	153.1	159.3	-63.9	-103.5	0	0	0	117.6
275	N	30.9	Very low	31.6	Very low	133 Å²	133	159.8 Å²	159.8	71%	0.711	78%	0.782	S	S	*	*			cis	-146.8	160	26.8	-150	1.7	0	0	0	115.7
276	R	27.6	Very low	31.4	Very low	192 Å²	192	159.9 Å²	159.9	73%	0.725	79%	0.788	S	S	*	*			trans	-93.3	128.3	167.5	163.6	-171.9	170.6	-170.8	-1.7	108	E278	R276-E278 IonicContact CZ-OE2 3.89Å; R276-E278 IonicContact NE-OE2 3.88Å; R276-E278 PolarHBondContact NE-OE2 2.76Å; R276-E278 IonicContact NH2-OE2 3.65Å; R276-E278 PolarHBondContact NH2-OE2 3.1Å
277	E	29	Very low	31.3	Very low	187 Å²	187	156.9 Å²	156.9	87%	0.874	78%	0.781	S	S	*	*			trans	-138.1	145.6	161.7	-142.7	162.1	-121.2	0	0	111.3
278	E	30	Very low	31.6	Very low	120 Å²	120	155.3 Å²	155.3	56%	0.561	78%	0.779	S	S	*	*			trans	-132.8	111.1	-155	179.5	-176.8	137.5	0	0	108.7	R276	R276-E278 IonicContact CZ-OE2 3.89Å; R276-E278 IonicContact NE-OE2 3.88Å; R276-E278 PolarHBondContact NE-OE2 2.76Å; R276-E278 IonicContact NH2-OE2 3.65Å; R276-E278 PolarHBondContact NH2-OE2 3.1Å
279	C	27.2	Very low	30.5	Very low	132 Å²	132	161.5 Å²	161.5	89%	0.892	79%	0.787	S	S	*	*			trans	-114.9	125.4	179.2	-89.9	0	0	0	0	112.3
280	R	28.3	Very low	30.6	Very low	228 Å²	228	158.6 Å²	158.6	86%	0.86	78%	0.782	S	S	*	*			trans	-79.7	161.8	-171.3	-67.5	174	171	179.3	-3.8	112.8
281	S	29.7	Very low	30.7	Very low	107 Å²	107	159.3 Å²	159.3	75%	0.748	78%	0.78	S	S	*	*			trans	-84.8	173	170.2	-40.4	0	0	0	0	112.6
282	R	31.8	Very low	30.8	Very low	238 Å²	238	155.4 Å²	155.4	90%	0.898	78%	0.775	S	S	*	*			trans	96.3	159.6	162.3	-59.7	-168.1	172.4	-151	0.4	115.9
283	P	47.5	Very low	30.8	Very low	98 Å²	98	155.9 Å²	155.9	64%	0.636	78%	0.778	S	S	*	*				-144.7	-164.4	-89.2	32.1	-5.5	0	0	0	116
284	Y	28.8	Very low	30.8	Very low	215 Å²	215	156.7 Å²	156.7	84%	0.843	78%	0.777	S	S	*	*			trans	89.7	116.2	158.6	-69.5	-64.7	0	0	0	121.5
285	S	29.6	Very low	31.1	Very low	104 Å²	104	154.7 Å²	154.7	73%	0.727	78%	0.78	S	S	*	*				49.3	110.5	124.8	-175.7	0	0	0	0	121.3
286	T	28.3	Very low	31.2	Very low	148 Å²	148	156.2 Å²	156.2	91%	0.908	78%	0.78	S	S	*	*				-159.6	166.1	123.3	0.1	0	0	0	0	112.4
287	S	28.3	Very low	31.4	Very low	108 Å²	108	154.9 Å²	154.9	76%	0.755	78%	0.782	S	S	*	*			trans	-163.6	158.3	177.7	178.4	0	0	0	0	108.5
288	P	41.3	Very low	31.5	Very low	110 Å²	110	152.2 Å²	152.2	71%	0.714	78%	0.779	S	S	*	*			cis	-111.7	-176.3	-33.5	36.9	-25.1	0	0	0	110.5
289	R	29.5	Very low	31.6	Very low	243 Å²	243	154.6 Å²	154.6	92%	0.917	79%	0.792	S	S	*	*			trans	-126.8	133.6	156.4	-80	-167	173.9	-163.6	-1.8	111
290	V	30.2	Very low	31.8	Very low	120 Å²	120	153.2 Å²	153.2	73%	0.727	78%	0.784	S	S	*	*			trans	-71.7	141.5	167.4	178.2	0	0	0	0	108.2
291	I	32.3	Very low	31.9	Very low	145 Å²	145	150.9 Å²	150.9	74%	0.744	79%	0.787	S	S	*	*			trans	-133.4	110.1	162.6	-60.9	179.8	0	0	0	105.9	F293	I291-F293 HydrophobicContact CG2-CD2 4.31Å
292	D	30	Very low	32.1	Very low	142 Å²	142	153.7 Å²	153.7	76%	0.759	79%	0.792	S	S	*	*			trans	-67.1	147.8	170	-59.6	-74.5	0	0	0	110.2
293	F	29.2	Very low	32	Very low	194 Å²	194	150.8 Å²	150.8	85%	0.851	79%	0.786	S	S	*	*			trans	-129.4	118.8	169.9	-119.3	-88.3	0	0	0	109.8	I291	I291-F293 HydrophobicContact CG2-CD2 4.31Å
294	E	29.9	Very low	31.2	Very low	147 Å²	147	154.3 Å²	154.3	69%	0.687	80%	0.799	S	S	*	*			trans	-63.9	141.5	-176	-59.6	-179.7	121.6	0	0	112.2	K296	E294-K296 PolarHBondContact O-N 3.07Å; E294-K296 VanDerWaalsContact O-N 3.12Å; E294-K296 WeakPolarHBondContact OE2-CE 3.48Å; E294-K296 IonicContact OE2-NZ 2.67Å; E294-K296 PolarHBondContact OE2-NZ 2.96Å
295	V	33.3	Very low	31.2	Very low	138 Å²	138	152.1 Å²	152.1	84%	0.836	80%	0.796	S	S	*	*			trans	-76.4	97.4	167.9	179.4	0	0	0	0	109
296	K	32.4	Very low	31.1	Very low	164 Å²	164	151.7 Å²	151.7	71%	0.713	79%	0.793	S	S	*	*			trans	-93	97	167.1	-81.9	172.5	171.6	145	0	110	E294 T298	E294-K296 PolarHBondContact O-N 3.07Å; E294-K296 VanDerWaalsContact O-N 3.12Å; E294-K296 WeakPolarHBondContact OE2-CE 3.48Å; E294-K296 IonicContact OE2-NZ 2.67Å; E294-K296 PolarHBondContact OE2-NZ 2.96Å; K296-T298 PolarHBondContact O-N 2.7Å
297	Q	32.6	Very low	31.2	Very low	165 Å²	165	154 Å²	154	77%	0.771	79%	0.791	S	S	*	*			trans	-82.4	106.9	-177.5	-174.9	179.1	31.4	0	0	110.4
298	T	31	Very low	31.7	Very low	131 Å²	131	154.2 Å²	154.2	80%	0.804	79%	0.789	S	S	*	*			trans	-114.1	108.2	172.9	51.1	0	0	0	0	110.5	K296	K296-T298 PolarHBondContact O-N 2.7Å
299	M	31.5	Very low	31.2	Very low	170 Å²	170	154.9 Å²	154.9	84%	0.837	80%	0.796	S	S	*	*			trans	-78	129.2	172.5	-68.4	-102.9	63.6	0	0	110.2
300	S	31.2	Very low	31.2	Very low	103 Å²	103	148.2 Å²	148.2	72%	0.72	79%	0.787	S	S	*	*			trans	-128.5	110.8	167.3	59.4	0	0	0	0	109.8
301	L	31.6	Very low	31.2	Very low	179 Å²	179	150.9 Å²	150.9	94%	0.937	79%	0.792	S	S	*	*			trans	-77.5	123	174.2	-73.9	160.2	0	0	0	109.8
302	I	33.9	Very low	30.9	Very low	166 Å²	166	151.9 Å²	151.9	85%	0.851	80%	0.798	S	S	*	*			trans	-126.3	133.2	162.6	-62.2	-174.7	0	0	0	109.2
303	K	30.3	Very low	30.8	Very low	176 Å²	176	150.9 Å²	150.9	77%	0.765	80%	0.802	S	S	*	*			trans	-57.8	142.4	-166	-72.3	167.1	171.6	174.4	0	114.4
304	L	29.3	Very low	30.8	Very low	172 Å²	172	146.1 Å²	146.1	90%	0.901	79%	0.793	S	S	*	*			trans	-61.9	136.5	153	-67.5	165.2	0	0	0	109.7
305	H	29.6	Very low	30.7	Very low	169 Å²	169	147 Å²	147	78%	0.782	80%	0.802	S	S	*	*			trans	-130.5	109.5	156	-92.6	-88.6	0	0	0	108.6
306	S	28.2	Very low	30.6	Very low	95 Å²	95	145.4 Å²	145.4	66%	0.664	80%	0.797	S	S	*	*			trans	-78.8	143.7	168.2	51.6	0	0	0	0	110.6
307	F	30.5	Very low	30.4	Very low	198 Å²	198	144.7 Å²	144.7	87%	0.868	80%	0.8	S	S	*	*			trans	-167.2	166.4	144.1	-97.6	-47	0	0	0	110
308	P	38.7	Very low	30.2	Very low	111 Å²	111	146.6 Å²	146.6	72%	0.721	81%	0.806	S	S	*	*				-120.2	178.5	-119.4	43.5	-34	0	0	0	115.8
309	S	29	Very low	30.1	Very low	124 Å²	124	150 Å²	150	87%	0.867	80%	0.804	S	S	*	*			trans	-80.9	134	169.7	-52.2	0	0	0	0	112.8
310	S	30.6	Very low	29.9	Very low	104 Å²	104	150.3 Å²	150.3	73%	0.727	81%	0.808	S	S	*	*			trans	-147.6	105.6	159	55.4	0	0	0	0	107.5
311	Q	29.3	Very low	29.8	Very low	176 Å²	176	150.5 Å²	150.5	82%	0.822	80%	0.801	S	S	*	*				74.2	130.2	91.5	-77.9	-69.3	11.3	0	0	113.8
312	L	27.6	Very low	30.6	Very low	165 Å²	165	147.1 Å²	147.1	86%	0.864	79%	0.79	S	S	*	*			trans	-82	154.5	179.9	-64.9	85.6	0	0	0	110.7
313	S	27.1	Very low	30.3	Very low	121 Å²	121	146.9 Å²	146.9	85%	0.846	79%	0.785	S	S	*	*			trans	-140.6	151.2	153.6	-166.7	0	0	0	0	110.2
314	S	28.3	Very low	30.1	Very low	95 Å²	95	146.4 Å²	146.4	66%	0.664	79%	0.785	S	S	*	*			trans	-85.5	161.1	-175.2	51.6	0	0	0	0	112.5
315	N	29.3	Very low	30.2	Very low	165 Å²	165	144 Å²	144	88%	0.882	78%	0.778	S	S	*	*			trans	-154.1	130.4	133.6	-105.2	-31.7	0	0	0	112.1
316	S	30.3	Very low	30.4	Very low	105 Å²	105	142.1 Å²	142.1	73%	0.734	78%	0.78	S	S	*	*			trans	-81.8	-178	163.9	-45.3	0	0	0	0	108.6
317	L	29.3	Very low	30.5	Very low	148 Å²	148	146 Å²	146	78%	0.775	79%	0.788	S	S	*	*			cis	-161.2	153.8	2.8	-166.9	79.1	0	0	0	106.7
318	K	27.5	Very low	30.4	Very low	205 Å²	205	145.4 Å²	145.4	89%	0.891	79%	0.788	S	S	*	*			trans	-177	131.2	132.2	-101.6	156.7	-173.5	-179.9	0	111.5
319	R	28.6	Very low	29.9	Very low	204 Å²	204	149.7 Å²	149.7	77%	0.77	79%	0.79	S	S	*	*			trans	-94.5	166.7	165	-61.7	-171.7	-172.8	-179.1	3.1	109.9	D321	R319-D321 WeakPolarHBondContact CD-OD2 3.29Å; R319-D321 IonicContact NH1-OD2 3.54Å; R319-D321 PolarHBondContact NH1-OD2 3.45Å
320	L	28.7	Very low	29.9	Very low	175 Å²	175	150.4 Å²	150.4	92%	0.916	78%	0.779	S	S	*	*				-149.7	148.5	129.4	-102.6	166.1	0	0	0	108.9
321	D	29.2	Very low	29.8	Very low	108 Å²	108	150.9 Å²	150.9	58%	0.578	78%	0.782	S	S	*	*			trans	-132.6	179.8	-172.3	-72.6	-61	0	0	0	107.3	R319	R319-D321 WeakPolarHBondContact CD-OD2 3.29Å; R319-D321 IonicContact NH1-OD2 3.54Å; R319-D321 PolarHBondContact NH1-OD2 3.45Å
322	P	48.3	Very low	29.9	Very low	108 Å²	108	150.8 Å²	150.8	70%	0.701	78%	0.779	S	S	*	*			cis	-131.7	-141.5	-44.8	36	-15.8	0	0	0	111.7
323	H	27.4	Very low	29.9	Very low	161 Å²	161	152 Å²	152	75%	0.745	78%	0.778	S	S	*	*			trans	79.5	144.4	-177.7	-70.8	-106.4	0	0	0	115.9
324	E	26.3	Very low	30	Very low	165 Å²	165	152 Å²	152	77%	0.771	77%	0.769	S	S	*	*			cis	-144.6	173.3	7.1	-156.2	148.3	-116.4	0	0	113.4
325	V	30.5	Very low	30.1	Very low	123 Å²	123	156.5 Å²	156.5	75%	0.745	78%	0.779	S	S	*	*			trans	-133.4	139.2	-178.5	173.2	0	0	0	0	111.2
326	P	34.7	Very low	30.2	Very low	128 Å²	128	153.3 Å²	153.3	83%	0.831	77%	0.769	S	S	*	*			trans	-110.9	146.4	151.4	-4.2	25.2	0	0	0	113.3
327	Q	30	Very low	30.2	Very low	178 Å²	178	156.6 Å²	156.6	83%	0.832	78%	0.778	S	S	*	*			trans	-99.6	158.5	176.2	-55.3	168.1	-50.4	0	0	112
328	Q	27.1	Very low	30.4	Very low	184 Å²	184	157.7 Å²	157.7	86%	0.86	78%	0.779	S	S	*	*			trans	-162.8	114.3	134.6	-102.8	166.9	28.3	0	0	107.1
329	R	29.4	Very low	30.4	Very low	202 Å²	202	156.6 Å²	156.6	76%	0.762	78%	0.779	S	S	*	*				87.4	106.5	75.6	-88.9	-162.7	152.4	144.5	7.4	114.3
330	E	27.5	Very low	30.5	Very low	139 Å²	139	156.1 Å²	156.1	65%	0.65	78%	0.783	S	S	*	*				73.9	152.5	129.3	-64	175.3	-132.9	0	0	117.3
331	S	30.3	Very low	30.4	Very low	113 Å²	113	152.6 Å²	152.6	79%	0.79	78%	0.779	S	S	*	*			cis	-142.9	176.6	26.9	63.7	0	0	0	0	115.7
332	K	30.9	Very low	30.4	Very low	174 Å²	174	154 Å²	154	76%	0.757	79%	0.791	S	S	*	*			trans	-86.9	156.9	-167.9	-51.1	132.7	179.2	167.6	0	112.5
333	F	26.2	Very low	29.6	Very low	192 Å²	192	152 Å²	152	84%	0.842	79%	0.791	S	S	*	*				-159.2	172.8	116.3	-131	-112.3	0	0	0	114.6
334	N	31.1	Very low	29.8	Very low	121 Å²	121	152.7 Å²	152.7	65%	0.647	80%	0.799	S	S	*	*			trans	-67.8	173	-168.3	-65.5	-69.2	0	0	0	114.2
335	Q	30.3	Very low	30.2	Very low	189 Å²	189	151.6 Å²	151.6	88%	0.883	80%	0.803	S	S	*	*			cis	-161.2	166	38.2	-159.7	165.8	19.8	0	0	115.9
336	S	29.6	Very low	30.2	Very low	97 Å²	97	155 Å²	155	68%	0.678	81%	0.812	S	S	*	*			trans	-64.2	146.3	-174.9	177.9	0	0	0	0	116.3
337	L	32.2	Very low	30	Very low	175 Å²	175	157.5 Å²	157.5	92%	0.916	81%	0.812	S	S	*	*			trans	-145.8	132.4	141.1	-110.9	167.7	0	0	0	109.9
338	Q	31.6	Very low	30.2	Very low	170 Å²	170	157 Å²	157	79%	0.794	81%	0.814	S	S	*	*			trans	-97.9	145.2	179.8	-67.5	178.1	-23.9	0	0	111.5
339	M	29.5	Very low	30.4	Very low	182 Å²	182	155.3 Å²	155.3	90%	0.897	81%	0.811	S	S	*	*			trans	-137.7	162.4	145.2	-78	-138	77.5	0	0	110.6
340	K	28.8	Very low	30.9	Very low	194 Å²	194	151.3 Å²	151.3	84%	0.843	81%	0.811	S	S	*	*			trans	-85.7	132	-158.9	-62.2	170.9	179	175.8	0	113
341	A	28.3	Very low	31.1	Very low	102 Å²	102	152.4 Å²	152.4	84%	0.843	82%	0.82	S	S	*	*			trans	-87.1	134.3	153	0	0	0	0	0	109.2
342	V	29	Very low	31.8	Very low	136 Å²	136	152.6 Å²	152.6	82%	0.824	82%	0.819	S	S	*	*			trans	-98.8	111.7	169	176.7	0	0	0	0	107.4
343	G	31.6	Very low	31.9	Very low	67 Å²	67	150.5 Å²	150.5	69%	0.691	82%	0.823	S	S	*	*			trans	-87.5	145.4	171.9	0	0	0	0	0	111.4
344	L	31.3	Very low	32.2	Very low	176 Å²	176	146.1 Å²	146.1	92%	0.921	82%	0.822	S	S	*	*			trans	-126.1	118.6	157.1	-76.1	175.9	0	0	0	108
345	T	34	Very low	32.5	Very low	141 Å²	141	146.7 Å²	146.7	87%	0.865	83%	0.829	S	S	*	*			trans	-102.9	132	171.9	46.9	0	0	0	0	108.7
346	E	31	Very low	32.8	Very low	196 Å²	196	143.3 Å²	143.3	92%	0.916	82%	0.824	S	S	*	*			trans	-143.6	130.6	164	-157.9	158.8	-141.6	0	0	108.3
347	E	31.1	Very low	32.8	Very low	179 Å²	179	145 Å²	145	84%	0.836	83%	0.83	S	S	*	*			trans	-85.5	152.5	-171.5	-68.5	-167.1	132.1	0	0	112.7
348	L	33.1	Very low	33.1	Very low	169 Å²	169	142.2 Å²	142.2	89%	0.885	83%	0.825	S	S	*	*			trans	-104.5	126.1	171.8	-73.2	168.5	0	0	0	110.5
349	N	31.1	Very low	33.1	Very low	148 Å²	148	139.9 Å²	139.9	79%	0.791	83%	0.828	S	S	*	*			trans	-136.8	125	161.7	-91.2	-60.4	0	0	0	109.7
350	P	41.3	Very low	33.1	Very low	118 Å²	118	135.3 Å²	135.3	77%	0.766	82%	0.819	S	S	*	*			trans	-100.8	143	-171.4	36.5	-33.6	0	0	0	114.3
351	I	31.8	Very low	33.4	Very low	161 Å²	161	132.4 Å²	132.4	83%	0.826	81%	0.812	S	S	*	*			trans	-137.3	130.1	161.4	-57.7	-178.7	0	0	0	108.6
352	P	43.5	Very low	33.5	Very low	118 Å²	118	135.8 Å²	135.8	77%	0.766	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-95.7	144.7	-176.9	35.7	-33.7	0	0	0	113.9
353	P	33.9	Very low	33.9	Very low	130 Å²	130	137.5 Å²	137.5	84%	0.844	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-91.6	158.2	164.9	35.4	-32.1	0	0	0	112.5
354	A	31.8	Very low	33.9	Very low	99 Å²	99	143.7 Å²	143.7	82%	0.818	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-102	171.9	-170	0	0	0	0	0	115.1
355	V	38.7	Very low	34.4	Very low	133 Å²	133	140.8 Å²	140.8	81%	0.806	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-78	135.6	178	-178.4	0	0	0	0	111.6
356	P	35.1	Very low	34.4	Very low	119 Å²	119	142 Å²	142	77%	0.773	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-92.4	131.4	165.2	33.7	-29.9	0	0	0	112.2
357	T	30.8	Very low	35	Very low	133 Å²	133	141.6 Å²	141.6	82%	0.816	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-80.3	154	-179.3	-48	0	0	0	0	112.5
358	S	38.4	Very low	35.7	Very low	115 Å²	115	136 Å²	136	80%	0.804	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-70.5	127.9	170	56.7	0	0	0	0	112.9
359	S	30.4	Very low	36.7	Very low	121 Å²	121	133.7 Å²	133.7	85%	0.846	79%	0.787	S	S	*	*			trans	-136.3	145	157.2	61.8	0	0	0	0	110.3
360	A	31.2	Very low	37.8	Very low	86 Å²	86	135.3 Å²	135.3	71%	0.711	79%	0.79	S	S	*	*			trans	-92.8	157.6	-161	0	0	0	0	0	113.9
361	L	34.7	Very low	38.6	Very low	133 Å²	133	133.2 Å²	133.2	70%	0.696	77%	0.772	S	S	*	*			trans	42.2	110	142	-67.3	165.4	0	0	0	117.9	K363	L361-K363 HydrophobicContact CD2-CD 4.12Å; L361-K363 HydrophobicContact CD2-CG 3.92Å
362	N	29.7	Very low	40.1	Very low	173 Å²	173	126.8 Å²	126.8	93%	0.925	74%	0.741	S	S	*	*				-127.2	109.9	125.3	-120	-29.7	0	0	0	109.5
363	K	37.3	Very low	40.8	Very low	172 Å²	172	127.4 Å²	127.4	75%	0.748	73%	0.733	S	S	*	*			trans	-94.5	120.3	172	-79.6	-179.9	176.7	179.9	0	108.4	L361	L361-K363 HydrophobicContact CD2-CD 4.12Å; L361-K363 HydrophobicContact CD2-CG 3.92Å
364	Q	32	Very low	42.1	Very low	197 Å²	197	126.2 Å²	126.2	92%	0.921	72%	0.719	S	S	*	*			trans	-122.4	152.8	139	-85.1	-169.5	-21.9	0	0	109.5
365	V	41.6	Very low	43.6	Very low	115 Å²	115	123.2 Å²	123.2	70%	0.697	69%	0.692	S	S	*	*			trans	-86.1	133.5	-159.5	175.4	0	0	0	0	110.7	Q367	V365-Q367 HydrophobicContact CG1-CG 3.82Å
366	N	33.4	Very low	44.7	Very low	168 Å²	168	119.6 Å²	119.6	90%	0.898	67%	0.67	S	S	*	*			trans	-126.7	133.5	140.1	-93.5	-45.5	0	0	0	108.4
367	Q	44.9	Very low	45.7	Very low	186 Å²	186	118 Å²	118	87%	0.869	65%	0.652	S	S	*	*			trans	-82.7	144.2	-175.3	-65.2	165.2	-23.8	0	0	110	V365	V365-Q367 HydrophobicContact CG1-CG 3.82Å
368	G	45.4	Very low	47	Very low	62 Å²	62	120.3 Å²	120.3	64%	0.639	65%	0.646	S	S	*	*			trans	120.9	38	164.9	0	0	0	0	0	118.6
369	E	53.5	Low	47.8	Very low	121 Å²	121	118 Å²	118	57%	0.565	63%	0.634	S	S	*	*			trans	-135.1	41.2	171.3	-140.1	173.3	-72.7	0	0	115.4	L371 W671 R672	E369-L371 PolarHBondContact O-N 2.99Å; E369-W671 HydrophobicContact CG-CZ2 3.9Å; E369-W671 WeakPolarHBondContact OE1-CZ2 3.48Å; E369-R672 IonicContact OE1-NH1 2.67Å; E369-R672 IonicContact OE2-CZ 2.99Å; E369-R672 IonicContact OE2-NH1 3.62Å; E369-R672 PolarHBondContact OE2-NH1 3.18Å; E369-R672 IonicContact OE2-NH2 2.63Å
370	E	54.8	Low	49	Very low	181 Å²	181	119.1 Å²	119.1	85%	0.846	63%	0.63	S	S	*	*			trans	-67.2	113.7	168	-67.4	-165.6	167	0	0	111.3	C372 C670	E370-C372 PolarHBondContact O-N 3.49Å; E370-C670 WeakPolarHBondContact O-CB 3.32Å
371	L	57.2	Low	50	Low	74 Å²	74	124.4 Å²	124.4	39%	0.387	63%	0.631	S	S	.	*			trans	-66.4	128.8	168.5	-68	179.1	0	0	0	109.1	E369 C375 T376	E369-L371 PolarHBondContact O-N 2.99Å; L371-C375 HydrophobicContact CB-CB 3.91Å; L371-C375 HydrophobicContact CD1-CB 4.41Å; L371-C375 HydrophobicContact CD2-CB 4.1Å; L371-C375 HydrophobicContact CG-CB 4.37Å; L371-T376 PolarHBondContact O-OG1 3.14Å
372	C	64.6	Low	50.5	Low	26 Å²	26	124.2 Å²	124.2	18%	0.176	63%	0.631	C	S	.	*			trans	-62.8	154.6	173.9	65.4	0	0	0	0	110.5	E370 L374 C375 T376 C670	E370-C372 PolarHBondContact O-N 3.49Å; C372-L374 PolarHBondContact O-N 3.47Å; C372-C375 WeakPolarHBondContact O-CB 3.45Å; C372-C375 PolarHBondContact O-N 3.2Å; C372-T376 PolarHBondContact O-N 2.79Å; C372-T376 PolarHBondContact O-OG1 3.06Å; C372-C670 HydrophobicContact CB-CB 4.21Å
373	H	57.9	Low	51.5	Low	132 Å²	132	122.7 Å²	122.7	61%	0.611	63%	0.627	S	S	*	*	H	α-helix	trans	-42.1	-39.5	-174.4	-179.4	-99.1	0	0	0	114.8	T376 Q377	H373-T376 PolarHBondContact O-N 2.91Å; H373-Q377 VanDerWaalsContact CE1-CD 3.46Å; H373-Q377 PolarHBondContact CE1-NE2 3.07Å; H373-Q377 WeakPolarHBondContact O-CB 3.41Å; H373-Q377 WeakPolarHBondContact O-CG 3.48Å; H373-Q377 PolarHBondContact O-N 3.19Å
374	L	61.2	Low	52.1	Low	104 Å²	104	119.8 Å²	119.8	55%	0.545	63%	0.626	S	S	.	*	H	α-helix	trans	-66.3	-34.8	177.9	-63.2	173.6	0	0	0	114.3	C372 R378	C372-L374 PolarHBondContact O-N 3.47Å; L374-R378 WeakPolarHBondContact O-CD 3.47Å; L374-R378 VanDerWaalsContact O-CG 3.26Å; L374-R378 WeakPolarHBondContact O-CG 3.45Å; L374-R378 PolarHBondContact O-N 3.47Å
375	C	62.9	Low	52.8	Low	36 Å²	36	117.3 Å²	117.3	24%	0.243	61%	0.614	C	S	.	*	H	α-helix	trans	-76.3	-41	176	-73.7	0	0	0	0	110.9	L371 C372 R378 A379	L371-C375 HydrophobicContact CB-CB 3.91Å; L371-C375 HydrophobicContact CD1-CB 4.41Å; L371-C375 HydrophobicContact CD2-CB 4.1Å; L371-C375 HydrophobicContact CG-CB 4.37Å; C372-C375 WeakPolarHBondContact O-CB 3.45Å; C372-C375 PolarHBondContact O-N 3.2Å; C375-R378 WeakPolarHBondContact O-CB 3.49Å; C375-R378 PolarHBondContact O-N 3.23Å; C375-R378 VanDerWaalsContact O-N 3.12Å; C375-A379 PolarHBondContact O-N 3.34Å; C375-A379 VanDerWaalsContact O-N 3.1Å
376	T	60.6	Low	53.2	Low	57 Å²	57	114.6 Å²	114.6	35%	0.35	60%	0.596	S	S	.	*	H	α-helix	trans	-62.6	-43.3	177.4	-48.4	0	0	0	0	111.6	L371 C372 H373 R378 A379 L380	L371-T376 PolarHBondContact O-OG1 3.14Å; C372-T376 PolarHBondContact O-N 2.79Å; C372-T376 PolarHBondContact O-OG1 3.06Å; H373-T376 PolarHBondContact O-N 2.91Å; T376-R378 VanDerWaalsContact C-N 3.27Å; T376-R378 PolarHBondContact O-N 3.47Å; T376-A379 PolarHBondContact O-N 3.4Å; T376-L380 HydrophobicContact CG2-CD1 4.05Å; T376-L380 WeakPolarHBondContact O-CG 3.43Å; T376-L380 PolarHBondContact O-N 3.29Å
377	Q	56.3	Low	54.1	Low	85 Å²	85	115 Å²	115	40%	0.397	59%	0.585	S	S	.	*	H	α-helix	trans	-63.8	-25.9	173.4	-78.2	-168.1	-20.5	0	0	114.3	H373 R381	H373-Q377 VanDerWaalsContact CE1-CD 3.46Å; H373-Q377 PolarHBondContact CE1-NE2 3.07Å; H373-Q377 WeakPolarHBondContact O-CB 3.41Å; H373-Q377 WeakPolarHBondContact O-CG 3.48Å; H373-Q377 PolarHBondContact O-N 3.19Å; Q377-R381 WeakPolarHBondContact O-CG 3.26Å
378	R	58.8	Low	54.7	Low	183 Å²	183	113.6 Å²	113.6	69%	0.691	57%	0.572	S	S	*	*	H	α-helix	trans	-77.9	-40.6	176.4	-74	170	-176.7	-160.3	-0.4	112	L374 C375 T376	L374-R378 WeakPolarHBondContact O-CD 3.47Å; L374-R378 VanDerWaalsContact O-CG 3.26Å; L374-R378 WeakPolarHBondContact O-CG 3.45Å; L374-R378 PolarHBondContact O-N 3.47Å; C375-R378 WeakPolarHBondContact O-CB 3.49Å; C375-R378 PolarHBondContact O-N 3.23Å; C375-R378 VanDerWaalsContact O-N 3.12Å; T376-R378 VanDerWaalsContact C-N 3.27Å; T376-R378 PolarHBondContact O-N 3.47Å
379	A	56.3	Low	55.6	Low	66 Å²	66	116.5 Å²	116.5	55%	0.545	57%	0.569	S	S	.	*	H	α-helix	trans	-64.2	-46.6	177.4	0	0	0	0	0	111.9	C375 T376 R381 N382	C375-A379 PolarHBondContact O-N 3.34Å; C375-A379 VanDerWaalsContact O-N 3.1Å; T376-A379 PolarHBondContact O-N 3.4Å; A379-R381 PolarHBondContact O-N 3.25Å; A379-N382 PolarHBondContact O-N 2.81Å
380	L	54	Low	55.8	Low	145 Å²	145	119.6 Å²	119.6	76%	0.759	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	-1.9	-175.7	-68	171.9	0	0	0	115.4	T376	T376-L380 HydrophobicContact CG2-CD1 4.05Å; T376-L380 WeakPolarHBondContact O-CG 3.43Å; T376-L380 PolarHBondContact O-N 3.29Å
381	R	52.2	Low	56.2	Low	197 Å²	197	117.3 Å²	117.3	74%	0.743	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.1	-4.3	-177.6	-74.6	-177.5	172.6	-171.8	-1.4	114.8	Q377 A379	Q377-R381 WeakPolarHBondContact O-CG 3.26Å; A379-R381 PolarHBondContact O-N 3.25Å
382	N	46.8	Very low	56.9	Low	129 Å²	129	116.5 Å²	116.5	69%	0.69	56%	0.555	S	S	*	*			trans	-110.3	93.8	-172.1	-73.7	-5	0	0	0	112.5	A379	A379-N382 PolarHBondContact O-N 2.81Å
383	V	50.8	Low	57.5	Low	141 Å²	141	117.9 Å²	117.9	86%	0.855	57%	0.568	S	S	*	*			trans	-134.1	100.9	166.3	-177	0	0	0	0	108.9
384	P	49.6	Very low	58.4	Low	111 Å²	111	115.6 Å²	115.6	72%	0.721	56%	0.558	S	S	*	*			trans	-105.7	92.2	-172.1	36.3	-30.1	0	0	0	114.4	N386	P384-N386 PolarHBondContact O-N 2.99Å
385	E	45.9	Very low	59.3	Low	144 Å²	144	116.9 Å²	116.9	67%	0.673	56%	0.561	S	S	*	*			trans	-74.1	101.3	151	-85.2	-163.2	174.3	0	0	108.3	R387	E385-R387 VanDerWaalsContact C-N 3.28Å; E385-R387 PolarHBondContact O-N 2.97Å; E385-R387 IonicContact OE2-CZ 3.9Å; E385-R387 IonicContact OE2-NE 3.49Å; E385-R387 PolarHBondContact OE2-NE 3.49Å; E385-R387 IonicContact OE2-NH2 2.7Å; E385-R387 PolarHBondContact OE2-NH2 3.1Å
386	N	49.3	Very low	60.4	Low	59 Å²	59	121.6 Å²	121.6	32%	0.316	58%	0.577	S	S	.	*			trans	-84.4	68.2	-170.7	-137.1	9.3	0	0	0	113.6	P384 R388 E389	P384-N386 PolarHBondContact O-N 2.99Å; N386-R388 PolarHBondContact O-N 3.48Å; N386-R388 PolarHBondContact OD1-NE 2.98Å; N386-R388 VanDerWaalsContact OD1-NE 3.12Å; N386-R388 PolarHBondContact OD1-NH2 3.08Å; N386-E389 HydrophobicContact CB-CG 4.19Å; N386-E389 WeakPolarHBondContact CB-OE1 3.16Å; N386-E389 PolarHBondContact ND2-OE1 3.46Å; N386-E389 PolarHBondContact O-N 3.21Å; N386-E389 VanDerWaalsContact O-N 3.1Å
387	R	52.2	Low	61.6	Low	175 Å²	175	121.7 Å²	121.7	66%	0.66	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.6	6.8	164.7	-55	-175	-166.7	-170.1	2.7	113.6	E385 R391	E385-R387 VanDerWaalsContact C-N 3.28Å; E385-R387 PolarHBondContact O-N 2.97Å; E385-R387 IonicContact OE2-CZ 3.9Å; E385-R387 IonicContact OE2-NE 3.49Å; E385-R387 PolarHBondContact OE2-NE 3.49Å; E385-R387 IonicContact OE2-NH2 2.7Å; E385-R387 PolarHBondContact OE2-NH2 3.1Å; R387-R391 VanDerWaalsContact O-CZ 3.3Å; R387-R391 PolarHBondContact O-NE 2.84Å; R387-R391 PolarHBondContact O-NH2 3.46Å
