A0A077Z500_TRITR Loading...

ARF GTPase activating protein GIT2

AlphaFold DB , UniProt , Accession A0A077Z500, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 757 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.5	Very low	56.3	Low	231 Å²	231	109.6 Å²	109.6	100%	1.138	59%	0.594	S	S	*	*				0	130.6	0	-74.4	173.5	162.5	0	0	109.6	K3	M1-K3 PolarHBondContact O-N 3.41Å
2	S	30.5	Very low	58.7	Low	115 Å²	115	110.3 Å²	110.3	80%	0.804	63%	0.626	S	S	*	*			trans	-63.3	124	175.2	-49.6	0	0	0	0	109.9	V4	S2-V4 VanDerWaalsContact C-N 3.29Å; S2-V4 PolarHBondContact O-N 3.06Å
3	K	31.9	Very low	60.9	Low	206 Å²	206	111.8 Å²	111.8	90%	0.896	63%	0.631	S	S	*	*			trans	-70.3	85.2	176.1	-75.6	-176.4	176.9	178.5	0	110	M1 K5	M1-K3 PolarHBondContact O-N 3.41Å; K3-K5 PolarHBondContact O-N 3.19Å
4	V	37.3	Very low	63	Low	124 Å²	124	104.1 Å²	104.1	75%	0.752	59%	0.588	S	S	*	*			trans	-60.7	105.7	161.8	-179.7	0	0	0	0	106.3	S2 M6	S2-V4 VanDerWaalsContact C-N 3.29Å; S2-V4 PolarHBondContact O-N 3.06Å; V4-M6 VanDerWaalsContact C-N 3.34Å; V4-M6 PolarHBondContact O-N 3.35Å
5	K	41.3	Very low	65.1	Low	195 Å²	195	101.2 Å²	101.2	85%	0.848	57%	0.574	S	S	*	*			trans	-64.2	99.8	169.1	-86.9	-178.3	172.6	177.2	0	107	K3 S7	K3-K5 PolarHBondContact O-N 3.19Å; K5-S7 PolarHBondContact O-N 3.05Å
6	M	54.8	Low	67	Low	91 Å²	91	94.9 Å²	94.9	45%	0.448	54%	0.538	S	S	.	.			trans	-50.3	115	162.3	-75	-86.3	-91.3	0	0	107.2	V4 T8 L66	V4-M6 VanDerWaalsContact C-N 3.34Å; V4-M6 PolarHBondContact O-N 3.35Å; M6-T8 PolarHBondContact O-N 3.23Å; M6-L66 HydrophobicContact CB-CD2 4.35Å
7	S	61.5	Low	68.7	Low	72 Å²	72	89.8 Å²	89.8	50%	0.503	51%	0.511	S	S	.	.			trans	-62.8	123.6	176.3	53.4	0	0	0	0	108.3	K5 S9	K5-S7 PolarHBondContact O-N 3.05Å; S7-S9 WeakPolarHBondContact CB-OG 3.48Å; S7-S9 PolarHBondContact O-N 3.03Å; S7-S9 VanDerWaalsContact O-N 3.07Å
8	T	77.6	Confident	70.3	Confident	68 Å²	68	84.9 Å²	84.9	42%	0.417	48%	0.483	S	S	.	.	S	Bend	trans	-73.9	5.9	176.8	70.4	0	0	0	0	112.8	M6 L56 L66	M6-T8 PolarHBondContact O-N 3.23Å; T8-L56 WeakPolarHBondContact CB-O 3.21Å; T8-L56 CarbonylContact O-C 3.6Å; T8-L56 VanDerWaalsContact O-CB 3.26Å; T8-L56 WeakPolarHBondContact O-CB 3.28Å; T8-L56 PolarHBondContact OG1-O 3.2Å; T8-L66 HydrophobicContact CG2-CD2 4.29Å
9	S	82.2	Confident	71.5	Confident	52 Å²	52	80.7 Å²	80.7	36%	0.364	46%	0.459	S	S	.	.	S	Bend	trans	-79.2	151.9	171.2	50.7	0	0	0	0	111.9	S7 H70	S7-S9 WeakPolarHBondContact CB-OG 3.48Å; S7-S9 PolarHBondContact O-N 3.03Å; S7-S9 VanDerWaalsContact O-N 3.07Å; S9-H70 PolarHBondContact O-CE1 2.95Å
10	A	82.7	Confident	72.5	Confident	18 Å²	18	78.3 Å²	78.3	15%	0.149	45%	0.448	C	S	.	.	P	Polyproline II helix	trans	-57.8	157.6	164.9	0	0	0	0	0	110.8	A14 P24 F34 L56	A10-A14 HydrophobicContact CB-CB 3.96Å; A10-P24 HydrophobicContact CB-CG 4Å; A10-F34 HydrophobicContact CB-CD1 3.95Å; A10-F34 HydrophobicContact CB-CD2 4.38Å; A10-F34 HydrophobicContact CB-CE1 4.17Å; A10-F34 HydrophobicContact CB-CG 4.06Å; A10-F34 HydrophobicContact CB-CZ 4.49Å; A10-L56 HydrophobicContact CB-CD1 3.87Å
11	P	88.4	Confident	73.4	Confident	34 Å²	34	75.6 Å²	75.6	22%	0.221	43%	0.432	C	S	.	.	P	Polyproline II helix	trans	-51.2	152.3	167.2	-25.4	34.8	0	0	0	112.2	D13 A14 F34 H70	P11-D13 WeakPolarHBondContact CB-OD1 3.46Å; P11-D13 PolarHBondContact O-N 3.16Å; P11-A14 HydrophobicContact CB-CB 3.93Å; P11-A14 HydrophobicContact CG-CB 4.09Å; P11-A14 WeakPolarHBondContact O-CB 3.27Å; P11-A14 PolarHBondContact O-N 2.88Å; P11-F34 HydrophobicContact CG-CE2 3.97Å; P11-F34 HydrophobicContact CG-CZ 4.43Å; P11-H70 WeakPolarHBondContact CG-ND1 3.21Å
12	A	85.1	Confident	76	Confident	118 Å²	118	71.2 Å²	71.2	98%	0.975	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-22.2	-176	0	0	0	0	0	113.6
13	D	87.1	Confident	78.7	Confident	129 Å²	129	71.3 Å²	71.3	69%	0.69	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-8.1	176.1	59.7	-44.7	0	0	0	113.5	P11 V15	P11-D13 WeakPolarHBondContact CB-OD1 3.46Å; P11-D13 PolarHBondContact O-N 3.16Å; D13-V15 PolarHBondContact O-N 3.28Å
14	A	90.9	Very high	81.6	Confident	4 Å²	4	62.2 Å²	62.2	3%	0.033	36%	0.362	C	S	.	.			trans	-74.9	111.4	-175.7	0	0	0	0	0	111.9	A10 P11 P24 F34 H73	A10-A14 HydrophobicContact CB-CB 3.96Å; P11-A14 HydrophobicContact CB-CB 3.93Å; P11-A14 HydrophobicContact CG-CB 4.09Å; P11-A14 WeakPolarHBondContact O-CB 3.27Å; P11-A14 PolarHBondContact O-N 2.88Å; A14-P24 HydrophobicContact CB-CG 4.5Å; A14-P24 WeakPolarHBondContact O-CD 3.36Å; A14-P24 WeakPolarHBondContact O-CG 3.45Å; A14-F34 HydrophobicContact CB-CD2 3.82Å; A14-F34 HydrophobicContact CB-CE2 4.37Å; A14-F34 HydrophobicContact CB-CG 4.45Å; A14-H73 WeakPolarHBondContact CB-NE2 3.06Å
15	V	94	Very high	84.2	Confident	61 Å²	61	57.3 Å²	57.3	37%	0.37	33%	0.332	S	S	.	.			trans	-91.1	161.5	168.9	-57.2	0	0	0	0	111.5	D13 A17	D13-V15 PolarHBondContact O-N 3.28Å; V15-A17 PolarHBondContact O-N 2.8Å
16	C	95.6	Very high	86.8	Confident	0 Å²	0	48 Å²	48	0%	0	29%	0.292	C	S	.	.			trans	-55.7	121.5	170	177.9	0	0	0	0	110.6	D18 S20 D21 C36 C39	C16-D18 PolarHBondContact O-N 3.46Å; C16-D18 VanDerWaalsContact O-N 3.08Å; C16-S20 VanDerWaalsContact O-CA 3.26Å; C16-S20 WeakPolarHBondContact O-CA 3.34Å; C16-S20 PolarHBondContact O-N 2.85Å; C16-D21 HydrophobicContact CB-CB 4.05Å; C16-D21 WeakPolarHBondContact CB-O 3.37Å; C16-D21 PolarHBondContact N-O 3.12Å; C16-C36 HydrophobicContact CB-CB 4.03Å; C16-C36 PolarHBondContact SG-N 3.29Å; C16-C36 VanDerWaalsContact SG-SG 3.69Å; C16-C39 VanDerWaalsContact SG-SG 3.67Å
17	A	96.4	Very high	88.8	Confident	9 Å²	9	43.7 Å²	43.7	7%	0.074	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-20.1	-175.8	0	0	0	0	0	114	V15 V33 F34 N78 K99 K137	V15-A17 PolarHBondContact O-N 2.8Å; A17-V33 HydrophobicContact CB-CB 3.64Å; A17-V33 HydrophobicContact CB-CG1 3.84Å; A17-V33 HydrophobicContact CB-CG2 4.3Å; A17-F34 WeakPolarHBondContact CB-O 3.22Å; A17-F34 PolarHBondContact N-O 3.01Å; A17-N78 PolarHBondContact O-OD1 3.03Å; A17-K99 WeakPolarHBondContact O-CE 3.25Å; A17-K99 PolarHBondContact O-NZ 2.74Å; A17-K137 PolarHBondContact O-NZ 3.08Å
18	D	96.2	Very high	90.4	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.005	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.2	-29.4	-173.5	-52.1	-45.3	0	0	0	114.2	C16 I35 C39 H43 F133 I134 K137 Y138	C16-D18 PolarHBondContact O-N 3.46Å; C16-D18 VanDerWaalsContact O-N 3.08Å; D18-I35 VanDerWaalsContact OD2-CG2 3.3Å; D18-I35 WeakPolarHBondContact OD2-CG2 3.41Å; D18-C39 HydrophobicContact CB-CB 4.37Å; D18-H43 IonicContact OD2-CE1 3.65Å; D18-H43 IonicContact OD2-NE2 2.7Å; D18-H43 PolarHBondContact OD2-NE2 2.93Å; D18-F133 HydrophobicContact CB-CD1 4.42Å; D18-F133 HydrophobicContact CB-CE1 4.35Å; D18-F133 WeakPolarHBondContact O-CE1 3.33Å; D18-I134 HydrophobicContact CB-CD1 4.27Å; D18-I134 HydrophobicContact CB-CG1 3.88Å; D18-K137 WeakPolarHBondContact OD1-CD 3.34Å; D18-K137 WeakPolarHBondContact OD1-CE 3.45Å; D18-K137 IonicContact OD1-NZ 3.43Å; D18-K137 PolarHBondContact OD1-NZ 2.86Å; D18-Y138 WeakPolarHBondContact OD1-CE2 3.17Å; D18-Y138 VanDerWaalsContact OD1-CZ 3.29Å; D18-Y138 PolarHBondContact OD1-OH 3.37Å
19	C	93.2	Very high	91.3	Very high	5 Å²	5	37.5 Å²	37.5	3%	0.034	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-130.9	3.4	-178.1	75.7	0	0	0	0	114.9	D21 P100 P102 K130	C19-D21 VanDerWaalsContact C-N 3.25Å; C19-D21 PolarHBondContact O-N 3.16Å; C19-P100 CarbonylContact C-O 3.58Å; C19-P100 WeakPolarHBondContact CA-O 3.39Å; C19-P100 HydrophobicContact CB-CB 4.21Å; C19-P102 WeakPolarHBondContact O-CD 3.5Å; C19-K130 HydrophobicContact CB-CD 4.23Å; C19-K130 HydrophobicContact CB-CG 4.4Å
20	S	92.9	Very high	91.8	Very high	33 Å²	33	35.1 Å²	35.1	23%	0.231	21%	0.212	C	C	.	.			trans	57.6	27.5	179.2	-60.1	0	0	0	0	115.8	C16	C16-S20 VanDerWaalsContact O-CA 3.26Å; C16-S20 WeakPolarHBondContact O-CA 3.34Å; C16-S20 PolarHBondContact O-N 2.85Å
21	D	90.3	Very high	92.4	Very high	21 Å²	21	34.4 Å²	34.4	11%	0.112	21%	0.206	C	C	.	.			trans	-70.2	134.7	167.7	-168.5	9	0	0	0	111.3	C16 C19 N23 C36 R123	C16-D21 HydrophobicContact CB-CB 4.05Å; C16-D21 WeakPolarHBondContact CB-O 3.37Å; C16-D21 PolarHBondContact N-O 3.12Å; C19-D21 VanDerWaalsContact C-N 3.25Å; C19-D21 PolarHBondContact O-N 3.16Å; D21-N23 VanDerWaalsContact C-N 3.26Å; D21-N23 PolarHBondContact O-N 2.96Å; D21-C36 HydrophobicContact CB-CB 4.16Å; D21-R123 IonicContact OD1-CZ 3.37Å; D21-R123 IonicContact OD1-NH1 3.32Å; D21-R123 PolarHBondContact OD1-NH1 2.94Å; D21-R123 IonicContact OD1-NH2 2.72Å; D21-R123 PolarHBondContact OD1-NH2 2.86Å; D21-R123 IonicContact OD2-CZ 2.69Å; D21-R123 IonicContact OD2-NH1 3.65Å; D21-R123 PolarHBondContact OD2-NH1 2.91Å; D21-R123 IonicContact OD2-NH2 3.29Å
22	E	87.3	Confident	92.8	Very high	139 Å²	139	32.8 Å²	32.8	65%	0.65	20%	0.195	S	C	*	.	S	Bend	trans	-73.9	-9.1	-165.2	-62.5	170.3	167.5	0	0	114.7
23	N	85.6	Confident	93.3	Very high	118 Å²	118	27.2 Å²	27.2	63%	0.631	15%	0.149	S	C	*	.			trans	-128	68.9	-173.9	-74.4	-89.9	0	0	0	112	D21 T25	D21-N23 VanDerWaalsContact C-N 3.26Å; D21-N23 PolarHBondContact O-N 2.96Å; N23-T25 PolarHBondContact O-N 3Å
24	P	92.4	Very high	93.8	Very high	14 Å²	14	21 Å²	21	9%	0.091	12%	0.116	C	C	.	.			trans	-65.6	133.9	172.4	29.2	-33.8	0	0	0	111.2	A10 A14 F34 I35	A10-P24 HydrophobicContact CB-CG 4Å; A14-P24 HydrophobicContact CB-CG 4.5Å; A14-P24 WeakPolarHBondContact O-CD 3.36Å; A14-P24 WeakPolarHBondContact O-CG 3.45Å; P24-F34 HydrophobicContact CB-CB 3.81Å; P24-F34 HydrophobicContact CG-CB 3.89Å; P24-I35 WeakPolarHBondContact CA-O 3.29Å; P24-I35 WeakPolarHBondContact CB-O 3.36Å
25	T	92.9	Very high	94	Very high	21 Å²	21	20.9 Å²	20.9	13%	0.129	11%	0.114	C	C	.	.			trans	-119.2	-2.5	-175.8	46.8	0	0	0	0	112.6	N23 I35 T37 L56	N23-T25 PolarHBondContact O-N 3Å; T25-I35 PolarHBondContact N-O 3.1Å; T25-T37 PolarHBondContact OG1-OG1 3.17Å; T25-T37 VanDerWaalsContact OG1-OG1 3.07Å; T25-L56 WeakPolarHBondContact O-CB 3.46Å; T25-L56 PolarHBondContact O-N 3.44Å
26	W	95.1	Very high	94	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	161.8	-178.8	-60.8	85.3	0	0	0	109.5	I35 C40 R54 I326 A329 W330 N333	W26-I35 HydrophobicContact CB-CG1 3.8Å; W26-I35 PolarHBondContact N-O 3.14Å; W26-I35 VanDerWaalsContact N-O 3.1Å; W26-I35 PolarHBondContact O-N 3.44Å; W26-I35 VanDerWaalsContact O-O 3.13Å; W26-C40 HydrophobicContact CB-CB 4.05Å; W26-C40 HydrophobicContact CD2-CB 4.17Å; W26-C40 VanDerWaalsContact CE3-SG 3.54Å; W26-C40 HydrophobicContact CG-CB 3.76Å; W26-C40 VanDerWaalsContact CG-SG 3.6Å; W26-R54 WeakPolarHBondContact CA-O 3.23Å; W26-I326 HydrophobicContact CZ3-CG2 4.4Å; W26-A329 HydrophobicContact CH2-CB 4.11Å; W26-W330 HydrophobicContact CH2-CB 4.17Å; W26-W330 HydrophobicContact CH2-CE3 4.06Å; W26-W330 HydrophobicContact CZ2-CB 4.44Å; W26-W330 HydrophobicContact CZ2-CD2 4.47Å; W26-W330 AromaticContact CZ2-CE3 3.66Å; W26-W330 HydrophobicContact CZ2-CE3 3.66Å; W26-W330 HydrophobicContact CZ2-CZ3 4.29Å; W26-N333 HydrophobicContact CZ2-CB 4.25Å
27	A	96.9	Very high	93.6	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	148.8	170	0	0	0	0	0	110.5	V33 F34 V53 R54 L56 W61 V69	A27-V33 CarbonylContact C-O 3.58Å; A27-V33 VanDerWaalsContact CA-O 3.28Å; A27-V33 WeakPolarHBondContact CA-O 3.44Å; A27-F34 HydrophobicContact CB-CD1 4Å; A27-F34 HydrophobicContact CB-CE1 4.35Å; A27-V53 CarbonylContact O-C 3.56Å; A27-V53 VanDerWaalsContact O-CA 3.29Å; A27-V53 WeakPolarHBondContact O-CA 3.37Å; A27-R54 PolarHBondContact N-O 3.23Å; A27-R54 PolarHBondContact O-N 2.97Å; A27-L56 HydrophobicContact CB-CD2 4.22Å; A27-W61 HydrophobicContact CB-CH2 3.9Å; A27-W61 HydrophobicContact CB-CZ2 4.16Å; A27-V69 HydrophobicContact CB-CG1 3.96Å
28	S	96.7	Very high	93.2	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	105.3	165.5	-177.7	0	0	0	0	108.3	N30 R31 G32 V33 S51 Q52	S28-N30 PolarHBondContact OG-OD1 3.46Å; S28-R31 CarbonylContact O-C 3.52Å; S28-R31 PolarHBondContact O-N 3.16Å; S28-R31 WeakPolarHBondContact OG-CG 3.18Å; S28-G32 PolarHBondContact O-N 3.1Å; S28-V33 PolarHBondContact N-O 3.22Å; S28-V33 PolarHBondContact O-N 3.07Å; S28-S51 WeakPolarHBondContact CB-OG 3.28Å; S28-S51 PolarHBondContact OG-OG 3.45Å; S28-Q52 CarbonylContact C-O 3.55Å; S28-Q52 WeakPolarHBondContact CA-O 3.46Å
29	I	95.1	Very high	93.1	Very high	10 Å²	10	21.9 Å²	21.9	5%	0.051	12%	0.116	C	C	.	.	G	3₁₀ helix	trans	-64.8	-54.7	-166.6	-49.4	174.6	0	0	0	110.9	R31 G32 Q52 R54 W61 V69 L223	I29-R31 PolarHBondContact O-N 2.66Å; I29-R31 VanDerWaalsContact O-N 3.07Å; I29-G32 PolarHBondContact O-N 3.13Å; I29-Q52 PolarHBondContact N-O 3.45Å; I29-R54 HydrophobicContact CD1-CB 4.03Å; I29-R54 HydrophobicContact CG1-CB 4.4Å; I29-W61 HydrophobicContact CD1-CH2 4.38Å; I29-W61 HydrophobicContact CD1-CZ3 4.35Å; I29-W61 HydrophobicContact CG1-CH2 4.03Å; I29-W61 HydrophobicContact CG1-CZ3 4.26Å; I29-V69 HydrophobicContact CB-CG2 4.4Å; I29-V69 HydrophobicContact CG2-CG2 4.02Å; I29-L223 HydrophobicContact CG2-CD1 3.61Å; I29-L223 HydrophobicContact CG2-CD2 4.32Å
30	N	93.8	Very high	93.1	Very high	2 Å²	2	21.7 Å²	21.7	1%	0.011	11%	0.114	C	C	.	.	G	3₁₀ helix	trans	-64.5	-12.9	179.1	71.3	-48.3	0	0	0	114.3	S28 V50 Q52 L223 Y224	S28-N30 PolarHBondContact OG-OD1 3.46Å; N30-V50 PolarHBondContact ND2-O 3.44Å; N30-Q52 HydrophobicContact CB-CG 4.3Å; N30-Q52 PolarHBondContact OD1-N 2.92Å; N30-L223 HydrophobicContact CB-CB 4.46Å; N30-Y224 HydrophobicContact CB-CE2 4.34Å; N30-Y224 VanDerWaalsContact O-CE2 3.29Å; N30-Y224 WeakPolarHBondContact O-CE2 3.4Å; N30-Y224 PolarHBondContact O-OH 3.06Å
31	R	95.3	Very high	93	Very high	4 Å²	4	20.2 Å²	20.2	2%	0.015	10%	0.104	C	C	.	.	G	3₁₀ helix	trans	-103.7	-10.5	175.6	-55.5	-59.8	179.3	-166.9	1.3	112.5	S28 I29 V33 V50 W81 Y138	S28-R31 CarbonylContact O-C 3.52Å; S28-R31 PolarHBondContact O-N 3.16Å; S28-R31 WeakPolarHBondContact OG-CG 3.18Å; I29-R31 PolarHBondContact O-N 2.66Å; I29-R31 VanDerWaalsContact O-N 3.07Å; R31-V33 HydrophobicContact CB-CG2 3.89Å; R31-V33 PolarHBondContact O-N 3.34Å; R31-V50 PolarHBondContact NE-O 3.37Å; R31-V50 PolarHBondContact NH2-O 2.85Å; R31-W81 HydrophobicContact CB-CZ2 3.97Å; R31-W81 HydrophobicContact CG-CZ2 4.21Å; R31-W81 VanDerWaalsContact NH1-CZ3 3.33Å; R31-W81 PolarHBondContact O-NE1 2.93Å; R31-Y138 HydrophobicContact CB-CD1 4.44Å; R31-Y138 HydrophobicContact CB-CE1 4.14Å; R31-Y138 HydrophobicContact CG-CD1 3.93Å; R31-Y138 HydrophobicContact CG-CE1 4.12Å
32	G	95.3	Very high	93.1	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.1	32	178.5	0	0	0	0	0	114.6	S28 I29 S77	S28-G32 PolarHBondContact O-N 3.1Å; I29-G32 PolarHBondContact O-N 3.13Å; G32-S77 PolarHBondContact O-OG 2.87Å
33	V	96.7	Very high	93.5	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	146.7	-172.4	-68.7	0	0	0	0	113.4	A17 A27 S28 R31 I35 N78	A17-V33 HydrophobicContact CB-CB 3.64Å; A17-V33 HydrophobicContact CB-CG1 3.84Å; A17-V33 HydrophobicContact CB-CG2 4.3Å; A27-V33 CarbonylContact C-O 3.58Å; A27-V33 VanDerWaalsContact CA-O 3.28Å; A27-V33 WeakPolarHBondContact CA-O 3.44Å; S28-V33 PolarHBondContact N-O 3.22Å; S28-V33 PolarHBondContact O-N 3.07Å; R31-V33 HydrophobicContact CB-CG2 3.89Å; R31-V33 PolarHBondContact O-N 3.34Å; V33-I35 HydrophobicContact CG2-CG2 4.28Å; V33-N78 HydrophobicContact CG1-CB 4.36Å
34	F	97.4	Very high	93.9	Very high	0 Å²	0	7.9 Å²	7.9	0%	0	4%	0.041	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	137.4	171	-61.5	-67.5	0	0	0	110.8	A10 P11 A14 A17 P24 A27 L56 V69 H70 H73	A10-F34 HydrophobicContact CB-CD1 3.95Å; A10-F34 HydrophobicContact CB-CD2 4.38Å; A10-F34 HydrophobicContact CB-CE1 4.17Å; A10-F34 HydrophobicContact CB-CG 4.06Å; A10-F34 HydrophobicContact CB-CZ 4.49Å; P11-F34 HydrophobicContact CG-CE2 3.97Å; P11-F34 HydrophobicContact CG-CZ 4.43Å; A14-F34 HydrophobicContact CB-CD2 3.82Å; A14-F34 HydrophobicContact CB-CE2 4.37Å; A14-F34 HydrophobicContact CB-CG 4.45Å; A17-F34 WeakPolarHBondContact CB-O 3.22Å; A17-F34 PolarHBondContact N-O 3.01Å; P24-F34 HydrophobicContact CB-CB 3.81Å; P24-F34 HydrophobicContact CG-CB 3.89Å; A27-F34 HydrophobicContact CB-CD1 4Å; A27-F34 HydrophobicContact CB-CE1 4.35Å; F34-L56 HydrophobicContact CD1-CD1 3.96Å; F34-L56 HydrophobicContact CD1-CD2 4.2Å; F34-L56 HydrophobicContact CE1-CD1 4.35Å; F34-L56 HydrophobicContact CE1-CD2 3.97Å; F34-V69 HydrophobicContact CD1-CG1 4.13Å; F34-V69 HydrophobicContact CE1-CG1 3.61Å; F34-V69 HydrophobicContact CE2-CG1 4.29Å; F34-V69 HydrophobicContact CZ-CG1 3.7Å; F34-H70 AromaticContact CZ-CE1 3.98Å; F34-H70 AromaticContact CZ-ND1 3.94Å; F34-H73 HydrophobicContact CD2-CB 4.07Å; F34-H73 AromaticContact CD2-CD2 3.85Å; F34-H73 AromaticContact CD2-CG 3.63Å; F34-H73 AromaticContact CD2-ND1 3.79Å; F34-H73 HydrophobicContact CE2-CB 3.7Å; F34-H73 AromaticContact CE2-CD2 3.67Å; F34-H73 AromaticContact CE2-CG 3.59Å
35	I	95.9	Very high	93.9	Very high	0 Å²	0	9.2 Å²	9.2	0%	0	5%	0.051	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	149.1	-175.9	65.2	-176.6	0	0	0	111.6	D18 P24 T25 W26 V33 C39 C40 H43 V53	D18-I35 VanDerWaalsContact OD2-CG2 3.3Å; D18-I35 WeakPolarHBondContact OD2-CG2 3.41Å; P24-I35 WeakPolarHBondContact CA-O 3.29Å; P24-I35 WeakPolarHBondContact CB-O 3.36Å; T25-I35 PolarHBondContact N-O 3.1Å; W26-I35 HydrophobicContact CB-CG1 3.8Å; W26-I35 PolarHBondContact N-O 3.14Å; W26-I35 VanDerWaalsContact N-O 3.1Å; W26-I35 PolarHBondContact O-N 3.44Å; W26-I35 VanDerWaalsContact O-O 3.13Å; V33-I35 HydrophobicContact CG2-CG2 4.28Å; I35-C39 HydrophobicContact CB-CB 4.32Å; I35-C40 HydrophobicContact CD1-CB 3.94Å; I35-C40 HydrophobicContact CG1-CB 4.19Å; I35-H43 HydrophobicContact CD1-CB 4.19Å; I35-V53 HydrophobicContact CD1-CG1 4.19Å
36	C	92.2	Very high	93.9	Very high	3 Å²	3	8.7 Å²	8.7	2%	0.02	5%	0.047	C	C	.	.			trans	-77.6	164.4	174.4	72.4	0	0	0	0	111.6	C16 D21 E38 C39 C40	C16-C36 HydrophobicContact CB-CB 4.03Å; C16-C36 PolarHBondContact SG-N 3.29Å; C16-C36 VanDerWaalsContact SG-SG 3.69Å; D21-C36 HydrophobicContact CB-CB 4.16Å; C36-E38 VanDerWaalsContact C-N 3.27Å; C36-E38 PolarHBondContact O-N 3.35Å; C36-C39 PolarHBondContact O-N 2.76Å; C36-C39 VanDerWaalsContact O-N 3.17Å; C36-C39 VanDerWaalsContact SG-SG 3.62Å; C36-C40 WeakPolarHBondContact O-CB 3.48Å; C36-C40 PolarHBondContact O-N 2.83Å
37	T	89.1	Confident	93.7	Very high	25 Å²	25	9 Å²	9	15%	0.153	5%	0.051	C	C	.	.	H	α-helix	trans	-51.6	-44.8	177.8	-47.5	0	0	0	0	112	T25 C39 C40 C41 W330 N333 E334	T25-T37 PolarHBondContact OG1-OG1 3.17Å; T25-T37 VanDerWaalsContact OG1-OG1 3.07Å; T37-C39 PolarHBondContact O-N 3.16Å; T37-C40 WeakPolarHBondContact O-CB 3.45Å; T37-C40 PolarHBondContact O-N 2.93Å; T37-C41 PolarHBondContact O-N 2.96Å; T37-W330 HydrophobicContact CG2-CH2 3.52Å; T37-W330 HydrophobicContact CG2-CZ2 4.13Å; T37-W330 HydrophobicContact CG2-CZ3 3.82Å; T37-W330 WeakPolarHBondContact O-CH2 3.35Å; T37-W330 WeakPolarHBondContact O-CZ3 3.34Å; T37-N333 PolarHBondContact OG1-ND2 3.31Å; T37-E334 VanDerWaalsContact CG2-OE1 3.3Å; T37-E334 WeakPolarHBondContact CG2-OE1 3.49Å
38	E	88	Confident	93.5	Very high	65 Å²	65	10.1 Å²	10.1	30%	0.304	6%	0.055	S	C	.	.	H	α-helix	trans	-59.8	-45.7	179.6	-63.9	-173.6	119.1	0	0	112.6	C36 C40 C41 L126 K130	C36-E38 VanDerWaalsContact C-N 3.27Å; C36-E38 PolarHBondContact O-N 3.35Å; E38-C40 VanDerWaalsContact C-N 3.34Å; E38-C41 PolarHBondContact O-N 3.18Å; E38-C41 PolarHBondContact O-SG 2.98Å; E38-L126 HydrophobicContact CB-CD1 4.37Å; E38-L126 VanDerWaalsContact O-CD1 3.26Å; E38-L126 WeakPolarHBondContact O-CD1 3.43Å; E38-K130 IonicContact OE1-NZ 3.99Å; E38-K130 IonicContact OE2-NZ 3.98Å; E38-K130 PolarHBondContact OE2-NZ 2.98Å
39	C	93.3	Very high	93.1	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-70.9	-34.1	179.2	-61	0	0	0	0	111.1	C16 D18 I35 C36 T37 C41 V42 H43 I134	C16-C39 VanDerWaalsContact SG-SG 3.67Å; D18-C39 HydrophobicContact CB-CB 4.37Å; I35-C39 HydrophobicContact CB-CB 4.32Å; C36-C39 PolarHBondContact O-N 2.76Å; C36-C39 VanDerWaalsContact O-N 3.17Å; C36-C39 VanDerWaalsContact SG-SG 3.62Å; T37-C39 PolarHBondContact O-N 3.16Å; C39-C41 VanDerWaalsContact C-N 3.31Å; C39-C41 PolarHBondContact O-N 3.11Å; C39-V42 PolarHBondContact O-N 2.88Å; C39-V42 VanDerWaalsContact O-N 3.08Å; C39-H43 PolarHBondContact O-CD2 3.42Å; C39-H43 VanDerWaalsContact O-CD2 3.28Å; C39-H43 PolarHBondContact O-N 3.29Å; C39-H43 VanDerWaalsContact O-N 3.12Å; C39-I134 HydrophobicContact CB-CD1 3.67Å
40	C	93.6	Very high	93	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-59	-35	176.7	-176.8	0	0	0	0	113.5	W26 I35 C36 T37 E38 V42 H43 R44 W330	W26-C40 HydrophobicContact CB-CB 4.05Å; W26-C40 HydrophobicContact CD2-CB 4.17Å; W26-C40 VanDerWaalsContact CE3-SG 3.54Å; W26-C40 HydrophobicContact CG-CB 3.76Å; W26-C40 VanDerWaalsContact CG-SG 3.6Å; I35-C40 HydrophobicContact CD1-CB 3.94Å; I35-C40 HydrophobicContact CG1-CB 4.19Å; C36-C40 WeakPolarHBondContact O-CB 3.48Å; C36-C40 PolarHBondContact O-N 2.83Å; T37-C40 WeakPolarHBondContact O-CB 3.45Å; T37-C40 PolarHBondContact O-N 2.93Å; E38-C40 VanDerWaalsContact C-N 3.34Å; C40-V42 VanDerWaalsContact C-N 3.28Å; C40-V42 PolarHBondContact O-N 3.09Å; C40-H43 PolarHBondContact O-N 3.49Å; C40-R44 WeakPolarHBondContact O-CG 3.44Å; C40-R44 PolarHBondContact O-N 3.48Å; C40-W330 HydrophobicContact CB-CZ3 4Å
41	C	90.3	Very high	93	Very high	3 Å²	3	11.4 Å²	11.4	2%	0.02	6%	0.061	C	C	.	.	H	α-helix	trans	-63.5	-34.1	176	77.6	0	0	0	0	112.8	T37 E38 C39 S45 L126 W330 Y356	T37-C41 PolarHBondContact O-N 2.96Å; E38-C41 PolarHBondContact O-N 3.18Å; E38-C41 PolarHBondContact O-SG 2.98Å; C39-C41 VanDerWaalsContact C-N 3.31Å; C39-C41 PolarHBondContact O-N 3.11Å; C41-S45 PolarHBondContact O-N 2.87Å; C41-L126 WeakPolarHBondContact SG-CD2 3.33Å; C41-W330 HydrophobicContact CB-CH2 3.5Å; C41-W330 VanDerWaalsContact CB-CH2 3.5Å; C41-W330 HydrophobicContact CB-CZ2 3.93Å; C41-W330 HydrophobicContact CB-CZ3 4.18Å; C41-Y356 HydrophobicContact CB-CD1 3.98Å
42	V	92.6	Very high	93	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-69.6	-47.3	174.6	-173.2	0	0	0	0	109.3	C39 C40 R44 S45 L46 L126 A131 I134	C39-V42 PolarHBondContact O-N 2.88Å; C39-V42 VanDerWaalsContact O-N 3.08Å; C40-V42 VanDerWaalsContact C-N 3.28Å; C40-V42 PolarHBondContact O-N 3.09Å; V42-R44 VanDerWaalsContact C-N 3.28Å; V42-R44 PolarHBondContact O-N 3.07Å; V42-S45 WeakPolarHBondContact O-CA 3.34Å; V42-S45 WeakPolarHBondContact O-CB 3.47Å; V42-S45 PolarHBondContact O-N 3.26Å; V42-S45 PolarHBondContact O-OG 3.4Å; V42-L46 HydrophobicContact CG1-CD2 4.48Å; V42-L46 WeakPolarHBondContact O-CG 3.39Å; V42-L46 PolarHBondContact O-N 2.9Å; V42-L126 HydrophobicContact CG2-CD1 3.66Å; V42-L126 HydrophobicContact CG2-CG 4.48Å; V42-A131 HydrophobicContact CG1-CB 4.1Å; V42-A131 HydrophobicContact CG2-CB 3.85Å; V42-I134 HydrophobicContact CB-CB 4.47Å; V42-I134 HydrophobicContact CB-CD1 3.92Å; V42-I134 HydrophobicContact CB-CG2 4.04Å; V42-I134 HydrophobicContact CG1-CB 3.99Å; V42-I134 HydrophobicContact CG1-CD1 4.34Å; V42-I134 HydrophobicContact CG1-CG2 3.58Å; V42-I134 HydrophobicContact CG2-CD1 4.05Å
43	H	95	Very high	93	Very high	0 Å²	0	12 Å²	12	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-55.2	-42	177.3	-81.1	-117.7	0	0	0	112.8	D18 I35 C39 C40 S45 L46 S51 V53 Y138	D18-H43 IonicContact OD2-CE1 3.65Å; D18-H43 IonicContact OD2-NE2 2.7Å; D18-H43 PolarHBondContact OD2-NE2 2.93Å; I35-H43 HydrophobicContact CD1-CB 4.19Å; C39-H43 PolarHBondContact O-CD2 3.42Å; C39-H43 VanDerWaalsContact O-CD2 3.28Å; C39-H43 PolarHBondContact O-N 3.29Å; C39-H43 VanDerWaalsContact O-N 3.12Å; C40-H43 PolarHBondContact O-N 3.49Å; H43-S45 VanDerWaalsContact C-N 3.26Å; H43-S45 PolarHBondContact O-N 3.16Å; H43-L46 PolarHBondContact O-N 3.47Å; H43-L46 VanDerWaalsContact O-N 3.08Å; H43-S51 WeakPolarHBondContact ND1-CB 3.17Å; H43-S51 PolarHBondContact ND1-OG 3.09Å; H43-V53 HydrophobicContact CB-CG1 3.59Å; H43-Y138 AromaticContact CE1-CD2 3.56Å; H43-Y138 AromaticContact CE1-CE2 3.29Å; H43-Y138 WeakPolarHBondContact CE1-CE2 3.49Å; H43-Y138 AromaticContact CE1-CZ 3.87Å; H43-Y138 AromaticContact NE2-CD2 3.63Å; H43-Y138 AromaticContact NE2-CE2 3.27Å; H43-Y138 VanDerWaalsContact NE2-CE2 3.27Å; H43-Y138 WeakPolarHBondContact NE2-CE2 3.45Å
44	R	93.8	Very high	92.9	Very high	18 Å²	18	13.1 Å²	13.1	7%	0.068	7%	0.069	C	C	.	.	H	α-helix	trans	-57.1	-38.1	173.2	-73.1	170.5	59.6	-127.7	-1.9	112.3	C40 V42 L46 G47 V53 I326 D327 Y356 V358 P362	C40-R44 WeakPolarHBondContact O-CG 3.44Å; C40-R44 PolarHBondContact O-N 3.48Å; V42-R44 VanDerWaalsContact C-N 3.28Å; V42-R44 PolarHBondContact O-N 3.07Å; R44-L46 VanDerWaalsContact C-N 3.31Å; R44-L46 PolarHBondContact O-N 2.86Å; R44-G47 PolarHBondContact O-N 2.84Å; R44-V53 HydrophobicContact CG-CG2 3.77Å; R44-I326 HydrophobicContact CG-CG2 3.9Å; R44-D327 IonicContact CZ-OD1 3.56Å; R44-D327 IonicContact NE-OD1 3.98Å; R44-D327 IonicContact NH2-OD1 2.85Å; R44-D327 PolarHBondContact NH2-OD1 3.15Å; R44-Y356 PolarHBondContact NH1-O 3Å; R44-V358 HydrophobicContact CB-CG2 3.91Å; R44-P362 WeakPolarHBondContact O-CG 3.26Å
45	S	92.2	Very high	92.7	Very high	43 Å²	43	13.1 Å²	13.1	30%	0.301	7%	0.069	S	C	.	.	H	α-helix	trans	-72.3	-17.5	177.5	78.9	0	0	0	0	114.7	C41 V42 H43 P362	C41-S45 PolarHBondContact O-N 2.87Å; V42-S45 WeakPolarHBondContact O-CA 3.34Å; V42-S45 WeakPolarHBondContact O-CB 3.47Å; V42-S45 PolarHBondContact O-N 3.26Å; V42-S45 PolarHBondContact O-OG 3.4Å; H43-S45 VanDerWaalsContact C-N 3.26Å; H43-S45 PolarHBondContact O-N 3.16Å; S45-P362 WeakPolarHBondContact O-CB 3.43Å
46	L	92.7	Very high	92.5	Very high	9 Å²	9	13.1 Å²	13.1	5%	0.047	7%	0.069	C	C	.	.	H	α-helix	trans	-81.5	-21.5	176.4	-47.5	-179.2	0	0	0	112.6	V42 H43 R44 H49 V50 I134 R135	V42-L46 HydrophobicContact CG1-CD2 4.48Å; V42-L46 WeakPolarHBondContact O-CG 3.39Å; V42-L46 PolarHBondContact O-N 2.9Å; H43-L46 PolarHBondContact O-N 3.47Å; H43-L46 VanDerWaalsContact O-N 3.08Å; R44-L46 VanDerWaalsContact C-N 3.31Å; R44-L46 PolarHBondContact O-N 2.86Å; L46-H49 PolarHBondContact O-CE1 3.41Å; L46-V50 HydrophobicContact CB-CB 3.72Å; L46-V50 HydrophobicContact CB-CG1 4Å; L46-V50 HydrophobicContact CB-CG2 4.16Å; L46-V50 HydrophobicContact CD1-CB 4.36Å; L46-V50 HydrophobicContact CD1-CG1 3.69Å; L46-V50 HydrophobicContact CG-CG1 4.47Å; L46-I134 HydrophobicContact CD1-CG2 4.04Å; L46-R135 HydrophobicContact CD2-CG 3.9Å
47	G	91.5	Very high	92.3	Very high	7 Å²	7	19.6 Å²	19.6	7%	0.072	10%	0.097	C	C	.	.			trans	78.1	163.3	-177.2	0	0	0	0	0	114.6	R44 H49 V50 S51	R44-G47 PolarHBondContact O-N 2.84Å; G47-H49 PolarHBondContact O-N 2.7Å; G47-H49 VanDerWaalsContact O-N 3.14Å; G47-V50 PolarHBondContact O-N 3.45Å; G47-S51 PolarHBondContact O-N 3.38Å
48	R	92.7	Very high	92.2	Very high	24 Å²	24	22.9 Å²	22.9	9%	0.091	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-26	-171.5	-59.4	-174.3	74.4	-120.6	-10.1	115.1	V50 S51 Q52 Y318 D319 D322 N587	R48-V50 VanDerWaalsContact C-N 3.26Å; R48-V50 PolarHBondContact O-N 2.84Å; R48-S51 WeakPolarHBondContact CA-O 3.41Å; R48-Q52 HydrophobicContact CB-CG 4.4Å; R48-Q52 VanDerWaalsContact NH2-OE1 3.08Å; R48-Q52 WeakPolarHBondContact O-CG 3.41Å; R48-Y318 VanDerWaalsContact CZ-CE1 3.49Å; R48-D319 VanDerWaalsContact CD-OD1 3.3Å; R48-D319 WeakPolarHBondContact CD-OD1 3.32Å; R48-D319 IonicContact CZ-OD1 3.85Å; R48-D319 IonicContact NE-OD1 2.85Å; R48-D319 IonicContact NH1-OD1 3.56Å; R48-D319 PolarHBondContact NH1-OD1 3.11Å; R48-D322 WeakPolarHBondContact CD-OD2 3.28Å; R48-D322 WeakPolarHBondContact CG-OD2 3.46Å; R48-D322 IonicContact CZ-OD2 3.21Å; R48-D322 IonicContact NE-OD1 3.95Å; R48-D322 IonicContact NE-OD2 3.6Å; R48-D322 PolarHBondContact NE-OD2 3.06Å; R48-N587 PolarHBondContact O-ND2 3.35Å; R48-N587 VanDerWaalsContact O-ND2 3.14Å
49	H	88.7	Confident	92.2	Very high	30 Å²	30	20.9 Å²	20.9	14%	0.139	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-29.5	174.5	68.3	-72.6	0	0	0	112	L46 G47 L363 N364	L46-H49 PolarHBondContact O-CE1 3.41Å; G47-H49 PolarHBondContact O-N 2.7Å; G47-H49 VanDerWaalsContact O-N 3.14Å; H49-L363 PolarHBondContact CE1-O 3.12Å; H49-L363 VanDerWaalsContact CE1-O 3.25Å; H49-N364 PolarHBondContact CD2-OD1 3.26Å; H49-N364 VanDerWaalsContact CD2-OD1 3.31Å
50	V	92.4	Very high	91.9	Very high	4 Å²	4	23.5 Å²	23.5	2%	0.024	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-46	173.2	-173.7	0	0	0	0	111.9	N30 R31 L46 G47 R48 Q139	N30-V50 PolarHBondContact ND2-O 3.44Å; R31-V50 PolarHBondContact NE-O 3.37Å; R31-V50 PolarHBondContact NH2-O 2.85Å; L46-V50 HydrophobicContact CB-CB 3.72Å; L46-V50 HydrophobicContact CB-CG1 4Å; L46-V50 HydrophobicContact CB-CG2 4.16Å; L46-V50 HydrophobicContact CD1-CB 4.36Å; L46-V50 HydrophobicContact CD1-CG1 3.69Å; L46-V50 HydrophobicContact CG-CG1 4.47Å; G47-V50 PolarHBondContact O-N 3.45Å; R48-V50 VanDerWaalsContact C-N 3.26Å; R48-V50 PolarHBondContact O-N 2.84Å; V50-Q139 HydrophobicContact CG1-CB 4.24Å; V50-Q139 HydrophobicContact CG2-CG 4.41Å
51	S	95.1	Very high	91.8	Very high	4 Å²	4	25.1 Å²	25.1	3%	0.028	13%	0.125	C	C	.	.			trans	-145.7	123.6	-176.9	-179.8	0	0	0	0	112.6	S28 H43 G47 R48 V53	S28-S51 WeakPolarHBondContact CB-OG 3.28Å; S28-S51 PolarHBondContact OG-OG 3.45Å; H43-S51 WeakPolarHBondContact ND1-CB 3.17Å; H43-S51 PolarHBondContact ND1-OG 3.09Å; G47-S51 PolarHBondContact O-N 3.38Å; R48-S51 WeakPolarHBondContact CA-O 3.41Å; S51-V53 WeakPolarHBondContact OG-CG1 3.43Å
52	Q	94.9	Very high	91.8	Very high	11 Å²	11	27.9 Å²	27.9	5%	0.051	14%	0.138	C	C	.	.			trans	-96.2	99.9	173.3	-54.7	-168	28.7	0	0	108.6	S28 I29 N30 R48 N587 S589	S28-Q52 CarbonylContact C-O 3.55Å; S28-Q52 WeakPolarHBondContact CA-O 3.46Å; I29-Q52 PolarHBondContact N-O 3.45Å; N30-Q52 HydrophobicContact CB-CG 4.3Å; N30-Q52 PolarHBondContact OD1-N 2.92Å; R48-Q52 HydrophobicContact CB-CG 4.4Å; R48-Q52 VanDerWaalsContact NH2-OE1 3.08Å; R48-Q52 WeakPolarHBondContact O-CG 3.41Å; Q52-N587 PolarHBondContact NE2-ND2 2.85Å; Q52-S589 PolarHBondContact NE2-OG 3.41Å
53	V	94.5	Very high	91.7	Very high	6 Å²	6	31.7 Å²	31.7	4%	0.036	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	142.8	-174.8	-62.5	0	0	0	0	112.9	A27 I35 H43 R44 S51 I326	A27-V53 CarbonylContact O-C 3.56Å; A27-V53 VanDerWaalsContact O-CA 3.29Å; A27-V53 WeakPolarHBondContact O-CA 3.37Å; I35-V53 HydrophobicContact CD1-CG1 4.19Å; H43-V53 HydrophobicContact CB-CG1 3.59Å; R44-V53 HydrophobicContact CG-CG2 3.77Å; S51-V53 WeakPolarHBondContact OG-CG1 3.43Å; V53-I326 HydrophobicContact CG2-CD1 3.84Å; V53-I326 HydrophobicContact CG2-CG1 4.35Å; V53-I326 HydrophobicContact CG2-CG2 4.02Å; V53-I326 WeakPolarHBondContact O-CD1 3.43Å
54	R	94.4	Very high	91.5	Very high	23 Å²	23	32.3 Å²	32.3	9%	0.087	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	142.6	175.5	-157.5	165	-146.3	170.4	6.3	111	W26 A27 I29 S59 P60 W61	W26-R54 WeakPolarHBondContact CA-O 3.23Å; A27-R54 PolarHBondContact N-O 3.23Å; A27-R54 PolarHBondContact O-N 2.97Å; I29-R54 HydrophobicContact CD1-CB 4.03Å; I29-R54 HydrophobicContact CG1-CB 4.4Å; R54-S59 VanDerWaalsContact CG-CB 3.47Å; R54-P60 VanDerWaalsContact CZ-O 3.23Å; R54-P60 PolarHBondContact NE-O 3.36Å; R54-W61 HydrophobicContact CB-CH2 4.11Å; R54-W61 HydrophobicContact CB-CZ2 3.69Å; R54-W61 HydrophobicContact CG-CZ2 4.05Å
55	S	93.9	Very high	91.4	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	131.5	-179.3	-178.5	0	0	0	0	110.5	K57 K58 S59 W61	S55-K57 PolarHBondContact O-N 3.4Å; S55-K57 PolarHBondContact OG-N 3.43Å; S55-K58 WeakPolarHBondContact OG-CB 3.39Å; S55-K58 PolarHBondContact OG-N 2.94Å; S55-K58 VanDerWaalsContact OG-N 3.12Å; S55-S59 WeakPolarHBondContact CB-OG 3.45Å; S55-S59 PolarHBondContact N-OG 3.12Å; S55-S59 VanDerWaalsContact N-OG 3.13Å; S55-S59 WeakPolarHBondContact O-CB 3.32Å; S55-S59 PolarHBondContact O-N 2.97Å; S55-W61 PolarHBondContact O-NE1 3.2Å
56	L	92.5	Very high	91.4	Very high	1 Å²	1	30 Å²	30	1%	0.005	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-25.2	176.5	-67.1	177.3	0	0	0	112.8	T8 A10 T25 A27 F34 W61	T8-L56 WeakPolarHBondContact CB-O 3.21Å; T8-L56 CarbonylContact O-C 3.6Å; T8-L56 VanDerWaalsContact O-CB 3.26Å; T8-L56 WeakPolarHBondContact O-CB 3.28Å; T8-L56 PolarHBondContact OG1-O 3.2Å; A10-L56 HydrophobicContact CB-CD1 3.87Å; T25-L56 WeakPolarHBondContact O-CB 3.46Å; T25-L56 PolarHBondContact O-N 3.44Å; A27-L56 HydrophobicContact CB-CD2 4.22Å; F34-L56 HydrophobicContact CD1-CD1 3.96Å; F34-L56 HydrophobicContact CD1-CD2 4.2Å; F34-L56 HydrophobicContact CE1-CD1 4.35Å; F34-L56 HydrophobicContact CE1-CD2 3.97Å; L56-W61 HydrophobicContact CD2-CZ2 3.9Å
57	K	87.5	Confident	91.4	Very high	139 Å²	139	30.7 Å²	30.7	60%	0.604	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-116.5	-18.4	-174.6	-63.3	-178	-178.7	177.2	0	114.5	S55	S55-K57 PolarHBondContact O-N 3.4Å; S55-K57 PolarHBondContact OG-N 3.43Å
58	K	86.6	Confident	91.5	Very high	93 Å²	93	30.3 Å²	30.3	40%	0.404	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-124.6	2.7	-169	-56.3	-60.3	-176.6	178.7	0	114.8	S55 A329 V332 N333	S55-K58 WeakPolarHBondContact OG-CB 3.39Å; S55-K58 PolarHBondContact OG-N 2.94Å; S55-K58 VanDerWaalsContact OG-N 3.12Å; K58-A329 HydrophobicContact CB-CB 4.02Å; K58-V332 HydrophobicContact CD-CG1 3.67Å; K58-V332 HydrophobicContact CG-CG1 4.32Å; K58-N333 HydrophobicContact CG-CB 4.48Å
59	S	87.6	Confident	91.5	Very high	24 Å²	24	29.2 Å²	29.2	17%	0.168	15%	0.15	C	C	.	.	S	Bend	trans	-120.1	148.9	174.9	-56.4	0	0	0	0	109.9	R54 S55	R54-S59 VanDerWaalsContact CG-CB 3.47Å; S55-S59 WeakPolarHBondContact CB-OG 3.45Å; S55-S59 PolarHBondContact N-OG 3.12Å; S55-S59 VanDerWaalsContact N-OG 3.13Å; S55-S59 WeakPolarHBondContact O-CB 3.32Å; S55-S59 PolarHBondContact O-N 2.97Å
60	P	88.3	Confident	91.8	Very high	55 Å²	55	29.6 Å²	29.6	36%	0.357	15%	0.152	S	C	.	.			trans	-64.3	146.5	165.6	31	-36.3	0	0	0	109.6	R54 Y267	R54-P60 VanDerWaalsContact CZ-O 3.23Å; R54-P60 PolarHBondContact NE-O 3.36Å; P60-Y267 HydrophobicContact CG-CE1 3.79Å
61	W	91.2	Very high	91.8	Very high	34 Å²	34	30.2 Å²	30.2	13%	0.129	16%	0.156	C	C	.	.			trans	-126.2	131.7	175.6	-81.3	84.8	0	0	0	109.8	A27 I29 R54 S55 L56 Q65 L66 V69	A27-W61 HydrophobicContact CB-CH2 3.9Å; A27-W61 HydrophobicContact CB-CZ2 4.16Å; I29-W61 HydrophobicContact CD1-CH2 4.38Å; I29-W61 HydrophobicContact CD1-CZ3 4.35Å; I29-W61 HydrophobicContact CG1-CH2 4.03Å; I29-W61 HydrophobicContact CG1-CZ3 4.26Å; R54-W61 HydrophobicContact CB-CH2 4.11Å; R54-W61 HydrophobicContact CB-CZ2 3.69Å; R54-W61 HydrophobicContact CG-CZ2 4.05Å; S55-W61 PolarHBondContact O-NE1 3.2Å; L56-W61 HydrophobicContact CD2-CZ2 3.9Å; W61-Q65 HydrophobicContact CE3-CB 4.23Å; W61-Q65 HydrophobicContact CZ3-CB 4.38Å; W61-L66 HydrophobicContact CB-CB 4.41Å; W61-L66 HydrophobicContact CD2-CB 4.28Å; W61-L66 HydrophobicContact CD2-CD1 4.18Å; W61-L66 HydrophobicContact CE3-CB 3.72Å; W61-L66 HydrophobicContact CE3-CD1 4.06Å; W61-L66 HydrophobicContact CE3-CG 4.47Å; W61-L66 HydrophobicContact CZ3-CB 4.38Å; W61-L66 HydrophobicContact CZ3-CD1 4.31Å; W61-V69 HydrophobicContact CH2-CG2 4.26Å; W61-V69 HydrophobicContact CZ3-CG2 4.17Å
62	H	90.8	Very high	91.7	Very high	60 Å²	60	30 Å²	30	28%	0.278	15%	0.154	S	C	.	.			trans	-75	136.2	163.2	-164.2	-98.9	0	0	0	109.3	S64 Q65 L66 R253 E256	H62-S64 VanDerWaalsContact C-N 3.29Å; H62-S64 PolarHBondContact CE1-OG 3.28Å; H62-S64 PolarHBondContact ND1-OG 3.36Å; H62-S64 PolarHBondContact O-N 2.94Å; H62-Q65 HydrophobicContact CB-CB 4.45Å; H62-Q65 HydrophobicContact CB-CG 4.33Å; H62-Q65 PolarHBondContact O-N 3.5Å; H62-Q65 VanDerWaalsContact O-N 3.14Å; H62-L66 PolarHBondContact O-N 2.88Å; H62-L66 VanDerWaalsContact O-N 3.08Å; H62-R253 PolarHBondContact ND1-NE 3.11Å; H62-E256 IonicContact CD2-OE2 3.57Å; H62-E256 IonicContact CE1-OE2 3.71Å; H62-E256 IonicContact NE2-OE2 2.68Å; H62-E256 PolarHBondContact NE2-OE2 3.2Å
63	P	90.6	Very high	91.7	Very high	81 Å²	81	31.8 Å²	31.8	53%	0.526	16%	0.162	S	C	.	.	H	α-helix	trans	-56.1	-36.7	-176.1	-30	37.1	0	0	0	114.9	S67	P63-S67 VanDerWaalsContact O-CB 3.27Å; P63-S67 WeakPolarHBondContact O-CB 3.46Å; P63-S67 PolarHBondContact O-N 3.42Å
64	S	90.2	Very high	91.6	Very high	12 Å²	12	35.4 Å²	35.4	8%	0.084	19%	0.193	C	C	.	.	H	α-helix	trans	-66.9	-42.4	176.2	55.2	0	0	0	0	112.6	H62 L66 S67 L68 E219 R253	H62-S64 VanDerWaalsContact C-N 3.29Å; H62-S64 PolarHBondContact CE1-OG 3.28Å; H62-S64 PolarHBondContact ND1-OG 3.36Å; H62-S64 PolarHBondContact O-N 2.94Å; S64-L66 PolarHBondContact O-N 3.05Å; S64-S67 PolarHBondContact O-N 2.74Å; S64-L68 WeakPolarHBondContact O-CB 3.27Å; S64-L68 PolarHBondContact O-N 3.08Å; S64-E219 WeakPolarHBondContact CB-OE1 3.31Å; S64-E219 PolarHBondContact OG-OE1 2.79Å; S64-R253 PolarHBondContact OG-NE 2.96Å
65	Q	91.9	Very high	91.5	Very high	9 Å²	9	37.9 Å²	37.9	4%	0.042	21%	0.208	C	C	.	.	H	α-helix	trans	-63.2	-41.3	176.3	-73.1	-179.3	-4	0	0	111.8	W61 H62 L68 V69 E219	W61-Q65 HydrophobicContact CE3-CB 4.23Å; W61-Q65 HydrophobicContact CZ3-CB 4.38Å; H62-Q65 HydrophobicContact CB-CB 4.45Å; H62-Q65 HydrophobicContact CB-CG 4.33Å; H62-Q65 PolarHBondContact O-N 3.5Å; H62-Q65 VanDerWaalsContact O-N 3.14Å; Q65-L68 PolarHBondContact O-N 3.19Å; Q65-V69 PolarHBondContact O-N 3.45Å; Q65-E219 WeakPolarHBondContact CG-OE2 3.45Å
66	L	92.1	Very high	91.4	Very high	4 Å²	4	38.8 Å²	38.8	2%	0.021	22%	0.217	C	C	.	.	H	α-helix	trans	-65.8	-47.6	175.1	-177.3	58.8	0	0	0	110.2	M6 T8 W61 H62 S64 L68 V69 H70	M6-L66 HydrophobicContact CB-CD2 4.35Å; T8-L66 HydrophobicContact CG2-CD2 4.29Å; W61-L66 HydrophobicContact CB-CB 4.41Å; W61-L66 HydrophobicContact CD2-CB 4.28Å; W61-L66 HydrophobicContact CD2-CD1 4.18Å; W61-L66 HydrophobicContact CE3-CB 3.72Å; W61-L66 HydrophobicContact CE3-CD1 4.06Å; W61-L66 HydrophobicContact CE3-CG 4.47Å; W61-L66 HydrophobicContact CZ3-CB 4.38Å; W61-L66 HydrophobicContact CZ3-CD1 4.31Å; H62-L66 PolarHBondContact O-N 2.88Å; H62-L66 VanDerWaalsContact O-N 3.08Å; S64-L66 PolarHBondContact O-N 3.05Å; L66-L68 VanDerWaalsContact C-N 3.3Å; L66-L68 PolarHBondContact O-N 3.18Å; L66-V69 PolarHBondContact O-N 3.08Å; L66-V69 VanDerWaalsContact O-N 3.14Å; L66-H70 PolarHBondContact O-CD2 3.27Å; L66-H70 VanDerWaalsContact O-CD2 3.24Å; L66-H70 PolarHBondContact O-N 3.36Å; L66-H70 VanDerWaalsContact O-N 3.07Å
67	S	92.3	Very high	91.5	Very high	23 Å²	23	38.7 Å²	38.7	16%	0.161	22%	0.217	C	C	.	.	H	α-helix	trans	-55.8	-43.4	176.1	-165.2	0	0	0	0	112	P63 S64 V69 H70 T71	P63-S67 VanDerWaalsContact O-CB 3.27Å; P63-S67 WeakPolarHBondContact O-CB 3.46Å; P63-S67 PolarHBondContact O-N 3.42Å; S64-S67 PolarHBondContact O-N 2.74Å; S67-V69 PolarHBondContact O-N 3.1Å; S67-H70 PolarHBondContact O-N 3.44Å; S67-T71 WeakPolarHBondContact O-CB 3.24Å; S67-T71 PolarHBondContact O-N 2.98Å; S67-T71 PolarHBondContact O-OG1 3.35Å
68	L	92.5	Very high	91.8	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-55.1	-49.5	175.6	169.8	61.4	0	0	0	111.5	S64 Q65 L66 H70 T71 L72 V175 A216 E219 L220 L223	S64-L68 WeakPolarHBondContact O-CB 3.27Å; S64-L68 PolarHBondContact O-N 3.08Å; Q65-L68 PolarHBondContact O-N 3.19Å; L66-L68 VanDerWaalsContact C-N 3.3Å; L66-L68 PolarHBondContact O-N 3.18Å; L68-H70 PolarHBondContact O-N 3.3Å; L68-T71 PolarHBondContact O-N 3.35Å; L68-L72 HydrophobicContact CD1-CD1 3.56Å; L68-L72 HydrophobicContact CD1-CG 3.76Å; L68-L72 HydrophobicContact CG-CD1 3.98Å; L68-L72 HydrophobicContact CG-CG 4.49Å; L68-L72 WeakPolarHBondContact O-CB 3.29Å; L68-L72 PolarHBondContact O-N 3.47Å; L68-V175 HydrophobicContact CD1-CG1 4.31Å; L68-A216 HydrophobicContact CD1-CB 3.93Å; L68-A216 WeakPolarHBondContact CD1-O 3.36Å; L68-E219 HydrophobicContact CB-CB 4.44Å; L68-E219 HydrophobicContact CD2-CB 3.66Å; L68-L220 HydrophobicContact CD1-CB 4.13Å; L68-L220 HydrophobicContact CD2-CB 4.3Å; L68-L223 HydrophobicContact CD2-CD1 3.54Å
69	V	94.5	Very high	92.2	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-64.1	-42.1	-178.8	179	0	0	0	0	111	A27 I29 F34 W61 Q65 L66 S67 H73	A27-V69 HydrophobicContact CB-CG1 3.96Å; I29-V69 HydrophobicContact CB-CG2 4.4Å; I29-V69 HydrophobicContact CG2-CG2 4.02Å; F34-V69 HydrophobicContact CD1-CG1 4.13Å; F34-V69 HydrophobicContact CE1-CG1 3.61Å; F34-V69 HydrophobicContact CE2-CG1 4.29Å; F34-V69 HydrophobicContact CZ-CG1 3.7Å; W61-V69 HydrophobicContact CH2-CG2 4.26Å; W61-V69 HydrophobicContact CZ3-CG2 4.17Å; Q65-V69 PolarHBondContact O-N 3.45Å; L66-V69 PolarHBondContact O-N 3.08Å; L66-V69 VanDerWaalsContact O-N 3.14Å; S67-V69 PolarHBondContact O-N 3.1Å; V69-H73 VanDerWaalsContact O-CB 3.24Å; V69-H73 WeakPolarHBondContact O-CB 3.41Å; V69-H73 PolarHBondContact O-N 2.93Å
70	H	93.6	Very high	92.4	Very high	39 Å²	39	31.4 Å²	31.4	18%	0.181	19%	0.187	C	C	.	.	H	α-helix	trans	-62.6	-46.8	174.2	-78	-84.8	0	0	0	112.3	S9 P11 F34 L66 S67 L68 H73 A74	S9-H70 PolarHBondContact O-CE1 2.95Å; P11-H70 WeakPolarHBondContact CG-ND1 3.21Å; F34-H70 AromaticContact CZ-CE1 3.98Å; F34-H70 AromaticContact CZ-ND1 3.94Å; L66-H70 PolarHBondContact O-CD2 3.27Å; L66-H70 VanDerWaalsContact O-CD2 3.24Å; L66-H70 PolarHBondContact O-N 3.36Å; L66-H70 VanDerWaalsContact O-N 3.07Å; S67-H70 PolarHBondContact O-N 3.44Å; L68-H70 PolarHBondContact O-N 3.3Å; H70-H73 PolarHBondContact O-N 3.07Å; H70-A74 VanDerWaalsContact O-CB 3.29Å; H70-A74 WeakPolarHBondContact O-CB 3.49Å; H70-A74 PolarHBondContact O-N 2.86Å
71	T	92.8	Very high	92.7	Very high	17 Å²	17	28.8 Å²	28.8	10%	0.104	17%	0.17	C	C	.	.	H	α-helix	trans	-61.8	-46.8	178.7	-61.7	0	0	0	0	111.2	S67 L68 A74 N75 V175 F213	S67-T71 WeakPolarHBondContact O-CB 3.24Å; S67-T71 PolarHBondContact O-N 2.98Å; S67-T71 PolarHBondContact O-OG1 3.35Å; L68-T71 PolarHBondContact O-N 3.35Å; T71-A74 PolarHBondContact O-N 3.38Å; T71-N75 WeakPolarHBondContact O-CB 3.27Å; T71-N75 PolarHBondContact O-N 3.06Å; T71-N75 PolarHBondContact O-ND2 3.41Å; T71-V175 HydrophobicContact CG2-CG2 4.24Å; T71-F213 HydrophobicContact CG2-CD1 4.11Å; T71-F213 HydrophobicContact CG2-CE1 3.98Å
72	L	93.9	Very high	92.8	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-61.9	-45.8	177	-83.3	177.3	0	0	0	112	L68 N75 G76 S77 V175 L179 L220	L68-L72 HydrophobicContact CD1-CD1 3.56Å; L68-L72 HydrophobicContact CD1-CG 3.76Å; L68-L72 HydrophobicContact CG-CD1 3.98Å; L68-L72 HydrophobicContact CG-CG 4.49Å; L68-L72 WeakPolarHBondContact O-CB 3.29Å; L68-L72 PolarHBondContact O-N 3.47Å; L72-N75 CarbonylContact O-C 3.53Å; L72-N75 PolarHBondContact O-N 2.88Å; L72-G76 PolarHBondContact O-N 3.07Å; L72-S77 VanDerWaalsContact O-CB 3.22Å; L72-S77 WeakPolarHBondContact O-CB 3.43Å; L72-S77 PolarHBondContact O-N 2.94Å; L72-S77 PolarHBondContact O-OG 3.07Å; L72-V175 HydrophobicContact CD2-CB 4.5Å; L72-V175 HydrophobicContact CD2-CG1 3.76Å; L72-V175 HydrophobicContact CG-CG1 4.23Å; L72-L179 HydrophobicContact CD1-CD2 4.46Å; L72-L179 HydrophobicContact CD2-CB 4.1Å; L72-L179 HydrophobicContact CD2-CD2 3.88Å; L72-L220 HydrophobicContact CD1-CD1 4.42Å