388	R	58.6	Low	63	Low	157 Å²	157	123.7 Å²	123.7	59%	0.592	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	-59.2	163.2	-83.8	172.7	-73.2	-131.1	-5.1	109.9	N386 R390 R391 D392	N386-R388 PolarHBondContact O-N 3.48Å; N386-R388 PolarHBondContact OD1-NE 2.98Å; N386-R388 VanDerWaalsContact OD1-NE 3.12Å; N386-R388 PolarHBondContact OD1-NH2 3.08Å; R388-R390 CarbonylContact O-C 3.53Å; R388-R390 PolarHBondContact O-N 3.34Å; R388-R391 CarbonylContact O-C 3.58Å; R388-R391 WeakPolarHBondContact O-CA 3.47Å; R388-R391 WeakPolarHBondContact O-CB 3.35Å; R388-R391 PolarHBondContact O-N 3.07Å; R388-D392 VanDerWaalsContact C-OD2 3.32Å; R388-D392 PolarHBondContact O-N 3.36Å
389	E	63.8	Low	64.5	Low	124 Å²	124	116.6 Å²	116.6	58%	0.579	58%	0.576	S	S	*	*	H	α-helix	trans	-45.9	-40.2	-173.6	-72.2	163.5	-154.2	0	0	114.6	N386 D392 A393	N386-E389 HydrophobicContact CB-CG 4.19Å; N386-E389 WeakPolarHBondContact CB-OE1 3.16Å; N386-E389 PolarHBondContact ND2-OE1 3.46Å; N386-E389 PolarHBondContact O-N 3.21Å; N386-E389 VanDerWaalsContact O-N 3.1Å; E389-D392 WeakPolarHBondContact CA-OD2 3.42Å; E389-D392 PolarHBondContact N-OD2 2.92Å; E389-A393 WeakPolarHBondContact O-CB 3.49Å; E389-A393 PolarHBondContact O-N 3.47Å
390	R	57.7	Low	66.2	Low	185 Å²	185	118.7 Å²	118.7	70%	0.698	58%	0.579	S	S	*	*	H	α-helix	trans	-66.4	-45.2	173.8	-177.9	170.4	-178.9	150	4.7	113.7	R388 A393 E394	R388-R390 CarbonylContact O-C 3.53Å; R388-R390 PolarHBondContact O-N 3.34Å; R390-A393 PolarHBondContact O-N 2.9Å; R390-E394 VanDerWaalsContact CG-OE1 3.3Å; R390-E394 WeakPolarHBondContact CG-OE1 3.21Å; R390-E394 IonicContact CZ-OE1 3.52Å; R390-E394 IonicContact NE-OE1 2.68Å; R390-E394 PolarHBondContact NE-OE1 2.89Å; R390-E394 IonicContact NH2-OE1 3.42Å; R390-E394 VanDerWaalsContact O-CG 3.3Å; R390-E394 WeakPolarHBondContact O-CG 3.49Å; R390-E394 PolarHBondContact O-N 3.07Å
391	R	63.2	Low	68.1	Low	133 Å²	133	117.3 Å²	117.3	50%	0.502	57%	0.571	S	S	.	*	H	α-helix	trans	-67.7	-39.9	172.4	-79	179.3	-70.1	173.5	2.1	111.4	R387 R388 A393 E394 E395	R387-R391 VanDerWaalsContact O-CZ 3.3Å; R387-R391 PolarHBondContact O-NE 2.84Å; R387-R391 PolarHBondContact O-NH2 3.46Å; R388-R391 CarbonylContact O-C 3.58Å; R388-R391 WeakPolarHBondContact O-CA 3.47Å; R388-R391 WeakPolarHBondContact O-CB 3.35Å; R388-R391 PolarHBondContact O-N 3.07Å; R391-A393 PolarHBondContact O-N 2.97Å; R391-E394 CarbonylContact O-C 3.6Å; R391-E394 PolarHBondContact O-N 2.84Å; R391-E394 VanDerWaalsContact O-N 3.17Å; R391-E395 VanDerWaalsContact O-CB 3.26Å; R391-E395 WeakPolarHBondContact O-CB 3.45Å; R391-E395 VanDerWaalsContact O-CG 3.31Å; R391-E395 WeakPolarHBondContact O-CG 3.27Å; R391-E395 PolarHBondContact O-N 3.04Å
392	D	72.1	Confident	70	Confident	57 Å²	57	113.5 Å²	113.5	31%	0.305	57%	0.565	S	S	.	*	H	α-helix	trans	-60.4	-32.8	174.8	-49.5	-18.5	0	0	0	110.8	R388 E389 K396	R388-D392 VanDerWaalsContact C-OD2 3.32Å; R388-D392 PolarHBondContact O-N 3.36Å; E389-D392 WeakPolarHBondContact CA-OD2 3.42Å; E389-D392 PolarHBondContact N-OD2 2.92Å; D392-K396 VanDerWaalsContact O-CB 3.29Å; D392-K396 WeakPolarHBondContact O-CB 3.46Å; D392-K396 WeakPolarHBondContact O-CD 3.29Å; D392-K396 WeakPolarHBondContact O-CG 3.48Å; D392-K396 PolarHBondContact O-N 2.85Å
393	A	77.8	Confident	72.3	Confident	55 Å²	55	111.7 Å²	111.7	46%	0.455	56%	0.555	S	S	.	*	H	α-helix	trans	-74.7	-43.6	173.5	0	0	0	0	0	112.7	E389 R390 R391 K396 A397	E389-A393 WeakPolarHBondContact O-CB 3.49Å; E389-A393 PolarHBondContact O-N 3.47Å; R390-A393 PolarHBondContact O-N 2.9Å; R391-A393 PolarHBondContact O-N 2.97Å; A393-K396 PolarHBondContact O-N 2.92Å; A393-A397 WeakPolarHBondContact O-CB 3.4Å; A393-A397 PolarHBondContact O-N 2.87Å
394	E	76.5	Confident	74.4	Confident	85 Å²	85	110.2 Å²	110.2	40%	0.397	54%	0.542	S	S	.	.	H	α-helix	trans	-63.7	-42.1	175.4	-70.4	161.3	-172.1	0	0	110.9	R390 R391 A397 H398	R390-E394 VanDerWaalsContact CG-OE1 3.3Å; R390-E394 WeakPolarHBondContact CG-OE1 3.21Å; R390-E394 IonicContact CZ-OE1 3.52Å; R390-E394 IonicContact NE-OE1 2.68Å; R390-E394 PolarHBondContact NE-OE1 2.89Å; R390-E394 IonicContact NH2-OE1 3.42Å; R390-E394 VanDerWaalsContact O-CG 3.3Å; R390-E394 WeakPolarHBondContact O-CG 3.49Å; R390-E394 PolarHBondContact O-N 3.07Å; R391-E394 CarbonylContact O-C 3.6Å; R391-E394 PolarHBondContact O-N 2.84Å; R391-E394 VanDerWaalsContact O-N 3.17Å; E394-A397 PolarHBondContact O-N 3.4Å; E394-H398 PolarHBondContact O-CD2 2.87Å; E394-H398 PolarHBondContact O-N 3.28Å
395	E	80	Confident	76.5	Confident	130 Å²	130	111.6 Å²	111.6	61%	0.607	54%	0.536	S	S	*	.	H	α-helix	trans	-66.8	-39.3	173.8	-72.9	176.5	-155.9	0	0	112.3	R391 H398 G399	R391-E395 VanDerWaalsContact O-CB 3.26Å; R391-E395 WeakPolarHBondContact O-CB 3.45Å; R391-E395 VanDerWaalsContact O-CG 3.31Å; R391-E395 WeakPolarHBondContact O-CG 3.27Å; R391-E395 PolarHBondContact O-N 3.04Å; E395-H398 PolarHBondContact O-N 2.96Å; E395-G399 PolarHBondContact O-N 3.42Å
396	K	85.9	Confident	78.6	Confident	136 Å²	136	109 Å²	109	59%	0.591	52%	0.524	S	S	*	.	H	α-helix	trans	-63.4	-40.5	171	-77.8	162.1	-163.8	163.4	0	111.9	D392 A393 G399 N400	D392-K396 VanDerWaalsContact O-CB 3.29Å; D392-K396 WeakPolarHBondContact O-CB 3.46Å; D392-K396 WeakPolarHBondContact O-CD 3.29Å; D392-K396 WeakPolarHBondContact O-CG 3.48Å; D392-K396 PolarHBondContact O-N 2.85Å; A393-K396 PolarHBondContact O-N 2.92Å; K396-G399 PolarHBondContact O-N 2.84Å; K396-N400 WeakPolarHBondContact O-CB 3.34Å; K396-N400 PolarHBondContact O-N 3.45Å; K396-N400 PolarHBondContact O-ND2 2.65Å; K396-N400 PolarHBondContact O-OD1 2.98Å
397	A	86.3	Confident	80.8	Confident	59 Å²	59	110.8 Å²	110.8	49%	0.488	53%	0.531	S	S	.	.	H	α-helix	trans	-63.3	-43.3	176.1	0	0	0	0	0	111.6	A393 E394 L401	A393-A397 WeakPolarHBondContact O-CB 3.4Å; A393-A397 PolarHBondContact O-N 2.87Å; E394-A397 PolarHBondContact O-N 3.4Å; A397-L401 PolarHBondContact O-N 3.17Å; A397-L401 VanDerWaalsContact O-N 3.11Å
398	H	84.7	Confident	82.8	Confident	127 Å²	127	106.8 Å²	106.8	59%	0.588	52%	0.522	S	S	*	.	H	α-helix	trans	-65.3	-40.4	173	-74.5	-58	0	0	0	112.9	E394 E395 L401 L402	E394-H398 PolarHBondContact O-CD2 2.87Å; E394-H398 PolarHBondContact O-N 3.28Å; E395-H398 PolarHBondContact O-N 2.96Å; H398-L401 PolarHBondContact O-N 3.06Å; H398-L402 WeakPolarHBondContact O-CG 3.45Å; H398-L402 PolarHBondContact O-N 3.1Å
399	G	91.6	Very high	84.5	Confident	33 Å²	33	103.9 Å²	103.9	34%	0.34	51%	0.511	S	S	.	.	H	α-helix	trans	-61.8	-44.4	175.4	0	0	0	0	0	112.7	E395 K396 L401 L402 L403	E395-G399 PolarHBondContact O-N 3.42Å; K396-G399 PolarHBondContact O-N 2.84Å; G399-L401 VanDerWaalsContact C-N 3.34Å; G399-L401 PolarHBondContact O-N 3.18Å; G399-L402 PolarHBondContact O-N 3.32Å; G399-L403 WeakPolarHBondContact O-CB 3.38Å; G399-L403 PolarHBondContact O-N 3.1Å
400	N	91.8	Very high	85.9	Confident	111 Å²	111	102 Å²	102	59%	0.594	51%	0.505	S	S	*	.	H	α-helix	trans	-62.4	-40.1	175.6	-69.4	-10.6	0	0	0	112	K396 L403 L404	K396-N400 WeakPolarHBondContact O-CB 3.34Å; K396-N400 PolarHBondContact O-N 3.45Å; K396-N400 PolarHBondContact O-ND2 2.65Å; K396-N400 PolarHBondContact O-OD1 2.98Å; N400-L403 PolarHBondContact O-N 3.16Å; N400-L404 WeakPolarHBondContact O-CB 3.32Å; N400-L404 PolarHBondContact O-N 3.36Å
401	L	93.8	Very high	87.7	Confident	115 Å²	115	99.1 Å²	99.1	60%	0.602	50%	0.499	S	S	*	.	H	α-helix	trans	-65.9	-38.8	175.9	-174.8	68.5	0	0	0	112.3	A397 H398 G399 K405	A397-L401 PolarHBondContact O-N 3.17Å; A397-L401 VanDerWaalsContact O-N 3.11Å; H398-L401 PolarHBondContact O-N 3.06Å; G399-L401 VanDerWaalsContact C-N 3.34Å; G399-L401 PolarHBondContact O-N 3.18Å; L401-K405 WeakPolarHBondContact O-CB 3.04Å; L401-K405 PolarHBondContact O-N 3.37Å; L401-K405 VanDerWaalsContact O-N 3.15Å
402	L	91.7	Very high	89.1	Confident	117 Å²	117	97.5 Å²	97.5	61%	0.613	50%	0.497	S	S	*	.	H	α-helix	trans	-66.9	-43.4	174.8	-72.7	170.5	0	0	0	111.7	H398 G399 K405 E406	H398-L402 WeakPolarHBondContact O-CG 3.45Å; H398-L402 PolarHBondContact O-N 3.1Å; G399-L402 PolarHBondContact O-N 3.32Å; L402-K405 CarbonylContact O-C 3.49Å; L402-K405 PolarHBondContact O-N 3.12Å; L402-E406 WeakPolarHBondContact O-CB 3.33Å; L402-E406 PolarHBondContact O-N 2.68Å
403	L	94.8	Very high	90.1	Very high	91 Å²	91	100.5 Å²	100.5	48%	0.476	51%	0.51	S	S	.	.	H	α-helix	trans	-62.1	-44.4	177.1	179.7	62.8	0	0	0	112.1	G399 N400 K405 E406 Q407	G399-L403 WeakPolarHBondContact O-CB 3.38Å; G399-L403 PolarHBondContact O-N 3.1Å; N400-L403 PolarHBondContact O-N 3.16Å; L403-K405 VanDerWaalsContact C-N 3.29Å; L403-K405 PolarHBondContact O-N 3.45Å; L403-E406 WeakPolarHBondContact O-CA 3.18Å; L403-E406 WeakPolarHBondContact O-CB 3.44Å; L403-E406 PolarHBondContact O-N 3.2Å; L403-Q407 WeakPolarHBondContact O-CG 3.43Å; L403-Q407 PolarHBondContact O-N 2.7Å
404	L	95.3	Very high	90.8	Very high	110 Å²	110	104.5 Å²	104.5	58%	0.576	52%	0.521	S	S	*	.	H	α-helix	trans	-62.3	-38.4	175.7	-174.1	68.4	0	0	0	111.6	N400 E406 L408	N400-L404 WeakPolarHBondContact O-CB 3.32Å; N400-L404 PolarHBondContact O-N 3.36Å; L404-E406 VanDerWaalsContact C-N 3.25Å; L404-E406 PolarHBondContact O-N 2.97Å; L404-L408 WeakPolarHBondContact O-CB 3.05Å; L404-L408 PolarHBondContact O-N 3.42Å; L404-L408 VanDerWaalsContact O-N 3.14Å
405	K	94.2	Very high	91.6	Very high	140 Å²	140	107 Å²	107	61%	0.609	53%	0.533	S	S	*	.	H	α-helix	trans	-72.6	-16.7	173.9	-171.2	178.2	176.8	-175.5	0	112.9	L401 L402 L403 R409	L401-K405 WeakPolarHBondContact O-CB 3.04Å; L401-K405 PolarHBondContact O-N 3.37Å; L401-K405 VanDerWaalsContact O-N 3.15Å; L402-K405 CarbonylContact O-C 3.49Å; L402-K405 PolarHBondContact O-N 3.12Å; L403-K405 VanDerWaalsContact C-N 3.29Å; L403-K405 PolarHBondContact O-N 3.45Å; K405-R409 WeakPolarHBondContact O-CG 3.27Å; K405-R409 PolarHBondContact O-NH1 2.91Å
406	E	89.5	Confident	92.2	Very high	90 Å²	90	105.9 Å²	105.9	42%	0.421	53%	0.527	S	S	.	.	H	α-helix	trans	-82	-52.7	173.2	-165.3	134.4	-97.6	0	0	110.2	L402 L403 L404 L408 R409 D410	L402-E406 WeakPolarHBondContact O-CB 3.33Å; L402-E406 PolarHBondContact O-N 2.68Å; L403-E406 WeakPolarHBondContact O-CA 3.18Å; L403-E406 WeakPolarHBondContact O-CB 3.44Å; L403-E406 PolarHBondContact O-N 3.2Å; L404-E406 VanDerWaalsContact C-N 3.25Å; L404-E406 PolarHBondContact O-N 2.97Å; E406-L408 VanDerWaalsContact C-N 3.29Å; E406-L408 PolarHBondContact O-N 3.31Å; E406-R409 WeakPolarHBondContact O-CA 3.15Å; E406-R409 WeakPolarHBondContact O-CB 3.41Å; E406-R409 PolarHBondContact O-N 3.44Å; E406-R409 IonicContact OE1-CZ 3.04Å; E406-R409 IonicContact OE1-NH2 2.78Å; E406-R409 PolarHBondContact OE1-NH2 3.03Å; E406-D410 PolarHBondContact O-N 3.26Å
407	Q	94.9	Very high	92.4	Very high	97 Å²	97	103.9 Å²	103.9	45%	0.453	52%	0.52	S	S	.	.	H	α-helix	trans	-50.7	-46	174.1	-70.2	171.5	-25.8	0	0	112.4	L403 R409 D410 E411	L403-Q407 WeakPolarHBondContact O-CG 3.43Å; L403-Q407 PolarHBondContact O-N 2.7Å; Q407-R409 VanDerWaalsContact C-N 3.27Å; Q407-R409 PolarHBondContact O-N 3.5Å; Q407-D410 PolarHBondContact O-N 2.91Å; Q407-E411 WeakPolarHBondContact O-CB 3.38Å; Q407-E411 WeakPolarHBondContact O-CG 3.07Å; Q407-E411 PolarHBondContact O-N 2.97Å
408	L	95.4	Very high	92.8	Very high	91 Å²	91	106.5 Å²	106.5	48%	0.476	53%	0.525	S	S	.	.	H	α-helix	trans	-69.7	-18.5	179.1	-172.4	141.4	0	0	0	114	L404 E406 Q412	L404-L408 WeakPolarHBondContact O-CB 3.05Å; L404-L408 PolarHBondContact O-N 3.42Å; L404-L408 VanDerWaalsContact O-N 3.14Å; E406-L408 VanDerWaalsContact C-N 3.29Å; E406-L408 PolarHBondContact O-N 3.31Å; L408-Q412 VanDerWaalsContact O-CG 3.3Å; L408-Q412 WeakPolarHBondContact O-CG 3.4Å
409	R	94.3	Very high	93.2	Very high	96 Å²	96	103 Å²	103	36%	0.362	52%	0.518	S	S	.	.	H	α-helix	trans	-81.6	-44.6	167.4	-67.4	-173.9	-38.6	-92.7	7.5	110.8	K405 E406 Q407 E411 Q412 E413	K405-R409 WeakPolarHBondContact O-CG 3.27Å; K405-R409 PolarHBondContact O-NH1 2.91Å; E406-R409 WeakPolarHBondContact O-CA 3.15Å; E406-R409 WeakPolarHBondContact O-CB 3.41Å; E406-R409 PolarHBondContact O-N 3.44Å; E406-R409 IonicContact OE1-CZ 3.04Å; E406-R409 IonicContact OE1-NH2 2.78Å; E406-R409 PolarHBondContact OE1-NH2 3.03Å; Q407-R409 VanDerWaalsContact C-N 3.27Å; Q407-R409 PolarHBondContact O-N 3.5Å; R409-E411 VanDerWaalsContact C-N 3.26Å; R409-E411 PolarHBondContact O-N 3.34Å; R409-Q412 CarbonylContact O-C 3.58Å; R409-Q412 PolarHBondContact O-N 2.62Å; R409-E413 PolarHBondContact O-N 3.31Å
410	D	92.6	Very high	93.4	Very high	85 Å²	85	105.2 Å²	105.2	46%	0.455	52%	0.518	S	S	.	.	H	α-helix	trans	-59.4	-39.4	179.5	-62.3	-8.5	0	0	0	110.8	E406 Q407 E413 M414	E406-D410 PolarHBondContact O-N 3.26Å; Q407-D410 PolarHBondContact O-N 2.91Å; D410-E413 PolarHBondContact O-N 2.86Å; D410-M414 VanDerWaalsContact O-CB 3.31Å; D410-M414 WeakPolarHBondContact O-CB 3.45Å; D410-M414 WeakPolarHBondContact O-CG 3.5Å; D410-M414 PolarHBondContact O-N 3.2Å
411	E	94.8	Very high	93.5	Very high	124 Å²	124	104.6 Å²	104.6	58%	0.579	52%	0.515	S	S	*	.	H	α-helix	trans	-58.7	-49.5	170.8	-74.4	173.4	163.7	0	0	112	Q407 R409 E413 M414 E415	Q407-E411 WeakPolarHBondContact O-CB 3.38Å; Q407-E411 WeakPolarHBondContact O-CG 3.07Å; Q407-E411 PolarHBondContact O-N 2.97Å; R409-E411 VanDerWaalsContact C-N 3.26Å; R409-E411 PolarHBondContact O-N 3.34Å; E411-E413 PolarHBondContact O-N 3.38Å; E411-M414 PolarHBondContact O-N 3.07Å; E411-E415 WeakPolarHBondContact O-CG 3.42Å; E411-E415 PolarHBondContact O-N 2.85Å
412	Q	93.4	Very high	93.4	Very high	98 Å²	98	103 Å²	103	46%	0.458	51%	0.51	S	S	.	.	H	α-helix	trans	-66.8	-33.4	178.6	-71.4	175.9	9.2	0	0	113.4	L408 R409 Q416	L408-Q412 VanDerWaalsContact O-CG 3.3Å; L408-Q412 WeakPolarHBondContact O-CG 3.4Å; R409-Q412 CarbonylContact O-C 3.58Å; R409-Q412 PolarHBondContact O-N 2.62Å; Q412-Q416 WeakPolarHBondContact O-CB 3.03Å; Q412-Q416 VanDerWaalsContact O-CG 3.25Å; Q412-Q416 WeakPolarHBondContact O-CG 3.35Å; Q412-Q416 PolarHBondContact O-N 3.47Å; Q412-Q416 VanDerWaalsContact O-N 3.13Å; Q412-Q416 PolarHBondContact O-NE2 3.38Å
413	E	92.9	Very high	93.5	Very high	120 Å²	120	102.9 Å²	102.9	56%	0.561	51%	0.506	S	S	*	.	H	α-helix	trans	-71.7	-38.6	174.4	-72	-172.5	-156.6	0	0	111	R409 D410 E411 Q416 E417	R409-E413 PolarHBondContact O-N 3.31Å; D410-E413 PolarHBondContact O-N 2.86Å; E411-E413 PolarHBondContact O-N 3.38Å; E413-Q416 PolarHBondContact O-N 3.48Å; E413-E417 PolarHBondContact O-N 3.08Å
414	M	91.6	Very high	93.4	Very high	139 Å²	139	103.4 Å²	103.4	69%	0.685	51%	0.506	S	S	*	.	H	α-helix	trans	-64.9	-41.5	173.2	-76.6	-67.2	-62.9	0	0	112.7	D410 E411 Q416 E417 L418	D410-M414 VanDerWaalsContact O-CB 3.31Å; D410-M414 WeakPolarHBondContact O-CB 3.45Å; D410-M414 WeakPolarHBondContact O-CG 3.5Å; D410-M414 PolarHBondContact O-N 3.2Å; E411-M414 PolarHBondContact O-N 3.07Å; M414-Q416 VanDerWaalsContact C-N 3.34Å; M414-E417 PolarHBondContact O-N 3.47Å; M414-L418 WeakPolarHBondContact O-CB 3.4Å; M414-L418 PolarHBondContact O-N 2.84Å
415	E	94.3	Very high	93.3	Very high	139 Å²	139	104.7 Å²	104.7	65%	0.65	51%	0.509	S	S	*	.	H	α-helix	trans	-60.9	-42.4	172.5	-74.8	-175	157.7	0	0	111.7	E411 L418 A419	E411-E415 WeakPolarHBondContact O-CG 3.42Å; E411-E415 PolarHBondContact O-N 2.85Å; E415-L418 PolarHBondContact O-N 3.5Å; E415-A419 WeakPolarHBondContact O-CB 3.26Å; E415-A419 PolarHBondContact O-N 3.06Å
416	Q	92.7	Very high	93.3	Very high	105 Å²	105	103 Å²	103	49%	0.491	50%	0.503	S	S	.	.	H	α-helix	trans	-67.4	-40	177.3	-75.1	173.3	55.5	0	0	113	Q412 E413 M414 A419 K420	Q412-Q416 WeakPolarHBondContact O-CB 3.03Å; Q412-Q416 VanDerWaalsContact O-CG 3.25Å; Q412-Q416 WeakPolarHBondContact O-CG 3.35Å; Q412-Q416 PolarHBondContact O-N 3.47Å; Q412-Q416 VanDerWaalsContact O-N 3.13Å; Q412-Q416 PolarHBondContact O-NE2 3.38Å; E413-Q416 PolarHBondContact O-N 3.48Å; M414-Q416 VanDerWaalsContact C-N 3.34Å; Q416-A419 PolarHBondContact O-N 2.99Å; Q416-K420 WeakPolarHBondContact O-CD 3.28Å; Q416-K420 VanDerWaalsContact O-CG 3.22Å; Q416-K420 WeakPolarHBondContact O-CG 3.17Å; Q416-K420 PolarHBondContact O-N 2.87Å
417	E	90.6	Very high	93.4	Very high	95 Å²	95	101.6 Å²	101.6	44%	0.444	50%	0.497	S	S	.	.	H	α-helix	trans	-68	-37.5	173.7	-72.8	-58	134.2	0	0	111.9	E413 M414 A419 K420 L421	E413-E417 PolarHBondContact O-N 3.08Å; M414-E417 PolarHBondContact O-N 3.47Å; E417-A419 VanDerWaalsContact C-N 3.35Å; E417-A419 PolarHBondContact O-N 3.03Å; E417-K420 PolarHBondContact O-N 3.21Å; E417-K420 VanDerWaalsContact OE1-CD 3.25Å; E417-K420 WeakPolarHBondContact OE1-CD 3.45Å; E417-K420 WeakPolarHBondContact OE1-CE 3.32Å; E417-K420 IonicContact OE1-NZ 2.62Å; E417-K420 PolarHBondContact OE1-NZ 2.95Å; E417-L421 WeakPolarHBondContact O-CB 3.47Å; E417-L421 VanDerWaalsContact O-CG 3.26Å; E417-L421 WeakPolarHBondContact O-CG 3.49Å; E417-L421 PolarHBondContact O-N 3.22Å
418	L	93.3	Very high	93.3	Very high	113 Å²	113	99.6 Å²	99.6	59%	0.592	50%	0.497	S	S	*	.	H	α-helix	trans	-60.1	-44.5	172.2	-174	65.6	0	0	0	111.5	M414 E415 L421 T422	M414-L418 WeakPolarHBondContact O-CB 3.4Å; M414-L418 PolarHBondContact O-N 2.84Å; E415-L418 PolarHBondContact O-N 3.5Å; L418-L421 PolarHBondContact O-N 3.36Å; L418-T422 PolarHBondContact O-N 3.2Å; L418-T422 PolarHBondContact O-OG1 3.2Å
419	A	94.7	Very high	93.4	Very high	54 Å²	54	101 Å²	101	45%	0.446	50%	0.499	S	S	.	.	H	α-helix	trans	-63.6	-41.3	175.9	0	0	0	0	0	113	E415 Q416 E417 L421 T422 E423	E415-A419 WeakPolarHBondContact O-CB 3.26Å; E415-A419 PolarHBondContact O-N 3.06Å; Q416-A419 PolarHBondContact O-N 2.99Å; E417-A419 VanDerWaalsContact C-N 3.35Å; E417-A419 PolarHBondContact O-N 3.03Å; A419-L421 VanDerWaalsContact C-N 3.29Å; A419-L421 PolarHBondContact O-N 3.17Å; A419-T422 PolarHBondContact O-N 3.29Å; A419-T422 PolarHBondContact O-OG1 3.38Å; A419-E423 PolarHBondContact O-N 3.46Å
420	K	94.4	Very high	93.4	Very high	79 Å²	79	101.9 Å²	101.9	34%	0.343	51%	0.505	S	S	.	.	H	α-helix	trans	-63.3	-35.2	173.8	-68.8	158.7	-166.2	150.8	0	111.8	Q416 E417 Q424	Q416-K420 WeakPolarHBondContact O-CD 3.28Å; Q416-K420 VanDerWaalsContact O-CG 3.22Å; Q416-K420 WeakPolarHBondContact O-CG 3.17Å; Q416-K420 PolarHBondContact O-N 2.87Å; E417-K420 PolarHBondContact O-N 3.21Å; E417-K420 VanDerWaalsContact OE1-CD 3.25Å; E417-K420 WeakPolarHBondContact OE1-CD 3.45Å; E417-K420 WeakPolarHBondContact OE1-CE 3.32Å; E417-K420 IonicContact OE1-NZ 2.62Å; E417-K420 PolarHBondContact OE1-NZ 2.95Å; K420-Q424 WeakPolarHBondContact O-CB 3.32Å; K420-Q424 VanDerWaalsContact O-CG 3.23Å; K420-Q424 WeakPolarHBondContact O-CG 3.42Å; K420-Q424 PolarHBondContact O-N 3.27Å; K420-Q424 PolarHBondContact O-NE2 2.82Å; K420-Q424 VanDerWaalsContact O-NE2 3.14Å
421	L	94.1	Very high	93.5	Very high	99 Å²	99	101.2 Å²	101.2	52%	0.518	50%	0.504	S	S	.	.	H	α-helix	trans	-73.6	-38.3	178.4	-73.2	170.7	0	0	0	112.4	E417 L418 A419 Q424 H425	E417-L421 WeakPolarHBondContact O-CB 3.47Å; E417-L421 VanDerWaalsContact O-CG 3.26Å; E417-L421 WeakPolarHBondContact O-CG 3.49Å; E417-L421 PolarHBondContact O-N 3.22Å; L418-L421 PolarHBondContact O-N 3.36Å; A419-L421 VanDerWaalsContact C-N 3.29Å; A419-L421 PolarHBondContact O-N 3.17Å; L421-Q424 PolarHBondContact O-N 2.81Å; L421-H425 WeakPolarHBondContact O-CB 3.47Å; L421-H425 PolarHBondContact O-N 3.31Å
422	T	92.1	Very high	93.3	Very high	81 Å²	81	97.9 Å²	97.9	50%	0.497	50%	0.498	S	S	.	.	H	α-helix	trans	-67.2	-40.6	173.6	55.3	0	0	0	0	111.5	L418 A419 H425 E426	L418-T422 PolarHBondContact O-N 3.2Å; L418-T422 PolarHBondContact O-OG1 3.2Å; A419-T422 PolarHBondContact O-N 3.29Å; A419-T422 PolarHBondContact O-OG1 3.38Å; T422-H425 PolarHBondContact O-N 2.85Å; T422-E426 PolarHBondContact O-N 3.22Å
423	E	94.6	Very high	93.4	Very high	114 Å²	114	98.2 Å²	98.2	53%	0.533	50%	0.5	S	S	.	.	H	α-helix	trans	-61.8	-47.1	173.9	-159.6	-155.4	156.5	0	0	111.6	A419 H425 E426 Q427	A419-E423 PolarHBondContact O-N 3.46Å; E423-H425 VanDerWaalsContact C-N 3.27Å; E423-H425 PolarHBondContact O-N 2.9Å; E423-E426 WeakPolarHBondContact O-CB 3.48Å; E423-E426 PolarHBondContact O-N 3.29Å; E423-Q427 VanDerWaalsContact O-CG 3.32Å; E423-Q427 WeakPolarHBondContact O-CG 3.34Å; E423-Q427 PolarHBondContact O-N 3.27Å; E423-Q427 PolarHBondContact OE1-NE2 3.47Å
424	Q	91.6	Very high	93.4	Very high	103 Å²	103	98.4 Å²	98.4	48%	0.481	50%	0.499	S	S	.	.	H	α-helix	trans	-59.5	-37.1	175	-78.8	171.9	64.9	0	0	112.5	K420 L421 Q427 A428	K420-Q424 WeakPolarHBondContact O-CB 3.32Å; K420-Q424 VanDerWaalsContact O-CG 3.23Å; K420-Q424 WeakPolarHBondContact O-CG 3.42Å; K420-Q424 PolarHBondContact O-N 3.27Å; K420-Q424 PolarHBondContact O-NE2 2.82Å; K420-Q424 VanDerWaalsContact O-NE2 3.14Å; L421-Q424 PolarHBondContact O-N 2.81Å; Q424-Q427 PolarHBondContact O-N 3.13Å; Q424-A428 VanDerWaalsContact O-CB 3.23Å; Q424-A428 WeakPolarHBondContact O-CB 3.42Å; Q424-A428 PolarHBondContact O-N 2.69Å
425	H	94	Very high	93.5	Very high	136 Å²	136	96.1 Å²	96.1	63%	0.63	49%	0.489	S	S	*	.	H	α-helix	trans	-67	-41.5	175.5	-179.2	-104	0	0	0	111.9	L421 T422 E423 A428 K429	L421-H425 WeakPolarHBondContact O-CB 3.47Å; L421-H425 PolarHBondContact O-N 3.31Å; T422-H425 PolarHBondContact O-N 2.85Å; E423-H425 VanDerWaalsContact C-N 3.27Å; E423-H425 PolarHBondContact O-N 2.9Å; H425-A428 PolarHBondContact O-N 2.95Å; H425-K429 WeakPolarHBondContact O-CB 3.45Å; H425-K429 PolarHBondContact O-N 2.69Å
426	E	94.4	Very high	93.3	Very high	106 Å²	106	93.9 Å²	93.9	50%	0.495	48%	0.481	S	S	.	.	H	α-helix	trans	-62.8	-45	172.2	-79.1	-159.6	-167	0	0	113.1	T422 E423 A428 K429 K430	T422-E426 PolarHBondContact O-N 3.22Å; E423-E426 WeakPolarHBondContact O-CB 3.48Å; E423-E426 PolarHBondContact O-N 3.29Å; E426-A428 VanDerWaalsContact C-N 3.32Å; E426-A428 PolarHBondContact O-N 2.82Å; E426-K429 WeakPolarHBondContact O-CB 3.47Å; E426-K429 PolarHBondContact O-N 2.92Å; E426-K430 WeakPolarHBondContact O-CD 3.41Å; E426-K430 VanDerWaalsContact O-CG 3.27Å; E426-K430 WeakPolarHBondContact O-CG 3.43Å; E426-K430 PolarHBondContact O-N 3.4Å; E426-K430 IonicContact OE2-NZ 3.49Å; E426-K430 PolarHBondContact OE2-NZ 3.06Å
427	Q	91.3	Very high	93.1	Very high	60 Å²	60	94.3 Å²	94.3	28%	0.28	48%	0.483	S	S	.	.	H	α-helix	trans	-59.9	-44.7	175.8	-68.7	173.8	9.1	0	0	110.5	E423 Q424 K429 K430 V431	E423-Q427 VanDerWaalsContact O-CG 3.32Å; E423-Q427 WeakPolarHBondContact O-CG 3.34Å; E423-Q427 PolarHBondContact O-N 3.27Å; E423-Q427 PolarHBondContact OE1-NE2 3.47Å; Q424-Q427 PolarHBondContact O-N 3.13Å; Q427-K429 PolarHBondContact O-N 2.86Å; Q427-K430 PolarHBondContact O-N 3.14Å; Q427-V431 WeakPolarHBondContact O-CG2 3.24Å; Q427-V431 PolarHBondContact O-N 2.95Å
428	A	93	Very high	92.7	Very high	55 Å²	55	93.3 Å²	93.3	46%	0.455	48%	0.479	S	S	.	.	H	α-helix	trans	-62.8	-38.8	176.2	0	0	0	0	0	112.5	Q424 H425 E426 V431 A432	Q424-A428 VanDerWaalsContact O-CB 3.23Å; Q424-A428 WeakPolarHBondContact O-CB 3.42Å; Q424-A428 PolarHBondContact O-N 2.69Å; H425-A428 PolarHBondContact O-N 2.95Å; E426-A428 VanDerWaalsContact C-N 3.32Å; E426-A428 PolarHBondContact O-N 2.82Å; A428-V431 PolarHBondContact O-N 3.39Å; A428-A432 WeakPolarHBondContact O-CB 3.49Å; A428-A432 PolarHBondContact O-N 3.5Å
429	K	95.9	Very high	92.1	Very high	120 Å²	120	90.4 Å²	90.4	52%	0.522	47%	0.468	S	S	.	.	H	α-helix	trans	-61.5	-50.8	173.3	178.6	179.5	171.3	-176.7	0	111.4	H425 E426 Q427 V431 A432 E433	H425-K429 WeakPolarHBondContact O-CB 3.45Å; H425-K429 PolarHBondContact O-N 2.69Å; E426-K429 WeakPolarHBondContact O-CB 3.47Å; E426-K429 PolarHBondContact O-N 2.92Å; Q427-K429 PolarHBondContact O-N 2.86Å; K429-V431 VanDerWaalsContact C-N 3.28Å; K429-V431 PolarHBondContact O-N 3.07Å; K429-A432 WeakPolarHBondContact O-CB 3.42Å; K429-A432 PolarHBondContact O-N 3.11Å; K429-E433 WeakPolarHBondContact CE-OE1 3.47Å; K429-E433 WeakPolarHBondContact CG-OE1 3.47Å; K429-E433 WeakPolarHBondContact O-CG 3.4Å; K429-E433 PolarHBondContact O-N 2.88Å
430	K	95.5	Very high	91.6	Very high	114 Å²	114	96.1 Å²	96.1	50%	0.496	48%	0.478	S	S	.	.	H	α-helix	trans	-56.8	-41	177.2	-67.8	157.9	-169.5	163.5	0	111.4	E426 Q427 F434	E426-K430 WeakPolarHBondContact O-CD 3.41Å; E426-K430 VanDerWaalsContact O-CG 3.27Å; E426-K430 WeakPolarHBondContact O-CG 3.43Å; E426-K430 PolarHBondContact O-N 3.4Å; E426-K430 IonicContact OE2-NZ 3.49Å; E426-K430 PolarHBondContact OE2-NZ 3.06Å; Q427-K430 PolarHBondContact O-N 3.14Å; K430-F434 PolarHBondContact O-N 3.45Å; K430-F434 VanDerWaalsContact O-N 3.11Å
431	V	93.4	Very high	90.7	Very high	72 Å²	72	100.9 Å²	100.9	44%	0.436	49%	0.494	S	S	.	.	H	α-helix	trans	-70.2	-37.5	175.1	170.3	0	0	0	0	112.6	Q427 A428 K429 N435	Q427-V431 WeakPolarHBondContact O-CG2 3.24Å; Q427-V431 PolarHBondContact O-N 2.95Å; A428-V431 PolarHBondContact O-N 3.39Å; K429-V431 VanDerWaalsContact C-N 3.28Å; K429-V431 PolarHBondContact O-N 3.07Å; V431-N435 WeakPolarHBondContact CG1-ND2 3.49Å; V431-N435 WeakPolarHBondContact O-CB 3.28Å; V431-N435 VanDerWaalsContact O-CG 3.24Å; V431-N435 PolarHBondContact O-N 3.3Å; V431-N435 PolarHBondContact O-ND2 3.25Å
432	A	92.3	Very high	89.5	Confident	54 Å²	54	100.8 Å²	100.8	45%	0.446	49%	0.491	S	S	.	.	H	α-helix	trans	-66.3	-43.5	176.1	0	0	0	0	0	111.8	A428 K429 N435 L436	A428-A432 WeakPolarHBondContact O-CB 3.49Å; A428-A432 PolarHBondContact O-N 3.5Å; K429-A432 WeakPolarHBondContact O-CB 3.42Å; K429-A432 PolarHBondContact O-N 3.11Å; A432-N435 PolarHBondContact O-N 3.25Å; A432-L436 VanDerWaalsContact O-CB 3.25Å; A432-L436 WeakPolarHBondContact O-CB 3.45Å; A432-L436 PolarHBondContact O-N 3.47Å
433	E	93.8	Very high	88.4	Confident	105 Å²	105	102.9 Å²	102.9	49%	0.491	49%	0.493	S	S	.	.	H	α-helix	trans	-59.6	-46.9	174.8	-72	166.5	174.6	0	0	111.2	K429 L436 H437	K429-E433 WeakPolarHBondContact CE-OE1 3.47Å; K429-E433 WeakPolarHBondContact CG-OE1 3.47Å; K429-E433 WeakPolarHBondContact O-CG 3.4Å; K429-E433 PolarHBondContact O-N 2.88Å; E433-L436 PolarHBondContact O-N 3.08Å; E433-H437 WeakPolarHBondContact O-CB 3.42Å; E433-H437 PolarHBondContact O-N 2.88Å
434	F	94.4	Very high	86.9	Confident	124 Å²	124	101 Å²	101	54%	0.544	49%	0.492	S	S	.	.	H	α-helix	trans	-59.6	-48.3	174.1	178.3	-95	0	0	0	112.7	K430 L436 H437 M438	K430-F434 PolarHBondContact O-N 3.45Å; K430-F434 VanDerWaalsContact O-N 3.11Å; F434-L436 VanDerWaalsContact C-N 3.29Å; F434-L436 PolarHBondContact O-N 3.03Å; F434-H437 PolarHBondContact O-N 3.44Å; F434-M438 HydrophobicContact CD1-CG 4.18Å; F434-M438 HydrophobicContact CE1-CG 3.71Å; F434-M438 HydrophobicContact CE2-CG 4.15Å; F434-M438 HydrophobicContact CE2-SD 4.44Å; F434-M438 HydrophobicContact CZ-CG 3.69Å; F434-M438 HydrophobicContact CZ-SD 4.15Å; F434-M438 WeakPolarHBondContact O-CG 3.46Å; F434-M438 PolarHBondContact O-N 2.77Å
435	N	92.3	Very high	85.2	Confident	90 Å²	90	99.5 Å²	99.5	48%	0.481	49%	0.494	S	S	.	.	H	α-helix	trans	-63	-35.8	178.5	-75	-37.5	0	0	0	112.2	V431 A432 S439	V431-N435 WeakPolarHBondContact CG1-ND2 3.49Å; V431-N435 WeakPolarHBondContact O-CB 3.28Å; V431-N435 VanDerWaalsContact O-CG 3.24Å; V431-N435 PolarHBondContact O-N 3.3Å; V431-N435 PolarHBondContact O-ND2 3.25Å; A432-N435 PolarHBondContact O-N 3.25Å; N435-S439 VanDerWaalsContact O-CB 3.27Å; N435-S439 WeakPolarHBondContact O-CB 3.38Å; N435-S439 PolarHBondContact O-N 3.26Å
436	L	90.4	Very high	83.4	Confident	92 Å²	92	100.2 Å²	100.2	48%	0.482	49%	0.491	S	S	.	.	H	α-helix	trans	-71.9	-38.6	178.2	-165.1	152.5	0	0	0	111.2	A432 E433 F434 S439 R440	A432-L436 VanDerWaalsContact O-CB 3.25Å; A432-L436 WeakPolarHBondContact O-CB 3.45Å; A432-L436 PolarHBondContact O-N 3.47Å; E433-L436 PolarHBondContact O-N 3.08Å; F434-L436 VanDerWaalsContact C-N 3.29Å; F434-L436 PolarHBondContact O-N 3.03Å; L436-S439 PolarHBondContact O-N 3.25Å; L436-R440 HydrophobicContact CD2-CG 4.33Å; L436-R440 WeakPolarHBondContact O-CG 3.46Å; L436-R440 PolarHBondContact O-N 3.39Å
437	H	89.6	Confident	81.4	Confident	115 Å²	115	103.2 Å²	103.2	53%	0.532	50%	0.502	S	S	.	.	H	α-helix	trans	-61.1	-48.9	169.9	175.3	-99.7	0	0	0	111.9	E433 F434 S439 R440 R441	E433-H437 WeakPolarHBondContact O-CB 3.42Å; E433-H437 PolarHBondContact O-N 2.88Å; F434-H437 PolarHBondContact O-N 3.44Å; H437-S439 VanDerWaalsContact C-N 3.35Å; H437-S439 PolarHBondContact O-N 3.24Å; H437-R440 PolarHBondContact O-N 2.98Å; H437-R441 PolarHBondContact O-N 3.07Å
438	M	82.5	Confident	79.5	Confident	74 Å²	74	106.7 Å²	106.7	37%	0.365	52%	0.523	S	S	.	.	H	α-helix	trans	-62.8	-39.2	176.4	-69.2	-58.7	-66.9	0	0	112.3	F434 R441 E442	F434-M438 HydrophobicContact CD1-CG 4.18Å; F434-M438 HydrophobicContact CE1-CG 3.71Å; F434-M438 HydrophobicContact CE2-CG 4.15Å; F434-M438 HydrophobicContact CE2-SD 4.44Å; F434-M438 HydrophobicContact CZ-CG 3.69Å; F434-M438 HydrophobicContact CZ-SD 4.15Å; F434-M438 WeakPolarHBondContact O-CG 3.46Å; F434-M438 PolarHBondContact O-N 2.77Å; M438-R441 PolarHBondContact O-N 2.69Å; M438-E442 PolarHBondContact O-N 3.13Å
439	S	80.9	Confident	77.2	Confident	51 Å²	51	107.4 Å²	107.4	36%	0.357	52%	0.524	S	S	.	.	H	α-helix	trans	-67.3	-36.1	175.5	-171.9	0	0	0	0	112.8	N435 L436 H437 K443	N435-S439 VanDerWaalsContact O-CB 3.27Å; N435-S439 WeakPolarHBondContact O-CB 3.38Å; N435-S439 PolarHBondContact O-N 3.26Å; L436-S439 PolarHBondContact O-N 3.25Å; H437-S439 VanDerWaalsContact C-N 3.35Å; H437-S439 PolarHBondContact O-N 3.24Å; S439-K443 WeakPolarHBondContact O-CB 3.08Å; S439-K443 VanDerWaalsContact O-CG 3.24Å; S439-K443 WeakPolarHBondContact O-CG 3.3Å; S439-K443 PolarHBondContact O-N 3.15Å
440	R	83.9	Confident	74.8	Confident	174 Å²	174	107.1 Å²	107.1	66%	0.657	53%	0.534	S	S	*	.	H	α-helix	trans	-61.4	-49.6	171	-77.3	175.5	176.7	174.9	1.4	110.7	L436 H437 E442 K443 S444	L436-R440 HydrophobicContact CD2-CG 4.33Å; L436-R440 WeakPolarHBondContact O-CG 3.46Å; L436-R440 PolarHBondContact O-N 3.39Å; H437-R440 PolarHBondContact O-N 2.98Å; R440-E442 PolarHBondContact O-N 2.97Å; R440-K443 PolarHBondContact O-N 3.24Å; R440-K443 VanDerWaalsContact O-N 3.15Å; R440-S444 PolarHBondContact O-N 3.06Å; R440-S444 PolarHBondContact O-OG 3.16Å
441	R	75.2	Confident	72.6	Confident	180 Å²	180	107.8 Å²	107.8	68%	0.679	55%	0.548	S	S	*	.	H	α-helix	trans	-59.3	-44.4	177.4	179.4	175.9	168.7	136.9	-0.3	112.5	H437 M438 S445	H437-R441 PolarHBondContact O-N 3.07Å; M438-R441 PolarHBondContact O-N 2.69Å; R441-S445 PolarHBondContact O-N 3.29Å; R441-S445 PolarHBondContact O-OG 3.45Å
442	E	67.9	Low	70.3	Confident	96 Å²	96	108.2 Å²	108.2	45%	0.449	56%	0.559	S	S	.	*	H	α-helix	trans	-61.4	-44.6	173.2	-88.4	-164.8	-147.4	0	0	112.2	M438 R440 S444 S445 R446	M438-E442 PolarHBondContact O-N 3.13Å; R440-E442 PolarHBondContact O-N 2.97Å; E442-S444 PolarHBondContact O-N 3.23Å; E442-S445 WeakPolarHBondContact CA-OG 3.29Å; E442-S445 PolarHBondContact O-N 2.86Å; E442-S445 PolarHBondContact O-OG 2.94Å; E442-R446 WeakPolarHBondContact O-CG 3.49Å; E442-R446 PolarHBondContact O-N 2.92Å; E442-R446 IonicContact OE2-CZ 3.74Å; E442-R446 IonicContact OE2-NE 2.69Å; E442-R446 IonicContact OE2-NH2 3.78Å; E442-R446 PolarHBondContact OE2-NH2 2.95Å
443	K	70.2	Confident	68.1	Low	125 Å²	125	114.4 Å²	114.4	54%	0.543	57%	0.571	S	S	.	*	H	α-helix	trans	-60.6	-45.1	179.6	-78	172	-179.3	-178	0	111.7	S439 R440 S445 R446 F447	S439-K443 WeakPolarHBondContact O-CB 3.08Å; S439-K443 VanDerWaalsContact O-CG 3.24Å; S439-K443 WeakPolarHBondContact O-CG 3.3Å; S439-K443 PolarHBondContact O-N 3.15Å; R440-K443 PolarHBondContact O-N 3.24Å; R440-K443 VanDerWaalsContact O-N 3.15Å; K443-S445 PolarHBondContact O-N 2.9Å; K443-R446 PolarHBondContact O-N 2.95Å; K443-R446 VanDerWaalsContact O-N 3.08Å; K443-F447 WeakPolarHBondContact O-CD2 3.49Å; K443-F447 PolarHBondContact O-N 2.86Å
444	S	62	Low	65.6	Low	74 Å²	74	118.7 Å²	118.7	52%	0.517	59%	0.591	S	S	.	*	H	α-helix	trans	-52.5	-53.6	172.6	-62.4	0	0	0	0	111.1	R440 E442 R446 F447	R440-S444 PolarHBondContact O-N 3.06Å; R440-S444 PolarHBondContact O-OG 3.16Å; E442-S444 PolarHBondContact O-N 3.23Å; S444-R446 PolarHBondContact O-N 3.02Å; S444-F447 PolarHBondContact O-N 3.31Å
445	S	57.3	Low	63.3	Low	73 Å²	73	121.6 Å²	121.6	51%	0.51	61%	0.606	S	S	.	*	H	α-helix	trans	-63.1	-6.7	179.3	66.1	0	0	0	0	116.1	R441 E442 K443 D448	R441-S445 PolarHBondContact O-N 3.29Å; R441-S445 PolarHBondContact O-OG 3.45Å; E442-S445 WeakPolarHBondContact CA-OG 3.29Å; E442-S445 PolarHBondContact O-N 2.86Å; E442-S445 PolarHBondContact O-OG 2.94Å; K443-S445 PolarHBondContact O-N 2.9Å; S445-D448 WeakPolarHBondContact CA-OD2 3.44Å
446	R	54.4	Low	61.1	Low	151 Å²	151	127.9 Å²	127.9	57%	0.57	62%	0.623	S	S	*	*	H	α-helix	trans	-101.2	-12.6	174.7	-66.5	174.3	-166.6	-150.5	11.2	113.5	E442 K443 S444	E442-R446 WeakPolarHBondContact O-CG 3.49Å; E442-R446 PolarHBondContact O-N 2.92Å; E442-R446 IonicContact OE2-CZ 3.74Å; E442-R446 IonicContact OE2-NE 2.69Å; E442-R446 IonicContact OE2-NH2 3.78Å; E442-R446 PolarHBondContact OE2-NH2 2.95Å; K443-R446 PolarHBondContact O-N 2.95Å; K443-R446 VanDerWaalsContact O-N 3.08Å; S444-R446 PolarHBondContact O-N 3.02Å
447	F	52.8	Low	58.6	Low	168 Å²	168	128.6 Å²	128.6	74%	0.737	64%	0.635	S	S	*	*	H	α-helix	trans	-83.1	-19.3	171.6	-76.8	-72.2	0	0	0	112.3	K443 S444 C449	K443-F447 WeakPolarHBondContact O-CD2 3.49Å; K443-F447 PolarHBondContact O-N 2.86Å; S444-F447 PolarHBondContact O-N 3.31Å; F447-C449 PolarHBondContact O-N 3.29Å
448	D	51.7	Low	56.9	Low	134 Å²	134	132 Å²	132	72%	0.717	65%	0.649	S	S	*	*	S	Bend	trans	-71.2	8.8	178.9	-54.2	-39	0	0	0	114.7	S445	S445-D448 WeakPolarHBondContact CA-OD2 3.44Å
449	C	44.7	Very low	55.2	Low	70 Å²	70	134.2 Å²	134.2	47%	0.473	67%	0.667	S	S	.	*			trans	-141.6	93.7	178.5	-167.1	0	0	0	0	112.2	F447 T451	F447-C449 PolarHBondContact O-N 3.29Å; C449-T451 VanDerWaalsContact C-N 3.31Å; C449-T451 PolarHBondContact O-N 3.31Å
450	P	46.2	Very low	53.6	Low	114 Å²	114	139.2 Å²	139.2	74%	0.74	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-64.5	-25.7	-174.1	-26.4	36.2	0	0	0	115.8	A452	P450-A452 PolarHBondContact O-N 3.27Å
451	T	47.9	Very low	52.2	Low	128 Å²	128	137.4 Å²	137.4	79%	0.785	69%	0.693	S	S	*	*	G	3₁₀ helix	trans	-82.6	-10.3	-161.5	-23.9	0	0	0	0	115.3	C449 W453	C449-T451 VanDerWaalsContact C-N 3.31Å; C449-T451 PolarHBondContact O-N 3.31Å; T451-W453 PolarHBondContact O-N 3.12Å
452	A	46.7	Very low	51.2	Low	80 Å²	80	132.3 Å²	132.3	66%	0.661	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-87.3	2.4	-164.8	0	0	0	0	0	116.3	P450	P450-A452 PolarHBondContact O-N 3.27Å
453	W	44.6	Very low	50.7	Low	184 Å²	184	138.4 Å²	138.4	70%	0.697	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-103.6	-10.6	-165.7	-68.9	97.6	0	0	0	116.1	T451	T451-W453 PolarHBondContact O-N 3.12Å
454	H	42.7	Very low	50	Low	196 Å²	196	136.8 Å²	136.8	91%	0.907	71%	0.71	S	S	*	*	S	Bend	trans	-97.9	19.6	-169.9	-107.1	-75	0	0	0	116.2
455	E	45	Very low	50.1	Low	185 Å²	185	139.5 Å²	139.5	86%	0.864	72%	0.724	S	S	*	*			trans	-130.9	56.6	-172.8	-143.4	176.2	-123.3	0	0	113.8
456	R	45.5	Very low	50.5	Low	221 Å²	221	141.4 Å²	141.4	83%	0.834	73%	0.733	S	S	*	*			trans	-139.9	58.3	174.5	-75.6	-166.4	174.8	157.5	2.7	114.8
457	S	39.6	Very low	51	Low	107 Å²	107	137 Å²	137	75%	0.748	72%	0.723	S	S	*	*			trans	-98.4	123.1	163.5	39.5	0	0	0	0	110.4	V459	S457-V459 VanDerWaalsContact C-N 3.27Å; S457-V459 PolarHBondContact O-N 3.47Å
458	F	52.5	Low	51.7	Low	187 Å²	187	133 Å²	133	82%	0.82	71%	0.714	S	S	*	*			trans	-83.9	56.7	-173.5	-81.6	-88.7	0	0	0	113.4
459	V	46.5	Very low	52.7	Low	121 Å²	121	134.8 Å²	134.8	73%	0.733	72%	0.716	S	S	*	*			trans	-129	117.3	172.4	-175.7	0	0	0	0	109.1	S457 P461	S457-V459 VanDerWaalsContact C-N 3.27Å; S457-V459 PolarHBondContact O-N 3.47Å; V459-P461 WeakPolarHBondContact O-CD 3.47Å
460	F	48.9	Very low	54.4	Low	155 Å²	155	141.5 Å²	141.5	68%	0.68	73%	0.731	S	S	*	*			trans	-103.7	108.1	175.6	-70.2	-77.6	0	0	0	109.7	A462	F460-A462 PolarHBondContact O-N 3.02Å
461	P	53.3	Low	55.9	Low	137 Å²	137	140.1 Å²	140.1	89%	0.89	72%	0.716	S	S	*	*	S	Bend	trans	-64.8	-25	179.7	-23.2	34.9	0	0	0	113.6	V459	V459-P461 WeakPolarHBondContact O-CD 3.47Å
462	A	54.7	Low	57.3	Low	73 Å²	73	142.1 Å²	142.1	60%	0.603	71%	0.71	S	S	*	*	S	Bend	trans	-139.8	144.7	169.8	0	0	0	0	0	109.9	F460 P464	F460-A462 PolarHBondContact O-N 3.02Å; A462-P464 WeakPolarHBondContact O-CD 3.37Å
463	R	57	Low	59.1	Low	224 Å²	224	144.3 Å²	144.3	85%	0.845	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-66.3	120.3	172.7	174.6	179.8	-76.7	-158.4	-2.3	108.6	V465	R463-V465 PolarHBondContact O-N 3.33Å
464	P	56.7	Low	61.2	Low	90 Å²	90	141.7 Å²	141.7	58%	0.584	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-60.9	130.7	176.5	24.4	-33.1	0	0	0	110.1	A462 T466	A462-P464 WeakPolarHBondContact O-CD 3.37Å; P464-T466 PolarHBondContact O-N 3.35Å
465	V	62.9	Low	63.3	Low	132 Å²	132	140.7 Å²	140.7	80%	0.8	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-56.1	124.4	-177.1	-179.4	0	0	0	0	109.5	R463 P467	R463-V465 PolarHBondContact O-N 3.33Å; V465-P467 WeakPolarHBondContact O-CD 3.42Å
466	T	67.1	Low	65.4	Low	113 Å²	113	139 Å²	139	69%	0.693	68%	0.676	S	S	*	*			trans	-54.7	113.7	-177.9	-62.3	0	0	0	0	109.9	P464	P464-T466 PolarHBondContact O-N 3.35Å
467	P	62.9	Low	67.5	Low	58 Å²	58	136.7 Å²	136.7	38%	0.377	67%	0.668	S	S	.	*			trans	-59.1	132.4	-170.1	-29	36.4	0	0	0	111.9	V465 K469	V465-P467 WeakPolarHBondContact O-CD 3.42Å; P467-K469 PolarHBondContact O-N 3.35Å
468	P	69.2	Low	70	Confident	84 Å²	84	134 Å²	134	55%	0.545	65%	0.649	S	S	.	*			trans	-47	130.8	-178.5	-32.5	35.4	0	0	0	112.5	R470 I471	P468-R470 PolarHBondContact O-N 2.91Å; P468-I471 HydrophobicContact CG-CD1 4.49Å; P468-I471 PolarHBondContact O-N 3.46Å
469	K	72.6	Confident	72	Confident	172 Å²	172	129 Å²	129	75%	0.748	63%	0.631	S	S	*	*	H	α-helix	trans	-50.5	-34.2	-172.2	-68.9	178.5	-179.7	173.1	0	112.7	P467 I471 R472 Q473	P467-K469 PolarHBondContact O-N 3.35Å; K469-I471 VanDerWaalsContact C-N 3.28Å; K469-I471 PolarHBondContact O-N 3.07Å; K469-R472 PolarHBondContact O-N 3.46Å; K469-Q473 WeakPolarHBondContact O-CB 3.35Å; K469-Q473 VanDerWaalsContact O-CG 3.28Å; K469-Q473 WeakPolarHBondContact O-CG 3.42Å; K469-Q473 PolarHBondContact O-N 3.4Å; K469-Q473 PolarHBondContact O-OE1 3.05Å
470	R	79.8	Confident	74.3	Confident	210 Å²	210	126.4 Å²	126.4	79%	0.792	61%	0.612	S	S	*	*	H	α-helix	trans	-52.1	-38.2	174.4	-169.4	177.4	-178	-174.8	0.3	113.7	P468 H474	P468-R470 PolarHBondContact O-N 2.91Å; R470-H474 WeakPolarHBondContact O-CB 3.43Å; R470-H474 PolarHBondContact O-N 3.2Å
471	I	78	Confident	76.5	Confident	85 Å²	85	125 Å²	125	44%	0.436	60%	0.603	S	S	.	*	H	α-helix	trans	-70	-46.9	180	-59.2	175.2	0	0	0	110.5	P468 K469 Q473 H474 R475	P468-I471 HydrophobicContact CG-CD1 4.49Å; P468-I471 PolarHBondContact O-N 3.46Å; K469-I471 VanDerWaalsContact C-N 3.28Å; K469-I471 PolarHBondContact O-N 3.07Å; I471-Q473 VanDerWaalsContact C-N 3.35Å; I471-H474 PolarHBondContact O-N 3.49Å; I471-R475 PolarHBondContact O-N 2.92Å
472	R	77.8	Confident	78.5	Confident	171 Å²	171	120.5 Å²	120.5	65%	0.645	57%	0.574	S	S	*	*	H	α-helix	trans	-66.3	-37.3	176.4	-68.3	-171.8	177.2	-165	-0.6	111.7	K469 Y476	K469-R472 PolarHBondContact O-N 3.46Å; R472-Y476 WeakPolarHBondContact O-CB 3.33Å; R472-Y476 PolarHBondContact O-N 3.14Å
473	Q	83.8	Confident	80.3	Confident	125 Å²	125	122.4 Å²	122.4	58%	0.584	57%	0.57	S	S	*	*	H	α-helix	trans	-65.1	-38.5	173	-73.6	168	-31.5	0	0	112.5	K469 I471 R477	K469-Q473 WeakPolarHBondContact O-CB 3.35Å; K469-Q473 VanDerWaalsContact O-CG 3.28Å; K469-Q473 WeakPolarHBondContact O-CG 3.42Å; K469-Q473 PolarHBondContact O-N 3.4Å; K469-Q473 PolarHBondContact O-OE1 3.05Å; I471-Q473 VanDerWaalsContact C-N 3.35Å; Q473-R477 VanDerWaalsContact O-CB 3.3Å; Q473-R477 WeakPolarHBondContact O-CB 3.3Å; Q473-R477 PolarHBondContact O-N 3Å
474	H	88.1	Confident	82	Confident	130 Å²	130	117.5 Å²	117.5	60%	0.602	56%	0.559	S	S	*	*	H	α-helix	trans	-66.7	-45.5	175.9	-170.7	-86.4	0	0	0	111.8	R470 I471 R477 S478	R470-H474 WeakPolarHBondContact O-CB 3.43Å; R470-H474 PolarHBondContact O-N 3.2Å; I471-H474 PolarHBondContact O-N 3.49Å; H474-R477 PolarHBondContact O-N 3.49Å; H474-S478 PolarHBondContact O-N 3.21Å
475	R	86.8	Confident	83.9	Confident	174 Å²	174	117 Å²	117	66%	0.657	55%	0.548	S	S	*	.	H	α-helix	trans	-57.3	-53.7	173.4	-70.3	-175.4	-177.6	-170	0.1	110.7	I471 R477 S478 D479	I471-R475 PolarHBondContact O-N 2.92Å; R475-R477 VanDerWaalsContact C-N 3.3Å; R475-R477 PolarHBondContact O-N 3.31Å; R475-S478 CarbonylContact O-C 3.46Å; R475-S478 WeakPolarHBondContact O-CA 3.33Å; R475-S478 VanDerWaalsContact O-CB 3.26Å; R475-S478 WeakPolarHBondContact O-CB 3.35Å; R475-S478 PolarHBondContact O-N 3.03Å; R475-D479 VanDerWaalsContact C-OD2 3.3Å; R475-D479 PolarHBondContact O-N 3.03Å; R475-D479 VanDerWaalsContact O-OD2 3.08Å
476	Y	89	Confident	85.5	Confident	150 Å²	150	117.2 Å²	117.2	59%	0.588	54%	0.535	S	S	*	.	H	α-helix	trans	-56.7	-38.6	177.4	-178	-115.4	0	0	0	113.8	R472 S478 D479 L480	R472-Y476 WeakPolarHBondContact O-CB 3.33Å; R472-Y476 PolarHBondContact O-N 3.14Å; Y476-S478 VanDerWaalsContact C-N 3.35Å; Y476-D479 PolarHBondContact O-N 3.47Å; Y476-L480 HydrophobicContact CD1-CD1 3.99Å; Y476-L480 HydrophobicContact CD2-CG 4.47Å; Y476-L480 HydrophobicContact CE1-CD1 3.5Å; Y476-L480 VanDerWaalsContact CE1-CD1 3.5Å; Y476-L480 HydrophobicContact CE1-CG 4.24Å; Y476-L480 HydrophobicContact CE2-CD1 4.24Å; Y476-L480 HydrophobicContact CE2-CD2 4.39Å; Y476-L480 HydrophobicContact CE2-CG 4.1Å; Y476-L480 WeakPolarHBondContact O-CB 3.42Å; Y476-L480 WeakPolarHBondContact O-CG 3.39Å; Y476-L480 PolarHBondContact O-N 2.87Å
477	R	89.7	Confident	86.7	Confident	173 Å²	173	120.8 Å²	120.8	65%	0.653	54%	0.536	S	S	*	.	H	α-helix	trans	-65.9	-36	173.5	-177.2	176.9	179.5	176.6	0	112.3	Q473 H474 R475 R481	Q473-R477 VanDerWaalsContact O-CB 3.3Å; Q473-R477 WeakPolarHBondContact O-CB 3.3Å; Q473-R477 PolarHBondContact O-N 3Å; H474-R477 PolarHBondContact O-N 3.49Å; R475-R477 VanDerWaalsContact C-N 3.3Å; R475-R477 PolarHBondContact O-N 3.31Å; R477-R481 WeakPolarHBondContact O-CB 3.36Å; R477-R481 PolarHBondContact O-N 3.03Å
478	S	93.3	Very high	88.3	Confident	49 Å²	49	124.3 Å²	124.3	34%	0.343	55%	0.547	S	S	.	.	H	α-helix	trans	-69	-46.1	173.9	-154.8	0	0	0	0	111.3	H474 R475 Y476 L480 R481 S482	H474-S478 PolarHBondContact O-N 3.21Å; R475-S478 CarbonylContact O-C 3.46Å; R475-S478 WeakPolarHBondContact O-CA 3.33Å; R475-S478 VanDerWaalsContact O-CB 3.26Å; R475-S478 WeakPolarHBondContact O-CB 3.35Å; R475-S478 PolarHBondContact O-N 3.03Å; Y476-S478 VanDerWaalsContact C-N 3.35Å; S478-L480 VanDerWaalsContact C-N 3.35Å; S478-L480 PolarHBondContact O-N 3.49Å; S478-R481 WeakPolarHBondContact O-CB 3.43Å; S478-R481 PolarHBondContact O-N 3.06Å; S478-R481 VanDerWaalsContact O-N 3.12Å; S478-S482 PolarHBondContact O-N 2.74Å
479	D	94.8	Very high	89.5	Confident	84 Å²	84	125.9 Å²	125.9	45%	0.449	55%	0.547	S	S	.	.	H	α-helix	trans	-60.1	-44.7	178.6	-57.9	-38.9	0	0	0	111.2	R475 Y476 S482 Q483	R475-D479 VanDerWaalsContact C-OD2 3.3Å; R475-D479 PolarHBondContact O-N 3.03Å; R475-D479 VanDerWaalsContact O-OD2 3.08Å; Y476-D479 PolarHBondContact O-N 3.47Å; D479-S482 PolarHBondContact O-N 3.11Å; D479-Q483 VanDerWaalsContact O-CG 3.27Å; D479-Q483 WeakPolarHBondContact O-CG 3.31Å; D479-Q483 PolarHBondContact O-N 3.17Å
480	L	93.4	Very high	90.6	Very high	65 Å²	65	123 Å²	123	34%	0.34	54%	0.54	S	S	.	.	H	α-helix	trans	-61.7	-43.6	172.9	-78.4	177.7	0	0	0	112.3	Y476 S478 S482 Q483 M484	Y476-L480 HydrophobicContact CD1-CD1 3.99Å; Y476-L480 HydrophobicContact CD2-CG 4.47Å; Y476-L480 HydrophobicContact CE1-CD1 3.5Å; Y476-L480 VanDerWaalsContact CE1-CD1 3.5Å; Y476-L480 HydrophobicContact CE1-CG 4.24Å; Y476-L480 HydrophobicContact CE2-CD1 4.24Å; Y476-L480 HydrophobicContact CE2-CD2 4.39Å; Y476-L480 HydrophobicContact CE2-CG 4.1Å; Y476-L480 WeakPolarHBondContact O-CB 3.42Å; Y476-L480 WeakPolarHBondContact O-CG 3.39Å; Y476-L480 PolarHBondContact O-N 2.87Å; S478-L480 VanDerWaalsContact C-N 3.35Å; S478-L480 PolarHBondContact O-N 3.49Å; L480-S482 PolarHBondContact O-N 2.91Å; L480-Q483 WeakPolarHBondContact O-CB 3.19Å; L480-Q483 PolarHBondContact O-N 3.11Å; L480-M484 WeakPolarHBondContact O-CG 3.39Å; L480-M484 PolarHBondContact O-N 3.23Å