73	H	94.2	Very high	92.7	Very high	47 Å²	47	28 Å²	28	22%	0.218	17%	0.167	C	C	.	.	H	α-helix	trans	-60.5	-48.8	177.2	177.1	69.7	0	0	0	112	A14 F34 V69 H70 N75 G76	A14-H73 WeakPolarHBondContact CB-NE2 3.06Å; F34-H73 HydrophobicContact CD2-CB 4.07Å; F34-H73 AromaticContact CD2-CD2 3.85Å; F34-H73 AromaticContact CD2-CG 3.63Å; F34-H73 AromaticContact CD2-ND1 3.79Å; F34-H73 HydrophobicContact CE2-CB 3.7Å; F34-H73 AromaticContact CE2-CD2 3.67Å; F34-H73 AromaticContact CE2-CG 3.59Å; V69-H73 VanDerWaalsContact O-CB 3.24Å; V69-H73 WeakPolarHBondContact O-CB 3.41Å; V69-H73 PolarHBondContact O-N 2.93Å; H70-H73 PolarHBondContact O-N 3.07Å; H73-N75 PolarHBondContact O-N 3.09Å; H73-G76 PolarHBondContact O-N 3.35Å
74	A	92.9	Very high	92.5	Very high	83 Å²	83	26.2 Å²	26.2	69%	0.686	15%	0.154	S	C	*	.	H	α-helix	trans	-64.5	-26.9	179	0	0	0	0	0	113.3	H70 T71 G76	H70-A74 VanDerWaalsContact O-CB 3.29Å; H70-A74 WeakPolarHBondContact O-CB 3.49Å; H70-A74 PolarHBondContact O-N 2.86Å; T71-A74 PolarHBondContact O-N 3.38Å; A74-G76 VanDerWaalsContact C-N 3.33Å
75	N	91.8	Very high	92.3	Very high	75 Å²	75	27.3 Å²	27.3	40%	0.401	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	15.1	174.3	-71.9	-95.6	0	0	0	113	T71 L72 H73 E176	T71-N75 WeakPolarHBondContact O-CB 3.27Å; T71-N75 PolarHBondContact O-N 3.06Å; T71-N75 PolarHBondContact O-ND2 3.41Å; L72-N75 CarbonylContact O-C 3.53Å; L72-N75 PolarHBondContact O-N 2.88Å; H73-N75 PolarHBondContact O-N 3.09Å; N75-E176 HydrophobicContact CB-CB 4.08Å; N75-E176 VanDerWaalsContact O-CG 3.31Å; N75-E176 WeakPolarHBondContact O-CG 3.15Å
76	G	92.2	Very high	92	Very high	18 Å²	18	31.4 Å²	31.4	19%	0.186	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.9	29.1	170.3	0	0	0	0	0	115.3	L72 H73 A74 N78 N79	L72-G76 PolarHBondContact O-N 3.07Å; H73-G76 PolarHBondContact O-N 3.35Å; A74-G76 VanDerWaalsContact C-N 3.33Å; G76-N78 PolarHBondContact O-N 2.99Å; G76-N79 WeakPolarHBondContact O-CB 3.45Å; G76-N79 VanDerWaalsContact O-CG 3.26Å; G76-N79 PolarHBondContact O-N 3.41Å; G76-N79 PolarHBondContact O-ND2 2.84Å
77	S	94	Very high	91.3	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-44.3	-36.1	177	59.2	0	0	0	0	115	G32 L72 N79 V80 W81	G32-S77 PolarHBondContact O-OG 2.87Å; L72-S77 VanDerWaalsContact O-CB 3.22Å; L72-S77 WeakPolarHBondContact O-CB 3.43Å; L72-S77 PolarHBondContact O-N 2.94Å; L72-S77 PolarHBondContact O-OG 3.07Å; S77-N79 PolarHBondContact O-N 2.96Å; S77-V80 WeakPolarHBondContact O-CB 3.37Å; S77-V80 PolarHBondContact O-N 3Å; S77-V80 VanDerWaalsContact O-N 3.08Å; S77-W81 VanDerWaalsContact O-CD1 3.26Å
78	N	94.5	Very high	90.4	Very high	28 Å²	28	37.8 Å²	37.8	15%	0.15	22%	0.218	C	C	.	.	H	α-helix	trans	-60.4	-28.1	177.2	-173.6	65.1	0	0	0	113.2	A17 V33 G76 V80 W81 E82 K137	A17-N78 PolarHBondContact O-OD1 3.03Å; V33-N78 HydrophobicContact CG1-CB 4.36Å; G76-N78 PolarHBondContact O-N 2.99Å; N78-V80 VanDerWaalsContact C-N 3.25Å; N78-V80 PolarHBondContact O-N 3.21Å; N78-W81 PolarHBondContact O-N 3.34Å; N78-E82 VanDerWaalsContact ND2-CD 3.34Å; N78-E82 PolarHBondContact ND2-OE2 2.82Å; N78-E82 WeakPolarHBondContact O-CB 3.39Å; N78-E82 PolarHBondContact O-N 3.35Å; N78-K137 PolarHBondContact OD1-NZ 2.77Å
79	N	93.4	Very high	89.3	Confident	70 Å²	70	46 Å²	46	37%	0.374	26%	0.256	S	S	.	.	H	α-helix	trans	-69.2	-22.4	177.1	-54.2	-17.9	0	0	0	112.5	G76 S77 H83 L86	G76-N79 WeakPolarHBondContact O-CB 3.45Å; G76-N79 VanDerWaalsContact O-CG 3.26Å; G76-N79 PolarHBondContact O-N 3.41Å; G76-N79 PolarHBondContact O-ND2 2.84Å; S77-N79 PolarHBondContact O-N 2.96Å; N79-H83 VanDerWaalsContact O-CA 3.29Å; N79-H83 WeakPolarHBondContact O-CA 3.48Å; N79-H83 WeakPolarHBondContact O-CB 3.48Å; N79-H83 PolarHBondContact O-N 3.32Å; N79-H83 VanDerWaalsContact O-N 3.1Å; N79-L86 HydrophobicContact CB-CD1 3.89Å; N79-L86 WeakPolarHBondContact OD1-CD1 3.37Å
80	V	92.8	Very high	87.8	Confident	5 Å²	5	47 Å²	47	3%	0.03	27%	0.265	C	S	.	.	H	α-helix	trans	-71.1	-39.8	171.9	-176.9	0	0	0	0	110.4	S77 N78 S144 E176 L179 R180 V183	S77-V80 WeakPolarHBondContact O-CB 3.37Å; S77-V80 PolarHBondContact O-N 3Å; S77-V80 VanDerWaalsContact O-N 3.08Å; N78-V80 VanDerWaalsContact C-N 3.25Å; N78-V80 PolarHBondContact O-N 3.21Å; V80-S144 WeakPolarHBondContact O-CA 3.38Å; V80-S144 WeakPolarHBondContact O-CB 3.19Å; V80-E176 HydrophobicContact CG2-CG 4.04Å; V80-L179 HydrophobicContact CG2-CD2 4.41Å; V80-R180 HydrophobicContact CG1-CB 4.37Å; V80-R180 HydrophobicContact CG2-CB 4.36Å; V80-V183 HydrophobicContact CG1-CB 4.11Å; V80-V183 HydrophobicContact CG1-CG1 4.19Å; V80-V183 HydrophobicContact CG1-CG2 3.98Å
81	W	94.2	Very high	86.2	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-83	-23.2	-179	-50	114.7	0	0	0	114	R31 S77 N78 K137 Y138 L141 F143 L179 V183	R31-W81 HydrophobicContact CB-CZ2 3.97Å; R31-W81 HydrophobicContact CG-CZ2 4.21Å; R31-W81 VanDerWaalsContact NH1-CZ3 3.33Å; R31-W81 PolarHBondContact O-NE1 2.93Å; S77-W81 VanDerWaalsContact O-CD1 3.26Å; N78-W81 PolarHBondContact O-N 3.34Å; W81-K137 HydrophobicContact CB-CD 4.38Å; W81-K137 HydrophobicContact CB-CG 3.99Å; W81-Y138 HydrophobicContact CB-CE1 4.14Å; W81-Y138 AromaticContact CD1-CE1 3.94Å; W81-Y138 HydrophobicContact CD2-CD1 4.05Å; W81-Y138 AromaticContact CD2-CE1 3.96Å; W81-Y138 HydrophobicContact CD2-CE1 3.96Å; W81-Y138 HydrophobicContact CE3-CD1 4.14Å; W81-Y138 HydrophobicContact CG-CD1 4.24Å; W81-Y138 AromaticContact CG-CE1 3.73Å; W81-Y138 HydrophobicContact CG-CE1 3.73Å; W81-L141 HydrophobicContact CE3-CD2 4.25Å; W81-L141 HydrophobicContact CZ3-CD2 4.04Å; W81-F143 CarbonylContact O-C 3.49Å; W81-F143 WeakPolarHBondContact O-CB 3.49Å; W81-L179 HydrophobicContact CH2-CD1 4.47Å; W81-L179 HydrophobicContact CZ2-CD1 4.01Å; W81-L179 HydrophobicContact CZ2-CD2 4.18Å; W81-L179 HydrophobicContact CZ2-CG 4.36Å; W81-V183 HydrophobicContact CE3-CG2 4.43Å; W81-V183 HydrophobicContact CH2-CB 4.47Å; W81-V183 HydrophobicContact CH2-CG2 3.13Å; W81-V183 HydrophobicContact CZ2-CG2 3.95Å; W81-V183 HydrophobicContact CZ3-CB 4.44Å; W81-V183 HydrophobicContact CZ3-CG1 4.04Å; W81-V183 HydrophobicContact CZ3-CG2 3.45Å; W81-V183 VanDerWaalsContact CZ3-CG2 3.45Å
82	E	93.4	Very high	84.2	Confident	7 Å²	7	52.1 Å²	52.1	3%	0.033	31%	0.313	C	S	.	.	S	Bend	trans	-117.3	16.4	-176.7	-59.6	-171.2	162.9	0	0	113.3	N78 N84 L85 L86 K99 F133 K137 F143	N78-E82 VanDerWaalsContact ND2-CD 3.34Å; N78-E82 PolarHBondContact ND2-OE2 2.82Å; N78-E82 WeakPolarHBondContact O-CB 3.39Å; N78-E82 PolarHBondContact O-N 3.35Å; E82-N84 PolarHBondContact O-N 2.85Å; E82-L85 HydrophobicContact CB-CB 4.39Å; E82-L85 HydrophobicContact CB-CD1 4.25Å; E82-L85 HydrophobicContact CG-CD1 4.32Å; E82-L85 WeakPolarHBondContact O-CA 3.46Å; E82-L85 WeakPolarHBondContact O-CB 3.45Å; E82-L85 PolarHBondContact O-N 2.99Å; E82-L86 HydrophobicContact CB-CD1 4.49Å; E82-L86 HydrophobicContact CB-CG 4.49Å; E82-L86 PolarHBondContact O-N 2.97Å; E82-K99 VanDerWaalsContact OE1-CE 3.3Å; E82-K99 WeakPolarHBondContact OE1-CE 3.44Å; E82-K99 IonicContact OE1-NZ 3.57Å; E82-K99 PolarHBondContact OE1-NZ 3.34Å; E82-K99 IonicContact OE2-NZ 3.39Å; E82-K99 PolarHBondContact OE2-NZ 3.08Å; E82-F133 WeakPolarHBondContact OE1-CZ 3.03Å; E82-K137 HydrophobicContact CG-CD 4.15Å; E82-K137 WeakPolarHBondContact OE1-CE 3.37Å; E82-K137 IonicContact OE1-NZ 3.45Å; E82-K137 PolarHBondContact OE1-NZ 2.79Å; E82-F143 CarbonylContact C-O 3.55Å
83	H	89.4	Confident	82.1	Confident	69 Å²	69	56.4 Å²	56.4	32%	0.319	34%	0.343	S	S	.	.	H	α-helix	trans	-43.6	-54.2	-175.6	-171.3	69.5	0	0	0	114.1	N79 L85 L86 D87 F143	N79-H83 VanDerWaalsContact O-CA 3.29Å; N79-H83 WeakPolarHBondContact O-CA 3.48Å; N79-H83 WeakPolarHBondContact O-CB 3.48Å; N79-H83 PolarHBondContact O-N 3.32Å; N79-H83 VanDerWaalsContact O-N 3.1Å; H83-L85 PolarHBondContact O-N 2.79Å; H83-L86 PolarHBondContact O-N 3.04Å; H83-D87 PolarHBondContact O-N 2.85Å; H83-F143 WeakPolarHBondContact CB-O 3.46Å; H83-F143 PolarHBondContact N-O 3.25Å
84	N	86.3	Confident	79.9	Confident	44 Å²	44	60.3 Å²	60.3	24%	0.235	38%	0.375	C	S	.	.	H	α-helix	trans	-73.7	-8.5	-178	-49.1	-23.8	0	0	0	113.5	E82 A90 Q96 A142 F143 S144	E82-N84 PolarHBondContact O-N 2.85Å; N84-A90 WeakPolarHBondContact O-CB 3.28Å; N84-Q96 PolarHBondContact O-NE2 3.29Å; N84-A142 PolarHBondContact ND2-O 2.89Å; N84-F143 PolarHBondContact N-O 3.26Å; N84-F143 PolarHBondContact ND2-O 3.04Å; N84-S144 PolarHBondContact ND2-O 3.4Å
85	L	86.1	Confident	77.9	Confident	36 Å²	36	66.7 Å²	66.7	19%	0.188	38%	0.382	C	S	.	.	H	α-helix	trans	-94.1	-14.8	171.6	-62.4	171	0	0	0	112.1	E82 H83 C97 F133 F143	E82-L85 HydrophobicContact CB-CB 4.39Å; E82-L85 HydrophobicContact CB-CD1 4.25Å; E82-L85 HydrophobicContact CG-CD1 4.32Å; E82-L85 WeakPolarHBondContact O-CA 3.46Å; E82-L85 WeakPolarHBondContact O-CB 3.45Å; E82-L85 PolarHBondContact O-N 2.99Å; H83-L85 PolarHBondContact O-N 2.79Å; L85-C97 WeakPolarHBondContact CD2-O 3.21Å; L85-F133 HydrophobicContact CD1-CE2 3.77Å; L85-F133 HydrophobicContact CD1-CZ 4.06Å; L85-F143 HydrophobicContact CD1-CB 3.98Å; L85-F143 HydrophobicContact CD1-CD1 3.92Å; L85-F143 HydrophobicContact CD1-CD2 3.71Å; L85-F143 HydrophobicContact CD1-CE1 4.33Å; L85-F143 HydrophobicContact CD1-CE2 4.13Å; L85-F143 HydrophobicContact CD1-CG 3.59Å; L85-F143 HydrophobicContact CD1-CZ 4.42Å; L85-F143 HydrophobicContact CD2-CD1 3.91Å; L85-F143 HydrophobicContact CD2-CE1 4.18Å; L85-F143 HydrophobicContact CD2-CG 4.39Å; L85-F143 HydrophobicContact CG-CB 3.94Å; L85-F143 HydrophobicContact CG-CD1 3.83Å; L85-F143 HydrophobicContact CG-CD2 4.44Å; L85-F143 HydrophobicContact CG-CE1 4.46Å; L85-F143 HydrophobicContact CG-CG 3.82Å
86	L	84.5	Confident	76.2	Confident	94 Å²	94	65.8 Å²	65.8	49%	0.492	38%	0.375	S	S	.	.	H	α-helix	trans	-100.8	-24.6	178.8	-63	174.2	0	0	0	112.4	N79 E82 H83 P88	N79-L86 HydrophobicContact CB-CD1 3.89Å; N79-L86 WeakPolarHBondContact OD1-CD1 3.37Å; E82-L86 HydrophobicContact CB-CD1 4.49Å; E82-L86 HydrophobicContact CB-CG 4.49Å; E82-L86 PolarHBondContact O-N 2.97Å; H83-L86 PolarHBondContact O-N 3.04Å; L86-P88 VanDerWaalsContact O-CD 3.26Å; L86-P88 WeakPolarHBondContact O-CD 3.45Å
87	D	77.7	Confident	74.7	Confident	56 Å²	56	67.7 Å²	67.7	30%	0.299	39%	0.385	S	S	.	.			trans	-62.6	114.4	174.5	173	20.1	0	0	0	111.7	H83 H89 A90 V91	H83-D87 PolarHBondContact O-N 2.85Å; D87-H89 PolarHBondContact O-N 3.31Å; D87-H89 WeakPolarHBondContact OD1-CB 3.09Å; D87-H89 IonicContact OD1-CD2 2.75Å; D87-H89 PolarHBondContact OD1-CD2 3.03Å; D87-H89 IonicContact OD1-CG 3.98Å; D87-H89 PolarHBondContact OD1-N 3.28Å; D87-A90 HydrophobicContact CB-CB 4.05Å; D87-A90 PolarHBondContact O-N 3.11Å; D87-A90 VanDerWaalsContact O-N 3.11Å; D87-A90 PolarHBondContact OD2-N 2.94Å; D87-V91 WeakPolarHBondContact O-CG2 3.26Å; D87-V91 PolarHBondContact O-N 3.31Å
88	P	73.6	Confident	73.6	Confident	105 Å²	105	75.2 Å²	75.2	68%	0.682	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-27.8	178.3	-23.4	35.1	0	0	0	113.9	L86	L86-P88 VanDerWaalsContact O-CD 3.26Å; L86-P88 WeakPolarHBondContact O-CD 3.45Å
89	H	70.3	Confident	73.1	Confident	172 Å²	172	75.9 Å²	75.9	80%	0.796	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-30.9	179.2	-60.7	-74.9	0	0	0	112.1	D87	D87-H89 PolarHBondContact O-N 3.31Å; D87-H89 WeakPolarHBondContact OD1-CB 3.09Å; D87-H89 IonicContact OD1-CD2 2.75Å; D87-H89 PolarHBondContact OD1-CD2 3.03Å; D87-H89 IonicContact OD1-CG 3.98Å; D87-H89 PolarHBondContact OD1-N 3.28Å
90	A	62.9	Low	72.5	Confident	23 Å²	23	72.7 Å²	72.7	19%	0.19	41%	0.405	C	S	.	.	G	3₁₀ helix	trans	-72.7	-31.2	176.4	0	0	0	0	0	113.2	N84 D87 G92 S93 Q96	N84-A90 WeakPolarHBondContact O-CB 3.28Å; D87-A90 HydrophobicContact CB-CB 4.05Å; D87-A90 PolarHBondContact O-N 3.11Å; D87-A90 VanDerWaalsContact O-N 3.11Å; D87-A90 PolarHBondContact OD2-N 2.94Å; A90-G92 PolarHBondContact O-N 3.24Å; A90-S93 PolarHBondContact O-N 2.78Å; A90-Q96 PolarHBondContact O-NE2 3.46Å
91	V	58.4	Low	71.7	Confident	90 Å²	90	78 Å²	78	55%	0.545	43%	0.428	S	S	.	.	G	3₁₀ helix	trans	-60.6	-19.1	-173.9	175.1	0	0	0	0	113.7	D87 S93	D87-V91 WeakPolarHBondContact O-CG2 3.26Å; D87-V91 PolarHBondContact O-N 3.31Å; V91-S93 PolarHBondContact O-N 3.38Å
92	G	51.9	Low	70.5	Confident	73 Å²	73	80.4 Å²	80.4	75%	0.753	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-74.3	-13.7	177.9	0	0	0	0	0	116.1	A90	A90-G92 PolarHBondContact O-N 3.24Å
93	S	49.5	Very low	69.3	Low	89 Å²	89	85.8 Å²	85.8	62%	0.622	47%	0.466	S	S	*	.	S	Bend	trans	-87.6	117	-175.3	-93.3	0	0	0	0	113.7	A90 V91 R95 Q96	A90-S93 PolarHBondContact O-N 2.78Å; V91-S93 PolarHBondContact O-N 3.38Å; S93-R95 PolarHBondContact O-N 3.08Å; S93-Q96 PolarHBondContact O-N 2.9Å
94	S	47.7	Very low	68	Low	129 Å²	129	88.6 Å²	88.6	90%	0.902	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	23	-168.7	-157.1	0	0	0	0	117.8
95	R	51.5	Low	66.8	Low	217 Å²	217	90.7 Å²	90.7	82%	0.819	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.5	18.5	178.4	-64.8	-172.4	-175.7	158.9	4.7	114.4	S93	S93-R95 PolarHBondContact O-N 3.08Å
96	Q	55.3	Low	65.2	Low	57 Å²	57	92.8 Å²	92.8	27%	0.266	51%	0.505	S	S	.	.			trans	-73.1	139.3	-178.2	-74.5	-168.6	-26.4	0	0	113.7	N84 A90 S93 H98	N84-Q96 PolarHBondContact O-NE2 3.29Å; A90-Q96 PolarHBondContact O-NE2 3.46Å; S93-Q96 PolarHBondContact O-N 2.9Å; Q96-H98 PolarHBondContact O-N 3.16Å
97	C	60.6	Low	63.9	Low	58 Å²	58	90.7 Å²	90.7	39%	0.392	50%	0.496	S	S	.	.			trans	-74.6	112.3	169	-176.2	0	0	0	0	109	L85 F143	L85-C97 WeakPolarHBondContact CD2-O 3.21Å; C97-F143 HydrophobicContact CB-CE1 3.98Å; C97-F143 HydrophobicContact CB-CZ 3.91Å
98	H	71	Confident	62.8	Low	158 Å²	158	93.2 Å²	93.2	73%	0.731	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-73.7	137.1	177.1	-63.2	-58.8	0	0	0	111.5	Q96	Q96-H98 PolarHBondContact O-N 3.16Å
99	K	84.6	Confident	62	Low	42 Å²	42	92.2 Å²	92.2	18%	0.183	50%	0.498	C	S	.	.	P	Polyproline II helix	trans	-54.6	127.2	169.5	-177.2	170.2	-172.4	157.5	0	110.4	A17 E82 F133	A17-K99 WeakPolarHBondContact O-CE 3.25Å; A17-K99 PolarHBondContact O-NZ 2.74Å; E82-K99 VanDerWaalsContact OE1-CE 3.3Å; E82-K99 WeakPolarHBondContact OE1-CE 3.44Å; E82-K99 IonicContact OE1-NZ 3.57Å; E82-K99 PolarHBondContact OE1-NZ 3.34Å; E82-K99 IonicContact OE2-NZ 3.39Å; E82-K99 PolarHBondContact OE2-NZ 3.08Å; K99-F133 HydrophobicContact CB-CE2 4.02Å; K99-F133 HydrophobicContact CB-CZ 3.93Å; K99-F133 HydrophobicContact CD-CZ 4.39Å; K99-F133 HydrophobicContact CG-CE1 4.15Å; K99-F133 HydrophobicContact CG-CE2 4.37Å; K99-F133 HydrophobicContact CG-CZ 3.82Å
100	P	81.8	Confident	61	Low	3 Å²	3	88.4 Å²	88.4	2%	0.019	49%	0.489	C	S	.	.	P	Polyproline II helix	trans	-55.2	137.4	171.7	-23.2	31.6	0	0	0	110.7	C19 D124 V129 K130 F133	C19-P100 CarbonylContact C-O 3.58Å; C19-P100 WeakPolarHBondContact CA-O 3.39Å; C19-P100 HydrophobicContact CB-CB 4.21Å; P100-D124 VanDerWaalsContact CA-OD2 3.23Å; P100-D124 WeakPolarHBondContact CA-OD2 3.37Å; P100-D124 HydrophobicContact CB-CB 4.15Å; P100-V129 HydrophobicContact CG-CG1 4.27Å; P100-K130 HydrophobicContact CB-CG 4.04Å; P100-K130 HydrophobicContact CG-CG 4.22Å; P100-F133 HydrophobicContact CG-CB 3.82Å; P100-F133 HydrophobicContact CG-CD1 4.14Å; P100-F133 HydrophobicContact CG-CG 3.95Å
101	K	74.8	Confident	60.6	Low	117 Å²	117	96.4 Å²	96.4	51%	0.509	51%	0.514	S	S	.	.			trans	-142.4	143	-177.9	-72.7	-179.8	-177.2	-178.1	0	111.1	K103 D124	K101-K103 PolarHBondContact O-N 3.34Å; K101-K103 VanDerWaalsContact O-N 3.11Å; K101-D124 PolarHBondContact N-OD2 3.43Å
102	P	70.4	Confident	60.6	Low	50 Å²	50	99.5 Å²	99.5	33%	0.325	53%	0.528	S	S	.	.			trans	-59.4	115.4	162.9	26.5	-34.2	0	0	0	108.7	C19 I121 F122	C19-P102 WeakPolarHBondContact O-CD 3.5Å; P102-I121 HydrophobicContact CB-CG2 3.46Å; P102-I121 VanDerWaalsContact CB-CG2 3.46Å; P102-F122 WeakPolarHBondContact CA-O 3.48Å
103	K	67.6	Low	60.9	Low	120 Å²	120	99.4 Å²	99.4	52%	0.522	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	122.8	175.9	-69.7	171.5	-173.9	161.6	0	108.5	K101 F105 F122 D124	K101-K103 PolarHBondContact O-N 3.34Å; K101-K103 VanDerWaalsContact O-N 3.11Å; K103-F105 PolarHBondContact O-N 3.4Å; K103-F122 HydrophobicContact CB-CB 4.4Å; K103-F122 PolarHBondContact N-O 3.16Å; K103-F122 PolarHBondContact O-N 3.39Å; K103-D124 IonicContact NZ-OD1 2.85Å
104	L	62.1	Low	61.4	Low	128 Å²	128	99.2 Å²	99.2	67%	0.67	52%	0.522	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.9	129.5	167.4	-116.2	71.3	0	0	0	108.9	V119 I121	L104-V119 HydrophobicContact CD1-CG1 4.35Å; L104-V119 HydrophobicContact CD2-CG1 3.52Å; L104-V119 HydrophobicContact CG-CG1 3.53Å; L104-I121 HydrophobicContact CD1-CG1 4.24Å
105	F	61.4	Low	61.9	Low	87 Å²	87	96.8 Å²	96.8	38%	0.382	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	145.5	167	74.1	-90.4	0	0	0	109.3	K103 T107 V119 G120 F122	K103-F105 PolarHBondContact O-N 3.4Å; F105-T107 HydrophobicContact CD2-CG2 3.94Å; F105-T107 HydrophobicContact CE2-CG2 3.69Å; F105-V119 WeakPolarHBondContact O-CA 3.29Å; F105-G120 VanDerWaalsContact CD1-C 3.49Å; F105-G120 VanDerWaalsContact CD1-O 3.31Å; F105-G120 WeakPolarHBondContact CD1-O 3.37Å; F105-G120 VanDerWaalsContact CE1-C 3.44Å; F105-G120 PolarHBondContact N-O 3.43Å; F105-G120 PolarHBondContact O-N 2.98Å; F105-F122 HydrophobicContact CD1-CB 3.75Å; F105-F122 HydrophobicContact CE1-CB 4.22Å
106	T	52.8	Low	62.1	Low	81 Å²	81	94.7 Å²	94.7	50%	0.497	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	105.6	178.5	-47.7	0	0	0	0	108.6	H117 R118	T106-H117 HydrophobicContact CG2-CB 3.62Å; T106-R118 WeakPolarHBondContact CA-O 3.45Å
107	T	57	Low	62.3	Low	50 Å²	50	98.1 Å²	98.1	31%	0.307	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	130.8	168.2	34.5	0	0	0	0	110.2	F105 N109 R118	F105-T107 HydrophobicContact CD2-CG2 3.94Å; F105-T107 HydrophobicContact CE2-CG2 3.69Å; T107-N109 PolarHBondContact O-N 3.33Å; T107-R118 PolarHBondContact N-O 2.88Å; T107-R118 PolarHBondContact O-N 3.47Å; T107-R118 PolarHBondContact OG1-O 3.41Å
108	L	54.5	Low	62.2	Low	109 Å²	109	103.4 Å²	103.4	57%	0.571	52%	0.522	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.3	93.8	178	-140.4	156.8	0	0	0	107.5	P115	L108-P115 HydrophobicContact CD2-CB 3.55Å
109	N	55.5	Low	61.6	Low	84 Å²	84	100 Å²	100	45%	0.449	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	119.8	-178.9	-77.1	29.9	0	0	0	109.8	T107 R116	T107-N109 PolarHBondContact O-N 3.33Å; N109-R116 PolarHBondContact N-O 3.3Å; N109-R116 PolarHBondContact O-N 2.97Å
110	C	50.6	Low	60.4	Low	91 Å²	91	98.6 Å²	98.6	62%	0.615	51%	0.51	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.6	121.3	169.3	-65.9	0	0	0	0	109.9	V114	C110-V114 WeakPolarHBondContact CA-O 3.36Å
111	R	54.4	Low	59.5	Low	192 Å²	192	102.5 Å²	102.5	73%	0.725	53%	0.53	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.2	121.5	168.1	-166.3	175.5	-175.3	-178.7	2	107.7	G113 V114	R111-G113 VanDerWaalsContact C-N 3.34Å; R111-G113 PolarHBondContact O-N 3.42Å; R111-V114 PolarHBondContact N-O 2.95Å; R111-V114 VanDerWaalsContact N-O 3.14Å; R111-V114 PolarHBondContact O-N 2.96Å
112	N	57.6	Low	59.3	Low	155 Å²	155	101.9 Å²	101.9	83%	0.829	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	41.9	-174.1	-53	5.1	0	0	0	113.2	V114	N112-V114 PolarHBondContact O-N 3.45Å; N112-V114 VanDerWaalsContact O-N 3.08Å
113	G	58.8	Low	59.7	Low	71 Å²	71	105 Å²	105	73%	0.732	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.7	-8.8	-179.9	0	0	0	0	0	115.7	R111	R111-G113 VanDerWaalsContact C-N 3.34Å; R111-G113 PolarHBondContact O-N 3.42Å
114	V	59.6	Low	60.4	Low	84 Å²	84	100 Å²	100	51%	0.509	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	124.8	176.7	-175.6	0	0	0	0	109.8	C110 R111 N112 R116	C110-V114 WeakPolarHBondContact CA-O 3.36Å; R111-V114 PolarHBondContact N-O 2.95Å; R111-V114 VanDerWaalsContact N-O 3.14Å; R111-V114 PolarHBondContact O-N 2.96Å; N112-V114 PolarHBondContact O-N 3.45Å; N112-V114 VanDerWaalsContact O-N 3.08Å; V114-R116 PolarHBondContact O-N 3.09Å
115	P	57.5	Low	61.4	Low	78 Å²	78	96.8 Å²	96.8	51%	0.506	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	120.5	173.4	2.9	8.6	0	0	0	109.9	L108	L108-P115 HydrophobicContact CD2-CB 3.55Å
116	R	56.7	Low	62.5	Low	173 Å²	173	93.3 Å²	93.3	65%	0.653	48%	0.484	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.9	124.3	171.3	-70.5	-168.8	178.4	-162.1	-0.1	110.1	N109 V114 R118	N109-R116 PolarHBondContact N-O 3.3Å; N109-R116 PolarHBondContact O-N 2.97Å; V114-R116 PolarHBondContact O-N 3.09Å; R116-R118 PolarHBondContact O-N 3.03Å
117	H	60.1	Low	63.9	Low	129 Å²	129	93.8 Å²	93.8	60%	0.597	48%	0.477	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.9	111.3	169.3	-71.7	34.1	0	0	0	108.3	T106	T106-H117 HydrophobicContact CG2-CB 3.62Å
118	R	57.3	Low	65.3	Low	169 Å²	169	95.1 Å²	95.1	64%	0.638	49%	0.487	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95	111.3	165.7	-178.2	-175	-68.7	-159.9	-0.2	107.5	T106 T107 R116 G120	T106-R118 WeakPolarHBondContact CA-O 3.45Å; T107-R118 PolarHBondContact N-O 2.88Å; T107-R118 PolarHBondContact O-N 3.47Å; T107-R118 PolarHBondContact OG1-O 3.41Å; R116-R118 PolarHBondContact O-N 3.03Å; R118-G120 PolarHBondContact O-N 2.9Å
119	V	59.7	Low	66.9	Low	86 Å²	86	92.8 Å²	92.8	52%	0.521	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	118.5	167.3	-177.4	0	0	0	0	107.9	L104 F105	L104-V119 HydrophobicContact CD1-CG1 4.35Å; L104-V119 HydrophobicContact CD2-CG1 3.52Å; L104-V119 HydrophobicContact CG-CG1 3.53Å; F105-V119 WeakPolarHBondContact O-CA 3.29Å
120	G	57.8	Low	68.5	Low	14 Å²	14	89.1 Å²	89.1	14%	0.144	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	159	170.8	0	0	0	0	0	110.7	F105 R118	F105-G120 VanDerWaalsContact CD1-C 3.49Å; F105-G120 VanDerWaalsContact CD1-O 3.31Å; F105-G120 WeakPolarHBondContact CD1-O 3.37Å; F105-G120 VanDerWaalsContact CE1-C 3.44Å; F105-G120 PolarHBondContact N-O 3.43Å; F105-G120 PolarHBondContact O-N 2.98Å; R118-G120 PolarHBondContact O-N 2.9Å
121	I	64	Low	70.4	Confident	85 Å²	85	84.8 Å²	84.8	44%	0.436	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	110.1	174.3	-57.3	177	0	0	0	107.9	P102 L104 R123	P102-I121 HydrophobicContact CB-CG2 3.46Å; P102-I121 VanDerWaalsContact CB-CG2 3.46Å; L104-I121 HydrophobicContact CD1-CG1 4.24Å; I121-R123 HydrophobicContact CG2-CG 4.12Å; I121-R123 PolarHBondContact O-N 2.99Å
122	F	70.2	Confident	72.3	Confident	104 Å²	104	79.4 Å²	79.4	46%	0.456	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	118.9	168.1	-178.9	-90.1	0	0	0	107.9	P102 K103 F105	P102-F122 WeakPolarHBondContact CA-O 3.48Å; K103-F122 HydrophobicContact CB-CB 4.4Å; K103-F122 PolarHBondContact N-O 3.16Å; K103-F122 PolarHBondContact O-N 3.39Å; F105-F122 HydrophobicContact CD1-CB 3.75Å; F105-F122 HydrophobicContact CE1-CB 4.22Å
123	R	77.8	Confident	74	Confident	114 Å²	114	72.1 Å²	72.1	43%	0.43	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-102	125.8	176.5	-65.8	175.9	169.7	-124.6	-13.1	107.8	D21 I121	D21-R123 IonicContact OD1-CZ 3.37Å; D21-R123 IonicContact OD1-NH1 3.32Å; D21-R123 PolarHBondContact OD1-NH1 2.94Å; D21-R123 IonicContact OD1-NH2 2.72Å; D21-R123 PolarHBondContact OD1-NH2 2.86Å; D21-R123 IonicContact OD2-CZ 2.69Å; D21-R123 IonicContact OD2-NH1 3.65Å; D21-R123 PolarHBondContact OD2-NH1 2.91Å; D21-R123 IonicContact OD2-NH2 3.29Å; I121-R123 HydrophobicContact CG2-CG 4.12Å; I121-R123 PolarHBondContact O-N 2.99Å
124	D	82.6	Confident	75.7	Confident	17 Å²	17	68.8 Å²	68.8	9%	0.091	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-55.1	140.9	177.2	-70.4	-47.1	0	0	0	110.9	P100 K101 K103 V129 K130	P100-D124 VanDerWaalsContact CA-OD2 3.23Å; P100-D124 WeakPolarHBondContact CA-OD2 3.37Å; P100-D124 HydrophobicContact CB-CB 4.15Å; K101-D124 PolarHBondContact N-OD2 3.43Å; K103-D124 IonicContact NZ-OD1 2.85Å; D124-V129 HydrophobicContact CB-CG1 3.99Å; D124-K130 WeakPolarHBondContact O-CE 3.32Å; D124-K130 PolarHBondContact O-NZ 2.68Å
125	P	83.3	Confident	77.3	Confident	60 Å²	60	68.3 Å²	68.3	39%	0.39	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-65.1	146.8	-177	28	-35.3	0	0	0	110.8	Y127 V129 K130	P125-Y127 PolarHBondContact O-N 3.24Å; P125-V129 HydrophobicContact CG-CB 4.22Å; P125-V129 HydrophobicContact CG-CG2 3.83Å; P125-K130 PolarHBondContact O-N 3.22Å
126	L	84.7	Confident	79	Confident	14 Å²	14	65.4 Å²	65.4	7%	0.073	31%	0.311	C	S	.	.	I	π-helix	trans	-59.8	-49.5	-179.8	177.6	65.2	0	0	0	112.4	E38 C41 V42 K130 A131 Y356	E38-L126 HydrophobicContact CB-CD1 4.37Å; E38-L126 VanDerWaalsContact O-CD1 3.26Å; E38-L126 WeakPolarHBondContact O-CD1 3.43Å; C41-L126 WeakPolarHBondContact SG-CD2 3.33Å; V42-L126 HydrophobicContact CG2-CD1 3.66Å; V42-L126 HydrophobicContact CG2-CG 4.48Å; L126-K130 HydrophobicContact CD1-CB 4.18Å; L126-K130 HydrophobicContact CD1-CD 4.41Å; L126-K130 PolarHBondContact O-N 2.9Å; L126-A131 WeakPolarHBondContact O-CB 3.42Å; L126-A131 PolarHBondContact O-N 3.18Å; L126-Y356 HydrophobicContact CD2-CD1 4.35Å; L126-Y356 HydrophobicContact CD2-CE1 3.52Å
127	Y	83.3	Confident	80.8	Confident	90 Å²	90	57.1 Å²	57.1	35%	0.353	28%	0.28	S	S	.	.	I	π-helix	trans	-116.3	136.4	176.2	-67.3	-75.3	0	0	0	109.5	P125 A131	P125-Y127 PolarHBondContact O-N 3.24Å; Y127-A131 HydrophobicContact CD1-CB 3.34Å; Y127-A131 HydrophobicContact CE1-CB 3.35Å; Y127-A131 HydrophobicContact CG-CB 4.3Å
128	P	85.5	Confident	82.4	Confident	79 Å²	79	51.1 Å²	51.1	51%	0.513	25%	0.252	S	S	.	.	I	π-helix	cis	-76.4	-23.9	-8.1	30.3	-33.5	0	0	0	113.6	K130 A131 D132	P128-K130 PolarHBondContact O-N 2.97Å; P128-A131 PolarHBondContact O-N 2.75Å; P128-D132 WeakPolarHBondContact CB-OD2 3.47Å; P128-D132 WeakPolarHBondContact O-CB 3.5Å; P128-D132 PolarHBondContact O-N 3.33Å
129	V	87.6	Confident	83.9	Confident	60 Å²	60	47.8 Å²	47.8	36%	0.364	24%	0.244	S	C	.	.	I	π-helix	trans	-57.2	-60.2	-158	-178.8	0	0	0	0	114.7	P100 D124 P125 A131 F133	P100-V129 HydrophobicContact CG-CG1 4.27Å; D124-V129 HydrophobicContact CB-CG1 3.99Å; P125-V129 HydrophobicContact CG-CB 4.22Å; P125-V129 HydrophobicContact CG-CG2 3.83Å; V129-A131 PolarHBondContact O-N 3.26Å; V129-F133 PolarHBondContact O-N 2.91Å
130	K	90	Very high	85.3	Confident	6 Å²	6	46.3 Å²	46.3	3%	0.026	23%	0.233	C	C	.	.	I	π-helix	trans	-65.3	-40.5	179.6	-67.5	173.7	175.7	146.1	0	111.6	C19 E38 P100 D124 P125 L126 P128 F133 I134	C19-K130 HydrophobicContact CB-CD 4.23Å; C19-K130 HydrophobicContact CB-CG 4.4Å; E38-K130 IonicContact OE1-NZ 3.99Å; E38-K130 IonicContact OE2-NZ 3.98Å; E38-K130 PolarHBondContact OE2-NZ 2.98Å; P100-K130 HydrophobicContact CB-CG 4.04Å; P100-K130 HydrophobicContact CG-CG 4.22Å; D124-K130 WeakPolarHBondContact O-CE 3.32Å; D124-K130 PolarHBondContact O-NZ 2.68Å; P125-K130 PolarHBondContact O-N 3.22Å; L126-K130 HydrophobicContact CD1-CB 4.18Å; L126-K130 HydrophobicContact CD1-CD 4.41Å; L126-K130 PolarHBondContact O-N 2.9Å; P128-K130 PolarHBondContact O-N 2.97Å; K130-F133 PolarHBondContact O-N 3.44Å; K130-I134 WeakPolarHBondContact O-CB 3.36Å; K130-I134 WeakPolarHBondContact O-CD1 3.48Å; K130-I134 VanDerWaalsContact O-CG1 3.22Å; K130-I134 WeakPolarHBondContact O-CG1 3.43Å; K130-I134 PolarHBondContact O-N 3.2Å
131	A	90.6	Very high	86.8	Confident	0 Å²	0	47 Å²	47	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-64.5	-42.5	-176.8	0	0	0	0	0	113.1	V42 L126 Y127 P128 V129 I134 R135	V42-A131 HydrophobicContact CG1-CB 4.1Å; V42-A131 HydrophobicContact CG2-CB 3.85Å; L126-A131 WeakPolarHBondContact O-CB 3.42Å; L126-A131 PolarHBondContact O-N 3.18Å; Y127-A131 HydrophobicContact CD1-CB 3.34Å; Y127-A131 HydrophobicContact CE1-CB 3.35Å; Y127-A131 HydrophobicContact CG-CB 4.3Å; P128-A131 PolarHBondContact O-N 2.75Å; V129-A131 PolarHBondContact O-N 3.26Å; A131-I134 PolarHBondContact O-N 2.91Å; A131-R135 WeakPolarHBondContact O-CG 3.38Å; A131-R135 PolarHBondContact O-N 3.5Å
132	D	92.7	Very high	87.9	Confident	80 Å²	80	44.4 Å²	44.4	43%	0.428	22%	0.224	S	C	.	.	H	α-helix	trans	-71.9	-35.9	178.9	-69.9	-11.7	0	0	0	111.6	P128 R135 A136	P128-D132 WeakPolarHBondContact CB-OD2 3.47Å; P128-D132 WeakPolarHBondContact O-CB 3.5Å; P128-D132 PolarHBondContact O-N 3.33Å; D132-R135 PolarHBondContact O-N 3.24Å; D132-R135 IonicContact OD1-CZ 3.54Å; D132-R135 IonicContact OD1-NH1 2.71Å; D132-R135 PolarHBondContact OD1-NH1 2.86Å; D132-A136 WeakPolarHBondContact O-CB 3.44Å; D132-A136 PolarHBondContact O-N 3.28Å
133	F	94.1	Very high	88.8	Confident	1 Å²	1	40.2 Å²	40.2	0%	0.004	21%	0.206	C	C	.	.	H	α-helix	trans	-61	-46.4	170	179.8	-98.8	0	0	0	112.1	D18 E82 L85 K99 P100 V129 K130 A136 K137 F143	D18-F133 HydrophobicContact CB-CD1 4.42Å; D18-F133 HydrophobicContact CB-CE1 4.35Å; D18-F133 WeakPolarHBondContact O-CE1 3.33Å; E82-F133 WeakPolarHBondContact OE1-CZ 3.03Å; L85-F133 HydrophobicContact CD1-CE2 3.77Å; L85-F133 HydrophobicContact CD1-CZ 4.06Å; K99-F133 HydrophobicContact CB-CE2 4.02Å; K99-F133 HydrophobicContact CB-CZ 3.93Å; K99-F133 HydrophobicContact CD-CZ 4.39Å; K99-F133 HydrophobicContact CG-CE1 4.15Å; K99-F133 HydrophobicContact CG-CE2 4.37Å; K99-F133 HydrophobicContact CG-CZ 3.82Å; P100-F133 HydrophobicContact CG-CB 3.82Å; P100-F133 HydrophobicContact CG-CD1 4.14Å; P100-F133 HydrophobicContact CG-CG 3.95Å; V129-F133 PolarHBondContact O-N 2.91Å; K130-F133 PolarHBondContact O-N 3.44Å; F133-A136 WeakPolarHBondContact O-CB 3.5Å; F133-A136 PolarHBondContact O-N 3.29Å; F133-K137 HydrophobicContact CE1-CD 3.76Å; F133-K137 HydrophobicContact CZ-CD 4.09Å; F133-K137 VanDerWaalsContact O-CB 3.27Å; F133-K137 WeakPolarHBondContact O-CB 3.39Å; F133-K137 PolarHBondContact O-N 3.42Å; F133-F143 AromaticContact CD2-CE2 3.78Å; F133-F143 HydrophobicContact CD2-CE2 3.78Å; F133-F143 AromaticContact CD2-CZ 4Å; F133-F143 HydrophobicContact CD2-CZ 4Å; F133-F143 HydrophobicContact CE2-CD2 4.2Å; F133-F143 AromaticContact CE2-CE2 3.5Å; F133-F143 HydrophobicContact CE2-CE2 3.5Å; F133-F143 AromaticContact CE2-CZ 3.94Å; F133-F143 HydrophobicContact CE2-CZ 3.94Å; F133-F143 HydrophobicContact CZ-CE2 4.14Å
134	I	94.9	Very high	89.2	Confident	1 Å²	1	35 Å²	35	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-63.1	-43.4	179.1	-73.4	164.4	0	0	0	111.3	D18 C39 V42 L46 K130 A131 K137 Y138	D18-I134 HydrophobicContact CB-CD1 4.27Å; D18-I134 HydrophobicContact CB-CG1 3.88Å; C39-I134 HydrophobicContact CB-CD1 3.67Å; V42-I134 HydrophobicContact CB-CB 4.47Å; V42-I134 HydrophobicContact CB-CD1 3.92Å; V42-I134 HydrophobicContact CB-CG2 4.04Å; V42-I134 HydrophobicContact CG1-CB 3.99Å; V42-I134 HydrophobicContact CG1-CD1 4.34Å; V42-I134 HydrophobicContact CG1-CG2 3.58Å; V42-I134 HydrophobicContact CG2-CD1 4.05Å; L46-I134 HydrophobicContact CD1-CG2 4.04Å; K130-I134 WeakPolarHBondContact O-CB 3.36Å; K130-I134 WeakPolarHBondContact O-CD1 3.48Å; K130-I134 VanDerWaalsContact O-CG1 3.22Å; K130-I134 WeakPolarHBondContact O-CG1 3.43Å; K130-I134 PolarHBondContact O-N 3.2Å; A131-I134 PolarHBondContact O-N 2.91Å; I134-K137 PolarHBondContact O-N 2.97Å; I134-Y138 HydrophobicContact CG2-CD2 4.12Å; I134-Y138 WeakPolarHBondContact O-CD2 3.41Å; I134-Y138 PolarHBondContact O-N 3.25Å
135	R	93.5	Very high	89.2	Confident	75 Å²	75	37.6 Å²	37.6	28%	0.283	20%	0.201	S	C	.	.	I	π-helix	trans	-62.8	-46.2	172.9	-70.3	174.2	-166.9	125.9	-2	111.3	L46 A131 D132 K137 Q139 N140	L46-R135 HydrophobicContact CD2-CG 3.9Å; A131-R135 WeakPolarHBondContact O-CG 3.38Å; A131-R135 PolarHBondContact O-N 3.5Å; D132-R135 PolarHBondContact O-N 3.24Å; D132-R135 IonicContact OD1-CZ 3.54Å; D132-R135 IonicContact OD1-NH1 2.71Å; D132-R135 PolarHBondContact OD1-NH1 2.86Å; R135-K137 VanDerWaalsContact C-N 3.29Å; R135-K137 PolarHBondContact O-N 2.97Å; R135-Q139 WeakPolarHBondContact O-CB 3.42Å; R135-Q139 PolarHBondContact O-N 3.03Å; R135-Q139 VanDerWaalsContact O-N 3.14Å; R135-N140 VanDerWaalsContact O-CB 3.31Å; R135-N140 WeakPolarHBondContact O-CB 3.36Å; R135-N140 PolarHBondContact O-N 2.94Å; R135-N140 PolarHBondContact O-ND2 3.32Å
136	A	92.1	Very high	88.6	Confident	16 Å²	16	38.9 Å²	38.9	13%	0.132	20%	0.198	C	C	.	.	I	π-helix	trans	-55.2	-45	175.2	0	0	0	0	0	111.5	D132 F133 N140 L141 A142 F143	D132-A136 WeakPolarHBondContact O-CB 3.44Å; D132-A136 PolarHBondContact O-N 3.28Å; F133-A136 WeakPolarHBondContact O-CB 3.5Å; F133-A136 PolarHBondContact O-N 3.29Å; A136-N140 WeakPolarHBondContact O-CB 3.34Å; A136-L141 PolarHBondContact O-N 3.42Å; A136-A142 HydrophobicContact CB-CB 4.1Å; A136-A142 WeakPolarHBondContact O-CB 3.33Å; A136-A142 PolarHBondContact O-N 2.85Å; A136-F143 HydrophobicContact CB-CE2 3.77Å; A136-F143 HydrophobicContact CB-CZ 3.59Å
137	K	94.1	Very high	87.7	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.204	C	C	.	.	I	π-helix	trans	-68.6	-57.3	-177.5	-172.8	170.5	174.6	-178.4	0	113.4	A17 D18 N78 W81 E82 F133 I134 R135 L141 F143	A17-K137 PolarHBondContact O-NZ 3.08Å; D18-K137 WeakPolarHBondContact OD1-CD 3.34Å; D18-K137 WeakPolarHBondContact OD1-CE 3.45Å; D18-K137 IonicContact OD1-NZ 3.43Å; D18-K137 PolarHBondContact OD1-NZ 2.86Å; N78-K137 PolarHBondContact OD1-NZ 2.77Å; W81-K137 HydrophobicContact CB-CD 4.38Å; W81-K137 HydrophobicContact CB-CG 3.99Å; E82-K137 HydrophobicContact CG-CD 4.15Å; E82-K137 WeakPolarHBondContact OE1-CE 3.37Å; E82-K137 IonicContact OE1-NZ 3.45Å; E82-K137 PolarHBondContact OE1-NZ 2.79Å; F133-K137 HydrophobicContact CE1-CD 3.76Å; F133-K137 HydrophobicContact CZ-CD 4.09Å; F133-K137 VanDerWaalsContact O-CB 3.27Å; F133-K137 WeakPolarHBondContact O-CB 3.39Å; F133-K137 PolarHBondContact O-N 3.42Å; I134-K137 PolarHBondContact O-N 2.97Å; R135-K137 VanDerWaalsContact C-N 3.29Å; R135-K137 PolarHBondContact O-N 2.97Å; K137-L141 WeakPolarHBondContact O-CA 3.37Å; K137-F143 HydrophobicContact CB-CD2 3.94Å; K137-F143 HydrophobicContact CB-CE2 3.97Å; K137-F143 HydrophobicContact CG-CD2 4.27Å
138	Y	93.8	Very high	86.5	Confident	2 Å²	2	39.7 Å²	39.7	1%	0.008	21%	0.209	C	C	.	.	I	π-helix	trans	-103.2	-35.5	-168	-56	-71.7	0	0	0	115.5	D18 R31 H43 W81 I134	D18-Y138 WeakPolarHBondContact OD1-CE2 3.17Å; D18-Y138 VanDerWaalsContact OD1-CZ 3.29Å; D18-Y138 PolarHBondContact OD1-OH 3.37Å; R31-Y138 HydrophobicContact CB-CD1 4.44Å; R31-Y138 HydrophobicContact CB-CE1 4.14Å; R31-Y138 HydrophobicContact CG-CD1 3.93Å; R31-Y138 HydrophobicContact CG-CE1 4.12Å; H43-Y138 AromaticContact CE1-CD2 3.56Å; H43-Y138 AromaticContact CE1-CE2 3.29Å; H43-Y138 WeakPolarHBondContact CE1-CE2 3.49Å; H43-Y138 AromaticContact CE1-CZ 3.87Å; H43-Y138 AromaticContact NE2-CD2 3.63Å; H43-Y138 AromaticContact NE2-CE2 3.27Å; H43-Y138 VanDerWaalsContact NE2-CE2 3.27Å; H43-Y138 WeakPolarHBondContact NE2-CE2 3.45Å; W81-Y138 HydrophobicContact CB-CE1 4.14Å; W81-Y138 AromaticContact CD1-CE1 3.94Å; W81-Y138 HydrophobicContact CD2-CD1 4.05Å; W81-Y138 AromaticContact CD2-CE1 3.96Å; W81-Y138 HydrophobicContact CD2-CE1 3.96Å; W81-Y138 HydrophobicContact CE3-CD1 4.14Å; W81-Y138 HydrophobicContact CG-CD1 4.24Å; W81-Y138 AromaticContact CG-CE1 3.73Å; W81-Y138 HydrophobicContact CG-CE1 3.73Å; I134-Y138 HydrophobicContact CG2-CD2 4.12Å; I134-Y138 WeakPolarHBondContact O-CD2 3.41Å; I134-Y138 PolarHBondContact O-N 3.25Å
139	Q	90.3	Very high	84.8	Confident	100 Å²	100	42.7 Å²	42.7	47%	0.467	21%	0.214	S	C	.	.	I	π-helix	trans	-84	-38.6	179.6	-175.4	-176.8	5.1	0	0	111	V50 R135	V50-Q139 HydrophobicContact CG1-CB 4.24Å; V50-Q139 HydrophobicContact CG2-CG 4.41Å; R135-Q139 WeakPolarHBondContact O-CB 3.42Å; R135-Q139 PolarHBondContact O-N 3.03Å; R135-Q139 VanDerWaalsContact O-N 3.14Å
140	N	88	Confident	82.9	Confident	54 Å²	54	46.3 Å²	46.3	29%	0.289	23%	0.232	S	C	.	.	S	Bend	trans	-96.2	-15.8	-175.5	-79.6	-46.4	0	0	0	113.6	R135 A136 A142 R579	R135-N140 VanDerWaalsContact O-CB 3.31Å; R135-N140 WeakPolarHBondContact O-CB 3.36Å; R135-N140 PolarHBondContact O-N 2.94Å; R135-N140 PolarHBondContact O-ND2 3.32Å; A136-N140 WeakPolarHBondContact O-CB 3.34Å; N140-A142 PolarHBondContact O-N 2.96Å; N140-R579 VanDerWaalsContact CB-NH2 3.33Å; N140-R579 PolarHBondContact O-NE 3.07Å; N140-R579 VanDerWaalsContact O-NE 3.07Å; N140-R579 PolarHBondContact O-NH2 3.48Å; N140-R579 PolarHBondContact OD1-NH1 3Å
141	L	89.2	Confident	80.9	Confident	29 Å²	29	50.2 Å²	50.2	15%	0.152	25%	0.253	C	S	.	.			trans	47.7	47.9	-175.3	-55	179.5	0	0	0	111.2	W81 A136 K137 R146	W81-L141 HydrophobicContact CE3-CD2 4.25Å; W81-L141 HydrophobicContact CZ3-CD2 4.04Å; A136-L141 PolarHBondContact O-N 3.42Å; K137-L141 WeakPolarHBondContact O-CA 3.37Å; L141-R146 PolarHBondContact O-NH2 2.79Å
142	A	87.8	Confident	78.8	Confident	30 Å²	30	57.1 Å²	57.1	25%	0.248	30%	0.295	C	S	.	.			trans	-73.3	-32.4	-175.4	0	0	0	0	0	112.2	N84 A136 N140	N84-A142 PolarHBondContact ND2-O 2.89Å; A136-A142 HydrophobicContact CB-CB 4.1Å; A136-A142 WeakPolarHBondContact O-CB 3.33Å; A136-A142 PolarHBondContact O-N 2.85Å; N140-A142 PolarHBondContact O-N 2.96Å
143	F	88.6	Confident	76.9	Confident	17 Å²	17	56.7 Å²	56.7	8%	0.075	30%	0.296	C	S	.	.	S	Bend	trans	-112.6	-2.7	-172.2	-37.8	-58.9	0	0	0	113.9	W81 E82 H83 N84 L85 C97 F133 A136 K137	W81-F143 CarbonylContact O-C 3.49Å; W81-F143 WeakPolarHBondContact O-CB 3.49Å; E82-F143 CarbonylContact C-O 3.55Å; H83-F143 WeakPolarHBondContact CB-O 3.46Å; H83-F143 PolarHBondContact N-O 3.25Å; N84-F143 PolarHBondContact N-O 3.26Å; N84-F143 PolarHBondContact ND2-O 3.04Å; L85-F143 HydrophobicContact CD1-CB 3.98Å; L85-F143 HydrophobicContact CD1-CD1 3.92Å; L85-F143 HydrophobicContact CD1-CD2 3.71Å; L85-F143 HydrophobicContact CD1-CE1 4.33Å; L85-F143 HydrophobicContact CD1-CE2 4.13Å; L85-F143 HydrophobicContact CD1-CG 3.59Å; L85-F143 HydrophobicContact CD1-CZ 4.42Å; L85-F143 HydrophobicContact CD2-CD1 3.91Å; L85-F143 HydrophobicContact CD2-CE1 4.18Å; L85-F143 HydrophobicContact CD2-CG 4.39Å; L85-F143 HydrophobicContact CG-CB 3.94Å; L85-F143 HydrophobicContact CG-CD1 3.83Å; L85-F143 HydrophobicContact CG-CD2 4.44Å; L85-F143 HydrophobicContact CG-CE1 4.46Å; L85-F143 HydrophobicContact CG-CG 3.82Å; C97-F143 HydrophobicContact CB-CE1 3.98Å; C97-F143 HydrophobicContact CB-CZ 3.91Å; F133-F143 AromaticContact CD2-CE2 3.78Å; F133-F143 HydrophobicContact CD2-CE2 3.78Å; F133-F143 AromaticContact CD2-CZ 4Å; F133-F143 HydrophobicContact CD2-CZ 4Å; F133-F143 HydrophobicContact CE2-CD2 4.2Å; F133-F143 AromaticContact CE2-CE2 3.5Å; F133-F143 HydrophobicContact CE2-CE2 3.5Å; F133-F143 AromaticContact CE2-CZ 3.94Å; F133-F143 HydrophobicContact CE2-CZ 3.94Å; F133-F143 HydrophobicContact CZ-CE2 4.14Å; A136-F143 HydrophobicContact CB-CE2 3.77Å; A136-F143 HydrophobicContact CB-CZ 3.59Å; K137-F143 HydrophobicContact CB-CD2 3.94Å; K137-F143 HydrophobicContact CB-CE2 3.97Å; K137-F143 HydrophobicContact CG-CD2 4.27Å
144	S	86	Confident	75	Confident	4 Å²	4	59.6 Å²	59.6	3%	0.028	32%	0.319	C	S	.	.	S	Bend	trans	-75.7	159.6	173.5	67.8	0	0	0	0	111.2	V80 N84	V80-S144 WeakPolarHBondContact O-CA 3.38Å; V80-S144 WeakPolarHBondContact O-CB 3.19Å; N84-S144 PolarHBondContact ND2-O 3.4Å
145	L	83.3	Confident	73.3	Confident	72 Å²	72	63.7 Å²	63.7	38%	0.377	34%	0.344	S	S	.	.			trans	-55.5	142.2	166.4	-176.7	61.7	0	0	0	109.8	L184	L145-L184 HydrophobicContact CG-CD2 4.39Å
146	R	71.1	Confident	71.8	Confident	87 Å²	87	64.5 Å²	64.5	33%	0.328	35%	0.354	S	S	.	.			trans	-121.4	144.8	175	-64.6	178.8	178	172.9	-0.4	108.4	L141	L141-R146 PolarHBondContact O-NH2 2.79Å
147	R	65.7	Low	70.6	Confident	53 Å²	53	66.8 Å²	66.8	20%	0.2	36%	0.364	C	S	.	.			trans	-56	145.2	164.9	-48.9	-170.9	-167.1	-168.7	3	109.2	A158 L184	R147-A158 PolarHBondContact NH1-O 3Å; R147-L184 HydrophobicContact CG-CD2 4.35Å; R147-L184 PolarHBondContact NE-O 2.86Å; R147-L184 VanDerWaalsContact NE-O 3.09Å; R147-L184 PolarHBondContact NH2-O 2.9Å
148	S	57.1	Low	69.7	Low	67 Å²	67	67.9 Å²	67.9	47%	0.469	37%	0.373	S	S	.	.			trans	-58.1	159.1	-177.4	-167.8	0	0	0	0	111.6	D150	S148-D150 VanDerWaalsContact C-N 3.32Å; S148-D150 PolarHBondContact OG-N 2.88Å
149	K	50	Low	69.1	Low	142 Å²	142	69.5 Å²	69.5	62%	0.617	38%	0.382	S	S	*	.	S	Bend	trans	-77.6	-21.5	168.2	-81.1	-176.7	177.7	176.6	0	111.9	D151 E571	K149-D151 VanDerWaalsContact C-N 3.31Å; K149-D151 PolarHBondContact O-N 3.48Å; K149-E571 IonicContact NZ-OE1 3.16Å; K149-E571 PolarHBondContact NZ-OE1 2.97Å
150	D	48.1	Very low	68.7	Low	136 Å²	136	68.7 Å²	68.7	73%	0.727	38%	0.381	S	S	*	.			trans	-87.8	3.9	-168.7	-58.4	-36.5	0	0	0	114.2	S148 T152	S148-D150 VanDerWaalsContact C-N 3.32Å; S148-D150 PolarHBondContact OG-N 2.88Å; D150-T152 VanDerWaalsContact C-N 3.28Å; D150-T152 PolarHBondContact O-N 2.9Å
151	D	47.1	Very low	68.7	Low	88 Å²	88	70.4 Å²	70.4	47%	0.471	39%	0.39	S	S	.	.			trans	-71.6	85.6	172.2	-63.4	-31.9	0	0	0	109.3	K149 V153	K149-D151 VanDerWaalsContact C-N 3.31Å; K149-D151 PolarHBondContact O-N 3.48Å; D151-V153 PolarHBondContact O-N 2.86Å; D151-V153 VanDerWaalsContact O-N 3.09Å
152	T	46.7	Very low	68.7	Low	146 Å²	146	69.6 Å²	69.6	90%	0.896	39%	0.386	S	S	*	.			trans	-66.1	2.8	165.7	51.7	0	0	0	0	113	D150	D150-T152 VanDerWaalsContact C-N 3.28Å; D150-T152 PolarHBondContact O-N 2.9Å
153	V	53.6	Low	68.8	Low	71 Å²	71	68.6 Å²	68.6	43%	0.43	38%	0.376	S	S	.	.	S	Bend	trans	-69.2	134.9	170.5	-174.3	0	0	0	0	109.2	D151 V155 N157	D151-V153 PolarHBondContact O-N 2.86Å; D151-V153 VanDerWaalsContact O-N 3.09Å; V153-V155 PolarHBondContact O-N 3.12Å; V153-N157 HydrophobicContact CG1-CB 3.79Å
154	A	54.3	Low	68.9	Low	61 Å²	61	74.7 Å²	74.7	50%	0.504	40%	0.399	S	S	.	.			trans	-51.9	129.7	172.5	0	0	0	0	0	110.1	D156 N157	A154-D156 PolarHBondContact O-N 3.07Å; A154-N157 PolarHBondContact O-N 3.34Å
155	V	59.7	Low	69.2	Low	87 Å²	87	79.5 Å²	79.5	53%	0.527	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.4	-30.1	-169.2	175.2	0	0	0	0	113.3	V153 L159 K581	V153-V155 PolarHBondContact O-N 3.12Å; V155-L159 PolarHBondContact O-N 3.22Å; V155-K581 HydrophobicContact CG1-CD 4.11Å
156	D	60.3	Low	69.7	Low	92 Å²	92	76.1 Å²	76.1	49%	0.492	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-40.4	-173.9	-47.5	-40.3	0	0	0	111.5	A154 A158 L159 D160 K581	A154-D156 PolarHBondContact O-N 3.07Å; D156-A158 VanDerWaalsContact C-N 3.31Å; D156-A158 PolarHBondContact O-N 3.27Å; D156-L159 WeakPolarHBondContact O-CA 3.43Å; D156-L159 WeakPolarHBondContact O-CB 3.41Å; D156-L159 PolarHBondContact O-N 2.88Å; D156-D160 PolarHBondContact O-N 2.83Å; D156-K581 IonicContact OD1-NZ 2.7Å; D156-K581 PolarHBondContact OD1-NZ 2.68Å
157	N	67.7	Low	70.6	Confident	65 Å²	65	72.3 Å²	72.3	35%	0.348	39%	0.389	S	S	.	.	H	α-helix	trans	-59	-41.9	173.8	-68.1	8.5	0	0	0	111.8	V153 A154 L159 D160 D161	V153-N157 HydrophobicContact CG1-CB 3.79Å; A154-N157 PolarHBondContact O-N 3.34Å; N157-L159 PolarHBondContact O-N 2.87Å; N157-D160 PolarHBondContact O-N 2.94Å; N157-D161 PolarHBondContact O-N 3.21Å
158	A	74.7	Confident	71.8	Confident	23 Å²	23	73.4 Å²	73.4	19%	0.19	41%	0.405	C	S	.	.	H	α-helix	trans	-68.3	-18.9	178	0	0	0	0	0	112.8	R147 D156	R147-A158 PolarHBondContact NH1-O 3Å; D156-A158 VanDerWaalsContact C-N 3.31Å; D156-A158 PolarHBondContact O-N 3.27Å
159	L	81.1	Confident	73.5	Confident	36 Å²	36	70.7 Å²	70.7	19%	0.188	39%	0.386	C	S	.	.	H	α-helix	trans	-80.8	-42.1	170.8	179.1	59.8	0	0	0	110.8	V155 D156 N157 D161 L162 N163 G185	V155-L159 PolarHBondContact O-N 3.22Å; D156-L159 WeakPolarHBondContact O-CA 3.43Å; D156-L159 WeakPolarHBondContact O-CB 3.41Å; D156-L159 PolarHBondContact O-N 2.88Å; N157-L159 PolarHBondContact O-N 2.87Å; L159-D161 PolarHBondContact O-N 3.4Å; L159-L162 WeakPolarHBondContact O-CB 3.41Å; L159-L162 PolarHBondContact O-N 2.88Å; L159-L162 VanDerWaalsContact O-N 3.13Å; L159-N163 WeakPolarHBondContact O-CB 3.46Å; L159-N163 VanDerWaalsContact O-CG 3.25Å; L159-N163 PolarHBondContact O-N 3.2Å; L159-N163 PolarHBondContact O-ND2 2.83Å; L159-G185 WeakPolarHBondContact CD1-O 3.35Å
160	D	82.8	Confident	75.4	Confident	82 Å²	82	64 Å²	64	44%	0.439	36%	0.357	S	S	.	.	H	α-helix	trans	-60.3	-43	175.7	-71.6	-18.7	0	0	0	112.2	D156 N157 L162 N163 R164	D156-D160 PolarHBondContact O-N 2.83Å; N157-D160 PolarHBondContact O-N 2.94Å; D160-L162 VanDerWaalsContact C-N 3.31Å; D160-L162 PolarHBondContact O-N 2.9Å; D160-N163 PolarHBondContact O-N 2.76Å; D160-R164 WeakPolarHBondContact O-CB 3.27Å; D160-R164 VanDerWaalsContact O-CG 3.31Å; D160-R164 WeakPolarHBondContact O-CG 3.48Å; D160-R164 PolarHBondContact O-N 3.31Å
161	D	86.8	Confident	77.3	Confident	90 Å²	90	62.4 Å²	62.4	48%	0.481	34%	0.34	S	S	.	.	H	α-helix	trans	-60.4	-40.1	173.8	-76.2	-27.5	0	0	0	112.1	N157 L159 R164 Q165	N157-D161 PolarHBondContact O-N 3.21Å; L159-D161 PolarHBondContact O-N 3.4Å; D161-R164 PolarHBondContact O-N 3.23Å; D161-Q165 WeakPolarHBondContact O-CB 3.24Å; D161-Q165 VanDerWaalsContact O-CG 3.23Å; D161-Q165 WeakPolarHBondContact O-CG 3.36Å; D161-Q165 PolarHBondContact O-N 3.21Å; D161-Q165 PolarHBondContact O-NE2 3Å
162	L	89.6	Confident	79.3	Confident	12 Å²	12	60.8 Å²	60.8	6%	0.063	33%	0.334	C	S	.	.	H	α-helix	trans	-69.9	-36.4	178.3	-165.9	75.6	0	0	0	111.8	L159 D160 Q165 L166 L181 L184 A186	L159-L162 WeakPolarHBondContact O-CB 3.41Å; L159-L162 PolarHBondContact O-N 2.88Å; L159-L162 VanDerWaalsContact O-N 3.13Å; D160-L162 VanDerWaalsContact C-N 3.31Å; D160-L162 PolarHBondContact O-N 2.9Å; L162-Q165 WeakPolarHBondContact O-CB 3.49Å; L162-Q165 PolarHBondContact O-N 3.15Å; L162-L166 PolarHBondContact O-N 3.42Å; L162-L181 HydrophobicContact CD1-CD2 3.49Å; L162-L181 VanDerWaalsContact CD1-CD2 3.49Å; L162-L181 HydrophobicContact CG-CD2 4.31Å; L162-L184 HydrophobicContact CD1-CB 4.15Å; L162-L184 HydrophobicContact CD1-CD1 4.28Å; L162-L184 HydrophobicContact CD2-CB 3.69Å; L162-L184 WeakPolarHBondContact CD2-O 3.44Å; L162-A186 HydrophobicContact CD2-CB 3.87Å; L162-A186 HydrophobicContact CG-CB 3.97Å
163	N	90.7	Very high	81.1	Confident	9 Å²	9	57.4 Å²	57.4	5%	0.048	31%	0.311	C	S	.	.	H	α-helix	trans	-68.8	-40.6	175.5	-70	-19.8	0	0	0	111.5	L159 D160 L166 N167 A186 D187 F191	L159-N163 WeakPolarHBondContact O-CB 3.46Å; L159-N163 VanDerWaalsContact O-CG 3.25Å; L159-N163 PolarHBondContact O-N 3.2Å; L159-N163 PolarHBondContact O-ND2 2.83Å; D160-N163 PolarHBondContact O-N 2.76Å; N163-L166 WeakPolarHBondContact O-CB 3.32Å; N163-L166 PolarHBondContact O-N 3.33Å; N163-N167 PolarHBondContact O-N 2.96Å; N163-A186 WeakPolarHBondContact OD1-CA 3.46Å; N163-D187 PolarHBondContact OD1-N 3.09Å; N163-F191 HydrophobicContact CB-CB 3.9Å; N163-F191 HydrophobicContact CB-CD2 3.44Å; N163-F191 VanDerWaalsContact CB-CD2 3.44Å; N163-F191 HydrophobicContact CB-CE2 4.17Å; N163-F191 HydrophobicContact CB-CG 3.77Å
164	R	90.8	Very high	82.8	Confident	146 Å²	146	59.6 Å²	59.6	55%	0.551	32%	0.316	S	S	*	.	H	α-helix	trans	-60.4	-44.7	170.1	-71.2	171.3	-174.8	-104.2	1.6	111.4	D160 D161 L166 N167 S168 F191	D160-R164 WeakPolarHBondContact O-CB 3.27Å; D160-R164 VanDerWaalsContact O-CG 3.31Å; D160-R164 WeakPolarHBondContact O-CG 3.48Å; D160-R164 PolarHBondContact O-N 3.31Å; D161-R164 PolarHBondContact O-N 3.23Å; R164-L166 VanDerWaalsContact C-N 3.34Å; R164-L166 PolarHBondContact O-N 3.48Å; R164-N167 PolarHBondContact O-N 3.22Å; R164-S168 PolarHBondContact O-N 3.16Å; R164-S168 PolarHBondContact O-OG 3.46Å; R164-F191 HydrophobicContact CG-CE2 4.26Å; R164-F191 HydrophobicContact CG-CZ 4.45Å
165	Q	92.5	Very high	84.5	Confident	105 Å²	105	56.7 Å²	56.7	49%	0.491	29%	0.292	S	S	.	.	H	α-helix	trans	-60.3	-41.3	174.2	-74.6	169.4	42.5	0	0	112.1	D161 L162 S168 C169 L181	D161-Q165 WeakPolarHBondContact O-CB 3.24Å; D161-Q165 VanDerWaalsContact O-CG 3.23Å; D161-Q165 WeakPolarHBondContact O-CG 3.36Å; D161-Q165 PolarHBondContact O-N 3.21Å; D161-Q165 PolarHBondContact O-NE2 3Å; L162-Q165 WeakPolarHBondContact O-CB 3.49Å; L162-Q165 PolarHBondContact O-N 3.15Å; Q165-S168 PolarHBondContact O-N 2.96Å; Q165-C169 WeakPolarHBondContact O-CB 3.47Å; Q165-C169 PolarHBondContact O-N 2.79Å; Q165-L181 HydrophobicContact CB-CD1 4.37Å; Q165-L181 HydrophobicContact CB-CD2 4.09Å
166	L	92.3	Very high	85.9	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-61.1	-48.1	174.5	179.2	66.9	0	0	0	111.1	L162 N163 R164 S168 C169 V170 T178 L181 L182 A186 P188 P200 L221	L162-L166 PolarHBondContact O-N 3.42Å; N163-L166 WeakPolarHBondContact O-CB 3.32Å; N163-L166 PolarHBondContact O-N 3.33Å; R164-L166 VanDerWaalsContact C-N 3.34Å; R164-L166 PolarHBondContact O-N 3.48Å; L166-S168 VanDerWaalsContact C-N 3.3Å; L166-S168 PolarHBondContact O-N 3.16Å; L166-C169 PolarHBondContact O-N 3.06Å; L166-C169 VanDerWaalsContact O-N 3.11Å; L166-V170 HydrophobicContact CD1-CG1 4.3Å; L166-V170 WeakPolarHBondContact O-CG1 3.24Å; L166-V170 PolarHBondContact O-N 3.05Å; L166-T178 HydrophobicContact CD1-CG2 3.79Å; L166-L181 HydrophobicContact CB-CD1 4.4Å; L166-L181 HydrophobicContact CD1-CB 4.21Å; L166-L181 HydrophobicContact CD1-CD1 4.44Å; L166-L182 HydrophobicContact CD1-CD2 4.35Å; L166-L182 HydrophobicContact CD1-CG 4.29Å; L166-L182 HydrophobicContact CD2-CD2 3.88Å; L166-A186 HydrophobicContact CB-CB 4.11Å; L166-A186 HydrophobicContact CD2-CB 3.81Å; L166-A186 HydrophobicContact CG-CB 4.45Å; L166-P188 HydrophobicContact CD2-CB 4.04Å; L166-P200 HydrophobicContact CD2-CG 4.34Å; L166-L221 HydrophobicContact CD1-CD2 4.43Å; L166-L221 HydrophobicContact CD2-CD2 4.38Å
167	N	91.6	Very high	87.5	Confident	8 Å²	8	52.1 Å²	52.1	4%	0.043	27%	0.265	C	S	.	.	H	α-helix	trans	-61.4	-37.6	179.3	-163.7	33.6	0	0	0	112.2	N163 R164 V170 R171 F191 V203	N163-N167 PolarHBondContact O-N 2.96Å; R164-N167 PolarHBondContact O-N 3.22Å; N167-V170 WeakPolarHBondContact O-CG2 3.48Å; N167-R171 PolarHBondContact ND2-NH1 3.35Å; N167-R171 PolarHBondContact O-NH1 3.19Å; N167-R171 PolarHBondContact OD1-NH1 3.05Å; N167-F191 HydrophobicContact CB-CD1 4.24Å; N167-F191 HydrophobicContact CB-CE1 3.69Å; N167-F191 HydrophobicContact CB-CZ 4.38Å; N167-V203 WeakPolarHBondContact OD1-CG2 3.37Å
168	S	90.6	Very high	88.7	Confident	75 Å²	75	49 Å²	49	52%	0.524	25%	0.249	S	C	.	.	H	α-helix	trans	-68.6	-43.8	171.4	-65.7	0	0	0	0	112	R164 Q165 L166 V170 R171	R164-S168 PolarHBondContact O-N 3.16Å; R164-S168 PolarHBondContact O-OG 3.46Å; Q165-S168 PolarHBondContact O-N 2.96Å; L166-S168 VanDerWaalsContact C-N 3.3Å; L166-S168 PolarHBondContact O-N 3.16Å; S168-V170 PolarHBondContact O-N 3.25Å; S168-R171 WeakPolarHBondContact O-CB 3.44Å; S168-R171 PolarHBondContact O-N 3.07Å
169	C	91.5	Very high	89.6	Confident	11 Å²	11	48 Å²	48	7%	0.074	24%	0.24	C	C	.	.	H	α-helix	trans	-63	-38.3	-177.3	-173.4	0	0	0	0	112.8	Q165 L166 R171 T172 T178 L181	Q165-C169 WeakPolarHBondContact O-CB 3.47Å; Q165-C169 PolarHBondContact O-N 2.79Å; L166-C169 PolarHBondContact O-N 3.06Å; L166-C169 VanDerWaalsContact O-N 3.11Å; C169-R171 PolarHBondContact O-N 3.26Å; C169-R171 VanDerWaalsContact O-N 3.13Å; C169-T172 PolarHBondContact O-N 3.47Å; C169-T172 PolarHBondContact O-OG1 3.41Å; C169-T178 PolarHBondContact SG-OG1 2.95Å; C169-T178 VanDerWaalsContact SG-OG1 3.42Å; C169-L181 HydrophobicContact CB-CD1 3.63Å
170	V	90.6	Very high	90.1	Very high	0 Å²	0	49 Å²	49	0%	0	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-17.2	179.3	-65.2	0	0	0	0	113.7	L166 N167 S168 T172 T178 P200 V203 K217 L221	L166-V170 HydrophobicContact CD1-CG1 4.3Å; L166-V170 WeakPolarHBondContact O-CG1 3.24Å; L166-V170 PolarHBondContact O-N 3.05Å; N167-V170 WeakPolarHBondContact O-CG2 3.48Å; S168-V170 PolarHBondContact O-N 3.25Å; V170-T172 VanDerWaalsContact C-N 3.31Å; V170-T178 HydrophobicContact CG1-CG2 4.19Å; V170-P200 HydrophobicContact CG1-CB 4.4Å; V170-P200 HydrophobicContact CG2-CB 4.27Å; V170-V203 HydrophobicContact CG2-CB 4.09Å; V170-V203 HydrophobicContact CG2-CG1 3.88Å; V170-K217 VanDerWaalsContact O-CD 3.29Å; V170-K217 WeakPolarHBondContact O-CD 3.41Å; V170-K217 VanDerWaalsContact O-CE 3.3Å; V170-K217 WeakPolarHBondContact O-CE 3.39Å; V170-K217 PolarHBondContact O-NZ 2.81Å; V170-L221 HydrophobicContact CG1-CD1 3.97Å; V170-L221 HydrophobicContact CG1-CD2 4.16Å
171	R	88.8	Confident	90.6	Very high	103 Å²	103	45.7 Å²	45.7	39%	0.389	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-19.8	171.1	-59.8	171.9	163.4	90.6	-14.5	112.8	N167 S168 C169 V203 E207	N167-R171 PolarHBondContact ND2-NH1 3.35Å; N167-R171 PolarHBondContact O-NH1 3.19Å; N167-R171 PolarHBondContact OD1-NH1 3.05Å; S168-R171 WeakPolarHBondContact O-CB 3.44Å; S168-R171 PolarHBondContact O-N 3.07Å; C169-R171 PolarHBondContact O-N 3.26Å; C169-R171 VanDerWaalsContact O-N 3.13Å; R171-V203 HydrophobicContact CG-CG1 3.46Å; R171-V203 VanDerWaalsContact CG-CG1 3.46Å; R171-E207 HydrophobicContact CB-CG 4.4Å; R171-E207 HydrophobicContact CG-CG 4.09Å
172	T	88.5	Confident	90.8	Very high	55 Å²	55	41.8 Å²	41.8	34%	0.337	20%	0.202	S	C	.	.	S	Bend	trans	-102.4	162.9	-176.6	75.8	0	0	0	0	112.5	C169 V170 H174 K217	C169-T172 PolarHBondContact O-N 3.47Å; C169-T172 PolarHBondContact O-OG1 3.41Å; V170-T172 VanDerWaalsContact C-N 3.31Å; T172-H174 PolarHBondContact O-N 2.97Å; T172-H174 VanDerWaalsContact O-N 3.16Å; T172-H174 PolarHBondContact OG1-CD2 3.39Å; T172-H174 VanDerWaalsContact OG1-CD2 3.28Å; T172-K217 WeakPolarHBondContact O-CE 3.46Å; T172-K217 PolarHBondContact O-NZ 3.3Å
173	N	85.1	Confident	90.8	Very high	75 Å²	75	42.1 Å²	42.1	40%	0.401	21%	0.205	S	C	.	.	S	Bend	trans	-79	11.5	-178.7	-69.7	-24.5	0	0	0	115.1	V175 F213	N173-V175 PolarHBondContact O-N 3.28Å; N173-V175 VanDerWaalsContact O-N 3.08Å; N173-F213 HydrophobicContact CB-CB 4.46Å; N173-F213 HydrophobicContact CB-CD1 4.43Å; N173-F213 HydrophobicContact CB-CD2 4.02Å; N173-F213 HydrophobicContact CB-CE2 4.37Å; N173-F213 HydrophobicContact CB-CG 4.06Å
174	H	87.9	Confident	90.7	Very high	117 Å²	117	43 Å²	43	54%	0.542	21%	0.21	S	C	.	.			trans	-87	70.6	-172	-58	-57.9	0	0	0	113.9	T172 E176 T177 T178	T172-H174 PolarHBondContact O-N 2.97Å; T172-H174 VanDerWaalsContact O-N 3.16Å; T172-H174 PolarHBondContact OG1-CD2 3.39Å; T172-H174 VanDerWaalsContact OG1-CD2 3.28Å; H174-E176 VanDerWaalsContact C-N 3.27Å; H174-E176 PolarHBondContact O-N 3.39Å; H174-T177 WeakPolarHBondContact O-CB 3.43Å; H174-T177 PolarHBondContact O-N 2.9Å; H174-T178 PolarHBondContact O-N 3.27Å; H174-T178 PolarHBondContact O-OG1 2.9Å
175	V	89.9	Confident	90.3	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-60.3	-32.6	-177.8	-168.7	0	0	0	0	113	L68 T71 L72 N173 T178 L179 F213 A216 L220	L68-V175 HydrophobicContact CD1-CG1 4.31Å; T71-V175 HydrophobicContact CG2-CG2 4.24Å; L72-V175 HydrophobicContact CD2-CB 4.5Å; L72-V175 HydrophobicContact CD2-CG1 3.76Å; L72-V175 HydrophobicContact CG-CG1 4.23Å; N173-V175 PolarHBondContact O-N 3.28Å; N173-V175 VanDerWaalsContact O-N 3.08Å; V175-T178 WeakPolarHBondContact O-CB 3.37Å; V175-T178 PolarHBondContact O-N 3.25Å; V175-L179 PolarHBondContact O-N 3.48Å; V175-F213 HydrophobicContact CG2-CD1 3.81Å; V175-A216 HydrophobicContact CG1-CB 4.42Å; V175-A216 HydrophobicContact CG2-CB 4.35Å; V175-L220 HydrophobicContact CG1-CD2 3.93Å
176	E	91	Very high	90.2	Very high	33 Å²	33	31.6 Å²	31.6	15%	0.154	17%	0.165	C	C	.	.	H	α-helix	trans	-67.5	-37	174.4	-172.5	-119	-163.8	0	0	112.4	N75 V80 H174 L179 R180	N75-E176 HydrophobicContact CB-CB 4.08Å; N75-E176 VanDerWaalsContact O-CG 3.31Å; N75-E176 WeakPolarHBondContact O-CG 3.15Å; V80-E176 HydrophobicContact CG2-CG 4.04Å; H174-E176 VanDerWaalsContact C-N 3.27Å; H174-E176 PolarHBondContact O-N 3.39Å; E176-L179 PolarHBondContact O-N 3.13Å; E176-R180 VanDerWaalsContact CD-NH2 3.26Å; E176-R180 WeakPolarHBondContact O-CB 3.31Å; E176-R180 PolarHBondContact O-N 3.41Å; E176-R180 IonicContact OE1-CZ 2.76Å; E176-R180 IonicContact OE1-NH1 2.84Å; E176-R180 IonicContact OE1-NH2 2.69Å; E176-R180 PolarHBondContact OE1-NH2 2.78Å; E176-R180 IonicContact OE2-CZ 3.66Å; E176-R180 IonicContact OE2-NH1 3.8Å; E176-R180 PolarHBondContact OE2-NH1 3.31Å; E176-R180 IonicContact OE2-NH2 3.86Å; E176-R180 PolarHBondContact OE2-NH2 3.04Å
177	T	92.4	Very high	89.9	Confident	50 Å²	50	33.4 Å²	33.4	31%	0.307	18%	0.175	S	C	.	.	H	α-helix	trans	-67.5	-41.8	172.6	-56.4	0	0	0	0	111.2	H174 L179 R180 L181	H174-T177 WeakPolarHBondContact O-CB 3.43Å; H174-T177 PolarHBondContact O-N 2.9Å; T177-L179 VanDerWaalsContact C-N 3.31Å; T177-L179 PolarHBondContact O-N 3.31Å; T177-R180 PolarHBondContact O-N 2.89Å; T177-R180 VanDerWaalsContact O-N 3.15Å; T177-L181 HydrophobicContact CG2-CD1 4.24Å; T177-L181 HydrophobicContact CG2-CG 4.49Å; T177-L181 WeakPolarHBondContact O-CG 3.46Å; T177-L181 PolarHBondContact O-N 3.46Å
178	T	93.3	Very high	89.8	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-55.7	-46.4	171.5	-56.2	0	0	0	0	111	L166 C169 V170 H174 V175 R180 L181 L182 L220	L166-T178 HydrophobicContact CD1-CG2 3.79Å; C169-T178 PolarHBondContact SG-OG1 2.95Å; C169-T178 VanDerWaalsContact SG-OG1 3.42Å; V170-T178 HydrophobicContact CG1-CG2 4.19Å; H174-T178 PolarHBondContact O-N 3.27Å; H174-T178 PolarHBondContact O-OG1 2.9Å; V175-T178 WeakPolarHBondContact O-CB 3.37Å; V175-T178 PolarHBondContact O-N 3.25Å; T178-R180 PolarHBondContact O-N 3.26Å; T178-L181 PolarHBondContact O-N 2.87Å; T178-L182 HydrophobicContact CG2-CD1 4.21Å; T178-L182 VanDerWaalsContact O-CG 3.31Å; T178-L182 WeakPolarHBondContact O-CG 3.38Å; T178-L182 PolarHBondContact O-N 2.81Å; T178-L182 VanDerWaalsContact O-N 3.1Å; T178-L220 HydrophobicContact CG2-CD2 3.88Å
179	L	93.6	Very high	89.5	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-61.2	-44.4	175.2	179.5	64.5	0	0	0	112	L72 V80 W81 V175 E176 T177 L181 L182 V183 L220 Y224	L72-L179 HydrophobicContact CD1-CD2 4.46Å; L72-L179 HydrophobicContact CD2-CB 4.1Å; L72-L179 HydrophobicContact CD2-CD2 3.88Å; V80-L179 HydrophobicContact CG2-CD2 4.41Å; W81-L179 HydrophobicContact CH2-CD1 4.47Å; W81-L179 HydrophobicContact CZ2-CD1 4.01Å; W81-L179 HydrophobicContact CZ2-CD2 4.18Å; W81-L179 HydrophobicContact CZ2-CG 4.36Å; V175-L179 PolarHBondContact O-N 3.48Å; E176-L179 PolarHBondContact O-N 3.13Å; T177-L179 VanDerWaalsContact C-N 3.31Å; T177-L179 PolarHBondContact O-N 3.31Å; L179-L181 VanDerWaalsContact C-N 3.34Å; L179-L181 PolarHBondContact O-N 2.93Å; L179-L182 PolarHBondContact O-N 3.06Å; L179-V183 HydrophobicContact CD1-CG2 4.33Å; L179-V183 HydrophobicContact CG-CG2 4.49Å; L179-V183 VanDerWaalsContact O-CG2 3.29Å; L179-V183 WeakPolarHBondContact O-CG2 3.41Å; L179-V183 PolarHBondContact O-N 2.59Å; L179-L220 HydrophobicContact CB-CD2 4.15Å; L179-L220 HydrophobicContact CD1-CD1 4Å; L179-Y224 HydrophobicContact CD1-CE2 4.13Å; L179-Y224 WeakPolarHBondContact CD1-OH 3.34Å
180	R	92.8	Very high	89	Confident	59 Å²	59	32.2 Å²	32.2	22%	0.223	18%	0.178	C	C	.	.	H	α-helix	trans	-59.7	-42.3	178.2	-176.9	-179.4	-73.5	105.5	5.1	112	V80 E176 T177 T178 V183 L184	V80-R180 HydrophobicContact CG1-CB 4.37Å; V80-R180 HydrophobicContact CG2-CB 4.36Å; E176-R180 VanDerWaalsContact CD-NH2 3.26Å; E176-R180 WeakPolarHBondContact O-CB 3.31Å; E176-R180 PolarHBondContact O-N 3.41Å; E176-R180 IonicContact OE1-CZ 2.76Å; E176-R180 IonicContact OE1-NH1 2.84Å; E176-R180 IonicContact OE1-NH2 2.69Å; E176-R180 PolarHBondContact OE1-NH2 2.78Å; E176-R180 IonicContact OE2-CZ 3.66Å; E176-R180 IonicContact OE2-NH1 3.8Å; E176-R180 PolarHBondContact OE2-NH1 3.31Å; E176-R180 IonicContact OE2-NH2 3.86Å; E176-R180 PolarHBondContact OE2-NH2 3.04Å; T177-R180 PolarHBondContact O-N 2.89Å; T177-R180 VanDerWaalsContact O-N 3.15Å; T178-R180 PolarHBondContact O-N 3.26Å; R180-V183 PolarHBondContact O-N 3.4Å; R180-L184 HydrophobicContact CG-CD1 4.31Å; R180-L184 WeakPolarHBondContact O-CG 3.48Å; R180-L184 PolarHBondContact O-N 3.13Å
181	L	92.2	Very high	88.8	Confident	12 Å²	12	33.2 Å²	33.2	6%	0.063	18%	0.182	C	C	.	.	H	α-helix	trans	-64.5	-44.8	177.2	-66.8	169	0	0	0	111.6	L162 Q165 L166 C169 T177 T178 L179 V183 L184 G185 A186	L162-L181 HydrophobicContact CD1-CD2 3.49Å; L162-L181 VanDerWaalsContact CD1-CD2 3.49Å; L162-L181 HydrophobicContact CG-CD2 4.31Å; Q165-L181 HydrophobicContact CB-CD1 4.37Å; Q165-L181 HydrophobicContact CB-CD2 4.09Å; L166-L181 HydrophobicContact CB-CD1 4.4Å; L166-L181 HydrophobicContact CD1-CB 4.21Å; L166-L181 HydrophobicContact CD1-CD1 4.44Å; C169-L181 HydrophobicContact CB-CD1 3.63Å; T177-L181 HydrophobicContact CG2-CD1 4.24Å; T177-L181 HydrophobicContact CG2-CG 4.49Å; T177-L181 WeakPolarHBondContact O-CG 3.46Å; T177-L181 PolarHBondContact O-N 3.46Å; T178-L181 PolarHBondContact O-N 2.87Å; L179-L181 VanDerWaalsContact C-N 3.34Å; L179-L181 PolarHBondContact O-N 2.93Å; L181-V183 VanDerWaalsContact C-N 3.32Å; L181-V183 PolarHBondContact O-N 3.33Å; L181-L184 PolarHBondContact O-N 3.09Å; L181-L184 VanDerWaalsContact O-N 3.16Å; L181-G185 PolarHBondContact O-N 2.87Å; L181-A186 HydrophobicContact CB-CB 4.38Å; L181-A186 VanDerWaalsContact O-CB 3.3Å; L181-A186 WeakPolarHBondContact O-CB 3.25Å; L181-A186 PolarHBondContact O-N 2.78Å; L181-A186 VanDerWaalsContact O-N 3.09Å
182	L	91.2	Very high	88.8	Confident	8 Å²	8	31.8 Å²	31.8	4%	0.042	18%	0.182	C	C	.	.	H	α-helix	trans	-60.1	-39.9	174.3	-66.8	167.1	0	0	0	111.9	L166 T178 L179 L184 G185 P188 L220 Y224	L166-L182 HydrophobicContact CD1-CD2 4.35Å; L166-L182 HydrophobicContact CD1-CG 4.29Å; L166-L182 HydrophobicContact CD2-CD2 3.88Å; T178-L182 HydrophobicContact CG2-CD1 4.21Å; T178-L182 VanDerWaalsContact O-CG 3.31Å; T178-L182 WeakPolarHBondContact O-CG 3.38Å; T178-L182 PolarHBondContact O-N 2.81Å; T178-L182 VanDerWaalsContact O-N 3.1Å; L179-L182 PolarHBondContact O-N 3.06Å; L182-L184 VanDerWaalsContact C-N 3.35Å; L182-L184 PolarHBondContact O-N 3.44Å; L182-G185 WeakPolarHBondContact O-CA 3.46Å; L182-G185 PolarHBondContact O-N 3.32Å; L182-P188 HydrophobicContact CD2-CB 4.21Å; L182-P188 HydrophobicContact CD2-CG 3.86Å; L182-L220 HydrophobicContact CD1-CD1 4.11Å; L182-L220 HydrophobicContact CD1-CD2 4.15Å; L182-L220 HydrophobicContact CD1-CG 3.74Å; L182-Y224 HydrophobicContact CB-CD1 3.72Å; L182-Y224 HydrophobicContact CB-CE1 3.88Å; L182-Y224 HydrophobicContact CB-CG 4.17Å; L182-Y224 HydrophobicContact CD1-CD1 4.32Å; L182-Y224 HydrophobicContact CD1-CD2 3.99Å; L182-Y224 HydrophobicContact CD1-CE2 4.48Å; L182-Y224 HydrophobicContact CD1-CG 3.9Å; L182-Y224 HydrophobicContact CD2-CD1 4.37Å; L182-Y224 HydrophobicContact CD2-CG 4.27Å; L182-Y224 HydrophobicContact CG-CD1 4.35Å; L182-Y224 HydrophobicContact CG-CG 4.34Å
183	V	89.5	Confident	88.9	Confident	18 Å²	18	30.6 Å²	30.6	11%	0.109	17%	0.173	C	C	.	.	H	α-helix	trans	-67.8	-31.2	175.5	172.9	0	0	0	0	113.2	V80 W81 L179 R180 L181 G185	V80-V183 HydrophobicContact CG1-CB 4.11Å; V80-V183 HydrophobicContact CG1-CG1 4.19Å; V80-V183 HydrophobicContact CG1-CG2 3.98Å; W81-V183 HydrophobicContact CE3-CG2 4.43Å; W81-V183 HydrophobicContact CH2-CB 4.47Å; W81-V183 HydrophobicContact CH2-CG2 3.13Å; W81-V183 HydrophobicContact CZ2-CG2 3.95Å; W81-V183 HydrophobicContact CZ3-CB 4.44Å; W81-V183 HydrophobicContact CZ3-CG1 4.04Å; W81-V183 HydrophobicContact CZ3-CG2 3.45Å; W81-V183 VanDerWaalsContact CZ3-CG2 3.45Å; L179-V183 HydrophobicContact CD1-CG2 4.33Å; L179-V183 HydrophobicContact CG-CG2 4.49Å; L179-V183 VanDerWaalsContact O-CG2 3.29Å; L179-V183 WeakPolarHBondContact O-CG2 3.41Å; L179-V183 PolarHBondContact O-N 2.59Å; R180-V183 PolarHBondContact O-N 3.4Å; L181-V183 VanDerWaalsContact C-N 3.32Å; L181-V183 PolarHBondContact O-N 3.33Å; V183-G185 PolarHBondContact O-N 2.87Å
184	L	87.8	Confident	89	Confident	29 Å²	29	31.5 Å²	31.5	15%	0.152	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-0.9	171.7	-70	169.4	0	0	0	113.1	L145 R147 L162 R180 L181 L182	L145-L184 HydrophobicContact CG-CD2 4.39Å; R147-L184 HydrophobicContact CG-CD2 4.35Å; R147-L184 PolarHBondContact NE-O 2.86Å; R147-L184 VanDerWaalsContact NE-O 3.09Å; R147-L184 PolarHBondContact NH2-O 2.9Å; L162-L184 HydrophobicContact CD1-CB 4.15Å; L162-L184 HydrophobicContact CD1-CD1 4.28Å; L162-L184 HydrophobicContact CD2-CB 3.69Å; L162-L184 WeakPolarHBondContact CD2-O 3.44Å; R180-L184 HydrophobicContact CG-CD1 4.31Å; R180-L184 WeakPolarHBondContact O-CG 3.48Å; R180-L184 PolarHBondContact O-N 3.13Å; L181-L184 PolarHBondContact O-N 3.09Å; L181-L184 VanDerWaalsContact O-N 3.16Å; L182-L184 VanDerWaalsContact C-N 3.35Å; L182-L184 PolarHBondContact O-N 3.44Å
185	G	84.3	Confident	88.9	Confident	8 Å²	8	34.7 Å²	34.7	8%	0.082	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	97.1	22.2	173.4	0	0	0	0	0	114.9	L159 L181 L182 V183	L159-G185 WeakPolarHBondContact CD1-O 3.35Å; L181-G185 PolarHBondContact O-N 2.87Å; L182-G185 WeakPolarHBondContact O-CA 3.46Å; L182-G185 PolarHBondContact O-N 3.32Å; V183-G185 PolarHBondContact O-N 2.87Å
186	A	89	Confident	88.8	Confident	3 Å²	3	36.9 Å²	36.9	3%	0.025	21%	0.214	C	C	.	.			trans	-64.5	135.1	170.9	0	0	0	0	0	110.1	L162 N163 L166 L181 P188	L162-A186 HydrophobicContact CD2-CB 3.87Å; L162-A186 HydrophobicContact CG-CB 3.97Å; N163-A186 WeakPolarHBondContact OD1-CA 3.46Å; L166-A186 HydrophobicContact CB-CB 4.11Å; L166-A186 HydrophobicContact CD2-CB 3.81Å; L166-A186 HydrophobicContact CG-CB 4.45Å; L181-A186 HydrophobicContact CB-CB 4.38Å; L181-A186 VanDerWaalsContact O-CB 3.3Å; L181-A186 WeakPolarHBondContact O-CB 3.25Å; L181-A186 PolarHBondContact O-N 2.78Å; L181-A186 VanDerWaalsContact O-N 3.09Å; A186-P188 WeakPolarHBondContact O-CD 3.5Å
187	D	86.5	Confident	88.7	Confident	38 Å²	38	35.4 Å²	35.4	20%	0.203	21%	0.208	C	C	.	.			trans	-104.7	106.3	-177.7	-176.5	-11.2	0	0	0	110	N163 G189 G190 F191 N584	N163-D187 PolarHBondContact OD1-N 3.09Å; D187-G189 VanDerWaalsContact C-N 3.31Å; D187-G189 PolarHBondContact O-N 2.88Å; D187-G189 PolarHBondContact OD1-N 3.37Å; D187-G190 VanDerWaalsContact CG-N 3.28Å; D187-G190 PolarHBondContact OD1-N 3.32Å; D187-F191 WeakPolarHBondContact O-CB 3.48Å; D187-F191 PolarHBondContact O-N 3.15Å; D187-N584 HydrophobicContact CB-CB 4.47Å
188	P	88.8	Confident	88.7	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-9.4	-177.9	36.1	-37.6	0	0	0	113.8	L166 L182 A186 P200 L221 Y224 A226	L166-P188 HydrophobicContact CD2-CB 4.04Å; L182-P188 HydrophobicContact CD2-CB 4.21Å; L182-P188 HydrophobicContact CD2-CG 3.86Å; A186-P188 WeakPolarHBondContact O-CD 3.5Å; P188-P200 WeakPolarHBondContact O-CD 3.47Å; P188-L221 HydrophobicContact CB-CD2 3.65Å; P188-Y224 WeakPolarHBondContact CG-O 3.42Å; P188-A226 HydrophobicContact CB-CB 4.07Å; P188-A226 HydrophobicContact CG-CB 4.29Å
189	G	84.2	Confident	88.7	Confident	19 Å²	19	33.3 Å²	33.3	20%	0.196	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-35.7	175.8	0	0	0	0	0	112.7	D187	D187-G189 VanDerWaalsContact C-N 3.31Å; D187-G189 PolarHBondContact O-N 2.88Å; D187-G189 PolarHBondContact OD1-N 3.37Å
190	G	81.5	Confident	88.6	Confident	50 Å²	50	33.3 Å²	33.3	52%	0.515	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-25.3	177.5	0	0	0	0	0	114.7	D187 I192	D187-G190 VanDerWaalsContact CG-N 3.28Å; D187-G190 PolarHBondContact OD1-N 3.32Å; G190-I192 PolarHBondContact O-N 2.9Å
191	F	87.1	Confident	88.6	Confident	20 Å²	20	30.5 Å²	30.5	9%	0.088	19%	0.185	C	C	.	.			trans	-79.5	116.3	177.2	-178.4	-97.9	0	0	0	112.2	N163 R164 N167 D187 D193 T199 P200	N163-F191 HydrophobicContact CB-CB 3.9Å; N163-F191 HydrophobicContact CB-CD2 3.44Å; N163-F191 VanDerWaalsContact CB-CD2 3.44Å; N163-F191 HydrophobicContact CB-CE2 4.17Å; N163-F191 HydrophobicContact CB-CG 3.77Å; R164-F191 HydrophobicContact CG-CE2 4.26Å; R164-F191 HydrophobicContact CG-CZ 4.45Å; N167-F191 HydrophobicContact CB-CD1 4.24Å; N167-F191 HydrophobicContact CB-CE1 3.69Å; N167-F191 HydrophobicContact CB-CZ 4.38Å; D187-F191 WeakPolarHBondContact O-CB 3.48Å; D187-F191 PolarHBondContact O-N 3.15Å; F191-D193 HydrophobicContact CE1-CB 4.39Å; F191-T199 WeakPolarHBondContact O-CG2 3.32Å; F191-P200 HydrophobicContact CD1-CG 4.05Å
192	I	89.5	Confident	88.7	Confident	74 Å²	74	30 Å²	30	38%	0.379	18%	0.182	S	C	.	.			trans	-114.7	125.8	172.6	-62.2	175.7	0	0	0	107.3	G190 P194 T199 F233	G190-I192 PolarHBondContact O-N 2.9Å; I192-P194 WeakPolarHBondContact O-CD 3.39Å; I192-T199 HydrophobicContact CG1-CG2 4.12Å; I192-F233 HydrophobicContact CG2-CE1 4.37Å; I192-F233 HydrophobicContact CG2-CZ 4.23Å
193	D	88.5	Confident	88.7	Confident	29 Å²	29	29.8 Å²	29.8	16%	0.155	18%	0.181	C	C	.	.			trans	-63.6	122.9	175.7	-177.4	85.3	0	0	0	110.8	F191 E195 S196 G197 A198	F191-D193 HydrophobicContact CE1-CB 4.39Å; D193-E195 PolarHBondContact O-N 3.13Å; D193-E195 PolarHBondContact OD2-N 3.48Å; D193-S196 WeakPolarHBondContact CB-OG 3.46Å; D193-S196 PolarHBondContact OD2-N 3.41Å; D193-S196 PolarHBondContact OD2-OG 3.34Å; D193-G197 VanDerWaalsContact O-CA 3.31Å; D193-G197 WeakPolarHBondContact O-CA 3.48Å; D193-G197 PolarHBondContact O-N 2.68Å; D193-A198 HydrophobicContact CB-CB 4.44Å; D193-A198 WeakPolarHBondContact CB-O 3.41Å; D193-A198 PolarHBondContact N-O 2.99Å
194	P	87.8	Confident	88.9	Confident	95 Å²	95	29 Å²	29	62%	0.617	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-20.2	-172.2	-25.5	35.4	0	0	0	115.7	I192	I192-P194 WeakPolarHBondContact O-CD 3.39Å
195	E	85.7	Confident	89.1	Confident	183 Å²	183	27.6 Å²	27.6	86%	0.855	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-41.1	-176.9	-63.6	178.2	-174	0	0	111.4	D193	D193-E195 PolarHBondContact O-N 3.13Å; D193-E195 PolarHBondContact OD2-N 3.48Å
196	S	88.1	Confident	89.4	Confident	47 Å²	47	32.1 Å²	32.1	33%	0.329	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.9	-15.3	-172.5	58.3	0	0	0	0	115.1	D193 A198 F233	D193-S196 WeakPolarHBondContact CB-OG 3.46Å; D193-S196 PolarHBondContact OD2-N 3.41Å; D193-S196 PolarHBondContact OD2-OG 3.34Å; S196-A198 PolarHBondContact O-N 3.39Å; S196-A198 WeakPolarHBondContact OG-CB 3.3Å; S196-A198 PolarHBondContact OG-N 2.75Å; S196-F233 VanDerWaalsContact C-CD2 3.46Å; S196-F233 PolarHBondContact O-N 2.94Å
197	G	89.7	Confident	89.2	Confident	2 Å²	2	34.8 Å²	34.8	2%	0.021	20%	0.195	C	C	.	.			trans	72.9	0.2	-169.2	0	0	0	0	0	113.7	D193	D193-G197 VanDerWaalsContact O-CA 3.31Å; D193-G197 WeakPolarHBondContact O-CA 3.48Å; D193-G197 PolarHBondContact O-N 2.68Å
198	A	91.7	Very high	88.6	Confident	5 Å²	5	33 Å²	33	4%	0.041	19%	0.186	C	C	.	.			trans	-72	130.1	-176.5	0	0	0	0	0	111.7	D193 S196 H202 V203	D193-A198 HydrophobicContact CB-CB 4.44Å; D193-A198 WeakPolarHBondContact CB-O 3.41Å; D193-A198 PolarHBondContact N-O 2.99Å; S196-A198 PolarHBondContact O-N 3.39Å; S196-A198 WeakPolarHBondContact OG-CB 3.3Å; S196-A198 PolarHBondContact OG-N 2.75Å; A198-H202 HydrophobicContact CB-CB 4Å; A198-V203 HydrophobicContact CB-CG2 4.48Å
199	T	92.6	Very high	87.2	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.006	23%	0.225	C	C	.	.			trans	-86.9	166.8	168.2	65.7	0	0	0	0	110.9	F191 I192 I201 H202 V203	F191-T199 WeakPolarHBondContact O-CG2 3.32Å; I192-T199 HydrophobicContact CG1-CG2 4.12Å; T199-I201 PolarHBondContact O-N 3.06Å; T199-I201 VanDerWaalsContact OG1-CG2 3.23Å; T199-I201 WeakPolarHBondContact OG1-CG2 3.49Å; T199-H202 PolarHBondContact N-ND1 3.35Å; T199-H202 WeakPolarHBondContact O-CB 3.11Å; T199-H202 PolarHBondContact O-N 3.45Å; T199-H202 PolarHBondContact OG1-ND1 2.87Å; T199-V203 PolarHBondContact O-N 3.02Å
200	P	92.8	Very high	86.3	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-58.7	-23.2	-178.6	-27.4	37.5	0	0	0	114.7	L166 V170 P188 F191 A204 L221	L166-P200 HydrophobicContact CD2-CG 4.34Å; V170-P200 HydrophobicContact CG1-CB 4.4Å; V170-P200 HydrophobicContact CG2-CB 4.27Å; P188-P200 WeakPolarHBondContact O-CD 3.47Å; F191-P200 HydrophobicContact CD1-CG 4.05Å; P200-A204 WeakPolarHBondContact O-CB 3.35Å; P200-A204 PolarHBondContact O-N 3.29Å; P200-L221 HydrophobicContact CB-CD1 4.31Å; P200-L221 HydrophobicContact CB-CD2 4.14Å
201	I	92.7	Very high	85.5	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-74.5	-34.3	174.8	-172.7	162.1	0	0	0	112.5	T199 A204 A205 V218 L221 A226 P228 L254	T199-I201 PolarHBondContact O-N 3.06Å; T199-I201 VanDerWaalsContact OG1-CG2 3.23Å; T199-I201 WeakPolarHBondContact OG1-CG2 3.49Å; I201-A204 PolarHBondContact O-N 3.03Å; I201-A205 WeakPolarHBondContact O-CB 3.44Å; I201-A205 PolarHBondContact O-N 3.36Å; I201-V218 HydrophobicContact CD1-CG1 4.26Å; I201-V218 HydrophobicContact CG1-CG2 4.46Å; I201-L221 HydrophobicContact CB-CD1 4.38Å; I201-A226 HydrophobicContact CB-CB 4.06Å; I201-A226 HydrophobicContact CD1-CB 4.22Å; I201-A226 HydrophobicContact CG2-CB 4.08Å; I201-P228 HydrophobicContact CD1-CB 3.97Å; I201-L254 HydrophobicContact CD1-CD2 4.01Å; I201-L254 HydrophobicContact CG1-CD2 4.08Å
202	H	93.4	Very high	84.6	Confident	2 Å²	2	49.1 Å²	49.1	1%	0.009	25%	0.251	C	S	.	.	H	α-helix	trans	-61.9	-45.2	170.9	-68.4	87.2	0	0	0	111.1	A198 T199 A205 R206 Q230 N236 S238 L241	A198-H202 HydrophobicContact CB-CB 4Å; T199-H202 PolarHBondContact N-ND1 3.35Å; T199-H202 WeakPolarHBondContact O-CB 3.11Å; T199-H202 PolarHBondContact O-N 3.45Å; T199-H202 PolarHBondContact OG1-ND1 2.87Å; H202-A205 WeakPolarHBondContact O-CB 3.48Å; H202-A205 PolarHBondContact O-N 3.3Å; H202-R206 PolarHBondContact O-N 3.45Å; H202-Q230 PolarHBondContact CE1-O 3.35Å; H202-Q230 PolarHBondContact NE2-O 2.8Å; H202-N236 PolarHBondContact NE2-O 3.31Å; H202-S238 PolarHBondContact N-OG 2.73Å; H202-L241 HydrophobicContact CB-CD1 3.69Å
203	V	92.3	Very high	84	Confident	2 Å²	2	48.3 Å²	48.3	1%	0.012	24%	0.244	C	C	.	.	H	α-helix	trans	-63.3	-46.2	175.9	179.6	0	0	0	0	110.5	N167 V170 R171 A198 T199 A205 R206 E207	N167-V203 WeakPolarHBondContact OD1-CG2 3.37Å; V170-V203 HydrophobicContact CG2-CB 4.09Å; V170-V203 HydrophobicContact CG2-CG1 3.88Å; R171-V203 HydrophobicContact CG-CG1 3.46Å; R171-V203 VanDerWaalsContact CG-CG1 3.46Å; A198-V203 HydrophobicContact CB-CG2 4.48Å; T199-V203 PolarHBondContact O-N 3.02Å; V203-A205 PolarHBondContact O-N 2.88Å; V203-R206 PolarHBondContact O-N 3.29Å; V203-E207 HydrophobicContact CG1-CG 4.04Å; V203-E207 VanDerWaalsContact O-CG 3.3Å; V203-E207 WeakPolarHBondContact O-CG 3.49Å; V203-E207 PolarHBondContact O-N 3Å; V203-E207 VanDerWaalsContact O-N 3.11Å
204	A	92.3	Very high	83.7	Confident	1 Å²	1	47 Å²	47	1%	0.008	24%	0.238	C	C	.	.	H	α-helix	trans	-62	-29.7	176.6	0	0	0	0	0	113.7	P200 I201 K217 V218 L221	P200-A204 WeakPolarHBondContact O-CB 3.35Å; P200-A204 PolarHBondContact O-N 3.29Å; I201-A204 PolarHBondContact O-N 3.03Å; A204-K217 HydrophobicContact CB-CB 4.19Å; A204-V218 HydrophobicContact CB-CG2 3.82Å; A204-L221 HydrophobicContact CB-CD1 3.84Å
205	A	92.7	Very high	83.7	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-72.2	-41.8	175.6	0	0	0	0	0	113	I201 H202 V203 S238 A242 H247 L254	I201-A205 WeakPolarHBondContact O-CB 3.44Å; I201-A205 PolarHBondContact O-N 3.36Å; H202-A205 WeakPolarHBondContact O-CB 3.48Å; H202-A205 PolarHBondContact O-N 3.3Å; V203-A205 PolarHBondContact O-N 2.88Å; A205-S238 VanDerWaalsContact CB-O 3.25Å; A205-S238 WeakPolarHBondContact CB-O 3.3Å; A205-A242 HydrophobicContact CB-CB 4.22Å; A205-H247 PolarHBondContact O-CD2 3.5Å; A205-L254 HydrophobicContact CB-CD1 3.71Å
206	R	90.5	Very high	83.8	Confident	104 Å²	104	35 Å²	35	39%	0.392	18%	0.176	S	C	.	.	H	α-helix	trans	-71.5	-45.9	-179.5	-170.3	-179	67.1	-156.8	-1.5	113.2	H202 V203 G208 H247	H202-R206 PolarHBondContact O-N 3.45Å; V203-R206 PolarHBondContact O-N 3.29Å; R206-G208 PolarHBondContact O-N 3.06Å; R206-H247 PolarHBondContact O-NE2 2.73Å
207	E	85.2	Confident	83.9	Confident	59 Å²	59	33 Å²	33	28%	0.276	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	22.7	-173.9	-53	-58.9	149.8	0	0	114.1	R171 V203 Q209	R171-E207 HydrophobicContact CB-CG 4.4Å; R171-E207 HydrophobicContact CG-CG 4.09Å; V203-E207 HydrophobicContact CG1-CG 4.04Å; V203-E207 VanDerWaalsContact O-CG 3.3Å; V203-E207 WeakPolarHBondContact O-CG 3.49Å; V203-E207 PolarHBondContact O-N 3Å; V203-E207 VanDerWaalsContact O-N 3.11Å; E207-Q209 PolarHBondContact O-N 3.38Å
208	G	72.9	Confident	84.1	Confident	0 Å²	0	33 Å²	33	0%	0	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	9.5	-164.2	0	0	0	0	0	118.9	R206 A210 L211 H247	R206-G208 PolarHBondContact O-N 3.06Å; G208-A210 PolarHBondContact O-N 3.49Å; G208-L211 PolarHBondContact O-N 3.35Å; G208-H247 WeakPolarHBondContact CA-NE2 3.49Å; G208-H247 PolarHBondContact N-NE2 3.1Å; G208-H247 VanDerWaalsContact N-NE2 3.2Å
209	Q	59.1	Low	84.2	Confident	177 Å²	177	32.8 Å²	32.8	83%	0.827	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.6	-24.7	-175	-59.4	-174.3	0.6	0	0	115.1	E207	E207-Q209 PolarHBondContact O-N 3.38Å
210	A	66.5	Low	84.2	Confident	33 Å²	33	32.7 Å²	32.7	27%	0.273	16%	0.159	S	C	.	.	S	Bend	trans	-118.4	78.5	174.1	0	0	0	0	0	110.9	G208 Q212 F213 S214	G208-A210 PolarHBondContact O-N 3.49Å; A210-Q212 PolarHBondContact O-N 2.9Å; A210-F213 HydrophobicContact CB-CD2 3.98Å; A210-F213 PolarHBondContact O-N 2.84Å; A210-S214 PolarHBondContact O-N 2.84Å; A210-S214 PolarHBondContact O-OG 3.28Å
211	L	63.8	Low	84.2	Confident	85 Å²	85	32.7 Å²	32.7	45%	0.445	16%	0.159	S	C	.	.	H	α-helix	trans	-39.9	-40	-171.4	-72.2	170	0	0	0	116.2	G208 S214 C215	G208-L211 PolarHBondContact O-N 3.35Å; L211-S214 VanDerWaalsContact CA-OG 3.31Å; L211-S214 WeakPolarHBondContact CA-OG 3.5Å; L211-S214 PolarHBondContact O-OG 3.03Å; L211-C215 VanDerWaalsContact O-CB 3.27Å; L211-C215 WeakPolarHBondContact O-CB 3.4Å; L211-C215 PolarHBondContact O-N 3.47Å; L211-C215 VanDerWaalsContact O-N 3.14Å; L211-C215 PolarHBondContact O-SG 3.19Å
212	Q	69.2	Low	84.2	Confident	132 Å²	132	32.9 Å²	32.9	62%	0.617	16%	0.16	S	C	*	.	H	α-helix	trans	-68.4	-41.9	178.9	-67.5	-178.1	-2.9	0	0	112.2	A210 A216	A210-Q212 PolarHBondContact O-N 2.9Å; Q212-A216 VanDerWaalsContact O-CB 3.29Å; Q212-A216 WeakPolarHBondContact O-CB 3.35Å; Q212-A216 PolarHBondContact O-N 3.28Å; Q212-A216 VanDerWaalsContact O-N 3.12Å
213	F	76.2	Confident	84.2	Confident	57 Å²	57	33 Å²	33	25%	0.25	16%	0.16	C	C	.	.	H	α-helix	trans	-79	-34.2	-179.9	-62.5	-69.1	0	0	0	112.3	T71 N173 V175 A210 A216 K217	T71-F213 HydrophobicContact CG2-CD1 4.11Å; T71-F213 HydrophobicContact CG2-CE1 3.98Å; N173-F213 HydrophobicContact CB-CB 4.46Å; N173-F213 HydrophobicContact CB-CD1 4.43Å; N173-F213 HydrophobicContact CB-CD2 4.02Å; N173-F213 HydrophobicContact CB-CE2 4.37Å; N173-F213 HydrophobicContact CB-CG 4.06Å; V175-F213 HydrophobicContact CG2-CD1 3.81Å; A210-F213 HydrophobicContact CB-CD2 3.98Å; A210-F213 PolarHBondContact O-N 2.84Å; F213-A216 PolarHBondContact O-N 2.92Å; F213-K217 WeakPolarHBondContact O-CD 3.49Å; F213-K217 WeakPolarHBondContact O-CG 3.44Å; F213-K217 PolarHBondContact O-N 3.37Å
214	S	81.7	Confident	84.1	Confident	3 Å²	3	33.4 Å²	33.4	2%	0.021	16%	0.162	C	C	.	.	H	α-helix	trans	-66.8	-48.1	174.6	52.8	0	0	0	0	111.8	A210 L211 A216 K217 V218	A210-S214 PolarHBondContact O-N 2.84Å; A210-S214 PolarHBondContact O-OG 3.28Å; L211-S214 VanDerWaalsContact CA-OG 3.31Å; L211-S214 WeakPolarHBondContact CA-OG 3.5Å; L211-S214 PolarHBondContact O-OG 3.03Å; S214-A216 VanDerWaalsContact C-N 3.32Å; S214-A216 PolarHBondContact O-N 3.05Å; S214-K217 PolarHBondContact O-N 3.24Å; S214-V218 PolarHBondContact O-N 2.84Å
215	C	87.4	Confident	83.8	Confident	25 Å²	25	33.8 Å²	33.8	17%	0.169	17%	0.166	C	C	.	.	H	α-helix	trans	-55.2	-45.9	170.9	-74.8	0	0	0	0	112	L211 K217 V218 E219 L250	L211-C215 VanDerWaalsContact O-CB 3.27Å; L211-C215 WeakPolarHBondContact O-CB 3.4Å; L211-C215 PolarHBondContact O-N 3.47Å; L211-C215 VanDerWaalsContact O-N 3.14Å; L211-C215 PolarHBondContact O-SG 3.19Å; C215-K217 PolarHBondContact O-N 2.9Å; C215-V218 PolarHBondContact O-N 2.88Å; C215-E219 WeakPolarHBondContact O-CG 3.27Å; C215-E219 PolarHBondContact O-N 2.81Å; C215-L250 HydrophobicContact CB-CD1 4.5Å
216	A	89.1	Confident	83.7	Confident	1 Å²	1	33.9 Å²	33.9	1%	0.008	17%	0.166	C	C	.	.	H	α-helix	trans	-61.8	-42.5	178.3	0	0	0	0	0	112.5	L68 V175 Q212 F213 S214 L220	L68-A216 HydrophobicContact CD1-CB 3.93Å; L68-A216 WeakPolarHBondContact CD1-O 3.36Å; V175-A216 HydrophobicContact CG1-CB 4.42Å; V175-A216 HydrophobicContact CG2-CB 4.35Å; Q212-A216 VanDerWaalsContact O-CB 3.29Å; Q212-A216 WeakPolarHBondContact O-CB 3.35Å; Q212-A216 PolarHBondContact O-N 3.28Å; Q212-A216 VanDerWaalsContact O-N 3.12Å; F213-A216 PolarHBondContact O-N 2.92Å; S214-A216 VanDerWaalsContact C-N 3.32Å; S214-A216 PolarHBondContact O-N 3.05Å; A216-L220 VanDerWaalsContact O-CB 3.23Å; A216-L220 WeakPolarHBondContact O-CB 3.47Å; A216-L220 PolarHBondContact O-N 3.36Å
217	K	91	Very high	83.7	Confident	4 Å²	4	29.9 Å²	29.9	2%	0.017	15%	0.153	C	C	.	.	H	α-helix	trans	-63.4	-46.7	175.4	-68	159.7	-169.3	177.2	0	111.8	V170 T172 A204 F213 S214 C215 E219 L220 L221	V170-K217 VanDerWaalsContact O-CD 3.29Å; V170-K217 WeakPolarHBondContact O-CD 3.41Å; V170-K217 VanDerWaalsContact O-CE 3.3Å; V170-K217 WeakPolarHBondContact O-CE 3.39Å; V170-K217 PolarHBondContact O-NZ 2.81Å; T172-K217 WeakPolarHBondContact O-CE 3.46Å; T172-K217 PolarHBondContact O-NZ 3.3Å; A204-K217 HydrophobicContact CB-CB 4.19Å; F213-K217 WeakPolarHBondContact O-CD 3.49Å; F213-K217 WeakPolarHBondContact O-CG 3.44Å; F213-K217 PolarHBondContact O-N 3.37Å; S214-K217 PolarHBondContact O-N 3.24Å; C215-K217 PolarHBondContact O-N 2.9Å; K217-E219 PolarHBondContact O-N 2.7Å; K217-L220 PolarHBondContact O-N 3.43Å; K217-L220 VanDerWaalsContact O-N 3.15Å; K217-L221 WeakPolarHBondContact O-CB 3.44Å; K217-L221 WeakPolarHBondContact O-CG 3.47Å; K217-L221 PolarHBondContact O-N 2.91Å
218	V	93.2	Very high	84	Confident	1 Å²	1	27.1 Å²	27.1	1%	0.006	14%	0.14	C	C	.	.	H	α-helix	trans	-60.3	-46.6	-179.7	164.6	0	0	0	0	110.8	I201 A204 S214 C215 L220 L221 F222 L250 L254 L257	I201-V218 HydrophobicContact CD1-CG1 4.26Å; I201-V218 HydrophobicContact CG1-CG2 4.46Å; A204-V218 HydrophobicContact CB-CG2 3.82Å; S214-V218 PolarHBondContact O-N 2.84Å; C215-V218 PolarHBondContact O-N 2.88Å; V218-L220 PolarHBondContact O-N 3.43Å; V218-L221 PolarHBondContact O-N 3.15Å; V218-F222 VanDerWaalsContact O-CB 3.3Å; V218-F222 WeakPolarHBondContact O-CB 3.28Å; V218-F222 PolarHBondContact O-N 3.04Å; V218-L250 HydrophobicContact CB-CD1 4.26Å; V218-L250 HydrophobicContact CG2-CD1 4.02Å; V218-L254 HydrophobicContact CG1-CD2 3.47Å; V218-L254 VanDerWaalsContact CG1-CD2 3.47Å; V218-L254 HydrophobicContact CG1-CG 4.1Å; V218-L254 HydrophobicContact CG2-CD2 4.42Å; V218-L257 HydrophobicContact CG1-CD1 3.63Å
219	E	92.6	Very high	84.8	Confident	1 Å²	1	27.7 Å²	27.7	1%	0.005	14%	0.144	C	C	.	.	H	α-helix	trans	-60	-43.3	172.9	-68.2	-72.8	168.4	0	0	112.1	S64 Q65 L68 C215 K217 F222 L223 R253	S64-E219 WeakPolarHBondContact CB-OE1 3.31Å; S64-E219 PolarHBondContact OG-OE1 2.79Å; Q65-E219 WeakPolarHBondContact CG-OE2 3.45Å; L68-E219 HydrophobicContact CB-CB 4.44Å; L68-E219 HydrophobicContact CD2-CB 3.66Å; C215-E219 WeakPolarHBondContact O-CG 3.27Å; C215-E219 PolarHBondContact O-N 2.81Å; K217-E219 PolarHBondContact O-N 2.7Å; E219-F222 PolarHBondContact O-N 3.26Å; E219-L223 WeakPolarHBondContact O-CB 3.5Å; E219-L223 WeakPolarHBondContact O-CD1 3.49Å; E219-L223 WeakPolarHBondContact O-CG 3.29Å; E219-L223 PolarHBondContact O-N 3.42Å; E219-R253 IonicContact OE1-CZ 3.52Å; E219-R253 VanDerWaalsContact OE1-CZ 3.3Å; E219-R253 IonicContact OE1-NE 3.6Å; E219-R253 PolarHBondContact OE1-NE 2.89Å; E219-R253 IonicContact OE1-NH2 3.13Å; E219-R253 PolarHBondContact OE1-NH2 2.8Å; E219-R253 IonicContact OE2-NH2 3.37Å; E219-R253 PolarHBondContact OE2-NH2 3.08Å
220	L	93.3	Very high	86.2	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-66	-43.3	-179.4	179.3	58.8	0	0	0	112.1	L68 L72 V175 T178 L179 L182 A216 K217 V218 L223 Y224	L68-L220 HydrophobicContact CD1-CB 4.13Å; L68-L220 HydrophobicContact CD2-CB 4.3Å; L72-L220 HydrophobicContact CD1-CD1 4.42Å; V175-L220 HydrophobicContact CG1-CD2 3.93Å; T178-L220 HydrophobicContact CG2-CD2 3.88Å; L179-L220 HydrophobicContact CB-CD2 4.15Å; L179-L220 HydrophobicContact CD1-CD1 4Å; L182-L220 HydrophobicContact CD1-CD1 4.11Å; L182-L220 HydrophobicContact CD1-CD2 4.15Å; L182-L220 HydrophobicContact CD1-CG 3.74Å; A216-L220 VanDerWaalsContact O-CB 3.23Å; A216-L220 WeakPolarHBondContact O-CB 3.47Å; A216-L220 PolarHBondContact O-N 3.36Å; K217-L220 PolarHBondContact O-N 3.43Å; K217-L220 VanDerWaalsContact O-N 3.15Å; V218-L220 PolarHBondContact O-N 3.43Å; L220-L223 PolarHBondContact O-N 3.05Å; L220-Y224 HydrophobicContact CD1-CD2 3.82Å; L220-Y224 HydrophobicContact CD1-CE2 3.63Å; L220-Y224 VanDerWaalsContact O-CD2 3.3Å; L220-Y224 WeakPolarHBondContact O-CD2 3.36Å; L220-Y224 PolarHBondContact O-N 2.94Å
221	L	93.5	Very high	87.4	Confident	0 Å²	0	23 Å²	23	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-64.5	-44.6	176.8	-67.5	166.9	0	0	0	110.6	L166 V170 P188 P200 I201 A204 K217 V218 L223 Y224 G225 A226	L166-L221 HydrophobicContact CD1-CD2 4.43Å; L166-L221 HydrophobicContact CD2-CD2 4.38Å; V170-L221 HydrophobicContact CG1-CD1 3.97Å; V170-L221 HydrophobicContact CG1-CD2 4.16Å; P188-L221 HydrophobicContact CB-CD2 3.65Å; P200-L221 HydrophobicContact CB-CD1 4.31Å; P200-L221 HydrophobicContact CB-CD2 4.14Å; I201-L221 HydrophobicContact CB-CD1 4.38Å; A204-L221 HydrophobicContact CB-CD1 3.84Å; K217-L221 WeakPolarHBondContact O-CB 3.44Å; K217-L221 WeakPolarHBondContact O-CG 3.47Å; K217-L221 PolarHBondContact O-N 2.91Å; V218-L221 PolarHBondContact O-N 3.15Å; L221-L223 PolarHBondContact O-N 3.34Å; L221-Y224 CarbonylContact O-C 3.53Å; L221-Y224 VanDerWaalsContact O-C 3.32Å; L221-Y224 PolarHBondContact O-N 3.01Å; L221-Y224 VanDerWaalsContact O-N 3.13Å; L221-G225 PolarHBondContact O-N 3.11Å; L221-G225 VanDerWaalsContact O-N 3.11Å; L221-A226 HydrophobicContact CB-CB 3.79Å; L221-A226 VanDerWaalsContact O-CB 3.3Å; L221-A226 WeakPolarHBondContact O-CB 3.5Å; L221-A226 PolarHBondContact O-N 2.99Å
222	F	92.7	Very high	88.7	Confident	4 Å²	4	19.8 Å²	19.8	2%	0.018	11%	0.106	C	C	.	.	H	α-helix	trans	-59.9	-44.1	174.8	177	-97	0	0	0	112.5	V218 E219 Y224 G225 P228 L257 E260 S589	V218-F222 VanDerWaalsContact O-CB 3.3Å; V218-F222 WeakPolarHBondContact O-CB 3.28Å; V218-F222 PolarHBondContact O-N 3.04Å; E219-F222 PolarHBondContact O-N 3.26Å; F222-Y224 PolarHBondContact O-N 2.63Å; F222-G225 PolarHBondContact O-N 3.06Å; F222-P228 HydrophobicContact CD2-CG 4.23Å; F222-P228 HydrophobicContact CE2-CG 4.35Å; F222-L257 HydrophobicContact CB-CD1 4.39Å; F222-L257 HydrophobicContact CD1-CD2 3.65Å; F222-L257 HydrophobicContact CD2-CB 4.16Å; F222-L257 HydrophobicContact CD2-CD2 4.15Å; F222-L257 HydrophobicContact CE1-CD2 3.72Å; F222-L257 HydrophobicContact CE2-CB 4.09Å; F222-L257 HydrophobicContact CE2-CD2 4.2Å; F222-L257 WeakPolarHBondContact CE2-O 3.29Å; F222-L257 HydrophobicContact CG-CD1 4.38Å; F222-L257 HydrophobicContact CG-CD2 3.87Å; F222-L257 HydrophobicContact CZ-CD2 3.99Å; F222-E260 HydrophobicContact CE1-CG 4.18Å; F222-E260 HydrophobicContact CZ-CB 4.09Å; F222-E260 HydrophobicContact CZ-CG 4.02Å; F222-S589 WeakPolarHBondContact CZ-O 3.17Å