481	R	95.1	Very high	91.4	Very high	127 Å²	127	116.4 Å²	116.4	48%	0.479	52%	0.522	S	S	.	.	H	α-helix	trans	-59.3	-48.6	176.7	-173.1	-169	-78.7	139.4	-11.2	110.3	R477 S478 Q483 M484 E485	R477-R481 WeakPolarHBondContact O-CB 3.36Å; R477-R481 PolarHBondContact O-N 3.03Å; S478-R481 WeakPolarHBondContact O-CB 3.43Å; S478-R481 PolarHBondContact O-N 3.06Å; S478-R481 VanDerWaalsContact O-N 3.12Å; R481-Q483 VanDerWaalsContact C-N 3.29Å; R481-Q483 PolarHBondContact O-N 3.33Å; R481-M484 CarbonylContact O-C 3.6Å; R481-M484 WeakPolarHBondContact O-CA 3.25Å; R481-M484 WeakPolarHBondContact O-CB 3.35Å; R481-M484 PolarHBondContact O-N 3.5Å; R481-E485 VanDerWaalsContact CD-OE1 3.24Å; R481-E485 WeakPolarHBondContact CD-OE1 3.33Å; R481-E485 HydrophobicContact CG-CG 4.4Å; R481-E485 VanDerWaalsContact CG-OE1 3.26Å; R481-E485 WeakPolarHBondContact CG-OE1 3.29Å; R481-E485 WeakPolarHBondContact O-CG 3.37Å; R481-E485 PolarHBondContact O-N 2.91Å
482	S	95.4	Very high	92.2	Very high	41 Å²	41	114.4 Å²	114.4	29%	0.287	52%	0.518	S	S	.	.	H	α-helix	trans	-71.8	-19.4	178.5	-58.6	0	0	0	0	114	S478 D479 L480 E485 R486	S478-S482 PolarHBondContact O-N 2.74Å; D479-S482 PolarHBondContact O-N 3.11Å; L480-S482 PolarHBondContact O-N 2.91Å; S482-E485 WeakPolarHBondContact CA-OE2 3.42Å; S482-E485 PolarHBondContact OG-OE2 3.03Å; S482-E485 VanDerWaalsContact OG-OE2 3.09Å; S482-R486 WeakPolarHBondContact O-CB 3.42Å; S482-R486 WeakPolarHBondContact O-CG 3.41Å; S482-R486 PolarHBondContact O-N 3.21Å; S482-R486 PolarHBondContact O-NE 3.49Å; S482-R486 PolarHBondContact O-NH2 3.42Å
483	Q	93.8	Very high	93	Very high	113 Å²	113	111.8 Å²	111.8	53%	0.528	51%	0.513	S	S	.	.	H	α-helix	trans	-71.6	-40.2	164.7	-74.4	171.3	18.6	0	0	111.9	D479 L480 R481 R487	D479-Q483 VanDerWaalsContact O-CG 3.27Å; D479-Q483 WeakPolarHBondContact O-CG 3.31Å; D479-Q483 PolarHBondContact O-N 3.17Å; L480-Q483 WeakPolarHBondContact O-CB 3.19Å; L480-Q483 PolarHBondContact O-N 3.11Å; R481-Q483 VanDerWaalsContact C-N 3.29Å; R481-Q483 PolarHBondContact O-N 3.33Å; Q483-R487 WeakPolarHBondContact O-CB 3.39Å; Q483-R487 PolarHBondContact O-N 2.91Å
484	M	91.6	Very high	93.5	Very high	122 Å²	122	109.1 Å²	109.1	60%	0.601	50%	0.503	S	S	*	.	H	α-helix	trans	-64.8	-45.4	174	-68.9	175.9	64.3	0	0	111.7	L480 R481 R487 Q488	L480-M484 WeakPolarHBondContact O-CG 3.39Å; L480-M484 PolarHBondContact O-N 3.23Å; R481-M484 CarbonylContact O-C 3.6Å; R481-M484 WeakPolarHBondContact O-CA 3.25Å; R481-M484 WeakPolarHBondContact O-CB 3.35Å; R481-M484 PolarHBondContact O-N 3.5Å; M484-R487 PolarHBondContact O-N 3.12Å; M484-Q488 WeakPolarHBondContact O-CG 3.49Å; M484-Q488 PolarHBondContact O-N 2.9Å
485	E	96.1	Very high	93.8	Very high	79 Å²	79	108.1 Å²	108.1	37%	0.369	50%	0.499	S	S	.	.	H	α-helix	trans	-59.3	-49.6	177.2	-69.6	159.3	171.7	0	0	111.1	R481 S482 R487 Q488 Q489	R481-E485 VanDerWaalsContact CD-OE1 3.24Å; R481-E485 WeakPolarHBondContact CD-OE1 3.33Å; R481-E485 HydrophobicContact CG-CG 4.4Å; R481-E485 VanDerWaalsContact CG-OE1 3.26Å; R481-E485 WeakPolarHBondContact CG-OE1 3.29Å; R481-E485 WeakPolarHBondContact O-CG 3.37Å; R481-E485 PolarHBondContact O-N 2.91Å; S482-E485 WeakPolarHBondContact CA-OE2 3.42Å; S482-E485 PolarHBondContact OG-OE2 3.03Å; S482-E485 VanDerWaalsContact OG-OE2 3.09Å; E485-R487 VanDerWaalsContact C-N 3.34Å; E485-R487 PolarHBondContact O-N 3.43Å; E485-Q488 PolarHBondContact O-N 2.94Å; E485-Q489 WeakPolarHBondContact O-CG 3.26Å; E485-Q489 PolarHBondContact O-N 3.1Å
486	R	96.2	Very high	94.1	Very high	136 Å²	136	106.3 Å²	106.3	51%	0.513	50%	0.498	S	S	.	.	H	α-helix	trans	-61	-39	174.9	-78.7	174.4	-70.9	-153.7	-3.8	112.6	S482 Q489 L490	S482-R486 WeakPolarHBondContact O-CB 3.42Å; S482-R486 WeakPolarHBondContact O-CG 3.41Å; S482-R486 PolarHBondContact O-N 3.21Å; S482-R486 PolarHBondContact O-NE 3.49Å; S482-R486 PolarHBondContact O-NH2 3.42Å; R486-Q489 PolarHBondContact O-N 2.88Å; R486-L490 WeakPolarHBondContact O-CB 3.35Å; R486-L490 WeakPolarHBondContact O-CG 3.47Å; R486-L490 PolarHBondContact O-N 3.3Å
487	R	94.4	Very high	94.4	Very high	189 Å²	189	106.8 Å²	106.8	71%	0.713	50%	0.5	S	S	*	.	H	α-helix	trans	-66.7	-38.8	176	-173.6	177.1	178.7	-170.8	-1	111.9	Q483 M484 E485 V491	Q483-R487 WeakPolarHBondContact O-CB 3.39Å; Q483-R487 PolarHBondContact O-N 2.91Å; M484-R487 PolarHBondContact O-N 3.12Å; E485-R487 VanDerWaalsContact C-N 3.34Å; E485-R487 PolarHBondContact O-N 3.43Å; R487-V491 VanDerWaalsContact O-CG2 3.31Å; R487-V491 WeakPolarHBondContact O-CG2 3.26Å; R487-V491 PolarHBondContact O-N 2.81Å
488	Q	95.3	Very high	94.6	Very high	131 Å²	131	105.2 Å²	105.2	61%	0.612	49%	0.494	S	S	*	.	H	α-helix	trans	-66.2	-42.5	174.9	-75	172.8	-22.6	0	0	111.4	M484 E485 V491 A492	M484-Q488 WeakPolarHBondContact O-CG 3.49Å; M484-Q488 PolarHBondContact O-N 2.9Å; E485-Q488 PolarHBondContact O-N 2.94Å; Q488-V491 PolarHBondContact O-N 3.22Å; Q488-A492 WeakPolarHBondContact O-CB 3.47Å; Q488-A492 PolarHBondContact O-N 2.87Å
489	Q	95.6	Very high	94.8	Very high	117 Å²	117	108.2 Å²	108.2	55%	0.547	51%	0.505	S	S	.	.	H	α-helix	trans	-60.4	-46.4	174.5	-73.3	170	-14.3	0	0	112	E485 R486 V491 A492 Q493	E485-Q489 WeakPolarHBondContact O-CG 3.26Å; E485-Q489 PolarHBondContact O-N 3.1Å; R486-Q489 PolarHBondContact O-N 2.88Å; Q489-V491 PolarHBondContact O-N 2.91Å; Q489-A492 PolarHBondContact O-N 2.82Å; Q489-Q493 WeakPolarHBondContact O-CB 3.24Å; Q489-Q493 WeakPolarHBondContact O-CG 3.26Å; Q489-Q493 PolarHBondContact O-N 2.72Å
490	L	95.5	Very high	94.9	Very high	113 Å²	113	109 Å²	109	59%	0.592	51%	0.509	S	S	*	.	H	α-helix	trans	-62.8	-40.5	176.7	-73.2	168.8	0	0	0	112.4	R486 Q493 D494	R486-L490 WeakPolarHBondContact O-CB 3.35Å; R486-L490 WeakPolarHBondContact O-CG 3.47Å; R486-L490 PolarHBondContact O-N 3.3Å; L490-Q493 PolarHBondContact O-N 2.92Å; L490-D494 WeakPolarHBondContact O-CB 3.41Å; L490-D494 PolarHBondContact O-N 2.75Å
491	V	94.9	Very high	95	Very high	70 Å²	70	108.1 Å²	108.1	42%	0.424	51%	0.506	S	S	.	.	H	α-helix	trans	-66.7	-38.4	175.4	169.5	0	0	0	0	111.6	R487 Q488 Q489 Q495	R487-V491 VanDerWaalsContact O-CG2 3.31Å; R487-V491 WeakPolarHBondContact O-CG2 3.26Å; R487-V491 PolarHBondContact O-N 2.81Å; Q488-V491 PolarHBondContact O-N 3.22Å; Q489-V491 PolarHBondContact O-N 2.91Å; V491-Q495 WeakPolarHBondContact O-CB 3.46Å; V491-Q495 VanDerWaalsContact O-CG 3.25Å; V491-Q495 WeakPolarHBondContact O-CG 3.32Å; V491-Q495 PolarHBondContact O-N 2.7Å
492	A	94.7	Very high	95	Very high	43 Å²	43	106.8 Å²	106.8	36%	0.355	51%	0.505	S	S	.	.	H	α-helix	trans	-68.3	-38.1	175.6	0	0	0	0	0	112.3	Q488 Q489 Q495 Q496	Q488-A492 WeakPolarHBondContact O-CB 3.47Å; Q488-A492 PolarHBondContact O-N 2.87Å; Q489-A492 PolarHBondContact O-N 2.82Å; A492-Q495 PolarHBondContact O-N 2.88Å; A492-Q496 WeakPolarHBondContact O-CB 3.36Å; A492-Q496 VanDerWaalsContact O-CG 3.32Å; A492-Q496 WeakPolarHBondContact O-CG 3.48Å; A492-Q496 PolarHBondContact O-N 3.37Å
493	Q	95.2	Very high	95.1	Very high	116 Å²	116	113.3 Å²	113.3	54%	0.542	52%	0.524	S	S	.	.	H	α-helix	trans	-66.6	-42.7	174.1	-76.3	176.5	-23.8	0	0	112	Q489 L490 Q496 Y497	Q489-Q493 WeakPolarHBondContact O-CB 3.24Å; Q489-Q493 WeakPolarHBondContact O-CG 3.26Å; Q489-Q493 PolarHBondContact O-N 2.72Å; L490-Q493 PolarHBondContact O-N 2.92Å; Q493-Q496 PolarHBondContact O-N 3.35Å; Q493-Y497 WeakPolarHBondContact O-CB 3.35Å; Q493-Y497 PolarHBondContact O-N 3.27Å
494	D	93.7	Very high	95.2	Very high	70 Å²	70	112.2 Å²	112.2	37%	0.374	52%	0.521	S	S	.	.	H	α-helix	trans	-61.6	-43.1	174	176.8	65.3	0	0	0	111.5	L490 Y497 R498	L490-D494 WeakPolarHBondContact O-CB 3.41Å; L490-D494 PolarHBondContact O-N 2.75Å; D494-Y497 PolarHBondContact O-N 3.4Å; D494-R498 VanDerWaalsContact O-CG 3.32Å; D494-R498 WeakPolarHBondContact O-CG 3.47Å; D494-R498 PolarHBondContact O-N 3.34Å; D494-R498 IonicContact OD1-NE 3.92Å; D494-R498 IonicContact OD1-NH2 3.88Å; D494-R498 IonicContact OD2-CZ 3.45Å; D494-R498 IonicContact OD2-NE 2.65Å; D494-R498 PolarHBondContact OD2-NE 3.15Å; D494-R498 IonicContact OD2-NH2 3.68Å; D494-R498 PolarHBondContact OD2-NH2 2.99Å
495	Q	94.9	Very high	95.3	Very high	109 Å²	109	110.4 Å²	110.4	51%	0.509	51%	0.514	S	S	.	.	H	α-helix	trans	-60.9	-44	172.6	-74.8	170.5	-8.9	0	0	112.5	V491 A492 Y497 L499	V491-Q495 WeakPolarHBondContact O-CB 3.46Å; V491-Q495 VanDerWaalsContact O-CG 3.25Å; V491-Q495 WeakPolarHBondContact O-CG 3.32Å; V491-Q495 PolarHBondContact O-N 2.7Å; A492-Q495 PolarHBondContact O-N 2.88Å; Q495-Y497 VanDerWaalsContact C-N 3.34Å; Q495-L499 VanDerWaalsContact O-CG 3.3Å; Q495-L499 WeakPolarHBondContact O-CG 3.33Å; Q495-L499 PolarHBondContact O-N 3Å; Q495-L499 VanDerWaalsContact O-N 3.09Å
496	Q	93.4	Very high	95.2	Very high	136 Å²	136	112.1 Å²	112.1	64%	0.636	52%	0.522	S	S	*	.	H	α-helix	trans	-63.8	-38.2	175.4	-76.3	175.9	-14.1	0	0	112.4	A492 Q493 L500	A492-Q496 WeakPolarHBondContact O-CB 3.36Å; A492-Q496 VanDerWaalsContact O-CG 3.32Å; A492-Q496 WeakPolarHBondContact O-CG 3.48Å; A492-Q496 PolarHBondContact O-N 3.37Å; Q493-Q496 PolarHBondContact O-N 3.35Å; Q496-L500 WeakPolarHBondContact O-CB 3.48Å; Q496-L500 PolarHBondContact O-N 2.97Å; Q496-L500 VanDerWaalsContact O-N 3.1Å
497	Y	95.5	Very high	95.2	Very high	160 Å²	160	111.5 Å²	111.5	63%	0.627	53%	0.526	S	S	*	.	H	α-helix	trans	-66.2	-48.5	177.4	-172	-98.9	0	0	0	111.3	Q493 D494 Q495 L499 L500 T501	Q493-Y497 WeakPolarHBondContact O-CB 3.35Å; Q493-Y497 PolarHBondContact O-N 3.27Å; D494-Y497 PolarHBondContact O-N 3.4Å; Q495-Y497 VanDerWaalsContact C-N 3.34Å; Y497-L499 PolarHBondContact O-N 3.18Å; Y497-L500 WeakPolarHBondContact O-CA 3.47Å; Y497-L500 WeakPolarHBondContact O-CB 3.33Å; Y497-L500 PolarHBondContact O-N 3.14Å; Y497-T501 PolarHBondContact O-N 3.36Å; Y497-T501 PolarHBondContact O-OG1 3.04Å
498	R	94.7	Very high	95.2	Very high	140 Å²	140	108.4 Å²	108.4	53%	0.528	52%	0.52	S	S	.	.	H	α-helix	trans	-55.6	-48.8	175	-67.8	175	-159.8	-147.2	8.1	112.4	D494 L500 T501 E502	D494-R498 VanDerWaalsContact O-CG 3.32Å; D494-R498 WeakPolarHBondContact O-CG 3.47Å; D494-R498 PolarHBondContact O-N 3.34Å; D494-R498 IonicContact OD1-NE 3.92Å; D494-R498 IonicContact OD1-NH2 3.88Å; D494-R498 IonicContact OD2-CZ 3.45Å; D494-R498 IonicContact OD2-NE 2.65Å; D494-R498 PolarHBondContact OD2-NE 3.15Å; D494-R498 IonicContact OD2-NH2 3.68Å; D494-R498 PolarHBondContact OD2-NH2 2.99Å; R498-L500 PolarHBondContact O-N 2.93Å; R498-T501 PolarHBondContact O-N 3.47Å; R498-T501 VanDerWaalsContact O-N 3.14Å; R498-E502 WeakPolarHBondContact O-CB 3.43Å; R498-E502 WeakPolarHBondContact O-CG 3.35Å; R498-E502 PolarHBondContact O-N 2.85Å
499	L	97.2	Very high	95.3	Very high	111 Å²	111	106.9 Å²	106.9	58%	0.581	52%	0.516	S	S	*	.	H	α-helix	trans	-62.6	-27.6	178.1	-71.2	170.4	0	0	0	112.9	Q495 Y497 R503	Q495-L499 VanDerWaalsContact O-CG 3.3Å; Q495-L499 WeakPolarHBondContact O-CG 3.33Å; Q495-L499 PolarHBondContact O-N 3Å; Q495-L499 VanDerWaalsContact O-N 3.09Å; Y497-L499 PolarHBondContact O-N 3.18Å; L499-R503 WeakPolarHBondContact O-CB 3.36Å; L499-R503 PolarHBondContact O-N 3.1Å
500	L	96.8	Very high	95.3	Very high	101 Å²	101	106.8 Å²	106.8	53%	0.529	52%	0.517	S	S	.	.	H	α-helix	trans	-75.8	-44.4	173.2	-172.3	152	0	0	0	111	Q496 Y497 R498 R503 L504	Q496-L500 WeakPolarHBondContact O-CB 3.48Å; Q496-L500 PolarHBondContact O-N 2.97Å; Q496-L500 VanDerWaalsContact O-N 3.1Å; Y497-L500 WeakPolarHBondContact O-CA 3.47Å; Y497-L500 WeakPolarHBondContact O-CB 3.33Å; Y497-L500 PolarHBondContact O-N 3.14Å; R498-L500 PolarHBondContact O-N 2.93Å; L500-R503 PolarHBondContact O-N 3.1Å; L500-L504 HydrophobicContact CD2-CD1 3.68Å; L500-L504 HydrophobicContact CD2-CG 4.22Å; L500-L504 WeakPolarHBondContact O-CG 3.29Å; L500-L504 PolarHBondContact O-N 3.28Å
501	T	94.7	Very high	95.3	Very high	47 Å²	47	108.3 Å²	108.3	29%	0.288	52%	0.522	S	S	.	.	H	α-helix	trans	-58.8	-53.9	174	-54.5	0	0	0	0	111.3	Y497 R498 R503 L504 D505	Y497-T501 PolarHBondContact O-N 3.36Å; Y497-T501 PolarHBondContact O-OG1 3.04Å; R498-T501 PolarHBondContact O-N 3.47Å; R498-T501 VanDerWaalsContact O-N 3.14Å; T501-R503 PolarHBondContact O-N 3.29Å; T501-R503 VanDerWaalsContact O-N 3.08Å; T501-L504 WeakPolarHBondContact O-CA 3.18Å; T501-L504 WeakPolarHBondContact O-CB 3.48Å; T501-L504 PolarHBondContact O-N 2.9Å; T501-D505 VanDerWaalsContact O-CG 3.22Å; T501-D505 PolarHBondContact O-N 3.35Å
502	E	95.8	Very high	95.3	Very high	98 Å²	98	109.8 Å²	109.8	46%	0.458	52%	0.524	S	S	.	.	H	α-helix	trans	-53.2	-35.1	177.5	-72.4	168.5	-159.1	0	0	112.3	R498 Q506	R498-E502 WeakPolarHBondContact O-CB 3.43Å; R498-E502 WeakPolarHBondContact O-CG 3.35Å; R498-E502 PolarHBondContact O-N 2.85Å; E502-Q506 WeakPolarHBondContact O-CB 3.49Å; E502-Q506 WeakPolarHBondContact O-CG 3.31Å; E502-Q506 PolarHBondContact O-N 3.21Å
503	R	96.3	Very high	95.4	Very high	179 Å²	179	110.8 Å²	110.8	68%	0.675	52%	0.522	S	S	*	.	H	α-helix	trans	-77.5	-33.4	178.2	-163.5	176.4	-167.2	180	4.3	113.1	L499 L500 T501 M507	L499-R503 WeakPolarHBondContact O-CB 3.36Å; L499-R503 PolarHBondContact O-N 3.1Å; L500-R503 PolarHBondContact O-N 3.1Å; T501-R503 PolarHBondContact O-N 3.29Å; T501-R503 VanDerWaalsContact O-N 3.08Å; R503-M507 WeakPolarHBondContact O-CG 3.45Å; R503-M507 PolarHBondContact O-N 2.92Å; R503-M507 VanDerWaalsContact O-N 3.09Å
504	L	96.6	Very high	95.4	Very high	89 Å²	89	107.8 Å²	107.8	47%	0.466	52%	0.518	S	S	.	.	H	α-helix	trans	-67.2	-44.5	170.7	-70.5	175.5	0	0	0	110.8	L500 T501 Q506 M507 Q508	L500-L504 HydrophobicContact CD2-CD1 3.68Å; L500-L504 HydrophobicContact CD2-CG 4.22Å; L500-L504 WeakPolarHBondContact O-CG 3.29Å; L500-L504 PolarHBondContact O-N 3.28Å; T501-L504 WeakPolarHBondContact O-CA 3.18Å; T501-L504 WeakPolarHBondContact O-CB 3.48Å; T501-L504 PolarHBondContact O-N 2.9Å; L504-Q506 VanDerWaalsContact C-N 3.34Å; L504-Q506 PolarHBondContact O-N 2.86Å; L504-M507 PolarHBondContact O-N 3.4Å; L504-Q508 WeakPolarHBondContact O-CG 3.37Å; L504-Q508 PolarHBondContact O-N 3.22Å
505	D	94.1	Very high	95.6	Very high	85 Å²	85	109.2 Å²	109.2	46%	0.455	53%	0.525	S	S	.	.	H	α-helix	trans	-61.1	-43.2	178.2	-58.8	-20.5	0	0	0	110.9	T501 M507 Q508 L509	T501-D505 VanDerWaalsContact O-CG 3.22Å; T501-D505 PolarHBondContact O-N 3.35Å; D505-M507 PolarHBondContact O-N 3.04Å; D505-Q508 PolarHBondContact O-N 3.43Å; D505-L509 WeakPolarHBondContact O-CB 3.34Å; D505-L509 PolarHBondContact O-N 2.88Å
506	Q	94.6	Very high	95.6	Very high	115 Å²	115	108.2 Å²	108.2	54%	0.537	52%	0.52	S	S	.	.	H	α-helix	trans	-59.5	-42.3	171.5	-76.3	170.1	25.6	0	0	112.5	E502 L504 I510	E502-Q506 WeakPolarHBondContact O-CB 3.49Å; E502-Q506 WeakPolarHBondContact O-CG 3.31Å; E502-Q506 PolarHBondContact O-N 3.21Å; L504-Q506 VanDerWaalsContact C-N 3.34Å; L504-Q506 PolarHBondContact O-N 2.86Å; Q506-I510 WeakPolarHBondContact O-CB 3.27Å; Q506-I510 WeakPolarHBondContact O-CD1 3.48Å; Q506-I510 WeakPolarHBondContact O-CG1 3.3Å; Q506-I510 PolarHBondContact O-N 2.85Å
507	M	94.9	Very high	95.8	Very high	122 Å²	122	109.4 Å²	109.4	60%	0.601	52%	0.519	S	S	*	.	H	α-helix	trans	-67.2	-40.6	177.6	-77.6	-175	64.1	0	0	112.5	R503 L504 D505 I510 Q511	R503-M507 WeakPolarHBondContact O-CG 3.45Å; R503-M507 PolarHBondContact O-N 2.92Å; R503-M507 VanDerWaalsContact O-N 3.09Å; L504-M507 PolarHBondContact O-N 3.4Å; D505-M507 PolarHBondContact O-N 3.04Å; M507-I510 PolarHBondContact O-N 2.78Å; M507-Q511 WeakPolarHBondContact O-CB 3.4Å; M507-Q511 PolarHBondContact O-N 3.34Å
508	Q	94.9	Very high	95.8	Very high	125 Å²	125	104.3 Å²	104.3	58%	0.584	51%	0.51	S	S	*	.	H	α-helix	trans	-61.8	-46.7	174.9	-70.3	-179.8	17.8	0	0	111.1	L504 D505 I510 Q511 E512	L504-Q508 WeakPolarHBondContact O-CG 3.37Å; L504-Q508 PolarHBondContact O-N 3.22Å; D505-Q508 PolarHBondContact O-N 3.43Å; Q508-I510 PolarHBondContact O-N 2.89Å; Q508-Q511 WeakPolarHBondContact O-CB 3.36Å; Q508-Q511 PolarHBondContact O-N 3.09Å; Q508-Q511 VanDerWaalsContact O-N 3.17Å; Q508-E512 PolarHBondContact O-N 2.99Å
509	L	96.9	Very high	95.9	Very high	99 Å²	99	101.9 Å²	101.9	52%	0.518	50%	0.504	S	S	.	.	H	α-helix	trans	-61.6	-41	176.8	-179	61.5	0	0	0	112.2	D505 E512 I513	D505-L509 WeakPolarHBondContact O-CB 3.34Å; D505-L509 PolarHBondContact O-N 2.88Å; L509-E512 PolarHBondContact O-N 3.17Å; L509-I513 HydrophobicContact CD1-CD1 4.02Å; L509-I513 HydrophobicContact CD1-CG1 4.36Å; L509-I513 HydrophobicContact CG-CD1 3.92Å; L509-I513 WeakPolarHBondContact O-CB 3.3Å; L509-I513 WeakPolarHBondContact O-CD1 3.46Å; L509-I513 VanDerWaalsContact O-CG1 3.23Å; L509-I513 WeakPolarHBondContact O-CG1 3.35Å; L509-I513 PolarHBondContact O-N 3.37Å
510	I	95.9	Very high	95.7	Very high	114 Å²	114	101.8 Å²	101.8	59%	0.585	50%	0.501	S	S	*	.	H	α-helix	trans	-63.7	-41.5	174.7	-71.7	164.8	0	0	0	111	Q506 M507 Q508 I513 A514	Q506-I510 WeakPolarHBondContact O-CB 3.27Å; Q506-I510 WeakPolarHBondContact O-CD1 3.48Å; Q506-I510 WeakPolarHBondContact O-CG1 3.3Å; Q506-I510 PolarHBondContact O-N 2.85Å; M507-I510 PolarHBondContact O-N 2.78Å; Q508-I510 PolarHBondContact O-N 2.89Å; I510-I513 PolarHBondContact O-N 3Å; I510-A514 VanDerWaalsContact O-CB 3.31Å; I510-A514 WeakPolarHBondContact O-CB 3.22Å; I510-A514 PolarHBondContact O-N 3.34Å
511	Q	95.1	Very high	95.7	Very high	145 Å²	145	102.1 Å²	102.1	68%	0.678	50%	0.503	S	S	*	.	H	α-helix	trans	-65.1	-41.3	177.1	-175.4	175.8	-1.5	0	0	111.7	M507 Q508 A514 L515	M507-Q511 WeakPolarHBondContact O-CB 3.4Å; M507-Q511 PolarHBondContact O-N 3.34Å; Q508-Q511 WeakPolarHBondContact O-CB 3.36Å; Q508-Q511 PolarHBondContact O-N 3.09Å; Q508-Q511 VanDerWaalsContact O-N 3.17Å; Q511-A514 PolarHBondContact O-N 2.98Å; Q511-L515 WeakPolarHBondContact O-CB 3.26Å; Q511-L515 PolarHBondContact O-N 3.17Å
512	E	96.4	Very high	95.7	Very high	102 Å²	102	105.2 Å²	105.2	48%	0.477	51%	0.514	S	S	.	.	H	α-helix	trans	-65.6	-46.4	176.1	-159.1	-158.6	148.6	0	0	111.4	Q508 L509 A514 L515 Q516	Q508-E512 PolarHBondContact O-N 2.99Å; L509-E512 PolarHBondContact O-N 3.17Å; E512-A514 VanDerWaalsContact C-N 3.26Å; E512-A514 PolarHBondContact O-N 2.93Å; E512-L515 WeakPolarHBondContact O-CB 3.29Å; E512-L515 PolarHBondContact O-N 3.26Å; E512-L515 VanDerWaalsContact O-N 3.13Å; E512-Q516 WeakPolarHBondContact O-CG 3.16Å; E512-Q516 PolarHBondContact O-N 3.02Å; E512-Q516 PolarHBondContact OE1-NE2 2.66Å
513	I	95.9	Very high	95.8	Very high	63 Å²	63	106.6 Å²	106.6	32%	0.323	52%	0.519	S	S	.	.	H	α-helix	trans	-59.7	-38	175.1	-69.7	167.2	0	0	0	110.9	L509 I510 R517	L509-I513 HydrophobicContact CD1-CD1 4.02Å; L509-I513 HydrophobicContact CD1-CG1 4.36Å; L509-I513 HydrophobicContact CG-CD1 3.92Å; L509-I513 WeakPolarHBondContact O-CB 3.3Å; L509-I513 WeakPolarHBondContact O-CD1 3.46Å; L509-I513 VanDerWaalsContact O-CG1 3.23Å; L509-I513 WeakPolarHBondContact O-CG1 3.35Å; L509-I513 PolarHBondContact O-N 3.37Å; I510-I513 PolarHBondContact O-N 3Å; I513-R517 WeakPolarHBondContact O-CB 3.05Å; I513-R517 WeakPolarHBondContact O-CD 3.44Å; I513-R517 WeakPolarHBondContact O-CG 3.26Å; I513-R517 PolarHBondContact O-N 2.79Å
514	A	96	Very high	95.7	Very high	54 Å²	54	104.2 Å²	104.2	45%	0.446	51%	0.513	S	S	.	.	H	α-helix	trans	-66.3	-43.1	174.8	0	0	0	0	0	112.1	I510 Q511 E512 R517 A518	I510-A514 VanDerWaalsContact O-CB 3.31Å; I510-A514 WeakPolarHBondContact O-CB 3.22Å; I510-A514 PolarHBondContact O-N 3.34Å; Q511-A514 PolarHBondContact O-N 2.98Å; E512-A514 VanDerWaalsContact C-N 3.26Å; E512-A514 PolarHBondContact O-N 2.93Å; A514-R517 PolarHBondContact O-N 2.96Å; A514-A518 WeakPolarHBondContact O-CB 3.31Å; A514-A518 PolarHBondContact O-N 2.73Å
515	L	97.4	Very high	95.8	Very high	100 Å²	100	105.3 Å²	105.3	52%	0.524	52%	0.519	S	S	.	.	H	α-helix	trans	-62.5	-48.2	175.8	-179.5	63.9	0	0	0	111.6	Q511 E512 R517 A518 Q519	Q511-L515 WeakPolarHBondContact O-CB 3.26Å; Q511-L515 PolarHBondContact O-N 3.17Å; E512-L515 WeakPolarHBondContact O-CB 3.29Å; E512-L515 PolarHBondContact O-N 3.26Å; E512-L515 VanDerWaalsContact O-N 3.13Å; L515-R517 VanDerWaalsContact C-N 3.31Å; L515-R517 PolarHBondContact O-N 3.23Å; L515-A518 PolarHBondContact O-N 3.47Å; L515-Q519 WeakPolarHBondContact O-CG 3.49Å; L515-Q519 PolarHBondContact O-N 2.94Å
516	Q	94.9	Very high	95.9	Very high	87 Å²	87	104.9 Å²	104.9	41%	0.407	51%	0.514	S	S	.	.	H	α-helix	trans	-59	-42.1	175.4	-68.6	-177.4	15.6	0	0	111.4	E512 Q519 Q520	E512-Q516 WeakPolarHBondContact O-CG 3.16Å; E512-Q516 PolarHBondContact O-N 3.02Å; E512-Q516 PolarHBondContact OE1-NE2 2.66Å; Q516-Q519 PolarHBondContact O-N 2.8Å; Q516-Q520 WeakPolarHBondContact O-CG 3.32Å; Q516-Q520 PolarHBondContact O-N 3.4Å
517	R	96.9	Very high	95.9	Very high	161 Å²	161	106.9 Å²	106.9	61%	0.608	52%	0.521	S	S	*	.	H	α-helix	trans	-64.9	-40.6	174.9	-75.3	171.2	-178.2	-173.7	3.3	112.5	I513 A514 L515 Q520 L521	I513-R517 WeakPolarHBondContact O-CB 3.05Å; I513-R517 WeakPolarHBondContact O-CD 3.44Å; I513-R517 WeakPolarHBondContact O-CG 3.26Å; I513-R517 PolarHBondContact O-N 2.79Å; A514-R517 PolarHBondContact O-N 2.96Å; L515-R517 VanDerWaalsContact C-N 3.31Å; L515-R517 PolarHBondContact O-N 3.23Å; R517-Q520 PolarHBondContact O-N 3.01Å; R517-L521 WeakPolarHBondContact O-CG 3.3Å; R517-L521 PolarHBondContact O-N 2.86Å
518	A	95.5	Very high	95.9	Very high	53 Å²	53	105.4 Å²	105.4	44%	0.438	52%	0.519	S	S	.	.	H	α-helix	trans	-62.4	-45.2	175.5	0	0	0	0	0	111.4	A514 L515 Q520 L521 Q522	A514-A518 WeakPolarHBondContact O-CB 3.31Å; A514-A518 PolarHBondContact O-N 2.73Å; L515-A518 PolarHBondContact O-N 3.47Å; A518-Q520 VanDerWaalsContact C-N 3.35Å; A518-Q520 PolarHBondContact O-N 2.93Å; A518-L521 PolarHBondContact O-N 3.15Å; A518-L521 VanDerWaalsContact O-N 3.17Å; A518-Q522 PolarHBondContact O-N 2.84Å