223	L	92	Very high	89.8	Confident	4 Å²	4	20.3 Å²	20.3	2%	0.021	11%	0.106	C	C	.	.	H	α-helix	trans	-60.9	-27	176.2	-75.7	164.9	0	0	0	113	I29 N30 L68 E219 L220 L221 N587	I29-L223 HydrophobicContact CG2-CD1 3.61Å; I29-L223 HydrophobicContact CG2-CD2 4.32Å; N30-L223 HydrophobicContact CB-CB 4.46Å; L68-L223 HydrophobicContact CD2-CD1 3.54Å; E219-L223 WeakPolarHBondContact O-CB 3.5Å; E219-L223 WeakPolarHBondContact O-CD1 3.49Å; E219-L223 WeakPolarHBondContact O-CG 3.29Å; E219-L223 PolarHBondContact O-N 3.42Å; L220-L223 PolarHBondContact O-N 3.05Å; L221-L223 PolarHBondContact O-N 3.34Å; L223-N587 PolarHBondContact O-OD1 3.44Å
224	Y	90.9	Very high	90.4	Very high	11 Å²	11	25.2 Å²	25.2	4%	0.043	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	17	175.3	-76.5	-106.5	0	0	0	113	N30 L179 L182 P188 L220 L221 F222 A585	N30-Y224 HydrophobicContact CB-CE2 4.34Å; N30-Y224 VanDerWaalsContact O-CE2 3.29Å; N30-Y224 WeakPolarHBondContact O-CE2 3.4Å; N30-Y224 PolarHBondContact O-OH 3.06Å; L179-Y224 HydrophobicContact CD1-CE2 4.13Å; L179-Y224 WeakPolarHBondContact CD1-OH 3.34Å; L182-Y224 HydrophobicContact CB-CD1 3.72Å; L182-Y224 HydrophobicContact CB-CE1 3.88Å; L182-Y224 HydrophobicContact CB-CG 4.17Å; L182-Y224 HydrophobicContact CD1-CD1 4.32Å; L182-Y224 HydrophobicContact CD1-CD2 3.99Å; L182-Y224 HydrophobicContact CD1-CE2 4.48Å; L182-Y224 HydrophobicContact CD1-CG 3.9Å; L182-Y224 HydrophobicContact CD2-CD1 4.37Å; L182-Y224 HydrophobicContact CD2-CG 4.27Å; L182-Y224 HydrophobicContact CG-CD1 4.35Å; L182-Y224 HydrophobicContact CG-CG 4.34Å; P188-Y224 WeakPolarHBondContact CG-O 3.42Å; L220-Y224 HydrophobicContact CD1-CD2 3.82Å; L220-Y224 HydrophobicContact CD1-CE2 3.63Å; L220-Y224 VanDerWaalsContact O-CD2 3.3Å; L220-Y224 WeakPolarHBondContact O-CD2 3.36Å; L220-Y224 PolarHBondContact O-N 2.94Å; L221-Y224 CarbonylContact O-C 3.53Å; L221-Y224 VanDerWaalsContact O-C 3.32Å; L221-Y224 PolarHBondContact O-N 3.01Å; L221-Y224 VanDerWaalsContact O-N 3.13Å; F222-Y224 PolarHBondContact O-N 2.63Å; Y224-A585 VanDerWaalsContact O-CB 3.25Å; Y224-A585 WeakPolarHBondContact O-CB 3.2Å
225	G	86.7	Confident	90.8	Very high	9 Å²	9	27.4 Å²	27.4	9%	0.093	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	96.4	10.6	165.9	0	0	0	0	0	117	L221 F222	L221-G225 PolarHBondContact O-N 3.11Å; L221-G225 VanDerWaalsContact O-N 3.11Å; F222-G225 PolarHBondContact O-N 3.06Å
226	A	90.7	Very high	91	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.008	16%	0.157	C	C	.	.			trans	-65.8	131.6	169.1	0	0	0	0	0	110.7	P188 I201 L221 P228	P188-A226 HydrophobicContact CB-CB 4.07Å; P188-A226 HydrophobicContact CG-CB 4.29Å; I201-A226 HydrophobicContact CB-CB 4.06Å; I201-A226 HydrophobicContact CD1-CB 4.22Å; I201-A226 HydrophobicContact CG2-CB 4.08Å; L221-A226 HydrophobicContact CB-CB 3.79Å; L221-A226 VanDerWaalsContact O-CB 3.3Å; L221-A226 WeakPolarHBondContact O-CB 3.5Å; L221-A226 PolarHBondContact O-N 2.99Å; A226-P228 WeakPolarHBondContact O-CD 3.29Å
227	D	89.6	Confident	91.2	Very high	21 Å²	21	30.4 Å²	30.4	11%	0.112	17%	0.167	C	C	.	.			trans	-96.6	111.8	-177.7	-153.1	-32.4	0	0	0	110.8	A229 Q230 R588 S591	D227-A229 PolarHBondContact O-N 3.13Å; D227-A229 WeakPolarHBondContact OD1-CB 3.47Å; D227-A229 PolarHBondContact OD1-N 3.39Å; D227-Q230 HydrophobicContact CB-CB 4.34Å; D227-Q230 PolarHBondContact O-N 2.81Å; D227-R588 IonicContact OD2-CZ 3.35Å; D227-R588 IonicContact OD2-NH1 3.08Å; D227-R588 PolarHBondContact OD2-NH1 3.15Å; D227-S591 WeakPolarHBondContact OD1-CB 3.24Å; D227-S591 PolarHBondContact OD1-OG 2.81Å
228	P	92.4	Very high	91.2	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-14.4	179	29.3	-36.1	0	0	0	113	I201 F222 A226 L254 L257	I201-P228 HydrophobicContact CD1-CB 3.97Å; F222-P228 HydrophobicContact CD2-CG 4.23Å; F222-P228 HydrophobicContact CE2-CG 4.35Å; A226-P228 WeakPolarHBondContact O-CD 3.29Å; P228-L254 HydrophobicContact CB-CD2 4.06Å; P228-L257 HydrophobicContact CG-CB 3.96Å
229	A	89.6	Confident	91.2	Very high	12 Å²	12	30.3 Å²	30.3	10%	0.099	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-11.7	178.6	0	0	0	0	0	113.9	D227 V593	D227-A229 PolarHBondContact O-N 3.13Å; D227-A229 WeakPolarHBondContact OD1-CB 3.47Å; D227-A229 PolarHBondContact OD1-N 3.39Å; A229-V593 HydrophobicContact CB-CG2 3.57Å
230	Q	88.9	Confident	91.3	Very high	49 Å²	49	32.4 Å²	32.4	23%	0.229	18%	0.178	C	C	.	.			trans	-69.4	132.1	177.8	179.8	173.7	-8.1	0	0	109.6	H202 D227	H202-Q230 PolarHBondContact CE1-O 3.35Å; H202-Q230 PolarHBondContact NE2-O 2.8Å; D227-Q230 HydrophobicContact CB-CB 4.34Å; D227-Q230 PolarHBondContact O-N 2.81Å
231	P	91	Very high	91.2	Very high	64 Å²	64	33.4 Å²	33.4	42%	0.416	18%	0.183	S	C	.	.	B	Isolated β-bridge	trans	-85.8	156.9	171.1	33.9	-33.9	0	0	0	112.2	N236 I237	P231-N236 WeakPolarHBondContact CA-O 3.36Å; P231-I237 HydrophobicContact CB-CG2 4.19Å
232	D	91	Very high	91.2	Very high	17 Å²	17	33.4 Å²	33.4	9%	0.091	18%	0.183	C	C	.	.			trans	-82	-173.3	165.6	65.8	20.8	0	0	0	112.5	E234 G235 N236	D232-E234 VanDerWaalsContact C-N 3.25Å; D232-E234 PolarHBondContact O-N 2.65Å; D232-E234 WeakPolarHBondContact OD1-CA 3.45Å; D232-E234 WeakPolarHBondContact OD1-CB 3.41Å; D232-E234 PolarHBondContact OD1-N 3.31Å; D232-G235 PolarHBondContact O-N 3.27Å; D232-G235 VanDerWaalsContact O-N 3.15Å; D232-G235 PolarHBondContact OD1-N 3.33Å; D232-N236 PolarHBondContact N-O 3.28Å; D232-N236 PolarHBondContact OD1-N 3.42Å
233	F	91.6	Very high	91.2	Very high	142 Å²	142	38.6 Å²	38.6	62%	0.623	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-16.4	179.1	-65	-21.6	0	0	0	113.9	I192 S196 G235	I192-F233 HydrophobicContact CG2-CE1 4.37Å; I192-F233 HydrophobicContact CG2-CZ 4.23Å; S196-F233 VanDerWaalsContact C-CD2 3.46Å; S196-F233 PolarHBondContact O-N 2.94Å; F233-G235 VanDerWaalsContact C-N 3.31Å
234	E	89.8	Confident	91.3	Very high	161 Å²	161	42.9 Å²	42.9	75%	0.752	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-9	172.4	-63.6	-177.9	177.7	0	0	111.7	D232 N236	D232-E234 VanDerWaalsContact C-N 3.25Å; D232-E234 PolarHBondContact O-N 2.65Å; D232-E234 WeakPolarHBondContact OD1-CA 3.45Å; D232-E234 WeakPolarHBondContact OD1-CB 3.41Å; D232-E234 PolarHBondContact OD1-N 3.31Å; E234-N236 VanDerWaalsContact CB-ND2 3.33Å; E234-N236 WeakPolarHBondContact CB-ND2 3.45Å; E234-N236 PolarHBondContact OE2-ND2 3.06Å
235	G	89.4	Confident	91.3	Very high	49 Å²	49	44.5 Å²	44.5	51%	0.505	25%	0.251	S	S	.	.	S	Bend	trans	86.5	5.1	-177	0	0	0	0	0	113.8	D232 F233	D232-G235 PolarHBondContact O-N 3.27Å; D232-G235 VanDerWaalsContact O-N 3.15Å; D232-G235 PolarHBondContact OD1-N 3.33Å; F233-G235 VanDerWaalsContact C-N 3.31Å
236	N	91.9	Very high	91.5	Very high	46 Å²	46	46.7 Å²	46.7	25%	0.246	27%	0.273	C	S	.	.			trans	-77.3	134.7	177.1	-54.9	-64	0	0	0	109.7	H202 P231 D232 E234 L241	H202-N236 PolarHBondContact NE2-O 3.31Å; P231-N236 WeakPolarHBondContact CA-O 3.36Å; D232-N236 PolarHBondContact N-O 3.28Å; D232-N236 PolarHBondContact OD1-N 3.42Å; E234-N236 VanDerWaalsContact CB-ND2 3.33Å; E234-N236 WeakPolarHBondContact CB-ND2 3.45Å; E234-N236 PolarHBondContact OE2-ND2 3.06Å; N236-L241 HydrophobicContact CB-CD2 3.69Å; N236-L241 HydrophobicContact CB-CG 3.96Å
237	I	92.4	Very high	91.5	Very high	42 Å²	42	48 Å²	48	22%	0.215	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-90.1	163.7	165.4	56.8	171.1	0	0	0	110.4	P231 S239 D240 L241	P231-I237 HydrophobicContact CB-CG2 4.19Å; I237-S239 VanDerWaalsContact C-N 3.27Å; I237-S239 WeakPolarHBondContact CD1-OG 3.46Å; I237-S239 WeakPolarHBondContact CG1-OG 3.27Å; I237-S239 PolarHBondContact O-N 3.01Å; I237-S239 VanDerWaalsContact O-N 3.16Å; I237-D240 HydrophobicContact CG1-CB 4.21Å; I237-D240 VanDerWaalsContact CG1-CG 3.46Å; I237-D240 WeakPolarHBondContact CG1-OD1 3.45Å; I237-D240 PolarHBondContact O-N 3.4Å; I237-L241 PolarHBondContact O-N 3.45Å
238	S	92.8	Very high	91.6	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-57.8	-33.6	-175.6	-68.9	0	0	0	0	114	H202 A205 D240 A242 L254	H202-S238 PolarHBondContact N-OG 2.73Å; A205-S238 VanDerWaalsContact CB-O 3.25Å; A205-S238 WeakPolarHBondContact CB-O 3.3Å; S238-D240 VanDerWaalsContact C-N 3.34Å; S238-D240 PolarHBondContact O-N 3.33Å; S238-A242 PolarHBondContact O-N 2.89Å; S238-A242 VanDerWaalsContact O-N 3.15Å; S238-L254 WeakPolarHBondContact O-CD1 3.46Å
239	S	93	Very high	91.5	Very high	4 Å²	4	57.4 Å²	57.4	3%	0.028	33%	0.325	C	S	.	.	H	α-helix	trans	-61.8	-42.4	174.5	49.3	0	0	0	0	112.3	I237 L241 A242 E243	I237-S239 VanDerWaalsContact C-N 3.27Å; I237-S239 WeakPolarHBondContact CD1-OG 3.46Å; I237-S239 WeakPolarHBondContact CG1-OG 3.27Å; I237-S239 PolarHBondContact O-N 3.01Å; I237-S239 VanDerWaalsContact O-N 3.16Å; S239-L241 VanDerWaalsContact C-N 3.34Å; S239-L241 PolarHBondContact O-N 3.31Å; S239-A242 CarbonylContact O-C 3.58Å; S239-A242 WeakPolarHBondContact O-CA 3.18Å; S239-A242 WeakPolarHBondContact O-CB 3.25Å; S239-A242 PolarHBondContact O-N 3.34Å; S239-E243 WeakPolarHBondContact O-CG 3.38Å; S239-E243 PolarHBondContact O-N 2.94Å
240	D	93.1	Very high	91.6	Very high	45 Å²	45	56.8 Å²	56.8	24%	0.241	32%	0.32	C	S	.	.	H	α-helix	trans	-74.3	-32.6	-171.3	-57.8	12	0	0	0	109.6	I237 S238 E243 S244 R597	I237-D240 HydrophobicContact CG1-CB 4.21Å; I237-D240 VanDerWaalsContact CG1-CG 3.46Å; I237-D240 WeakPolarHBondContact CG1-OD1 3.45Å; I237-D240 PolarHBondContact O-N 3.4Å; S238-D240 VanDerWaalsContact C-N 3.34Å; S238-D240 PolarHBondContact O-N 3.33Å; D240-E243 PolarHBondContact O-N 3.02Å; D240-S244 WeakPolarHBondContact O-CB 3.32Å; D240-S244 PolarHBondContact O-N 2.78Å; D240-S244 PolarHBondContact O-OG 3.43Å; D240-R597 IonicContact OD2-NH2 2.68Å
241	L	93.2	Very high	91.8	Very high	20 Å²	20	54.5 Å²	54.5	11%	0.105	31%	0.309	C	S	.	.	H	α-helix	trans	-65.1	-37.8	167	-65.6	-173.9	0	0	0	113	H202 N236 I237 S239 S244 S245	H202-L241 HydrophobicContact CB-CD1 3.69Å; N236-L241 HydrophobicContact CB-CD2 3.69Å; N236-L241 HydrophobicContact CB-CG 3.96Å; I237-L241 PolarHBondContact O-N 3.45Å; S239-L241 VanDerWaalsContact C-N 3.34Å; S239-L241 PolarHBondContact O-N 3.31Å; L241-S244 WeakPolarHBondContact CA-OG 3.38Å; L241-S244 PolarHBondContact O-OG 3.39Å; L241-S244 VanDerWaalsContact O-OG 3.11Å; L241-S245 VanDerWaalsContact O-CB 3.22Å; L241-S245 WeakPolarHBondContact O-CB 3.27Å; L241-S245 PolarHBondContact O-N 2.7Å; L241-S245 VanDerWaalsContact O-N 3.12Å; L241-S245 PolarHBondContact O-OG 3.38Å
242	A	93.4	Very high	91.8	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-69.4	-39.7	174.8	0	0	0	0	0	111.8	A205 S238 S239 S245 G246 H247 L250 A251 L254	A205-A242 HydrophobicContact CB-CB 4.22Å; S238-A242 PolarHBondContact O-N 2.89Å; S238-A242 VanDerWaalsContact O-N 3.15Å; S239-A242 CarbonylContact O-C 3.58Å; S239-A242 WeakPolarHBondContact O-CA 3.18Å; S239-A242 WeakPolarHBondContact O-CB 3.25Å; S239-A242 PolarHBondContact O-N 3.34Å; A242-S245 PolarHBondContact O-N 3.17Å; A242-G246 PolarHBondContact O-N 3.33Å; A242-H247 HydrophobicContact CB-CB 4.34Å; A242-H247 WeakPolarHBondContact O-CA 3.28Å; A242-H247 PolarHBondContact O-N 3.48Å; A242-L250 HydrophobicContact CB-CB 4.49Å; A242-L250 HydrophobicContact CB-CG 4.4Å; A242-A251 HydrophobicContact CB-CB 3.83Å; A242-L254 HydrophobicContact CB-CD1 3.91Å
243	E	92.7	Very high	91.9	Very high	114 Å²	114	56.5 Å²	56.5	53%	0.533	31%	0.307	S	S	.	.	H	α-helix	trans	-65.6	-49.2	176.8	-66.8	-164.6	166.8	0	0	112.2	S239 D240 S245 G246 A251	S239-E243 WeakPolarHBondContact O-CG 3.38Å; S239-E243 PolarHBondContact O-N 2.94Å; D240-E243 PolarHBondContact O-N 3.02Å; E243-S245 PolarHBondContact O-N 3.34Å; E243-G246 PolarHBondContact O-N 3.18Å; E243-A251 HydrophobicContact CB-CB 4.42Å; E243-A251 HydrophobicContact CG-CB 3.3Å
244	S	92.7	Very high	92	Very high	93 Å²	93	49.7 Å²	49.7	65%	0.65	28%	0.277	S	S	*	.	H	α-helix	trans	-62.3	-29.4	177.1	52	0	0	0	0	113.2	D240 L241 G246	D240-S244 WeakPolarHBondContact O-CB 3.32Å; D240-S244 PolarHBondContact O-N 2.78Å; D240-S244 PolarHBondContact O-OG 3.43Å; L241-S244 WeakPolarHBondContact CA-OG 3.38Å; L241-S244 PolarHBondContact O-OG 3.39Å; L241-S244 VanDerWaalsContact O-OG 3.11Å; S244-G246 VanDerWaalsContact C-N 3.31Å
245	S	92	Very high	92.1	Very high	46 Å²	46	43.6 Å²	43.6	32%	0.322	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-0.8	172.9	-55.3	0	0	0	0	114.3	L241 A242 E243 H247	L241-S245 VanDerWaalsContact O-CB 3.22Å; L241-S245 WeakPolarHBondContact O-CB 3.27Å; L241-S245 PolarHBondContact O-N 2.7Å; L241-S245 VanDerWaalsContact O-N 3.12Å; L241-S245 PolarHBondContact O-OG 3.38Å; A242-S245 PolarHBondContact O-N 3.17Å; E243-S245 PolarHBondContact O-N 3.34Å; S245-H247 WeakPolarHBondContact CB-CD2 3.11Å; S245-H247 WeakPolarHBondContact CB-NE2 3.32Å; S245-H247 PolarHBondContact O-NE2 3.11Å
246	G	90.7	Very high	92.3	Very high	54 Å²	54	43.9 Å²	43.9	56%	0.557	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.7	3.2	178.6	0	0	0	0	0	116	A242 E243 S244 Q248	A242-G246 PolarHBondContact O-N 3.33Å; E243-G246 PolarHBondContact O-N 3.18Å; S244-G246 VanDerWaalsContact C-N 3.31Å; G246-Q248 VanDerWaalsContact C-N 3.3Å; G246-Q248 PolarHBondContact O-N 3.35Å
247	H	91	Very high	92.3	Very high	28 Å²	28	41.7 Å²	41.7	13%	0.13	23%	0.227	C	C	.	.			trans	-87.2	58.2	-174.4	-51.3	-51.6	0	0	0	112.4	A205 R206 G208 A242 S245 D249 L250 A251	A205-H247 PolarHBondContact O-CD2 3.5Å; R206-H247 PolarHBondContact O-NE2 2.73Å; G208-H247 WeakPolarHBondContact CA-NE2 3.49Å; G208-H247 PolarHBondContact N-NE2 3.1Å; G208-H247 VanDerWaalsContact N-NE2 3.2Å; A242-H247 HydrophobicContact CB-CB 4.34Å; A242-H247 WeakPolarHBondContact O-CA 3.28Å; A242-H247 PolarHBondContact O-N 3.48Å; S245-H247 WeakPolarHBondContact CB-CD2 3.11Å; S245-H247 WeakPolarHBondContact CB-NE2 3.32Å; S245-H247 PolarHBondContact O-NE2 3.11Å; H247-D249 VanDerWaalsContact C-N 3.3Å; H247-D249 PolarHBondContact O-N 3.5Å; H247-D249 VanDerWaalsContact O-N 3.16Å; H247-L250 HydrophobicContact CB-CB 3.96Å; H247-L250 HydrophobicContact CB-CD2 4.35Å; H247-L250 WeakPolarHBondContact O-CA 3.24Å; H247-L250 WeakPolarHBondContact O-CB 3.33Å; H247-L250 PolarHBondContact O-N 3.04Å; H247-A251 PolarHBondContact O-N 3.17Å
248	Q	90.6	Very high	92.4	Very high	140 Å²	140	39.9 Å²	39.9	65%	0.654	22%	0.218	S	C	*	.	H	α-helix	trans	-52.6	-40.6	-172.8	-65.7	-175.8	-7.9	0	0	114.5	G246 L250 A251 R252	G246-Q248 VanDerWaalsContact C-N 3.3Å; G246-Q248 PolarHBondContact O-N 3.35Å; Q248-L250 VanDerWaalsContact C-N 3.32Å; Q248-L250 PolarHBondContact O-N 3.45Å; Q248-A251 PolarHBondContact O-N 2.79Å; Q248-R252 WeakPolarHBondContact O-CG 3.5Å; Q248-R252 PolarHBondContact O-N 3.2Å
249	D	89.9	Confident	92.4	Very high	79 Å²	79	40.2 Å²	40.2	42%	0.422	22%	0.22	S	C	.	.	H	α-helix	trans	-66.5	-34.1	178.6	-74	-24.9	0	0	0	112.3	H247 R252 R253	H247-D249 VanDerWaalsContact C-N 3.3Å; H247-D249 PolarHBondContact O-N 3.5Å; H247-D249 VanDerWaalsContact O-N 3.16Å; D249-R252 IonicContact OD1-CZ 3.17Å; D249-R252 IonicContact OD1-NH1 3.84Å; D249-R252 PolarHBondContact OD1-NH1 2.75Å; D249-R252 VanDerWaalsContact OD1-NH1 3.1Å; D249-R252 IonicContact OD1-NH2 2.65Å; D249-R252 PolarHBondContact OD1-NH2 3.19Å; D249-R253 PolarHBondContact O-N 3.21Å
250	L	91.9	Very high	92.4	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-74.8	-41.6	176.7	-176.1	61.6	0	0	0	111.2	C215 V218 A242 H247 Q248 R253 L254	C215-L250 HydrophobicContact CB-CD1 4.5Å; V218-L250 HydrophobicContact CB-CD1 4.26Å; V218-L250 HydrophobicContact CG2-CD1 4.02Å; A242-L250 HydrophobicContact CB-CB 4.49Å; A242-L250 HydrophobicContact CB-CG 4.4Å; H247-L250 HydrophobicContact CB-CB 3.96Å; H247-L250 HydrophobicContact CB-CD2 4.35Å; H247-L250 WeakPolarHBondContact O-CA 3.24Å; H247-L250 WeakPolarHBondContact O-CB 3.33Å; H247-L250 PolarHBondContact O-N 3.04Å; Q248-L250 VanDerWaalsContact C-N 3.32Å; Q248-L250 PolarHBondContact O-N 3.45Å; L250-R253 PolarHBondContact O-N 2.9Å; L250-R253 VanDerWaalsContact O-N 3.14Å; L250-L254 HydrophobicContact CG-CD1 4.07Å; L250-L254 WeakPolarHBondContact O-CG 3.22Å; L250-L254 PolarHBondContact O-N 3.02Å
251	A	92.9	Very high	92.4	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-57.1	-49.7	174.7	0	0	0	0	0	112.2	A242 E243 H247 Q248 R253 L254 V255	A242-A251 HydrophobicContact CB-CB 3.83Å; E243-A251 HydrophobicContact CB-CB 4.42Å; E243-A251 HydrophobicContact CG-CB 3.3Å; H247-A251 PolarHBondContact O-N 3.17Å; Q248-A251 PolarHBondContact O-N 2.79Å; A251-R253 VanDerWaalsContact C-N 3.25Å; A251-R253 PolarHBondContact O-N 3.24Å; A251-L254 WeakPolarHBondContact O-CB 3.22Å; A251-L254 PolarHBondContact O-N 2.94Å; A251-L254 VanDerWaalsContact O-N 3.11Å; A251-V255 PolarHBondContact O-N 3.25Å
252	R	91.9	Very high	92.4	Very high	108 Å²	108	38 Å²	38	41%	0.408	21%	0.207	S	C	.	.	H	α-helix	trans	-56.8	-41.1	174.8	-67.9	-167.7	-39.6	-114.8	-5.9	111.7	Q248 D249 V255 E256	Q248-R252 WeakPolarHBondContact O-CG 3.5Å; Q248-R252 PolarHBondContact O-N 3.2Å; D249-R252 IonicContact OD1-CZ 3.17Å; D249-R252 IonicContact OD1-NH1 3.84Å; D249-R252 PolarHBondContact OD1-NH1 2.75Å; D249-R252 VanDerWaalsContact OD1-NH1 3.1Å; D249-R252 IonicContact OD1-NH2 2.65Å; D249-R252 PolarHBondContact OD1-NH2 3.19Å; R252-V255 PolarHBondContact O-N 3.44Å; R252-E256 WeakPolarHBondContact O-CG 3.46Å; R252-E256 PolarHBondContact O-N 2.79Å
253	R	92.6	Very high	92.5	Very high	15 Å²	15	38.6 Å²	38.6	6%	0.057	21%	0.21	C	C	.	.	H	α-helix	trans	-68.6	-35.6	178.4	-175.8	52.2	-177.3	156.4	13.3	112.6	H62 S64 E219 D249 L250 A251 V255 E256 L257 E260	H62-R253 PolarHBondContact ND1-NE 3.11Å; S64-R253 PolarHBondContact OG-NE 2.96Å; E219-R253 IonicContact OE1-CZ 3.52Å; E219-R253 VanDerWaalsContact OE1-CZ 3.3Å; E219-R253 IonicContact OE1-NE 3.6Å; E219-R253 PolarHBondContact OE1-NE 2.89Å; E219-R253 IonicContact OE1-NH2 3.13Å; E219-R253 PolarHBondContact OE1-NH2 2.8Å; E219-R253 IonicContact OE2-NH2 3.37Å; E219-R253 PolarHBondContact OE2-NH2 3.08Å; D249-R253 PolarHBondContact O-N 3.21Å; L250-R253 PolarHBondContact O-N 2.9Å; L250-R253 VanDerWaalsContact O-N 3.14Å; A251-R253 VanDerWaalsContact C-N 3.25Å; A251-R253 PolarHBondContact O-N 3.24Å; R253-V255 VanDerWaalsContact C-N 3.33Å; R253-E256 WeakPolarHBondContact CD-OE2 3.43Å; R253-E256 IonicContact CZ-OE2 2.74Å; R253-E256 IonicContact NE-OE2 2.76Å; R253-E256 IonicContact NH1-OE2 3.99Å; R253-E256 PolarHBondContact NH1-OE2 3.11Å; R253-E256 PolarHBondContact O-N 2.84Å; R253-L257 HydrophobicContact CG-CD1 4.46Å; R253-L257 VanDerWaalsContact NH2-CD2 3.28Å; R253-L257 VanDerWaalsContact O-CG 3.32Å; R253-L257 WeakPolarHBondContact O-CG 3.46Å; R253-L257 PolarHBondContact O-N 3.21Å; R253-E260 IonicContact NH2-OE2 3.1Å
254	L	93.2	Very high	92.5	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-63	-40.1	172.8	-75.4	157.7	0	0	0	111.3	I201 A205 V218 P228 S238 A242 L250 A251 L257 C258	I201-L254 HydrophobicContact CD1-CD2 4.01Å; I201-L254 HydrophobicContact CG1-CD2 4.08Å; A205-L254 HydrophobicContact CB-CD1 3.71Å; V218-L254 HydrophobicContact CG1-CD2 3.47Å; V218-L254 VanDerWaalsContact CG1-CD2 3.47Å; V218-L254 HydrophobicContact CG1-CG 4.1Å; V218-L254 HydrophobicContact CG2-CD2 4.42Å; P228-L254 HydrophobicContact CB-CD2 4.06Å; S238-L254 WeakPolarHBondContact O-CD1 3.46Å; A242-L254 HydrophobicContact CB-CD1 3.91Å; L250-L254 HydrophobicContact CG-CD1 4.07Å; L250-L254 WeakPolarHBondContact O-CG 3.22Å; L250-L254 PolarHBondContact O-N 3.02Å; A251-L254 WeakPolarHBondContact O-CB 3.22Å; A251-L254 PolarHBondContact O-N 2.94Å; A251-L254 VanDerWaalsContact O-N 3.11Å; L254-L257 PolarHBondContact O-N 2.83Å; L254-C258 PolarHBondContact O-N 3.45Å; L254-C258 VanDerWaalsContact O-N 3.08Å; L254-C258 PolarHBondContact O-SG 2.86Å
255	V	93	Very high	92.7	Very high	33 Å²	33	29.6 Å²	29.6	20%	0.2	16%	0.157	C	C	.	.	H	α-helix	trans	-63.2	-41.4	172.5	178.1	0	0	0	0	111.9	A251 R252 R253 C258 F259 H276	A251-V255 PolarHBondContact O-N 3.25Å; R252-V255 PolarHBondContact O-N 3.44Å; R253-V255 VanDerWaalsContact C-N 3.33Å; V255-C258 WeakPolarHBondContact O-CB 3.44Å; V255-C258 PolarHBondContact O-N 2.92Å; V255-F259 HydrophobicContact CG1-CD2 4.41Å; V255-F259 HydrophobicContact CG1-CE2 4.34Å; V255-F259 VanDerWaalsContact O-CD2 3.25Å; V255-F259 WeakPolarHBondContact O-CD2 3.48Å; V255-H276 HydrophobicContact CG1-CB 3.9Å
256	E	93.1	Very high	92.8	Very high	54 Å²	54	27.4 Å²	27.4	25%	0.252	14%	0.142	S	C	.	.	H	α-helix	trans	-62	-41.2	172.8	-67	165.7	-163.2	0	0	112.3	H62 R252 R253 C258 F259 E260	H62-E256 IonicContact CD2-OE2 3.57Å; H62-E256 IonicContact CE1-OE2 3.71Å; H62-E256 IonicContact NE2-OE2 2.68Å; H62-E256 PolarHBondContact NE2-OE2 3.2Å; R252-E256 WeakPolarHBondContact O-CG 3.46Å; R252-E256 PolarHBondContact O-N 2.79Å; R253-E256 WeakPolarHBondContact CD-OE2 3.43Å; R253-E256 IonicContact CZ-OE2 2.74Å; R253-E256 IonicContact NE-OE2 2.76Å; R253-E256 IonicContact NH1-OE2 3.99Å; R253-E256 PolarHBondContact NH1-OE2 3.11Å; R253-E256 PolarHBondContact O-N 2.84Å; E256-C258 VanDerWaalsContact C-N 3.27Å; E256-C258 PolarHBondContact O-N 3.43Å; E256-F259 CarbonylContact O-C 3.55Å; E256-F259 PolarHBondContact O-N 3.17Å; E256-E260 PolarHBondContact O-N 2.88Å
257	L	93.1	Very high	92.9	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-64.5	-30.7	178.2	-70.8	172	0	0	0	112.8	V218 F222 P228 R253 L254 F259	V218-L257 HydrophobicContact CG1-CD1 3.63Å; F222-L257 HydrophobicContact CB-CD1 4.39Å; F222-L257 HydrophobicContact CD1-CD2 3.65Å; F222-L257 HydrophobicContact CD2-CB 4.16Å; F222-L257 HydrophobicContact CD2-CD2 4.15Å; F222-L257 HydrophobicContact CE1-CD2 3.72Å; F222-L257 HydrophobicContact CE2-CB 4.09Å; F222-L257 HydrophobicContact CE2-CD2 4.2Å; F222-L257 WeakPolarHBondContact CE2-O 3.29Å; F222-L257 HydrophobicContact CG-CD1 4.38Å; F222-L257 HydrophobicContact CG-CD2 3.87Å; F222-L257 HydrophobicContact CZ-CD2 3.99Å; P228-L257 HydrophobicContact CG-CB 3.96Å; R253-L257 HydrophobicContact CG-CD1 4.46Å; R253-L257 VanDerWaalsContact NH2-CD2 3.28Å; R253-L257 VanDerWaalsContact O-CG 3.32Å; R253-L257 WeakPolarHBondContact O-CG 3.46Å; R253-L257 PolarHBondContact O-N 3.21Å; L254-L257 PolarHBondContact O-N 2.83Å; L257-F259 PolarHBondContact O-N 3.19Å
258	C	92.6	Very high	93.1	Very high	4 Å²	4	31 Å²	31	3%	0.027	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-18.3	171.2	-77.9	0	0	0	0	114.6	L254 V255 E256 V593	L254-C258 PolarHBondContact O-N 3.45Å; L254-C258 VanDerWaalsContact O-N 3.08Å; L254-C258 PolarHBondContact O-SG 2.86Å; V255-C258 WeakPolarHBondContact O-CB 3.44Å; V255-C258 PolarHBondContact O-N 2.92Å; E256-C258 VanDerWaalsContact C-N 3.27Å; E256-C258 PolarHBondContact O-N 3.43Å; C258-V593 HydrophobicContact CB-CG2 3.56Å; C258-V593 PolarHBondContact O-N 3.21Å
259	F	93.1	Very high	93.2	Very high	8 Å²	8	26.4 Å²	26.4	4%	0.035	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-124.1	4.4	179.4	-62.6	-70.8	0	0	0	113.8	V255 E256 L257 A261 T262 D263 H276 H281 K401 V593	V255-F259 HydrophobicContact CG1-CD2 4.41Å; V255-F259 HydrophobicContact CG1-CE2 4.34Å; V255-F259 VanDerWaalsContact O-CD2 3.25Å; V255-F259 WeakPolarHBondContact O-CD2 3.48Å; E256-F259 CarbonylContact O-C 3.55Å; E256-F259 PolarHBondContact O-N 3.17Å; L257-F259 PolarHBondContact O-N 3.19Å; F259-A261 PolarHBondContact O-N 3.06Å; F259-T262 PolarHBondContact O-N 2.94Å; F259-T262 PolarHBondContact O-OG1 3.4Å; F259-D263 WeakPolarHBondContact O-CB 3.4Å; F259-D263 PolarHBondContact O-N 3.25Å; F259-H276 AromaticContact CD2-CE1 3.96Å; F259-H276 AromaticContact CD2-NE2 3.83Å; F259-H281 HydrophobicContact CD1-CB 4.12Å; F259-H281 HydrophobicContact CD2-CB 4.29Å; F259-H281 AromaticContact CD2-ND1 3.48Å; F259-H281 WeakPolarHBondContact CD2-ND1 3.49Å; F259-H281 HydrophobicContact CE1-CB 4.04Å; F259-H281 HydrophobicContact CE2-CB 4.24Å; F259-H281 AromaticContact CE2-CE1 3.82Å; F259-H281 AromaticContact CE2-CG 3.87Å; F259-H281 AromaticContact CE2-ND1 3.18Å; F259-H281 WeakPolarHBondContact CE2-ND1 3.41Å; F259-H281 HydrophobicContact CG-CB 4.29Å; F259-H281 HydrophobicContact CZ-CB 4.15Å; F259-H281 AromaticContact CZ-ND1 3.78Å; F259-K401 HydrophobicContact CE1-CD 4.15Å; F259-K401 HydrophobicContact CZ-CD 4.33Å; F259-V593 HydrophobicContact CE1-CB 4.14Å; F259-V593 HydrophobicContact CZ-CB 3.92Å; F259-V593 HydrophobicContact CZ-CG2 4.04Å
260	E	93.1	Very high	93.3	Very high	21 Å²	21	24.9 Å²	24.9	10%	0.098	11%	0.113	C	C	.	.	H	α-helix	trans	-45.9	-37.4	-179.2	164.8	69.5	-139.6	0	0	112.4	F222 R253 E256 R264 Y318	F222-E260 HydrophobicContact CE1-CG 4.18Å; F222-E260 HydrophobicContact CZ-CB 4.09Å; F222-E260 HydrophobicContact CZ-CG 4.02Å; R253-E260 IonicContact NH2-OE2 3.1Å; E256-E260 PolarHBondContact O-N 2.88Å; E260-R264 WeakPolarHBondContact O-CB 3.34Å; E260-R264 PolarHBondContact O-N 3.06Å; E260-R264 VanDerWaalsContact O-N 3.07Å; E260-Y318 HydrophobicContact CG-CE2 4.29Å; E260-Y318 PolarHBondContact OE1-OH 2.92Å
261	A	92.8	Very high	93.2	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-66.3	-57.1	177.2	0	0	0	0	0	113	F259 D263 R264 L265 V314 Y318 A590 M592	F259-A261 PolarHBondContact O-N 3.06Å; A261-D263 VanDerWaalsContact C-N 3.3Å; A261-D263 PolarHBondContact O-N 2.99Å; A261-R264 PolarHBondContact O-N 3.33Å; A261-L265 WeakPolarHBondContact O-CG 3.4Å; A261-L265 PolarHBondContact O-N 2.79Å; A261-V314 HydrophobicContact CB-CG1 3.99Å; A261-Y318 HydrophobicContact CB-CD2 4.07Å; A261-A590 HydrophobicContact CB-CB 3.77Å; A261-M592 HydrophobicContact CB-CG 3.97Å; A261-M592 HydrophobicContact CB-SD 3.69Å
262	T	94.6	Very high	93.1	Very high	2 Å²	2	35.7 Å²	35.7	1%	0.012	17%	0.169	C	C	.	.	H	α-helix	trans	-60.4	-38.3	175.7	31.4	0	0	0	0	113.2	F259 R264 L265 S266 F282 L394 A397 M592	F259-T262 PolarHBondContact O-N 2.94Å; F259-T262 PolarHBondContact O-OG1 3.4Å; T262-R264 VanDerWaalsContact C-N 3.34Å; T262-L265 PolarHBondContact O-N 3.38Å; T262-S266 WeakPolarHBondContact O-CB 3.47Å; T262-S266 PolarHBondContact O-N 3.03Å; T262-S266 PolarHBondContact O-OG 3.28Å; T262-F282 HydrophobicContact CG2-CD1 3.98Å; T262-F282 HydrophobicContact CG2-CE1 3.68Å; T262-L394 HydrophobicContact CG2-CD2 3.76Å; T262-L394 WeakPolarHBondContact O-CD2 3.39Å; T262-A397 HydrophobicContact CG2-CB 4.05Å; T262-M592 HydrophobicContact CG2-CE 3.48Å; T262-M592 VanDerWaalsContact CG2-CE 3.48Å; T262-M592 HydrophobicContact CG2-SD 3.62Å
263	D	94.5	Very high	93.1	Very high	11 Å²	11	35 Å²	35	6%	0.059	17%	0.173	C	C	.	.	H	α-helix	trans	-65.2	-41.4	-178.8	-79.9	13.6	0	0	0	110.9	F259 A261 S266 Y267 I273 P274 H276	F259-D263 WeakPolarHBondContact O-CB 3.4Å; F259-D263 PolarHBondContact O-N 3.25Å; A261-D263 VanDerWaalsContact C-N 3.3Å; A261-D263 PolarHBondContact O-N 2.99Å; D263-S266 WeakPolarHBondContact O-CB 3.28Å; D263-S266 PolarHBondContact O-N 2.95Å; D263-Y267 WeakPolarHBondContact O-CB 3.5Å; D263-Y267 PolarHBondContact O-N 3.34Å; D263-I273 HydrophobicContact CB-CG2 3.95Å; D263-I273 WeakPolarHBondContact OD2-CG2 3.43Å; D263-P274 VanDerWaalsContact OD1-CD 3.28Å; D263-P274 WeakPolarHBondContact OD1-CD 3.36Å; D263-P274 WeakPolarHBondContact OD1-CG 3.45Å; D263-H276 IonicContact OD1-CE1 3.66Å; D263-H276 PolarHBondContact OD1-CE1 3.29Å; D263-H276 IonicContact OD1-NE2 3.44Å; D263-H276 IonicContact OD2-CE1 2.72Å; D263-H276 PolarHBondContact OD2-CE1 2.89Å; D263-H276 IonicContact OD2-NE2 3.46Å; D263-H276 PolarHBondContact OD2-NE2 3.44Å; D263-H276 VanDerWaalsContact OD2-NE2 3.08Å
264	R	93.8	Very high	93	Very high	18 Å²	18	34.8 Å²	34.8	7%	0.068	17%	0.173	C	C	.	.	H	α-helix	trans	-69.9	-37.1	176.5	-162.5	164.2	-165.9	-177	-7.1	113	E260 A261 T262 S266 Y267 Y268 Y318 T321 D322 E325	E260-R264 WeakPolarHBondContact O-CB 3.34Å; E260-R264 PolarHBondContact O-N 3.06Å; E260-R264 VanDerWaalsContact O-N 3.07Å; A261-R264 PolarHBondContact O-N 3.33Å; T262-R264 VanDerWaalsContact C-N 3.34Å; R264-S266 VanDerWaalsContact C-N 3.32Å; R264-Y267 PolarHBondContact O-N 2.83Å; R264-Y268 WeakPolarHBondContact O-CB 3.39Å; R264-Y268 PolarHBondContact O-N 2.94Å; R264-Y318 HydrophobicContact CB-CD2 4.22Å; R264-Y318 HydrophobicContact CB-CE2 3.66Å; R264-Y318 VanDerWaalsContact CD-CZ 3.42Å; R264-Y318 VanDerWaalsContact CD-OH 3.26Å; R264-Y318 WeakPolarHBondContact CD-OH 3.43Å; R264-Y318 HydrophobicContact CG-CE2 4.17Å; R264-Y318 PolarHBondContact NH1-OH 3.49Å; R264-T321 HydrophobicContact CG-CG2 4.4Å; R264-D322 IonicContact CZ-OD1 2.85Å; R264-D322 IonicContact NH1-OD1 2.73Å; R264-D322 PolarHBondContact NH1-OD1 2.71Å; R264-D322 IonicContact NH2-OD1 2.82Å; R264-D322 PolarHBondContact NH2-OD1 2.98Å; R264-E325 IonicContact CZ-OE2 2.69Å; R264-E325 IonicContact NE-OE1 3.58Å; R264-E325 IonicContact NE-OE2 2.77Å; R264-E325 PolarHBondContact NE-OE2 2.96Å; R264-E325 IonicContact NH2-OE2 3.58Å; R264-E325 PolarHBondContact NH2-OE2 3.42Å
265	L	95.3	Very high	92.8	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-64.3	-39.2	172.2	-59	-169.5	0	0	0	111.5	A261 T262 Y268 L269 V317 T321 L390 I393 L394	A261-L265 WeakPolarHBondContact O-CG 3.4Å; A261-L265 PolarHBondContact O-N 2.79Å; T262-L265 PolarHBondContact O-N 3.38Å; L265-Y268 PolarHBondContact O-N 3.45Å; L265-L269 WeakPolarHBondContact O-CG 3.21Å; L265-L269 PolarHBondContact O-N 2.83Å; L265-V317 HydrophobicContact CD2-CG1 4.28Å; L265-T321 HydrophobicContact CD2-CG2 4.14Å; L265-T321 VanDerWaalsContact CD2-OG1 3.28Å; L265-T321 WeakPolarHBondContact CD2-OG1 3.37Å; L265-L390 HydrophobicContact CD1-CD2 4.19Å; L265-L390 HydrophobicContact CD2-CD1 4.43Å; L265-L390 HydrophobicContact CD2-CD2 3.8Å; L265-L390 HydrophobicContact CG-CD2 4.4Å; L265-I393 HydrophobicContact CD1-CG2 3.74Å; L265-L394 HydrophobicContact CB-CD1 4.47Å; L265-L394 HydrophobicContact CB-CD2 4.09Å; L265-L394 HydrophobicContact CB-CG 4.34Å
266	S	94.3	Very high	92.7	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-64.6	-45.7	175.2	-52.3	0	0	0	0	111.2	T262 D263 R264 Y268 L269 C270 R272 L283	T262-S266 WeakPolarHBondContact O-CB 3.47Å; T262-S266 PolarHBondContact O-N 3.03Å; T262-S266 PolarHBondContact O-OG 3.28Å; D263-S266 WeakPolarHBondContact O-CB 3.28Å; D263-S266 PolarHBondContact O-N 2.95Å; R264-S266 VanDerWaalsContact C-N 3.32Å; S266-Y268 PolarHBondContact O-N 2.88Å; S266-L269 PolarHBondContact O-N 2.78Å; S266-C270 PolarHBondContact O-N 3.4Å; S266-C270 VanDerWaalsContact O-N 3.1Å; S266-C270 PolarHBondContact O-SG 3.24Å; S266-R272 CarbonylContact C-O 3.54Å; S266-L283 WeakPolarHBondContact CB-O 3.33Å; S266-L283 PolarHBondContact OG-O 3.27Å
267	Y	94	Very high	92.5	Very high	79 Å²	79	42.7 Å²	42.7	31%	0.31	20%	0.202	S	C	.	.	H	α-helix	trans	-61.5	-41.4	177.2	-175.4	-99.4	0	0	0	112.2	P60 D263 R264 L269 G271 R272 I273	P60-Y267 HydrophobicContact CG-CE1 3.79Å; D263-Y267 WeakPolarHBondContact O-CB 3.5Å; D263-Y267 PolarHBondContact O-N 3.34Å; R264-Y267 PolarHBondContact O-N 2.83Å; Y267-L269 VanDerWaalsContact C-N 3.3Å; Y267-L269 PolarHBondContact O-N 3.37Å; Y267-G271 VanDerWaalsContact CD2-C 3.48Å; Y267-G271 WeakPolarHBondContact CE2-O 3.43Å; Y267-G271 WeakPolarHBondContact O-CA 3.4Å; Y267-G271 PolarHBondContact O-N 3.34Å; Y267-R272 WeakPolarHBondContact CA-O 3.36Å; Y267-R272 PolarHBondContact N-O 3.48Å; Y267-I273 HydrophobicContact CD2-CD1 4.18Å; Y267-I273 HydrophobicContact CD2-CG1 3.98Å; Y267-I273 HydrophobicContact CG-CG1 4.36Å
268	Y	93.9	Very high	92.2	Very high	78 Å²	78	48.8 Å²	48.8	31%	0.306	23%	0.233	S	C	.	.	H	α-helix	trans	-61.8	-37.3	176.2	-174.2	-92.8	0	0	0	112.7	R264 L265 S266 T321 R324 E325 F386 L390	R264-Y268 WeakPolarHBondContact O-CB 3.39Å; R264-Y268 PolarHBondContact O-N 2.94Å; L265-Y268 PolarHBondContact O-N 3.45Å; S266-Y268 PolarHBondContact O-N 2.88Å; Y268-T321 HydrophobicContact CD2-CG2 3.71Å; Y268-T321 HydrophobicContact CG-CG2 3.75Å; Y268-R324 HydrophobicContact CE2-CB 3.9Å; Y268-R324 WeakPolarHBondContact OH-CD 3.49Å; Y268-E325 HydrophobicContact CD2-CG 3.83Å; Y268-E325 HydrophobicContact CE2-CG 4.26Å; Y268-F386 HydrophobicContact CD1-CE1 4.27Å; Y268-F386 AromaticContact CE1-CD1 3.76Å; Y268-F386 HydrophobicContact CE1-CD1 3.76Å; Y268-F386 AromaticContact CE1-CE1 3.79Å; Y268-F386 HydrophobicContact CE1-CE1 3.79Å; Y268-L390 HydrophobicContact CD1-CD1 3.5Å; Y268-L390 HydrophobicContact CE1-CD1 4.21Å; Y268-L390 HydrophobicContact CG-CD1 4.24Å
269	L	93.2	Very high	91.8	Very high	43 Å²	43	53.1 Å²	53.1	23%	0.225	26%	0.264	C	S	.	.	H	α-helix	trans	-76.7	-36.9	-178.8	-70.3	169.9	0	0	0	114	L265 S266 Y267 P285 A387 L390 I391 L394	L265-L269 WeakPolarHBondContact O-CG 3.21Å; L265-L269 PolarHBondContact O-N 2.83Å; S266-L269 PolarHBondContact O-N 2.78Å; Y267-L269 VanDerWaalsContact C-N 3.3Å; Y267-L269 PolarHBondContact O-N 3.37Å; L269-P285 HydrophobicContact CB-CG 3.94Å; L269-P285 HydrophobicContact CD1-CG 4.43Å; L269-A387 HydrophobicContact CD2-CB 3.77Å; L269-L390 HydrophobicContact CD1-CB 3.91Å; L269-L390 HydrophobicContact CD2-CB 4.14Å; L269-L390 HydrophobicContact CD2-CD1 4.08Å; L269-L390 HydrophobicContact CG-CB 4.17Å; L269-L390 HydrophobicContact CG-CD1 4.01Å; L269-I391 HydrophobicContact CD1-CG1 3.69Å; L269-I391 HydrophobicContact CD2-CD1 4.47Å; L269-I391 HydrophobicContact CD2-CG1 4.32Å; L269-L394 HydrophobicContact CD1-CD1 3.72Å
270	C	91.6	Very high	91.5	Very high	47 Å²	47	57.5 Å²	57.5	32%	0.318	29%	0.285	S	S	.	.	H	α-helix	trans	-141.1	7.1	-170.6	70.5	0	0	0	0	116.2	S266 R272 L283 P285	S266-C270 PolarHBondContact O-N 3.4Å; S266-C270 VanDerWaalsContact O-N 3.1Å; S266-C270 PolarHBondContact O-SG 3.24Å; C270-R272 PolarHBondContact O-N 3Å; C270-L283 WeakPolarHBondContact SG-CD2 3.36Å; C270-P285 HydrophobicContact CB-CG 3.82Å
271	G	90.8	Very high	91.4	Very high	48 Å²	48	58.1 Å²	58.1	50%	0.495	29%	0.288	S	S	.	.	S	Bend	trans	66.4	18.1	-179.3	0	0	0	0	0	114.7	Y267	Y267-G271 VanDerWaalsContact CD2-C 3.48Å; Y267-G271 WeakPolarHBondContact CE2-O 3.43Å; Y267-G271 WeakPolarHBondContact O-CA 3.4Å; Y267-G271 PolarHBondContact O-N 3.34Å
272	R	91.7	Very high	91.3	Very high	180 Å²	180	59.3 Å²	59.3	68%	0.679	29%	0.293	S	S	*	.			trans	-131.7	151.9	-177.7	-59.7	178.2	-171.7	173	3.1	110.7	S266 Y267 C270 L283	S266-R272 CarbonylContact C-O 3.54Å; Y267-R272 WeakPolarHBondContact CA-O 3.36Å; Y267-R272 PolarHBondContact N-O 3.48Å; C270-R272 PolarHBondContact O-N 3Å; R272-L283 HydrophobicContact CB-CD1 3.73Å
273	I	90.6	Very high	91.2	Very high	94 Å²	94	60.9 Å²	60.9	48%	0.482	30%	0.301	S	S	.	.			trans	-119.7	147.4	179.4	-66.2	174.6	0	0	0	107.1	D263 Y267	D263-I273 HydrophobicContact CB-CG2 3.95Å; D263-I273 WeakPolarHBondContact OD2-CG2 3.43Å; Y267-I273 HydrophobicContact CD2-CD1 4.18Å; Y267-I273 HydrophobicContact CD2-CG1 3.98Å; Y267-I273 HydrophobicContact CG-CG1 4.36Å
274	P	90.9	Very high	91	Very high	10 Å²	10	62.4 Å²	62.4	7%	0.065	31%	0.308	C	S	.	.			trans	-60	152.8	174.5	-16.6	29.4	0	0	0	112.4	D263 Q280 L283	D263-P274 VanDerWaalsContact OD1-CD 3.28Å; D263-P274 WeakPolarHBondContact OD1-CD 3.36Å; D263-P274 WeakPolarHBondContact OD1-CG 3.45Å; P274-Q280 WeakPolarHBondContact CB-O 3.47Å; P274-L283 HydrophobicContact CB-CB 4.39Å; P274-L283 HydrophobicContact CG-CB 3.82Å
275	D	90	Very high	90.5	Very high	51 Å²	51	63.2 Å²	63.2	27%	0.273	32%	0.316	S	S	.	.			trans	-94.8	94.5	168.4	-166.3	-15.6	0	0	0	110.2	R277 L278 Q280	D275-R277 PolarHBondContact O-N 3.08Å; D275-R277 VanDerWaalsContact O-N 3.11Å; D275-R277 VanDerWaalsContact OD1-CB 3.29Å; D275-R277 WeakPolarHBondContact OD1-CB 3.45Å; D275-R277 WeakPolarHBondContact OD1-CG 3.32Å; D275-R277 IonicContact OD1-CZ 3.64Å; D275-R277 PolarHBondContact OD1-N 3.23Å; D275-R277 VanDerWaalsContact OD1-N 3.15Å; D275-R277 IonicContact OD1-NE 3.76Å; D275-R277 PolarHBondContact OD1-NE 2.96Å; D275-R277 IonicContact OD1-NH2 2.71Å; D275-R277 IonicContact OD2-CZ 3.83Å; D275-R277 IonicContact OD2-NE 2.71Å; D275-R277 PolarHBondContact OD2-NE 3.17Å; D275-R277 IonicContact OD2-NH2 3.78Å; D275-R277 PolarHBondContact OD2-NH2 3.31Å; D275-L278 HydrophobicContact CB-CD1 4.23Å; D275-L278 HydrophobicContact CB-CG 4.32Å; D275-L278 PolarHBondContact O-N 3.14Å; D275-Q280 CarbonylContact C-O 3.57Å
276	H	90.8	Very high	89.6	Confident	22 Å²	22	72.7 Å²	72.7	10%	0.102	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-60.3	-21	-179.3	-59.4	-25.1	0	0	0	114	V255 F259 D263 L278 S279 Q280 H281	V255-H276 HydrophobicContact CG1-CB 3.9Å; F259-H276 AromaticContact CD2-CE1 3.96Å; F259-H276 AromaticContact CD2-NE2 3.83Å; D263-H276 IonicContact OD1-CE1 3.66Å; D263-H276 PolarHBondContact OD1-CE1 3.29Å; D263-H276 IonicContact OD1-NE2 3.44Å; D263-H276 IonicContact OD2-CE1 2.72Å; D263-H276 PolarHBondContact OD2-CE1 2.89Å; D263-H276 IonicContact OD2-NE2 3.46Å; D263-H276 PolarHBondContact OD2-NE2 3.44Å; D263-H276 VanDerWaalsContact OD2-NE2 3.08Å; H276-L278 PolarHBondContact O-N 3.33Å; H276-S279 PolarHBondContact O-N 3.08Å; H276-Q280 PolarHBondContact ND1-O 3.15Å; H276-H281 AromaticContact CG-ND1 3.86Å; H276-H281 AromaticContact ND1-ND1 3.59Å
277	R	87.2	Confident	88.3	Confident	180 Å²	180	75.1 Å²	75.1	68%	0.679	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-67.5	-19.6	177.1	-55.7	172.6	-64.1	165.9	4.5	112.4	D275 S279	D275-R277 PolarHBondContact O-N 3.08Å; D275-R277 VanDerWaalsContact O-N 3.11Å; D275-R277 VanDerWaalsContact OD1-CB 3.29Å; D275-R277 WeakPolarHBondContact OD1-CB 3.45Å; D275-R277 WeakPolarHBondContact OD1-CG 3.32Å; D275-R277 IonicContact OD1-CZ 3.64Å; D275-R277 PolarHBondContact OD1-N 3.23Å; D275-R277 VanDerWaalsContact OD1-N 3.15Å; D275-R277 IonicContact OD1-NE 3.76Å; D275-R277 PolarHBondContact OD1-NE 2.96Å; D275-R277 IonicContact OD1-NH2 2.71Å; D275-R277 IonicContact OD2-CZ 3.83Å; D275-R277 IonicContact OD2-NE 2.71Å; D275-R277 PolarHBondContact OD2-NE 3.17Å; D275-R277 IonicContact OD2-NH2 3.78Å; D275-R277 PolarHBondContact OD2-NH2 3.31Å; R277-S279 VanDerWaalsContact C-N 3.32Å
278	L	88	Confident	86.4	Confident	127 Å²	127	74 Å²	74	67%	0.665	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-95.3	15.3	174.5	-55.2	179.9	0	0	0	111.9	D275 H276 Q280	D275-L278 HydrophobicContact CB-CD1 4.23Å; D275-L278 HydrophobicContact CB-CG 4.32Å; D275-L278 PolarHBondContact O-N 3.14Å; H276-L278 PolarHBondContact O-N 3.33Å; L278-Q280 PolarHBondContact O-N 3.4Å; L278-Q280 VanDerWaalsContact O-N 3.07Å
279	S	84.1	Confident	84.2	Confident	96 Å²	96	75.6 Å²	75.6	67%	0.671	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	18	-169.3	-56.2	0	0	0	0	114	H276 R277 H281	H276-S279 PolarHBondContact O-N 3.08Å; R277-S279 VanDerWaalsContact C-N 3.32Å; S279-H281 PolarHBondContact O-CD2 3.32Å
280	Q	87.4	Confident	82.3	Confident	99 Å²	99	75.6 Å²	75.6	46%	0.463	42%	0.422	S	S	.	.			trans	-91.7	103.6	174.7	-171.8	175.5	4.2	0	0	109.3	P274 D275 H276 L278 F282	P274-Q280 WeakPolarHBondContact CB-O 3.47Å; D275-Q280 CarbonylContact C-O 3.57Å; H276-Q280 PolarHBondContact ND1-O 3.15Å; L278-Q280 PolarHBondContact O-N 3.4Å; L278-Q280 VanDerWaalsContact O-N 3.07Å; Q280-F282 PolarHBondContact NE2-O 2.99Å
281	H	89.5	Confident	80.8	Confident	35 Å²	35	78.8 Å²	78.8	16%	0.162	43%	0.432	C	S	.	.			trans	-103.1	-0.7	-177.3	-55.6	-84.8	0	0	0	114.4	F259 H276 S279 K401	F259-H281 HydrophobicContact CD1-CB 4.12Å; F259-H281 HydrophobicContact CD2-CB 4.29Å; F259-H281 AromaticContact CD2-ND1 3.48Å; F259-H281 WeakPolarHBondContact CD2-ND1 3.49Å; F259-H281 HydrophobicContact CE1-CB 4.04Å; F259-H281 HydrophobicContact CE2-CB 4.24Å; F259-H281 AromaticContact CE2-CE1 3.82Å; F259-H281 AromaticContact CE2-CG 3.87Å; F259-H281 AromaticContact CE2-ND1 3.18Å; F259-H281 WeakPolarHBondContact CE2-ND1 3.41Å; F259-H281 HydrophobicContact CG-CB 4.29Å; F259-H281 HydrophobicContact CZ-CB 4.15Å; F259-H281 AromaticContact CZ-ND1 3.78Å; H276-H281 AromaticContact CG-ND1 3.86Å; H276-H281 AromaticContact ND1-ND1 3.59Å; S279-H281 PolarHBondContact O-CD2 3.32Å; H281-K401 PolarHBondContact CD2-NZ 3.13Å; H281-K401 VanDerWaalsContact CG-NZ 3.29Å; H281-K401 PolarHBondContact NE2-NZ 3.26Å
282	F	92	Very high	79.3	Confident	25 Å²	25	79.1 Å²	79.1	11%	0.11	42%	0.42	C	S	.	.			trans	-138.3	135.8	179.4	-59.6	-82.5	0	0	0	110.4	T262 Q280 A397 K398 K401	T262-F282 HydrophobicContact CG2-CD1 3.98Å; T262-F282 HydrophobicContact CG2-CE1 3.68Å; Q280-F282 PolarHBondContact NE2-O 2.99Å; F282-A397 HydrophobicContact CE1-CB 3.79Å; F282-A397 HydrophobicContact CZ-CB 4.43Å; F282-K398 HydrophobicContact CB-CB 4.49Å; F282-K398 HydrophobicContact CB-CD 4.29Å; F282-K398 HydrophobicContact CB-CG 4.48Å; F282-K398 HydrophobicContact CD1-CB 4.1Å; F282-K398 HydrophobicContact CD2-CB 3.91Å; F282-K398 HydrophobicContact CD2-CD 4.43Å; F282-K398 HydrophobicContact CD2-CG 3.79Å; F282-K398 HydrophobicContact CE1-CB 4.28Å; F282-K398 HydrophobicContact CE2-CB 4.1Å; F282-K398 HydrophobicContact CE2-CG 4.2Å; F282-K398 HydrophobicContact CG-CB 3.91Å; F282-K398 HydrophobicContact CG-CD 4.47Å; F282-K398 HydrophobicContact CG-CG 4.12Å; F282-K398 HydrophobicContact CZ-CB 4.29Å; F282-K401 HydrophobicContact CE2-CB 4.06Å; F282-K401 HydrophobicContact CE2-CD 3.72Å; F282-K401 HydrophobicContact CE2-CG 4.49Å; F282-K401 HydrophobicContact CZ-CB 4.04Å; F282-K401 HydrophobicContact CZ-CD 4.09Å
283	L	91.3	Very high	77.6	Confident	35 Å²	35	77.2 Å²	77.2	18%	0.183	42%	0.423	C	S	.	.			trans	-128.6	105.1	174.5	-171.2	168.3	0	0	0	106.7	S266 C270 R272 P274	S266-L283 WeakPolarHBondContact CB-O 3.33Å; S266-L283 PolarHBondContact OG-O 3.27Å; C270-L283 WeakPolarHBondContact SG-CD2 3.36Å; R272-L283 HydrophobicContact CB-CD1 3.73Å; P274-L283 HydrophobicContact CB-CB 4.39Å; P274-L283 HydrophobicContact CG-CB 3.82Å
284	I	90.5	Very high	76.1	Confident	42 Å²	42	75.2 Å²	75.2	22%	0.215	42%	0.418	C	S	.	.			trans	-112.6	115.2	-177.8	-48.9	-173.3	0	0	0	106.4	E286 I391 L394 N395 K398	I284-E286 PolarHBondContact O-N 3.06Å; I284-I391 HydrophobicContact CG2-CG2 4.18Å; I284-L394 HydrophobicContact CD1-CB 4Å; I284-L394 HydrophobicContact CG1-CB 3.98Å; I284-N395 HydrophobicContact CD1-CB 4.41Å; I284-N395 WeakPolarHBondContact CD1-OD1 3.48Å; I284-K398 HydrophobicContact CD1-CB 4.48Å; I284-K398 HydrophobicContact CD1-CD 4.17Å
285	P	84.2	Confident	75.2	Confident	35 Å²	35	79.3 Å²	79.3	23%	0.227	44%	0.439	C	S	.	.	P	Polyproline II helix	trans	-60.5	137.1	178.7	-26.5	37.1	0	0	0	111.6	L269 C270 V287	L269-P285 HydrophobicContact CB-CG 3.94Å; L269-P285 HydrophobicContact CD1-CG 4.43Å; C270-P285 HydrophobicContact CB-CG 3.82Å; P285-V287 PolarHBondContact O-N 3.47Å
286	E	75	Confident	74.8	Confident	201 Å²	201	84.9 Å²	84.9	94%	0.939	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-67.8	122.2	171.3	-71	-176.9	177.1	0	0	109.7	I284	I284-E286 PolarHBondContact O-N 3.06Å
287	V	66.7	Low	74.4	Confident	51 Å²	51	90 Å²	90	31%	0.309	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-90.2	124.8	174.4	180	0	0	0	0	107.4	P285 A289 Q291 F292 I391	P285-V287 PolarHBondContact O-N 3.47Å; V287-A289 PolarHBondContact O-N 2.76Å; V287-Q291 HydrophobicContact CG1-CB 3.84Å; V287-F292 HydrophobicContact CB-CD2 4.15Å; V287-F292 HydrophobicContact CG1-CB 4.43Å; V287-F292 HydrophobicContact CG1-CD2 3.36Å; V287-F292 HydrophobicContact CG1-CE2 3.94Å; V287-F292 HydrophobicContact CG1-CG 4.27Å; V287-F292 HydrophobicContact CG2-CD2 3.62Å; V287-F292 HydrophobicContact CG2-CE2 3.87Å; V287-I391 HydrophobicContact CG2-CD1 3.68Å; V287-I391 HydrophobicContact CG2-CG2 4.5Å
288	A	55.9	Low	74.3	Confident	56 Å²	56	83.7 Å²	83.7	46%	0.463	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-61	128.4	169.4	0	0	0	0	0	109.3	G290 Q291	A288-G290 PolarHBondContact O-N 2.84Å; A288-Q291 HydrophobicContact CB-CG 4.14Å; A288-Q291 WeakPolarHBondContact O-CB 3.28Å; A288-Q291 PolarHBondContact O-N 3.36Å