519	Q	96.2	Very high	95.9	Very high	89 Å²	89	106.4 Å²	106.4	42%	0.416	52%	0.521	S	S	.	.	H	α-helix	trans	-61.3	-39.9	173.7	-68.5	178.4	12.4	0	0	112.5	L515 Q516 Q522 K523	L515-Q519 WeakPolarHBondContact O-CG 3.49Å; L515-Q519 PolarHBondContact O-N 2.94Å; Q516-Q519 PolarHBondContact O-N 2.8Å; Q519-Q522 PolarHBondContact O-N 3.42Å; Q519-K523 WeakPolarHBondContact O-CB 3.4Å; Q519-K523 VanDerWaalsContact O-CG 3.32Å; Q519-K523 WeakPolarHBondContact O-CG 3.3Å; Q519-K523 PolarHBondContact O-N 3.28Å
520	Q	94.6	Very high	95.8	Very high	110 Å²	110	108 Å²	108	51%	0.514	53%	0.526	S	S	.	.	H	α-helix	trans	-65.2	-37.2	174.2	-74	-179.3	20.6	0	0	112.4	Q516 R517 A518 K524	Q516-Q520 WeakPolarHBondContact O-CG 3.32Å; Q516-Q520 PolarHBondContact O-N 3.4Å; R517-Q520 PolarHBondContact O-N 3.01Å; A518-Q520 VanDerWaalsContact C-N 3.35Å; A518-Q520 PolarHBondContact O-N 2.93Å; Q520-K524 WeakPolarHBondContact O-CB 3.25Å; Q520-K524 VanDerWaalsContact O-CG 3.28Å; Q520-K524 WeakPolarHBondContact O-CG 3.35Å; Q520-K524 PolarHBondContact O-N 3.24Å
521	L	96.3	Very high	95.7	Very high	107 Å²	107	110 Å²	110	56%	0.56	53%	0.527	S	S	*	.	H	α-helix	trans	-67.8	-43.4	174.7	-73.7	169.6	0	0	0	111.5	R517 A518 K524 L525	R517-L521 WeakPolarHBondContact O-CG 3.3Å; R517-L521 PolarHBondContact O-N 2.86Å; A518-L521 PolarHBondContact O-N 3.15Å; A518-L521 VanDerWaalsContact O-N 3.17Å; L521-K524 WeakPolarHBondContact O-CB 3.44Å; L521-K524 PolarHBondContact O-N 2.92Å; L521-L525 WeakPolarHBondContact O-CG 3.49Å; L521-L525 PolarHBondContact O-N 3.35Å
522	Q	95.6	Very high	95.7	Very high	113 Å²	113	110.8 Å²	110.8	53%	0.528	52%	0.524	S	S	.	.	H	α-helix	trans	-59.1	-51.7	173.9	179.1	178.7	-14.6	0	0	111.2	A518 Q519 K524 L525 E526	A518-Q522 PolarHBondContact O-N 2.84Å; Q519-Q522 PolarHBondContact O-N 3.42Å; Q522-K524 PolarHBondContact O-N 2.95Å; Q522-L525 PolarHBondContact O-N 3.41Å; Q522-E526 HydrophobicContact CG-CG 4.42Å; Q522-E526 VanDerWaalsContact CG-OE1 3.24Å; Q522-E526 WeakPolarHBondContact CG-OE1 3.45Å; Q522-E526 PolarHBondContact NE2-OE1 2.68Å; Q522-E526 WeakPolarHBondContact O-CG 3.36Å; Q522-E526 PolarHBondContact O-N 3.36Å
523	K	95.9	Very high	95.6	Very high	127 Å²	127	113 Å²	113	55%	0.552	53%	0.532	S	S	*	.	H	α-helix	trans	-59.6	-30.5	177.2	-72.5	171	179.8	174.3	0	112.6	Q519 K527	Q519-K523 WeakPolarHBondContact O-CB 3.4Å; Q519-K523 VanDerWaalsContact O-CG 3.32Å; Q519-K523 WeakPolarHBondContact O-CG 3.3Å; Q519-K523 PolarHBondContact O-N 3.28Å; K523-K527 WeakPolarHBondContact O-CB 3.33Å; K523-K527 VanDerWaalsContact O-CG 3.28Å; K523-K527 WeakPolarHBondContact O-CG 3.49Å; K523-K527 PolarHBondContact O-N 2.94Å; K523-K527 VanDerWaalsContact O-N 3.13Å
524	K	96.1	Very high	95.4	Very high	129 Å²	129	112.1 Å²	112.1	56%	0.561	53%	0.534	S	S	*	.	H	α-helix	trans	-71	-47.7	170.7	-78.3	172.1	179.8	176.4	0	111.9	Q520 L521 Q522 E526 K527 T528	Q520-K524 WeakPolarHBondContact O-CB 3.25Å; Q520-K524 VanDerWaalsContact O-CG 3.28Å; Q520-K524 WeakPolarHBondContact O-CG 3.35Å; Q520-K524 PolarHBondContact O-N 3.24Å; L521-K524 WeakPolarHBondContact O-CB 3.44Å; L521-K524 PolarHBondContact O-N 2.92Å; Q522-K524 PolarHBondContact O-N 2.95Å; K524-E526 VanDerWaalsContact C-N 3.31Å; K524-E526 PolarHBondContact O-N 3.4Å; K524-K527 PolarHBondContact O-N 3.03Å; K524-T528 PolarHBondContact O-N 3.39Å; K524-T528 PolarHBondContact O-OG1 2.91Å; K524-T528 VanDerWaalsContact O-OG1 3.06Å
525	L	96.7	Very high	95.1	Very high	112 Å²	112	112.6 Å²	112.6	59%	0.586	53%	0.529	S	S	*	.	H	α-helix	trans	-60.6	-39.8	177.2	-71.6	171.1	0	0	0	111.9	L521 Q522 T528 K529	L521-L525 WeakPolarHBondContact O-CG 3.49Å; L521-L525 PolarHBondContact O-N 3.35Å; Q522-L525 PolarHBondContact O-N 3.41Å; L525-T528 PolarHBondContact O-N 2.97Å; L525-K529 WeakPolarHBondContact O-CB 3.4Å; L525-K529 VanDerWaalsContact O-CG 3.32Å; L525-K529 WeakPolarHBondContact O-CG 3.32Å; L525-K529 PolarHBondContact O-N 3.43Å
526	E	96.4	Very high	94.7	Very high	75 Å²	75	110.7 Å²	110.7	35%	0.35	52%	0.519	S	S	.	.	H	α-helix	trans	-62.5	-48.8	173.1	-73.5	163.4	178.9	0	0	111.2	Q522 K524 T528 K529 H530	Q522-E526 HydrophobicContact CG-CG 4.42Å; Q522-E526 VanDerWaalsContact CG-OE1 3.24Å; Q522-E526 WeakPolarHBondContact CG-OE1 3.45Å; Q522-E526 PolarHBondContact NE2-OE1 2.68Å; Q522-E526 WeakPolarHBondContact O-CG 3.36Å; Q522-E526 PolarHBondContact O-N 3.36Å; K524-E526 VanDerWaalsContact C-N 3.31Å; K524-E526 PolarHBondContact O-N 3.4Å; E526-T528 VanDerWaalsContact C-N 3.32Å; E526-T528 PolarHBondContact O-N 3.47Å; E526-K529 WeakPolarHBondContact O-CB 3.48Å; E526-K529 PolarHBondContact O-N 3.13Å; E526-K529 VanDerWaalsContact O-N 3.15Å; E526-H530 PolarHBondContact O-N 3.13Å; E526-H530 PolarHBondContact O-ND1 3.19Å
527	K	95.2	Very high	94.3	Very high	157 Å²	157	109.7 Å²	109.7	68%	0.683	52%	0.519	S	S	*	.	H	α-helix	trans	-59.3	-40.9	174.5	-76	178.6	178.4	-167.6	0	112.4	K523 K524 H530 Y531	K523-K527 WeakPolarHBondContact O-CB 3.33Å; K523-K527 VanDerWaalsContact O-CG 3.28Å; K523-K527 WeakPolarHBondContact O-CG 3.49Å; K523-K527 PolarHBondContact O-N 2.94Å; K523-K527 VanDerWaalsContact O-N 3.13Å; K524-K527 PolarHBondContact O-N 3.03Å; K527-H530 PolarHBondContact O-N 2.74Å; K527-Y531 WeakPolarHBondContact O-CB 3.4Å; K527-Y531 PolarHBondContact O-N 3.48Å
528	T	94.3	Very high	93.7	Very high	91 Å²	91	107.1 Å²	107.1	56%	0.558	51%	0.514	S	S	*	.	H	α-helix	trans	-65.1	-38.6	174.6	-57.6	0	0	0	0	112.1	K524 L525 E526 R532	K524-T528 PolarHBondContact O-N 3.39Å; K524-T528 PolarHBondContact O-OG1 2.91Å; K524-T528 VanDerWaalsContact O-OG1 3.06Å; L525-T528 PolarHBondContact O-N 2.97Å; E526-T528 VanDerWaalsContact C-N 3.32Å; E526-T528 PolarHBondContact O-N 3.47Å; T528-R532 VanDerWaalsContact O-CB 3.23Å; T528-R532 WeakPolarHBondContact O-CB 3.38Å; T528-R532 PolarHBondContact O-N 2.93Å
529	K	95.5	Very high	92.9	Very high	146 Å²	146	108.2 Å²	108.2	64%	0.635	52%	0.515	S	S	*	.	H	α-helix	trans	-64	-43.5	173.6	-76.3	174.1	179.8	-178	0	111.9	L525 E526 K533	L525-K529 WeakPolarHBondContact O-CB 3.4Å; L525-K529 VanDerWaalsContact O-CG 3.32Å; L525-K529 WeakPolarHBondContact O-CG 3.32Å; L525-K529 PolarHBondContact O-N 3.43Å; E526-K529 WeakPolarHBondContact O-CB 3.48Å; E526-K529 PolarHBondContact O-N 3.13Å; E526-K529 VanDerWaalsContact O-N 3.15Å; K529-K533 WeakPolarHBondContact O-CG 3.49Å; K529-K533 PolarHBondContact O-N 3.12Å
530	H	94.9	Very high	92	Very high	133 Å²	133	109.3 Å²	109.3	62%	0.616	52%	0.52	S	S	*	.	H	α-helix	trans	-67.1	-45.2	177.3	-72	88	0	0	0	111.9	E526 K527 R532 K533 A534	E526-H530 PolarHBondContact O-N 3.13Å; E526-H530 PolarHBondContact O-ND1 3.19Å; K527-H530 PolarHBondContact O-N 2.74Å; H530-R532 PolarHBondContact O-N 2.87Å; H530-K533 PolarHBondContact O-N 3.27Å; H530-A534 PolarHBondContact O-N 2.99Å
531	Y	94.4	Very high	90.7	Very high	156 Å²	156	108.8 Å²	108.8	61%	0.612	52%	0.521	S	S	*	.	H	α-helix	trans	-62	-42.5	175.5	179.6	-112.1	0	0	0	111.9	K527 A534 L535	K527-Y531 WeakPolarHBondContact O-CB 3.4Å; K527-Y531 PolarHBondContact O-N 3.48Å; Y531-A534 PolarHBondContact O-N 3.31Å; Y531-L535 HydrophobicContact CD1-CD1 4.14Å; Y531-L535 HydrophobicContact CE1-CD1 3.52Å; Y531-L535 HydrophobicContact CE1-CG 4.22Å; Y531-L535 HydrophobicContact CE2-CD1 4.42Å; Y531-L535 HydrophobicContact CE2-CD2 4.48Å; Y531-L535 HydrophobicContact CE2-CG 4.3Å; Y531-L535 PolarHBondContact O-N 3.11Å
532	R	95.1	Very high	89.3	Confident	161 Å²	161	110.7 Å²	110.7	61%	0.608	53%	0.525	S	S	*	.	H	α-helix	trans	-59	-50.2	172	174.6	174.3	170	177.9	-1.5	111.2	T528 H530 A534 L535 D536	T528-R532 VanDerWaalsContact O-CB 3.23Å; T528-R532 WeakPolarHBondContact O-CB 3.38Å; T528-R532 PolarHBondContact O-N 2.93Å; H530-R532 PolarHBondContact O-N 2.87Å; R532-A534 VanDerWaalsContact C-N 3.26Å; R532-A534 PolarHBondContact O-N 3.38Å; R532-L535 CarbonylContact O-C 3.59Å; R532-L535 PolarHBondContact O-N 3.48Å; R532-D536 VanDerWaalsContact CG-OD2 3.3Å; R532-D536 WeakPolarHBondContact CG-OD2 3.41Å; R532-D536 IonicContact CZ-OD2 3.49Å; R532-D536 IonicContact NE-OD1 3.22Å; R532-D536 IonicContact NE-OD2 2.94Å; R532-D536 PolarHBondContact NE-OD2 2.99Å; R532-D536 IonicContact NH2-OD2 3.29Å; R532-D536 PolarHBondContact NH2-OD2 3.26Å; R532-D536 WeakPolarHBondContact O-CB 3.37Å; R532-D536 PolarHBondContact O-N 2.95Å
533	K	93.3	Very high	87.4	Confident	149 Å²	149	110.9 Å²	110.9	65%	0.648	53%	0.527	S	S	*	.	H	α-helix	trans	-54.7	-43	177.3	-79.9	-174.2	171.6	-164.4	0	112.1	K529 H530 L535 D536 T537	K529-K533 WeakPolarHBondContact O-CG 3.49Å; K529-K533 PolarHBondContact O-N 3.12Å; H530-K533 PolarHBondContact O-N 3.27Å; K533-L535 VanDerWaalsContact C-N 3.32Å; K533-L535 PolarHBondContact O-N 3.41Å; K533-D536 PolarHBondContact O-N 2.89Å; K533-T537 WeakPolarHBondContact O-CG2 3.39Å; K533-T537 PolarHBondContact O-N 2.98Å; K533-T537 PolarHBondContact O-OG1 2.98Å
534	A	91.5	Very high	85.5	Confident	44 Å²	44	112.8 Å²	112.8	36%	0.364	54%	0.535	S	S	.	.	H	α-helix	trans	-68.1	-27.6	178.1	0	0	0	0	0	113.8	H530 Y531 R532 T537 Q538	H530-A534 PolarHBondContact O-N 2.99Å; Y531-A534 PolarHBondContact O-N 3.31Å; R532-A534 VanDerWaalsContact C-N 3.26Å; R532-A534 PolarHBondContact O-N 3.38Å; A534-T537 PolarHBondContact O-OG1 2.92Å; A534-Q538 WeakPolarHBondContact O-CB 3.33Å; A534-Q538 WeakPolarHBondContact O-CG 3.5Å; A534-Q538 PolarHBondContact O-N 3.32Å
535	L	90.1	Very high	83.5	Confident	65 Å²	65	112.1 Å²	112.1	34%	0.34	54%	0.542	S	S	.	.	H	α-helix	trans	-78	-41.6	169.8	-71.3	-179.4	0	0	0	112	Y531 R532 K533 T537 Q538 V539	Y531-L535 HydrophobicContact CD1-CD1 4.14Å; Y531-L535 HydrophobicContact CE1-CD1 3.52Å; Y531-L535 HydrophobicContact CE1-CG 4.22Å; Y531-L535 HydrophobicContact CE2-CD1 4.42Å; Y531-L535 HydrophobicContact CE2-CD2 4.48Å; Y531-L535 HydrophobicContact CE2-CG 4.3Å; Y531-L535 PolarHBondContact O-N 3.11Å; R532-L535 CarbonylContact O-C 3.59Å; R532-L535 PolarHBondContact O-N 3.48Å; K533-L535 VanDerWaalsContact C-N 3.32Å; K533-L535 PolarHBondContact O-N 3.41Å; L535-T537 VanDerWaalsContact C-N 3.33Å; L535-T537 PolarHBondContact O-N 2.87Å; L535-Q538 CarbonylContact O-C 3.6Å; L535-Q538 PolarHBondContact O-N 2.83Å; L535-V539 WeakPolarHBondContact O-CG2 3.46Å; L535-V539 PolarHBondContact O-N 3.44Å
536	D	90.3	Very high	81.2	Confident	60 Å²	60	110.6 Å²	110.6	32%	0.321	54%	0.541	S	S	.	.	H	α-helix	trans	-61.4	-42.9	178.5	-69.1	-9.2	0	0	0	109.2	R532 K533 V539 E540	R532-D536 VanDerWaalsContact CG-OD2 3.3Å; R532-D536 WeakPolarHBondContact CG-OD2 3.41Å; R532-D536 IonicContact CZ-OD2 3.49Å; R532-D536 IonicContact NE-OD1 3.22Å; R532-D536 IonicContact NE-OD2 2.94Å; R532-D536 PolarHBondContact NE-OD2 2.99Å; R532-D536 IonicContact NH2-OD2 3.29Å; R532-D536 PolarHBondContact NH2-OD2 3.26Å; R532-D536 WeakPolarHBondContact O-CB 3.37Å; R532-D536 PolarHBondContact O-N 2.95Å; K533-D536 PolarHBondContact O-N 2.89Å; D536-V539 WeakPolarHBondContact O-CB 3.46Å; D536-V539 PolarHBondContact O-N 3.01Å; D536-E540 WeakPolarHBondContact O-CG 3.42Å; D536-E540 PolarHBondContact O-N 2.9Å
537	T	85.4	Confident	78.5	Confident	66 Å²	66	112.3 Å²	112.3	41%	0.405	56%	0.56	S	S	.	*	H	α-helix	trans	-64.9	-42.2	171.7	56.6	0	0	0	0	112.9	K533 A534 L535 V539 E540 D541	K533-T537 WeakPolarHBondContact O-CG2 3.39Å; K533-T537 PolarHBondContact O-N 2.98Å; K533-T537 PolarHBondContact O-OG1 2.98Å; A534-T537 PolarHBondContact O-OG1 2.92Å; L535-T537 VanDerWaalsContact C-N 3.33Å; L535-T537 PolarHBondContact O-N 2.87Å; T537-V539 PolarHBondContact O-N 3.15Å; T537-E540 PolarHBondContact O-N 3.46Å; T537-E540 VanDerWaalsContact O-N 3.1Å; T537-D541 WeakPolarHBondContact O-CB 3.49Å; T537-D541 PolarHBondContact O-N 3.33Å
538	Q	83.6	Confident	76.1	Confident	107 Å²	107	109.6 Å²	109.6	50%	0.5	56%	0.561	S	S	.	*	H	α-helix	trans	-62.4	-23.2	174.1	-78.7	173.9	17.5	0	0	113.4	A534 L535 K542	A534-Q538 WeakPolarHBondContact O-CB 3.33Å; A534-Q538 WeakPolarHBondContact O-CG 3.5Å; A534-Q538 PolarHBondContact O-N 3.32Å; L535-Q538 CarbonylContact O-C 3.6Å; L535-Q538 PolarHBondContact O-N 2.83Å; Q538-K542 WeakPolarHBondContact O-CB 3.45Å; Q538-K542 WeakPolarHBondContact O-CD 3.49Å; Q538-K542 VanDerWaalsContact O-CG 3.29Å; Q538-K542 WeakPolarHBondContact O-CG 3.29Å; Q538-K542 PolarHBondContact O-N 3.44Å
539	V	80	Confident	73.6	Confident	75 Å²	75	113.8 Å²	113.8	46%	0.455	57%	0.574	S	S	.	*	H	α-helix	trans	-82	-43	171.8	171.3	0	0	0	0	110.1	L535 D536 T537 K542 M543	L535-V539 WeakPolarHBondContact O-CG2 3.46Å; L535-V539 PolarHBondContact O-N 3.44Å; D536-V539 WeakPolarHBondContact O-CB 3.46Å; D536-V539 PolarHBondContact O-N 3.01Å; T537-V539 PolarHBondContact O-N 3.15Å; V539-K542 CarbonylContact O-C 3.53Å; V539-K542 WeakPolarHBondContact O-CB 3.32Å; V539-K542 PolarHBondContact O-N 3.41Å; V539-M543 HydrophobicContact CG1-CE 4.02Å; V539-M543 HydrophobicContact CG1-CG 4.22Å; V539-M543 VanDerWaalsContact O-CG 3.24Å; V539-M543 WeakPolarHBondContact O-CG 3.43Å; V539-M543 PolarHBondContact O-N 2.94Å
540	E	76.6	Confident	71.1	Confident	112 Å²	112	112.3 Å²	112.3	52%	0.523	58%	0.581	S	S	.	*	H	α-helix	trans	-59.2	-48.6	174.4	-72.1	168.8	175.5	0	0	111.7	D536 T537 K542 M543 F544	D536-E540 WeakPolarHBondContact O-CG 3.42Å; D536-E540 PolarHBondContact O-N 2.9Å; T537-E540 PolarHBondContact O-N 3.46Å; T537-E540 VanDerWaalsContact O-N 3.1Å; E540-K542 PolarHBondContact O-N 2.91Å; E540-M543 WeakPolarHBondContact O-CA 3.25Å; E540-M543 WeakPolarHBondContact O-CB 3.43Å; E540-M543 PolarHBondContact O-N 3.23Å; E540-F544 WeakPolarHBondContact O-CD2 3.46Å; E540-F544 PolarHBondContact O-N 3.41Å
541	D	67.9	Low	68.8	Low	99 Å²	99	111.6 Å²	111.6	53%	0.529	59%	0.588	S	S	.	*	H	α-helix	trans	-53.4	-41.8	173.3	-65.7	-31.8	0	0	0	111.5	T537 T545	T537-D541 WeakPolarHBondContact O-CB 3.49Å; T537-D541 PolarHBondContact O-N 3.33Å; D541-T545 WeakPolarHBondContact O-CB 3.33Å; D541-T545 PolarHBondContact O-N 3.05Å; D541-T545 PolarHBondContact O-OG1 3.46Å
542	K	67.3	Low	66.9	Low	148 Å²	148	110.3 Å²	110.3	64%	0.643	60%	0.599	S	S	*	*	H	α-helix	trans	-72.7	-33.2	176	-79.6	177.8	178.5	176.9	0	113.4	Q538 V539 E540 T545 S546	Q538-K542 WeakPolarHBondContact O-CB 3.45Å; Q538-K542 WeakPolarHBondContact O-CD 3.49Å; Q538-K542 VanDerWaalsContact O-CG 3.29Å; Q538-K542 WeakPolarHBondContact O-CG 3.29Å; Q538-K542 PolarHBondContact O-N 3.44Å; V539-K542 CarbonylContact O-C 3.53Å; V539-K542 WeakPolarHBondContact O-CB 3.32Å; V539-K542 PolarHBondContact O-N 3.41Å; E540-K542 PolarHBondContact O-N 2.91Å; K542-T545 CarbonylContact O-C 3.56Å; K542-T545 WeakPolarHBondContact O-CB 3.46Å; K542-T545 PolarHBondContact O-N 3.23Å; K542-S546 WeakPolarHBondContact O-CB 3.3Å; K542-S546 PolarHBondContact O-N 3.45Å; K542-S546 PolarHBondContact O-OG 3.01Å
543	M	56	Low	64.7	Low	117 Å²	117	109.6 Å²	109.6	58%	0.576	61%	0.607	S	S	*	*	H	α-helix	trans	-66.9	-44.9	175	-71	-68.8	175.5	0	0	110	V539 E540 T545 S546 C547	V539-M543 HydrophobicContact CG1-CE 4.02Å; V539-M543 HydrophobicContact CG1-CG 4.22Å; V539-M543 VanDerWaalsContact O-CG 3.24Å; V539-M543 WeakPolarHBondContact O-CG 3.43Å; V539-M543 PolarHBondContact O-N 2.94Å; E540-M543 WeakPolarHBondContact O-CA 3.25Å; E540-M543 WeakPolarHBondContact O-CB 3.43Å; E540-M543 PolarHBondContact O-N 3.23Å; M543-T545 VanDerWaalsContact C-N 3.32Å; M543-T545 PolarHBondContact O-N 2.89Å; M543-S546 WeakPolarHBondContact CA-OG 3.34Å; M543-S546 CarbonylContact O-C 3.59Å; M543-S546 WeakPolarHBondContact O-CA 3.32Å; M543-S546 PolarHBondContact O-N 3.19Å; M543-S546 PolarHBondContact O-OG 3.27Å; M543-C547 PolarHBondContact O-N 2.95Å
544	F	55.1	Low	62.7	Low	166 Å²	166	112 Å²	112	73%	0.728	62%	0.618	S	S	*	*	H	α-helix	trans	-59.4	-41.3	170.2	-75	-67.1	0	0	0	112.1	E540 S546 C547	E540-F544 WeakPolarHBondContact O-CD2 3.46Å; E540-F544 PolarHBondContact O-N 3.41Å; F544-S546 PolarHBondContact O-N 3.45Å; F544-C547 PolarHBondContact O-N 3.38Å
545	T	54.3	Low	60.8	Low	115 Å²	115	115.6 Å²	115.6	71%	0.706	64%	0.637	S	S	*	*	H	α-helix	trans	-63.5	-27.2	173.3	-52.4	0	0	0	0	112.8	D541 K542 M543	D541-T545 WeakPolarHBondContact O-CB 3.33Å; D541-T545 PolarHBondContact O-N 3.05Å; D541-T545 PolarHBondContact O-OG1 3.46Å; K542-T545 CarbonylContact O-C 3.56Å; K542-T545 WeakPolarHBondContact O-CB 3.46Å; K542-T545 PolarHBondContact O-N 3.23Å; M543-T545 VanDerWaalsContact C-N 3.32Å; M543-T545 PolarHBondContact O-N 2.89Å
546	S	47.8	Very low	59.1	Low	80 Å²	80	124.1 Å²	124.1	56%	0.559	67%	0.665	S	S	*	*	H	α-helix	trans	-88.9	-4.2	179.9	70.4	0	0	0	0	115	K542 M543 F544 S548	K542-S546 WeakPolarHBondContact O-CB 3.3Å; K542-S546 PolarHBondContact O-N 3.45Å; K542-S546 PolarHBondContact O-OG 3.01Å; M543-S546 WeakPolarHBondContact CA-OG 3.34Å; M543-S546 CarbonylContact O-C 3.59Å; M543-S546 WeakPolarHBondContact O-CA 3.32Å; M543-S546 PolarHBondContact O-N 3.19Å; M543-S546 PolarHBondContact O-OG 3.27Å; F544-S546 PolarHBondContact O-N 3.45Å; S546-S548 PolarHBondContact O-N 3.49Å
547	C	40.2	Very low	57.3	Low	112 Å²	112	127 Å²	127	76%	0.757	68%	0.679	S	S	*	*			trans	-78.8	58.5	173.1	-78.6	0	0	0	0	111.9	M543 F544	M543-C547 PolarHBondContact O-N 2.95Å; F544-C547 PolarHBondContact O-N 3.38Å
548	S	44	Very low	55.7	Low	100 Å²	100	128.4 Å²	128.4	70%	0.699	69%	0.688	S	S	*	*	S	Bend	trans	-139.7	81.1	169.3	-166.4	0	0	0	0	109.7	S546	S546-S548 PolarHBondContact O-N 3.49Å
549	E	43.3	Very low	54.2	Low	179 Å²	179	134 Å²	134	84%	0.836	71%	0.705	S	S	*	*			trans	58.3	142.7	157.3	-54.4	-165.8	138.5	0	0	122.2
550	C	41.2	Very low	53.2	Low	115 Å²	115	134.8 Å²	134.8	78%	0.777	71%	0.712	S	S	*	*			trans	74.5	167.2	158.7	-64	0	0	0	0	117.4
551	P	47.7	Very low	52.3	Low	118 Å²	118	132.5 Å²	132.5	77%	0.766	70%	0.702	S	S	*	*				-116.2	173.7	-97	6.7	18.8	0	0	0	114.5
552	P	55.3	Low	52.2	Low	128 Å²	128	131 Å²	131	83%	0.831	70%	0.696	S	S	*	*			trans	-87.7	132.9	-167.3	33.4	-34.6	0	0	0	114.4
553	D	47.5	Very low	52.5	Low	146 Å²	146	126.5 Å²	126.5	78%	0.781	69%	0.687	S	S	*	*			trans	-158.5	111.7	157.1	-140	-18.2	0	0	0	113.4
554	K	51.3	Low	53.5	Low	201 Å²	201	125.7 Å²	125.7	87%	0.874	68%	0.684	S	S	*	*			trans	-179.2	144.7	156.9	-98.2	135.7	-153.1	151.4	0	112.6
555	P	51.4	Low	54.6	Low	119 Å²	119	124.6 Å²	124.6	77%	0.773	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-88	169.1	-169.3	35.2	-37.7	0	0	0	115.4
556	R	54.7	Low	55.7	Low	243 Å²	243	126.3 Å²	126.3	92%	0.917	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-61.4	132.7	174.6	-73.1	178.2	168.8	178.3	-3.6	112.1
557	L	51.8	Low	57.4	Low	120 Å²	120	124.1 Å²	124.1	63%	0.628	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-57.2	141.3	176.6	-72.7	94.8	0	0	0	112.6	E561 R565	L557-E561 VanDerWaalsContact CA-OE2 3.23Å; L557-E561 WeakPolarHBondContact CA-OE2 3.41Å; L557-E561 VanDerWaalsContact CB-OE2 3.22Å; L557-E561 WeakPolarHBondContact CB-OE2 3.49Å; L557-R565 VanDerWaalsContact CD2-NH2 3.27Å
558	T	52.9	Low	59.6	Low	97 Å²	97	122.9 Å²	122.9	60%	0.595	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-96.2	152.7	-170.8	-1.5	0	0	0	0	113	C560 E561	T558-C560 PolarHBondContact O-N 2.87Å; T558-E561 PolarHBondContact N-OE2 2.83Å; T558-E561 PolarHBondContact O-N 3.14Å
559	R	52.7	Low	61.5	Low	224 Å²	224	121.5 Å²	121.5	85%	0.845	63%	0.629	S	S	*	*	H	α-helix	trans	-50.1	-35.2	-177.3	-172.6	173.4	177.2	172.9	-2.2	113.5	E561 T562	R559-E561 PolarHBondContact O-N 3.26Å; R559-T562 PolarHBondContact O-N 3.06Å; R559-T562 PolarHBondContact O-OG1 2.94Å
560	C	58.1	Low	63.6	Low	91 Å²	91	120.3 Å²	120.3	62%	0.615	62%	0.617	S	S	*	*	H	α-helix	trans	-62.7	-35.9	-180	-60.4	0	0	0	0	113.8	T558 T562 A563 I564	T558-C560 PolarHBondContact O-N 2.87Å; C560-T562 PolarHBondContact O-N 3.46Å; C560-A563 WeakPolarHBondContact O-CA 3.41Å; C560-A563 WeakPolarHBondContact O-CB 3.47Å; C560-A563 PolarHBondContact O-N 3.42Å; C560-I564 PolarHBondContact O-N 2.84Å; C560-I564 VanDerWaalsContact O-N 3.11Å
561	E	58.7	Low	65.9	Low	65 Å²	65	121.6 Å²	121.6	30%	0.304	61%	0.609	S	S	.	*	H	α-helix	trans	-63.2	-31.7	179.2	-61.9	177.6	79.7	0	0	111.5	L557 T558 R559 A563 I564 R565	L557-E561 VanDerWaalsContact CA-OE2 3.23Å; L557-E561 WeakPolarHBondContact CA-OE2 3.41Å; L557-E561 VanDerWaalsContact CB-OE2 3.22Å; L557-E561 WeakPolarHBondContact CB-OE2 3.49Å; T558-E561 PolarHBondContact N-OE2 2.83Å; T558-E561 PolarHBondContact O-N 3.14Å; R559-E561 PolarHBondContact O-N 3.26Å; E561-A563 VanDerWaalsContact C-N 3.27Å; E561-A563 PolarHBondContact O-N 3.09Å; E561-I564 PolarHBondContact O-N 3.28Å; E561-R565 WeakPolarHBondContact O-CG 3.5Å; E561-R565 PolarHBondContact O-N 3.14Å
562	T	65.4	Low	67.9	Low	66 Å²	66	122.9 Å²	122.9	41%	0.405	60%	0.599	S	S	.	*	H	α-helix	trans	-69.3	-24	174.4	80.4	0	0	0	0	112.9	R559 C560 R566	R559-T562 PolarHBondContact O-N 3.06Å; R559-T562 PolarHBondContact O-OG1 2.94Å; C560-T562 PolarHBondContact O-N 3.46Å; T562-R566 WeakPolarHBondContact O-CB 3.5Å; T562-R566 WeakPolarHBondContact O-CD 3.44Å; T562-R566 WeakPolarHBondContact O-CG 3.25Å; T562-R566 PolarHBondContact O-N 3.3Å; T562-R566 PolarHBondContact O-NH1 3.1Å; T562-R566 PolarHBondContact OG1-NH1 2.87Å
563	A	73.8	Confident	69.5	Low	55 Å²	55	119.7 Å²	119.7	46%	0.455	58%	0.583	S	S	.	*	H	α-helix	trans	-79	-41	173.8	0	0	0	0	0	111	C560 E561 R566 A567	C560-A563 WeakPolarHBondContact O-CA 3.41Å; C560-A563 WeakPolarHBondContact O-CB 3.47Å; C560-A563 PolarHBondContact O-N 3.42Å; E561-A563 VanDerWaalsContact C-N 3.27Å; E561-A563 PolarHBondContact O-N 3.09Å; A563-R566 PolarHBondContact O-N 2.94Å; A563-A567 PolarHBondContact O-N 3.22Å
564	I	77.2	Confident	71.6	Confident	100 Å²	100	119.1 Å²	119.1	51%	0.513	58%	0.576	S	S	.	*	H	α-helix	trans	-60.3	-53	174.4	-62.5	170.2	0	0	0	110.1	C560 E561 R566 A567 E568	C560-I564 PolarHBondContact O-N 2.84Å; C560-I564 VanDerWaalsContact O-N 3.11Å; E561-I564 PolarHBondContact O-N 3.28Å; I564-R566 VanDerWaalsContact C-N 3.26Å; I564-R566 PolarHBondContact O-N 3.27Å; I564-A567 WeakPolarHBondContact O-CA 3.3Å; I564-A567 WeakPolarHBondContact O-CB 3.34Å; I564-A567 PolarHBondContact O-N 3.42Å; I564-E568 HydrophobicContact CG2-CG 4.49Å; I564-E568 WeakPolarHBondContact O-CG 3.46Å; I564-E568 PolarHBondContact O-N 3.46Å