289	A	47.9	Very low	74.2	Confident	110 Å²	110	80.6 Å²	80.6	91%	0.909	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.1	124.2	-173.4	0	0	0	0	0	111.7	V287	V287-A289 PolarHBondContact O-N 2.76Å
290	G	53.2	Low	74.5	Confident	44 Å²	44	80.2 Å²	80.2	45%	0.454	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	94	-10.9	-174.8	0	0	0	0	0	116.1	A288 F292 R384	A288-G290 PolarHBondContact O-N 2.84Å; G290-F292 VanDerWaalsContact C-N 3.34Å; G290-F292 PolarHBondContact O-N 3.11Å; G290-R384 PolarHBondContact O-NH2 3.48Å
291	Q	58.2	Low	74.7	Confident	113 Å²	113	84 Å²	84	53%	0.528	45%	0.453	S	S	.	.	S	Bend	trans	-71.2	-27.3	176.8	-79.2	-174.2	-17.7	0	0	113.8	V287 A288 R384	V287-Q291 HydrophobicContact CG1-CB 3.84Å; A288-Q291 HydrophobicContact CB-CG 4.14Å; A288-Q291 WeakPolarHBondContact O-CB 3.28Å; A288-Q291 PolarHBondContact O-N 3.36Å; Q291-R384 PolarHBondContact O-NE 3.27Å; Q291-R384 PolarHBondContact O-NH2 3Å
292	F	60.4	Low	74.8	Confident	55 Å²	55	83 Å²	83	24%	0.241	45%	0.449	C	S	.	.	S	Bend	trans	-128	106.1	162.6	-54.3	-71.1	0	0	0	107.8	V287 G290 S294 R384 A387 A388 I391	V287-F292 HydrophobicContact CB-CD2 4.15Å; V287-F292 HydrophobicContact CG1-CB 4.43Å; V287-F292 HydrophobicContact CG1-CD2 3.36Å; V287-F292 HydrophobicContact CG1-CE2 3.94Å; V287-F292 HydrophobicContact CG1-CG 4.27Å; V287-F292 HydrophobicContact CG2-CD2 3.62Å; V287-F292 HydrophobicContact CG2-CE2 3.87Å; G290-F292 VanDerWaalsContact C-N 3.34Å; G290-F292 PolarHBondContact O-N 3.11Å; F292-S294 PolarHBondContact O-N 2.9Å; F292-R384 HydrophobicContact CD1-CG 3.6Å; F292-R384 WeakPolarHBondContact CD1-O 3.33Å; F292-R384 HydrophobicContact CE1-CB 4.28Å; F292-R384 HydrophobicContact CE1-CG 3.5Å; F292-R384 VanDerWaalsContact CE1-O 3.25Å; F292-R384 WeakPolarHBondContact CE1-O 3.4Å; F292-A387 HydrophobicContact CE1-CB 3.93Å; F292-A387 HydrophobicContact CZ-CB 3.81Å; F292-A388 HydrophobicContact CB-CB 4.11Å; F292-A388 HydrophobicContact CD1-CB 3.96Å; F292-A388 HydrophobicContact CG-CB 4.11Å; F292-I391 HydrophobicContact CD2-CD1 3.91Å; F292-I391 HydrophobicContact CE2-CD1 3.67Å; F292-I391 HydrophobicContact CZ-CD1 4.45Å
293	D	55.2	Low	74.7	Confident	140 Å²	140	85 Å²	85	75%	0.749	46%	0.458	S	S	*	.			trans	-68.9	77.9	166	-73	-48.6	0	0	0	108.2	N295	D293-N295 PolarHBondContact O-N 3.11Å; D293-N295 VanDerWaalsContact O-N 3.08Å
294	S	59.7	Low	74.8	Confident	53 Å²	53	93.1 Å²	93.1	37%	0.371	49%	0.486	S	S	.	.			trans	-56.8	117.8	-178.3	57.1	0	0	0	0	108.4	F292 K296	F292-S294 PolarHBondContact O-N 2.9Å; S294-K296 PolarHBondContact O-N 3.19Å
295	N	72.4	Confident	74.8	Confident	95 Å²	95	94 Å²	94	51%	0.508	49%	0.491	S	S	.	.			trans	-63.7	102	178.9	179.4	-22.1	0	0	0	107.8	D293 Q297 A298 K299	D293-N295 PolarHBondContact O-N 3.11Å; D293-N295 VanDerWaalsContact O-N 3.08Å; N295-Q297 PolarHBondContact O-N 3.27Å; N295-Q297 WeakPolarHBondContact OD1-CB 3.4Å; N295-Q297 PolarHBondContact OD1-N 2.92Å; N295-Q297 VanDerWaalsContact OD1-N 3.09Å; N295-A298 HydrophobicContact CB-CB 3.88Å; N295-A298 WeakPolarHBondContact O-CA 3.21Å; N295-A298 WeakPolarHBondContact O-CB 3.35Å; N295-A298 PolarHBondContact O-N 3.12Å; N295-A298 PolarHBondContact OD1-N 3.2Å; N295-K299 PolarHBondContact O-N 3.43Å
296	K	80.4	Confident	75.1	Confident	168 Å²	168	94.2 Å²	94.2	73%	0.73	49%	0.494	S	S	*	.	H	α-helix	trans	-52.9	-34.8	-175.9	-67.8	-178	179.2	178.1	0	111.8	S294 L300	S294-K296 PolarHBondContact O-N 3.19Å; K296-L300 WeakPolarHBondContact O-CB 3.47Å; K296-L300 VanDerWaalsContact O-CG 3.25Å; K296-L300 WeakPolarHBondContact O-CG 3.37Å; K296-L300 PolarHBondContact O-N 3.32Å
297	Q	83.6	Confident	75.7	Confident	129 Å²	129	88.3 Å²	88.3	60%	0.603	47%	0.468	S	S	*	.	H	α-helix	trans	-69.6	-39.3	176.4	-56.5	-177.7	-3.1	0	0	112.2	N295 L300 R301	N295-Q297 PolarHBondContact O-N 3.27Å; N295-Q297 WeakPolarHBondContact OD1-CB 3.4Å; N295-Q297 PolarHBondContact OD1-N 2.92Å; N295-Q297 VanDerWaalsContact OD1-N 3.09Å; Q297-L300 PolarHBondContact O-N 3.07Å; Q297-R301 WeakPolarHBondContact O-CB 3.43Å; Q297-R301 VanDerWaalsContact O-CG 3.28Å; Q297-R301 WeakPolarHBondContact O-CG 3.27Å; Q297-R301 PolarHBondContact O-N 2.71Å
298	A	85.1	Confident	76.7	Confident	49 Å²	49	92.3 Å²	92.3	41%	0.405	48%	0.478	S	S	.	.	H	α-helix	trans	-64	-43.6	175.1	0	0	0	0	0	111.4	N295 R301 L302	N295-A298 HydrophobicContact CB-CB 3.88Å; N295-A298 WeakPolarHBondContact O-CA 3.21Å; N295-A298 WeakPolarHBondContact O-CB 3.35Å; N295-A298 PolarHBondContact O-N 3.12Å; N295-A298 PolarHBondContact OD1-N 3.2Å; A298-R301 PolarHBondContact O-N 2.85Å; A298-L302 PolarHBondContact O-N 2.96Å
299	K	86.4	Confident	78.3	Confident	62 Å²	62	90.9 Å²	90.9	27%	0.27	47%	0.466	S	S	.	.	H	α-helix	trans	-60.8	-45	174.3	-169.9	175.1	-168.5	124.8	0	112.1	N295 R301 L302 Q303 D392	N295-K299 PolarHBondContact O-N 3.43Å; K299-R301 VanDerWaalsContact C-N 3.33Å; K299-R301 PolarHBondContact O-N 3.23Å; K299-L302 WeakPolarHBondContact O-CB 3.43Å; K299-L302 PolarHBondContact O-N 3.3Å; K299-Q303 WeakPolarHBondContact O-CB 3.31Å; K299-Q303 VanDerWaalsContact O-CG 3.24Å; K299-Q303 WeakPolarHBondContact O-CG 3.43Å; K299-Q303 PolarHBondContact O-N 3.36Å; K299-D392 WeakPolarHBondContact CD-OD1 3.36Å; K299-D392 WeakPolarHBondContact CE-OD1 3.11Å; K299-D392 IonicContact NZ-OD1 2.67Å; K299-D392 PolarHBondContact NZ-OD1 2.95Å
300	L	88.8	Confident	80.4	Confident	88 Å²	88	85.6 Å²	85.6	46%	0.461	42%	0.423	S	S	.	.	H	α-helix	trans	-62.9	-36.7	174.5	-73.6	168.5	0	0	0	112.7	K296 Q297 Q303 R304	K296-L300 WeakPolarHBondContact O-CB 3.47Å; K296-L300 VanDerWaalsContact O-CG 3.25Å; K296-L300 WeakPolarHBondContact O-CG 3.37Å; K296-L300 PolarHBondContact O-N 3.32Å; Q297-L300 PolarHBondContact O-N 3.07Å; L300-Q303 PolarHBondContact O-N 2.92Å; L300-R304 VanDerWaalsContact O-CG 3.27Å; L300-R304 WeakPolarHBondContact O-CG 3.49Å; L300-R304 PolarHBondContact O-N 3.24Å
301	R	91.4	Very high	82.2	Confident	179 Å²	179	85.4 Å²	85.4	68%	0.675	41%	0.41	S	S	*	.	H	α-helix	trans	-66.5	-41.4	174.3	-74	173.2	-178.5	-167.3	0.7	111.8	Q297 A298 K299 R304	Q297-R301 WeakPolarHBondContact O-CB 3.43Å; Q297-R301 VanDerWaalsContact O-CG 3.28Å; Q297-R301 WeakPolarHBondContact O-CG 3.27Å; Q297-R301 PolarHBondContact O-N 2.71Å; A298-R301 PolarHBondContact O-N 2.85Å; K299-R301 VanDerWaalsContact C-N 3.33Å; K299-R301 PolarHBondContact O-N 3.23Å; R301-R304 PolarHBondContact O-N 3.18Å
302	L	91.6	Very high	83.7	Confident	14 Å²	14	82.4 Å²	82.4	7%	0.073	40%	0.395	C	S	.	.	H	α-helix	trans	-60.7	-45.2	174.4	-175.3	68.6	0	0	0	111.6	A298 K299 R304 L305 F310 L313 D392 I393 D396 R400	A298-L302 PolarHBondContact O-N 2.96Å; K299-L302 WeakPolarHBondContact O-CB 3.43Å; K299-L302 PolarHBondContact O-N 3.3Å; L302-R304 PolarHBondContact O-N 2.92Å; L302-L305 HydrophobicContact CD1-CD1 4.1Å; L302-L305 WeakPolarHBondContact O-CB 3.21Å; L302-L305 WeakPolarHBondContact O-CG 3.4Å; L302-L305 PolarHBondContact O-N 3.3Å; L302-F310 HydrophobicContact CD1-CD2 3.98Å; L302-F310 HydrophobicContact CD1-CE2 3.92Å; L302-F310 HydrophobicContact CG-CD2 4.5Å; L302-F310 HydrophobicContact CG-CE2 4.24Å; L302-L313 HydrophobicContact CD1-CD2 3.4Å; L302-D392 HydrophobicContact CD2-CB 3.9Å; L302-I393 HydrophobicContact CD1-CG1 4.39Å; L302-I393 HydrophobicContact CD2-CG1 4.19Å; L302-D396 HydrophobicContact CD2-CB 4.02Å; L302-D396 HydrophobicContact CG-CB 4.35Å; L302-R400 PolarHBondContact O-NH2 3.32Å
303	Q	90.7	Very high	85.3	Confident	66 Å²	66	82 Å²	82	31%	0.308	40%	0.396	S	S	.	.	H	α-helix	trans	-64	-24.6	179.7	-73.7	179	-10.8	0	0	114.1	K299 L300 D396	K299-Q303 WeakPolarHBondContact O-CB 3.31Å; K299-Q303 VanDerWaalsContact O-CG 3.24Å; K299-Q303 WeakPolarHBondContact O-CG 3.43Å; K299-Q303 PolarHBondContact O-N 3.36Å; L300-Q303 PolarHBondContact O-N 2.92Å; Q303-D396 WeakPolarHBondContact CG-OD1 3.25Å
304	R	92.7	Very high	87.2	Confident	205 Å²	205	75.5 Å²	75.5	77%	0.774	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-9.3	177.8	-73.8	172	-177.1	-165.1	0.7	114.1	L300 R301 L302	L300-R304 VanDerWaalsContact O-CG 3.27Å; L300-R304 WeakPolarHBondContact O-CG 3.49Å; L300-R304 PolarHBondContact O-N 3.24Å; R301-R304 PolarHBondContact O-N 3.18Å; L302-R304 PolarHBondContact O-N 2.92Å
305	L	91.7	Very high	88.7	Confident	60 Å²	60	74.6 Å²	74.6	31%	0.314	35%	0.35	S	S	.	.	S	Bend	trans	-67.1	140.1	176.1	-61.5	-177.5	0	0	0	111	L302 A309 F310 L313 R400	L302-L305 HydrophobicContact CD1-CD1 4.1Å; L302-L305 WeakPolarHBondContact O-CB 3.21Å; L302-L305 WeakPolarHBondContact O-CG 3.4Å; L302-L305 PolarHBondContact O-N 3.3Å; L305-A309 HydrophobicContact CB-CB 4.2Å; L305-A309 HydrophobicContact CD2-CB 4.4Å; L305-F310 HydrophobicContact CB-CB 4.38Å; L305-L313 HydrophobicContact CD1-CD2 3.88Å; L305-R400 PolarHBondContact O-NH1 3.05Å; L305-R400 PolarHBondContact O-NH2 2.95Å
306	S	90.7	Very high	89.8	Confident	41 Å²	41	70.6 Å²	70.6	29%	0.287	33%	0.329	S	S	.	.			trans	-60.3	156.6	163.8	63	0	0	0	0	110.4	R308 A309 F310 D643	S306-R308 VanDerWaalsContact C-N 3.27Å; S306-R308 PolarHBondContact O-N 2.97Å; S306-A309 PolarHBondContact O-N 3Å; S306-A309 VanDerWaalsContact O-N 3.09Å; S306-A309 VanDerWaalsContact OG-CB 3.31Å; S306-A309 WeakPolarHBondContact OG-CB 3.38Å; S306-A309 PolarHBondContact OG-N 3.38Å; S306-F310 WeakPolarHBondContact O-CB 3.27Å; S306-F310 PolarHBondContact O-N 2.97Å; S306-D643 VanDerWaalsContact CB-OD2 3.27Å; S306-D643 WeakPolarHBondContact CB-OD2 3.41Å; S306-D643 PolarHBondContact OG-OD2 2.99Å
307	D	87.5	Confident	90.6	Very high	76 Å²	76	62.6 Å²	62.6	41%	0.406	30%	0.295	S	S	.	.	H	α-helix	trans	-60.1	-39	-177.8	-58.2	-56.6	0	0	0	111.6	A309 F310 E311 R400	D307-A309 PolarHBondContact O-N 3.1Å; D307-F310 CarbonylContact O-C 3.59Å; D307-F310 WeakPolarHBondContact O-CB 3.25Å; D307-F310 PolarHBondContact O-N 3.43Å; D307-E311 WeakPolarHBondContact O-CG 3.36Å; D307-E311 PolarHBondContact O-N 3.31Å; D307-R400 VanDerWaalsContact OD1-CD 3.29Å; D307-R400 WeakPolarHBondContact OD1-CD 3.28Å; D307-R400 IonicContact OD1-CZ 2.67Å; D307-R400 IonicContact OD1-NE 2.77Å; D307-R400 IonicContact OD1-NH1 3.21Å; D307-R400 PolarHBondContact OD1-NH1 3.43Å
308	R	86.5	Confident	91.2	Very high	135 Å²	135	56.7 Å²	56.7	51%	0.509	27%	0.267	S	S	.	.	H	α-helix	trans	-62.8	-38.8	173.9	-169.8	179.7	-174.5	-169.3	2.1	113.4	S306 K312	S306-R308 VanDerWaalsContact C-N 3.27Å; S306-R308 PolarHBondContact O-N 2.97Å; R308-K312 PolarHBondContact O-N 3.02Å
309	A	89.9	Confident	91.7	Very high	26 Å²	26	55.3 Å²	55.3	22%	0.215	25%	0.252	C	S	.	.	H	α-helix	trans	-71.8	-35.3	175.4	0	0	0	0	0	111.6	L305 S306 D307 L313	L305-A309 HydrophobicContact CB-CB 4.2Å; L305-A309 HydrophobicContact CD2-CB 4.4Å; S306-A309 PolarHBondContact O-N 3Å; S306-A309 VanDerWaalsContact O-N 3.09Å; S306-A309 VanDerWaalsContact OG-CB 3.31Å; S306-A309 WeakPolarHBondContact OG-CB 3.38Å; S306-A309 PolarHBondContact OG-N 3.38Å; D307-A309 PolarHBondContact O-N 3.1Å; A309-L313 PolarHBondContact O-N 3.3Å; A309-L313 VanDerWaalsContact O-N 3.13Å
310	F	92.8	Very high	92.2	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-66.1	-45.5	173.7	-176.3	-105.7	0	0	0	111.7	L302 L305 S306 D307 K312 L313 V314 I393 D396 A397 F594	L302-F310 HydrophobicContact CD1-CD2 3.98Å; L302-F310 HydrophobicContact CD1-CE2 3.92Å; L302-F310 HydrophobicContact CG-CD2 4.5Å; L302-F310 HydrophobicContact CG-CE2 4.24Å; L305-F310 HydrophobicContact CB-CB 4.38Å; S306-F310 WeakPolarHBondContact O-CB 3.27Å; S306-F310 PolarHBondContact O-N 2.97Å; D307-F310 CarbonylContact O-C 3.59Å; D307-F310 WeakPolarHBondContact O-CB 3.25Å; D307-F310 PolarHBondContact O-N 3.43Å; F310-K312 PolarHBondContact O-N 3.39Å; F310-L313 CarbonylContact O-C 3.6Å; F310-L313 WeakPolarHBondContact O-CB 3.38Å; F310-L313 PolarHBondContact O-N 3.41Å; F310-L313 VanDerWaalsContact O-N 3.11Å; F310-V314 HydrophobicContact CD1-CG2 4.06Å; F310-V314 HydrophobicContact CE1-CG2 3.7Å; F310-V314 HydrophobicContact CE2-CG2 4.26Å; F310-V314 HydrophobicContact CG-CG2 4.49Å; F310-V314 HydrophobicContact CZ-CG2 3.79Å; F310-V314 WeakPolarHBondContact O-CG2 3.44Å; F310-V314 PolarHBondContact O-N 3.02Å; F310-I393 HydrophobicContact CE2-CG1 4.37Å; F310-I393 HydrophobicContact CE2-CG2 4.45Å; F310-I393 HydrophobicContact CZ-CG2 4.03Å; F310-D396 HydrophobicContact CE2-CB 3.62Å; F310-D396 HydrophobicContact CZ-CB 3.7Å; F310-A397 HydrophobicContact CE1-CB 4.07Å; F310-A397 HydrophobicContact CZ-CB 4.2Å; F310-F594 HydrophobicContact CD1-CE1 4.35Å; F310-F594 HydrophobicContact CD1-CE2 4.12Å; F310-F594 AromaticContact CD1-CZ 3.62Å; F310-F594 HydrophobicContact CD1-CZ 3.62Å; F310-F594 HydrophobicContact CE1-CE1 4.11Å; F310-F594 HydrophobicContact CE1-CE2 4.48Å; F310-F594 AromaticContact CE1-CZ 3.58Å; F310-F594 HydrophobicContact CE1-CZ 3.58Å
311	E	90.2	Very high	92.5	Very high	39 Å²	39	48.1 Å²	48.1	18%	0.182	22%	0.218	C	C	.	.	H	α-helix	trans	-54.5	-49.6	171.7	-78.1	173.1	-144.5	0	0	112.3	D307 L313 V314 Q315 R588 F594	D307-E311 WeakPolarHBondContact O-CG 3.36Å; D307-E311 PolarHBondContact O-N 3.31Å; E311-L313 PolarHBondContact O-N 3.48Å; E311-V314 PolarHBondContact O-N 2.74Å; E311-Q315 VanDerWaalsContact O-CG 3.32Å; E311-Q315 WeakPolarHBondContact O-CG 3.05Å; E311-Q315 PolarHBondContact O-N 2.69Å; E311-R588 IonicContact OE2-CZ 3.85Å; E311-R588 IonicContact OE2-NH1 3.97Å; E311-R588 IonicContact OE2-NH2 2.75Å; E311-R588 PolarHBondContact OE2-NH2 2.94Å; E311-F594 HydrophobicContact CG-CD2 4.14Å; E311-F594 HydrophobicContact CG-CE2 3.73Å
312	K	90.2	Very high	92.6	Very high	51 Å²	51	40 Å²	40	22%	0.222	19%	0.187	C	C	.	.	H	α-helix	trans	-57.4	-38.5	176.8	-79.5	-173.9	172.9	-174.3	0	111.5	R308 F310 D316 R371 E650	R308-K312 PolarHBondContact O-N 3.02Å; F310-K312 PolarHBondContact O-N 3.39Å; K312-D316 VanDerWaalsContact O-CG 3.24Å; K312-D316 PolarHBondContact O-N 3.44Å; K312-R371 PolarHBondContact O-NH2 3.43Å; K312-E650 IonicContact NZ-OE1 3.67Å; K312-E650 PolarHBondContact NZ-OE1 2.8Å; K312-E650 IonicContact NZ-OE2 3.4Å; K312-E650 PolarHBondContact NZ-OE2 3.07Å
313	L	93.6	Very high	92.8	Very high	47 Å²	47	40.6 Å²	40.6	25%	0.246	19%	0.189	C	C	.	.	H	α-helix	trans	-70.4	-43	175.7	176.7	63.3	0	0	0	112.4	L302 L305 A309 F310 E311 Q315 D316 V317	L302-L313 HydrophobicContact CD1-CD2 3.4Å; L305-L313 HydrophobicContact CD1-CD2 3.88Å; A309-L313 PolarHBondContact O-N 3.3Å; A309-L313 VanDerWaalsContact O-N 3.13Å; F310-L313 CarbonylContact O-C 3.6Å; F310-L313 WeakPolarHBondContact O-CB 3.38Å; F310-L313 PolarHBondContact O-N 3.41Å; F310-L313 VanDerWaalsContact O-N 3.11Å; E311-L313 PolarHBondContact O-N 3.48Å; L313-Q315 VanDerWaalsContact C-N 3.32Å; L313-Q315 PolarHBondContact O-N 3.02Å; L313-D316 PolarHBondContact O-N 2.88Å; L313-V317 HydrophobicContact CD1-CG2 4.07Å; L313-V317 HydrophobicContact CG-CG2 4.48Å; L313-V317 WeakPolarHBondContact O-CG2 3.41Å; L313-V317 PolarHBondContact O-N 3.19Å
314	V	94.6	Very high	93	Very high	2 Å²	2	39 Å²	39	1%	0.012	18%	0.18	C	C	.	.	H	α-helix	trans	-60.6	-41.6	176.7	171.5	0	0	0	0	110.8	A261 F310 E311 V317 Y318 I393 M592	A261-V314 HydrophobicContact CB-CG1 3.99Å; F310-V314 HydrophobicContact CD1-CG2 4.06Å; F310-V314 HydrophobicContact CE1-CG2 3.7Å; F310-V314 HydrophobicContact CE2-CG2 4.26Å; F310-V314 HydrophobicContact CG-CG2 4.49Å; F310-V314 HydrophobicContact CZ-CG2 3.79Å; F310-V314 WeakPolarHBondContact O-CG2 3.44Å; F310-V314 PolarHBondContact O-N 3.02Å; E311-V314 PolarHBondContact O-N 2.74Å; V314-V317 PolarHBondContact O-N 3.35Å; V314-Y318 VanDerWaalsContact O-CB 3.26Å; V314-Y318 WeakPolarHBondContact O-CB 3.27Å; V314-Y318 PolarHBondContact O-N 3.41Å; V314-I393 HydrophobicContact CG2-CG2 3.83Å; V314-M592 HydrophobicContact CG1-CG 4.1Å; V314-M592 HydrophobicContact CG1-SD 4.35Å
315	Q	92.4	Very high	93	Very high	34 Å²	34	30.6 Å²	30.6	16%	0.159	15%	0.149	C	C	.	.	H	α-helix	trans	-59	-47.6	172.7	-70.1	164.4	8.1	0	0	112.1	E311 L313 V317 Y318 D319 A590	E311-Q315 VanDerWaalsContact O-CG 3.32Å; E311-Q315 WeakPolarHBondContact O-CG 3.05Å; E311-Q315 PolarHBondContact O-N 2.69Å; L313-Q315 VanDerWaalsContact C-N 3.32Å; L313-Q315 PolarHBondContact O-N 3.02Å; Q315-V317 VanDerWaalsContact C-N 3.32Å; Q315-V317 PolarHBondContact O-N 3.06Å; Q315-Y318 PolarHBondContact O-N 2.87Å; Q315-D319 PolarHBondContact O-N 3.23Å; Q315-A590 HydrophobicContact CG-CB 4.24Å
316	D	95.3	Very high	93	Very high	12 Å²	12	28.4 Å²	28.4	6%	0.064	14%	0.138	C	C	.	.	H	α-helix	trans	-66.5	-34.6	-178.1	-70.5	-11	0	0	0	111.7	K312 L313 E320 R371 R375 L378	K312-D316 VanDerWaalsContact O-CG 3.24Å; K312-D316 PolarHBondContact O-N 3.44Å; L313-D316 PolarHBondContact O-N 2.88Å; D316-E320 PolarHBondContact O-N 2.77Å; D316-R371 IonicContact OD1-CZ 3.69Å; D316-R371 IonicContact OD1-NE 2.78Å; D316-R371 PolarHBondContact OD1-NE 2.72Å; D316-R371 VanDerWaalsContact OD1-NE 3.08Å; D316-R371 IonicContact OD1-NH2 2.67Å; D316-R371 PolarHBondContact OD1-NH2 2.87Å; D316-R371 WeakPolarHBondContact OD2-CG 3.41Å; D316-R371 IonicContact OD2-CZ 2.8Å; D316-R371 IonicContact OD2-NE 3.82Å; D316-R371 PolarHBondContact OD2-NE 3.14Å; D316-R371 IonicContact OD2-NH2 3.62Å; D316-R375 HydrophobicContact CB-CG 3.74Å; D316-R375 WeakPolarHBondContact OD1-CD 3.21Å; D316-R375 WeakPolarHBondContact OD1-CG 3.19Å; D316-R375 IonicContact OD1-CZ 2.91Å; D316-R375 IonicContact OD1-NE 3.84Å; D316-R375 IonicContact OD1-NH1 3.78Å; D316-R375 PolarHBondContact OD1-NH1 3.4Å; D316-L378 HydrophobicContact CB-CD1 4.34Å; D316-L378 WeakPolarHBondContact O-CD1 3.28Å
317	V	96.7	Very high	93	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-77.1	-38.1	175.1	171.9	0	0	0	0	112.5	L265 L313 V314 Q315 D319 E320 T321 L378 F386 L389 L390 I393	L265-V317 HydrophobicContact CD2-CG1 4.28Å; L313-V317 HydrophobicContact CD1-CG2 4.07Å; L313-V317 HydrophobicContact CG-CG2 4.48Å; L313-V317 WeakPolarHBondContact O-CG2 3.41Å; L313-V317 PolarHBondContact O-N 3.19Å; V314-V317 PolarHBondContact O-N 3.35Å; Q315-V317 VanDerWaalsContact C-N 3.32Å; Q315-V317 PolarHBondContact O-N 3.06Å; V317-D319 VanDerWaalsContact C-N 3.29Å; V317-D319 PolarHBondContact O-N 3.47Å; V317-E320 PolarHBondContact O-N 2.74Å; V317-T321 PolarHBondContact O-N 3.21Å; V317-T321 PolarHBondContact O-OG1 3.24Å; V317-T321 VanDerWaalsContact O-OG1 3.11Å; V317-L378 HydrophobicContact CG2-CD1 4.08Å; V317-L378 HydrophobicContact CG2-CD2 4.23Å; V317-F386 HydrophobicContact CG1-CE2 4.32Å; V317-F386 HydrophobicContact CG1-CZ 4.35Å; V317-L389 HydrophobicContact CG2-CD2 3.98Å; V317-L390 HydrophobicContact CG1-CD2 3.28Å; V317-I393 HydrophobicContact CB-CD1 4.08Å; V317-I393 HydrophobicContact CG1-CD1 3.97Å; V317-I393 HydrophobicContact CG2-CD1 3.8Å
318	Y	96.1	Very high	93	Very high	5 Å²	5	27.4 Å²	27.4	2%	0.02	14%	0.135	C	C	.	.	H	α-helix	trans	-58	-44	172.4	-178.8	-74.7	0	0	0	110.8	R48 E260 A261 R264 V314 Q315 E320 T321 D322 A590	R48-Y318 VanDerWaalsContact CZ-CE1 3.49Å; E260-Y318 HydrophobicContact CG-CE2 4.29Å; E260-Y318 PolarHBondContact OE1-OH 2.92Å; A261-Y318 HydrophobicContact CB-CD2 4.07Å; R264-Y318 HydrophobicContact CB-CD2 4.22Å; R264-Y318 HydrophobicContact CB-CE2 3.66Å; R264-Y318 VanDerWaalsContact CD-CZ 3.42Å; R264-Y318 VanDerWaalsContact CD-OH 3.26Å; R264-Y318 WeakPolarHBondContact CD-OH 3.43Å; R264-Y318 HydrophobicContact CG-CE2 4.17Å; R264-Y318 PolarHBondContact NH1-OH 3.49Å; V314-Y318 VanDerWaalsContact O-CB 3.26Å; V314-Y318 WeakPolarHBondContact O-CB 3.27Å; V314-Y318 PolarHBondContact O-N 3.41Å; Q315-Y318 PolarHBondContact O-N 2.87Å; Y318-E320 VanDerWaalsContact C-N 3.33Å; Y318-E320 PolarHBondContact O-N 3.13Å; Y318-T321 WeakPolarHBondContact O-CB 3.42Å; Y318-T321 PolarHBondContact O-N 3.41Å; Y318-D322 HydrophobicContact CE1-CB 4.41Å; Y318-D322 WeakPolarHBondContact O-CB 3.31Å; Y318-D322 PolarHBondContact O-N 3.42Å; Y318-A590 HydrophobicContact CD2-CB 4.45Å; Y318-A590 HydrophobicContact CG-CB 4.39Å
319	D	95.6	Very high	93	Very high	19 Å²	19	21.3 Å²	21.3	10%	0.102	11%	0.113	C	C	.	.	H	α-helix	trans	-59.6	-42.4	177.5	-78	-1.5	0	0	0	111.9	R48 Q315 V317 D322 R323 L361 R375	R48-D319 VanDerWaalsContact CD-OD1 3.3Å; R48-D319 WeakPolarHBondContact CD-OD1 3.32Å; R48-D319 IonicContact CZ-OD1 3.85Å; R48-D319 IonicContact NE-OD1 2.85Å; R48-D319 IonicContact NH1-OD1 3.56Å; R48-D319 PolarHBondContact NH1-OD1 3.11Å; Q315-D319 PolarHBondContact O-N 3.23Å; V317-D319 VanDerWaalsContact C-N 3.29Å; V317-D319 PolarHBondContact O-N 3.47Å; D319-D322 PolarHBondContact O-N 3.44Å; D319-R323 WeakPolarHBondContact O-CB 3.45Å; D319-R323 PolarHBondContact O-N 2.93Å; D319-L361 HydrophobicContact CB-CD1 3.8Å; D319-L361 HydrophobicContact CB-CD2 3.87Å; D319-R375 IonicContact OD2-CZ 3.02Å; D319-R375 IonicContact OD2-NH1 3.75Å; D319-R375 PolarHBondContact OD2-NH1 3.2Å; D319-R375 IonicContact OD2-NH2 3.3Å; D319-R375 PolarHBondContact OD2-NH2 3.07Å
320	E	96.7	Very high	92.8	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-68.5	-37.4	176.4	177.1	62.1	-169.8	0	0	112	D316 V317 Y318 R323 R324 L361 L378 A379 F386	D316-E320 PolarHBondContact O-N 2.77Å; V317-E320 PolarHBondContact O-N 2.74Å; Y318-E320 VanDerWaalsContact C-N 3.33Å; Y318-E320 PolarHBondContact O-N 3.13Å; E320-R323 PolarHBondContact O-N 2.76Å; E320-R323 IonicContact OE1-CZ 2.78Å; E320-R323 IonicContact OE1-NE 2.84Å; E320-R323 IonicContact OE1-NH2 3.35Å; E320-R323 PolarHBondContact OE1-NH2 3.34Å; E320-R323 IonicContact OE2-CZ 3.64Å; E320-R323 IonicContact OE2-NE 2.79Å; E320-R323 PolarHBondContact OE2-NE 3.4Å; E320-R323 IonicContact OE2-NH2 3.48Å; E320-R324 WeakPolarHBondContact O-CG 3.38Å; E320-R324 PolarHBondContact O-N 2.93Å; E320-R324 IonicContact OE1-CZ 2.68Å; E320-R324 IonicContact OE1-NE 3.06Å; E320-R324 PolarHBondContact OE1-NE 3.49Å; E320-R324 IonicContact OE1-NH2 3.7Å; E320-R324 PolarHBondContact OE1-NH2 3.32Å; E320-R324 VanDerWaalsContact OE1-NH2 3.13Å; E320-L361 HydrophobicContact CB-CD1 4.21Å; E320-L378 HydrophobicContact CB-CB 4.14Å; E320-L378 HydrophobicContact CB-CD1 4.08Å; E320-L378 HydrophobicContact CG-CB 3.92Å; E320-A379 WeakPolarHBondContact OE1-CA 3.26Å; E320-F386 HydrophobicContact CB-CE2 4.13Å; E320-F386 HydrophobicContact CB-CZ 4.18Å; E320-F386 HydrophobicContact CG-CD2 4.41Å; E320-F386 HydrophobicContact CG-CE2 3.56Å; E320-F386 HydrophobicContact CG-CZ 3.77Å
321	T	95.9	Very high	92.2	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-59.8	-50	172	-62.8	0	0	0	0	111	R264 L265 Y268 V317 Y318 R323 R324 E325 F386	R264-T321 HydrophobicContact CG-CG2 4.4Å; L265-T321 HydrophobicContact CD2-CG2 4.14Å; L265-T321 VanDerWaalsContact CD2-OG1 3.28Å; L265-T321 WeakPolarHBondContact CD2-OG1 3.37Å; Y268-T321 HydrophobicContact CD2-CG2 3.71Å; Y268-T321 HydrophobicContact CG-CG2 3.75Å; V317-T321 PolarHBondContact O-N 3.21Å; V317-T321 PolarHBondContact O-OG1 3.24Å; V317-T321 VanDerWaalsContact O-OG1 3.11Å; Y318-T321 WeakPolarHBondContact O-CB 3.42Å; Y318-T321 PolarHBondContact O-N 3.41Å; T321-R323 VanDerWaalsContact C-N 3.33Å; T321-R323 PolarHBondContact O-N 3.06Å; T321-R324 PolarHBondContact O-N 2.82Å; T321-E325 WeakPolarHBondContact O-CG 3.39Å; T321-E325 PolarHBondContact O-N 3.17Å; T321-F386 WeakPolarHBondContact OG1-CZ 3.49Å
322	D	94.3	Very high	91.5	Very high	7 Å²	7	27.4 Å²	27.4	4%	0.037	14%	0.144	C	C	.	.	H	α-helix	trans	-58.1	-43.2	175.3	-177.7	74.5	0	0	0	111.2	R48 R264 Y318 D319 E325 I326	R48-D322 WeakPolarHBondContact CD-OD2 3.28Å; R48-D322 WeakPolarHBondContact CG-OD2 3.46Å; R48-D322 IonicContact CZ-OD2 3.21Å; R48-D322 IonicContact NE-OD1 3.95Å; R48-D322 IonicContact NE-OD2 3.6Å; R48-D322 PolarHBondContact NE-OD2 3.06Å; R264-D322 IonicContact CZ-OD1 2.85Å; R264-D322 IonicContact NH1-OD1 2.73Å; R264-D322 PolarHBondContact NH1-OD1 2.71Å; R264-D322 IonicContact NH2-OD1 2.82Å; R264-D322 PolarHBondContact NH2-OD1 2.98Å; Y318-D322 HydrophobicContact CE1-CB 4.41Å; Y318-D322 WeakPolarHBondContact O-CB 3.31Å; Y318-D322 PolarHBondContact O-N 3.42Å; D319-D322 PolarHBondContact O-N 3.44Å; D322-E325 PolarHBondContact O-N 2.82Å; D322-I326 WeakPolarHBondContact O-CB 3.38Å; D322-I326 WeakPolarHBondContact O-CD1 3.42Å; D322-I326 WeakPolarHBondContact O-CG1 3.33Å; D322-I326 PolarHBondContact O-N 3.44Å; D322-I326 VanDerWaalsContact OD2-CD1 3.23Å; D322-I326 WeakPolarHBondContact OD2-CD1 3.49Å
323	R	95.2	Very high	90.5	Very high	28 Å²	28	25.6 Å²	25.6	11%	0.106	14%	0.137	C	C	.	.	H	α-helix	trans	-59.5	-47.4	175	-165.5	-166.8	68.2	68.3	14	112	D319 E320 T321 I326 D327 V358 P359 L361	D319-R323 WeakPolarHBondContact O-CB 3.45Å; D319-R323 PolarHBondContact O-N 2.93Å; E320-R323 PolarHBondContact O-N 2.76Å; E320-R323 IonicContact OE1-CZ 2.78Å; E320-R323 IonicContact OE1-NE 2.84Å; E320-R323 IonicContact OE1-NH2 3.35Å; E320-R323 PolarHBondContact OE1-NH2 3.34Å; E320-R323 IonicContact OE2-CZ 3.64Å; E320-R323 IonicContact OE2-NE 2.79Å; E320-R323 PolarHBondContact OE2-NE 3.4Å; E320-R323 IonicContact OE2-NH2 3.48Å; T321-R323 VanDerWaalsContact C-N 3.33Å; T321-R323 PolarHBondContact O-N 3.06Å; R323-I326 PolarHBondContact O-N 2.89Å; R323-D327 IonicContact CZ-OD2 3.79Å; R323-D327 IonicContact NH1-OD2 3.2Å; R323-D327 PolarHBondContact NH1-OD2 3.41Å; R323-D327 WeakPolarHBondContact O-CB 3.4Å; R323-D327 PolarHBondContact O-N 3.32Å; R323-V358 PolarHBondContact NH1-O 2.83Å; R323-P359 PolarHBondContact NH1-O 3.43Å; R323-L361 HydrophobicContact CB-CD2 4.05Å; R323-L361 HydrophobicContact CG-CD2 4.45Å
324	R	94.7	Very high	89.2	Confident	32 Å²	32	25.4 Å²	25.4	12%	0.121	14%	0.135	C	C	.	.	H	α-helix	trans	-65.5	-36.4	178.8	-71	179.4	-173.4	-137.1	-2.7	112.5	Y268 E320 T321 S328 L378 L381	Y268-R324 HydrophobicContact CE2-CB 3.9Å; Y268-R324 WeakPolarHBondContact OH-CD 3.49Å; E320-R324 WeakPolarHBondContact O-CG 3.38Å; E320-R324 PolarHBondContact O-N 2.93Å; E320-R324 IonicContact OE1-CZ 2.68Å; E320-R324 IonicContact OE1-NE 3.06Å; E320-R324 PolarHBondContact OE1-NE 3.49Å; E320-R324 IonicContact OE1-NH2 3.7Å; E320-R324 PolarHBondContact OE1-NH2 3.32Å; E320-R324 VanDerWaalsContact OE1-NH2 3.13Å; T321-R324 PolarHBondContact O-N 2.82Å; R324-S328 WeakPolarHBondContact O-CB 3.4Å; R324-S328 PolarHBondContact O-N 3.13Å; R324-S328 VanDerWaalsContact O-N 3.07Å; R324-S328 PolarHBondContact O-OG 3.45Å; R324-L378 PolarHBondContact NH2-O 3.4Å; R324-L378 VanDerWaalsContact NH2-O 3.08Å; R324-L381 PolarHBondContact NH1-O 2.69Å; R324-L381 VanDerWaalsContact NH1-O 3.11Å; R324-L381 PolarHBondContact NH2-O 2.89Å
325	E	92.4	Very high	87.3	Confident	29 Å²	29	29.9 Å²	29.9	14%	0.136	16%	0.158	C	C	.	.	H	α-helix	trans	-67	-45.1	173.1	-73.4	-176.8	177.9	0	0	112.1	R264 Y268 T321 D322 S328 A329	R264-E325 IonicContact CZ-OE2 2.69Å; R264-E325 IonicContact NE-OE1 3.58Å; R264-E325 IonicContact NE-OE2 2.77Å; R264-E325 PolarHBondContact NE-OE2 2.96Å; R264-E325 IonicContact NH2-OE2 3.58Å; R264-E325 PolarHBondContact NH2-OE2 3.42Å; Y268-E325 HydrophobicContact CD2-CG 3.83Å; Y268-E325 HydrophobicContact CE2-CG 4.26Å; T321-E325 WeakPolarHBondContact O-CG 3.39Å; T321-E325 PolarHBondContact O-N 3.17Å; D322-E325 PolarHBondContact O-N 2.82Å; E325-S328 PolarHBondContact O-N 3.15Å; E325-A329 WeakPolarHBondContact O-CB 3.35Å; E325-A329 PolarHBondContact O-N 2.92Å
326	I	91.8	Very high	85.4	Confident	13 Å²	13	35 Å²	35	7%	0.067	18%	0.18	C	C	.	.	H	α-helix	trans	-63.5	-42.9	177.8	-70.1	162.5	0	0	0	110.6	W26 R44 V53 D322 R323 S328 A329 W330	W26-I326 HydrophobicContact CZ3-CG2 4.4Å; R44-I326 HydrophobicContact CG-CG2 3.9Å; V53-I326 HydrophobicContact CG2-CD1 3.84Å; V53-I326 HydrophobicContact CG2-CG1 4.35Å; V53-I326 HydrophobicContact CG2-CG2 4.02Å; V53-I326 WeakPolarHBondContact O-CD1 3.43Å; D322-I326 WeakPolarHBondContact O-CB 3.38Å; D322-I326 WeakPolarHBondContact O-CD1 3.42Å; D322-I326 WeakPolarHBondContact O-CG1 3.33Å; D322-I326 PolarHBondContact O-N 3.44Å; D322-I326 VanDerWaalsContact OD2-CD1 3.23Å; D322-I326 WeakPolarHBondContact OD2-CD1 3.49Å; R323-I326 PolarHBondContact O-N 2.89Å; I326-S328 VanDerWaalsContact C-N 3.33Å; I326-S328 PolarHBondContact O-N 3.34Å; I326-A329 PolarHBondContact O-N 2.94Å; I326-W330 WeakPolarHBondContact O-CB 3.38Å; I326-W330 PolarHBondContact O-N 2.78Å
327	D	90	Very high	83.4	Confident	29 Å²	29	36.4 Å²	36.4	16%	0.155	19%	0.191	C	C	.	.	H	α-helix	trans	-61	-41.8	174.8	-78.1	-3.7	0	0	0	111.7	R44 R323 W330 L331	R44-D327 IonicContact CZ-OD1 3.56Å; R44-D327 IonicContact NE-OD1 3.98Å; R44-D327 IonicContact NH2-OD1 2.85Å; R44-D327 PolarHBondContact NH2-OD1 3.15Å; R323-D327 IonicContact CZ-OD2 3.79Å; R323-D327 IonicContact NH1-OD2 3.2Å; R323-D327 PolarHBondContact NH1-OD2 3.41Å; R323-D327 WeakPolarHBondContact O-CB 3.4Å; R323-D327 PolarHBondContact O-N 3.32Å; D327-W330 WeakPolarHBondContact O-CB 3.33Å; D327-W330 PolarHBondContact O-N 2.58Å; D327-L331 WeakPolarHBondContact O-CB 3.46Å; D327-L331 WeakPolarHBondContact O-CG 3.41Å; D327-L331 PolarHBondContact O-N 3.03Å
328	S	87.8	Confident	81	Confident	68 Å²	68	37.7 Å²	37.7	48%	0.476	20%	0.198	S	C	.	.	H	α-helix	trans	-63.3	-46.9	175.7	-58.4	0	0	0	0	111.7	R324 E325 I326 W330 L331 V332	R324-S328 WeakPolarHBondContact O-CB 3.4Å; R324-S328 PolarHBondContact O-N 3.13Å; R324-S328 VanDerWaalsContact O-N 3.07Å; R324-S328 PolarHBondContact O-OG 3.45Å; E325-S328 PolarHBondContact O-N 3.15Å; I326-S328 VanDerWaalsContact C-N 3.33Å; I326-S328 PolarHBondContact O-N 3.34Å; S328-W330 VanDerWaalsContact C-N 3.3Å; S328-W330 PolarHBondContact O-N 3.24Å; S328-L331 PolarHBondContact O-N 3.07Å; S328-V332 WeakPolarHBondContact O-CG2 3.49Å; S328-V332 PolarHBondContact O-N 3.45Å; S328-V332 VanDerWaalsContact O-N 3.09Å
329	A	87.3	Confident	78.7	Confident	6 Å²	6	44.2 Å²	44.2	5%	0.05	23%	0.227	C	C	.	.	H	α-helix	trans	-63.4	-35.9	175.3	0	0	0	0	0	112.3	W26 K58 E325 I326 N333	W26-A329 HydrophobicContact CH2-CB 4.11Å; K58-A329 HydrophobicContact CB-CB 4.02Å; E325-A329 WeakPolarHBondContact O-CB 3.35Å; E325-A329 PolarHBondContact O-N 2.92Å; I326-A329 PolarHBondContact O-N 2.94Å; A329-N333 WeakPolarHBondContact O-CB 3.4Å; A329-N333 PolarHBondContact O-N 3.13Å
330	W	85.3	Confident	76.5	Confident	13 Å²	13	46.3 Å²	46.3	5%	0.049	25%	0.247	C	C	.	.	H	α-helix	trans	-65.1	-50.5	176.6	-178.1	-86.9	0	0	0	111.2	W26 T37 C40 C41 I326 D327 S328 V332 N333 E334	W26-W330 HydrophobicContact CH2-CB 4.17Å; W26-W330 HydrophobicContact CH2-CE3 4.06Å; W26-W330 HydrophobicContact CZ2-CB 4.44Å; W26-W330 HydrophobicContact CZ2-CD2 4.47Å; W26-W330 AromaticContact CZ2-CE3 3.66Å; W26-W330 HydrophobicContact CZ2-CE3 3.66Å; W26-W330 HydrophobicContact CZ2-CZ3 4.29Å; T37-W330 HydrophobicContact CG2-CH2 3.52Å; T37-W330 HydrophobicContact CG2-CZ2 4.13Å; T37-W330 HydrophobicContact CG2-CZ3 3.82Å; T37-W330 WeakPolarHBondContact O-CH2 3.35Å; T37-W330 WeakPolarHBondContact O-CZ3 3.34Å; C40-W330 HydrophobicContact CB-CZ3 4Å; C41-W330 HydrophobicContact CB-CH2 3.5Å; C41-W330 VanDerWaalsContact CB-CH2 3.5Å; C41-W330 HydrophobicContact CB-CZ2 3.93Å; C41-W330 HydrophobicContact CB-CZ3 4.18Å; I326-W330 WeakPolarHBondContact O-CB 3.38Å; I326-W330 PolarHBondContact O-N 2.78Å; D327-W330 WeakPolarHBondContact O-CB 3.33Å; D327-W330 PolarHBondContact O-N 2.58Å; S328-W330 VanDerWaalsContact C-N 3.3Å; S328-W330 PolarHBondContact O-N 3.24Å; W330-V332 VanDerWaalsContact C-N 3.32Å; W330-V332 PolarHBondContact O-N 3.39Å; W330-N333 PolarHBondContact O-N 3.1Å; W330-N333 VanDerWaalsContact O-N 3.11Å; W330-E334 HydrophobicContact CZ2-CG 4.18Å; W330-E334 PolarHBondContact O-N 2.75Å
331	L	80.9	Confident	74.2	Confident	104 Å²	104	53 Å²	53	55%	0.545	28%	0.276	S	S	.	.	H	α-helix	trans	-60.7	-39.9	177.7	-71.4	171.5	0	0	0	111.9	D327 S328 N333 L335	D327-L331 WeakPolarHBondContact O-CB 3.46Å; D327-L331 WeakPolarHBondContact O-CG 3.41Å; D327-L331 PolarHBondContact O-N 3.03Å; S328-L331 PolarHBondContact O-N 3.07Å; L331-N333 VanDerWaalsContact C-N 3.33Å; L331-N333 PolarHBondContact O-N 2.87Å; L331-L335 WeakPolarHBondContact O-CB 3.47Å; L331-L335 PolarHBondContact O-N 2.66Å
332	V	75.3	Confident	71.7	Confident	77 Å²	77	55.2 Å²	55.2	47%	0.467	29%	0.294	S	S	.	.	H	α-helix	trans	-67.6	-32.9	176	176.2	0	0	0	0	112.1	K58 S328 W330 F336	K58-V332 HydrophobicContact CD-CG1 3.67Å; K58-V332 HydrophobicContact CG-CG1 4.32Å; S328-V332 WeakPolarHBondContact O-CG2 3.49Å; S328-V332 PolarHBondContact O-N 3.45Å; S328-V332 VanDerWaalsContact O-N 3.09Å; W330-V332 VanDerWaalsContact C-N 3.32Å; W330-V332 PolarHBondContact O-N 3.39Å; V332-F336 PolarHBondContact O-N 3.13Å
333	N	69.8	Low	69.6	Low	12 Å²	12	59.2 Å²	59.2	6%	0.064	33%	0.328	C	S	.	.	H	α-helix	trans	-75	-48.3	176.5	-170.7	72.7	0	0	0	111.9	W26 T37 K58 A329 W330 L331 F336 C337	W26-N333 HydrophobicContact CZ2-CB 4.25Å; T37-N333 PolarHBondContact OG1-ND2 3.31Å; K58-N333 HydrophobicContact CG-CB 4.48Å; A329-N333 WeakPolarHBondContact O-CB 3.4Å; A329-N333 PolarHBondContact O-N 3.13Å; W330-N333 PolarHBondContact O-N 3.1Å; W330-N333 VanDerWaalsContact O-N 3.11Å; L331-N333 VanDerWaalsContact C-N 3.33Å; L331-N333 PolarHBondContact O-N 2.87Å; N333-F336 WeakPolarHBondContact O-CB 3.35Å; N333-F336 PolarHBondContact O-N 2.87Å; N333-C337 PolarHBondContact O-N 3.12Å; N333-C337 VanDerWaalsContact O-N 3.08Å
334	E	64.5	Low	67.4	Low	43 Å²	43	62.1 Å²	62.1	20%	0.201	35%	0.353	C	S	.	.	H	α-helix	trans	-61.6	-47.8	175.1	-81	-56.9	131.4	0	0	111.1	T37 W330 F336 C337 V338	T37-E334 VanDerWaalsContact CG2-OE1 3.3Å; T37-E334 WeakPolarHBondContact CG2-OE1 3.49Å; W330-E334 HydrophobicContact CZ2-CG 4.18Å; W330-E334 PolarHBondContact O-N 2.75Å; E334-F336 PolarHBondContact O-N 3.46Å; E334-C337 CarbonylContact O-C 3.51Å; E334-C337 PolarHBondContact O-N 3.43Å; E334-V338 WeakPolarHBondContact O-CB 3.18Å; E334-V338 WeakPolarHBondContact O-CG2 3.36Å; E334-V338 PolarHBondContact O-N 3.47Å
335	L	55.6	Low	65	Low	96 Å²	96	65.5 Å²	65.5	50%	0.503	37%	0.373	S	S	.	.	H	α-helix	trans	-57.9	-29.3	178.9	-168.4	69.9	0	0	0	112.5	L331 K339	L331-L335 WeakPolarHBondContact O-CB 3.47Å; L331-L335 PolarHBondContact O-N 2.66Å; L335-K339 WeakPolarHBondContact O-CB 3.3Å; L335-K339 WeakPolarHBondContact O-CG 3.33Å; L335-K339 PolarHBondContact O-N 2.94Å
336	F	53.1	Low	62.9	Low	142 Å²	142	70.1 Å²	70.1	62%	0.623	41%	0.408	S	S	*	.	H	α-helix	trans	-73.1	-47.7	172.8	-171.5	-95.2	0	0	0	112	V332 N333 E334 V338 K339 A340	V332-F336 PolarHBondContact O-N 3.13Å; N333-F336 WeakPolarHBondContact O-CB 3.35Å; N333-F336 PolarHBondContact O-N 2.87Å; E334-F336 PolarHBondContact O-N 3.46Å; F336-V338 VanDerWaalsContact C-N 3.32Å; F336-V338 PolarHBondContact O-N 3.2Å; F336-K339 PolarHBondContact O-N 3.47Å; F336-A340 PolarHBondContact O-N 3.11Å
337	C	51.7	Low	60.4	Low	42 Å²	42	73 Å²	73	28%	0.284	43%	0.426	S	S	.	.	H	α-helix	trans	-63.7	-36.1	174.9	-69.1	0	0	0	0	112.9	N333 E334 A340 K341	N333-C337 PolarHBondContact O-N 3.12Å; N333-C337 VanDerWaalsContact O-N 3.08Å; E334-C337 CarbonylContact O-C 3.51Å; E334-C337 PolarHBondContact O-N 3.43Å; C337-A340 PolarHBondContact O-N 3.16Å; C337-K341 WeakPolarHBondContact O-CB 3.34Å; C337-K341 WeakPolarHBondContact O-CG 3.44Å; C337-K341 PolarHBondContact O-N 3.04Å
338	V	47.5	Very low	58.2	Low	26 Å²	26	81.1 Å²	81.1	16%	0.158	46%	0.46	C	S	.	.	H	α-helix	trans	-64.1	-48.1	173.8	155.4	0	0	0	0	110.6	E334 F336 A340 K341 A342 L351	E334-V338 WeakPolarHBondContact O-CB 3.18Å; E334-V338 WeakPolarHBondContact O-CG2 3.36Å; E334-V338 PolarHBondContact O-N 3.47Å; F336-V338 VanDerWaalsContact C-N 3.32Å; F336-V338 PolarHBondContact O-N 3.2Å; V338-A340 VanDerWaalsContact C-N 3.31Å; V338-A340 PolarHBondContact O-N 3.16Å; V338-K341 PolarHBondContact O-N 3.48Å; V338-A342 WeakPolarHBondContact O-CB 3.43Å; V338-A342 PolarHBondContact O-N 2.73Å; V338-L351 HydrophobicContact CB-CD2 4.09Å; V338-L351 HydrophobicContact CG1-CB 4.04Å; V338-L351 HydrophobicContact CG1-CD2 3.65Å; V338-L351 HydrophobicContact CG1-CG 4.43Å; V338-L351 HydrophobicContact CG2-CB 3.94Å; V338-L351 HydrophobicContact CG2-CD2 4.1Å; V338-L351 VanDerWaalsContact CG2-O 3.31Å; V338-L351 WeakPolarHBondContact CG2-O 3.48Å
339	K	47.4	Very low	56	Low	142 Å²	142	82.4 Å²	82.4	62%	0.617	48%	0.475	S	S	*	.	H	α-helix	trans	-61.9	-38.8	174	-77.2	172.4	-180	-177.3	0	111.9	L335 F336 A343	L335-K339 WeakPolarHBondContact O-CB 3.3Å; L335-K339 WeakPolarHBondContact O-CG 3.33Å; L335-K339 PolarHBondContact O-N 2.94Å; F336-K339 PolarHBondContact O-N 3.47Å; K339-A343 PolarHBondContact O-N 3.3Å
340	A	49.6	Very low	53.8	Low	64 Å²	64	89.8 Å²	89.8	53%	0.529	51%	0.509	S	S	.	.	H	α-helix	trans	-68	-37.7	175.9	0	0	0	0	0	113.5	F336 C337 V338	F336-A340 PolarHBondContact O-N 3.11Å; C337-A340 PolarHBondContact O-N 3.16Å; V338-A340 VanDerWaalsContact C-N 3.31Å; V338-A340 PolarHBondContact O-N 3.16Å
341	K	47.5	Very low	51.9	Low	140 Å²	140	91.2 Å²	91.2	61%	0.609	52%	0.517	S	S	*	.	H	α-helix	trans	-79.7	-33.2	176.4	-74.3	178.4	177.9	177.2	0	113.5	C337 V338 A343 S344 L345	C337-K341 WeakPolarHBondContact O-CB 3.34Å; C337-K341 WeakPolarHBondContact O-CG 3.44Å; C337-K341 PolarHBondContact O-N 3.04Å; V338-K341 PolarHBondContact O-N 3.48Å; K341-A343 PolarHBondContact O-N 2.89Å; K341-S344 CarbonylContact O-C 3.58Å; K341-S344 WeakPolarHBondContact O-CA 3.28Å; K341-S344 PolarHBondContact O-N 3.41Å; K341-S344 PolarHBondContact O-OG 3.14Å; K341-L345 PolarHBondContact O-N 2.94Å
342	A	44.9	Very low	50.4	Low	47 Å²	47	90.7 Å²	90.7	39%	0.388	52%	0.518	S	S	.	.	H	α-helix	trans	-69.5	-20.2	175.4	0	0	0	0	0	112.4	V338 S344 L351	V338-A342 WeakPolarHBondContact O-CB 3.43Å; V338-A342 PolarHBondContact O-N 2.73Å; A342-S344 PolarHBondContact O-N 3.36Å; A342-L351 HydrophobicContact CB-CD2 4.22Å
343	A	48.8	Very low	49.2	Very low	91 Å²	91	89 Å²	89	75%	0.752	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-11.6	166.4	0	0	0	0	0	113.3	K339 K341	K339-A343 PolarHBondContact O-N 3.3Å; K341-A343 PolarHBondContact O-N 2.89Å
344	S	48.9	Very low	48.4	Very low	88 Å²	88	96.8 Å²	96.8	62%	0.615	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.1	-10	179.6	62.9	0	0	0	0	115.5	K341 A342	K341-S344 CarbonylContact O-C 3.58Å; K341-S344 WeakPolarHBondContact O-CA 3.28Å; K341-S344 PolarHBondContact O-N 3.41Å; K341-S344 PolarHBondContact O-OG 3.14Å; A342-S344 PolarHBondContact O-N 3.36Å
345	L	45.2	Very low	48	Very low	104 Å²	104	104.1 Å²	104.1	55%	0.545	57%	0.572	S	S	.	*			trans	-133.5	134.4	173.6	-80.7	89.9	0	0	0	111.8	K341 T347	K341-L345 PolarHBondContact O-N 2.94Å; L345-T347 VanDerWaalsContact C-N 3.29Å; L345-T347 PolarHBondContact O-N 3.46Å
346	S	47.1	Very low	48.5	Very low	126 Å²	126	103.4 Å²	103.4	88%	0.881	56%	0.563	S	S	*	*	S	Bend	trans	-76.4	-6.8	-177.8	54.5	0	0	0	0	115.1	K348	S346-K348 PolarHBondContact O-N 3Å
347	T	40.6	Very low	49.5	Very low	72 Å²	72	100.4 Å²	100.4	44%	0.442	56%	0.556	S	S	.	*			trans	-91.9	84.6	-172.8	38.8	0	0	0	0	112.4	L345 A349 L351	L345-T347 VanDerWaalsContact C-N 3.29Å; L345-T347 PolarHBondContact O-N 3.46Å; T347-A349 PolarHBondContact O-N 3.25Å; T347-L351 WeakPolarHBondContact O-CD1 3.01Å
348	K	44.4	Very low	50.9	Low	200 Å²	200	99.2 Å²	99.2	87%	0.87	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	2.7	-178.8	-123.4	178.6	-175.2	179	0	117	S346 L351	S346-K348 PolarHBondContact O-N 3Å; K348-L351 WeakPolarHBondContact O-CD1 3.44Å
349	A	41.6	Very low	52.9	Low	96 Å²	96	101.6 Å²	101.6	79%	0.793	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.3	-20.4	-162.7	0	0	0	0	0	116.8	T347 L351	T347-A349 PolarHBondContact O-N 3.25Å; A349-L351 VanDerWaalsContact C-N 3.3Å; A349-L351 PolarHBondContact O-N 3.14Å
350	E	40.7	Very low	55.1	Low	160 Å²	160	99.4 Å²	99.4	75%	0.748	55%	0.554	S	S	*	*	S	Bend	trans	-84.7	2.3	179.3	-70.9	-176.8	121.3	0	0	114.1	V352	E350-V352 PolarHBondContact O-N 3.14Å
351	L	44.3	Very low	57.2	Low	44 Å²	44	96.7 Å²	96.7	23%	0.23	53%	0.53	C	S	.	.	S	Bend	trans	-85.3	0.3	-153.2	-68.8	105.6	0	0	0	116.9	V338 A342 T347 K348 A349	V338-L351 HydrophobicContact CB-CD2 4.09Å; V338-L351 HydrophobicContact CG1-CB 4.04Å; V338-L351 HydrophobicContact CG1-CD2 3.65Å; V338-L351 HydrophobicContact CG1-CG 4.43Å; V338-L351 HydrophobicContact CG2-CB 3.94Å; V338-L351 HydrophobicContact CG2-CD2 4.1Å; V338-L351 VanDerWaalsContact CG2-O 3.31Å; V338-L351 WeakPolarHBondContact CG2-O 3.48Å; A342-L351 HydrophobicContact CB-CD2 4.22Å; T347-L351 WeakPolarHBondContact O-CD1 3.01Å; K348-L351 WeakPolarHBondContact O-CD1 3.44Å; A349-L351 VanDerWaalsContact C-N 3.3Å; A349-L351 PolarHBondContact O-N 3.14Å
352	V	50.1	Low	59.4	Low	93 Å²	93	91 Å²	91	56%	0.564	51%	0.508	S	S	*	.	S	Bend	trans	-140.3	91.1	160.2	-174.7	0	0	0	0	107.9	E350 E354	E350-V352 PolarHBondContact O-N 3.14Å; V352-E354 PolarHBondContact O-N 3.43Å
353	S	50.9	Low	61.6	Low	41 Å²	41	94.1 Å²	94.1	29%	0.287	52%	0.517	S	S	.	.			trans	-65.1	125.9	172.2	-166.3	0	0	0	0	109.1	R355 Y356	S353-R355 PolarHBondContact O-N 3.07Å; S353-Y356 VanDerWaalsContact O-CD2 3.28Å; S353-Y356 WeakPolarHBondContact O-CD2 3.23Å; S353-Y356 PolarHBondContact O-N 2.83Å
354	E	51.5	Low	63.5	Low	176 Å²	176	90.5 Å²	90.5	82%	0.822	49%	0.485	S	S	*	.	G	3₁₀ helix	trans	-52.2	-25.6	178.6	-63	177.5	148.8	0	0	112.5	V352 Y356 V357	V352-E354 PolarHBondContact O-N 3.43Å; E354-Y356 PolarHBondContact O-N 2.7Å; E354-V357 PolarHBondContact O-N 2.95Å
355	R	56.8	Low	65.3	Low	197 Å²	197	89.9 Å²	89.9	74%	0.743	49%	0.485	S	S	*	.	G	3₁₀ helix	trans	-56.3	-11.2	173.7	-56.1	-179.6	-173.3	-177.2	3.4	115.1	S353	S353-R355 PolarHBondContact O-N 3.07Å
356	Y	66.8	Low	66.9	Low	81 Å²	81	89.7 Å²	89.7	32%	0.318	49%	0.485	S	S	.	.	G	3₁₀ helix	trans	-105.1	-1.8	178.7	-56.5	-56.6	0	0	0	114.5	C41 R44 L126 S353 E354	C41-Y356 HydrophobicContact CB-CD1 3.98Å; R44-Y356 PolarHBondContact NH1-O 3Å; L126-Y356 HydrophobicContact CD2-CD1 4.35Å; L126-Y356 HydrophobicContact CD2-CE1 3.52Å; S353-Y356 VanDerWaalsContact O-CD2 3.28Å; S353-Y356 WeakPolarHBondContact O-CD2 3.23Å; S353-Y356 PolarHBondContact O-N 2.83Å; E354-Y356 PolarHBondContact O-N 2.7Å
357	V	72.4	Confident	68.6	Low	78 Å²	78	85.2 Å²	85.2	47%	0.473	45%	0.451	S	S	.	.			trans	-91	134.6	-178.6	-174.6	0	0	0	0	109.7	E354 P359	E354-V357 PolarHBondContact O-N 2.95Å; V357-P359 HydrophobicContact CG1-CB 4.34Å; V357-P359 WeakPolarHBondContact O-CD 3.48Å
358	V	82.3	Confident	70.8	Confident	17 Å²	17	83 Å²	83	10%	0.103	44%	0.44	C	S	.	.			trans	-113.3	81.3	172.2	-179.7	0	0	0	0	106.9	R44 R323 F360 P362	R44-V358 HydrophobicContact CB-CG2 3.91Å; R323-V358 PolarHBondContact NH1-O 2.83Å; V358-F360 WeakPolarHBondContact CG1-O 3.49Å; V358-F360 PolarHBondContact O-N 3.16Å; V358-F360 VanDerWaalsContact O-N 3.17Å; V358-P362 HydrophobicContact CG1-CG 3.91Å
359	P	88.3	Confident	72.8	Confident	76 Å²	76	77.1 Å²	77.1	49%	0.494	43%	0.429	S	S	.	.			trans	-68.6	-18.5	-162.8	27	-36	0	0	0	114	R323 V357 A379	R323-P359 PolarHBondContact NH1-O 3.43Å; V357-P359 HydrophobicContact CG1-CB 4.34Å; V357-P359 WeakPolarHBondContact O-CD 3.48Å; P359-A379 WeakPolarHBondContact O-CB 3.33Å
360	F	94.4	Very high	75.2	Confident	96 Å²	96	76.2 Å²	76.2	42%	0.421	42%	0.415	S	S	.	.	S	Bend	trans	-148.7	168.9	177.9	48.3	-108.7	0	0	0	109.7	V358 P362 Q376 A379	V358-F360 WeakPolarHBondContact CG1-O 3.49Å; V358-F360 PolarHBondContact O-N 3.16Å; V358-F360 VanDerWaalsContact O-N 3.17Å; F360-P362 WeakPolarHBondContact O-CD 3.32Å; F360-Q376 HydrophobicContact CB-CB 4.36Å; F360-Q376 HydrophobicContact CB-CG 4.33Å; F360-Q376 HydrophobicContact CD2-CB 4.43Å; F360-Q376 HydrophobicContact CD2-CG 3.75Å; F360-Q376 HydrophobicContact CE2-CG 4.42Å; F360-Q376 HydrophobicContact CG-CB 4.46Å; F360-Q376 HydrophobicContact CG-CG 4.24Å; F360-A379 HydrophobicContact CB-CB 3.64Å