565	R	76.4	Confident	73.6	Confident	143 Å²	143	117.5 Å²	117.5	54%	0.54	57%	0.568	S	S	.	*	H	α-helix	trans	-58	-34.5	176.7	-68	-179.9	-164.6	-166.1	6.8	112.9	L557 E561 S569	L557-R565 VanDerWaalsContact CD2-NH2 3.27Å; E561-R565 WeakPolarHBondContact O-CG 3.5Å; E561-R565 PolarHBondContact O-N 3.14Å; R565-S569 VanDerWaalsContact O-CB 3.31Å; R565-S569 WeakPolarHBondContact O-CB 3.2Å; R565-S569 PolarHBondContact O-N 3.13Å
566	R	78.1	Confident	75.6	Confident	150 Å²	150	115.6 Å²	115.6	57%	0.566	56%	0.555	S	S	*	*	H	α-helix	trans	-69.4	-38.3	172.8	-77.8	175.6	-178.5	113.9	-9.3	112.5	T562 A563 I564 S569 R570	T562-R566 WeakPolarHBondContact O-CB 3.5Å; T562-R566 WeakPolarHBondContact O-CD 3.44Å; T562-R566 WeakPolarHBondContact O-CG 3.25Å; T562-R566 PolarHBondContact O-N 3.3Å; T562-R566 PolarHBondContact O-NH1 3.1Å; T562-R566 PolarHBondContact OG1-NH1 2.87Å; A563-R566 PolarHBondContact O-N 2.94Å; I564-R566 VanDerWaalsContact C-N 3.26Å; I564-R566 PolarHBondContact O-N 3.27Å; R566-S569 PolarHBondContact O-N 3.05Å; R566-R570 WeakPolarHBondContact O-CG 3.31Å; R566-R570 PolarHBondContact O-N 3.18Å
567	A	84.1	Confident	77.3	Confident	35 Å²	35	107.7 Å²	107.7	29%	0.289	54%	0.537	S	S	.	.	H	α-helix	trans	-67.3	-41.6	174.7	0	0	0	0	0	112.1	A563 I564 S569 R570 K571	A563-A567 PolarHBondContact O-N 3.22Å; I564-A567 WeakPolarHBondContact O-CA 3.3Å; I564-A567 WeakPolarHBondContact O-CB 3.34Å; I564-A567 PolarHBondContact O-N 3.42Å; A567-S569 VanDerWaalsContact C-N 3.34Å; A567-R570 PolarHBondContact O-N 2.82Å; A567-K571 PolarHBondContact O-N 3.35Å
568	E	86.2	Confident	79.3	Confident	85 Å²	85	111.1 Å²	111.1	40%	0.397	54%	0.543	S	S	.	.	H	α-helix	trans	-62.6	-38.2	170.9	-67.8	171.6	-179.5	0	0	112.8	I564 K571 R572	I564-E568 HydrophobicContact CG2-CG 4.49Å; I564-E568 WeakPolarHBondContact O-CG 3.46Å; I564-E568 PolarHBondContact O-N 3.46Å; E568-K571 PolarHBondContact O-N 3.28Å; E568-R572 WeakPolarHBondContact O-CB 3.46Å; E568-R572 WeakPolarHBondContact O-CG 3.35Å; E568-R572 PolarHBondContact O-N 2.9Å; E568-R572 PolarHBondContact O-NE 3.43Å; E568-R572 IonicContact OE2-NH2 3.71Å; E568-R572 PolarHBondContact OE2-NH2 3.44Å
569	S	83.4	Confident	81.3	Confident	71 Å²	71	109.1 Å²	109.1	50%	0.497	54%	0.535	S	S	.	.	H	α-helix	trans	-63	-43.2	175.3	-173.5	0	0	0	0	110.7	R565 R566 A567 R572 A573	R565-S569 VanDerWaalsContact O-CB 3.31Å; R565-S569 WeakPolarHBondContact O-CB 3.2Å; R565-S569 PolarHBondContact O-N 3.13Å; R566-S569 PolarHBondContact O-N 3.05Å; A567-S569 VanDerWaalsContact C-N 3.34Å; S569-R572 PolarHBondContact O-N 2.89Å; S569-A573 WeakPolarHBondContact O-CB 3.35Å; S569-A573 PolarHBondContact O-N 3.32Å
570	R	87.1	Confident	83.2	Confident	154 Å²	154	103.2 Å²	103.2	58%	0.581	52%	0.521	S	S	*	.	H	α-helix	trans	-61	-45.7	171.4	-70	-173	-63.6	-98	4.9	112.5	R566 A567 R572 A573 Q574	R566-R570 WeakPolarHBondContact O-CG 3.31Å; R566-R570 PolarHBondContact O-N 3.18Å; A567-R570 PolarHBondContact O-N 2.82Å; R570-R572 VanDerWaalsContact C-N 3.32Å; R570-R572 PolarHBondContact O-N 2.63Å; R570-A573 PolarHBondContact O-N 2.89Å; R570-Q574 WeakPolarHBondContact O-CG 3.22Å; R570-Q574 PolarHBondContact O-N 3.22Å
571	K	90.6	Very high	84.9	Confident	142 Å²	142	105.7 Å²	105.7	62%	0.617	52%	0.521	S	S	*	.	H	α-helix	trans	-60.4	-38.9	175.3	-73.9	-179.1	176.4	-177.8	0	112.1	A567 E568 K575	A567-K571 PolarHBondContact O-N 3.35Å; E568-K571 PolarHBondContact O-N 3.28Å; K571-K575 WeakPolarHBondContact O-CG 3.26Å; K571-K575 PolarHBondContact O-N 3.36Å; K571-K575 VanDerWaalsContact O-N 3.12Å
572	R	90.2	Very high	86.6	Confident	146 Å²	146	104.3 Å²	104.3	55%	0.551	52%	0.524	S	S	*	.	H	α-helix	trans	-66.6	-46.3	174	-78.8	178.6	-89.2	-168.2	-11.3	111.8	E568 S569 R570 Q574 K575 V576	E568-R572 WeakPolarHBondContact O-CB 3.46Å; E568-R572 WeakPolarHBondContact O-CG 3.35Å; E568-R572 PolarHBondContact O-N 2.9Å; E568-R572 PolarHBondContact O-NE 3.43Å; E568-R572 IonicContact OE2-NH2 3.71Å; E568-R572 PolarHBondContact OE2-NH2 3.44Å; S569-R572 PolarHBondContact O-N 2.89Å; R570-R572 VanDerWaalsContact C-N 3.32Å; R570-R572 PolarHBondContact O-N 2.63Å; R572-Q574 VanDerWaalsContact C-N 3.32Å; R572-Q574 PolarHBondContact O-N 3.12Å; R572-K575 PolarHBondContact O-N 3.02Å; R572-V576 WeakPolarHBondContact O-CG2 3.48Å; R572-V576 PolarHBondContact O-N 2.89Å
573	A	88.3	Confident	88	Confident	60 Å²	60	104.7 Å²	104.7	50%	0.496	53%	0.526	S	S	.	.	H	α-helix	trans	-61.2	-38.8	176.7	0	0	0	0	0	112.4	S569 R570 V576 S577	S569-A573 WeakPolarHBondContact O-CB 3.35Å; S569-A573 PolarHBondContact O-N 3.32Å; R570-A573 PolarHBondContact O-N 2.89Å; A573-V576 PolarHBondContact O-N 3.47Å; A573-S577 WeakPolarHBondContact O-CB 3.37Å; A573-S577 PolarHBondContact O-N 3.43Å
574	Q	91.5	Very high	89	Confident	135 Å²	135	104.5 Å²	104.5	63%	0.631	53%	0.525	S	S	*	.	H	α-helix	trans	-63.5	-45.6	173.3	-75.2	172.4	-30	0	0	112.2	R570 R572 V576 S577 Y578	R570-Q574 WeakPolarHBondContact O-CG 3.22Å; R570-Q574 PolarHBondContact O-N 3.22Å; R572-Q574 VanDerWaalsContact C-N 3.32Å; R572-Q574 PolarHBondContact O-N 3.12Å; Q574-V576 VanDerWaalsContact C-N 3.35Å; Q574-V576 PolarHBondContact O-N 3.46Å; Q574-S577 PolarHBondContact O-N 2.98Å; Q574-Y578 PolarHBondContact O-N 3.26Å
575	K	93.6	Very high	89.8	Confident	166 Å²	166	102.1 Å²	102.1	72%	0.722	52%	0.515	S	S	*	.	H	α-helix	trans	-59.7	-42.7	174.3	-74.8	-175.7	174.9	-168.8	0	112.3	K571 R572 Y578 A579	K571-K575 WeakPolarHBondContact O-CG 3.26Å; K571-K575 PolarHBondContact O-N 3.36Å; K571-K575 VanDerWaalsContact O-N 3.12Å; R572-K575 PolarHBondContact O-N 3.02Å; K575-Y578 PolarHBondContact O-N 3.31Å; K575-A579 WeakPolarHBondContact O-CB 3.38Å; K575-A579 PolarHBondContact O-N 3.45Å
576	V	93.4	Very high	90.6	Very high	80 Å²	80	99 Å²	99	49%	0.485	51%	0.506	S	S	.	.	H	α-helix	trans	-66.4	-40.1	176	171.6	0	0	0	0	111.6	R572 A573 Q574 A579 N580	R572-V576 WeakPolarHBondContact O-CG2 3.48Å; R572-V576 PolarHBondContact O-N 2.89Å; A573-V576 PolarHBondContact O-N 3.47Å; Q574-V576 VanDerWaalsContact C-N 3.35Å; Q574-V576 PolarHBondContact O-N 3.46Å; V576-A579 PolarHBondContact O-N 3.14Å; V576-N580 WeakPolarHBondContact O-CB 3.43Å; V576-N580 PolarHBondContact O-N 3.32Å; V576-N580 PolarHBondContact O-ND2 2.84Å
577	S	90.9	Very high	91.5	Very high	77 Å²	77	99.7 Å²	99.7	54%	0.538	51%	0.509	S	S	.	.	H	α-helix	trans	-60.7	-45.7	175.6	-171.8	0	0	0	0	111.9	A573 Q574 N580 F581	A573-S577 WeakPolarHBondContact O-CB 3.37Å; A573-S577 PolarHBondContact O-N 3.43Å; Q574-S577 PolarHBondContact O-N 2.98Å; S577-N580 PolarHBondContact O-N 2.86Å; S577-F581 PolarHBondContact O-N 3.37Å
578	Y	93.7	Very high	92	Very high	192 Å²	192	105 Å²	105	75%	0.753	53%	0.526	S	S	*	.	H	α-helix	trans	-62.6	-44.5	175.9	-172.7	-93.4	0	0	0	112.2	Q574 K575 N580 F581 G582	Q574-Y578 PolarHBondContact O-N 3.26Å; K575-Y578 PolarHBondContact O-N 3.31Å; Y578-N580 PolarHBondContact O-N 2.99Å; Y578-F581 PolarHBondContact O-N 3.46Å; Y578-G582 PolarHBondContact O-N 2.93Å
579	A	93.3	Very high	92.5	Very high	54 Å²	54	108.3 Å²	108.3	45%	0.446	54%	0.535	S	S	.	.	H	α-helix	trans	-61.8	-42.6	175.1	0	0	0	0	0	112.3	K575 V576 F581 G582 V583	K575-A579 WeakPolarHBondContact O-CB 3.38Å; K575-A579 PolarHBondContact O-N 3.45Å; V576-A579 PolarHBondContact O-N 3.14Å; A579-F581 VanDerWaalsContact C-N 3.33Å; A579-F581 PolarHBondContact O-N 3.02Å; A579-G582 PolarHBondContact O-N 3.44Å; A579-V583 WeakPolarHBondContact O-CG2 3.23Å; A579-V583 PolarHBondContact O-N 2.89Å
580	N	93.2	Very high	93.2	Very high	100 Å²	100	108.7 Å²	108.7	54%	0.535	53%	0.529	S	S	.	.	H	α-helix	trans	-63	-37.6	176	-72.7	-14.7	0	0	0	112.1	V576 S577 Y578 V583 A584	V576-N580 WeakPolarHBondContact O-CB 3.43Å; V576-N580 PolarHBondContact O-N 3.32Å; V576-N580 PolarHBondContact O-ND2 2.84Å; S577-N580 PolarHBondContact O-N 2.86Å; Y578-N580 PolarHBondContact O-N 2.99Å; N580-V583 PolarHBondContact O-N 2.95Å; N580-A584 VanDerWaalsContact O-CB 3.29Å; N580-A584 WeakPolarHBondContact O-CB 3.37Å; N580-A584 PolarHBondContact O-N 3.06Å
581	F	93.5	Very high	93.6	Very high	144 Å²	144	107.7 Å²	107.7	63%	0.632	53%	0.53	S	S	*	.	H	α-helix	trans	-65.4	-40	173.5	-175.8	-95.7	0	0	0	111.9	S577 Y578 A579 A584 T585	S577-F581 PolarHBondContact O-N 3.37Å; Y578-F581 PolarHBondContact O-N 3.46Å; A579-F581 VanDerWaalsContact C-N 3.33Å; A579-F581 PolarHBondContact O-N 3.02Å; F581-A584 PolarHBondContact O-N 2.96Å; F581-T585 HydrophobicContact CD1-CG2 4.22Å; F581-T585 HydrophobicContact CE1-CG2 3.8Å; F581-T585 HydrophobicContact CE2-CG2 4.23Å; F581-T585 HydrophobicContact CZ-CG2 3.8Å; F581-T585 WeakPolarHBondContact O-CB 3.19Å; F581-T585 WeakPolarHBondContact O-CG2 3.45Å; F581-T585 PolarHBondContact O-N 3.01Å; F581-T585 PolarHBondContact O-OG1 3.09Å
582	G	94.7	Very high	93.8	Very high	35 Å²	35	106.8 Å²	106.8	36%	0.361	53%	0.53	S	S	.	.	H	α-helix	trans	-58.7	-49	171.4	0	0	0	0	0	112.4	Y578 A579 A584 T585 Q586	Y578-G582 PolarHBondContact O-N 2.93Å; A579-G582 PolarHBondContact O-N 3.44Å; G582-A584 PolarHBondContact O-N 3.46Å; G582-T585 PolarHBondContact O-N 3.49Å; G582-T585 PolarHBondContact O-OG1 2.87Å; G582-T585 VanDerWaalsContact O-OG1 3.05Å; G582-Q586 VanDerWaalsContact O-CB 3.26Å; G582-Q586 WeakPolarHBondContact O-CB 3.39Å; G582-Q586 PolarHBondContact O-N 3.08Å
583	V	95.5	Very high	94.1	Very high	74 Å²	74	105.3 Å²	105.3	45%	0.448	53%	0.529	S	S	.	.	H	α-helix	trans	-64.3	-39	177.2	174.8	0	0	0	0	112	A579 N580 R587	A579-V583 WeakPolarHBondContact O-CG2 3.23Å; A579-V583 PolarHBondContact O-N 2.89Å; N580-V583 PolarHBondContact O-N 2.95Å; V583-R587 WeakPolarHBondContact O-CB 3.42Å; V583-R587 WeakPolarHBondContact O-CG 3.23Å; V583-R587 PolarHBondContact O-N 3.16Å
584	A	93.8	Very high	94.4	Very high	52 Å²	52	107.1 Å²	107.1	43%	0.43	53%	0.53	S	S	.	.	H	α-helix	trans	-69.3	-39.4	179	0	0	0	0	0	112.9	N580 F581 G582 K588	N580-A584 VanDerWaalsContact O-CB 3.29Å; N580-A584 WeakPolarHBondContact O-CB 3.37Å; N580-A584 PolarHBondContact O-N 3.06Å; F581-A584 PolarHBondContact O-N 2.96Å; G582-A584 PolarHBondContact O-N 3.46Å; A584-K588 PolarHBondContact O-N 2.9Å
585	T	94.2	Very high	94.6	Very high	49 Å²	49	106.2 Å²	106.2	30%	0.301	52%	0.521	S	S	.	.	H	α-helix	trans	-71.6	-36.7	175.1	50.5	0	0	0	0	112	F581 G582 K588 R589	F581-T585 HydrophobicContact CD1-CG2 4.22Å; F581-T585 HydrophobicContact CE1-CG2 3.8Å; F581-T585 HydrophobicContact CE2-CG2 4.23Å; F581-T585 HydrophobicContact CZ-CG2 3.8Å; F581-T585 WeakPolarHBondContact O-CB 3.19Å; F581-T585 WeakPolarHBondContact O-CG2 3.45Å; F581-T585 PolarHBondContact O-N 3.01Å; F581-T585 PolarHBondContact O-OG1 3.09Å; G582-T585 PolarHBondContact O-N 3.49Å; G582-T585 PolarHBondContact O-OG1 2.87Å; G582-T585 VanDerWaalsContact O-OG1 3.05Å; T585-K588 PolarHBondContact O-N 3.01Å; T585-R589 WeakPolarHBondContact O-CG 3.35Å; T585-R589 PolarHBondContact O-N 2.67Å
586	Q	94.4	Very high	94.7	Very high	77 Å²	77	104.1 Å²	104.1	36%	0.36	51%	0.514	S	S	.	.	H	α-helix	trans	-63.7	-47.6	173.3	179.9	56.2	22.1	0	0	112.1	G582 K588 R589 E590	G582-Q586 VanDerWaalsContact O-CB 3.26Å; G582-Q586 WeakPolarHBondContact O-CB 3.39Å; G582-Q586 PolarHBondContact O-N 3.08Å; Q586-K588 VanDerWaalsContact C-N 3.28Å; Q586-K588 PolarHBondContact O-N 3.29Å; Q586-R589 WeakPolarHBondContact O-CA 3.45Å; Q586-R589 WeakPolarHBondContact O-CB 3.48Å; Q586-R589 PolarHBondContact O-N 3.4Å; Q586-E590 VanDerWaalsContact CG-OE1 3.3Å; Q586-E590 WeakPolarHBondContact CG-OE1 3.44Å; Q586-E590 PolarHBondContact NE2-OE1 3.34Å; Q586-E590 PolarHBondContact O-N 3.38Å
587	R	95.8	Very high	94.9	Very high	166 Å²	166	105.7 Å²	105.7	63%	0.626	52%	0.519	S	S	*	.	H	α-helix	trans	-57.6	-38	175.6	-76.8	176	-179.4	-179.2	1.1	113.3	V583 R589 E590 E591	V583-R587 WeakPolarHBondContact O-CB 3.42Å; V583-R587 WeakPolarHBondContact O-CG 3.23Å; V583-R587 PolarHBondContact O-N 3.16Å; R587-R589 VanDerWaalsContact C-N 3.32Å; R587-R589 PolarHBondContact O-N 3.27Å; R587-E590 PolarHBondContact O-N 3.4Å; R587-E591 VanDerWaalsContact O-CB 3.32Å; R587-E591 WeakPolarHBondContact O-CB 3.48Å; R587-E591 PolarHBondContact O-N 3.41Å
588	K	95.9	Very high	95.1	Very high	147 Å²	147	106.5 Å²	106.5	64%	0.639	51%	0.514	S	S	*	.	H	α-helix	trans	-66	-31.3	174.3	-77.6	-167.5	172.6	-166.5	0	113.1	A584 T585 Q586 M592	A584-K588 PolarHBondContact O-N 2.9Å; T585-K588 PolarHBondContact O-N 3.01Å; Q586-K588 VanDerWaalsContact C-N 3.28Å; Q586-K588 PolarHBondContact O-N 3.29Å; K588-M592 WeakPolarHBondContact O-CB 3.42Å; K588-M592 WeakPolarHBondContact O-CG 3.36Å; K588-M592 PolarHBondContact O-N 2.9Å; K588-M592 VanDerWaalsContact O-N 3.15Å
589	R	96.5	Very high	95.2	Very high	154 Å²	154	101.2 Å²	101.2	58%	0.581	50%	0.499	S	S	*	.	H	α-helix	trans	-69.4	-45.5	172.8	-66.7	168.6	176.7	168.9	-3.6	110.9	T585 Q586 R587 M592 Q593	T585-R589 WeakPolarHBondContact O-CG 3.35Å; T585-R589 PolarHBondContact O-N 2.67Å; Q586-R589 WeakPolarHBondContact O-CA 3.45Å; Q586-R589 WeakPolarHBondContact O-CB 3.48Å; Q586-R589 PolarHBondContact O-N 3.4Å; R587-R589 VanDerWaalsContact C-N 3.32Å; R587-R589 PolarHBondContact O-N 3.27Å; R589-M592 PolarHBondContact O-N 2.95Å; R589-Q593 WeakPolarHBondContact O-CB 3.5Å; R589-Q593 WeakPolarHBondContact O-CG 3.41Å; R589-Q593 PolarHBondContact O-N 2.84Å
590	E	96.4	Very high	95.3	Very high	79 Å²	79	102.7 Å²	102.7	37%	0.369	50%	0.497	S	S	.	.	H	α-helix	trans	-61.5	-42.7	177.2	-68.3	161	178.9	0	0	111.6	Q586 R587 Q593 N594	Q586-E590 VanDerWaalsContact CG-OE1 3.3Å; Q586-E590 WeakPolarHBondContact CG-OE1 3.44Å; Q586-E590 PolarHBondContact NE2-OE1 3.34Å; Q586-E590 PolarHBondContact O-N 3.38Å; R587-E590 PolarHBondContact O-N 3.4Å; E590-Q593 PolarHBondContact O-N 3.27Å; E590-N594 WeakPolarHBondContact O-CB 3.49Å; E590-N594 PolarHBondContact O-N 2.94Å; E590-N594 PolarHBondContact O-ND2 2.93Å; E590-N594 VanDerWaalsContact O-ND2 3.15Å
591	E	96.1	Very high	95.5	Very high	132 Å²	132	101 Å²	101	62%	0.617	49%	0.49	S	S	*	.	H	α-helix	trans	-60.4	-45.2	174.2	-175.4	174.9	-159.6	0	0	112.1	R587 N594 R595	R587-E591 VanDerWaalsContact O-CB 3.32Å; R587-E591 WeakPolarHBondContact O-CB 3.48Å; R587-E591 PolarHBondContact O-N 3.41Å; E591-N594 PolarHBondContact O-N 2.84Å; E591-R595 WeakPolarHBondContact O-CB 3.23Å; E591-R595 PolarHBondContact O-N 3.28Å
592	M	95.4	Very high	95.6	Very high	123 Å²	123	98 Å²	98	61%	0.606	48%	0.478	S	S	*	.	H	α-helix	trans	-66.2	-39.3	176.1	-70.5	-69.8	-63.6	0	0	112.6	K588 R589 R595 Q596	K588-M592 WeakPolarHBondContact O-CB 3.42Å; K588-M592 WeakPolarHBondContact O-CG 3.36Å; K588-M592 PolarHBondContact O-N 2.9Å; K588-M592 VanDerWaalsContact O-N 3.15Å; R589-M592 PolarHBondContact O-N 2.95Å; M592-R595 PolarHBondContact O-N 3.41Å; M592-Q596 WeakPolarHBondContact O-CG 3.37Å; M592-Q596 PolarHBondContact O-N 3.03Å
593	Q	95.1	Very high	95.7	Very high	116 Å²	116	100.7 Å²	100.7	54%	0.542	48%	0.48	S	S	.	.	H	α-helix	trans	-65.6	-44.7	175.4	-75.7	173	-28.1	0	0	111.5	R589 E590 R595 Q596 L597	R589-Q593 WeakPolarHBondContact O-CB 3.5Å; R589-Q593 WeakPolarHBondContact O-CG 3.41Å; R589-Q593 PolarHBondContact O-N 2.84Å; E590-Q593 PolarHBondContact O-N 3.27Å; Q593-R595 VanDerWaalsContact C-N 3.28Å; Q593-R595 PolarHBondContact O-N 3.41Å; Q593-Q596 PolarHBondContact O-N 2.98Å; Q593-L597 PolarHBondContact O-N 2.95Å
594	N	96.3	Very high	95.8	Very high	97 Å²	97	102.5 Å²	102.5	52%	0.519	48%	0.483	S	S	.	.	H	α-helix	trans	-60.9	-38.4	174	-72.8	-29.8	0	0	0	111.4	E590 E591 L597 Q598	E590-N594 WeakPolarHBondContact O-CB 3.49Å; E590-N594 PolarHBondContact O-N 2.94Å; E590-N594 PolarHBondContact O-ND2 2.93Å; E590-N594 VanDerWaalsContact O-ND2 3.15Å; E591-N594 PolarHBondContact O-N 2.84Å; N594-L597 PolarHBondContact O-N 3.23Å; N594-Q598 WeakPolarHBondContact O-CG 3.49Å; N594-Q598 PolarHBondContact O-N 2.75Å
595	R	95.8	Very high	95.9	Very high	116 Å²	116	105.7 Å²	105.7	44%	0.438	49%	0.491	S	S	.	.	H	α-helix	trans	-69.7	-35.7	176.1	-168.3	59.1	-178.7	142.2	8.7	112.7	E591 M592 Q593 Q598 L599 E602	E591-R595 WeakPolarHBondContact O-CB 3.23Å; E591-R595 PolarHBondContact O-N 3.28Å; M592-R595 PolarHBondContact O-N 3.41Å; Q593-R595 VanDerWaalsContact C-N 3.28Å; Q593-R595 PolarHBondContact O-N 3.41Å; R595-Q598 VanDerWaalsContact CD-OE1 3.22Å; R595-L599 VanDerWaalsContact O-CG 3.31Å; R595-L599 WeakPolarHBondContact O-CG 3.42Å; R595-L599 PolarHBondContact O-N 2.76Å; R595-L599 VanDerWaalsContact O-N 3.14Å; R595-E602 IonicContact NH1-OE1 3.45Å; R595-E602 PolarHBondContact NH1-OE1 2.88Å
596	Q	94.8	Very high	96	Very high	123 Å²	123	109.4 Å²	109.4	58%	0.575	51%	0.508	S	S	*	.	H	α-helix	trans	-64.7	-42.9	171.4	-75.3	173.5	-20.3	0	0	111.8	M592 Q593 Q598 L599 E600	M592-Q596 WeakPolarHBondContact O-CG 3.37Å; M592-Q596 PolarHBondContact O-N 3.03Å; Q593-Q596 PolarHBondContact O-N 2.98Å; Q596-Q598 PolarHBondContact O-N 3.43Å; Q596-L599 PolarHBondContact O-N 3.42Å; Q596-E600 PolarHBondContact O-N 3.41Å
597	L	97.4	Very high	96.1	Very high	113 Å²	113	110.8 Å²	110.8	59%	0.592	51%	0.513	S	S	*	.	H	α-helix	trans	-61.6	-43.4	176.7	-177	62.4	0	0	0	111.9	Q593 N594 L599 E600 T601	Q593-L597 PolarHBondContact O-N 2.95Å; N594-L597 PolarHBondContact O-N 3.23Å; L597-L599 VanDerWaalsContact C-N 3.34Å; L597-L599 PolarHBondContact O-N 2.95Å; L597-E600 PolarHBondContact O-N 3.49Å; L597-T601 PolarHBondContact O-N 3.43Å; L597-T601 PolarHBondContact O-OG1 3.42Å
598	Q	95.1	Very high	96.2	Very high	93 Å²	93	107.8 Å²	107.8	44%	0.435	51%	0.506	S	S	.	.	H	α-helix	trans	-57.6	-44.5	172.6	-74.5	172.6	-4.4	0	0	112.4	N594 R595 Q596 E600 T601 E602	N594-Q598 WeakPolarHBondContact O-CG 3.49Å; N594-Q598 PolarHBondContact O-N 2.75Å; R595-Q598 VanDerWaalsContact CD-OE1 3.22Å; Q596-Q598 PolarHBondContact O-N 3.43Å; Q598-E600 PolarHBondContact O-N 3.23Å; Q598-T601 PolarHBondContact O-N 3.37Å; Q598-T601 PolarHBondContact O-OG1 2.87Å; Q598-T601 VanDerWaalsContact O-OG1 3.07Å; Q598-E602 WeakPolarHBondContact O-CB 3.21Å; Q598-E602 VanDerWaalsContact O-CG 3.25Å; Q598-E602 WeakPolarHBondContact O-CG 3.31Å; Q598-E602 PolarHBondContact O-N 3.5Å
599	L	95.6	Very high	96.3	Very high	82 Å²	82	104.3 Å²	104.3	43%	0.429	50%	0.497	S	S	.	.	H	α-helix	trans	-67.6	-33.8	-179	-71	168.5	0	0	0	112.5	R595 Q596 L597 K603	R595-L599 VanDerWaalsContact O-CG 3.31Å; R595-L599 WeakPolarHBondContact O-CG 3.42Å; R595-L599 PolarHBondContact O-N 2.76Å; R595-L599 VanDerWaalsContact O-N 3.14Å; Q596-L599 PolarHBondContact O-N 3.42Å; L597-L599 VanDerWaalsContact C-N 3.34Å; L597-L599 PolarHBondContact O-N 2.95Å; L599-K603 WeakPolarHBondContact O-CB 3.44Å; L599-K603 PolarHBondContact O-N 2.95Å
600	E	96.9	Very high	96.4	Very high	85 Å²	85	104 Å²	104	40%	0.397	50%	0.5	S	S	.	.	H	α-helix	trans	-71.7	-39.6	172.4	-71.5	-59.5	137.1	0	0	112.4	Q596 L597 Q598 K603 E604	Q596-E600 PolarHBondContact O-N 3.41Å; L597-E600 PolarHBondContact O-N 3.49Å; Q598-E600 PolarHBondContact O-N 3.23Å; E600-K603 CarbonylContact O-C 3.39Å; E600-K603 WeakPolarHBondContact O-CB 3.49Å; E600-K603 PolarHBondContact O-N 2.94Å; E600-K603 IonicContact OE1-NZ 2.69Å; E600-K603 PolarHBondContact OE1-NZ 2.95Å; E600-K603 WeakPolarHBondContact OE2-CD 3.44Å; E600-K603 WeakPolarHBondContact OE2-CE 3.32Å; E600-K603 IonicContact OE2-NZ 2.72Å; E600-K603 PolarHBondContact OE2-NZ 2.92Å; E600-E604 WeakPolarHBondContact O-CB 3.41Å; E600-E604 WeakPolarHBondContact O-CG 3.42Å; E600-E604 PolarHBondContact O-N 3.17Å
601	T	96.3	Very high	96.4	Very high	64 Å²	64	103.9 Å²	103.9	39%	0.393	51%	0.505	S	S	.	.	H	α-helix	trans	-69.1	-39.1	176.1	58.5	0	0	0	0	112.6	L597 Q598 K603 E604 M605	L597-T601 PolarHBondContact O-N 3.43Å; L597-T601 PolarHBondContact O-OG1 3.42Å; Q598-T601 PolarHBondContact O-N 3.37Å; Q598-T601 PolarHBondContact O-OG1 2.87Å; Q598-T601 VanDerWaalsContact O-OG1 3.07Å; T601-K603 VanDerWaalsContact C-N 3.33Å; T601-K603 PolarHBondContact O-N 2.97Å; T601-E604 PolarHBondContact O-N 3.27Å; T601-M605 WeakPolarHBondContact O-CG 3.49Å; T601-M605 PolarHBondContact O-N 2.88Å
602	E	96.1	Very high	96.4	Very high	80 Å²	80	101.2 Å²	101.2	37%	0.374	49%	0.492	S	S	.	.	H	α-helix	trans	-56.8	-46.1	169.7	-74.6	171.3	-155.5	0	0	111	R595 Q598 E604 M605 L606	R595-E602 IonicContact NH1-OE1 3.45Å; R595-E602 PolarHBondContact NH1-OE1 2.88Å; Q598-E602 WeakPolarHBondContact O-CB 3.21Å; Q598-E602 VanDerWaalsContact O-CG 3.25Å; Q598-E602 WeakPolarHBondContact O-CG 3.31Å; Q598-E602 PolarHBondContact O-N 3.5Å; E602-E604 PolarHBondContact O-N 3.49Å; E602-M605 PolarHBondContact O-N 3.39Å; E602-L606 WeakPolarHBondContact O-CB 3.39Å; E602-L606 VanDerWaalsContact O-CG 3.3Å; E602-L606 WeakPolarHBondContact O-CG 3.27Å; E602-L606 PolarHBondContact O-N 2.87Å
603	K	96.4	Very high	96.6	Very high	92 Å²	92	100.9 Å²	100.9	40%	0.4	49%	0.492	S	S	.	.	H	α-helix	trans	-66.5	-33	177.5	174	-178.2	168.6	-147.2	0	112.9	L599 E600 T601 K607	L599-K603 WeakPolarHBondContact O-CB 3.44Å; L599-K603 PolarHBondContact O-N 2.95Å; E600-K603 CarbonylContact O-C 3.39Å; E600-K603 WeakPolarHBondContact O-CB 3.49Å; E600-K603 PolarHBondContact O-N 2.94Å; E600-K603 IonicContact OE1-NZ 2.69Å; E600-K603 PolarHBondContact OE1-NZ 2.95Å; E600-K603 WeakPolarHBondContact OE2-CD 3.44Å; E600-K603 WeakPolarHBondContact OE2-CE 3.32Å; E600-K603 IonicContact OE2-NZ 2.72Å; E600-K603 PolarHBondContact OE2-NZ 2.92Å; T601-K603 VanDerWaalsContact C-N 3.33Å; T601-K603 PolarHBondContact O-N 2.97Å; K603-K607 VanDerWaalsContact O-CG 3.26Å; K603-K607 WeakPolarHBondContact O-CG 3.42Å; K603-K607 PolarHBondContact O-N 3.07Å
604	E	97.3	Very high	96.7	Very high	113 Å²	113	100.9 Å²	100.9	53%	0.528	49%	0.494	S	S	.	.	H	α-helix	trans	-72.4	-42.5	173	-75.7	-176.3	162.3	0	0	112.7	E600 T601 E602 L606 K607 H608	E600-E604 WeakPolarHBondContact O-CB 3.41Å; E600-E604 WeakPolarHBondContact O-CG 3.42Å; E600-E604 PolarHBondContact O-N 3.17Å; T601-E604 PolarHBondContact O-N 3.27Å; E602-E604 PolarHBondContact O-N 3.49Å; E604-L606 VanDerWaalsContact C-N 3.33Å; E604-L606 PolarHBondContact O-N 3.17Å; E604-K607 WeakPolarHBondContact O-CB 3.49Å; E604-K607 PolarHBondContact O-N 3.31Å; E604-H608 WeakPolarHBondContact O-CB 3.45Å; E604-H608 PolarHBondContact O-N 2.89Å
605	M	95.7	Very high	96.7	Very high	119 Å²	119	101.8 Å²	101.8	59%	0.586	49%	0.49	S	S	*	.	H	α-helix	trans	-58.6	-45.3	170.8	-70.5	-169.7	-66.1	0	0	111.3	T601 E602 K607 H608 T609	T601-M605 WeakPolarHBondContact O-CG 3.49Å; T601-M605 PolarHBondContact O-N 2.88Å; E602-M605 PolarHBondContact O-N 3.39Å; M605-K607 PolarHBondContact O-N 3.44Å; M605-H608 WeakPolarHBondContact O-CB 3.39Å; M605-H608 PolarHBondContact O-N 3.06Å; M605-H608 VanDerWaalsContact O-N 3.11Å; M605-T609 PolarHBondContact O-N 3.46Å; M605-T609 PolarHBondContact O-OG1 3.33Å; M605-T609 VanDerWaalsContact O-OG1 3.14Å
606	L	96.9	Very high	96.8	Very high	126 Å²	126	100.2 Å²	100.2	66%	0.66	49%	0.49	S	S	*	.	H	α-helix	trans	-62.7	-38.7	176.9	-72.4	171.1	0	0	0	113.1	E602 E604 K610	E602-L606 WeakPolarHBondContact O-CB 3.39Å; E602-L606 VanDerWaalsContact O-CG 3.3Å; E602-L606 WeakPolarHBondContact O-CG 3.27Å; E602-L606 PolarHBondContact O-N 2.87Å; E604-L606 VanDerWaalsContact C-N 3.33Å; E604-L606 PolarHBondContact O-N 3.17Å; L606-K610 VanDerWaalsContact O-CB 3.28Å; L606-K610 WeakPolarHBondContact O-CB 3.25Å; L606-K610 PolarHBondContact O-N 2.84Å
607	K	96.9	Very high	96.8	Very high	106 Å²	106	97 Å²	97	46%	0.461	49%	0.485	S	S	.	.	H	α-helix	trans	-60.7	-47.7	170.2	-72.2	165.6	-169.4	163.3	0	110.5	K603 E604 M605 K610 T611	K603-K607 VanDerWaalsContact O-CG 3.26Å; K603-K607 WeakPolarHBondContact O-CG 3.42Å; K603-K607 PolarHBondContact O-N 3.07Å; E604-K607 WeakPolarHBondContact O-CB 3.49Å; E604-K607 PolarHBondContact O-N 3.31Å; M605-K607 PolarHBondContact O-N 3.44Å; K607-K610 PolarHBondContact O-N 2.98Å; K607-T611 WeakPolarHBondContact O-CG2 3.39Å; K607-T611 PolarHBondContact O-N 3.34Å
608	H	97.7	Very high	96.8	Very high	103 Å²	103	95 Å²	95	48%	0.477	48%	0.477	S	S	.	.	H	α-helix	trans	-60.2	-57	-178.2	-171.6	76.1	0	0	0	111	E604 M605 K610 T611 E612	E604-H608 WeakPolarHBondContact O-CB 3.45Å; E604-H608 PolarHBondContact O-N 2.89Å; M605-H608 WeakPolarHBondContact O-CB 3.39Å; M605-H608 PolarHBondContact O-N 3.06Å; M605-H608 VanDerWaalsContact O-N 3.11Å; H608-K610 PolarHBondContact O-N 3.11Å; H608-T611 WeakPolarHBondContact O-CA 3.39Å; H608-T611 PolarHBondContact O-N 2.88Å; H608-T611 PolarHBondContact O-OG1 3.33Å; H608-E612 IonicContact NE2-OE1 3.8Å; H608-E612 IonicContact NE2-OE2 3.8Å; H608-E612 WeakPolarHBondContact O-CG 3.48Å; H608-E612 PolarHBondContact O-N 2.96Å
609	T	97.5	Very high	96.9	Very high	74 Å²	74	93.1 Å²	93.1	45%	0.454	47%	0.47	S	S	.	.	H	α-helix	trans	-55.2	-38.1	176.6	-52.8	0	0	0	0	112.3	M605 E612 L613	M605-T609 PolarHBondContact O-N 3.46Å; M605-T609 PolarHBondContact O-OG1 3.33Å; M605-T609 VanDerWaalsContact O-OG1 3.14Å; T609-E612 PolarHBondContact O-N 2.89Å; T609-L613 HydrophobicContact CG2-CD1 4.14Å; T609-L613 HydrophobicContact CG2-CG 4.46Å; T609-L613 VanDerWaalsContact O-CG 3.32Å; T609-L613 WeakPolarHBondContact O-CG 3.32Å; T609-L613 PolarHBondContact O-N 2.91Å
610	K	97.8	Very high	96.9	Very high	148 Å²	148	94.4 Å²	94.4	64%	0.643	47%	0.474	S	S	*	.	H	α-helix	trans	-62.3	-44.5	173	-177.3	179.6	177.5	-178	0	112	L606 K607 H608 E612 M614	L606-K610 VanDerWaalsContact O-CB 3.28Å; L606-K610 WeakPolarHBondContact O-CB 3.25Å; L606-K610 PolarHBondContact O-N 2.84Å; K607-K610 PolarHBondContact O-N 2.98Å; H608-K610 PolarHBondContact O-N 3.11Å; K610-E612 VanDerWaalsContact C-N 3.32Å; K610-E612 PolarHBondContact O-N 3.29Å; K610-M614 VanDerWaalsContact O-CG 3.29Å; K610-M614 WeakPolarHBondContact O-CG 3.36Å; K610-M614 PolarHBondContact O-N 2.92Å; K610-M614 VanDerWaalsContact O-N 3.1Å
611	T	97.4	Very high	96.9	Very high	77 Å²	77	96.8 Å²	96.8	47%	0.472	48%	0.483	S	S	.	.	H	α-helix	trans	-65.9	-34.2	176.2	59.9	0	0	0	0	112.7	K607 H608 M614 R615	K607-T611 WeakPolarHBondContact O-CG2 3.39Å; K607-T611 PolarHBondContact O-N 3.34Å; H608-T611 WeakPolarHBondContact O-CA 3.39Å; H608-T611 PolarHBondContact O-N 2.88Å; H608-T611 PolarHBondContact O-OG1 3.33Å; T611-M614 PolarHBondContact O-N 3.44Å; T611-R615 WeakPolarHBondContact O-CB 3.45Å; T611-R615 PolarHBondContact O-N 2.85Å
612	E	96.9	Very high	97	Very high	76 Å²	76	99 Å²	99	36%	0.355	49%	0.489	S	S	.	.	H	α-helix	trans	-65.6	-49.6	176.2	-56.7	-120.9	98.2	0	0	111.4	H608 T609 K610 M614 R615 D616	H608-E612 IonicContact NE2-OE1 3.8Å; H608-E612 IonicContact NE2-OE2 3.8Å; H608-E612 WeakPolarHBondContact O-CG 3.48Å; H608-E612 PolarHBondContact O-N 2.96Å; T609-E612 PolarHBondContact O-N 2.89Å; K610-E612 VanDerWaalsContact C-N 3.32Å; K610-E612 PolarHBondContact O-N 3.29Å; E612-M614 VanDerWaalsContact C-N 3.29Å; E612-M614 PolarHBondContact O-N 3.38Å; E612-R615 WeakPolarHBondContact O-CA 3.27Å; E612-R615 WeakPolarHBondContact O-CB 3.24Å; E612-R615 PolarHBondContact O-N 3.35Å; E612-R615 VanDerWaalsContact O-N 3.08Å; E612-R615 IonicContact OE1-CZ 3.69Å; E612-R615 IonicContact OE1-NH1 3.28Å; E612-R615 PolarHBondContact OE1-NH1 3.44Å; E612-R615 IonicContact OE1-NH2 3.39Å; E612-R615 PolarHBondContact OE1-NH2 2.87Å; E612-D616 PolarHBondContact O-N 2.73Å
613	L	97.8	Very high	97.1	Very high	116 Å²	116	102.3 Å²	102.3	61%	0.607	50%	0.502	S	S	*	.	H	α-helix	trans	-61.3	-36.1	177.1	-70.1	170.8	0	0	0	112.5	T609 A617	T609-L613 HydrophobicContact CG2-CD1 4.14Å; T609-L613 HydrophobicContact CG2-CG 4.46Å; T609-L613 VanDerWaalsContact O-CG 3.32Å; T609-L613 WeakPolarHBondContact O-CG 3.32Å; T609-L613 PolarHBondContact O-N 2.91Å; L613-A617 WeakPolarHBondContact O-CB 3.44Å; L613-A617 PolarHBondContact O-N 3.43Å
614	M	97.6	Very high	97.1	Very high	116 Å²	116	104.1 Å²	104.1	57%	0.571	51%	0.51	S	S	*	.	H	α-helix	trans	-68.2	-41.4	172.6	-70	-60	-58.6	0	0	111.8	K610 T611 E612 D616 A617 T618	K610-M614 VanDerWaalsContact O-CG 3.29Å; K610-M614 WeakPolarHBondContact O-CG 3.36Å; K610-M614 PolarHBondContact O-N 2.92Å; K610-M614 VanDerWaalsContact O-N 3.1Å; T611-M614 PolarHBondContact O-N 3.44Å; E612-M614 VanDerWaalsContact C-N 3.29Å; E612-M614 PolarHBondContact O-N 3.38Å; M614-D616 VanDerWaalsContact C-N 3.32Å; M614-D616 PolarHBondContact O-N 3.31Å; M614-A617 PolarHBondContact O-N 3.48Å; M614-T618 PolarHBondContact O-N 3Å; M614-T618 PolarHBondContact O-OG1 3.24Å
615	R	97.3	Very high	97.1	Very high	116 Å²	116	107.3 Å²	107.3	44%	0.438	52%	0.517	S	S	.	.	H	α-helix	trans	-60.2	-43.4	174.7	-162.1	-169.1	-52.3	119.3	-0.4	110.9	T611 E612 T618 N619	T611-R615 WeakPolarHBondContact O-CB 3.45Å; T611-R615 PolarHBondContact O-N 2.85Å; E612-R615 WeakPolarHBondContact O-CA 3.27Å; E612-R615 WeakPolarHBondContact O-CB 3.24Å; E612-R615 PolarHBondContact O-N 3.35Å; E612-R615 VanDerWaalsContact O-N 3.08Å; E612-R615 IonicContact OE1-CZ 3.69Å; E612-R615 IonicContact OE1-NH1 3.28Å; E612-R615 PolarHBondContact OE1-NH1 3.44Å; E612-R615 IonicContact OE1-NH2 3.39Å; E612-R615 PolarHBondContact OE1-NH2 2.87Å; R615-T618 WeakPolarHBondContact O-CB 3.35Å; R615-T618 PolarHBondContact O-N 3Å; R615-N619 WeakPolarHBondContact O-CB 3.38Å; R615-N619 PolarHBondContact O-N 3.25Å; R615-N619 PolarHBondContact O-ND2 2.93Å
616	D	96.7	Very high	97.2	Very high	82 Å²	82	104.7 Å²	104.7	44%	0.439	51%	0.514	S	S	.	.	H	α-helix	trans	-70.4	-34.3	178.4	-86.5	-7.9	0	0	0	113.9	E612 M614 T618 N619 Q620	E612-D616 PolarHBondContact O-N 2.73Å; M614-D616 VanDerWaalsContact C-N 3.32Å; M614-D616 PolarHBondContact O-N 3.31Å; D616-T618 VanDerWaalsContact C-N 3.34Å; D616-N619 PolarHBondContact O-N 3.46Å; D616-N619 PolarHBondContact OD1-ND2 3.36Å; D616-Q620 WeakPolarHBondContact O-CB 3.38Å; D616-Q620 VanDerWaalsContact O-CG 3.27Å; D616-Q620 WeakPolarHBondContact O-CG 3.4Å; D616-Q620 PolarHBondContact O-N 2.93Å
617	A	96.1	Very high	97.3	Very high	57 Å²	57	103 Å²	103	47%	0.471	51%	0.509	S	S	.	.	H	α-helix	trans	-60.4	-44.9	170	0	0	0	0	0	111.1	L613 M614 Q620 F621	L613-A617 WeakPolarHBondContact O-CB 3.44Å; L613-A617 PolarHBondContact O-N 3.43Å; M614-A617 PolarHBondContact O-N 3.48Å; A617-Q620 PolarHBondContact O-N 3.08Å; A617-F621 PolarHBondContact O-N 3.45Å
618	T	97.6	Very high	97.3	Very high	69 Å²	69	106 Å²	106	42%	0.423	52%	0.517	S	S	.	.	H	α-helix	trans	-62.7	-51.9	174.1	-57.1	0	0	0	0	111.6	M614 R615 D616 Q620 F621 E622	M614-T618 PolarHBondContact O-N 3Å; M614-T618 PolarHBondContact O-OG1 3.24Å; R615-T618 WeakPolarHBondContact O-CB 3.35Å; R615-T618 PolarHBondContact O-N 3Å; D616-T618 VanDerWaalsContact C-N 3.34Å; T618-Q620 VanDerWaalsContact C-N 3.25Å; T618-Q620 PolarHBondContact O-N 3.15Å; T618-F621 WeakPolarHBondContact O-CA 3.42Å; T618-F621 WeakPolarHBondContact O-CB 3.19Å; T618-F621 PolarHBondContact O-N 3.21Å; T618-E622 HydrophobicContact CG2-CG 4.3Å; T618-E622 WeakPolarHBondContact O-CG 3.35Å; T618-E622 PolarHBondContact O-N 2.96Å
619	N	97.5	Very high	97.3	Very high	55 Å²	55	106.8 Å²	106.8	29%	0.294	52%	0.519	S	S	.	.	H	α-helix	trans	-53.2	-41.5	176.9	-70.2	-27.5	0	0	0	112	R615 D616 K623	R615-N619 WeakPolarHBondContact O-CB 3.38Å; R615-N619 PolarHBondContact O-N 3.25Å; R615-N619 PolarHBondContact O-ND2 2.93Å; D616-N619 PolarHBondContact O-N 3.46Å; D616-N619 PolarHBondContact OD1-ND2 3.36Å; N619-K623 WeakPolarHBondContact O-CB 3.45Å; N619-K623 WeakPolarHBondContact O-CD 3.43Å; N619-K623 WeakPolarHBondContact O-CG 3.46Å; N619-K623 PolarHBondContact O-N 3.21Å
620	Q	95.3	Very high	97.4	Very high	108 Å²	108	105.9 Å²	105.9	51%	0.505	52%	0.516	S	S	.	.	H	α-helix	trans	-69.9	-36.8	176.8	-76.7	-174.6	43.2	0	0	112.7	D616 A617 T618 K624	D616-Q620 WeakPolarHBondContact O-CB 3.38Å; D616-Q620 VanDerWaalsContact O-CG 3.27Å; D616-Q620 WeakPolarHBondContact O-CG 3.4Å; D616-Q620 PolarHBondContact O-N 2.93Å; A617-Q620 PolarHBondContact O-N 3.08Å; T618-Q620 VanDerWaalsContact C-N 3.25Å; T618-Q620 PolarHBondContact O-N 3.15Å; Q620-K624 WeakPolarHBondContact O-CB 3.18Å; Q620-K624 VanDerWaalsContact O-CD 3.23Å; Q620-K624 WeakPolarHBondContact O-CD 3.34Å; Q620-K624 WeakPolarHBondContact O-CG 3.36Å; Q620-K624 PolarHBondContact O-N 2.87Å; Q620-K624 VanDerWaalsContact O-N 3.13Å
621	F	97.1	Very high	97.3	Very high	136 Å²	136	103.3 Å²	103.3	60%	0.596	51%	0.509	S	S	*	.	H	α-helix	trans	-67.6	-45.7	175.4	-179.6	-97.6	0	0	0	111.1	A617 T618 K624 R625	A617-F621 PolarHBondContact O-N 3.45Å; T618-F621 WeakPolarHBondContact O-CA 3.42Å; T618-F621 WeakPolarHBondContact O-CB 3.19Å; T618-F621 PolarHBondContact O-N 3.21Å; F621-K624 PolarHBondContact O-N 3.21Å; F621-R625 WeakPolarHBondContact O-CB 3.44Å; F621-R625 PolarHBondContact O-N 2.96Å
622	E	97.8	Very high	97.4	Very high	111 Å²	111	104.5 Å²	104.5	52%	0.519	51%	0.509	S	S	.	.	H	α-helix	trans	-61.1	-46.2	176.4	-71.5	-179.7	171.1	0	0	111.9	T618 K624 R625 A626	T618-E622 HydrophobicContact CG2-CG 4.3Å; T618-E622 WeakPolarHBondContact O-CG 3.35Å; T618-E622 PolarHBondContact O-N 2.96Å; E622-K624 VanDerWaalsContact C-N 3.33Å; E622-K624 PolarHBondContact O-N 3.38Å; E622-R625 PolarHBondContact O-N 3.35Å; E622-R625 VanDerWaalsContact O-N 3.14Å; E622-A626 WeakPolarHBondContact O-CB 3.48Å; E622-A626 PolarHBondContact O-N 3.38Å
623	K	97.8	Very high	97.4	Very high	149 Å²	149	103.7 Å²	103.7	65%	0.648	51%	0.507	S	S	*	.	H	α-helix	trans	-58	-42.7	173.7	-74.9	169.5	-178.3	176.7	0	112	N619 V627	N619-K623 WeakPolarHBondContact O-CB 3.45Å; N619-K623 WeakPolarHBondContact O-CD 3.43Å; N619-K623 WeakPolarHBondContact O-CG 3.46Å; N619-K623 PolarHBondContact O-N 3.21Å; K623-V627 WeakPolarHBondContact O-CB 3.37Å; K623-V627 VanDerWaalsContact O-CG2 3.32Å; K623-V627 WeakPolarHBondContact O-CG2 3.31Å; K623-V627 PolarHBondContact O-N 3.01Å
624	K	96.9	Very high	97.4	Very high	130 Å²	130	101 Å²	101	57%	0.565	49%	0.494	S	S	*	.	H	α-helix	trans	-65.8	-37.7	175.8	-70.9	161.7	-166.7	161.1	0	112.2	Q620 F621 E622 R628	Q620-K624 WeakPolarHBondContact O-CB 3.18Å; Q620-K624 VanDerWaalsContact O-CD 3.23Å; Q620-K624 WeakPolarHBondContact O-CD 3.34Å; Q620-K624 WeakPolarHBondContact O-CG 3.36Å; Q620-K624 PolarHBondContact O-N 2.87Å; Q620-K624 VanDerWaalsContact O-N 3.13Å; F621-K624 PolarHBondContact O-N 3.21Å; E622-K624 VanDerWaalsContact C-N 3.33Å; E622-K624 PolarHBondContact O-N 3.38Å; K624-R628 PolarHBondContact O-N 3.45Å; K624-R628 VanDerWaalsContact O-N 3.12Å
625	R	97.6	Very high	97.3	Very high	180 Å²	180	104.8 Å²	104.8	68%	0.679	50%	0.502	S	S	*	.	H	α-helix	trans	-69.1	-44	176.4	-173.7	-178.5	-178.8	-169.6	1.3	111.8	F621 E622 R628 K629	F621-R625 WeakPolarHBondContact O-CB 3.44Å; F621-R625 PolarHBondContact O-N 2.96Å; E622-R625 PolarHBondContact O-N 3.35Å; E622-R625 VanDerWaalsContact O-N 3.14Å; R625-R628 PolarHBondContact O-N 2.91Å; R625-K629 PolarHBondContact O-N 3.02Å
626	A	97.8	Very high	97.3	Very high	63 Å²	63	102.6 Å²	102.6	52%	0.521	50%	0.504	S	S	.	.	H	α-helix	trans	-64.5	-44.8	178.2	0	0	0	0	0	111.9	E622 R628 K629 S630	E622-A626 WeakPolarHBondContact O-CB 3.48Å; E622-A626 PolarHBondContact O-N 3.38Å; A626-R628 VanDerWaalsContact C-N 3.34Å; A626-R628 PolarHBondContact O-N 2.96Å; A626-K629 PolarHBondContact O-N 3.33Å; A626-S630 PolarHBondContact O-N 2.84Å
627	V	97.8	Very high	97.4	Very high	91 Å²	91	104.3 Å²	104.3	55%	0.552	51%	0.505	S	S	*	.	H	α-helix	trans	-61.1	-42.8	173.9	169.6	0	0	0	0	111.2	K623 S630 L631	K623-V627 WeakPolarHBondContact O-CB 3.37Å; K623-V627 VanDerWaalsContact O-CG2 3.32Å; K623-V627 WeakPolarHBondContact O-CG2 3.31Å; K623-V627 PolarHBondContact O-N 3.01Å; V627-S630 PolarHBondContact O-N 2.9Å; V627-L631 HydrophobicContact CG1-CD1 4.11Å; V627-L631 WeakPolarHBondContact O-CG 3.44Å; V627-L631 PolarHBondContact O-N 2.9Å; V627-L631 VanDerWaalsContact O-N 3.13Å
628	R	97.8	Very high	97.4	Very high	169 Å²	169	105 Å²	105	64%	0.638	51%	0.506	S	S	*	.	H	α-helix	trans	-61.4	-49.2	175.7	-168.2	-167.7	-62.9	177.5	-1.4	111.4	K624 R625 A626 S630 L631 E632	K624-R628 PolarHBondContact O-N 3.45Å; K624-R628 VanDerWaalsContact O-N 3.12Å; R625-R628 PolarHBondContact O-N 2.91Å; A626-R628 VanDerWaalsContact C-N 3.34Å; A626-R628 PolarHBondContact O-N 2.96Å; R628-S630 VanDerWaalsContact C-N 3.34Å; R628-S630 PolarHBondContact O-N 3.13Å; R628-L631 PolarHBondContact O-N 3.31Å; R628-L631 VanDerWaalsContact O-N 3.13Å; R628-E632 WeakPolarHBondContact CD-OE1 3.4Å; R628-E632 HydrophobicContact CG-CG 4.42Å; R628-E632 VanDerWaalsContact CG-OE1 3.26Å; R628-E632 WeakPolarHBondContact CG-OE1 3.32Å; R628-E632 WeakPolarHBondContact O-CG 3.28Å; R628-E632 PolarHBondContact O-N 2.93Å
629	K	98.1	Very high	97.4	Very high	119 Å²	119	105.5 Å²	105.5	52%	0.517	51%	0.509	S	S	.	.	H	α-helix	trans	-61	-42.2	179.8	-162.8	-158.6	168.2	-162.1	0	111.7	R625 A626 L631 E632 D633	R625-K629 PolarHBondContact O-N 3.02Å; A626-K629 PolarHBondContact O-N 3.33Å; K629-L631 VanDerWaalsContact C-N 3.29Å; K629-L631 PolarHBondContact O-N 2.99Å; K629-E632 WeakPolarHBondContact O-CB 2.9Å; K629-E632 PolarHBondContact O-N 3.4Å; K629-D633 WeakPolarHBondContact CE-OD1 3.42Å; K629-D633 WeakPolarHBondContact CE-OD2 3.46Å; K629-D633 IonicContact NZ-OD2 2.67Å; K629-D633 WeakPolarHBondContact O-CB 3.36Å; K629-D633 VanDerWaalsContact O-CG 3.22Å; K629-D633 PolarHBondContact O-N 3.45Å
630	S	98.3	Very high	97.3	Very high	56 Å²	56	107.7 Å²	107.7	39%	0.392	52%	0.517	S	S	.	.	H	α-helix	trans	-57.4	-44.5	175.4	-168	0	0	0	0	111.4	A626 V627 R628 D633 D634	A626-S630 PolarHBondContact O-N 2.84Å; V627-S630 PolarHBondContact O-N 2.9Å; R628-S630 VanDerWaalsContact C-N 3.34Å; R628-S630 PolarHBondContact O-N 3.13Å; S630-D633 PolarHBondContact O-N 3.2Å; S630-D634 VanDerWaalsContact O-CB 3.28Å; S630-D634 WeakPolarHBondContact O-CB 3.39Å; S630-D634 PolarHBondContact O-N 3.22Å; S630-D634 PolarHBondContact OG-OD2 2.86Å
631	L	97.2	Very high	97.4	Very high	94 Å²	94	107.2 Å²	107.2	49%	0.492	52%	0.517	S	S	.	.	H	α-helix	trans	-67	-36.5	178	-67.8	168.8	0	0	0	112.6	V627 R628 K629 W635	V627-L631 HydrophobicContact CG1-CD1 4.11Å; V627-L631 WeakPolarHBondContact O-CG 3.44Å; V627-L631 PolarHBondContact O-N 2.9Å; V627-L631 VanDerWaalsContact O-N 3.13Å; R628-L631 PolarHBondContact O-N 3.31Å; R628-L631 VanDerWaalsContact O-N 3.13Å; K629-L631 VanDerWaalsContact C-N 3.29Å; K629-L631 PolarHBondContact O-N 2.99Å; L631-W635 WeakPolarHBondContact O-CB 3.38Å; L631-W635 VanDerWaalsContact O-CG 3.28Å; L631-W635 PolarHBondContact O-N 3.04Å
632	E	97.8	Very high	97.4	Very high	102 Å²	102	106.3 Å²	106.3	48%	0.477	51%	0.513	S	S	.	.	H	α-helix	trans	-63.1	-49.5	172.1	-70	161.5	174.9	0	0	110.5	R628 K629 D634 W635 S636	R628-E632 WeakPolarHBondContact CD-OE1 3.4Å; R628-E632 HydrophobicContact CG-CG 4.42Å; R628-E632 VanDerWaalsContact CG-OE1 3.26Å; R628-E632 WeakPolarHBondContact CG-OE1 3.32Å; R628-E632 WeakPolarHBondContact O-CG 3.28Å; R628-E632 PolarHBondContact O-N 2.93Å; K629-E632 WeakPolarHBondContact O-CB 2.9Å; K629-E632 PolarHBondContact O-N 3.4Å; E632-D634 PolarHBondContact O-N 3.34Å; E632-W635 PolarHBondContact O-N 3.32Å; E632-S636 PolarHBondContact O-N 2.72Å; E632-S636 PolarHBondContact O-OG 2.86Å
633	D	97.8	Very high	97.2	Very high	58 Å²	58	105.6 Å²	105.6	31%	0.31	51%	0.51	S	S	.	.	H	α-helix	trans	-61.8	-39.3	176.8	-66	-26.3	0	0	0	111.8	K629 S630 R637	K629-D633 WeakPolarHBondContact CE-OD1 3.42Å; K629-D633 WeakPolarHBondContact CE-OD2 3.46Å; K629-D633 IonicContact NZ-OD2 2.67Å; K629-D633 WeakPolarHBondContact O-CB 3.36Å; K629-D633 VanDerWaalsContact O-CG 3.22Å; K629-D633 PolarHBondContact O-N 3.45Å; S630-D633 PolarHBondContact O-N 3.2Å; D633-R637 WeakPolarHBondContact O-CG 3.48Å; D633-R637 PolarHBondContact O-N 3.17Å
634	D	97.9	Very high	97.1	Very high	61 Å²	61	103.1 Å²	103.1	33%	0.326	50%	0.499	S	S	.	.	H	α-helix	trans	-70.3	-36.5	176.8	-74.9	-39.3	0	0	0	112.3	S630 E632 R637 S638	S630-D634 VanDerWaalsContact O-CB 3.28Å; S630-D634 WeakPolarHBondContact O-CB 3.39Å; S630-D634 PolarHBondContact O-N 3.22Å; S630-D634 PolarHBondContact OG-OD2 2.86Å; E632-D634 PolarHBondContact O-N 3.34Å; D634-R637 IonicContact OD1-CZ 2.71Å; D634-R637 IonicContact OD1-NE 3.86Å; D634-R637 PolarHBondContact OD1-NE 3.43Å; D634-R637 IonicContact OD1-NH2 2.74Å; D634-R637 PolarHBondContact OD1-NH2 3.29Å; D634-S638 VanDerWaalsContact O-CB 3.31Å; D634-S638 WeakPolarHBondContact O-CB 3.44Å; D634-S638 PolarHBondContact O-N 2.93Å; D634-S638 PolarHBondContact O-OG 3.02Å
635	W	96	Very high	96.8	Very high	194 Å²	194	102.9 Å²	102.9	74%	0.735	50%	0.5	S	S	*	.	H	α-helix	trans	-67.3	-44.2	173.1	-79.3	26.8	0	0	0	111	L631 E632 S638 V639	L631-W635 WeakPolarHBondContact O-CB 3.38Å; L631-W635 VanDerWaalsContact O-CG 3.28Å; L631-W635 PolarHBondContact O-N 3.04Å; E632-W635 PolarHBondContact O-N 3.32Å; W635-S638 PolarHBondContact O-N 2.93Å; W635-S638 VanDerWaalsContact O-N 3.16Å; W635-V639 WeakPolarHBondContact O-CG2 3.4Å; W635-V639 PolarHBondContact O-N 2.93Å
636	S	97.7	Very high	96.5	Very high	70 Å²	70	96.2 Å²	96.2	49%	0.49	48%	0.477	S	S	.	.	H	α-helix	trans	-57.5	-48.7	173.3	-68.6	0	0	0	0	112	E632 S638 V639 E640	E632-S636 PolarHBondContact O-N 2.72Å; E632-S636 PolarHBondContact O-OG 2.86Å; S636-S638 VanDerWaalsContact C-N 3.3Å; S636-S638 PolarHBondContact O-N 3.36Å; S636-V639 PolarHBondContact O-N 3.45Å; S636-E640 PolarHBondContact O-N 2.86Å
637	R	97.8	Very high	96.2	Very high	119 Å²	119	96.6 Å²	96.6	45%	0.449	47%	0.47	S	S	.	.	H	α-helix	trans	-56.6	-42.8	173.5	-77.9	-175.3	-76.9	-87.6	5.7	112.3	D633 D634 E640 L641	D633-R637 WeakPolarHBondContact O-CG 3.48Å; D633-R637 PolarHBondContact O-N 3.17Å; D634-R637 IonicContact OD1-CZ 2.71Å; D634-R637 IonicContact OD1-NE 3.86Å; D634-R637 PolarHBondContact OD1-NE 3.43Å; D634-R637 IonicContact OD1-NH2 2.74Å; D634-R637 PolarHBondContact OD1-NH2 3.29Å; R637-E640 PolarHBondContact O-N 2.9Å; R637-L641 WeakPolarHBondContact O-CB 3.47Å; R637-L641 VanDerWaalsContact O-CG 3.25Å; R637-L641 WeakPolarHBondContact O-CG 3.35Å; R637-L641 PolarHBondContact O-N 3.25Å
638	S	96.2	Very high	95.7	Very high	70 Å²	70	97.7 Å²	97.7	49%	0.49	47%	0.469	S	S	.	.	H	α-helix	trans	-68.2	-37.2	-179.3	-59.2	0	0	0	0	112.7	D634 W635 S636 K642	D634-S638 VanDerWaalsContact O-CB 3.31Å; D634-S638 WeakPolarHBondContact O-CB 3.44Å; D634-S638 PolarHBondContact O-N 2.93Å; D634-S638 PolarHBondContact O-OG 3.02Å; W635-S638 PolarHBondContact O-N 2.93Å; W635-S638 VanDerWaalsContact O-N 3.16Å; S636-S638 VanDerWaalsContact C-N 3.3Å; S636-S638 PolarHBondContact O-N 3.36Å; S638-K642 WeakPolarHBondContact O-CB 3.21Å; S638-K642 PolarHBondContact O-N 3.11Å
639	V	97.3	Very high	95.1	Very high	81 Å²	81	95.4 Å²	95.4	49%	0.491	47%	0.466	S	S	.	.	H	α-helix	trans	-67.7	-44.3	174.7	168.6	0	0	0	0	110.8	W635 S636 L641 K642 H643	W635-V639 WeakPolarHBondContact O-CG2 3.4Å; W635-V639 PolarHBondContact O-N 2.93Å; S636-V639 PolarHBondContact O-N 3.45Å; V639-L641 PolarHBondContact O-N 3.33Å; V639-K642 PolarHBondContact O-N 3.29Å; V639-H643 PolarHBondContact O-CD2 3.06Å; V639-H643 VanDerWaalsContact O-CD2 3.29Å; V639-H643 PolarHBondContact O-N 3.4Å
640	E	96.5	Very high	94.6	Very high	101 Å²	101	95 Å²	95	47%	0.472	46%	0.46	S	S	.	.	H	α-helix	trans	-58.8	-46.2	172.9	-79.1	-174.1	-136.9	0	0	112.6	S636 R637 K642 H643 K644	S636-E640 PolarHBondContact O-N 2.86Å; R637-E640 PolarHBondContact O-N 2.9Å; E640-K642 VanDerWaalsContact C-N 3.34Å; E640-H643 PolarHBondContact O-N 2.94Å; E640-K644 WeakPolarHBondContact O-CB 3.46Å; E640-K644 WeakPolarHBondContact O-CD 3.28Å; E640-K644 VanDerWaalsContact O-CG 3.27Å; E640-K644 WeakPolarHBondContact O-CG 3.34Å; E640-K644 PolarHBondContact O-N 2.86Å; E640-K644 IonicContact OE2-NZ 2.61Å; E640-K644 PolarHBondContact OE2-NZ 3.37Å
641	L	96.1	Very high	93.7	Very high	97 Å²	97	99.3 Å²	99.3	51%	0.508	47%	0.468	S	S	.	.	H	α-helix	trans	-63.4	-40.7	178.9	-73.6	168.2	0	0	0	111.3	R637 V639 K644 Q645	R637-L641 WeakPolarHBondContact O-CB 3.47Å; R637-L641 VanDerWaalsContact O-CG 3.25Å; R637-L641 WeakPolarHBondContact O-CG 3.35Å; R637-L641 PolarHBondContact O-N 3.25Å; V639-L641 PolarHBondContact O-N 3.33Å; L641-K644 PolarHBondContact O-N 3.4Å; L641-Q645 WeakPolarHBondContact O-CB 3.23Å; L641-Q645 VanDerWaalsContact O-CG 3.28Å; L641-Q645 WeakPolarHBondContact O-CG 3.46Å; L641-Q645 PolarHBondContact O-N 3.22Å