361	L	94.7	Very high	77.6	Confident	7 Å²	7	70.3 Å²	70.3	4%	0.037	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-58.1	127.5	179.2	-72.6	172.4	0	0	0	112.5	D319 E320 R323 R375 Q376	D319-L361 HydrophobicContact CB-CD1 3.8Å; D319-L361 HydrophobicContact CB-CD2 3.87Å; E320-L361 HydrophobicContact CB-CD1 4.21Å; R323-L361 HydrophobicContact CB-CD2 4.05Å; R323-L361 HydrophobicContact CG-CD2 4.45Å; L361-R375 HydrophobicContact CB-CB 4.47Å; L361-R375 HydrophobicContact CD1-CB 3.91Å; L361-R375 HydrophobicContact CD1-CG 4.46Å; L361-Q376 VanDerWaalsContact O-CG 3.31Å; L361-Q376 WeakPolarHBondContact O-CG 3.42Å; L361-Q376 PolarHBondContact O-NE2 3.49Å; L361-Q376 VanDerWaalsContact O-NE2 3.14Å
362	P	93.4	Very high	79.9	Confident	21 Å²	21	68.8 Å²	68.8	14%	0.136	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-56.7	149.2	172.3	-27.3	36.4	0	0	0	112.4	R44 S45 V358 F360 N364	R44-P362 WeakPolarHBondContact O-CG 3.26Å; S45-P362 WeakPolarHBondContact O-CB 3.43Å; V358-P362 HydrophobicContact CG1-CG 3.91Å; F360-P362 WeakPolarHBondContact O-CD 3.32Å; P362-N364 PolarHBondContact O-N 3.32Å
363	L	91.3	Very high	82	Confident	112 Å²	112	69.4 Å²	69.4	59%	0.586	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-61.8	134	175.5	-65.4	174.3	0	0	0	110.2	H49 N372	H49-L363 PolarHBondContact CE1-O 3.12Å; H49-L363 VanDerWaalsContact CE1-O 3.25Å; L363-N372 HydrophobicContact CD2-CB 3.79Å
364	N	88.7	Confident	84.1	Confident	15 Å²	15	76.1 Å²	76.1	8%	0.08	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-103.5	120.7	164.7	-178.7	-6.2	0	0	0	108.6	H49 P362 D366 L367 N372	H49-N364 PolarHBondContact CD2-OD1 3.26Å; H49-N364 VanDerWaalsContact CD2-OD1 3.31Å; P362-N364 PolarHBondContact O-N 3.32Å; N364-D366 PolarHBondContact O-N 3.45Å; N364-D366 WeakPolarHBondContact OD1-CB 3.48Å; N364-D366 PolarHBondContact OD1-N 2.92Å; N364-D366 PolarHBondContact OD1-OD2 3.44Å; N364-L367 HydrophobicContact CB-CB 4.43Å; N364-L367 HydrophobicContact CB-CD1 3.99Å; N364-L367 HydrophobicContact CB-CG 3.94Å; N364-L367 PolarHBondContact O-N 2.85Å; N364-N372 PolarHBondContact N-OD1 3.34Å; N364-N372 PolarHBondContact O-ND2 3.33Å
365	A	85.8	Confident	86.2	Confident	75 Å²	75	68.4 Å²	68.4	62%	0.62	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-27.7	-179.6	0	0	0	0	0	113.1	L367	A365-L367 PolarHBondContact O-N 3.08Å
366	D	77.9	Confident	88.1	Confident	100 Å²	100	61.6 Å²	61.6	54%	0.535	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-8.6	-179.6	-49.7	-41.3	0	0	0	112.9	N364	N364-D366 PolarHBondContact O-N 3.45Å; N364-D366 WeakPolarHBondContact OD1-CB 3.48Å; N364-D366 PolarHBondContact OD1-N 2.92Å; N364-D366 PolarHBondContact OD1-OD2 3.44Å
367	L	84.4	Confident	89.5	Confident	33 Å²	33	62.1 Å²	62.1	17%	0.173	34%	0.337	C	S	.	.	S	Bend	trans	-104.5	135.8	179.7	-58.1	-175.2	0	0	0	111.4	N364 A365 R371 N372	N364-L367 HydrophobicContact CB-CB 4.43Å; N364-L367 HydrophobicContact CB-CD1 3.99Å; N364-L367 HydrophobicContact CB-CG 3.94Å; N364-L367 PolarHBondContact O-N 2.85Å; A365-L367 PolarHBondContact O-N 3.08Å; L367-R371 HydrophobicContact CD1-CG 4.38Å; L367-N372 PolarHBondContact O-ND2 2.92Å
368	A	85.5	Confident	90.7	Very high	25 Å²	25	59.4 Å²	59.4	21%	0.207	32%	0.32	C	S	.	.			trans	-55	143.5	174.2	0	0	0	0	0	111.7	P370 R371 N372	A368-P370 VanDerWaalsContact C-CD 3.43Å; A368-P370 VanDerWaalsContact C-N 3.32Å; A368-P370 VanDerWaalsContact O-N 3.16Å; A368-R371 PolarHBondContact O-N 3.34Å; A368-N372 PolarHBondContact O-N 2.87Å; A368-N372 VanDerWaalsContact O-N 3.15Å
369	A	86.7	Confident	91.3	Very high	77 Å²	77	60 Å²	60	64%	0.636	33%	0.326	S	S	*	.	H	α-helix	trans	-51.2	-40	-176.3	0	0	0	0	0	114.4	R371 N372 Q373	A369-R371 VanDerWaalsContact C-N 3.32Å; A369-R371 PolarHBondContact O-N 3.18Å; A369-N372 PolarHBondContact O-N 3.22Å; A369-Q373 WeakPolarHBondContact O-CB 3.42Å; A369-Q373 PolarHBondContact O-N 3.32Å
370	P	92.2	Very high	91.6	Very high	77 Å²	77	64.6 Å²	64.6	50%	0.5	34%	0.339	S	S	.	.	H	α-helix	trans	-62.1	-33.6	174.5	-24.3	35.8	0	0	0	114	A368 R374	A368-P370 VanDerWaalsContact C-CD 3.43Å; A368-P370 VanDerWaalsContact C-N 3.32Å; A368-P370 VanDerWaalsContact O-N 3.16Å; P370-R374 VanDerWaalsContact O-CG 3.28Å; P370-R374 WeakPolarHBondContact O-CG 3.48Å; P370-R374 PolarHBondContact O-N 2.89Å
371	R	91.2	Very high	91.6	Very high	35 Å²	35	62.3 Å²	62.3	13%	0.132	33%	0.331	C	S	.	.	H	α-helix	trans	-72.5	-42.9	176.3	-171.8	174.3	177.9	-170.1	-0.1	110.9	K312 D316 L367 A368 A369 Q373 R374 R375	K312-R371 PolarHBondContact O-NH2 3.43Å; D316-R371 IonicContact OD1-CZ 3.69Å; D316-R371 IonicContact OD1-NE 2.78Å; D316-R371 PolarHBondContact OD1-NE 2.72Å; D316-R371 VanDerWaalsContact OD1-NE 3.08Å; D316-R371 IonicContact OD1-NH2 2.67Å; D316-R371 PolarHBondContact OD1-NH2 2.87Å; D316-R371 WeakPolarHBondContact OD2-CG 3.41Å; D316-R371 IonicContact OD2-CZ 2.8Å; D316-R371 IonicContact OD2-NE 3.82Å; D316-R371 PolarHBondContact OD2-NE 3.14Å; D316-R371 IonicContact OD2-NH2 3.62Å; L367-R371 HydrophobicContact CD1-CG 4.38Å; A368-R371 PolarHBondContact O-N 3.34Å; A369-R371 VanDerWaalsContact C-N 3.32Å; A369-R371 PolarHBondContact O-N 3.18Å; R371-Q373 VanDerWaalsContact C-N 3.33Å; R371-Q373 PolarHBondContact O-N 3.38Å; R371-R374 PolarHBondContact O-N 2.81Å; R371-R375 WeakPolarHBondContact O-CB 3.39Å; R371-R375 WeakPolarHBondContact O-CD 3.36Å; R371-R375 VanDerWaalsContact O-CG 3.28Å; R371-R375 WeakPolarHBondContact O-CG 3.42Å; R371-R375 PolarHBondContact O-N 3.42Å
372	N	93.1	Very high	91.4	Very high	12 Å²	12	65.8 Å²	65.8	6%	0.064	35%	0.35	C	S	.	.	H	α-helix	trans	-56.9	-45.1	171.2	-85.9	-57.4	0	0	0	112	L363 N364 L367 A368 A369 R374 R375 Q376	L363-N372 HydrophobicContact CD2-CB 3.79Å; N364-N372 PolarHBondContact N-OD1 3.34Å; N364-N372 PolarHBondContact O-ND2 3.33Å; L367-N372 PolarHBondContact O-ND2 2.92Å; A368-N372 PolarHBondContact O-N 2.87Å; A368-N372 VanDerWaalsContact O-N 3.15Å; A369-N372 PolarHBondContact O-N 3.22Å; N372-R374 PolarHBondContact O-N 2.88Å; N372-R375 PolarHBondContact O-N 2.76Å; N372-Q376 WeakPolarHBondContact O-CG 3.2Å; N372-Q376 PolarHBondContact O-N 2.64Å
373	Q	94.1	Very high	91.2	Very high	106 Å²	106	67.3 Å²	67.3	50%	0.495	37%	0.369	S	S	.	.	H	α-helix	trans	-62.2	-42.7	176.6	-166.5	-168.5	21.6	0	0	112.1	A369 R371 Q376 K377	A369-Q373 WeakPolarHBondContact O-CB 3.42Å; A369-Q373 PolarHBondContact O-N 3.32Å; R371-Q373 VanDerWaalsContact C-N 3.33Å; R371-Q373 PolarHBondContact O-N 3.38Å; Q373-Q376 PolarHBondContact O-N 3.21Å; Q373-K377 WeakPolarHBondContact O-CG 3.4Å; Q373-K377 PolarHBondContact O-N 3.41Å
374	R	93.8	Very high	91.1	Very high	183 Å²	183	68.7 Å²	68.7	69%	0.691	37%	0.366	S	S	*	.	H	α-helix	trans	-60.7	-47.3	175.1	-75.4	173.6	-174.7	-161	2.4	111.7	P370 R371 N372 Q376 K377 L378	P370-R374 VanDerWaalsContact O-CG 3.28Å; P370-R374 WeakPolarHBondContact O-CG 3.48Å; P370-R374 PolarHBondContact O-N 2.89Å; R371-R374 PolarHBondContact O-N 2.81Å; N372-R374 PolarHBondContact O-N 2.88Å; R374-Q376 VanDerWaalsContact C-N 3.33Å; R374-Q376 PolarHBondContact O-N 3.35Å; R374-K377 WeakPolarHBondContact O-CB 3.45Å; R374-K377 PolarHBondContact O-N 2.93Å; R374-K377 VanDerWaalsContact O-N 3.13Å; R374-L378 PolarHBondContact O-N 3.4Å
375	R	96.6	Very high	91.3	Very high	14 Å²	14	72.4 Å²	72.4	5%	0.053	38%	0.383	C	S	.	.	H	α-helix	trans	-56.5	-45	175.9	-72.4	160.6	62.9	83.1	5.4	111.8	D316 D319 L361 R371 N372 L378	D316-R375 HydrophobicContact CB-CG 3.74Å; D316-R375 WeakPolarHBondContact OD1-CD 3.21Å; D316-R375 WeakPolarHBondContact OD1-CG 3.19Å; D316-R375 IonicContact OD1-CZ 2.91Å; D316-R375 IonicContact OD1-NE 3.84Å; D316-R375 IonicContact OD1-NH1 3.78Å; D316-R375 PolarHBondContact OD1-NH1 3.4Å; D319-R375 IonicContact OD2-CZ 3.02Å; D319-R375 IonicContact OD2-NH1 3.75Å; D319-R375 PolarHBondContact OD2-NH1 3.2Å; D319-R375 IonicContact OD2-NH2 3.3Å; D319-R375 PolarHBondContact OD2-NH2 3.07Å; L361-R375 HydrophobicContact CB-CB 4.47Å; L361-R375 HydrophobicContact CD1-CB 3.91Å; L361-R375 HydrophobicContact CD1-CG 4.46Å; R371-R375 WeakPolarHBondContact O-CB 3.39Å; R371-R375 WeakPolarHBondContact O-CD 3.36Å; R371-R375 VanDerWaalsContact O-CG 3.28Å; R371-R375 WeakPolarHBondContact O-CG 3.42Å; R371-R375 PolarHBondContact O-N 3.42Å; N372-R375 PolarHBondContact O-N 2.76Å; R375-L378 WeakPolarHBondContact O-CB 3.42Å; R375-L378 PolarHBondContact O-N 3.25Å
376	Q	96.4	Very high	91.7	Very high	53 Å²	53	68.9 Å²	68.9	25%	0.248	35%	0.354	C	S	.	.	H	α-helix	trans	-69.5	-31.6	177	-70.5	177.8	-18.1	0	0	113.3	F360 L361 N372 Q373 R374 L378 A379	F360-Q376 HydrophobicContact CB-CB 4.36Å; F360-Q376 HydrophobicContact CB-CG 4.33Å; F360-Q376 HydrophobicContact CD2-CB 4.43Å; F360-Q376 HydrophobicContact CD2-CG 3.75Å; F360-Q376 HydrophobicContact CE2-CG 4.42Å; F360-Q376 HydrophobicContact CG-CB 4.46Å; F360-Q376 HydrophobicContact CG-CG 4.24Å; L361-Q376 VanDerWaalsContact O-CG 3.31Å; L361-Q376 WeakPolarHBondContact O-CG 3.42Å; L361-Q376 PolarHBondContact O-NE2 3.49Å; L361-Q376 VanDerWaalsContact O-NE2 3.14Å; N372-Q376 WeakPolarHBondContact O-CG 3.2Å; N372-Q376 PolarHBondContact O-N 2.64Å; Q373-Q376 PolarHBondContact O-N 3.21Å; R374-Q376 VanDerWaalsContact C-N 3.33Å; R374-Q376 PolarHBondContact O-N 3.35Å; Q376-L378 PolarHBondContact O-N 2.78Å; Q376-A379 PolarHBondContact O-N 3.1Å
377	K	96.6	Very high	92.4	Very high	93 Å²	93	64.9 Å²	64.9	40%	0.404	34%	0.335	S	S	.	.	H	α-helix	trans	-63.7	-25	173.5	-77.6	-175.8	177.7	-168.2	0	112.8	Q373 R374 A379 K380	Q373-K377 WeakPolarHBondContact O-CG 3.4Å; Q373-K377 PolarHBondContact O-N 3.41Å; R374-K377 WeakPolarHBondContact O-CB 3.45Å; R374-K377 PolarHBondContact O-N 2.93Å; R374-K377 VanDerWaalsContact O-N 3.13Å; K377-A379 PolarHBondContact O-N 2.91Å; K377-K380 WeakPolarHBondContact O-CB 3.43Å; K377-K380 PolarHBondContact O-N 3.45Å
378	L	96.6	Very high	92.7	Very high	20 Å²	20	64.3 Å²	64.3	11%	0.105	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-61.3	-30.7	176.4	-62.7	174.2	0	0	0	113.1	D316 V317 E320 R324 R374 R375 Q376 K380 L381 L389	D316-L378 HydrophobicContact CB-CD1 4.34Å; D316-L378 WeakPolarHBondContact O-CD1 3.28Å; V317-L378 HydrophobicContact CG2-CD1 4.08Å; V317-L378 HydrophobicContact CG2-CD2 4.23Å; E320-L378 HydrophobicContact CB-CB 4.14Å; E320-L378 HydrophobicContact CB-CD1 4.08Å; E320-L378 HydrophobicContact CG-CB 3.92Å; R324-L378 PolarHBondContact NH2-O 3.4Å; R324-L378 VanDerWaalsContact NH2-O 3.08Å; R374-L378 PolarHBondContact O-N 3.4Å; R375-L378 WeakPolarHBondContact O-CB 3.42Å; R375-L378 PolarHBondContact O-N 3.25Å; Q376-L378 PolarHBondContact O-N 2.78Å; L378-K380 PolarHBondContact O-N 3.27Å; L378-L381 HydrophobicContact CD2-CD1 4.14Å; L378-L381 WeakPolarHBondContact O-CB 3.45Å; L378-L381 PolarHBondContact O-N 3.29Å; L378-L381 VanDerWaalsContact O-N 3.15Å; L378-L389 HydrophobicContact CD2-CD2 4.13Å
379	A	95.1	Very high	93.1	Very high	29 Å²	29	65.2 Å²	65.2	24%	0.24	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-66.2	-17.9	176.2	0	0	0	0	0	113.6	E320 P359 F360 Q376 K377 L381	E320-A379 WeakPolarHBondContact OE1-CA 3.26Å; P359-A379 WeakPolarHBondContact O-CB 3.33Å; F360-A379 HydrophobicContact CB-CB 3.64Å; Q376-A379 PolarHBondContact O-N 3.1Å; K377-A379 PolarHBondContact O-N 2.91Å; A379-L381 VanDerWaalsContact C-N 3.31Å
380	K	94.9	Very high	93.5	Very high	173 Å²	173	61.5 Å²	61.5	75%	0.752	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-74.6	-20.5	174.5	-60.7	-168.5	174.4	-163.9	0	113.2	K377 L378 N382	K377-K380 WeakPolarHBondContact O-CB 3.43Å; K377-K380 PolarHBondContact O-N 3.45Å; L378-K380 PolarHBondContact O-N 3.27Å; K380-N382 PolarHBondContact O-N 2.84Å
381	L	94	Very high	93.5	Very high	49 Å²	49	58.7 Å²	58.7	26%	0.257	29%	0.286	S	S	.	.	S	Bend	trans	-69.7	122.9	-178.3	-61.1	174.5	0	0	0	110.2	R324 L378 A379 E385 F386 L389	R324-L381 PolarHBondContact NH1-O 2.69Å; R324-L381 VanDerWaalsContact NH1-O 3.11Å; R324-L381 PolarHBondContact NH2-O 2.89Å; L378-L381 HydrophobicContact CD2-CD1 4.14Å; L378-L381 WeakPolarHBondContact O-CB 3.45Å; L378-L381 PolarHBondContact O-N 3.29Å; L378-L381 VanDerWaalsContact O-N 3.15Å; A379-L381 VanDerWaalsContact C-N 3.31Å; L381-E385 WeakPolarHBondContact CA-OE2 3.5Å; L381-E385 HydrophobicContact CB-CB 4.15Å; L381-E385 HydrophobicContact CD2-CB 4.11Å; L381-F386 HydrophobicContact CB-CB 4.14Å; L381-F386 HydrophobicContact CB-CD2 4.45Å; L381-F386 HydrophobicContact CD1-CD2 4.14Å; L381-L389 HydrophobicContact CD1-CD2 3.76Å
382	N	91.7	Very high	93.6	Very high	80 Å²	80	57.9 Å²	57.9	43%	0.428	28%	0.284	S	S	.	.			trans	-66.1	169.9	174.3	74.2	54.4	0	0	0	110.9	K380 R384 E385 F386	K380-N382 PolarHBondContact O-N 2.84Å; N382-R384 PolarHBondContact O-N 3.35Å; N382-R384 WeakPolarHBondContact OD1-CA 3.41Å; N382-R384 VanDerWaalsContact OD1-CB 3.3Å; N382-R384 WeakPolarHBondContact OD1-CB 3.45Å; N382-R384 PolarHBondContact OD1-N 2.78Å; N382-E385 PolarHBondContact N-OE2 3.12Å; N382-E385 WeakPolarHBondContact ND2-CG 3.37Å; N382-E385 PolarHBondContact ND2-OE1 3.43Å; N382-E385 PolarHBondContact ND2-OE2 3.28Å; N382-E385 PolarHBondContact O-N 2.95Å; N382-E385 PolarHBondContact OD1-N 2.88Å; N382-F386 WeakPolarHBondContact O-CB 3.48Å; N382-F386 PolarHBondContact O-N 3.18Å
383	G	88.9	Confident	93.6	Very high	53 Å²	53	57.3 Å²	57.3	55%	0.546	28%	0.281	S	S	.	.	H	α-helix	trans	-57.2	-34	-176.6	0	0	0	0	0	114.1	A387	G383-A387 VanDerWaalsContact O-CB 3.28Å; G383-A387 WeakPolarHBondContact O-CB 3.31Å; G383-A387 PolarHBondContact O-N 3.07Å; G383-A387 VanDerWaalsContact O-N 3.11Å
384	R	89.3	Confident	93.6	Very high	140 Å²	140	52.3 Å²	52.3	53%	0.528	26%	0.258	S	S	.	.	H	α-helix	trans	-74.9	-44.6	-179.9	-167.4	-178.2	-177.2	-168	-4.2	111.4	G290 Q291 F292 N382 A388	G290-R384 PolarHBondContact O-NH2 3.48Å; Q291-R384 PolarHBondContact O-NE 3.27Å; Q291-R384 PolarHBondContact O-NH2 3Å; F292-R384 HydrophobicContact CD1-CG 3.6Å; F292-R384 WeakPolarHBondContact CD1-O 3.33Å; F292-R384 HydrophobicContact CE1-CB 4.28Å; F292-R384 HydrophobicContact CE1-CG 3.5Å; F292-R384 VanDerWaalsContact CE1-O 3.25Å; F292-R384 WeakPolarHBondContact CE1-O 3.4Å; N382-R384 PolarHBondContact O-N 3.35Å; N382-R384 WeakPolarHBondContact OD1-CA 3.41Å; N382-R384 VanDerWaalsContact OD1-CB 3.3Å; N382-R384 WeakPolarHBondContact OD1-CB 3.45Å; N382-R384 PolarHBondContact OD1-N 2.78Å; R384-A388 PolarHBondContact O-N 3.32Å
385	E	92.1	Very high	93.5	Very high	94 Å²	94	46.4 Å²	46.4	44%	0.439	24%	0.24	S	C	.	.	H	α-helix	trans	-65.7	-43.2	176.9	-67.9	165.4	162	0	0	112.3	L381 N382 A388 L389	L381-E385 WeakPolarHBondContact CA-OE2 3.5Å; L381-E385 HydrophobicContact CB-CB 4.15Å; L381-E385 HydrophobicContact CD2-CB 4.11Å; N382-E385 PolarHBondContact N-OE2 3.12Å; N382-E385 WeakPolarHBondContact ND2-CG 3.37Å; N382-E385 PolarHBondContact ND2-OE1 3.43Å; N382-E385 PolarHBondContact ND2-OE2 3.28Å; N382-E385 PolarHBondContact O-N 2.95Å; N382-E385 PolarHBondContact OD1-N 2.88Å; E385-A388 PolarHBondContact O-N 3.29Å; E385-L389 PolarHBondContact O-N 3.29Å
386	F	94.2	Very high	93.3	Very high	1 Å²	1	45.9 Å²	45.9	0%	0.004	24%	0.238	C	C	.	.	H	α-helix	trans	-64.5	-45.6	178.1	-168.8	-110.5	0	0	0	110.6	Y268 V317 E320 T321 L381 N382 A388 L389 L390	Y268-F386 HydrophobicContact CD1-CE1 4.27Å; Y268-F386 AromaticContact CE1-CD1 3.76Å; Y268-F386 HydrophobicContact CE1-CD1 3.76Å; Y268-F386 AromaticContact CE1-CE1 3.79Å; Y268-F386 HydrophobicContact CE1-CE1 3.79Å; V317-F386 HydrophobicContact CG1-CE2 4.32Å; V317-F386 HydrophobicContact CG1-CZ 4.35Å; E320-F386 HydrophobicContact CB-CE2 4.13Å; E320-F386 HydrophobicContact CB-CZ 4.18Å; E320-F386 HydrophobicContact CG-CD2 4.41Å; E320-F386 HydrophobicContact CG-CE2 3.56Å; E320-F386 HydrophobicContact CG-CZ 3.77Å; T321-F386 WeakPolarHBondContact OG1-CZ 3.49Å; L381-F386 HydrophobicContact CB-CB 4.14Å; L381-F386 HydrophobicContact CB-CD2 4.45Å; L381-F386 HydrophobicContact CD1-CD2 4.14Å; N382-F386 WeakPolarHBondContact O-CB 3.48Å; N382-F386 PolarHBondContact O-N 3.18Å; F386-A388 VanDerWaalsContact C-N 3.34Å; F386-A388 PolarHBondContact O-N 3.09Å; F386-L389 WeakPolarHBondContact O-CB 3.32Å; F386-L389 PolarHBondContact O-N 2.87Å; F386-L390 HydrophobicContact CD1-CD1 4.23Å; F386-L390 HydrophobicContact CD1-CG 4.27Å; F386-L390 HydrophobicContact CE1-CD1 3.9Å; F386-L390 HydrophobicContact CE1-CD2 4.03Å; F386-L390 HydrophobicContact CE1-CG 4.11Å; F386-L390 HydrophobicContact CE2-CD2 4.34Å; F386-L390 HydrophobicContact CZ-CD2 3.91Å; F386-L390 HydrophobicContact CZ-CG 4.48Å; F386-L390 WeakPolarHBondContact O-CG 3.49Å; F386-L390 PolarHBondContact O-N 3.25Å
387	A	92.9	Very high	93.1	Very high	15 Å²	15	43.3 Å²	43.3	12%	0.124	23%	0.226	C	C	.	.	H	α-helix	trans	-58.5	-42.7	175.1	0	0	0	0	0	112.6	L269 F292 G383 L389 L390 I391	L269-A387 HydrophobicContact CD2-CB 3.77Å; F292-A387 HydrophobicContact CE1-CB 3.93Å; F292-A387 HydrophobicContact CZ-CB 3.81Å; G383-A387 VanDerWaalsContact O-CB 3.28Å; G383-A387 WeakPolarHBondContact O-CB 3.31Å; G383-A387 PolarHBondContact O-N 3.07Å; G383-A387 VanDerWaalsContact O-N 3.11Å; A387-L389 PolarHBondContact O-N 3.28Å; A387-L390 PolarHBondContact O-N 2.84Å; A387-I391 WeakPolarHBondContact O-CD1 3.46Å; A387-I391 VanDerWaalsContact O-CG1 3.27Å; A387-I391 WeakPolarHBondContact O-CG1 3.42Å; A387-I391 PolarHBondContact O-N 2.98Å
388	A	91.7	Very high	92.9	Very high	21 Å²	21	44.6 Å²	44.6	17%	0.174	23%	0.232	C	C	.	.	H	α-helix	trans	-60.2	-43.5	175.1	0	0	0	0	0	112.3	F292 R384 E385 F386 I391 D392	F292-A388 HydrophobicContact CB-CB 4.11Å; F292-A388 HydrophobicContact CD1-CB 3.96Å; F292-A388 HydrophobicContact CG-CB 4.11Å; R384-A388 PolarHBondContact O-N 3.32Å; E385-A388 PolarHBondContact O-N 3.29Å; F386-A388 VanDerWaalsContact C-N 3.34Å; F386-A388 PolarHBondContact O-N 3.09Å; A388-I391 PolarHBondContact O-N 3.26Å; A388-D392 PolarHBondContact O-N 3.24Å
389	L	93.5	Very high	92.6	Very high	44 Å²	44	46.6 Å²	46.6	23%	0.23	24%	0.238	C	C	.	.	H	α-helix	trans	-61.5	-43.2	175.1	176.3	62.3	0	0	0	112.1	V317 L378 L381 E385 F386 A387 I391 D392 I393	V317-L389 HydrophobicContact CG2-CD2 3.98Å; L378-L389 HydrophobicContact CD2-CD2 4.13Å; L381-L389 HydrophobicContact CD1-CD2 3.76Å; E385-L389 PolarHBondContact O-N 3.29Å; F386-L389 WeakPolarHBondContact O-CB 3.32Å; F386-L389 PolarHBondContact O-N 2.87Å; A387-L389 PolarHBondContact O-N 3.28Å; L389-I391 VanDerWaalsContact C-N 3.34Å; L389-I391 PolarHBondContact O-N 2.99Å; L389-D392 PolarHBondContact O-N 3.2Å; L389-I393 HydrophobicContact CD1-CD1 3.89Å; L389-I393 HydrophobicContact CD1-CG1 4.27Å; L389-I393 HydrophobicContact CG-CD1 3.97Å; L389-I393 WeakPolarHBondContact O-CB 3.49Å; L389-I393 WeakPolarHBondContact O-CG1 3.17Å; L389-I393 PolarHBondContact O-N 3.39Å
390	L	94.6	Very high	92.4	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-61.4	-43.7	176.5	-61.7	-164	0	0	0	111.4	L265 Y268 L269 V317 F386 A387 I393 L394	L265-L390 HydrophobicContact CD1-CD2 4.19Å; L265-L390 HydrophobicContact CD2-CD1 4.43Å; L265-L390 HydrophobicContact CD2-CD2 3.8Å; L265-L390 HydrophobicContact CG-CD2 4.4Å; Y268-L390 HydrophobicContact CD1-CD1 3.5Å; Y268-L390 HydrophobicContact CE1-CD1 4.21Å; Y268-L390 HydrophobicContact CG-CD1 4.24Å; L269-L390 HydrophobicContact CD1-CB 3.91Å; L269-L390 HydrophobicContact CD2-CB 4.14Å; L269-L390 HydrophobicContact CD2-CD1 4.08Å; L269-L390 HydrophobicContact CG-CB 4.17Å; L269-L390 HydrophobicContact CG-CD1 4.01Å; V317-L390 HydrophobicContact CG1-CD2 3.28Å; F386-L390 HydrophobicContact CD1-CD1 4.23Å; F386-L390 HydrophobicContact CD1-CG 4.27Å; F386-L390 HydrophobicContact CE1-CD1 3.9Å; F386-L390 HydrophobicContact CE1-CD2 4.03Å; F386-L390 HydrophobicContact CE1-CG 4.11Å; F386-L390 HydrophobicContact CE2-CD2 4.34Å; F386-L390 HydrophobicContact CZ-CD2 3.91Å; F386-L390 HydrophobicContact CZ-CG 4.48Å; F386-L390 WeakPolarHBondContact O-CG 3.49Å; F386-L390 PolarHBondContact O-N 3.25Å; A387-L390 PolarHBondContact O-N 2.84Å; L390-I393 PolarHBondContact O-N 3.43Å; L390-L394 VanDerWaalsContact O-CG 3.32Å; L390-L394 WeakPolarHBondContact O-CG 3.4Å; L390-L394 PolarHBondContact O-N 3.42Å
391	I	92.9	Very high	92	Very high	18 Å²	18	40 Å²	40	9%	0.092	20%	0.204	C	C	.	.	H	α-helix	trans	-65.3	-42.5	179.4	-68.2	162.6	0	0	0	111.1	L269 I284 V287 F292 A387 A388 L389 L394 N395	L269-I391 HydrophobicContact CD1-CG1 3.69Å; L269-I391 HydrophobicContact CD2-CD1 4.47Å; L269-I391 HydrophobicContact CD2-CG1 4.32Å; I284-I391 HydrophobicContact CG2-CG2 4.18Å; V287-I391 HydrophobicContact CG2-CD1 3.68Å; V287-I391 HydrophobicContact CG2-CG2 4.5Å; F292-I391 HydrophobicContact CD2-CD1 3.91Å; F292-I391 HydrophobicContact CE2-CD1 3.67Å; F292-I391 HydrophobicContact CZ-CD1 4.45Å; A387-I391 WeakPolarHBondContact O-CD1 3.46Å; A387-I391 VanDerWaalsContact O-CG1 3.27Å; A387-I391 WeakPolarHBondContact O-CG1 3.42Å; A387-I391 PolarHBondContact O-N 2.98Å; A388-I391 PolarHBondContact O-N 3.26Å; L389-I391 VanDerWaalsContact C-N 3.34Å; L389-I391 PolarHBondContact O-N 2.99Å; I391-L394 PolarHBondContact O-N 2.88Å; I391-N395 WeakPolarHBondContact O-CB 3.4Å; I391-N395 PolarHBondContact O-N 3.13Å; I391-N395 PolarHBondContact O-ND2 2.97Å
392	D	92.5	Very high	91.2	Very high	18 Å²	18	39.2 Å²	39.2	10%	0.096	21%	0.208	C	C	.	.	H	α-helix	trans	-64.7	-40.9	175.3	-89.2	-24.2	0	0	0	111.6	K299 L302 A388 L389 N395 D396	K299-D392 WeakPolarHBondContact CD-OD1 3.36Å; K299-D392 WeakPolarHBondContact CE-OD1 3.11Å; K299-D392 IonicContact NZ-OD1 2.67Å; K299-D392 PolarHBondContact NZ-OD1 2.95Å; L302-D392 HydrophobicContact CD2-CB 3.9Å; A388-D392 PolarHBondContact O-N 3.24Å; L389-D392 PolarHBondContact O-N 3.2Å; D392-N395 PolarHBondContact O-N 3.29Å; D392-D396 WeakPolarHBondContact O-CB 3.47Å; D392-D396 PolarHBondContact O-N 3.34Å
393	I	94	Very high	90.3	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-61.7	-46	174.1	-75.3	170	0	0	0	112	L265 L302 F310 V314 V317 L389 L390 N395 D396 A397	L265-I393 HydrophobicContact CD1-CG2 3.74Å; L302-I393 HydrophobicContact CD1-CG1 4.39Å; L302-I393 HydrophobicContact CD2-CG1 4.19Å; F310-I393 HydrophobicContact CE2-CG1 4.37Å; F310-I393 HydrophobicContact CE2-CG2 4.45Å; F310-I393 HydrophobicContact CZ-CG2 4.03Å; V314-I393 HydrophobicContact CG2-CG2 3.83Å; V317-I393 HydrophobicContact CB-CD1 4.08Å; V317-I393 HydrophobicContact CG1-CD1 3.97Å; V317-I393 HydrophobicContact CG2-CD1 3.8Å; L389-I393 HydrophobicContact CD1-CD1 3.89Å; L389-I393 HydrophobicContact CD1-CG1 4.27Å; L389-I393 HydrophobicContact CG-CD1 3.97Å; L389-I393 WeakPolarHBondContact O-CB 3.49Å; L389-I393 WeakPolarHBondContact O-CG1 3.17Å; L389-I393 PolarHBondContact O-N 3.39Å; L390-I393 PolarHBondContact O-N 3.43Å; I393-N395 VanDerWaalsContact C-N 3.33Å; I393-N395 PolarHBondContact O-N 2.97Å; I393-D396 PolarHBondContact O-N 2.82Å; I393-D396 VanDerWaalsContact O-N 3.17Å; I393-A397 WeakPolarHBondContact O-CB 3.23Å; I393-A397 PolarHBondContact O-N 3.05Å
394	L	93.7	Very high	88.8	Confident	0 Å²	0	41 Å²	41	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-62.3	-40.2	178.1	-72.1	174.2	0	0	0	111.9	T262 L265 L269 I284 L390 I391 K398	T262-L394 HydrophobicContact CG2-CD2 3.76Å; T262-L394 WeakPolarHBondContact O-CD2 3.39Å; L265-L394 HydrophobicContact CB-CD1 4.47Å; L265-L394 HydrophobicContact CB-CD2 4.09Å; L265-L394 HydrophobicContact CB-CG 4.34Å; L269-L394 HydrophobicContact CD1-CD1 3.72Å; I284-L394 HydrophobicContact CD1-CB 4Å; I284-L394 HydrophobicContact CG1-CB 3.98Å; L390-L394 VanDerWaalsContact O-CG 3.32Å; L390-L394 WeakPolarHBondContact O-CG 3.4Å; L390-L394 PolarHBondContact O-N 3.42Å; I391-L394 PolarHBondContact O-N 2.88Å; L394-K398 WeakPolarHBondContact O-CB 3.36Å; L394-K398 PolarHBondContact O-N 2.91Å
395	N	92.1	Very high	87	Confident	60 Å²	60	39 Å²	39	32%	0.321	21%	0.205	S	C	.	.	H	α-helix	trans	-66.1	-38.5	173.8	-80.4	-68.8	0	0	0	112.2	I284 I391 D392 I393 R399	I284-N395 HydrophobicContact CD1-CB 4.41Å; I284-N395 WeakPolarHBondContact CD1-OD1 3.48Å; I391-N395 WeakPolarHBondContact O-CB 3.4Å; I391-N395 PolarHBondContact O-N 3.13Å; I391-N395 PolarHBondContact O-ND2 2.97Å; D392-N395 PolarHBondContact O-N 3.29Å; I393-N395 VanDerWaalsContact C-N 3.33Å; I393-N395 PolarHBondContact O-N 2.97Å; N395-R399 PolarHBondContact O-N 3.34Å
396	D	92	Very high	84.7	Confident	2 Å²	2	39.1 Å²	39.1	1%	0.011	22%	0.216	C	C	.	.	H	α-helix	trans	-67.1	-44.5	178.4	-144.2	72	0	0	0	111.6	L302 Q303 F310 D392 I393 R399 R400	L302-D396 HydrophobicContact CD2-CB 4.02Å; L302-D396 HydrophobicContact CG-CB 4.35Å; Q303-D396 WeakPolarHBondContact CG-OD1 3.25Å; F310-D396 HydrophobicContact CE2-CB 3.62Å; F310-D396 HydrophobicContact CZ-CB 3.7Å; D392-D396 WeakPolarHBondContact O-CB 3.47Å; D392-D396 PolarHBondContact O-N 3.34Å; I393-D396 PolarHBondContact O-N 2.82Å; I393-D396 VanDerWaalsContact O-N 3.17Å; D396-R399 PolarHBondContact O-N 3Å; D396-R399 IonicContact OD1-CZ 2.81Å; D396-R399 IonicContact OD1-NH1 3.99Å; D396-R399 PolarHBondContact OD1-NH1 3.09Å; D396-R399 IonicContact OD1-NH2 2.87Å; D396-R399 PolarHBondContact OD1-NH2 2.91Å; D396-R399 IonicContact OD2-CZ 3.24Å; D396-R399 IonicContact OD2-NH2 3.18Å; D396-R399 PolarHBondContact OD2-NH2 3.09Å; D396-R399 VanDerWaalsContact OD2-NH2 3.09Å; D396-R400 WeakPolarHBondContact O-CG 3.37Å; D396-R400 PolarHBondContact O-N 3.49Å; D396-R400 IonicContact OD2-CZ 2.66Å; D396-R400 VanDerWaalsContact OD2-CZ 3.24Å; D396-R400 IonicContact OD2-NE 3.58Å; D396-R400 PolarHBondContact OD2-NE 3.29Å; D396-R400 IonicContact OD2-NH2 2.76Å; D396-R400 PolarHBondContact OD2-NH2 3.49Å
397	A	92.6	Very high	81.9	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-61.7	-45.8	175.3	0	0	0	0	0	112.4	T262 F282 F310 I393 R399 R400 K401 M592 F594	T262-A397 HydrophobicContact CG2-CB 4.05Å; F282-A397 HydrophobicContact CE1-CB 3.79Å; F282-A397 HydrophobicContact CZ-CB 4.43Å; F310-A397 HydrophobicContact CE1-CB 4.07Å; F310-A397 HydrophobicContact CZ-CB 4.2Å; I393-A397 WeakPolarHBondContact O-CB 3.23Å; I393-A397 PolarHBondContact O-N 3.05Å; A397-R399 VanDerWaalsContact C-N 3.29Å; A397-R399 PolarHBondContact O-N 3.15Å; A397-R400 PolarHBondContact O-N 3Å; A397-K401 PolarHBondContact O-N 3.11Å; A397-M592 HydrophobicContact CB-CE 3.46Å; A397-M592 VanDerWaalsContact CB-CE 3.46Å; A397-F594 HydrophobicContact CB-CE1 4.21Å
398	K	91.8	Very high	78.9	Confident	119 Å²	119	50.1 Å²	50.1	52%	0.517	27%	0.272	S	S	.	.	H	α-helix	trans	-58.5	-41.3	174.9	-175.5	177.6	178.4	-177.7	0	111.7	F282 I284 L394 G402	F282-K398 HydrophobicContact CB-CB 4.49Å; F282-K398 HydrophobicContact CB-CD 4.29Å; F282-K398 HydrophobicContact CB-CG 4.48Å; F282-K398 HydrophobicContact CD1-CB 4.1Å; F282-K398 HydrophobicContact CD2-CB 3.91Å; F282-K398 HydrophobicContact CD2-CD 4.43Å; F282-K398 HydrophobicContact CD2-CG 3.79Å; F282-K398 HydrophobicContact CE1-CB 4.28Å; F282-K398 HydrophobicContact CE2-CB 4.1Å; F282-K398 HydrophobicContact CE2-CG 4.2Å; F282-K398 HydrophobicContact CG-CB 3.91Å; F282-K398 HydrophobicContact CG-CD 4.47Å; F282-K398 HydrophobicContact CG-CG 4.12Å; F282-K398 HydrophobicContact CZ-CB 4.29Å; I284-K398 HydrophobicContact CD1-CB 4.48Å; I284-K398 HydrophobicContact CD1-CD 4.17Å; L394-K398 WeakPolarHBondContact O-CB 3.36Å; L394-K398 PolarHBondContact O-N 2.91Å; K398-G402 PolarHBondContact O-N 2.84Å; K398-G402 VanDerWaalsContact O-N 3.11Å
399	R	91.1	Very high	76.1	Confident	63 Å²	63	55 Å²	55	24%	0.238	30%	0.302	C	S	.	.	H	α-helix	trans	-66.8	-43	175.6	-170.8	-169.5	67.2	-97.9	-2.2	112.1	N395 D396 A397 G402 R403	N395-R399 PolarHBondContact O-N 3.34Å; D396-R399 PolarHBondContact O-N 3Å; D396-R399 IonicContact OD1-CZ 2.81Å; D396-R399 IonicContact OD1-NH1 3.99Å; D396-R399 PolarHBondContact OD1-NH1 3.09Å; D396-R399 IonicContact OD1-NH2 2.87Å; D396-R399 PolarHBondContact OD1-NH2 2.91Å; D396-R399 IonicContact OD2-CZ 3.24Å; D396-R399 IonicContact OD2-NH2 3.18Å; D396-R399 PolarHBondContact OD2-NH2 3.09Å; D396-R399 VanDerWaalsContact OD2-NH2 3.09Å; A397-R399 VanDerWaalsContact C-N 3.29Å; A397-R399 PolarHBondContact O-N 3.15Å; R399-G402 PolarHBondContact O-N 2.91Å; R399-R403 PolarHBondContact O-N 3.33Å
400	R	91	Very high	73.2	Confident	10 Å²	10	58 Å²	58	4%	0.038	33%	0.327	C	S	.	.	H	α-helix	trans	-61.8	-47.6	178.8	-73	172.7	-166.3	-90.5	0.2	111.2	L302 L305 D307 D396 A397 G402 R403 A404 F594	L302-R400 PolarHBondContact O-NH2 3.32Å; L305-R400 PolarHBondContact O-NH1 3.05Å; L305-R400 PolarHBondContact O-NH2 2.95Å; D307-R400 VanDerWaalsContact OD1-CD 3.29Å; D307-R400 WeakPolarHBondContact OD1-CD 3.28Å; D307-R400 IonicContact OD1-CZ 2.67Å; D307-R400 IonicContact OD1-NE 2.77Å; D307-R400 IonicContact OD1-NH1 3.21Å; D307-R400 PolarHBondContact OD1-NH1 3.43Å; D396-R400 WeakPolarHBondContact O-CG 3.37Å; D396-R400 PolarHBondContact O-N 3.49Å; D396-R400 IonicContact OD2-CZ 2.66Å; D396-R400 VanDerWaalsContact OD2-CZ 3.24Å; D396-R400 IonicContact OD2-NE 3.58Å; D396-R400 PolarHBondContact OD2-NE 3.29Å; D396-R400 IonicContact OD2-NH2 2.76Å; D396-R400 PolarHBondContact OD2-NH2 3.49Å; A397-R400 PolarHBondContact O-N 3Å; R400-G402 VanDerWaalsContact C-N 3.29Å; R400-G402 PolarHBondContact O-N 2.84Å; R400-R403 PolarHBondContact O-N 2.95Å; R400-A404 PolarHBondContact O-N 3.03Å; R400-F594 HydrophobicContact CB-CD1 3.66Å; R400-F594 HydrophobicContact CB-CE1 3.92Å
401	K	85.2	Confident	70.1	Confident	53 Å²	53	66.8 Å²	66.8	23%	0.23	37%	0.368	C	S	.	.	H	α-helix	trans	-58.6	-39.6	173.5	-163.6	-174.5	-173.6	-175.6	0	112.3	F259 H281 F282 A397 R403 A404	F259-K401 HydrophobicContact CE1-CD 4.15Å; F259-K401 HydrophobicContact CZ-CD 4.33Å; H281-K401 PolarHBondContact CD2-NZ 3.13Å; H281-K401 VanDerWaalsContact CG-NZ 3.29Å; H281-K401 PolarHBondContact NE2-NZ 3.26Å; F282-K401 HydrophobicContact CE2-CB 4.06Å; F282-K401 HydrophobicContact CE2-CD 3.72Å; F282-K401 HydrophobicContact CE2-CG 4.49Å; F282-K401 HydrophobicContact CZ-CB 4.04Å; F282-K401 HydrophobicContact CZ-CD 4.09Å; A397-K401 PolarHBondContact O-N 3.11Å; K401-R403 PolarHBondContact O-N 3.21Å; K401-A404 PolarHBondContact O-N 3.2Å
402	G	78.3	Confident	67.3	Low	33 Å²	33	71.3 Å²	71.3	34%	0.34	40%	0.401	S	S	.	.	H	α-helix	trans	-65.2	-34.7	177.5	0	0	0	0	0	114.4	K398 R399 R400 A404 S405	K398-G402 PolarHBondContact O-N 2.84Å; K398-G402 VanDerWaalsContact O-N 3.11Å; R399-G402 PolarHBondContact O-N 2.91Å; R400-G402 VanDerWaalsContact C-N 3.29Å; R400-G402 PolarHBondContact O-N 2.84Å; G402-A404 VanDerWaalsContact C-N 3.31Å; G402-A404 PolarHBondContact O-N 2.9Å; G402-S405 PolarHBondContact O-N 3.44Å; G402-S405 VanDerWaalsContact O-N 3.11Å; G402-S405 PolarHBondContact O-OG 2.72Å
403	R	71.3	Confident	64.6	Low	143 Å²	143	74.8 Å²	74.8	54%	0.54	43%	0.433	S	S	.	.	H	α-helix	trans	-63.1	-36.6	176.3	-74.1	175.4	173.8	178.4	-4.7	112.5	R399 R400 K401 S405 S406	R399-R403 PolarHBondContact O-N 3.33Å; R400-R403 PolarHBondContact O-N 2.95Å; K401-R403 PolarHBondContact O-N 3.21Å; R403-S405 PolarHBondContact O-N 3.28Å; R403-S405 VanDerWaalsContact O-N 3.17Å; R403-S406 PolarHBondContact O-N 2.98Å; R403-S406 PolarHBondContact O-OG 3.21Å
404	A	57.5	Low	61.7	Low	26 Å²	26	82 Å²	82	22%	0.215	47%	0.471	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72	2.1	175.8	0	0	0	0	0	114.2	R400 K401 G402 F594 E596	R400-A404 PolarHBondContact O-N 3.03Å; K401-A404 PolarHBondContact O-N 3.2Å; G402-A404 VanDerWaalsContact C-N 3.31Å; G402-A404 PolarHBondContact O-N 2.9Å; A404-F594 WeakPolarHBondContact CB-O 3.4Å; A404-E596 HydrophobicContact CB-CG 3.99Å
405	S	51.6	Low	59.1	Low	100 Å²	100	91.9 Å²	91.9	70%	0.699	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117	4.6	176.4	60.2	0	0	0	0	114.3	G402 R403	G402-S405 PolarHBondContact O-N 3.44Å; G402-S405 VanDerWaalsContact O-N 3.11Å; G402-S405 PolarHBondContact O-OG 2.72Å; R403-S405 PolarHBondContact O-N 3.28Å; R403-S405 VanDerWaalsContact O-N 3.17Å
406	S	43.8	Very low	56.1	Low	95 Å²	95	98.7 Å²	98.7	66%	0.664	54%	0.541	S	S	*	.			trans	-124.3	29.8	-172.7	66.8	0	0	0	0	113.6	R403	R403-S406 PolarHBondContact O-N 2.98Å; R403-S406 PolarHBondContact O-OG 3.21Å
407	S	36.8	Very low	53.4	Low	68 Å²	68	107.5 Å²	107.5	48%	0.476	58%	0.582	S	S	.	*			trans	-115.1	36.8	-174.4	40.9	0	0	0	0	113.3	E596	S407-E596 WeakPolarHBondContact CB-OE1 3.46Å; S407-E596 PolarHBondContact OG-OE1 2.85Å
408	E	29.6	Very low	50.3	Low	180 Å²	180	113.9 Å²	113.9	84%	0.841	62%	0.621	S	S	*	*			trans	-97.8	131.2	164.8	-70.3	-146.2	162.5	0	0	111.5	S410	E408-S410 PolarHBondContact O-N 3.42Å
409	P	31.5	Very low	47.7	Very low	123 Å²	123	114.9 Å²	114.9	80%	0.799	64%	0.637	S	S	*	*			trans	-79.7	84.3	173.1	33	-32.9	0	0	0	109.9	E411	P409-E411 VanDerWaalsContact C-N 3.31Å; P409-E411 PolarHBondContact O-N 3.03Å
410	S	33.7	Very low	44.8	Very low	106 Å²	106	120.9 Å²	120.9	74%	0.741	67%	0.667	S	S	*	*			trans	-72	87.4	168.7	64.1	0	0	0	0	110.3	E408 S412	E408-S410 PolarHBondContact O-N 3.42Å; S410-S412 PolarHBondContact O-N 3.35Å
411	E	29.9	Very low	42.1	Very low	185 Å²	185	124 Å²	124	86%	0.864	70%	0.702	S	S	*	*			trans	-60.2	102.8	158.4	-72.7	-171.7	139.6	0	0	109	P409	P409-E411 VanDerWaalsContact C-N 3.31Å; P409-E411 PolarHBondContact O-N 3.03Å
412	S	34.5	Very low	39.6	Very low	113 Å²	113	128.5 Å²	128.5	79%	0.79	73%	0.729	S	S	*	*			trans	172.2	155	144.3	40.6	0	0	0	0	113.8	S410	S410-S412 PolarHBondContact O-N 3.35Å
413	A	35.8	Very low	37.4	Very low	92 Å²	92	135 Å²	135	76%	0.76	75%	0.751	S	S	*	*			trans	70.8	87.1	160.3	0	0	0	0	0	118
414	D	33	Very low	35.7	Very low	151 Å²	151	132.5 Å²	132.5	81%	0.807	75%	0.753	S	S	*	*			trans	-11.8	126.2	136.8	-73.5	-71	0	0	0	116.4
415	K	38.4	Very low	34.5	Very low	208 Å²	208	137.1 Å²	137.1	90%	0.904	78%	0.781	S	S	*	*			trans	-156.5	107.6	135.7	-109.2	156.4	-169.8	179	0	111	E417	K415-E417 PolarHBondContact O-N 3.34Å
416	K	29.4	Very low	33.7	Very low	202 Å²	202	140.4 Å²	140.4	88%	0.878	79%	0.789	S	S	*	*			trans	-65.4	121.6	161.8	-71	173.2	175.2	174.2	0	108.5
417	E	33.9	Very low	33.3	Very low	188 Å²	188	143.2 Å²	143.2	88%	0.879	80%	0.797	S	S	*	*			trans	-130.7	108.6	150.6	-104.1	176.7	-176.7	0	0	109.1	K415	K415-E417 PolarHBondContact O-N 3.34Å
418	T	28	Very low	33	Very low	133 Å²	133	151 Å²	151	82%	0.816	82%	0.816	S	S	*	*			trans	-70.9	127.4	170.8	38.3	0	0	0	0	109.9
419	V	37.3	Very low	33.3	Very low	140 Å²	140	151.5 Å²	151.5	85%	0.848	82%	0.819	S	S	*	*			trans	-125.4	112	160.1	180	0	0	0	0	107.8
420	E	30.2	Very low	33.3	Very low	189 Å²	189	152.7 Å²	152.7	88%	0.883	82%	0.818	S	S	*	*			trans	-72.7	148.3	176.1	-64.2	174.1	130.1	0	0	111
421	G	34.3	Very low	33.2	Very low	75 Å²	75	155.5 Å²	155.5	77%	0.773	83%	0.825	S	S	*	*			trans	-171.7	78.4	-176.7	0	0	0	0	0	113
422	N	33.5	Very low	33.3	Very low	148 Å²	148	153.4 Å²	153.4	79%	0.791	82%	0.819	S	S	*	*			trans	-31.1	150.6	160.5	-61.1	-4.1	0	0	0	113.1
423	E	32	Very low	33.2	Very low	170 Å²	170	155.9 Å²	155.9	79%	0.794	82%	0.824	S	S	*	*			cis	-176	-171.6	6.6	-118.6	-166.7	155.9	0	0	106.1
424	P	35.8	Very low	33	Very low	90 Å²	90	158 Å²	158	58%	0.584	82%	0.822	S	S	*	*				-118.1	175.7	-61.5	32	-13.3	0	0	0	111
425	P	31.2	Very low	33.1	Very low	123 Å²	123	158 Å²	158	80%	0.799	82%	0.822	S	S	*	*			trans	-76.1	146.2	173.4	32.2	-34.4	0	0	0	111.6
426	L	35.4	Very low	32.8	Very low	169 Å²	169	155.2 Å²	155.2	89%	0.885	82%	0.817	S	S	*	*			trans	-120.2	144.7	171	-81.1	177	0	0	0	112.4
427	D	34.6	Very low	32.9	Very low	155 Å²	155	150.4 Å²	150.4	83%	0.829	82%	0.816	S	S	*	*			trans	-80.5	164.9	-157.2	-84.6	-62	0	0	0	116.6
428	R	30.8	Very low	33	Very low	231 Å²	231	151 Å²	151	87%	0.872	82%	0.818	S	S	*	*			trans	-53.4	132.1	157.4	-69.5	169.5	163.8	153.5	-7.2	110.7
429	Q	35.1	Very low	33.6	Very low	191 Å²	191	147.2 Å²	147.2	89%	0.893	81%	0.806	S	S	*	*			trans	-135.3	117.8	143	-101.2	-179.1	-4.6	0	0	109.5
430	D	31.8	Very low	33.8	Very low	148 Å²	148	143.4 Å²	143.4	79%	0.791	78%	0.784	S	S	*	*			trans	-62.2	137.8	167.7	-64.5	-65.9	0	0	0	109.8
431	N	32.6	Very low	34.3	Very low	164 Å²	164	141 Å²	141	88%	0.877	78%	0.782	S	S	*	*			trans	-144.7	101.2	151.4	-113	-31.3	0	0	0	109.8	N433	N431-N433 PolarHBondContact O-N 3.08Å
432	N	31.6	Very low	34.5	Very low	141 Å²	141	143.2 Å²	143.2	75%	0.754	77%	0.768	S	S	*	*			trans	-55.7	129.7	167.3	-88.3	-42.4	0	0	0	110
433	N	32.8	Very low	34.7	Very low	166 Å²	166	142.7 Å²	142.7	89%	0.888	77%	0.765	S	S	*	*			trans	-147.7	116.9	136.4	-105	-31.6	0	0	0	109.9	N431	N431-N433 PolarHBondContact O-N 3.08Å
434	N	31.4	Very low	35.3	Very low	135 Å²	135	142.9 Å²	142.9	72%	0.722	77%	0.766	S	S	*	*			trans	-59.9	138.1	173	-70.8	-46	0	0	0	110.3
435	N	34.4	Very low	35.4	Very low	151 Å²	151	144.6 Å²	144.6	81%	0.807	78%	0.775	S	S	*	*			trans	-168.9	92	135.9	-92.6	-30.7	0	0	0	111.7
436	N	32.7	Very low	35.6	Very low	150 Å²	150	144.4 Å²	144.4	80%	0.802	77%	0.774	S	S	*	*			trans	36	124.3	139.8	-57.4	-29.5	0	0	0	121.8
437	A	31.2	Very low	35.7	Very low	102 Å²	102	142.8 Å²	142.8	84%	0.843	77%	0.77	S	S	*	*			trans	75.4	73	139.8	0	0	0	0	0	119.9
438	E	37.1	Very low	35.7	Very low	199 Å²	199	143.2 Å²	143.2	93%	0.93	77%	0.767	S	S	*	*			trans	-89.1	108.9	154.3	-98.3	-178.1	139.7	0	0	111.2
439	G	39.9	Very low	35.9	Very low	55 Å²	55	141 Å²	141	57%	0.567	77%	0.767	S	S	*	*			trans	-84.5	165.1	166.8	0	0	0	0	0	112.1	V441	G439-V441 PolarHBondContact O-N 3.35Å
440	P	41.7	Very low	35.8	Very low	60 Å²	60	135.3 Å²	135.3	39%	0.39	76%	0.759	S	S	.	*			trans	-76.8	127.6	-175.4	30.7	-27.7	0	0	0	110.2	Y442 I753 Q757	P440-Y442 PolarHBondContact O-N 3.25Å; P440-I753 HydrophobicContact CB-CG2 4.08Å; P440-I753 HydrophobicContact CG-CG2 3.57Å; P440-Q757 HydrophobicContact CB-CG 4.47Å
441	V	41.2	Very low	35.8	Very low	138 Å²	138	136.7 Å²	136.7	84%	0.836	77%	0.767	S	S	*	*			trans	-58.1	104.9	-172.9	-178.8	0	0	0	0	112.1	G439	G439-V441 PolarHBondContact O-N 3.35Å
442	Y	36.7	Very low	35.7	Very low	122 Å²	122	135.9 Å²	135.9	48%	0.478	76%	0.759	S	S	.	*			trans	-91.5	135	152.7	-79.6	-89.1	0	0	0	108.1	P440 E444 K749 I753	P440-Y442 PolarHBondContact O-N 3.25Å; Y442-E444 VanDerWaalsContact C-N 3.32Å; Y442-E444 PolarHBondContact O-N 2.93Å; Y442-K749 WeakPolarHBondContact OH-CE 3.36Å; Y442-K749 PolarHBondContact OH-NZ 2.9Å; Y442-I753 HydrophobicContact CE2-CD1 4.38Å; Y442-I753 WeakPolarHBondContact OH-CD1 3.09Å
443	D	39.5	Very low	35.8	Very low	137 Å²	137	138.8 Å²	138.8	73%	0.733	77%	0.768	S	S	*	*			trans	-63	94.4	167.6	-75.3	-36.7	0	0	0	107.9
444	E	43.4	Very low	35.5	Very low	173 Å²	173	136.2 Å²	136.2	81%	0.808	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-65.6	139.3	169.6	-71.2	-161.1	154.2	0	0	109.9	Y442 P446	Y442-E444 VanDerWaalsContact C-N 3.32Å; Y442-E444 PolarHBondContact O-N 2.93Å; E444-P446 WeakPolarHBondContact O-CD 3.42Å
445	V	38.6	Very low	35.6	Very low	126 Å²	126	135.7 Å²	135.7	76%	0.764	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-64.3	123.4	173.6	-124	0	0	0	0	108	V447	V445-V447 PolarHBondContact O-N 3.27Å; V445-V447 VanDerWaalsContact O-N 3.09Å
446	P	34.9	Very low	35.3	Very low	120 Å²	120	133.4 Å²	133.4	78%	0.779	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-58.5	118.4	-176	-27	35.2	0	0	0	112.1	E444	E444-P446 WeakPolarHBondContact O-CD 3.42Å
447	V	38.6	Very low	35.4	Very low	134 Å²	134	131.2 Å²	131.2	81%	0.812	76%	0.759	S	S	*	*			trans	-98.1	103.5	166.7	-152.9	0	0	0	0	106.4	V445 H449	V445-V447 PolarHBondContact O-N 3.27Å; V445-V447 VanDerWaalsContact O-N 3.09Å; V447-H449 PolarHBondContact O-N 3.02Å; V447-H449 VanDerWaalsContact O-N 3.16Å
448	E	33.5	Very low	35.5	Very low	164 Å²	164	130.6 Å²	130.6	77%	0.766	75%	0.754	S	S	*	*			trans	-71.6	106.6	-172.5	-63.8	178.9	168.7	0	0	111.9
449	H	35.9	Very low	35.3	Very low	185 Å²	185	128.8 Å²	128.8	86%	0.856	75%	0.749	S	S	*	*			trans	-130.4	121.2	152.5	-80.1	47.7	0	0	0	106.6	V447	V447-H449 PolarHBondContact O-N 3.02Å; V447-H449 VanDerWaalsContact O-N 3.16Å
450	G	31.4	Very low	35	Very low	72 Å²	72	131.1 Å²	131.1	74%	0.742	75%	0.754	S	S	*	*			trans	-88.2	168.9	-167	0	0	0	0	0	114.4
451	D	33	Very low	34.6	Very low	177 Å²	177	133.8 Å²	133.8	95%	0.947	77%	0.774	S	S	*	*				-160.2	152.9	113.9	-108.2	-32.1	0	0	0	113
452	M	30.6	Very low	34.3	Very low	147 Å²	147	133.1 Å²	133.1	72%	0.724	78%	0.776	S	S	*	*			trans	-77.8	145	-178.5	-92.6	174.1	48	0	0	113	I454	M452-I454 HydrophobicContact CE-CD1 3.96Å
453	Q	32.9	Very low	34.1	Very low	201 Å²	201	132.2 Å²	132.2	94%	0.939	79%	0.787	S	S	*	*			trans	-154.8	143.1	131.9	-114.9	157.3	78.7	0	0	113.3
454	I	27.3	Very low	33.9	Very low	113 Å²	113	136.8 Å²	136.8	58%	0.579	79%	0.794	S	S	*	*			trans	-119.1	137.5	-171.4	-63.5	169.4	0	0	0	108.9	M452	M452-I454 HydrophobicContact CE-CD1 3.96Å
455	S	33.4	Very low	33.5	Very low	124 Å²	124	138 Å²	138	87%	0.867	80%	0.797	S	S	*	*			trans	-140.7	140.3	156.9	56	0	0	0	0	110.4
456	S	28.3	Very low	33.5	Very low	102 Å²	102	137.1 Å²	137.1	71%	0.713	79%	0.792	S	S	*	*			trans	-141.5	135.1	-167.7	59.2	0	0	0	0	111.4
457	A	33.4	Very low	33.6	Very low	105 Å²	105	138.2 Å²	138.2	87%	0.868	79%	0.791	S	S	*	*			trans	-139.9	120.4	170.4	0	0	0	0	0	111.2
458	A	33.6	Very low	33.4	Very low	88 Å²	88	137.5 Å²	137.5	73%	0.727	78%	0.783	S	S	*	*			trans	-66.4	176.8	173	0	0	0	0	0	111.8
459	I	34.1	Very low	33.7	Very low	162 Å²	162	136.5 Å²	136.5	83%	0.831	79%	0.787	S	S	*	*			cis	-179.4	178.3	47.9	-135.5	151	0	0	0	107.2
460	P	33.8	Very low	33.5	Very low	104 Å²	104	134.1 Å²	134.1	68%	0.675	78%	0.781	S	S	*	*				-138.3	-175.6	-99.3	46.5	-28.6	0	0	0	118.5
461	S	31.9	Very low	33.7	Very low	116 Å²	116	135.6 Å²	135.6	81%	0.811	79%	0.786	S	S	*	*			trans	50.7	112.8	143.3	-59.4	0	0	0	0	124.9
462	S	34.9	Very low	33.8	Very low	124 Å²	124	131.3 Å²	131.3	87%	0.867	78%	0.775	S	S	*	*			trans	-175.6	153.7	141.5	-129.8	0	0	0	0	110.3
463	S	34.1	Very low	34	Very low	103 Å²	103	130.4 Å²	130.4	72%	0.72	78%	0.78	S	S	*	*			cis	-161	141.5	-20.2	50.8	0	0	0	0	112.7
464	R	34.3	Very low	34.3	Very low	233 Å²	233	128.1 Å²	128.1	88%	0.879	77%	0.772	S	S	*	*			trans	2.9	144.1	157.1	-59.8	175.9	-179.7	158.1	0.7	122.7
465	F	34.9	Very low	34.8	Very low	198 Å²	198	130.3 Å²	130.3	87%	0.868	78%	0.783	S	S	*	*				178.2	94	118.5	-104.2	-91.3	0	0	0	107.6
466	V	38.7	Very low	35.3	Very low	107 Å²	107	130 Å²	130	65%	0.648	76%	0.764	S	S	*	*				61.2	144.7	104.4	-55.7	0	0	0	0	116.2
467	D	37.3	Very low	36.3	Very low	143 Å²	143	132.6 Å²	132.6	77%	0.765	77%	0.77	S	S	*	*			cis	-142.1	132	11	-77.6	-64	0	0	0	110
468	D	33.7	Very low	37.5	Very low	120 Å²	120	130.7 Å²	130.7	64%	0.642	75%	0.745	S	S	*	*				80	106.1	88.9	-167.5	21.5	0	0	0	118.2	N470	D468-N470 PolarHBondContact OD1-N 3.26Å; D468-N470 VanDerWaalsContact OD1-N 3.12Å
469	V	40.1	Very low	38.9	Very low	142 Å²	142	130.8 Å²	130.8	86%	0.861	74%	0.739	S	S	*	*			trans	-148	87.2	139.2	-168.7	0	0	0	0	111.2
470	N	31.2	Very low	40.5	Very low	136 Å²	136	130.3 Å²	130.3	73%	0.727	73%	0.73	S	S	*	*			trans	27.8	107.4	148.1	-79.5	-71.2	0	0	0	121.9	D468	D468-N470 PolarHBondContact OD1-N 3.26Å; D468-N470 VanDerWaalsContact OD1-N 3.12Å
471	A	36.4	Very low	42	Very low	102 Å²	102	127.5 Å²	127.5	84%	0.843	71%	0.711	S	S	*	*			trans	-161.9	96.9	140.3	0	0	0	0	0	113.1
472	A	34.7	Very low	43.2	Very low	88 Å²	88	126.4 Å²	126.4	73%	0.727	69%	0.694	S	S	*	*			trans	44.6	103.4	161.1	0	0	0	0	0	119.4	M474	A472-M474 PolarHBondContact O-N 2.89Å
473	P	34.5	Very low	44.7	Very low	127 Å²	127	127.6 Å²	127.6	83%	0.825	68%	0.68	S	S	*	*			trans	-76.7	110.6	174	31.2	-32.6	0	0	0	112
474	M	40.1	Very low	46.2	Very low	154 Å²	154	130.2 Å²	130.2	76%	0.759	67%	0.674	S	S	*	*			trans	-78.6	124.2	161.1	-75.6	-82	96.4	0	0	109.2	A472 Y476	A472-M474 PolarHBondContact O-N 2.89Å; M474-Y476 HydrophobicContact CB-CD2 4.2Å; M474-Y476 HydrophobicContact CB-CE2 4.2Å; M474-Y476 PolarHBondContact O-N 2.99Å; M474-Y476 VanDerWaalsContact O-N 3.15Å
475	L	38.5	Very low	47.5	Very low	158 Å²	158	120.9 Å²	120.9	83%	0.827	64%	0.644	S	S	*	*			trans	-62.6	109.9	-177.1	-69.8	161.6	0	0	0	111.6
476	Y	43	Very low	49.1	Very low	119 Å²	119	115.5 Å²	115.5	47%	0.467	62%	0.623	S	S	.	*			trans	-123.4	18.1	179.1	-92.4	-77.3	0	0	0	114	M474 D478 V481 C485	M474-Y476 HydrophobicContact CB-CD2 4.2Å; M474-Y476 HydrophobicContact CB-CE2 4.2Å; M474-Y476 PolarHBondContact O-N 2.99Å; M474-Y476 VanDerWaalsContact O-N 3.15Å; Y476-D478 VanDerWaalsContact C-N 3.34Å; Y476-D478 PolarHBondContact O-N 3.4Å; Y476-V481 HydrophobicContact CD1-CG1 4.36Å; Y476-V481 HydrophobicContact CE1-CG1 4.28Å; Y476-C485 HydrophobicContact CE1-CB 4.15Å
477	D	49.9	Very low	50.8	Low	156 Å²	156	115.1 Å²	115.1	83%	0.834	62%	0.617	S	S	*	*			trans	-81.1	0.5	-178.4	-72.8	-48.2	0	0	0	115.4	P479	D477-P479 WeakPolarHBondContact O-CD 3.3Å
478	D	58.5	Low	52.1	Low	65 Å²	65	111.8 Å²	111.8	35%	0.348	60%	0.604	S	S	.	*			trans	-96.3	114.2	170.7	178.1	9.4	0	0	0	110.9	Y476 K480 V481 M482	Y476-D478 VanDerWaalsContact C-N 3.34Å; Y476-D478 PolarHBondContact O-N 3.4Å; D478-K480 PolarHBondContact O-N 2.83Å; D478-K480 VanDerWaalsContact O-N 3.07Å; D478-K480 VanDerWaalsContact OD1-CB 3.32Å; D478-K480 WeakPolarHBondContact OD1-CB 3.49Å; D478-K480 PolarHBondContact OD1-N 2.81Å; D478-V481 HydrophobicContact CB-CB 4.12Å; D478-V481 HydrophobicContact CB-CG2 3.87Å; D478-V481 WeakPolarHBondContact O-CA 3.3Å; D478-V481 WeakPolarHBondContact O-CB 3.5Å; D478-V481 PolarHBondContact O-N 3.23Å; D478-M482 PolarHBondContact O-N 3.36Å
479	P	61.8	Low	53.7	Low	90 Å²	90	111.9 Å²	111.9	58%	0.584	60%	0.602	S	S	*	*	H	α-helix	trans	-54.2	-27.1	173.9	-26.3	35	0	0	0	114.1	D477 R483	D477-P479 WeakPolarHBondContact O-CD 3.3Å; P479-R483 WeakPolarHBondContact O-CB 3.48Å; P479-R483 WeakPolarHBondContact O-CG 3.34Å; P479-R483 PolarHBondContact O-N 3.14Å
480	K	68.5	Low	55.2	Low	152 Å²	152	108.9 Å²	108.9	66%	0.661	58%	0.582	S	S	*	*	H	α-helix	trans	-77.3	-26.2	175.8	-57.1	176	179.8	176.1	0	112.8	D478 R484	D478-K480 PolarHBondContact O-N 2.83Å; D478-K480 VanDerWaalsContact O-N 3.07Å; D478-K480 VanDerWaalsContact OD1-CB 3.32Å; D478-K480 WeakPolarHBondContact OD1-CB 3.49Å; D478-K480 PolarHBondContact OD1-N 2.81Å; K480-R484 WeakPolarHBondContact O-CG 3.48Å; K480-R484 PolarHBondContact O-N 3.4Å; K480-R484 PolarHBondContact O-NE 3.07Å
481	V	65.3	Low	57.2	Low	44 Å²	44	109.4 Å²	109.4	27%	0.267	58%	0.577	S	S	.	*	H	α-helix	trans	-73.9	-47.4	168.7	173.5	0	0	0	0	109	Y476 D478 R483 R484 C485	Y476-V481 HydrophobicContact CD1-CG1 4.36Å; Y476-V481 HydrophobicContact CE1-CG1 4.28Å; D478-V481 HydrophobicContact CB-CB 4.12Å; D478-V481 HydrophobicContact CB-CG2 3.87Å; D478-V481 WeakPolarHBondContact O-CA 3.3Å; D478-V481 WeakPolarHBondContact O-CB 3.5Å; D478-V481 PolarHBondContact O-N 3.23Å; V481-R483 PolarHBondContact O-N 2.94Å; V481-R484 WeakPolarHBondContact O-CB 3.25Å; V481-R484 PolarHBondContact O-N 2.85Å; V481-R484 VanDerWaalsContact O-N 3.07Å; V481-C485 PolarHBondContact O-N 3.04Å
482	M	57.3	Low	59	Low	94 Å²	94	110.6 Å²	110.6	46%	0.463	56%	0.564	S	S	.	*	H	α-helix	trans	-58.4	-46.1	178.2	-170.8	173.2	-72.2	0	0	112.3	D478 R484 C485 I486	D478-M482 PolarHBondContact O-N 3.36Å; M482-R484 VanDerWaalsContact C-N 3.34Å; M482-R484 PolarHBondContact O-N 3.25Å; M482-C485 PolarHBondContact O-N 3.11Å; M482-I486 HydrophobicContact CG-CD1 4.06Å; M482-I486 WeakPolarHBondContact O-CG1 3.37Å; M482-I486 PolarHBondContact O-N 2.67Å
483	R	66.6	Low	60.8	Low	149 Å²	149	111.3 Å²	111.3	56%	0.562	55%	0.554	S	S	*	*	H	α-helix	trans	-60.1	-39.3	173.6	-75.9	-175	-171.9	-158.6	3.8	113.1	P479 V481 I486 I487	P479-R483 WeakPolarHBondContact O-CB 3.48Å; P479-R483 WeakPolarHBondContact O-CG 3.34Å; P479-R483 PolarHBondContact O-N 3.14Å; V481-R483 PolarHBondContact O-N 2.94Å; R483-I486 PolarHBondContact O-N 2.94Å; R483-I487 WeakPolarHBondContact O-CD1 3.12Å; R483-I487 VanDerWaalsContact O-CG1 3.29Å; R483-I487 WeakPolarHBondContact O-CG1 3.31Å; R483-I487 PolarHBondContact O-N 3.08Å
484	R	65.9	Low	62.7	Low	158 Å²	158	109.5 Å²	109.5	60%	0.596	54%	0.537	S	S	*	.	H	α-helix	trans	-66	-38.1	175.5	-81.7	-179.2	-73	165.1	-4.8	112.1	K480 V481 M482 S488	K480-R484 WeakPolarHBondContact O-CG 3.48Å; K480-R484 PolarHBondContact O-N 3.4Å; K480-R484 PolarHBondContact O-NE 3.07Å; V481-R484 WeakPolarHBondContact O-CB 3.25Å; V481-R484 PolarHBondContact O-N 2.85Å; V481-R484 VanDerWaalsContact O-N 3.07Å; M482-R484 VanDerWaalsContact C-N 3.34Å; M482-R484 PolarHBondContact O-N 3.25Å; R484-S488 VanDerWaalsContact O-CB 3.25Å; R484-S488 WeakPolarHBondContact O-CB 3.21Å; R484-S488 PolarHBondContact O-N 3.42Å
485	C	60.5	Low	64.3	Low	36 Å²	36	107.8 Å²	107.8	24%	0.243	53%	0.527	C	S	.	.	H	α-helix	trans	-67.7	-40.9	174.5	-70.5	0	0	0	0	112	Y476 V481 M482 S488 M489	Y476-C485 HydrophobicContact CE1-CB 4.15Å; V481-C485 PolarHBondContact O-N 3.04Å; M482-C485 PolarHBondContact O-N 3.11Å; C485-S488 WeakPolarHBondContact O-CB 3.09Å; C485-S488 PolarHBondContact O-N 2.83Å; C485-M489 WeakPolarHBondContact O-CB 3.18Å; C485-M489 VanDerWaalsContact O-CG 3.27Å; C485-M489 WeakPolarHBondContact O-CG 3.46Å; C485-M489 PolarHBondContact O-N 3.5Å
486	I	69.5	Low	65.9	Low	85 Å²	85	105.2 Å²	105.2	44%	0.436	51%	0.514	S	S	.	.	H	α-helix	trans	-60	-52.3	174.2	-68	164.3	0	0	0	110.6	M482 R483 S488 M489 D490	M482-I486 HydrophobicContact CG-CD1 4.06Å; M482-I486 WeakPolarHBondContact O-CG1 3.37Å; M482-I486 PolarHBondContact O-N 2.67Å; R483-I486 PolarHBondContact O-N 2.94Å; I486-S488 PolarHBondContact O-N 3.23Å; I486-M489 CarbonylContact O-C 3.4Å; I486-M489 WeakPolarHBondContact O-CA 3.5Å; I486-M489 WeakPolarHBondContact O-CB 3.43Å; I486-M489 PolarHBondContact O-N 3.26Å; I486-D490 PolarHBondContact O-N 2.95Å
487	I	73.1	Confident	67.4	Low	100 Å²	100	102.2 Å²	102.2	51%	0.513	51%	0.511	S	S	.	.	H	α-helix	trans	-59.7	-34.1	177.7	-65.9	163.4	0	0	0	112	R483 K491	R483-I487 WeakPolarHBondContact O-CD1 3.12Å; R483-I487 VanDerWaalsContact O-CG1 3.29Å; R483-I487 WeakPolarHBondContact O-CG1 3.31Å; R483-I487 PolarHBondContact O-N 3.08Å; I487-K491 WeakPolarHBondContact O-CG 3.44Å; I487-K491 PolarHBondContact O-N 2.82Å
488	S	65.1	Low	68.7	Low	72 Å²	72	99.8 Å²	99.8	50%	0.503	50%	0.497	S	S	.	.	H	α-helix	trans	-70.8	-33.3	174.7	-171.5	0	0	0	0	112.6	R484 C485 I486 K492	R484-S488 VanDerWaalsContact O-CB 3.25Å; R484-S488 WeakPolarHBondContact O-CB 3.21Å; R484-S488 PolarHBondContact O-N 3.42Å; C485-S488 WeakPolarHBondContact O-CB 3.09Å; C485-S488 PolarHBondContact O-N 2.83Å; I486-S488 PolarHBondContact O-N 3.23Å; S488-K492 PolarHBondContact O-N 2.69Å
489	M	67.6	Low	69.3	Low	122 Å²	122	101.4 Å²	101.4	60%	0.601	50%	0.503	S	S	*	.	H	α-helix	trans	-75.5	-42.3	175.8	-72.8	174.4	70.1	0	0	111.9	C485 I486 K492 I493	C485-M489 WeakPolarHBondContact O-CB 3.18Å; C485-M489 VanDerWaalsContact O-CG 3.27Å; C485-M489 WeakPolarHBondContact O-CG 3.46Å; C485-M489 PolarHBondContact O-N 3.5Å; I486-M489 CarbonylContact O-C 3.4Å; I486-M489 WeakPolarHBondContact O-CA 3.5Å; I486-M489 WeakPolarHBondContact O-CB 3.43Å; I486-M489 PolarHBondContact O-N 3.26Å; M489-K492 CarbonylContact O-C 3.43Å; M489-K492 WeakPolarHBondContact O-CA 3.43Å; M489-K492 WeakPolarHBondContact O-CB 3.32Å; M489-K492 PolarHBondContact O-N 2.77Å; M489-K492 VanDerWaalsContact O-N 3.07Å; M489-I493 WeakPolarHBondContact O-CG1 3.41Å; M489-I493 PolarHBondContact O-N 2.97Å
490	D	70.4	Confident	69.7	Low	80 Å²	80	101.5 Å²	101.5	43%	0.428	50%	0.498	S	S	.	.	H	α-helix	trans	-58.8	-49.6	175.3	-69.8	-28.8	0	0	0	110.6	I486 K492 I493 D494	I486-D490 PolarHBondContact O-N 2.95Å; D490-K492 PolarHBondContact O-N 2.67Å; D490-K492 VanDerWaalsContact O-N 3.12Å; D490-I493 CarbonylContact O-C 3.6Å; D490-I493 WeakPolarHBondContact O-CA 3.42Å; D490-I493 WeakPolarHBondContact O-CB 3.42Å; D490-I493 PolarHBondContact O-N 2.65Å; D490-D494 PolarHBondContact O-N 2.86Å
491	K	74.6	Confident	70	Confident	146 Å²	146	100.7 Å²	100.7	64%	0.635	49%	0.494	S	S	*	.	H	α-helix	trans	-54.9	-35	173.6	-75.9	-174.3	176.7	-165.8	0	113.6	I487 E495	I487-K491 WeakPolarHBondContact O-CG 3.44Å; I487-K491 PolarHBondContact O-N 2.82Å; K491-E495 VanDerWaalsContact O-CB 3.31Å; K491-E495 WeakPolarHBondContact O-CB 3.45Å; K491-E495 PolarHBondContact O-N 3.49Å
492	K	72.9	Confident	70.1	Confident	128 Å²	128	103.1 Å²	103.1	56%	0.557	51%	0.506	S	S	*	.	H	α-helix	trans	-74	-33.7	174.8	-103	179.1	174.6	178.6	0	112.9	S488 M489 D490 D494 L496	S488-K492 PolarHBondContact O-N 2.69Å; M489-K492 CarbonylContact O-C 3.43Å; M489-K492 WeakPolarHBondContact O-CA 3.43Å; M489-K492 WeakPolarHBondContact O-CB 3.32Å; M489-K492 PolarHBondContact O-N 2.77Å; M489-K492 VanDerWaalsContact O-N 3.07Å; D490-K492 PolarHBondContact O-N 2.67Å; D490-K492 VanDerWaalsContact O-N 3.12Å; K492-D494 VanDerWaalsContact C-N 3.34Å; K492-L496 VanDerWaalsContact O-CB 3.25Å; K492-L496 WeakPolarHBondContact O-CB 3.45Å; K492-L496 WeakPolarHBondContact O-CD1 3.45Å; K492-L496 WeakPolarHBondContact O-CG 3.4Å; K492-L496 PolarHBondContact O-N 2.89Å
493	I	73.7	Confident	70.6	Confident	102 Å²	102	104.8 Å²	104.8	52%	0.523	51%	0.51	S	S	.	.	H	α-helix	trans	-65.4	-41.9	172.8	-70.1	165.2	0	0	0	109.4	M489 D490 L496 S497	M489-I493 WeakPolarHBondContact O-CG1 3.41Å; M489-I493 PolarHBondContact O-N 2.97Å; D490-I493 CarbonylContact O-C 3.6Å; D490-I493 WeakPolarHBondContact O-CA 3.42Å; D490-I493 WeakPolarHBondContact O-CB 3.42Å; D490-I493 PolarHBondContact O-N 2.65Å; I493-L496 PolarHBondContact O-N 2.91Å; I493-S497 WeakPolarHBondContact O-CB 3.46Å; I493-S497 PolarHBondContact O-N 3.5Å
494	D	74.3	Confident	70.5	Confident	89 Å²	89	103.6 Å²	103.6	48%	0.476	51%	0.511	S	S	.	.	H	α-helix	trans	-66.5	-44.5	176.5	-60	-33.7	0	0	0	111.9	D490 K492 S497 L498	D490-D494 PolarHBondContact O-N 2.86Å; K492-D494 VanDerWaalsContact C-N 3.34Å; D494-S497 WeakPolarHBondContact O-CB 3.43Å; D494-S497 PolarHBondContact O-N 3.12Å; D494-L498 WeakPolarHBondContact O-CB 3.26Å; D494-L498 PolarHBondContact O-N 3.08Å
495	E	74	Confident	70.6	Confident	118 Å²	118	98.9 Å²	98.9	55%	0.551	50%	0.503	S	S	*	.	H	α-helix	trans	-60.7	-44.8	174.9	-174.2	175.3	-155.3	0	0	111.8	K491 L498 Q499	K491-E495 VanDerWaalsContact O-CB 3.31Å; K491-E495 WeakPolarHBondContact O-CB 3.45Å; K491-E495 PolarHBondContact O-N 3.49Å; E495-L498 PolarHBondContact O-N 3.34Å; E495-Q499 PolarHBondContact O-N 3.23Å
496	L	72.1	Confident	70.9	Confident	105 Å²	105	102.7 Å²	102.7	55%	0.55	52%	0.517	S	S	.	.	H	α-helix	trans	-68.2	-35.1	174.8	-73	169.2	0	0	0	112.4	K492 I493 Q499 N500	K492-L496 VanDerWaalsContact O-CB 3.25Å; K492-L496 WeakPolarHBondContact O-CB 3.45Å; K492-L496 WeakPolarHBondContact O-CD1 3.45Å; K492-L496 WeakPolarHBondContact O-CG 3.4Å; K492-L496 PolarHBondContact O-N 2.89Å; I493-L496 PolarHBondContact O-N 2.91Å; L496-Q499 PolarHBondContact O-N 3.49Å; L496-N500 VanDerWaalsContact O-CB 3.27Å; L496-N500 WeakPolarHBondContact O-CB 3.45Å; L496-N500 PolarHBondContact O-N 3.07Å
497	S	73.8	Confident	70.6	Confident	56 Å²	56	102.6 Å²	102.6	39%	0.392	52%	0.52	S	S	.	.	H	α-helix	trans	-65.5	-41.6	175	-175.3	0	0	0	0	111	I493 D494 N500 K501	I493-S497 WeakPolarHBondContact O-CB 3.46Å; I493-S497 PolarHBondContact O-N 3.5Å; D494-S497 WeakPolarHBondContact O-CB 3.43Å; D494-S497 PolarHBondContact O-N 3.12Å; S497-N500 PolarHBondContact O-N 3.24Å; S497-K501 WeakPolarHBondContact O-CG 3.49Å; S497-K501 PolarHBondContact O-N 3.29Å
498	L	76.2	Confident	70.2	Confident	105 Å²	105	99.6 Å²	99.6	55%	0.55	51%	0.514	S	S	.	.	H	α-helix	trans	-65.3	-45.9	173	-175	64.3	0	0	0	111.5	D494 E495 N500 K501 L502	D494-L498 WeakPolarHBondContact O-CB 3.26Å; D494-L498 PolarHBondContact O-N 3.08Å; E495-L498 PolarHBondContact O-N 3.34Å; L498-N500 VanDerWaalsContact C-N 3.28Å; L498-N500 PolarHBondContact O-N 2.92Å; L498-K501 PolarHBondContact O-N 2.67Å; L498-L502 HydrophobicContact CG-CD1 4.45Å; L498-L502 WeakPolarHBondContact O-CG 3.5Å; L498-L502 PolarHBondContact O-N 3.26Å
499	Q	72.6	Confident	70.3	Confident	99 Å²	99	100.5 Å²	100.5	46%	0.463	51%	0.513	S	S	.	.	H	α-helix	trans	-58.5	-38.8	172.6	-80.5	-168.5	-24.7	0	0	112.2	E495 L496 L502 F503	E495-Q499 PolarHBondContact O-N 3.23Å; L496-Q499 PolarHBondContact O-N 3.49Å; Q499-L502 PolarHBondContact O-N 3.24Å; Q499-F503 WeakPolarHBondContact O-CB 3.22Å; Q499-F503 WeakPolarHBondContact O-CD2 3.19Å; Q499-F503 PolarHBondContact O-N 3.48Å
500	N	69.7	Low	70.5	Confident	91 Å²	91	97.6 Å²	97.6	49%	0.487	51%	0.505	S	S	.	.	H	α-helix	trans	-68.6	-38.9	178.5	-157.9	-28.5	0	0	0	111.6	L496 S497 L498 F503 Q504	L496-N500 VanDerWaalsContact O-CB 3.27Å; L496-N500 WeakPolarHBondContact O-CB 3.45Å; L496-N500 PolarHBondContact O-N 3.07Å; S497-N500 PolarHBondContact O-N 3.24Å; L498-N500 VanDerWaalsContact C-N 3.28Å; L498-N500 PolarHBondContact O-N 2.92Å; N500-F503 PolarHBondContact O-N 2.78Å; N500-Q504 WeakPolarHBondContact O-CB 3.31Å; N500-Q504 VanDerWaalsContact O-CG 3.24Å; N500-Q504 WeakPolarHBondContact O-CG 3.22Å; N500-Q504 PolarHBondContact O-N 3.42Å; N500-Q504 PolarHBondContact OD1-NE2 2.8Å
501	K	73.7	Confident	70	Confident	135 Å²	135	98.5 Å²	98.5	59%	0.587	51%	0.51	S	S	*	.	H	α-helix	trans	-60.9	-43	170.1	-71.2	172.3	-175.6	175.5	0	111.9	S497 L498 Q504 S505	S497-K501 WeakPolarHBondContact O-CG 3.49Å; S497-K501 PolarHBondContact O-N 3.29Å; L498-K501 PolarHBondContact O-N 2.67Å; K501-Q504 PolarHBondContact O-N 3.35Å; K501-S505 PolarHBondContact O-N 3.11Å; K501-S505 VanDerWaalsContact O-N 3.1Å
502	L	69.4	Low	69.7	Low	96 Å²	96	96.2 Å²	96.2	50%	0.503	50%	0.504	S	S	.	.	H	α-helix	trans	-64.1	-47.6	175.8	-69.3	170.6	0	0	0	111.4	L498 Q499 Q504 S505 E506	L498-L502 HydrophobicContact CG-CD1 4.45Å; L498-L502 WeakPolarHBondContact O-CG 3.5Å; L498-L502 PolarHBondContact O-N 3.26Å; Q499-L502 PolarHBondContact O-N 3.24Å; L502-Q504 VanDerWaalsContact C-N 3.31Å; L502-Q504 PolarHBondContact O-N 2.91Å; L502-S505 WeakPolarHBondContact O-CA 3.11Å; L502-S505 PolarHBondContact O-N 3.4Å; L502-S505 PolarHBondContact O-OG 2.84Å; L502-E506 PolarHBondContact O-N 2.87Å
503	F	67.8	Low	69.6	Low	129 Å²	129	95.1 Å²	95.1	57%	0.566	50%	0.503	S	S	*	.	H	α-helix	trans	-59.7	-37.5	174.6	-95.8	-67.3	0	0	0	112.8	Q499 N500 S505 E506 V507	Q499-F503 WeakPolarHBondContact O-CB 3.22Å; Q499-F503 WeakPolarHBondContact O-CD2 3.19Å; Q499-F503 PolarHBondContact O-N 3.48Å; N500-F503 PolarHBondContact O-N 2.78Å; F503-S505 VanDerWaalsContact C-N 3.33Å; F503-S505 PolarHBondContact O-N 3.05Å; F503-E506 PolarHBondContact O-N 3.29Å; F503-V507 WeakPolarHBondContact O-CB 3.36Å; F503-V507 VanDerWaalsContact O-CG2 3.29Å; F503-V507 WeakPolarHBondContact O-CG2 3.34Å; F503-V507 PolarHBondContact O-N 3.3Å
504	Q	64.2	Low	69.4	Low	123 Å²	123	95.4 Å²	95.4	58%	0.575	51%	0.505	S	S	*	.	H	α-helix	trans	-64	-38.8	174.2	-74.4	169.9	35.9	0	0	111.7	N500 K501 L502 V507 G508	N500-Q504 WeakPolarHBondContact O-CB 3.31Å; N500-Q504 VanDerWaalsContact O-CG 3.24Å; N500-Q504 WeakPolarHBondContact O-CG 3.22Å; N500-Q504 PolarHBondContact O-N 3.42Å; N500-Q504 PolarHBondContact OD1-NE2 2.8Å; K501-Q504 PolarHBondContact O-N 3.35Å; L502-Q504 VanDerWaalsContact C-N 3.31Å; L502-Q504 PolarHBondContact O-N 2.91Å; Q504-V507 PolarHBondContact O-N 3.44Å; Q504-G508 PolarHBondContact O-N 3.36Å
505	S	67.5	Low	69	Low	60 Å²	60	98.5 Å²	98.5	42%	0.42	51%	0.511	S	S	.	.	H	α-helix	trans	-68.2	-37.9	173.1	79.1	0	0	0	0	112.7	K501 L502 F503 G508 N509	K501-S505 PolarHBondContact O-N 3.11Å; K501-S505 VanDerWaalsContact O-N 3.1Å; L502-S505 WeakPolarHBondContact O-CA 3.11Å; L502-S505 PolarHBondContact O-N 3.4Å; L502-S505 PolarHBondContact O-OG 2.84Å; F503-S505 VanDerWaalsContact C-N 3.33Å; F503-S505 PolarHBondContact O-N 3.05Å; S505-G508 PolarHBondContact O-N 3.09Å; S505-N509 PolarHBondContact O-N 3.36Å; S505-N509 PolarHBondContact O-ND2 3.45Å
506	E	65.8	Low	68.8	Low	115 Å²	115	97.1 Å²	97.1	54%	0.537	51%	0.507	S	S	.	.	H	α-helix	trans	-66.8	-37.4	174.2	-72.8	-172.3	170.7	0	0	112.6	L502 F503 N509 S510	L502-E506 PolarHBondContact O-N 2.87Å; F503-E506 PolarHBondContact O-N 3.29Å; E506-N509 CarbonylContact O-C 3.59Å; E506-N509 PolarHBondContact O-N 3.07Å; E506-S510 VanDerWaalsContact O-CB 3.27Å; E506-S510 WeakPolarHBondContact O-CB 3.4Å; E506-S510 PolarHBondContact O-N 3.3Å
507	V	64.2	Low	69	Low	83 Å²	83	98.4 Å²	98.4	50%	0.503	51%	0.508	S	S	.	.	H	α-helix	trans	-67	-38.5	173	170	0	0	0	0	110.9	F503 Q504 S510 N511	F503-V507 WeakPolarHBondContact O-CB 3.36Å; F503-V507 VanDerWaalsContact O-CG2 3.29Å; F503-V507 WeakPolarHBondContact O-CG2 3.34Å; F503-V507 PolarHBondContact O-N 3.3Å; Q504-V507 PolarHBondContact O-N 3.44Å; V507-S510 PolarHBondContact O-N 3.39Å; V507-N511 PolarHBondContact O-N 2.92Å; V507-N511 PolarHBondContact O-ND2 3.48Å; V507-N511 VanDerWaalsContact O-ND2 3.08Å
508	G	63.9	Low	68.9	Low	38 Å²	38	102 Å²	102	39%	0.392	52%	0.517	S	S	.	.	H	α-helix	trans	-58	-50.1	169.7	0	0	0	0	0	112.2	Q504 S505 S510 N511 L512	Q504-G508 PolarHBondContact O-N 3.36Å; S505-G508 PolarHBondContact O-N 3.09Å; G508-S510 VanDerWaalsContact C-N 3.34Å; G508-S510 PolarHBondContact O-N 3.46Å; G508-N511 PolarHBondContact O-N 2.69Å; G508-L512 PolarHBondContact O-N 3.01Å
509	N	68.1	Low	68.7	Low	91 Å²	91	99.3 Å²	99.3	49%	0.487	51%	0.505	S	S	.	.	H	α-helix	trans	-62.9	-37.7	176	-72.3	-23.5	0	0	0	112.4	S505 E506 L512 I513	S505-N509 PolarHBondContact O-N 3.36Å; S505-N509 PolarHBondContact O-ND2 3.45Å; E506-N509 CarbonylContact O-C 3.59Å; E506-N509 PolarHBondContact O-N 3.07Å; N509-L512 CarbonylContact O-C 3.53Å; N509-L512 PolarHBondContact O-N 2.88Å; N509-I513 WeakPolarHBondContact O-CB 3.31Å; N509-I513 WeakPolarHBondContact O-CD1 3.32Å; N509-I513 WeakPolarHBondContact O-CG1 3.49Å; N509-I513 PolarHBondContact O-N 3.27Å
510	S	70.7	Confident	68.9	Low	60 Å²	60	99 Å²	99	42%	0.42	51%	0.505	S	S	.	.	H	α-helix	trans	-66.2	-40.6	178	-169.7	0	0	0	0	111.8	E506 V507 G508 I513 L514	E506-S510 VanDerWaalsContact O-CB 3.27Å; E506-S510 WeakPolarHBondContact O-CB 3.4Å; E506-S510 PolarHBondContact O-N 3.3Å; V507-S510 PolarHBondContact O-N 3.39Å; G508-S510 VanDerWaalsContact C-N 3.34Å; G508-S510 PolarHBondContact O-N 3.46Å; S510-I513 PolarHBondContact O-N 2.88Å; S510-L514 WeakPolarHBondContact O-CB 3.11Å; S510-L514 WeakPolarHBondContact O-CG 3.5Å; S510-L514 PolarHBondContact O-N 3.5Å
511	N	60.7	Low	69.1	Low	100 Å²	100	99 Å²	99	54%	0.535	51%	0.505	S	S	.	.	H	α-helix	trans	-63.7	-40.2	171.4	-73.9	-44.7	0	0	0	111.9	V507 G508 L514 Y515	V507-N511 PolarHBondContact O-N 2.92Å; V507-N511 PolarHBondContact O-ND2 3.48Å; V507-N511 VanDerWaalsContact O-ND2 3.08Å; G508-N511 PolarHBondContact O-N 2.69Å; N511-L514 PolarHBondContact O-N 2.93Å; N511-Y515 WeakPolarHBondContact O-CB 3.49Å; N511-Y515 PolarHBondContact O-N 3.28Å
512	L	68.3	Low	68.9	Low	97 Å²	97	95.1 Å²	95.1	51%	0.508	49%	0.491	S	S	.	.	H	α-helix	trans	-66.3	-40.3	175.2	-172.6	65.5	0	0	0	112.1	G508 N509 Y515 L516	G508-L512 PolarHBondContact O-N 3.01Å; N509-L512 CarbonylContact O-C 3.53Å; N509-L512 PolarHBondContact O-N 2.88Å; L512-Y515 PolarHBondContact O-N 3.25Å; L512-L516 HydrophobicContact CG-CD1 4.14Å; L512-L516 WeakPolarHBondContact O-CB 3.23Å; L512-L516 VanDerWaalsContact O-CG 3.28Å; L512-L516 WeakPolarHBondContact O-CG 3.46Å; L512-L516 PolarHBondContact O-N 3.3Å
513	I	70.8	Confident	69	Low	106 Å²	106	95.3 Å²	95.3	54%	0.544	49%	0.492	S	S	.	.	H	α-helix	trans	-64.7	-43.6	175.2	-71.9	162.9	0	0	0	110.6	N509 S510 Y515 L516 K517	N509-I513 WeakPolarHBondContact O-CB 3.31Å; N509-I513 WeakPolarHBondContact O-CD1 3.32Å; N509-I513 WeakPolarHBondContact O-CG1 3.49Å; N509-I513 PolarHBondContact O-N 3.27Å; S510-I513 PolarHBondContact O-N 2.88Å; I513-Y515 VanDerWaalsContact C-N 3.33Å; I513-Y515 PolarHBondContact O-N 3.5Å; I513-L516 PolarHBondContact O-N 2.99Å; I513-K517 WeakPolarHBondContact O-CB 3.11Å; I513-K517 PolarHBondContact O-N 3.42Å
514	L	68.7	Low	69.3	Low	107 Å²	107	94.5 Å²	94.5	56%	0.56	49%	0.491	S	S	*	.	H	α-helix	trans	-62.9	-39.5	175.1	-76.2	169.5	0	0	0	111.9	S510 N511 K518	S510-L514 WeakPolarHBondContact O-CB 3.11Å; S510-L514 WeakPolarHBondContact O-CG 3.5Å; S510-L514 PolarHBondContact O-N 3.5Å; N511-L514 PolarHBondContact O-N 2.93Å; L514-K518 WeakPolarHBondContact O-CB 3.47Å; L514-K518 PolarHBondContact O-N 3.38Å; L514-K518 VanDerWaalsContact O-N 3.07Å
515	Y	66.1	Low	69.7	Low	154 Å²	154	92.9 Å²	92.9	60%	0.604	48%	0.484	S	S	*	.	H	α-helix	trans	-63.2	-52.3	173.2	177.8	-96.1	0	0	0	111.7	N511 L512 I513 K517 K518 T519	N511-Y515 WeakPolarHBondContact O-CB 3.49Å; N511-Y515 PolarHBondContact O-N 3.28Å; L512-Y515 PolarHBondContact O-N 3.25Å; I513-Y515 VanDerWaalsContact C-N 3.33Å; I513-Y515 PolarHBondContact O-N 3.5Å; Y515-K517 VanDerWaalsContact C-N 3.34Å; Y515-K517 PolarHBondContact O-N 3.36Å; Y515-K518 PolarHBondContact O-N 3.05Å; Y515-T519 PolarHBondContact O-N 2.97Å; Y515-T519 PolarHBondContact O-OG1 3.15Å; Y515-T519 VanDerWaalsContact O-OG1 3.06Å
516	L	71.2	Confident	69.8	Low	89 Å²	89	93.9 Å²	93.9	47%	0.466	48%	0.484	S	S	.	.	H	α-helix	trans	-59.3	-43.2	178.5	-74	169.4	0	0	0	112	L512 I513 T519 I520	L512-L516 HydrophobicContact CG-CD1 4.14Å; L512-L516 WeakPolarHBondContact O-CB 3.23Å; L512-L516 VanDerWaalsContact O-CG 3.28Å; L512-L516 WeakPolarHBondContact O-CG 3.46Å; L512-L516 PolarHBondContact O-N 3.3Å; I513-L516 PolarHBondContact O-N 2.99Å; L516-T519 PolarHBondContact O-N 2.91Å; L516-I520 WeakPolarHBondContact O-CG1 3.3Å; L516-I520 PolarHBondContact O-N 3.5Å
517	K	74.8	Confident	69.9	Low	132 Å²	132	92 Å²	92	57%	0.574	48%	0.48	S	S	*	.	H	α-helix	trans	-63.1	-45	178.6	-161.8	174.5	-171.2	-179.3	0	111.4	I513 Y515 T519 I520 D521	I513-K517 WeakPolarHBondContact O-CB 3.11Å; I513-K517 PolarHBondContact O-N 3.42Å; Y515-K517 VanDerWaalsContact C-N 3.34Å; Y515-K517 PolarHBondContact O-N 3.36Å; K517-T519 VanDerWaalsContact C-N 3.3Å; K517-T519 PolarHBondContact O-N 3.34Å; K517-I520 PolarHBondContact O-N 3.16Å; K517-D521 VanDerWaalsContact O-CG 3.22Å; K517-D521 PolarHBondContact O-N 3.21Å
518	K	73.5	Confident	70.3	Confident	132 Å²	132	93.8 Å²	93.8	57%	0.574	48%	0.482	S	S	*	.	H	α-helix	trans	-63	-34.7	174.5	-172.2	175.7	-177.7	178.6	0	112.8	L514 Y515 N522	L514-K518 WeakPolarHBondContact O-CB 3.47Å; L514-K518 PolarHBondContact O-N 3.38Å; L514-K518 VanDerWaalsContact O-N 3.07Å; Y515-K518 PolarHBondContact O-N 3.05Å; K518-N522 PolarHBondContact O-N 3Å; K518-N522 PolarHBondContact O-ND2 2.99Å
519	T	71.6	Confident	70.5	Confident	48 Å²	48	94.8 Å²	94.8	29%	0.294	49%	0.486	S	S	.	.	H	α-helix	trans	-69.8	-40.7	174.6	-60.9	0	0	0	0	111.7	Y515 L516 K517 N522 L523	Y515-T519 PolarHBondContact O-N 2.97Å; Y515-T519 PolarHBondContact O-OG1 3.15Å; Y515-T519 VanDerWaalsContact O-OG1 3.06Å; L516-T519 PolarHBondContact O-N 2.91Å; K517-T519 VanDerWaalsContact C-N 3.3Å; K517-T519 PolarHBondContact O-N 3.34Å; T519-N522 PolarHBondContact O-N 3.49Å; T519-L523 HydrophobicContact CG2-CD1 4.22Å; T519-L523 WeakPolarHBondContact O-CG 3.38Å; T519-L523 PolarHBondContact O-N 3.48Å
520	I	75.3	Confident	70.3	Confident	94 Å²	94	96.4 Å²	96.4	48%	0.482	49%	0.494	S	S	.	.	H	α-helix	trans	-62.5	-47.1	172.7	-69.1	164.5	0	0	0	110.7	L516 K517 N522 L523 M524	L516-I520 WeakPolarHBondContact O-CG1 3.3Å; L516-I520 PolarHBondContact O-N 3.5Å; K517-I520 PolarHBondContact O-N 3.16Å; I520-N522 VanDerWaalsContact C-N 3.29Å; I520-N522 PolarHBondContact O-N 2.97Å; I520-L523 PolarHBondContact O-N 3.16Å; I520-M524 HydrophobicContact CG2-CG 4.34Å; I520-M524 HydrophobicContact CG2-SD 4.07Å; I520-M524 WeakPolarHBondContact O-CG 3.37Å; I520-M524 PolarHBondContact O-N 3.33Å
521	D	74.4	Confident	70.1	Confident	89 Å²	89	101.9 Å²	101.9	48%	0.476	51%	0.51	S	S	.	.	H	α-helix	trans	-60.4	-38	178.6	-67.1	-29.1	0	0	0	111.8	K517 E525	K517-D521 VanDerWaalsContact O-CG 3.22Å; K517-D521 PolarHBondContact O-N 3.21Å; D521-E525 PolarHBondContact O-N 3.4Å
522	N	70.4	Confident	70.4	Confident	54 Å²	54	100.9 Å²	100.9	29%	0.289	52%	0.516	S	S	.	.	H	α-helix	trans	-63.4	-52.1	172.7	-72.2	-18.3	0	0	0	111.4	K518 T519 I520 M524 E525 D526 R569	K518-N522 PolarHBondContact O-N 3Å; K518-N522 PolarHBondContact O-ND2 2.99Å; T519-N522 PolarHBondContact O-N 3.49Å; I520-N522 VanDerWaalsContact C-N 3.29Å; I520-N522 PolarHBondContact O-N 2.97Å; N522-M524 VanDerWaalsContact C-N 3.26Å; N522-M524 PolarHBondContact O-N 3.45Å; N522-E525 PolarHBondContact O-N 2.88Å; N522-E525 VanDerWaalsContact O-N 3.1Å; N522-D526 PolarHBondContact O-N 3.07Å; N522-R569 PolarHBondContact OD1-NH2 3.29Å
523	L	71.7	Confident	69.1	Low	100 Å²	100	103 Å²	103	52%	0.524	52%	0.523	S	S	.	.	H	α-helix	trans	-60.4	-34.6	-179.8	-72.6	167.5	0	0	0	112.6	T519 I520 D526 V527	T519-L523 HydrophobicContact CG2-CD1 4.22Å; T519-L523 WeakPolarHBondContact O-CG 3.38Å; T519-L523 PolarHBondContact O-N 3.48Å; I520-L523 PolarHBondContact O-N 3.16Å; L523-D526 PolarHBondContact O-N 3.32Å; L523-V527 VanDerWaalsContact O-CG2 3.31Å; L523-V527 WeakPolarHBondContact O-CG2 3.25Å; L523-V527 PolarHBondContact O-N 3.1Å
524	M	72.8	Confident	67.8	Low	113 Å²	113	103.4 Å²	103.4	56%	0.557	53%	0.533	S	S	*	.	H	α-helix	trans	-66.3	-37.1	175.5	-75.5	-175.9	68.4	0	0	112.8	I520 N522 K528	I520-M524 HydrophobicContact CG2-CG 4.34Å; I520-M524 HydrophobicContact CG2-SD 4.07Å; I520-M524 WeakPolarHBondContact O-CG 3.37Å; I520-M524 PolarHBondContact O-N 3.33Å; N522-M524 VanDerWaalsContact C-N 3.26Å; N522-M524 PolarHBondContact O-N 3.45Å; M524-K528 PolarHBondContact O-N 2.8Å; M524-K528 VanDerWaalsContact O-N 3.16Å
525	E	72.9	Confident	66.6	Low	89 Å²	89	105.2 Å²	105.2	42%	0.416	55%	0.548	S	S	.	.	H	α-helix	trans	-71.8	-38.5	173.2	-73.5	-59.7	131.6	0	0	111.9	D521 N522 V527 K528 A529	D521-E525 PolarHBondContact O-N 3.4Å; N522-E525 PolarHBondContact O-N 2.88Å; N522-E525 VanDerWaalsContact O-N 3.1Å; E525-V527 VanDerWaalsContact C-N 3.32Å; E525-V527 PolarHBondContact O-N 3.44Å; E525-K528 WeakPolarHBondContact O-CB 3.36Å; E525-K528 PolarHBondContact O-N 2.95Å; E525-K528 VanDerWaalsContact O-N 3.14Å; E525-K528 WeakPolarHBondContact OE1-CE 3.48Å; E525-K528 IonicContact OE1-NZ 2.74Å; E525-K528 PolarHBondContact OE1-NZ 3.46Å; E525-A529 PolarHBondContact O-N 3.44Å
526	D	69.3	Low	65.2	Low	80 Å²	80	103.3 Å²	103.3	43%	0.428	55%	0.553	S	S	.	*	H	α-helix	trans	-63	-39.6	175.9	-61.7	-24.2	0	0	0	111.2	N522 L523 A529 L530	N522-D526 PolarHBondContact O-N 3.07Å; L523-D526 PolarHBondContact O-N 3.32Å; D526-A529 PolarHBondContact O-N 3.43Å; D526-L530 WeakPolarHBondContact O-CG 3.48Å; D526-L530 PolarHBondContact O-N 2.96Å
527	V	67.9	Low	63.5	Low	75 Å²	75	105.9 Å²	105.9	46%	0.455	57%	0.567	S	S	.	*	H	α-helix	trans	-66	-34.5	173.4	169.3	0	0	0	0	112.5	L523 E525 K531	L523-V527 VanDerWaalsContact O-CG2 3.31Å; L523-V527 WeakPolarHBondContact O-CG2 3.25Å; L523-V527 PolarHBondContact O-N 3.1Å; E525-V527 VanDerWaalsContact C-N 3.32Å; E525-V527 PolarHBondContact O-N 3.44Å; V527-K531 HydrophobicContact CG1-CD 4.37Å; V527-K531 WeakPolarHBondContact O-CB 3.41Å; V527-K531 WeakPolarHBondContact O-CG 3.35Å; V527-K531 PolarHBondContact O-N 3.47Å; V527-K531 VanDerWaalsContact O-N 3.16Å
528	K	73.1	Confident	61.8	Low	122 Å²	122	106.9 Å²	106.9	53%	0.53	58%	0.578	S	S	.	*	H	α-helix	trans	-66.3	-45.2	171.3	-75.9	177.5	-173.3	167.9	0	111.4	M524 E525 L530 K531 A532	M524-K528 PolarHBondContact O-N 2.8Å; M524-K528 VanDerWaalsContact O-N 3.16Å; E525-K528 WeakPolarHBondContact O-CB 3.36Å; E525-K528 PolarHBondContact O-N 2.95Å; E525-K528 VanDerWaalsContact O-N 3.14Å; E525-K528 WeakPolarHBondContact OE1-CE 3.48Å; E525-K528 IonicContact OE1-NZ 2.74Å; E525-K528 PolarHBondContact OE1-NZ 3.46Å; K528-L530 PolarHBondContact O-N 2.84Å; K528-K531 PolarHBondContact O-N 2.97Å; K528-A532 WeakPolarHBondContact O-CB 3.44Å; K528-A532 PolarHBondContact O-N 2.93Å
529	A	69.2	Low	60.1	Low	58 Å²	58	108.7 Å²	108.7	48%	0.479	59%	0.588	S	S	.	*	H	α-helix	trans	-61.1	-43.3	179.5	0	0	0	0	0	111.8	E525 D526 K531 A532	E525-A529 PolarHBondContact O-N 3.44Å; D526-A529 PolarHBondContact O-N 3.43Å; A529-K531 VanDerWaalsContact C-N 3.35Å; A529-K531 PolarHBondContact O-N 3.46Å; A529-A532 PolarHBondContact O-N 3Å; A529-A532 VanDerWaalsContact O-N 3.16Å
530	L	62.9	Low	58.6	Low	125 Å²	125	111.8 Å²	111.8	65%	0.654	61%	0.612	S	S	*	*	H	α-helix	trans	-63	-38.1	174.6	-73.7	166	0	0	0	112.7	D526 K528 A532	D526-L530 WeakPolarHBondContact O-CG 3.48Å; D526-L530 PolarHBondContact O-N 2.96Å; K528-L530 PolarHBondContact O-N 2.84Å; L530-A532 VanDerWaalsContact C-N 3.27Å; L530-A532 PolarHBondContact O-N 2.73Å
531	K	67.4	Low	57	Low	175 Å²	175	117.1 Å²	117.1	76%	0.761	63%	0.631	S	S	*	*	H	α-helix	trans	-73.6	-14.4	175.1	-74.3	-179.9	179.1	-175.4	0	114.3	V527 K528 A529	V527-K531 HydrophobicContact CG1-CD 4.37Å; V527-K531 WeakPolarHBondContact O-CB 3.41Å; V527-K531 WeakPolarHBondContact O-CG 3.35Å; V527-K531 PolarHBondContact O-N 3.47Å; V527-K531 VanDerWaalsContact O-N 3.16Å; K528-K531 PolarHBondContact O-N 2.97Å; A529-K531 VanDerWaalsContact C-N 3.35Å; A529-K531 PolarHBondContact O-N 3.46Å
532	A	66.1	Low	55.6	Low	79 Å²	79	118.5 Å²	118.5	65%	0.653	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	-4.7	-179.6	0	0	0	0	0	113.8	K528 A529 L530	K528-A532 WeakPolarHBondContact O-CB 3.44Å; K528-A532 PolarHBondContact O-N 2.93Å; A529-A532 PolarHBondContact O-N 3Å; A529-A532 VanDerWaalsContact O-N 3.16Å; L530-A532 VanDerWaalsContact C-N 3.27Å; L530-A532 PolarHBondContact O-N 2.73Å
533	Q	41.2	Very low	54	Low	142 Å²	142	120.2 Å²	120.2	66%	0.664	67%	0.667	S	S	*	*	S	Bend	trans	-80.7	125	177.4	-66.1	-164.6	0.7	0	0	111.5	T535	Q533-T535 PolarHBondContact O-N 3.28Å
534	P	42.9	Very low	52.4	Low	115 Å²	115	121 Å²	121	75%	0.747	68%	0.676	S	S	*	*			trans	-79	114.1	177.1	30.9	-32.6	0	0	0	110.9
535	T	44.5	Very low	50.8	Low	144 Å²	144	121 Å²	121	88%	0.883	68%	0.683	S	S	*	*			trans	-76.5	123.9	168.8	49.7	0	0	0	0	110.4	Q533	Q533-T535 PolarHBondContact O-N 3.28Å
536	T	36.9	Very low	49.1	Very low	114 Å²	114	123.9 Å²	123.9	70%	0.699	70%	0.7	S	S	*	*			trans	-98.2	154.6	178.1	45.4	0	0	0	0	112.6
537	N	34.5	Very low	47.6	Very low	143 Å²	143	125.3 Å²	125.3	77%	0.765	71%	0.712	S	S	*	*			trans	73.9	107.1	163.6	-51.8	-25.3	0	0	0	118.3
538	L	40.2	Very low	46.2	Very low	154 Å²	154	126.7 Å²	126.7	81%	0.806	73%	0.725	S	S	*	*				-174.8	106.2	101.9	-93.3	157.2	0	0	0	113
539	E	37.6	Very low	44.6	Very low	170 Å²	170	125.1 Å²	125.1	79%	0.794	73%	0.729	S	S	*	*			trans	48.4	124.7	141.7	-62.9	-173.4	128.9	0	0	125.7
540	S	39.2	Very low	43.1	Very low	113 Å²	113	128.8 Å²	128.8	79%	0.79	74%	0.741	S	S	*	*			trans	76	145.5	139.1	80	0	0	0	0	120
541	K	42.1	Very low	42.1	Very low	205 Å²	205	130.9 Å²	130.9	89%	0.891	75%	0.747	S	S	*	*			cis	-153.6	165.3	-18.6	-116.5	-171.6	177.3	176.3	0	109
542	P	44.5	Very low	41	Very low	119 Å²	119	127.8 Å²	127.8	77%	0.773	75%	0.745	S	S	*	*			trans	-118	175.2	-158.2	43.8	-36.8	0	0	0	116
543	A	37.8	Very low	39.5	Very low	89 Å²	89	130 Å²	130	74%	0.736	75%	0.754	S	S	*	*			trans	-172.3	151.8	144.9	0	0	0	0	0	108.5
544	T	38.4	Very low	39.2	Very low	116 Å²	116	129 Å²	129	71%	0.712	75%	0.753	S	S	*	*			cis	-163.3	152.6	3.1	-10	0	0	0	0	110.7
545	T	38	Very low	38.9	Very low	115 Å²	115	131.3 Å²	131.3	71%	0.706	75%	0.751	S	S	*	*			trans	58.6	145.6	147.6	49.4	0	0	0	0	121.1
546	L	37.1	Very low	38.3	Very low	148 Å²	148	131.3 Å²	131.3	78%	0.775	75%	0.745	S	S	*	*			cis	-161.8	164.9	-6.1	-84.9	150.1	0	0	0	104.8
547	T	38.1	Very low	38	Very low	110 Å²	110	131.5 Å²	131.5	68%	0.675	75%	0.747	S	S	*	*			cis	-164.7	153	9.5	-1	0	0	0	0	110.7
548	S	39	Very low	37.9	Very low	104 Å²	104	129.5 Å²	129.5	73%	0.727	74%	0.744	S	S	*	*			trans	41.4	146.4	141.3	67.5	0	0	0	0	122.4
549	S	39.3	Very low	37.5	Very low	89 Å²	89	129.9 Å²	129.9	62%	0.622	75%	0.746	S	S	*	*			cis	-176.6	146.5	-11.8	51.1	0	0	0	0	105.9
550	D	37.5	Very low	37.2	Very low	135 Å²	135	128 Å²	128	72%	0.722	75%	0.746	S	S	*	*				148.4	155.4	91	-84.6	-49.9	0	0	0	105.8
551	H	40.9	Very low	36.9	Very low	170 Å²	170	130.6 Å²	130.6	79%	0.787	75%	0.751	S	S	*	*			cis	-160.4	143.1	-34.3	-139.7	-67.7	0	0	0	107
552	P	44.6	Very low	36.4	Very low	110 Å²	110	125 Å²	125	71%	0.714	74%	0.743	S	S	*	*			trans	-109.1	172.1	-177.5	40	-34.5	0	0	0	114.2
553	C	35.5	Very low	35.5	Very low	125 Å²	125	127.2 Å²	127.2	85%	0.845	75%	0.748	S	S	*	*			trans	-176.9	153.2	166.1	-103.9	0	0	0	0	110.3
554	D	35.2	Very low	35.4	Very low	120 Å²	120	129 Å²	129	64%	0.642	75%	0.752	S	S	*	*			cis	-172	171.5	-18.9	-155.2	6.3	0	0	0	111.3
555	K	35.7	Very low	35.1	Very low	164 Å²	164	126.8 Å²	126.8	71%	0.713	75%	0.752	S	S	*	*			trans	76.4	118.8	163.3	-67.8	153	-172.4	177.6	0	118.6
556	L	31.5	Very low	34.7	Very low	145 Å²	145	125.1 Å²	125.1	76%	0.759	76%	0.757	S	S	*	*				71	130.9	60.9	-61	164.6	0	0	0	111.6
557	T	30.9	Very low	34.4	Very low	118 Å²	118	123.7 Å²	123.7	72%	0.724	76%	0.755	S	S	*	*			cis	-162.6	168.2	10.3	6.6	0	0	0	0	112.2
558	S	31.9	Very low	34.3	Very low	101 Å²	101	122.8 Å²	122.8	71%	0.706	75%	0.753	S	S	*	*			trans	58.4	110.8	155.6	62.7	0	0	0	0	120.4
559	N	33.3	Very low	34.2	Very low	161 Å²	161	125.2 Å²	125.2	86%	0.861	75%	0.747	S	S	*	*				-159.6	159.8	109.7	-98.1	-24.3	0	0	0	112
560	V	31.3	Very low	34	Very low	131 Å²	131	127.9 Å²	127.9	79%	0.794	75%	0.753	S	S	*	*			trans	-72.4	134.6	-177	-163	0	0	0	0	109.8
561	D	31.8	Very low	33.9	Very low	167 Å²	167	126 Å²	126	89%	0.893	74%	0.74	S	S	*	*			trans	-171.1	162.9	146.3	-103.7	-31.8	0	0	0	115.5
562	A	31.5	Very low	33.7	Very low	87 Å²	87	125 Å²	125	72%	0.719	74%	0.735	S	S	*	*			trans	-41.4	146.4	-166.4	0	0	0	0	0	121.3
563	L	26.6	Very low	33.1	Very low	167 Å²	167	126.7 Å²	126.7	87%	0.874	73%	0.728	S	S	*	*			trans	-70.4	129.3	160.2	-146.3	85.4	0	0	0	110.9	G565	L563-G565 PolarHBondContact O-N 3Å
564	P	36	Very low	33	Very low	127 Å²	127	122.6 Å²	122.6	83%	0.825	70%	0.701	S	S	*	*			trans	-89.2	99.5	164.7	-3.5	22.5	0	0	0	110.2
565	G	31.5	Very low	33	Very low	68 Å²	68	120 Å²	120	70%	0.701	69%	0.685	S	S	*	*			trans	-66.2	151.7	165.1	0	0	0	0	0	111.6	L563	L563-G565 PolarHBondContact O-N 3Å
566	G	29.2	Very low	33	Very low	80 Å²	80	115.8 Å²	115.8	83%	0.825	67%	0.67	S	S	*	*			trans	-86.3	130.5	-171.3	0	0	0	0	0	115.1
567	T	30.3	Very low	33.2	Very low	119 Å²	119	110 Å²	110	73%	0.73	64%	0.639	S	S	*	*			trans	-149.4	100.6	154.4	46	0	0	0	0	110.3
568	S	36.8	Very low	33.4	Very low	91 Å²	91	109.7 Å²	109.7	64%	0.636	63%	0.634	S	S	*	*			trans	-147.8	43.6	176.6	-159	0	0	0	0	114.1
569	R	37	Very low	33.7	Very low	155 Å²	155	108.3 Å²	108.3	59%	0.585	61%	0.613	S	S	*	*	S	Bend	trans	-146.4	-23.1	168.6	-132.4	171.9	-177.6	158	1	115.6	N522	N522-R569 PolarHBondContact OD1-NH2 3.29Å
570	L	34.5	Very low	33.8	Very low	144 Å²	144	105.7 Å²	105.7	75%	0.754	60%	0.595	S	S	*	*	S	Bend	trans	-82.9	-23	175.1	-86.1	93.1	0	0	0	114.8	H572 Y573	L570-H572 PolarHBondContact O-N 3Å; L570-Y573 PolarHBondContact O-N 2.88Å; L570-Y573 VanDerWaalsContact O-N 3.13Å
571	E	35.4	Very low	34.1	Very low	97 Å²	97	105 Å²	105	45%	0.453	58%	0.581	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.2	-10	-174.6	-72.7	-144.6	99.8	0	0	115.8	K149 Q575	K149-E571 IonicContact NZ-OE1 3.16Å; K149-E571 PolarHBondContact NZ-OE1 2.97Å; E571-Q575 WeakPolarHBondContact O-CG 3.29Å; E571-Q575 PolarHBondContact O-NE2 3.47Å
572	H	37.3	Very low	34.6	Very low	148 Å²	148	101.1 Å²	101.1	69%	0.685	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.3	-14.4	177.9	-141.8	-95.5	0	0	0	113.3	L570	L570-H572 PolarHBondContact O-N 3Å
573	Y	31.9	Very low	34.9	Very low	145 Å²	145	100.2 Å²	100.2	57%	0.569	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-38.1	175.7	-111.5	-97.2	0	0	0	112.1	L570 Q575 L576 L577 T665	L570-Y573 PolarHBondContact O-N 2.88Å; L570-Y573 VanDerWaalsContact O-N 3.13Å; Y573-Q575 PolarHBondContact O-N 3.29Å; Y573-Q575 VanDerWaalsContact O-N 3.15Å; Y573-L576 WeakPolarHBondContact O-CB 3.34Å; Y573-L576 PolarHBondContact O-N 3.11Å; Y573-L576 VanDerWaalsContact O-N 3.1Å; Y573-L577 WeakPolarHBondContact O-CD1 3.31Å; Y573-T665 HydrophobicContact CD1-CG2 4.36Å
574	S	33.8	Very low	35.4	Very low	39 Å²	39	96.1 Å²	96.1	27%	0.273	52%	0.515	S	S	.	.	G	3₁₀ helix	trans	-62.1	-22.9	177.4	57.2	0	0	0	0	114.1	L576 L577	S574-L576 VanDerWaalsContact C-N 3.26Å; S574-L576 PolarHBondContact O-N 3.14Å; S574-L577 PolarHBondContact O-N 3.34Å
575	Q	35.2	Very low	35.3	Very low	65 Å²	65	90.9 Å²	90.9	30%	0.304	48%	0.483	S	S	.	.	G	3₁₀ helix	trans	-71.1	-14.6	176.3	-65.9	-179.7	35.8	0	0	114.4	E571 Y573	E571-Q575 WeakPolarHBondContact O-CG 3.29Å; E571-Q575 PolarHBondContact O-NE2 3.47Å; Y573-Q575 PolarHBondContact O-N 3.29Å; Y573-Q575 VanDerWaalsContact O-N 3.15Å
576	L	35.2	Very low	35.5	Very low	76 Å²	76	91.7 Å²	91.7	40%	0.398	48%	0.483	S	S	.	.	G	3₁₀ helix	trans	-81.9	-21.8	177.6	-84.8	149.4	0	0	0	113.2	Y573 S574	Y573-L576 WeakPolarHBondContact O-CB 3.34Å; Y573-L576 PolarHBondContact O-N 3.11Å; Y573-L576 VanDerWaalsContact O-N 3.1Å; S574-L576 VanDerWaalsContact C-N 3.26Å; S574-L576 PolarHBondContact O-N 3.14Å
577	L	36.6	Very low	36.3	Very low	23 Å²	23	89.8 Å²	89.8	12%	0.12	45%	0.454	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-47.4	-170.9	-71.3	88.3	0	0	0	112.1	Y573 S574 R579 H580 T661 T665	Y573-L577 WeakPolarHBondContact O-CD1 3.31Å; S574-L577 PolarHBondContact O-N 3.34Å; L577-R579 PolarHBondContact O-N 2.77Å; L577-H580 PolarHBondContact O-N 2.82Å; L577-H580 PolarHBondContact O-ND1 3.06Å; L577-T661 HydrophobicContact CB-CG2 4.18Å; L577-T661 HydrophobicContact CD2-CG2 3.48Å; L577-T661 VanDerWaalsContact CD2-CG2 3.48Å; L577-T661 HydrophobicContact CG-CG2 3.45Å; L577-T661 VanDerWaalsContact CG-CG2 3.45Å; L577-T665 HydrophobicContact CD1-CG2 3.29Å; L577-T665 HydrophobicContact CD2-CG2 3.85Å; L577-T665 WeakPolarHBondContact CD2-OG1 3.22Å; L577-T665 HydrophobicContact CG-CG2 4.12Å
578	N	33.7	Very low	37.2	Very low	113 Å²	113	88.1 Å²	88.1	60%	0.604	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	3.7	178.1	-68.8	-9.4	0	0	0	113.8
579	R	38.2	Very low	37.6	Very low	71 Å²	71	83.9 Å²	83.9	27%	0.268	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-30.1	172.4	-75.1	-174.3	171.9	153	3	113.8	N140 L577 K581 R582	N140-R579 VanDerWaalsContact CB-NH2 3.33Å; N140-R579 PolarHBondContact O-NE 3.07Å; N140-R579 VanDerWaalsContact O-NE 3.07Å; N140-R579 PolarHBondContact O-NH2 3.48Å; N140-R579 PolarHBondContact OD1-NH1 3Å; L577-R579 PolarHBondContact O-N 2.77Å; R579-K581 VanDerWaalsContact C-N 3.26Å; R579-K581 PolarHBondContact O-N 3.36Å; R579-K581 VanDerWaalsContact O-N 3.13Å; R579-R582 PolarHBondContact O-N 3.22Å
580	H	37.3	Very low	38.2	Very low	106 Å²	106	77 Å²	77	49%	0.491	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-6.2	-165.7	-68.5	88.9	0	0	0	115.9	L577	L577-H580 PolarHBondContact O-N 2.82Å; L577-H580 PolarHBondContact O-ND1 3.06Å
581	K	35.6	Very low	39.2	Very low	116 Å²	116	70.1 Å²	70.1	50%	0.504	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	-0.9	166.5	-83.7	-166.3	170.5	-166.4	0	113.5	V155 D156 R579	V155-K581 HydrophobicContact CG1-CD 4.11Å; D156-K581 IonicContact OD1-NZ 2.7Å; D156-K581 PolarHBondContact OD1-NZ 2.68Å; R579-K581 VanDerWaalsContact C-N 3.26Å; R579-K581 PolarHBondContact O-N 3.36Å; R579-K581 VanDerWaalsContact O-N 3.13Å
582	R	42.5	Very low	40.3	Very low	87 Å²	87	66.4 Å²	66.4	33%	0.328	33%	0.327	S	S	.	.	S	Bend	trans	-112.9	40.8	-161.7	-66.3	-170.7	178	-176.5	2.1	115.7	R579	R579-R582 PolarHBondContact O-N 3.22Å
583	M	38.6	Very low	41.1	Very low	67 Å²	67	60.8 Å²	60.8	33%	0.33	30%	0.303	S	S	.	.			trans	-151.6	77.3	140.5	-75.6	-156.2	-53.7	0	0	107.8	A585	M583-A585 PolarHBondContact O-N 3.32Å
584	N	36.6	Very low	42.2	Very low	81 Å²	81	54.9 Å²	54.9	43%	0.433	28%	0.281	S	S	.	.			trans	-72.1	59.5	167.3	-88.7	1.6	0	0	0	110.4	D187	D187-N584 HydrophobicContact CB-CB 4.47Å
585	A	33.7	Very low	42.3	Very low	18 Å²	18	58 Å²	58	15%	0.149	30%	0.298	C	S	.	.			trans	-147.4	76.3	170.5	0	0	0	0	0	104.8	Y224 M583 N587	Y224-A585 VanDerWaalsContact O-CB 3.25Å; Y224-A585 WeakPolarHBondContact O-CB 3.2Å; M583-A585 PolarHBondContact O-N 3.32Å; A585-N587 PolarHBondContact O-N 3.37Å; A585-N587 PolarHBondContact O-OD1 2.53Å
586	A	37.1	Very low	42.3	Very low	85 Å²	85	59.6 Å²	59.6	70%	0.702	31%	0.306	S	S	*	.			trans	-60.2	100.5	159	0	0	0	0	0	105.5	R588	A586-R588 VanDerWaalsContact C-N 3.3Å; A586-R588 PolarHBondContact O-N 2.78Å
587	N	45.9	Very low	42.3	Very low	39 Å²	39	67 Å²	67	21%	0.209	33%	0.328	C	S	.	.			trans	-52.7	87.6	-168.2	-81.5	-8.7	0	0	0	112	R48 Q52 L223 A585 S589	R48-N587 PolarHBondContact O-ND2 3.35Å; R48-N587 VanDerWaalsContact O-ND2 3.14Å; Q52-N587 PolarHBondContact NE2-ND2 2.85Å; L223-N587 PolarHBondContact O-OD1 3.44Å; A585-N587 PolarHBondContact O-N 3.37Å; A585-N587 PolarHBondContact O-OD1 2.53Å; N587-S589 PolarHBondContact O-N 3.39Å
588	R	49.2	Very low	41.8	Very low	85 Å²	85	69.4 Å²	69.4	32%	0.321	35%	0.347	S	S	.	.			trans	-71.1	55.1	161.6	-81.3	-171	166.8	-116.4	-13.5	108.9	D227 E311 A586 A590	D227-R588 IonicContact OD2-CZ 3.35Å; D227-R588 IonicContact OD2-NH1 3.08Å; D227-R588 PolarHBondContact OD2-NH1 3.15Å; E311-R588 IonicContact OE2-CZ 3.85Å; E311-R588 IonicContact OE2-NH1 3.97Å; E311-R588 IonicContact OE2-NH2 2.75Å; E311-R588 PolarHBondContact OE2-NH2 2.94Å; A586-R588 VanDerWaalsContact C-N 3.3Å; A586-R588 PolarHBondContact O-N 2.78Å; R588-A590 PolarHBondContact O-N 2.61Å; R588-A590 VanDerWaalsContact O-N 3.13Å
589	S	44.9	Very low	41.4	Very low	2 Å²	2	68.8 Å²	68.8	1%	0.014	36%	0.358	C	S	.	.			trans	-75.2	11.8	166.1	-49.7	0	0	0	0	112.2	Q52 F222 N587	Q52-S589 PolarHBondContact NE2-OG 3.41Å; F222-S589 WeakPolarHBondContact CZ-O 3.17Å; N587-S589 PolarHBondContact O-N 3.39Å
590	A	50.2	Low	41.1	Very low	9 Å²	9	71.1 Å²	71.1	7%	0.074	38%	0.38	C	S	.	.			trans	-134.4	84.5	174.5	0	0	0	0	0	106.8	A261 Q315 Y318 R588	A261-A590 HydrophobicContact CB-CB 3.77Å; Q315-A590 HydrophobicContact CG-CB 4.24Å; Y318-A590 HydrophobicContact CD2-CB 4.45Å; Y318-A590 HydrophobicContact CG-CB 4.39Å; R588-A590 PolarHBondContact O-N 2.61Å; R588-A590 VanDerWaalsContact O-N 3.13Å
591	S	54.1	Low	40.6	Very low	1 Å²	1	73.5 Å²	73.5	1%	0.007	40%	0.396	C	S	.	.			trans	-78.1	152.7	160.9	178	0	0	0	0	109.1	D227	D227-S591 WeakPolarHBondContact OD1-CB 3.24Å; D227-S591 PolarHBondContact OD1-OG 2.81Å