642	K	96.4	Very high	92.8	Very high	117 Å²	117	101.3 Å²	101.3	51%	0.509	47%	0.473	S	S	.	.	H	α-helix	trans	-63.1	-42.7	175	-175.1	173.1	-178.1	-70.1	0	112	S638 V639 E640 Q645 E646	S638-K642 WeakPolarHBondContact O-CB 3.21Å; S638-K642 PolarHBondContact O-N 3.11Å; V639-K642 PolarHBondContact O-N 3.29Å; E640-K642 VanDerWaalsContact C-N 3.34Å; K642-Q645 PolarHBondContact O-N 3.13Å; K642-E646 IonicContact NZ-OE1 2.68Å; K642-E646 PolarHBondContact NZ-OE1 2.91Å; K642-E646 WeakPolarHBondContact O-CB 3.49Å; K642-E646 WeakPolarHBondContact O-CG 3.43Å; K642-E646 PolarHBondContact O-N 2.77Å
643	H	95.1	Very high	91.6	Very high	96 Å²	96	102.7 Å²	102.7	44%	0.444	48%	0.483	S	S	.	.	H	α-helix	trans	-66.1	-41.1	174.8	-75.7	-51.7	0	0	0	112.5	V639 E640 Q645 E646 D647	V639-H643 PolarHBondContact O-CD2 3.06Å; V639-H643 VanDerWaalsContact O-CD2 3.29Å; V639-H643 PolarHBondContact O-N 3.4Å; E640-H643 PolarHBondContact O-N 2.94Å; H643-Q645 PolarHBondContact O-N 3.35Å; H643-E646 IonicContact ND1-OE2 3.88Å; H643-E646 PolarHBondContact O-N 3.19Å; H643-D647 WeakPolarHBondContact O-CB 3.22Å; H643-D647 PolarHBondContact O-N 3.05Å
644	K	95.1	Very high	90.6	Very high	97 Å²	97	109.9 Å²	109.9	42%	0.422	51%	0.506	S	S	.	.	H	α-helix	trans	-59.4	-45.8	174.2	-72.3	158.8	-176	162.5	0	111.2	E640 L641 D647 E648	E640-K644 WeakPolarHBondContact O-CB 3.46Å; E640-K644 WeakPolarHBondContact O-CD 3.28Å; E640-K644 VanDerWaalsContact O-CG 3.27Å; E640-K644 WeakPolarHBondContact O-CG 3.34Å; E640-K644 PolarHBondContact O-N 2.86Å; E640-K644 IonicContact OE2-NZ 2.61Å; E640-K644 PolarHBondContact OE2-NZ 3.37Å; L641-K644 PolarHBondContact O-N 3.4Å; K644-D647 PolarHBondContact O-N 2.84Å; K644-E648 WeakPolarHBondContact O-CB 3.32Å; K644-E648 VanDerWaalsContact O-CG 3.26Å; K644-E648 WeakPolarHBondContact O-CG 3.2Å; K644-E648 PolarHBondContact O-N 3.39Å
645	Q	90.3	Very high	89.2	Confident	125 Å²	125	109.7 Å²	109.7	58%	0.584	51%	0.51	S	S	*	.	H	α-helix	trans	-61.9	-46.7	174.8	-74.7	172.2	-12	0	0	112.6	L641 K642 H643 D647 E648 E649	L641-Q645 WeakPolarHBondContact O-CB 3.23Å; L641-Q645 VanDerWaalsContact O-CG 3.28Å; L641-Q645 WeakPolarHBondContact O-CG 3.46Å; L641-Q645 PolarHBondContact O-N 3.22Å; K642-Q645 PolarHBondContact O-N 3.13Å; H643-Q645 PolarHBondContact O-N 3.35Å; Q645-D647 VanDerWaalsContact C-N 3.32Å; Q645-D647 PolarHBondContact O-N 3.15Å; Q645-E648 PolarHBondContact O-N 2.83Å; Q645-E649 WeakPolarHBondContact O-CB 3.48Å; Q645-E649 PolarHBondContact O-N 3.03Å
646	E	92.3	Very high	87.3	Confident	41 Å²	41	106.4 Å²	106.4	19%	0.192	51%	0.513	C	S	.	.	H	α-helix	trans	-60.5	-40.3	175	-76.8	175.5	-167.6	0	0	112.2	K642 H643 E649 R650	K642-E646 IonicContact NZ-OE1 2.68Å; K642-E646 PolarHBondContact NZ-OE1 2.91Å; K642-E646 WeakPolarHBondContact O-CB 3.49Å; K642-E646 WeakPolarHBondContact O-CG 3.43Å; K642-E646 PolarHBondContact O-N 2.77Å; H643-E646 IonicContact ND1-OE2 3.88Å; H643-E646 PolarHBondContact O-N 3.19Å; E646-E649 PolarHBondContact O-N 2.79Å; E646-R650 VanDerWaalsContact O-CB 3.31Å; E646-R650 WeakPolarHBondContact O-CB 3.37Å; E646-R650 WeakPolarHBondContact O-CD 3.3Å; E646-R650 WeakPolarHBondContact O-CG 3.46Å; E646-R650 PolarHBondContact O-N 3.29Å; E646-R650 IonicContact OE2-CZ 3.72Å; E646-R650 IonicContact OE2-NH1 3.99Å; E646-R650 IonicContact OE2-NH2 2.72Å; E646-R650 PolarHBondContact OE2-NH2 3.47Å
647	D	90.8	Very high	85.3	Confident	71 Å²	71	106 Å²	106	38%	0.38	52%	0.52	S	S	.	.	H	α-helix	trans	-74.9	-28.2	178.5	-74.7	-28	0	0	0	112.7	H643 K644 Q645 R650 R651	H643-D647 WeakPolarHBondContact O-CB 3.22Å; H643-D647 PolarHBondContact O-N 3.05Å; K644-D647 PolarHBondContact O-N 2.84Å; Q645-D647 VanDerWaalsContact C-N 3.32Å; Q645-D647 PolarHBondContact O-N 3.15Å; D647-R650 WeakPolarHBondContact OD1-CD 3.23Å; D647-R650 IonicContact OD1-CZ 3.75Å; D647-R650 IonicContact OD1-NE 3.21Å; D647-R650 IonicContact OD1-NH1 2.66Å; D647-R650 PolarHBondContact OD1-NH1 3.42Å; D647-R651 VanDerWaalsContact O-CB 3.32Å; D647-R651 WeakPolarHBondContact O-CB 3.43Å; D647-R651 VanDerWaalsContact O-CG 3.28Å; D647-R651 WeakPolarHBondContact O-CG 3.47Å; D647-R651 PolarHBondContact O-N 3.02Å; D647-R651 PolarHBondContact O-NE 3.48Å
648	E	87.4	Confident	83.4	Confident	113 Å²	113	106.6 Å²	106.6	53%	0.528	53%	0.526	S	S	.	.	H	α-helix	trans	-70.1	-43.3	169.5	-75.7	167.2	-165.3	0	0	111.2	K644 Q645 R651 F652	K644-E648 WeakPolarHBondContact O-CB 3.32Å; K644-E648 VanDerWaalsContact O-CG 3.26Å; K644-E648 WeakPolarHBondContact O-CG 3.2Å; K644-E648 PolarHBondContact O-N 3.39Å; Q645-E648 PolarHBondContact O-N 2.83Å; E648-R651 PolarHBondContact O-N 3.01Å; E648-F652 WeakPolarHBondContact O-CB 3.24Å; E648-F652 PolarHBondContact O-N 2.8Å
649	E	84.9	Confident	81.6	Confident	122 Å²	122	108 Å²	108	57%	0.57	53%	0.527	S	S	*	.	H	α-helix	trans	-62.6	-46.3	172.9	-175.5	176.3	-149.7	0	0	111.3	Q645 E646 R651 F652 L653	Q645-E649 WeakPolarHBondContact O-CB 3.48Å; Q645-E649 PolarHBondContact O-N 3.03Å; E646-E649 PolarHBondContact O-N 2.79Å; E649-R651 VanDerWaalsContact C-N 3.27Å; E649-R651 PolarHBondContact O-N 2.75Å; E649-F652 PolarHBondContact O-N 2.91Å; E649-L653 HydrophobicContact CG-CD1 4.01Å; E649-L653 HydrophobicContact CG-CG 4.46Å; E649-L653 WeakPolarHBondContact O-CB 3.46Å; E649-L653 VanDerWaalsContact O-CG 3.3Å; E649-L653 WeakPolarHBondContact O-CG 3.29Å; E649-L653 PolarHBondContact O-N 3.45Å
650	R	86.8	Confident	79.5	Confident	109 Å²	109	109.8 Å²	109.8	41%	0.411	53%	0.533	S	S	.	.	H	α-helix	trans	-58.9	-35.4	172.5	-72.8	162.2	-170.5	143.3	11.4	112.4	E646 D647 R654	E646-R650 VanDerWaalsContact O-CB 3.31Å; E646-R650 WeakPolarHBondContact O-CB 3.37Å; E646-R650 WeakPolarHBondContact O-CD 3.3Å; E646-R650 WeakPolarHBondContact O-CG 3.46Å; E646-R650 PolarHBondContact O-N 3.29Å; E646-R650 IonicContact OE2-CZ 3.72Å; E646-R650 IonicContact OE2-NH1 3.99Å; E646-R650 IonicContact OE2-NH2 2.72Å; E646-R650 PolarHBondContact OE2-NH2 3.47Å; D647-R650 WeakPolarHBondContact OD1-CD 3.23Å; D647-R650 IonicContact OD1-CZ 3.75Å; D647-R650 IonicContact OD1-NE 3.21Å; D647-R650 IonicContact OD1-NH1 2.66Å; D647-R650 PolarHBondContact OD1-NH1 3.42Å; R650-R654 WeakPolarHBondContact O-CB 3.49Å; R650-R654 VanDerWaalsContact O-CD 3.3Å; R650-R654 WeakPolarHBondContact O-CD 3.45Å; R650-R654 WeakPolarHBondContact O-CG 3.5Å; R650-R654 PolarHBondContact O-N 3.04Å
651	R	81.4	Confident	77.4	Confident	147 Å²	147	109.1 Å²	109.1	56%	0.555	54%	0.536	S	S	*	.	H	α-helix	trans	-73.3	-42.8	175.6	-83.5	173	-78.2	168.6	-1.9	111.6	D647 E648 E649 R654 S655	D647-R651 VanDerWaalsContact O-CB 3.32Å; D647-R651 WeakPolarHBondContact O-CB 3.43Å; D647-R651 VanDerWaalsContact O-CG 3.28Å; D647-R651 WeakPolarHBondContact O-CG 3.47Å; D647-R651 PolarHBondContact O-N 3.02Å; D647-R651 PolarHBondContact O-NE 3.48Å; E648-R651 PolarHBondContact O-N 3.01Å; E649-R651 VanDerWaalsContact C-N 3.27Å; E649-R651 PolarHBondContact O-N 2.75Å; R651-R654 CarbonylContact O-C 3.33Å; R651-R654 PolarHBondContact O-N 3.03Å; R651-R654 VanDerWaalsContact O-N 3.14Å; R651-S655 PolarHBondContact O-N 3.29Å; R651-S655 PolarHBondContact O-OG 3.17Å
652	F	77	Confident	75.4	Confident	137 Å²	137	106.7 Å²	106.7	60%	0.601	52%	0.523	S	S	*	.	H	α-helix	trans	-61	-46.3	176	-179.8	-100.2	0	0	0	112	E648 E649 R654 S655	E648-F652 WeakPolarHBondContact O-CB 3.24Å; E648-F652 PolarHBondContact O-N 2.8Å; E649-F652 PolarHBondContact O-N 2.91Å; F652-R654 PolarHBondContact O-N 3.29Å; F652-S655 PolarHBondContact O-N 3.32Å; F652-S655 PolarHBondContact O-OG 2.78Å
653	L	73.4	Confident	73.4	Confident	130 Å²	130	107 Å²	107	68%	0.681	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-18.3	175.3	-67.9	171.7	0	0	0	113.8	E649	E649-L653 HydrophobicContact CG-CD1 4.01Å; E649-L653 HydrophobicContact CG-CG 4.46Å; E649-L653 WeakPolarHBondContact O-CB 3.46Å; E649-L653 VanDerWaalsContact O-CG 3.3Å; E649-L653 WeakPolarHBondContact O-CG 3.29Å; E649-L653 PolarHBondContact O-N 3.45Å
654	R	76.7	Confident	71.4	Confident	209 Å²	209	106.1 Å²	106.1	79%	0.789	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	-19.5	175.3	-75.3	173	-178.1	-173.1	0.7	113.6	R650 R651 F652	R650-R654 WeakPolarHBondContact O-CB 3.49Å; R650-R654 VanDerWaalsContact O-CD 3.3Å; R650-R654 WeakPolarHBondContact O-CD 3.45Å; R650-R654 WeakPolarHBondContact O-CG 3.5Å; R650-R654 PolarHBondContact O-N 3.04Å; R651-R654 CarbonylContact O-C 3.33Å; R651-R654 PolarHBondContact O-N 3.03Å; R651-R654 VanDerWaalsContact O-N 3.14Å; F652-R654 PolarHBondContact O-N 3.29Å
655	S	68	Low	69.4	Low	58 Å²	58	108.8 Å²	108.8	41%	0.406	54%	0.537	S	S	.	.	S	Bend	trans	-80.3	124	174.6	53.4	0	0	0	0	110.4	R651 F652 G657	R651-S655 PolarHBondContact O-N 3.29Å; R651-S655 PolarHBondContact O-OG 3.17Å; F652-S655 PolarHBondContact O-N 3.32Å; F652-S655 PolarHBondContact O-OG 2.78Å; S655-G657 PolarHBondContact O-N 2.97Å
656	P	55.9	Low	67.7	Low	125 Å²	125	108.7 Å²	108.7	81%	0.812	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-59.8	125.8	163.5	27.2	-32.5	0	0	0	107.5	K658	P656-K658 PolarHBondContact O-N 2.87Å
657	G	55.7	Low	65.9	Low	60 Å²	60	109.3 Å²	109.3	62%	0.619	55%	0.545	S	S	*	.	P	Polyproline II helix	trans	-60.2	121.3	-162.7	0	0	0	0	0	113.3	S655	S655-G657 PolarHBondContact O-N 2.97Å
658	K	58.8	Low	64.3	Low	133 Å²	133	115 Å²	115	58%	0.578	57%	0.57	S	S	*	*			trans	-104.3	97.7	143.8	-81	-157.7	171.9	-169.1	0	108.4	P656 D662 E666	P656-K658 PolarHBondContact O-N 2.87Å; K658-D662 VanDerWaalsContact CA-OD2 3.24Å; K658-D662 WeakPolarHBondContact CA-OD2 3.24Å; K658-E666 IonicContact NZ-OE1 3.54Å; K658-E666 PolarHBondContact NZ-OE1 3.24Å
659	L	58.2	Low	62.9	Low	100 Å²	100	115.6 Å²	115.6	52%	0.524	57%	0.567	S	S	.	*			trans	-64.7	165.2	174.6	-69.1	164.2	0	0	0	110.3	V661 D662 K663	L659-V661 HydrophobicContact CB-CB 4.37Å; L659-V661 PolarHBondContact O-N 3.49Å; L659-D662 PolarHBondContact N-OD2 3.5Å; L659-D662 PolarHBondContact O-N 2.78Å; L659-K663 PolarHBondContact O-N 3.25Å
660	L	53.1	Low	61.8	Low	117 Å²	117	110.7 Å²	110.7	61%	0.613	55%	0.546	S	S	*	.	H	α-helix	trans	-63.4	-25.4	172.2	-159.6	76.1	0	0	0	111.6	L664	L660-L664 HydrophobicContact CG-CD1 4.37Å; L660-L664 WeakPolarHBondContact O-CB 3.46Å; L660-L664 WeakPolarHBondContact O-CD1 3.49Å; L660-L664 WeakPolarHBondContact O-CG 3.45Å; L660-L664 PolarHBondContact O-N 3.21Å; L660-L664 VanDerWaalsContact O-N 3.15Å
661	V	52.3	Low	60.2	Low	87 Å²	87	110.2 Å²	110.2	53%	0.527	54%	0.544	S	S	.	.	H	α-helix	trans	-60.4	-51.7	173.4	-176.9	0	0	0	0	110.2	L659 K663 L664 E665	L659-V661 HydrophobicContact CB-CB 4.37Å; L659-V661 PolarHBondContact O-N 3.49Å; V661-K663 VanDerWaalsContact C-N 3.29Å; V661-K663 PolarHBondContact O-N 3.18Å; V661-L664 CarbonylContact O-C 3.4Å; V661-L664 VanDerWaalsContact O-CA 3.27Å; V661-L664 WeakPolarHBondContact O-CA 3.42Å; V661-L664 VanDerWaalsContact O-CB 3.31Å; V661-L664 WeakPolarHBondContact O-CB 3.48Å; V661-L664 PolarHBondContact O-N 2.8Å; V661-E665 PolarHBondContact O-N 3.19Å
662	D	53.2	Low	58.9	Low	47 Å²	47	109.5 Å²	109.5	25%	0.251	54%	0.542	S	S	.	.	H	α-helix	trans	-61.4	-37.9	-176.6	-37.4	-11.6	0	0	0	111.2	K658 L659 L664 E665 E666	K658-D662 VanDerWaalsContact CA-OD2 3.24Å; K658-D662 WeakPolarHBondContact CA-OD2 3.24Å; L659-D662 PolarHBondContact N-OD2 3.5Å; L659-D662 PolarHBondContact O-N 2.78Å; D662-L664 VanDerWaalsContact C-N 3.29Å; D662-L664 PolarHBondContact O-N 2.91Å; D662-E665 PolarHBondContact O-N 2.85Å; D662-E666 PolarHBondContact O-N 3.22Å; D662-E666 VanDerWaalsContact O-N 3.16Å
663	K	55	Low	58.1	Low	122 Å²	122	105.9 Å²	105.9	53%	0.53	53%	0.533	S	S	.	.	H	α-helix	trans	-70.7	-21	172	-66.3	-169.6	177.4	-174.7	0	114	L659 V661 S667	L659-K663 PolarHBondContact O-N 3.25Å; V661-K663 VanDerWaalsContact C-N 3.29Å; V661-K663 PolarHBondContact O-N 3.18Å; K663-S667 PolarHBondContact O-OG 2.9Å
664	L	53.4	Low	57.1	Low	79 Å²	79	107 Å²	107	41%	0.414	53%	0.532	S	S	.	.	H	α-helix	trans	-89.3	-8.4	174.5	-74.3	169.7	0	0	0	113.2	L660 V661 D662 R669	L660-L664 HydrophobicContact CG-CD1 4.37Å; L660-L664 WeakPolarHBondContact O-CB 3.46Å; L660-L664 WeakPolarHBondContact O-CD1 3.49Å; L660-L664 WeakPolarHBondContact O-CG 3.45Å; L660-L664 PolarHBondContact O-N 3.21Å; L660-L664 VanDerWaalsContact O-N 3.15Å; V661-L664 CarbonylContact O-C 3.4Å; V661-L664 VanDerWaalsContact O-CA 3.27Å; V661-L664 WeakPolarHBondContact O-CA 3.42Å; V661-L664 VanDerWaalsContact O-CB 3.31Å; V661-L664 WeakPolarHBondContact O-CB 3.48Å; V661-L664 PolarHBondContact O-N 2.8Å; D662-L664 VanDerWaalsContact C-N 3.29Å; D662-L664 PolarHBondContact O-N 2.91Å; L664-R669 PolarHBondContact O-NH2 3.1Å
665	E	52.7	Low	55.8	Low	153 Å²	153	106 Å²	106	72%	0.715	53%	0.528	S	S	*	.	H	α-helix	trans	-87.4	-38.2	165.5	-65.2	-175.3	163.8	0	0	111.4	V661 D662 S667	V661-E665 PolarHBondContact O-N 3.19Å; D662-E665 PolarHBondContact O-N 2.85Å; E665-S667 PolarHBondContact O-N 2.87Å
666	E	54.9	Low	54.6	Low	122 Å²	122	113 Å²	113	57%	0.57	55%	0.546	S	S	*	.	S	Bend	trans	-60.7	-13.1	174.2	-73.2	175.3	168.3	0	0	114.3	K658 D662	K658-E666 IonicContact NZ-OE1 3.54Å; K658-E666 PolarHBondContact NZ-OE1 3.24Å; D662-E666 PolarHBondContact O-N 3.22Å; D662-E666 VanDerWaalsContact O-N 3.16Å
667	S	55.3	Low	54.1	Low	54 Å²	54	114.2 Å²	114.2	38%	0.378	55%	0.551	S	S	.	*	S	Bend	trans	-106.6	106.9	-176.1	37.1	0	0	0	0	113.2	K663 E665 R669	K663-S667 PolarHBondContact O-OG 2.9Å; E665-S667 PolarHBondContact O-N 2.87Å; S667-R669 PolarHBondContact O-N 3.17Å
668	Q	55.4	Low	53.6	Low	191 Å²	191	116.9 Å²	116.9	89%	0.893	56%	0.555	S	S	*	*			trans	-62.2	133.3	-178.6	-63.6	-165.1	14	0	0	113.1
669	R	58.3	Low	52.6	Low	126 Å²	126	116 Å²	116	48%	0.475	56%	0.557	S	S	.	*			trans	-108	125.6	-172.7	-63	-173	-170.6	-145.2	2.2	112.1	L664 S667 K674	L664-R669 PolarHBondContact O-NH2 3.1Å; S667-R669 PolarHBondContact O-N 3.17Å; R669-K674 HydrophobicContact CB-CG 4.3Å; R669-K674 VanDerWaalsContact O-CE 3.3Å; R669-K674 WeakPolarHBondContact O-CE 3.36Å
670	C	62.7	Low	52.1	Low	18 Å²	18	117.7 Å²	117.7	12%	0.122	58%	0.576	C	S	.	*			trans	-63.7	157.1	175.8	71.2	0	0	0	0	111.9	E370 C372 R672 C673	E370-C670 WeakPolarHBondContact O-CB 3.32Å; C372-C670 HydrophobicContact CB-CB 4.21Å; C670-R672 PolarHBondContact O-N 3.31Å; C670-R672 VanDerWaalsContact O-N 3.1Å; C670-C673 PolarHBondContact O-N 3.29Å; C670-C673 PolarHBondContact O-SG 2.7Å; C670-C673 VanDerWaalsContact SG-SG 3.69Å
671	W	53.9	Low	51.6	Low	100 Å²	100	114 Å²	114	38%	0.379	57%	0.566	S	S	.	*	G	3₁₀ helix	trans	-58.1	-29.9	-175.3	68.2	-104.2	0	0	0	113.4	E369 C673 K674 R675	E369-W671 HydrophobicContact CG-CZ2 3.9Å; E369-W671 WeakPolarHBondContact OE1-CZ2 3.48Å; W671-C673 PolarHBondContact O-N 3.34Å; W671-K674 PolarHBondContact O-N 2.91Å; W671-K674 VanDerWaalsContact O-N 3.07Å; W671-R675 VanDerWaalsContact CZ3-NH2 3.35Å
672	R	53.4	Low	51	Low	132 Å²	132	119 Å²	119	50%	0.498	58%	0.583	S	S	.	*	G	3₁₀ helix	trans	-56.6	-32.4	178.5	-154.5	70.4	145.6	-122.2	-5.9	112.1	E369 C670	E369-R672 IonicContact OE1-NH1 2.67Å; E369-R672 IonicContact OE2-CZ 2.99Å; E369-R672 IonicContact OE2-NH1 3.62Å; E369-R672 PolarHBondContact OE2-NH1 3.18Å; E369-R672 IonicContact OE2-NH2 2.63Å; C670-R672 PolarHBondContact O-N 3.31Å; C670-R672 VanDerWaalsContact O-N 3.1Å
673	C	59.3	Low	50.6	Low	61 Å²	61	121.5 Å²	121.5	41%	0.412	60%	0.6	S	S	.	*	G	3₁₀ helix	trans	-107.1	12.8	179.6	61.8	0	0	0	0	114.4	C670 W671	C670-C673 PolarHBondContact O-N 3.29Å; C670-C673 PolarHBondContact O-SG 2.7Å; C670-C673 VanDerWaalsContact SG-SG 3.69Å; W671-C673 PolarHBondContact O-N 3.34Å
674	K	53.9	Low	49.9	Very low	154 Å²	154	123.3 Å²	123.3	67%	0.67	62%	0.616	S	S	*	*	S	Bend	trans	-105	9	170.5	-72.5	-169.7	173.8	-177.1	0	113.8	R669 W671	R669-K674 HydrophobicContact CB-CG 4.3Å; R669-K674 VanDerWaalsContact O-CE 3.3Å; R669-K674 WeakPolarHBondContact O-CE 3.36Å; W671-K674 PolarHBondContact O-N 2.91Å; W671-K674 VanDerWaalsContact O-N 3.07Å
675	R	47.8	Very low	49.7	Very low	187 Å²	187	124.1 Å²	124.1	71%	0.706	62%	0.619	S	S	*	*			trans	-88.1	115.6	-177.9	-70.8	-170.3	175.9	-162.4	1.3	112.8	W671	W671-R675 VanDerWaalsContact CZ3-NH2 3.35Å
676	R	43.1	Very low	49.3	Very low	206 Å²	206	126.5 Å²	126.5	78%	0.777	62%	0.622	S	S	*	*			trans	61	118.7	162.8	-61.6	-174.1	177.2	-172.2	-1.5	118.1
677	T	46	Very low	48.6	Very low	150 Å²	150	130.3 Å²	130.3	92%	0.92	64%	0.637	S	S	*	*	S	Bend	trans	-88.3	-4.8	164.3	43.9	0	0	0	0	113.8
678	T	44.3	Very low	48	Very low	116 Å²	116	134.4 Å²	134.4	71%	0.712	66%	0.655	S	S	*	*			trans	-105.5	25.8	-171.3	48.9	0	0	0	0	114.2
679	N	39.5	Very low	47.7	Very low	114 Å²	114	126.6 Å²	126.6	61%	0.61	62%	0.621	S	S	*	*			trans	-101.3	93.1	178.2	-162	58.1	0	0	0	111.6	G681	N679-G681 PolarHBondContact ND2-O 3.37Å; N679-G681 PolarHBondContact O-N 2.76Å; N679-G681 VanDerWaalsContact O-N 3.13Å
680	C	45.9	Very low	47.3	Very low	136 Å²	136	129.6 Å²	129.6	92%	0.919	63%	0.632	S	S	*	*			trans	-80.8	87.2	177.6	-66.9	0	0	0	0	110.9
681	G	43	Very low	46.7	Very low	39 Å²	39	136.3 Å²	136.3	40%	0.402	66%	0.656	S	S	.	*			trans	88.1	148.2	-172.6	0	0	0	0	0	112.1	N679	N679-G681 PolarHBondContact ND2-O 3.37Å; N679-G681 PolarHBondContact O-N 2.76Å; N679-G681 VanDerWaalsContact O-N 3.13Å
682	E	41.1	Very low	46.3	Very low	192 Å²	192	136.7 Å²	136.7	90%	0.897	67%	0.665	S	S	*	*			cis	-103.3	116.7	8.9	-62.6	170.7	150.1	0	0	111.6
683	T	43.2	Very low	45.4	Very low	99 Å²	99	136.7 Å²	136.7	61%	0.607	69%	0.685	S	S	*	*			trans	-82	119	164.9	48.4	0	0	0	0	109.1	I685	T683-I685 HydrophobicContact CG2-CD1 4.04Å; T683-I685 PolarHBondContact O-N 3.02Å
684	N	41.5	Very low	44.8	Very low	160 Å²	160	138.2 Å²	138.2	86%	0.856	71%	0.711	S	S	*	*			trans	-71.5	43.5	161.7	-89.7	-27	0	0	0	111.8
685	I	47.7	Very low	44.4	Very low	96 Å²	96	133.3 Å²	133.3	49%	0.492	70%	0.696	S	S	.	*			trans	-88.8	110.2	164.1	-67.9	172.4	0	0	0	104.5	T683 S689	T683-I685 HydrophobicContact CG2-CD1 4.04Å; T683-I685 PolarHBondContact O-N 3.02Å; I685-S689 VanDerWaalsContact CG2-OG 3.24Å; I685-S689 WeakPolarHBondContact CG2-OG 3.5Å
686	W	44.3	Very low	44.2	Very low	204 Å²	204	132.6 Å²	132.6	77%	0.773	70%	0.701	S	S	*	*			trans	-64.4	139	-179.6	-69.4	30.7	0	0	0	108.3	D688 S689	W686-D688 PolarHBondContact O-N 2.89Å; W686-S689 WeakPolarHBondContact O-CB 3.41Å; W686-S689 PolarHBondContact O-N 3.33Å; W686-S689 PolarHBondContact O-OG 3.22Å
687	K	41.2	Very low	44	Very low	202 Å²	202	130.8 Å²	130.8	88%	0.878	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59	-20.5	-167.6	-72.9	-178.4	177.1	175.3	0	114.7
688	D	43.3	Very low	43.7	Very low	140 Å²	140	128.3 Å²	128.3	75%	0.749	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	-12.5	-180	-54.2	-60.2	0	0	0	113.5	W686 R690	W686-D688 PolarHBondContact O-N 2.89Å; D688-R690 PolarHBondContact O-N 3.44Å
689	S	49.2	Very low	43.9	Very low	26 Å²	26	130.5 Å²	130.5	18%	0.182	68%	0.684	C	S	.	*			trans	-71.9	126.2	-177.1	60.7	0	0	0	0	112.1	I685 W686 I699	I685-S689 VanDerWaalsContact CG2-OG 3.24Å; I685-S689 WeakPolarHBondContact CG2-OG 3.5Å; W686-S689 WeakPolarHBondContact O-CB 3.41Å; W686-S689 PolarHBondContact O-N 3.33Å; W686-S689 PolarHBondContact O-OG 3.22Å; S689-I699 CarbonylContact C-O 3.45Å; S689-I699 WeakPolarHBondContact CA-O 3.18Å; S689-I699 WeakPolarHBondContact CB-O 3.47Å
690	R	49.3	Very low	44.1	Very low	190 Å²	190	131.3 Å²	131.3	72%	0.717	69%	0.687	S	S	*	*			trans	-138	123.7	-171.9	-67.5	-177	-170.2	-147	1.9	111.1	D688 L692 I699	D688-R690 PolarHBondContact O-N 3.44Å; R690-L692 PolarHBondContact O-N 2.96Å; R690-I699 PolarHBondContact N-O 3.32Å; R690-I699 VanDerWaalsContact N-O 3.16Å
691	Y	49.6	Very low	44	Very low	159 Å²	159	131.1 Å²	131.1	62%	0.624	68%	0.675	S	S	*	*	B	Isolated β-bridge	trans	-66.2	123.3	167	-70.5	-81.1	0	0	0	110.2	S693 M698	Y691-S693 PolarHBondContact O-N 3.31Å; Y691-M698 HydrophobicContact CE1-CB 4.3Å; Y691-M698 HydrophobicContact CE1-CE 4.22Å; Y691-M698 HydrophobicContact CE2-CE 4.01Å; Y691-M698 WeakPolarHBondContact OH-CE 3.5Å
692	L	46.6	Very low	44.1	Very low	108 Å²	108	136.2 Å²	136.2	57%	0.565	69%	0.69	S	S	*	*			trans	-77.9	112.9	167.2	-66.8	171.6	0	0	0	108.4	R690 G694 S695 I699	R690-L692 PolarHBondContact O-N 2.96Å; L692-G694 PolarHBondContact O-N 3Å; L692-G694 VanDerWaalsContact O-N 3.16Å; L692-S695 PolarHBondContact O-N 2.77Å; L692-S695 PolarHBondContact O-OG 2.89Å; L692-I699 HydrophobicContact CD1-CD1 4.01Å
693	S	34.8	Very low	44.3	Very low	132 Å²	132	132.9 Å²	132.9	92%	0.923	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.6	117.5	-178.9	-56.9	0	0	0	0	111.8	Y691	Y691-S693 PolarHBondContact O-N 3.31Å
694	G	46.2	Very low	44.3	Very low	93 Å²	93	135 Å²	135	96%	0.959	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	99.9	0.5	-176.5	0	0	0	0	0	115.3	L692	L692-G694 PolarHBondContact O-N 3Å; L692-G694 VanDerWaalsContact O-N 3.16Å
695	S	44.6	Very low	44.5	Very low	51 Å²	51	133.3 Å²	133.3	36%	0.357	67%	0.671	S	S	.	*			trans	-116.8	155	173.8	75.3	0	0	0	0	112.4	L692	L692-S695 PolarHBondContact O-N 2.77Å; L692-S695 PolarHBondContact O-OG 2.89Å
696	Q	44.3	Very low	44.3	Very low	172 Å²	172	136 Å²	136	80%	0.804	68%	0.684	S	S	*	*	S	Bend	trans	-92.5	5.7	176.7	-64	-173.8	4.2	0	0	113.5
697	F	38.3	Very low	44.3	Very low	168 Å²	168	130.8 Å²	130.8	74%	0.737	68%	0.677	S	S	*	*			trans	-106.2	137.4	-175.9	-64.3	-73.3	0	0	0	111.4
698	M	40.4	Very low	44.6	Very low	97 Å²	97	124.8 Å²	124.8	48%	0.478	66%	0.66	S	S	.	*	B	Isolated β-bridge	trans	-93.3	135.9	167.6	-177.2	-172.4	-65.7	0	0	107.9	Y691	Y691-M698 HydrophobicContact CE1-CB 4.3Å; Y691-M698 HydrophobicContact CE1-CE 4.22Å; Y691-M698 HydrophobicContact CE2-CE 4.01Å; Y691-M698 WeakPolarHBondContact OH-CE 3.5Å
699	I	48.2	Very low	44.7	Very low	162 Å²	162	123.5 Å²	123.5	83%	0.831	65%	0.652	S	S	*	*			trans	-102.6	0	162	-54.5	175.7	0	0	0	105.8	S689 R690 L692	S689-I699 CarbonylContact C-O 3.45Å; S689-I699 WeakPolarHBondContact CA-O 3.18Å; S689-I699 WeakPolarHBondContact CB-O 3.47Å; R690-I699 PolarHBondContact N-O 3.32Å; R690-I699 VanDerWaalsContact N-O 3.16Å; L692-I699 HydrophobicContact CD1-CD1 4.01Å

Retrieved 699 of 699 residues in 107.6 ms (Link to these results)

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