592	M	58.6	Low	40.1	Very low	18 Å²	18	71.5 Å²	71.5	9%	0.089	41%	0.408	C	S	.	.			trans	-148.7	113.4	177.9	-75.2	-74	-70.9	0	0	108.2	A261 T262 V314 A397 F594	A261-M592 HydrophobicContact CB-CG 3.97Å; A261-M592 HydrophobicContact CB-SD 3.69Å; T262-M592 HydrophobicContact CG2-CE 3.48Å; T262-M592 VanDerWaalsContact CG2-CE 3.48Å; T262-M592 HydrophobicContact CG2-SD 3.62Å; V314-M592 HydrophobicContact CG1-CG 4.1Å; V314-M592 HydrophobicContact CG1-SD 4.35Å; A397-M592 HydrophobicContact CB-CE 3.46Å; A397-M592 VanDerWaalsContact CB-CE 3.46Å; M592-F594 HydrophobicContact CB-CD2 4.1Å; M592-F594 HydrophobicContact CB-CE1 4.39Å; M592-F594 HydrophobicContact CB-CE2 3.44Å; M592-F594 VanDerWaalsContact CB-CE2 3.44Å; M592-F594 HydrophobicContact CB-CZ 3.61Å; M592-F594 HydrophobicContact CE-CE1 3.75Å; M592-F594 HydrophobicContact CE-CE2 4.36Å; M592-F594 HydrophobicContact CE-CZ 3.37Å; M592-F594 HydrophobicContact CG-CE2 4.26Å; M592-F594 HydrophobicContact CG-CZ 4.14Å; M592-F594 PolarHBondContact O-N 2.88Å
593	V	55	Low	39.4	Very low	30 Å²	30	79.3 Å²	79.3	18%	0.182	44%	0.438	C	S	.	.			trans	-70.6	114.5	176.1	177.5	0	0	0	0	110.6	A229 C258 F259	A229-V593 HydrophobicContact CB-CG2 3.57Å; C258-V593 HydrophobicContact CB-CG2 3.56Å; C258-V593 PolarHBondContact O-N 3.21Å; F259-V593 HydrophobicContact CE1-CB 4.14Å; F259-V593 HydrophobicContact CZ-CB 3.92Å; F259-V593 HydrophobicContact CZ-CG2 4.04Å
594	F	53.7	Low	38.7	Very low	21 Å²	21	81 Å²	81	9%	0.092	46%	0.457	C	S	.	.			trans	-121.8	-7.5	171.6	-60.8	-55.6	0	0	0	114.6	F310 E311 A397 R400 A404 M592	F310-F594 HydrophobicContact CD1-CE1 4.35Å; F310-F594 HydrophobicContact CD1-CE2 4.12Å; F310-F594 AromaticContact CD1-CZ 3.62Å; F310-F594 HydrophobicContact CD1-CZ 3.62Å; F310-F594 HydrophobicContact CE1-CE1 4.11Å; F310-F594 HydrophobicContact CE1-CE2 4.48Å; F310-F594 AromaticContact CE1-CZ 3.58Å; F310-F594 HydrophobicContact CE1-CZ 3.58Å; E311-F594 HydrophobicContact CG-CD2 4.14Å; E311-F594 HydrophobicContact CG-CE2 3.73Å; A397-F594 HydrophobicContact CB-CE1 4.21Å; R400-F594 HydrophobicContact CB-CD1 3.66Å; R400-F594 HydrophobicContact CB-CE1 3.92Å; A404-F594 WeakPolarHBondContact CB-O 3.4Å; M592-F594 HydrophobicContact CB-CD2 4.1Å; M592-F594 HydrophobicContact CB-CE1 4.39Å; M592-F594 HydrophobicContact CB-CE2 3.44Å; M592-F594 VanDerWaalsContact CB-CE2 3.44Å; M592-F594 HydrophobicContact CB-CZ 3.61Å; M592-F594 HydrophobicContact CE-CE1 3.75Å; M592-F594 HydrophobicContact CE-CE2 4.36Å; M592-F594 HydrophobicContact CE-CZ 3.37Å; M592-F594 HydrophobicContact CG-CE2 4.26Å; M592-F594 HydrophobicContact CG-CZ 4.14Å; M592-F594 PolarHBondContact O-N 2.88Å
595	T	36.5	Very low	38.2	Very low	104 Å²	104	82.1 Å²	82.1	64%	0.638	48%	0.477	S	S	*	.			trans	-100.9	153.7	-165.3	43.8	0	0	0	0	114.9
596	E	36.2	Very low	37.8	Very low	99 Å²	99	85.8 Å²	85.8	46%	0.463	50%	0.497	S	S	.	.			trans	-75.1	162	-175.4	-62.2	-180	138.5	0	0	113.9	A404 S407 S598	A404-E596 HydrophobicContact CB-CG 3.99Å; S407-E596 WeakPolarHBondContact CB-OE1 3.46Å; S407-E596 PolarHBondContact OG-OE1 2.85Å; E596-S598 PolarHBondContact O-N 3.38Å
597	R	33.8	Very low	37.2	Very low	231 Å²	231	87 Å²	87	87%	0.872	50%	0.498	S	S	*	.	S	Bend	trans	-84.6	17.1	169.3	-81.5	-178	161.8	177.4	-8.1	113.8	D240	D240-R597 IonicContact OD2-NH2 2.68Å
598	S	27.3	Very low	36.3	Very low	75 Å²	75	91.6 Å²	91.6	52%	0.524	53%	0.527	S	S	.	.			trans	-96.4	113.4	-172.9	-66.9	0	0	0	0	111.9	E596 V600	E596-S598 PolarHBondContact O-N 3.38Å; S598-V600 PolarHBondContact O-N 2.96Å; S598-V600 VanDerWaalsContact O-N 3.12Å
599	A	24.6	Very low	35.2	Very low	100 Å²	100	91.5 Å²	91.5	83%	0.826	54%	0.539	S	S	*	.			trans	-64.2	108.1	167.1	0	0	0	0	0	109.9
600	V	31.2	Very low	34.3	Very low	120 Å²	120	98.3 Å²	98.3	73%	0.727	57%	0.57	S	S	*	*			trans	-119.1	87.2	176.2	-173.5	0	0	0	0	110.8	S598	S598-V600 PolarHBondContact O-N 2.96Å; S598-V600 VanDerWaalsContact O-N 3.12Å
601	N	26.5	Very low	33.2	Very low	155 Å²	155	109.6 Å²	109.6	83%	0.829	61%	0.611	S	S	*	*			trans	15.6	105.8	143.2	-65.7	-31	0	0	0	117.8
602	G	25.3	Very low	31.9	Very low	74 Å²	74	116 Å²	116	76%	0.763	65%	0.65	S	S	*	*				65.9	82.9	128.7	0	0	0	0	0	118.2
603	R	27.8	Very low	30.5	Very low	251 Å²	251	120.7 Å²	120.7	95%	0.947	69%	0.685	S	S	*	*			trans	-143.3	74.7	146	-108.4	171.7	-162.9	-145.7	2.6	112.6
604	S	25	Very low	29.1	Very low	104 Å²	104	127 Å²	127	73%	0.727	72%	0.717	S	S	*	*			trans	39	81.9	142.8	-144.8	0	0	0	0	117.5	V606	S604-V606 PolarHBondContact O-N 2.68Å; S604-V606 VanDerWaalsContact OG-CG2 3.27Å; S604-V606 WeakPolarHBondContact OG-CG2 3.36Å
605	A	25.7	Very low	27.9	Very low	103 Å²	103	135.5 Å²	135.5	85%	0.851	76%	0.757	S	S	*	*			trans	-86.1	78.8	155.6	0	0	0	0	0	109	P607	A605-P607 WeakPolarHBondContact O-CD 3.47Å
606	V	24.5	Very low	27.4	Very low	95 Å²	95	136.4 Å²	136.4	58%	0.576	76%	0.762	S	S	*	*			trans	-73.1	124.3	172.4	-176.9	0	0	0	0	108.9	S604 V608	S604-V606 PolarHBondContact O-N 2.68Å; S604-V606 VanDerWaalsContact OG-CG2 3.27Å; S604-V606 WeakPolarHBondContact OG-CG2 3.36Å; V606-V608 HydrophobicContact CG1-CG2 4.29Å; V606-V608 PolarHBondContact O-N 3.21Å; V606-V608 VanDerWaalsContact O-N 3.07Å
607	P	24.4	Very low	27	Very low	111 Å²	111	137.3 Å²	137.3	72%	0.721	78%	0.777	S	S	*	*			trans	-74.9	97.6	169.3	30.6	-31.5	0	0	0	108.6	A605 S609	A605-P607 WeakPolarHBondContact O-CD 3.47Å; P607-S609 VanDerWaalsContact C-N 3.3Å; P607-S609 PolarHBondContact O-N 3.21Å
608	V	27.6	Very low	26.7	Very low	136 Å²	136	134 Å²	134	82%	0.824	77%	0.771	S	S	*	*			trans	-75.7	86	176.3	-176.8	0	0	0	0	109.4	V606	V606-V608 HydrophobicContact CG1-CG2 4.29Å; V606-V608 PolarHBondContact O-N 3.21Å; V606-V608 VanDerWaalsContact O-N 3.07Å
609	S	25.5	Very low	26.9	Very low	83 Å²	83	138.6 Å²	138.6	58%	0.58	78%	0.782	S	S	*	*			trans	-92.5	141.7	162.7	61.1	0	0	0	0	109.9	P607	P607-S609 VanDerWaalsContact C-N 3.3Å; P607-S609 PolarHBondContact O-N 3.21Å
610	H	26	Very low	27.2	Very low	144 Å²	144	139.9 Å²	139.9	67%	0.667	77%	0.774	S	S	*	*			trans	51.7	113.4	168.4	-53.5	-73.5	0	0	0	119
611	R	28.9	Very low	27.2	Very low	246 Å²	246	143 Å²	143	93%	0.928	78%	0.778	S	S	*	*				-176.2	142.2	91.9	-99.5	-178	175.4	-176.2	-2.3	113.4
612	T	25.4	Very low	27.5	Very low	135 Å²	135	141.2 Å²	141.2	83%	0.828	78%	0.775	S	S	*	*			trans	-81.9	167.3	169	-20.4	0	0	0	0	111.3
613	S	29.4	Very low	27.8	Very low	117 Å²	117	141.8 Å²	141.8	82%	0.818	77%	0.772	S	S	*	*			trans	84.7	107.1	168.1	-58.7	0	0	0	0	117.3
614	L	25	Very low	27.8	Very low	164 Å²	164	138.3 Å²	138.3	86%	0.859	77%	0.767	S	S	*	*			trans	-64.6	143.5	163	-65.1	143	0	0	0	111.2
615	E	28.7	Very low	28.2	Very low	198 Å²	198	138.9 Å²	138.9	93%	0.925	77%	0.771	S	S	*	*			trans	-156.8	138.5	143.2	-113.2	169.8	-147.3	0	0	108.8
616	V	25.7	Very low	28.4	Very low	124 Å²	124	139.2 Å²	139.2	75%	0.752	77%	0.767	S	S	*	*			trans	-130.4	131.4	-172.4	173.3	0	0	0	0	108.9
617	P	27.7	Very low	28.8	Very low	118 Å²	118	140.6 Å²	140.6	77%	0.766	78%	0.778	S	S	*	*				-144	129.3	123.1	25.9	-6.3	0	0	0	112.6
618	E	28.4	Very low	29.1	Very low	160 Å²	160	144.9 Å²	144.9	75%	0.748	79%	0.788	S	S	*	*				80.2	106.1	65	-167.2	-168.4	-116.4	0	0	114.7
619	K	31.9	Very low	29	Very low	173 Å²	173	147.7 Å²	147.7	75%	0.752	79%	0.793	S	S	*	*			trans	166.7	119.7	141.6	-93.3	163.4	-173.6	174.2	0	112.9
620	L	31.2	Very low	29.2	Very low	126 Å²	126	150.5 Å²	150.5	66%	0.66	81%	0.806	S	S	*	*				71.5	129.4	101.8	-95.2	54.9	0	0	0	114
621	F	31.4	Very low	29.3	Very low	187 Å²	187	148.5 Å²	148.5	82%	0.82	81%	0.809	S	S	*	*			cis	-149.7	175.5	18.5	-90.8	-72.5	0	0	0	112.7
622	P	31.8	Very low	29.2	Very low	116 Å²	116	144.1 Å²	144.1	75%	0.753	80%	0.804	S	S	*	*			trans	-121.4	-163.1	-163.5	46.4	-36.9	0	0	0	116.6
623	A	31.7	Very low	29.3	Very low	87 Å²	87	141 Å²	141	72%	0.719	80%	0.798	S	S	*	*			trans	83.9	148.4	163.7	0	0	0	0	0	116.9
624	E	27.9	Very low	29.4	Very low	178 Å²	178	142.4 Å²	142.4	83%	0.832	80%	0.796	S	S	*	*			cis	-164.3	176.5	-10.8	-120.1	176.2	-176.6	0	0	109.9
625	S	32.7	Very low	29.5	Very low	115 Å²	115	140.1 Å²	140.1	80%	0.804	79%	0.794	S	S	*	*			trans	67.8	144.9	171.4	76.7	0	0	0	0	117.3
626	S	30.4	Very low	29.7	Very low	110 Å²	110	135.7 Å²	135.7	77%	0.769	78%	0.781	S	S	*	*			cis	-179.7	155.9	-29	42.9	0	0	0	0	106
627	P	34.1	Very low	30.2	Very low	125 Å²	125	135.2 Å²	135.2	81%	0.812	78%	0.778	S	S	*	*			trans	-104	157.7	-152.9	38.4	-34.6	0	0	0	116.2
628	E	29.3	Very low	30.6	Very low	201 Å²	201	134.3 Å²	134.3	94%	0.939	77%	0.771	S	S	*	*			trans	-131.1	156.1	157.5	-76	-163.5	150.1	0	0	111
629	E	25.9	Very low	31.3	Very low	195 Å²	195	133.7 Å²	133.7	91%	0.911	77%	0.773	S	S	*	*			trans	-91.1	138.1	-166.3	-54.3	178.2	138.2	0	0	113.3
630	T	30.5	Very low	32.7	Very low	142 Å²	142	128.5 Å²	128.5	87%	0.871	76%	0.762	S	S	*	*			trans	-141	137.7	155	53.7	0	0	0	0	112.1
631	S	27.3	Very low	34.7	Very low	102 Å²	102	123.9 Å²	123.9	71%	0.713	74%	0.737	S	S	*	*			trans	-57.7	157.5	-179.3	-164.9	0	0	0	0	115.7
632	D	27.5	Very low	36.8	Very low	154 Å²	154	118.2 Å²	118.2	82%	0.824	72%	0.718	S	S	*	*			trans	124.4	124.6	142.6	-64.9	-16.1	0	0	0	118.6
633	G	27.6	Very low	38.7	Very low	69 Å²	69	115.9 Å²	115.9	71%	0.711	70%	0.7	S	S	*	*			trans	78.2	92.8	139.1	0	0	0	0	0	120.6
634	N	30.2	Very low	41	Very low	146 Å²	146	115.6 Å²	115.6	78%	0.781	68%	0.683	S	S	*	*				-175.9	104.5	121.5	-103.9	-47.8	0	0	0	113.6	T636	N634-T636 PolarHBondContact OD1-OG1 3.28Å
635	S	27.2	Very low	43.8	Very low	117 Å²	117	107.2 Å²	107.2	82%	0.818	64%	0.644	S	S	*	*			trans	-104.6	69	172.9	59.9	0	0	0	0	111.6
636	T	32.4	Very low	46.2	Very low	105 Å²	105	104.4 Å²	104.4	64%	0.644	62%	0.622	S	S	*	*			trans	-141.8	-13.6	-175.3	11.9	0	0	0	0	115.2	N634	N634-T636 PolarHBondContact OD1-OG1 3.28Å
637	T	36.2	Very low	48.7	Very low	113 Å²	113	102.7 Å²	102.7	69%	0.693	60%	0.601	S	S	*	*	S	Bend	trans	-90.3	-14.3	-174	47.2	0	0	0	0	115	N639	T637-N639 PolarHBondContact O-N 3.22Å
638	T	38.1	Very low	51.3	Low	100 Å²	100	97.5 Å²	97.5	61%	0.613	57%	0.566	S	S	*	*	G	3₁₀ helix	trans	-70.9	-28.1	-172	45.7	0	0	0	0	114.6	A640	T638-A640 VanDerWaalsContact C-N 3.31Å; T638-A640 PolarHBondContact O-N 2.96Å
639	N	42.8	Very low	54.1	Low	147 Å²	147	89.4 Å²	89.4	79%	0.786	53%	0.53	S	S	*	.	G	3₁₀ helix	trans	-73	-16.7	-178	-78.3	-18.7	0	0	0	114.4	T637	T637-N639 PolarHBondContact O-N 3.22Å
640	A	60.8	Low	56.9	Low	64 Å²	64	82.8 Å²	82.8	53%	0.529	50%	0.499	S	S	.	.	G	3₁₀ helix	trans	-84.5	-17.2	-176.6	0	0	0	0	0	114.1	T638 H644	T638-A640 VanDerWaalsContact C-N 3.31Å; T638-A640 PolarHBondContact O-N 2.96Å; A640-H644 PolarHBondContact O-N 3.13Å; A640-H644 VanDerWaalsContact O-N 3.16Å
641	F	72.6	Confident	59.7	Low	28 Å²	28	76.5 Å²	76.5	12%	0.123	46%	0.461	C	S	.	.	H	α-helix	trans	-60.6	-51.7	-170.3	162.9	-123.5	0	0	0	114.4	D643 H644 L645 S688 V689 P690 L693 I755	F641-D643 PolarHBondContact O-N 3.31Å; F641-H644 PolarHBondContact O-N 2.84Å; F641-L645 HydrophobicContact CE2-CB 4.27Å; F641-L645 HydrophobicContact CE2-CD2 4.18Å; F641-L645 HydrophobicContact CZ-CD2 4.21Å; F641-L645 PolarHBondContact O-N 3.17Å; F641-L645 VanDerWaalsContact O-N 3.08Å; F641-S688 WeakPolarHBondContact CD2-O 3.42Å; F641-S688 VanDerWaalsContact CE2-O 3.29Å; F641-S688 WeakPolarHBondContact CE2-O 3.19Å; F641-V689 HydrophobicContact CE2-CB 4.27Å; F641-V689 HydrophobicContact CE2-CG2 3.99Å; F641-V689 HydrophobicContact CZ-CB 4.39Å; F641-V689 HydrophobicContact CZ-CG1 4.28Å; F641-V689 HydrophobicContact CZ-CG2 4.13Å; F641-P690 HydrophobicContact CD1-CG 4.24Å; F641-P690 HydrophobicContact CD2-CG 4.34Å; F641-P690 HydrophobicContact CG-CG 4.11Å; F641-L693 HydrophobicContact CD1-CD1 4.11Å; F641-L693 HydrophobicContact CE1-CD1 3.43Å; F641-L693 VanDerWaalsContact CE1-CD1 3.43Å; F641-L693 HydrophobicContact CZ-CD1 4.11Å; F641-I755 HydrophobicContact CE1-CG2 3.88Å; F641-I755 HydrophobicContact CZ-CD1 3.99Å; F641-I755 HydrophobicContact CZ-CG2 4.04Å
642	P	75.1	Confident	62.8	Low	68 Å²	68	71.8 Å²	71.8	44%	0.442	43%	0.428	S	S	.	.	H	α-helix	trans	-63.9	-40.4	-176.1	-21.8	34	0	0	0	112.7	L645 V646	P642-L645 PolarHBondContact O-N 3.26Å; P642-V646 VanDerWaalsContact O-CG2 3.32Å; P642-V646 WeakPolarHBondContact O-CG2 3.29Å; P642-V646 PolarHBondContact O-N 3.12Å
643	D	72.6	Confident	65.8	Low	68 Å²	68	67.1 Å²	67.1	36%	0.364	41%	0.405	S	S	.	.	H	α-helix	trans	-66.8	-38.5	-179.6	-82.2	-6.4	0	0	0	111.9	S306 F641 F647	S306-D643 VanDerWaalsContact CB-OD2 3.27Å; S306-D643 WeakPolarHBondContact CB-OD2 3.41Å; S306-D643 PolarHBondContact OG-OD2 2.99Å; F641-D643 PolarHBondContact O-N 3.31Å; D643-F647 WeakPolarHBondContact O-CB 3.3Å; D643-F647 PolarHBondContact O-N 3.38Å
644	H	80.5	Confident	68.6	Low	80 Å²	80	69.4 Å²	69.4	37%	0.37	39%	0.392	S	S	.	.	H	α-helix	trans	-65.4	-46.1	174.5	-174.2	-93.4	0	0	0	111.5	A640 F641 V646 F647 Q648 S688	A640-H644 PolarHBondContact O-N 3.13Å; A640-H644 VanDerWaalsContact O-N 3.16Å; F641-H644 PolarHBondContact O-N 2.84Å; H644-V646 VanDerWaalsContact C-N 3.34Å; H644-V646 PolarHBondContact O-N 3.32Å; H644-F647 PolarHBondContact O-N 3.43Å; H644-F647 VanDerWaalsContact O-N 3.16Å; H644-Q648 VanDerWaalsContact CE1-CG 3.45Å; H644-Q648 WeakPolarHBondContact CE1-CG 3.45Å; H644-Q648 PolarHBondContact CE1-NE2 2.79Å; H644-Q648 PolarHBondContact NE2-NE2 3.43Å; H644-Q648 VanDerWaalsContact NE2-NE2 3.11Å; H644-Q648 WeakPolarHBondContact O-CG 3.36Å; H644-Q648 PolarHBondContact O-N 2.99Å; H644-S688 WeakPolarHBondContact ND1-CB 3.48Å
645	L	85	Confident	71.5	Confident	2 Å²	2	63.4 Å²	63.4	1%	0.01	36%	0.36	C	S	.	.	H	α-helix	trans	-64.1	-38.2	179.5	-172.8	68.5	0	0	0	112.3	F641 P642 Q648 T649 M685 V689 L751 M752 I755	F641-L645 HydrophobicContact CE2-CB 4.27Å; F641-L645 HydrophobicContact CE2-CD2 4.18Å; F641-L645 HydrophobicContact CZ-CD2 4.21Å; F641-L645 PolarHBondContact O-N 3.17Å; F641-L645 VanDerWaalsContact O-N 3.08Å; P642-L645 PolarHBondContact O-N 3.26Å; L645-Q648 PolarHBondContact O-N 3.46Å; L645-T649 WeakPolarHBondContact O-CB 3.39Å; L645-T649 PolarHBondContact O-N 2.99Å; L645-T649 PolarHBondContact O-OG1 3.01Å; L645-M685 HydrophobicContact CD1-CB 4.07Å; L645-M685 HydrophobicContact CD1-CE 3.86Å; L645-M685 HydrophobicContact CD1-CG 4.14Å; L645-V689 HydrophobicContact CD1-CG2 4.49Å; L645-L751 HydrophobicContact CD1-CD2 4.27Å; L645-M752 HydrophobicContact CD2-SD 3.71Å; L645-M752 HydrophobicContact CG-SD 3.78Å; L645-I755 HydrophobicContact CD2-CD1 3.39Å
646	V	83.4	Confident	74.6	Confident	57 Å²	57	58.4 Å²	58.4	35%	0.345	32%	0.323	S	S	.	.	H	α-helix	trans	-61.7	-43.8	172.4	169.7	0	0	0	0	111.1	P642 H644 T649 E650 M752	P642-V646 VanDerWaalsContact O-CG2 3.32Å; P642-V646 WeakPolarHBondContact O-CG2 3.29Å; P642-V646 PolarHBondContact O-N 3.12Å; H644-V646 VanDerWaalsContact C-N 3.34Å; H644-V646 PolarHBondContact O-N 3.32Å; V646-T649 WeakPolarHBondContact O-CB 3.16Å; V646-T649 PolarHBondContact O-N 3.08Å; V646-E650 PolarHBondContact O-N 3.35Å; V646-M752 HydrophobicContact CG2-CE 3.74Å
647	F	84.4	Confident	77.3	Confident	73 Å²	73	57.5 Å²	57.5	32%	0.32	31%	0.312	S	S	.	.	H	α-helix	trans	-64.8	-39.1	177.1	175	-99.4	0	0	0	113	D643 H644 T649 E650 S651	D643-F647 WeakPolarHBondContact O-CB 3.3Å; D643-F647 PolarHBondContact O-N 3.38Å; H644-F647 PolarHBondContact O-N 3.43Å; H644-F647 VanDerWaalsContact O-N 3.16Å; F647-T649 VanDerWaalsContact C-N 3.32Å; F647-E650 PolarHBondContact O-N 3.38Å; F647-S651 WeakPolarHBondContact O-CB 3.32Å; F647-S651 PolarHBondContact O-N 3.47Å; F647-S651 PolarHBondContact O-OG 3.43Å
648	Q	88.4	Confident	79.8	Confident	17 Å²	17	54.1 Å²	54.1	8%	0.079	29%	0.288	C	S	.	.	H	α-helix	trans	-67	-35.7	173.7	-64.2	-63.1	-16	0	0	111.1	H644 L645 S651 L652 V681 N684 M685	H644-Q648 VanDerWaalsContact CE1-CG 3.45Å; H644-Q648 WeakPolarHBondContact CE1-CG 3.45Å; H644-Q648 PolarHBondContact CE1-NE2 2.79Å; H644-Q648 PolarHBondContact NE2-NE2 3.43Å; H644-Q648 VanDerWaalsContact NE2-NE2 3.11Å; H644-Q648 WeakPolarHBondContact O-CG 3.36Å; H644-Q648 PolarHBondContact O-N 2.99Å; L645-Q648 PolarHBondContact O-N 3.46Å; Q648-S651 CarbonylContact O-C 3.32Å; Q648-S651 WeakPolarHBondContact O-CB 3.46Å; Q648-S651 PolarHBondContact O-N 2.71Å; Q648-L652 WeakPolarHBondContact O-CB 3.27Å; Q648-L652 PolarHBondContact O-N 3.39Å; Q648-V681 HydrophobicContact CB-CG1 4.48Å; Q648-V681 WeakPolarHBondContact O-CG1 3.19Å; Q648-N684 HydrophobicContact CG-CB 4.34Å; Q648-M685 HydrophobicContact CB-CG 3.39Å; Q648-M685 HydrophobicContact CB-SD 4.24Å; Q648-M685 HydrophobicContact CG-CG 4.32Å
649	T	88	Confident	82.2	Confident	30 Å²	30	49.4 Å²	49.4	18%	0.184	26%	0.259	C	S	.	.	H	α-helix	trans	-67.4	-40	173.7	-51.1	0	0	0	0	112.5	L645 V646 F647 S651 L652 T653 M685 M752	L645-T649 WeakPolarHBondContact O-CB 3.39Å; L645-T649 PolarHBondContact O-N 2.99Å; L645-T649 PolarHBondContact O-OG1 3.01Å; V646-T649 WeakPolarHBondContact O-CB 3.16Å; V646-T649 PolarHBondContact O-N 3.08Å; F647-T649 VanDerWaalsContact C-N 3.32Å; T649-S651 VanDerWaalsContact C-N 3.27Å; T649-S651 PolarHBondContact O-N 3.26Å; T649-L652 PolarHBondContact O-N 3.01Å; T649-T653 WeakPolarHBondContact O-CB 3.38Å; T649-T653 PolarHBondContact O-N 2.96Å; T649-T653 PolarHBondContact O-OG1 3.41Å; T649-M685 WeakPolarHBondContact OG1-CE 3.47Å; T649-M752 HydrophobicContact CG2-CG 4.3Å
650	E	84.9	Confident	84.4	Confident	57 Å²	57	43.7 Å²	43.7	27%	0.266	23%	0.229	S	C	.	.	H	α-helix	trans	-58.1	-41.9	169.8	-74.3	179.9	161.1	0	0	110.3	K312 V646 F647 R654	K312-E650 IonicContact NZ-OE1 3.67Å; K312-E650 PolarHBondContact NZ-OE1 2.8Å; K312-E650 IonicContact NZ-OE2 3.4Å; K312-E650 PolarHBondContact NZ-OE2 3.07Å; V646-E650 PolarHBondContact O-N 3.35Å; F647-E650 PolarHBondContact O-N 3.38Å; E650-R654 PolarHBondContact O-N 2.93Å
651	S	89.4	Confident	85.6	Confident	10 Å²	10	42.2 Å²	42.2	7%	0.07	21%	0.213	C	C	.	.	H	α-helix	trans	-70.6	-40.9	179.1	-60.1	0	0	0	0	113.4	F647 Q648 T649 T653 R654 E655	F647-S651 WeakPolarHBondContact O-CB 3.32Å; F647-S651 PolarHBondContact O-N 3.47Å; F647-S651 PolarHBondContact O-OG 3.43Å; Q648-S651 CarbonylContact O-C 3.32Å; Q648-S651 WeakPolarHBondContact O-CB 3.46Å; Q648-S651 PolarHBondContact O-N 2.71Å; T649-S651 VanDerWaalsContact C-N 3.27Å; T649-S651 PolarHBondContact O-N 3.26Å; S651-T653 VanDerWaalsContact C-N 3.33Å; S651-T653 PolarHBondContact O-N 3.45Å; S651-R654 WeakPolarHBondContact O-CB 3.41Å; S651-R654 PolarHBondContact O-N 2.76Å; S651-R654 PolarHBondContact OG-NH2 2.87Å; S651-E655 PolarHBondContact O-N 3.3Å
652	L	92.6	Very high	86.1	Confident	3 Å²	3	41 Å²	41	2%	0.016	21%	0.209	C	C	.	.	H	α-helix	trans	-62.6	-42.1	176.3	-178.2	60.8	0	0	0	110.9	Q648 T649 R654 E655 I656 V678 V681 V682 M685 V744 A748	Q648-L652 WeakPolarHBondContact O-CB 3.27Å; Q648-L652 PolarHBondContact O-N 3.39Å; T649-L652 PolarHBondContact O-N 3.01Å; L652-R654 VanDerWaalsContact C-N 3.3Å; L652-R654 PolarHBondContact O-N 3.36Å; L652-E655 PolarHBondContact O-N 2.95Å; L652-I656 HydrophobicContact CD1-CD1 3.98Å; L652-I656 HydrophobicContact CD1-CG1 4.26Å; L652-I656 HydrophobicContact CD2-CD1 4.48Å; L652-I656 HydrophobicContact CG-CD1 3.85Å; L652-I656 HydrophobicContact CG-CG1 4.47Å; L652-I656 WeakPolarHBondContact O-CB 3.43Å; L652-I656 WeakPolarHBondContact O-CG1 3.29Å; L652-I656 PolarHBondContact O-N 3.11Å; L652-V678 HydrophobicContact CD1-CG1 3.88Å; L652-V681 HydrophobicContact CB-CG1 3.71Å; L652-V681 HydrophobicContact CD1-CG1 4.33Å; L652-V682 HydrophobicContact CD1-CG2 4.1Å; L652-M685 HydrophobicContact CB-SD 4.21Å; L652-M685 HydrophobicContact CD2-SD 3.7Å; L652-V744 HydrophobicContact CD1-CG1 4.09Å; L652-V744 HydrophobicContact CD2-CG1 4.21Å; L652-A748 HydrophobicContact CD2-CB 3.5Å; L652-A748 VanDerWaalsContact CD2-CB 3.5Å
653	T	89.4	Confident	86.5	Confident	56 Å²	56	38 Å²	38	34%	0.344	19%	0.19	S	C	.	.	H	α-helix	trans	-58.6	-43.3	176.9	-55.9	0	0	0	0	111.1	T649 S651 Q657	T649-T653 WeakPolarHBondContact O-CB 3.38Å; T649-T653 PolarHBondContact O-N 2.96Å; T649-T653 PolarHBondContact O-OG1 3.41Å; S651-T653 VanDerWaalsContact C-N 3.33Å; S651-T653 PolarHBondContact O-N 3.45Å; T653-Q657 WeakPolarHBondContact O-CB 3.17Å; T653-Q657 VanDerWaalsContact O-CG 3.29Å; T653-Q657 WeakPolarHBondContact O-CG 3.38Å; T653-Q657 PolarHBondContact O-N 3.41Å
654	R	87.7	Confident	86.9	Confident	116 Å²	116	41.5 Å²	41.5	44%	0.438	20%	0.203	S	C	.	.	H	α-helix	trans	-64.6	-43.3	176.6	168.5	172.6	54.8	-133.1	-7.5	112.4	E650 S651 L652 Q657 H658	E650-R654 PolarHBondContact O-N 2.93Å; S651-R654 WeakPolarHBondContact O-CB 3.41Å; S651-R654 PolarHBondContact O-N 2.76Å; S651-R654 PolarHBondContact OG-NH2 2.87Å; L652-R654 VanDerWaalsContact C-N 3.3Å; L652-R654 PolarHBondContact O-N 3.36Å; R654-Q657 WeakPolarHBondContact O-CB 3.49Å; R654-Q657 PolarHBondContact O-N 2.97Å; R654-H658 PolarHBondContact O-N 3.37Å; R654-H658 PolarHBondContact O-ND1 2.76Å
655	E	91	Very high	86.9	Confident	21 Å²	21	39.1 Å²	39.1	10%	0.098	20%	0.195	C	C	.	.	H	α-helix	trans	-70.8	-35.6	178.8	-65.5	-57.4	159.1	0	0	112.8	S651 L652 H658 I659 R677 V678	S651-E655 PolarHBondContact O-N 3.3Å; L652-E655 PolarHBondContact O-N 2.95Å; E655-H658 WeakPolarHBondContact O-CB 3.02Å; E655-H658 PolarHBondContact O-N 3.47Å; E655-H658 IonicContact OE1-CE1 3.94Å; E655-H658 IonicContact OE1-ND1 2.81Å; E655-H658 IonicContact OE2-CE1 3.42Å; E655-H658 IonicContact OE2-CG 2.81Å; E655-H658 IonicContact OE2-ND1 2.63Å; E655-H658 PolarHBondContact OE2-ND1 2.73Å; E655-I659 PolarHBondContact O-N 2.82Å; E655-I659 VanDerWaalsContact O-N 3.07Å; E655-R677 HydrophobicContact CG-CB 4.14Å; E655-R677 IonicContact OE1-CZ 3.09Å; E655-R677 IonicContact OE1-NE 3.11Å; E655-R677 IonicContact OE1-NH1 3.84Å; E655-R677 PolarHBondContact OE1-NH1 3.21Å; E655-R677 IonicContact OE2-CZ 2.78Å; E655-R677 IonicContact OE2-NE 2.75Å; E655-R677 PolarHBondContact OE2-NE 3.34Å; E655-R677 IonicContact OE2-NH1 3.69Å; E655-R677 PolarHBondContact OE2-NH1 2.82Å; E655-R677 IonicContact OE2-NH2 2.68Å; E655-V678 HydrophobicContact CB-CG2 3.72Å
656	I	91.1	Very high	86.5	Confident	11 Å²	11	43.4 Å²	43.4	6%	0.056	22%	0.215	C	C	.	.	H	α-helix	trans	-63.7	-41.4	170.2	-70.7	173.6	0	0	0	110.9	L652 H658 I659 L660 V678 V744 A745	L652-I656 HydrophobicContact CD1-CD1 3.98Å; L652-I656 HydrophobicContact CD1-CG1 4.26Å; L652-I656 HydrophobicContact CD2-CD1 4.48Å; L652-I656 HydrophobicContact CG-CD1 3.85Å; L652-I656 HydrophobicContact CG-CG1 4.47Å; L652-I656 WeakPolarHBondContact O-CB 3.43Å; L652-I656 WeakPolarHBondContact O-CG1 3.29Å; L652-I656 PolarHBondContact O-N 3.11Å; I656-H658 VanDerWaalsContact C-N 3.31Å; I656-H658 PolarHBondContact O-N 3.31Å; I656-I659 PolarHBondContact O-N 3.11Å; I656-I659 VanDerWaalsContact O-N 3.13Å; I656-L660 HydrophobicContact CG2-CD1 4.22Å; I656-L660 HydrophobicContact CG2-CG 4.32Å; I656-L660 WeakPolarHBondContact O-CG 3.19Å; I656-L660 PolarHBondContact O-N 3.27Å; I656-V678 HydrophobicContact CG1-CG2 4.48Å; I656-V744 HydrophobicContact CD1-CB 4.25Å; I656-V744 HydrophobicContact CD1-CG1 4.07Å; I656-A745 HydrophobicContact CD1-CB 3.83Å
657	Q	88.9	Confident	86.2	Confident	87 Å²	87	44.3 Å²	44.3	41%	0.407	22%	0.215	S	C	.	.	H	α-helix	trans	-58.4	-42.1	173.2	-78.6	171.7	-17.5	0	0	112.1	T653 R654 I659 L660 T661	T653-Q657 WeakPolarHBondContact O-CB 3.17Å; T653-Q657 VanDerWaalsContact O-CG 3.29Å; T653-Q657 WeakPolarHBondContact O-CG 3.38Å; T653-Q657 PolarHBondContact O-N 3.41Å; R654-Q657 WeakPolarHBondContact O-CB 3.49Å; R654-Q657 PolarHBondContact O-N 2.97Å; Q657-I659 PolarHBondContact O-N 2.97Å; Q657-L660 PolarHBondContact O-N 3.05Å; Q657-T661 WeakPolarHBondContact O-CB 3.37Å; Q657-T661 PolarHBondContact O-N 2.72Å; Q657-T661 PolarHBondContact O-OG1 3.31Å
658	H	88.9	Confident	85.7	Confident	42 Å²	42	41.7 Å²	41.7	19%	0.194	20%	0.204	C	C	.	.	H	α-helix	trans	-60.4	-41.6	173.9	-60.7	149.8	0	0	0	112.3	R654 E655 I656 T661 A662 L674 R677	R654-H658 PolarHBondContact O-N 3.37Å; R654-H658 PolarHBondContact O-ND1 2.76Å; E655-H658 WeakPolarHBondContact O-CB 3.02Å; E655-H658 PolarHBondContact O-N 3.47Å; E655-H658 IonicContact OE1-CE1 3.94Å; E655-H658 IonicContact OE1-ND1 2.81Å; E655-H658 IonicContact OE2-CE1 3.42Å; E655-H658 IonicContact OE2-CG 2.81Å; E655-H658 IonicContact OE2-ND1 2.63Å; E655-H658 PolarHBondContact OE2-ND1 2.73Å; I656-H658 VanDerWaalsContact C-N 3.31Å; I656-H658 PolarHBondContact O-N 3.31Å; H658-T661 PolarHBondContact O-N 3.12Å; H658-A662 WeakPolarHBondContact O-CB 3.29Å; H658-A662 PolarHBondContact O-N 3.47Å; H658-L674 HydrophobicContact CB-CD1 4.45Å; H658-L674 HydrophobicContact CB-CD2 3.33Å; H658-R677 PolarHBondContact ND1-NH1 3.02Å
659	I	88.7	Confident	85.2	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-63.7	-48.4	175	-67.1	176.5	0	0	0	111.7	E655 I656 Q657 T661 A662 A663 F671 L674 V675 V678 L712 V737 S741	E655-I659 PolarHBondContact O-N 2.82Å; E655-I659 VanDerWaalsContact O-N 3.07Å; I656-I659 PolarHBondContact O-N 3.11Å; I656-I659 VanDerWaalsContact O-N 3.13Å; Q657-I659 PolarHBondContact O-N 2.97Å; I659-T661 PolarHBondContact O-N 3.28Å; I659-A662 PolarHBondContact O-N 3.26Å; I659-A663 WeakPolarHBondContact O-CB 3.4Å; I659-A663 PolarHBondContact O-N 3.11Å; I659-F671 HydrophobicContact CG2-CD1 4.2Å; I659-F671 HydrophobicContact CG2-CE1 4.1Å; I659-L674 HydrophobicContact CD1-CB 4.2Å; I659-L674 HydrophobicContact CG1-CB 3.62Å; I659-L674 HydrophobicContact CG1-CD1 4.13Å; I659-L674 HydrophobicContact CG1-CD2 4.47Å; I659-L674 HydrophobicContact CG1-CG 4.3Å; I659-V675 HydrophobicContact CD1-CG2 4.41Å; I659-V678 HydrophobicContact CD1-CG2 3.67Å; I659-L712 HydrophobicContact CD1-CD2 3.96Å; I659-V737 HydrophobicContact CG2-CG1 3.59Å; I659-S741 WeakPolarHBondContact CG2-OG 3.41Å
660	L	88.6	Confident	84.9	Confident	28 Å²	28	48.5 Å²	48.5	15%	0.147	24%	0.243	C	C	.	.	H	α-helix	trans	-56.6	-38.9	177	-67	177	0	0	0	111	I656 Q657 Q664 I738 Y742	I656-L660 HydrophobicContact CG2-CD1 4.22Å; I656-L660 HydrophobicContact CG2-CG 4.32Å; I656-L660 WeakPolarHBondContact O-CG 3.19Å; I656-L660 PolarHBondContact O-N 3.27Å; Q657-L660 PolarHBondContact O-N 3.05Å; L660-Q664 WeakPolarHBondContact O-CB 3.27Å; L660-Q664 WeakPolarHBondContact O-CG 3.29Å; L660-Q664 PolarHBondContact O-N 2.8Å; L660-I738 HydrophobicContact CD2-CB 4.16Å; L660-I738 HydrophobicContact CD2-CG1 3.9Å; L660-I738 HydrophobicContact CD2-CG2 3.77Å; L660-Y742 HydrophobicContact CD2-CE2 4.16Å
661	T	85.8	Confident	85	Confident	32 Å²	32	45.9 Å²	45.9	20%	0.196	23%	0.231	C	C	.	.	H	α-helix	trans	-72	-44.9	-178.9	-60.4	0	0	0	0	111.1	L577 Q657 H658 I659 A663 Q664 T665	L577-T661 HydrophobicContact CB-CG2 4.18Å; L577-T661 HydrophobicContact CD2-CG2 3.48Å; L577-T661 VanDerWaalsContact CD2-CG2 3.48Å; L577-T661 HydrophobicContact CG-CG2 3.45Å; L577-T661 VanDerWaalsContact CG-CG2 3.45Å; Q657-T661 WeakPolarHBondContact O-CB 3.37Å; Q657-T661 PolarHBondContact O-N 2.72Å; Q657-T661 PolarHBondContact O-OG1 3.31Å; H658-T661 PolarHBondContact O-N 3.12Å; I659-T661 PolarHBondContact O-N 3.28Å; T661-A663 VanDerWaalsContact C-N 3.32Å; T661-A663 PolarHBondContact O-N 3.25Å; T661-Q664 PolarHBondContact O-N 3.38Å; T661-T665 PolarHBondContact O-N 2.93Å; T661-T665 PolarHBondContact O-OG1 3.38Å
662	A	84	Confident	84.6	Confident	4 Å²	4	49.7 Å²	49.7	3%	0.033	25%	0.254	C	S	.	.	H	α-helix	trans	-60.9	-38.1	172.9	0	0	0	0	0	112.8	H658 I659 T665 Q666 Q667 F671 L674	H658-A662 WeakPolarHBondContact O-CB 3.29Å; H658-A662 PolarHBondContact O-N 3.47Å; I659-A662 PolarHBondContact O-N 3.26Å; A662-T665 CarbonylContact O-C 3.43Å; A662-T665 PolarHBondContact O-N 3.5Å; A662-T665 PolarHBondContact O-OG1 2.95Å; A662-Q666 PolarHBondContact O-N 2.89Å; A662-Q667 PolarHBondContact O-N 2.96Å; A662-F671 HydrophobicContact CB-CD1 4.32Å; A662-F671 HydrophobicContact CB-CE1 4Å; A662-L674 HydrophobicContact CB-CD1 3.79Å
663	A	84.5	Confident	84.4	Confident	5 Å²	5	53.1 Å²	53.1	4%	0.041	28%	0.276	C	S	.	.	H	α-helix	trans	-67.6	-39.5	176	0	0	0	0	0	113.1	I659 T661 T665 Q666 F671 C734 I738	I659-A663 WeakPolarHBondContact O-CB 3.4Å; I659-A663 PolarHBondContact O-N 3.11Å; T661-A663 VanDerWaalsContact C-N 3.32Å; T661-A663 PolarHBondContact O-N 3.25Å; A663-T665 PolarHBondContact O-N 3.15Å; A663-Q666 PolarHBondContact O-N 3.4Å; A663-F671 HydrophobicContact CB-CE1 3.88Å; A663-F671 HydrophobicContact CB-CZ 3.69Å; A663-C734 HydrophobicContact CB-CB 4.24Å; A663-I738 HydrophobicContact CB-CD1 3.82Å; A663-I738 HydrophobicContact CB-CG1 3.74Å
664	Q	80.9	Confident	84.4	Confident	140 Å²	140	50.8 Å²	50.8	65%	0.654	26%	0.261	S	S	*	.	H	α-helix	trans	-64.5	-21.3	175.4	-76.2	171.4	7.9	0	0	113.3	L660 T661	L660-Q664 WeakPolarHBondContact O-CB 3.27Å; L660-Q664 WeakPolarHBondContact O-CG 3.29Å; L660-Q664 PolarHBondContact O-N 2.8Å; T661-Q664 PolarHBondContact O-N 3.38Å
665	T	80.2	Confident	84.5	Confident	31 Å²	31	45.5 Å²	45.5	19%	0.19	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.1	13.2	176.7	59.7	0	0	0	0	115	Y573 L577 T661 A662 A663 Q667	Y573-T665 HydrophobicContact CD1-CG2 4.36Å; L577-T665 HydrophobicContact CD1-CG2 3.29Å; L577-T665 HydrophobicContact CD2-CG2 3.85Å; L577-T665 WeakPolarHBondContact CD2-OG1 3.22Å; L577-T665 HydrophobicContact CG-CG2 4.12Å; T661-T665 PolarHBondContact O-N 2.93Å; T661-T665 PolarHBondContact O-OG1 3.38Å; A662-T665 CarbonylContact O-C 3.43Å; A662-T665 PolarHBondContact O-N 3.5Å; A662-T665 PolarHBondContact O-OG1 2.95Å; A663-T665 PolarHBondContact O-N 3.15Å; T665-Q667 PolarHBondContact O-N 3.02Å; T665-Q667 VanDerWaalsContact O-N 3.13Å
666	Q	75.1	Confident	84.4	Confident	92 Å²	92	48.5 Å²	48.5	43%	0.43	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.8	33.1	176.4	-56.2	178.6	-19	0	0	112.8	A662 A663 H668	A662-Q666 PolarHBondContact O-N 2.89Å; A663-Q666 PolarHBondContact O-N 3.4Å; Q666-H668 VanDerWaalsContact C-N 3.26Å; Q666-H668 PolarHBondContact O-CD2 3.4Å; Q666-H668 PolarHBondContact O-N 3.33Å
667	Q	77	Confident	84.5	Confident	75 Å²	75	52.6 Å²	52.6	35%	0.35	28%	0.276	S	S	.	.			trans	-85.6	68.8	176.7	-74.7	-171.1	-36.1	0	0	110	A662 T665 D669 S670	A662-Q667 PolarHBondContact O-N 2.96Å; T665-Q667 PolarHBondContact O-N 3.02Å; T665-Q667 VanDerWaalsContact O-N 3.13Å; Q667-D669 VanDerWaalsContact C-N 3.29Å; Q667-D669 PolarHBondContact O-N 3.36Å; Q667-S670 WeakPolarHBondContact O-CB 3.3Å; Q667-S670 PolarHBondContact O-N 3.37Å
668	H	75.5	Confident	84.6	Confident	19 Å²	19	48.5 Å²	48.5	9%	0.088	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-58.3	-37.8	-170.9	-63.4	-87.9	0	0	0	113.2	Q666 S670 F671 Y719 F733 C734	Q666-H668 VanDerWaalsContact C-N 3.26Å; Q666-H668 PolarHBondContact O-CD2 3.4Å; Q666-H668 PolarHBondContact O-N 3.33Å; H668-S670 PolarHBondContact O-N 2.95Å; H668-S670 VanDerWaalsContact O-N 3.11Å; H668-F671 HydrophobicContact CB-CD2 4.27Å; H668-F671 HydrophobicContact CB-CE2 4.37Å; H668-F671 AromaticContact ND1-CE2 3.67Å; H668-F671 WeakPolarHBondContact O-CB 3.43Å; H668-F671 VanDerWaalsContact O-CD2 3.28Å; H668-F671 WeakPolarHBondContact O-CD2 3.42Å; H668-F671 PolarHBondContact O-N 3.15Å; H668-Y719 HydrophobicContact CB-CD2 3.93Å; H668-Y719 HydrophobicContact CB-CE2 3.6Å; H668-Y719 AromaticContact CG-CE2 3.5Å; H668-Y719 AromaticContact ND1-CE2 3.7Å; H668-F733 AromaticContact CE1-CD1 3.83Å; H668-F733 AromaticContact ND1-CD1 3.6Å; H668-F733 AromaticContact ND1-CE1 3.6Å; H668-C734 VanDerWaalsContact CE1-SG 3.57Å
669	D	77.4	Confident	84.7	Confident	149 Å²	149	49.1 Å²	49.1	80%	0.797	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-61.1	-22.5	178.7	-48.7	-40.5	0	0	0	113.3	Q667 F671	Q667-D669 VanDerWaalsContact C-N 3.29Å; Q667-D669 PolarHBondContact O-N 3.36Å; D669-F671 VanDerWaalsContact C-N 3.33Å
670	S	82.3	Confident	84.8	Confident	41 Å²	41	52.1 Å²	52.1	29%	0.287	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-76.2	-19.5	177.5	-60.5	0	0	0	0	112.9	Q667 H668 T672 P673 L674	Q667-S670 WeakPolarHBondContact O-CB 3.3Å; Q667-S670 PolarHBondContact O-N 3.37Å; H668-S670 PolarHBondContact O-N 2.95Å; H668-S670 VanDerWaalsContact O-N 3.11Å; S670-T672 PolarHBondContact O-N 3.49Å; S670-P673 VanDerWaalsContact O-CD 3.32Å; S670-P673 WeakPolarHBondContact O-CD 3.49Å; S670-P673 WeakPolarHBondContact O-CG 3.44Å; S670-L674 VanDerWaalsContact O-CB 3.32Å; S670-L674 WeakPolarHBondContact O-CB 3.44Å; S670-L674 VanDerWaalsContact O-CD1 3.24Å; S670-L674 WeakPolarHBondContact O-CD1 3.05Å; S670-L674 WeakPolarHBondContact O-CG 3.44Å; S670-L674 PolarHBondContact O-N 3.38Å
671	F	85.7	Confident	85	Confident	2 Å²	2	51.5 Å²	51.5	1%	0.009	28%	0.278	C	S	.	.	H	α-helix	trans	-66	-40.6	-173.4	-70.1	-48.3	0	0	0	113.4	I659 A662 A663 H668 D669 L674 V675 C716 F733 V737	I659-F671 HydrophobicContact CG2-CD1 4.2Å; I659-F671 HydrophobicContact CG2-CE1 4.1Å; A662-F671 HydrophobicContact CB-CD1 4.32Å; A662-F671 HydrophobicContact CB-CE1 4Å; A663-F671 HydrophobicContact CB-CE1 3.88Å; A663-F671 HydrophobicContact CB-CZ 3.69Å; H668-F671 HydrophobicContact CB-CD2 4.27Å; H668-F671 HydrophobicContact CB-CE2 4.37Å; H668-F671 AromaticContact ND1-CE2 3.67Å; H668-F671 WeakPolarHBondContact O-CB 3.43Å; H668-F671 VanDerWaalsContact O-CD2 3.28Å; H668-F671 WeakPolarHBondContact O-CD2 3.42Å; H668-F671 PolarHBondContact O-N 3.15Å; D669-F671 VanDerWaalsContact C-N 3.33Å; F671-L674 PolarHBondContact O-N 3.46Å; F671-V675 WeakPolarHBondContact O-CB 3.3Å; F671-V675 WeakPolarHBondContact O-CG2 3.46Å; F671-V675 PolarHBondContact O-N 3.16Å; F671-C716 HydrophobicContact CB-CB 4.05Å; F671-F733 AromaticContact CD2-CE1 3.84Å; F671-F733 HydrophobicContact CD2-CE1 3.84Å; F671-F733 HydrophobicContact CE2-CD1 4.33Å; F671-F733 AromaticContact CE2-CE1 3.7Å; F671-F733 HydrophobicContact CE2-CE1 3.7Å; F671-V737 HydrophobicContact CD1-CG1 4.02Å; F671-V737 HydrophobicContact CE1-CG1 3.75Å; F671-V737 HydrophobicContact CZ-CG1 4.12Å
672	T	82.4	Confident	85.3	Confident	90 Å²	90	50.1 Å²	50.1	55%	0.552	27%	0.27	S	S	*	.	H	α-helix	trans	-58.3	-55.8	-179.8	-52.1	0	0	0	0	112.7	S670 L674 V675 V676	S670-T672 PolarHBondContact O-N 3.49Å; T672-L674 VanDerWaalsContact C-N 3.25Å; T672-L674 PolarHBondContact O-N 2.94Å; T672-V675 PolarHBondContact O-N 2.94Å; T672-V676 WeakPolarHBondContact O-CG2 3.15Å; T672-V676 PolarHBondContact O-N 3.22Å; T672-V676 VanDerWaalsContact O-N 3.15Å
673	P	86.8	Confident	85.6	Confident	74 Å²	74	54 Å²	54	48%	0.481	29%	0.29	S	S	.	.	H	α-helix	trans	-68.6	-21.3	177	27.6	-35.8	0	0	0	113.6	S670 R677	S670-P673 VanDerWaalsContact O-CD 3.32Å; S670-P673 WeakPolarHBondContact O-CD 3.49Å; S670-P673 WeakPolarHBondContact O-CG 3.44Å; P673-R677 PolarHBondContact O-N 3.07Å
674	L	89.3	Confident	85.9	Confident	8 Å²	8	57 Å²	57	4%	0.042	31%	0.305	C	S	.	.	H	α-helix	trans	-73.9	-43.1	173.3	-76.6	169	0	0	0	112.5	H658 I659 A662 S670 F671 T672 R677 V678	H658-L674 HydrophobicContact CB-CD1 4.45Å; H658-L674 HydrophobicContact CB-CD2 3.33Å; I659-L674 HydrophobicContact CD1-CB 4.2Å; I659-L674 HydrophobicContact CG1-CB 3.62Å; I659-L674 HydrophobicContact CG1-CD1 4.13Å; I659-L674 HydrophobicContact CG1-CD2 4.47Å; I659-L674 HydrophobicContact CG1-CG 4.3Å; A662-L674 HydrophobicContact CB-CD1 3.79Å; S670-L674 VanDerWaalsContact O-CB 3.32Å; S670-L674 WeakPolarHBondContact O-CB 3.44Å; S670-L674 VanDerWaalsContact O-CD1 3.24Å; S670-L674 WeakPolarHBondContact O-CD1 3.05Å; S670-L674 WeakPolarHBondContact O-CG 3.44Å; S670-L674 PolarHBondContact O-N 3.38Å; F671-L674 PolarHBondContact O-N 3.46Å; T672-L674 VanDerWaalsContact C-N 3.25Å; T672-L674 PolarHBondContact O-N 2.94Å; L674-R677 PolarHBondContact O-N 3.05Å; L674-V678 PolarHBondContact O-N 3.1Å
675	V	90	Very high	86.4	Confident	5 Å²	5	50.3 Å²	50.3	3%	0.03	27%	0.274	C	S	.	.	H	α-helix	trans	-61.9	-43.4	175	163.7	0	0	0	0	111.1	I659 F671 T672 R677 V678 Q679 L712 T713 C716	I659-V675 HydrophobicContact CD1-CG2 4.41Å; F671-V675 WeakPolarHBondContact O-CB 3.3Å; F671-V675 WeakPolarHBondContact O-CG2 3.46Å; F671-V675 PolarHBondContact O-N 3.16Å; T672-V675 PolarHBondContact O-N 2.94Å; V675-R677 VanDerWaalsContact C-N 3.25Å; V675-R677 PolarHBondContact O-N 3.46Å; V675-V678 CarbonylContact O-C 3.58Å; V675-V678 PolarHBondContact O-N 3.2Å; V675-V678 VanDerWaalsContact O-N 3.08Å; V675-Q679 HydrophobicContact CG1-CG 4.25Å; V675-Q679 WeakPolarHBondContact O-CG 3.38Å; V675-Q679 PolarHBondContact O-N 3.18Å; V675-L712 HydrophobicContact CG2-CD2 4.48Å; V675-L712 HydrophobicContact CG2-CG 4.03Å; V675-T713 HydrophobicContact CG1-CG2 3.99Å; V675-T713 WeakPolarHBondContact CG1-OG1 3.49Å; V675-C716 HydrophobicContact CG2-CB 3.67Å; V675-C716 WeakPolarHBondContact CG2-SG 3.16Å
676	V	89.6	Confident	86.8	Confident	84 Å²	84	50 Å²	50	51%	0.509	27%	0.272	S	S	.	.	H	α-helix	trans	-61	-35.7	176.9	174.8	0	0	0	0	111.6	T672 S680	T672-V676 WeakPolarHBondContact O-CG2 3.15Å; T672-V676 PolarHBondContact O-N 3.22Å; T672-V676 VanDerWaalsContact O-N 3.15Å; V676-S680 WeakPolarHBondContact O-CB 3.43Å; V676-S680 PolarHBondContact O-N 3.08Å
677	R	92.1	Very high	87.4	Confident	97 Å²	97	51 Å²	51	37%	0.366	28%	0.28	S	S	.	.	H	α-helix	trans	-67.5	-42.5	171.7	-77	-170.2	-75.7	161.2	-12.2	112.6	E655 H658 P673 L674 V675 S680 V681	E655-R677 HydrophobicContact CG-CB 4.14Å; E655-R677 IonicContact OE1-CZ 3.09Å; E655-R677 IonicContact OE1-NE 3.11Å; E655-R677 IonicContact OE1-NH1 3.84Å; E655-R677 PolarHBondContact OE1-NH1 3.21Å; E655-R677 IonicContact OE2-CZ 2.78Å; E655-R677 IonicContact OE2-NE 2.75Å; E655-R677 PolarHBondContact OE2-NE 3.34Å; E655-R677 IonicContact OE2-NH1 3.69Å; E655-R677 PolarHBondContact OE2-NH1 2.82Å; E655-R677 IonicContact OE2-NH2 2.68Å; H658-R677 PolarHBondContact ND1-NH1 3.02Å; P673-R677 PolarHBondContact O-N 3.07Å; L674-R677 PolarHBondContact O-N 3.05Å; V675-R677 VanDerWaalsContact C-N 3.25Å; V675-R677 PolarHBondContact O-N 3.46Å; R677-S680 PolarHBondContact O-N 3.48Å; R677-V681 WeakPolarHBondContact O-CG2 3.41Å; R677-V681 PolarHBondContact O-N 3.26Å
678	V	92	Very high	87.8	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-61.8	-44.4	174.5	169.7	0	0	0	0	111.3	L652 E655 I656 I659 L674 V675 V681 V682 L712 V744	L652-V678 HydrophobicContact CD1-CG1 3.88Å; E655-V678 HydrophobicContact CB-CG2 3.72Å; I656-V678 HydrophobicContact CG1-CG2 4.48Å; I659-V678 HydrophobicContact CD1-CG2 3.67Å; L674-V678 PolarHBondContact O-N 3.1Å; V675-V678 CarbonylContact O-C 3.58Å; V675-V678 PolarHBondContact O-N 3.2Å; V675-V678 VanDerWaalsContact O-N 3.08Å; V678-V681 PolarHBondContact O-N 3.46Å; V678-V682 HydrophobicContact CG1-CG2 4.29Å; V678-V682 WeakPolarHBondContact O-CB 3.35Å; V678-V682 WeakPolarHBondContact O-CG2 3.22Å; V678-V682 PolarHBondContact O-N 3.07Å; V678-L712 HydrophobicContact CG1-CD2 4.12Å; V678-V744 HydrophobicContact CG1-CG1 4.24Å
679	Q	90.5	Very high	88.3	Confident	56 Å²	56	47.6 Å²	47.6	26%	0.262	27%	0.267	S	S	.	.	H	α-helix	trans	-55.6	-53.3	173.8	-74.3	173.3	-19.5	0	0	111	V675 V681 V682 D683 T713	V675-Q679 HydrophobicContact CG1-CG 4.25Å; V675-Q679 WeakPolarHBondContact O-CG 3.38Å; V675-Q679 PolarHBondContact O-N 3.18Å; Q679-V681 VanDerWaalsContact C-N 3.29Å; Q679-V681 PolarHBondContact O-N 3.1Å; Q679-V682 CarbonylContact O-C 3.59Å; Q679-V682 WeakPolarHBondContact O-CA 3.17Å; Q679-V682 PolarHBondContact O-N 2.86Å; Q679-D683 PolarHBondContact O-N 2.83Å; Q679-T713 VanDerWaalsContact NE2-CG2 3.28Å; Q679-T713 PolarHBondContact NE2-OG1 3.38Å
680	S	91.4	Very high	88.7	Confident	62 Å²	62	42.3 Å²	42.3	43%	0.434	24%	0.241	S	C	.	.	H	α-helix	trans	-57.8	-39.1	179.1	-178.7	0	0	0	0	112.9	V676 R677 N684	V676-S680 WeakPolarHBondContact O-CB 3.43Å; V676-S680 PolarHBondContact O-N 3.08Å; R677-S680 PolarHBondContact O-N 3.48Å; S680-N684 WeakPolarHBondContact O-CB 3.49Å; S680-N684 PolarHBondContact O-N 2.65Å; S680-N684 PolarHBondContact O-ND2 3.12Å
681	V	92.3	Very high	88.7	Confident	16 Å²	16	45.8 Å²	45.8	10%	0.097	26%	0.26	C	S	.	.	H	α-helix	trans	-69.7	-41.4	174.6	178.3	0	0	0	0	111.6	Q648 L652 R677 V678 Q679 N684 M685	Q648-V681 HydrophobicContact CB-CG1 4.48Å; Q648-V681 WeakPolarHBondContact O-CG1 3.19Å; L652-V681 HydrophobicContact CB-CG1 3.71Å; L652-V681 HydrophobicContact CD1-CG1 4.33Å; R677-V681 WeakPolarHBondContact O-CG2 3.41Å; R677-V681 PolarHBondContact O-N 3.26Å; V678-V681 PolarHBondContact O-N 3.46Å; Q679-V681 VanDerWaalsContact C-N 3.29Å; Q679-V681 PolarHBondContact O-N 3.1Å; V681-N684 PolarHBondContact O-N 2.96Å; V681-M685 HydrophobicContact CG1-SD 4.41Å; V681-M685 WeakPolarHBondContact O-CG 3.48Å; V681-M685 PolarHBondContact O-N 3.43Å
682	V	92.5	Very high	88.5	Confident	2 Å²	2	51.7 Å²	51.7	1%	0.012	29%	0.288	C	S	.	.	H	α-helix	trans	-61.2	-45.4	175.7	165	0	0	0	0	110.9	L652 V678 Q679 N684 M685 V686 M705 C709 V744	L652-V682 HydrophobicContact CD1-CG2 4.1Å; V678-V682 HydrophobicContact CG1-CG2 4.29Å; V678-V682 WeakPolarHBondContact O-CB 3.35Å; V678-V682 WeakPolarHBondContact O-CG2 3.22Å; V678-V682 PolarHBondContact O-N 3.07Å; Q679-V682 CarbonylContact O-C 3.59Å; Q679-V682 WeakPolarHBondContact O-CA 3.17Å; Q679-V682 PolarHBondContact O-N 2.86Å; V682-N684 VanDerWaalsContact C-N 3.34Å; V682-N684 PolarHBondContact O-N 3.17Å; V682-M685 WeakPolarHBondContact O-CA 3.38Å; V682-M685 WeakPolarHBondContact O-CB 3.33Å; V682-M685 PolarHBondContact O-N 2.93Å; V682-M685 VanDerWaalsContact O-N 3.09Å; V682-V686 HydrophobicContact CG1-CG2 4.44Å; V682-V686 WeakPolarHBondContact O-CG2 3.22Å; V682-V686 PolarHBondContact O-N 3.14Å; V682-M705 HydrophobicContact CG1-CE 4.23Å; V682-M705 HydrophobicContact CG1-CG 4.06Å; V682-M705 HydrophobicContact CG2-CG 4.18Å; V682-C709 HydrophobicContact CG1-CB 4.23Å; V682-C709 HydrophobicContact CG2-CB 4.34Å; V682-V744 HydrophobicContact CG2-CG1 4.11Å
683	D	90.1	Very high	88.6	Confident	87 Å²	87	50.5 Å²	50.5	47%	0.465	28%	0.278	S	S	.	.	H	α-helix	trans	-60.6	-43.2	175.1	-69.2	-28.7	0	0	0	111.3	Q679 M685 V686 N687	Q679-D683 PolarHBondContact O-N 2.83Å; D683-M685 VanDerWaalsContact C-N 3.32Å; D683-M685 PolarHBondContact O-N 3.24Å; D683-V686 PolarHBondContact O-N 3.28Å; D683-N687 VanDerWaalsContact O-CB 3.23Å; D683-N687 WeakPolarHBondContact O-CB 3.47Å; D683-N687 VanDerWaalsContact O-CG 3.27Å; D683-N687 PolarHBondContact O-N 3.5Å; D683-N687 PolarHBondContact O-ND2 3.35Å; D683-N687 VanDerWaalsContact O-ND2 3.07Å
684	N	90.6	Very high	88.6	Confident	66 Å²	66	51 Å²	51	35%	0.353	27%	0.27	S	S	.	.	H	α-helix	trans	-63.5	-35.4	173.8	-74.5	-38.1	0	0	0	112.5	Q648 S680 V681 V682 S688	Q648-N684 HydrophobicContact CG-CB 4.34Å; S680-N684 WeakPolarHBondContact O-CB 3.49Å; S680-N684 PolarHBondContact O-N 2.65Å; S680-N684 PolarHBondContact O-ND2 3.12Å; V681-N684 PolarHBondContact O-N 2.96Å; V682-N684 VanDerWaalsContact C-N 3.34Å; V682-N684 PolarHBondContact O-N 3.17Å; N684-S688 WeakPolarHBondContact O-CB 3.49Å; N684-S688 PolarHBondContact O-N 3.31Å; N684-S688 PolarHBondContact O-OG 3.48Å
685	M	91.3	Very high	88.3	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-66.2	-51	173	-71.5	-177.4	68.4	0	0	111.1	L645 Q648 T649 L652 V681 V682 D683 N687 S688 V689 M705 A748 L751	L645-M685 HydrophobicContact CD1-CB 4.07Å; L645-M685 HydrophobicContact CD1-CE 3.86Å; L645-M685 HydrophobicContact CD1-CG 4.14Å; Q648-M685 HydrophobicContact CB-CG 3.39Å; Q648-M685 HydrophobicContact CB-SD 4.24Å; Q648-M685 HydrophobicContact CG-CG 4.32Å; T649-M685 WeakPolarHBondContact OG1-CE 3.47Å; L652-M685 HydrophobicContact CB-SD 4.21Å; L652-M685 HydrophobicContact CD2-SD 3.7Å; V681-M685 HydrophobicContact CG1-SD 4.41Å; V681-M685 WeakPolarHBondContact O-CG 3.48Å; V681-M685 PolarHBondContact O-N 3.43Å; V682-M685 WeakPolarHBondContact O-CA 3.38Å; V682-M685 WeakPolarHBondContact O-CB 3.33Å; V682-M685 PolarHBondContact O-N 2.93Å; V682-M685 VanDerWaalsContact O-N 3.09Å; D683-M685 VanDerWaalsContact C-N 3.32Å; D683-M685 PolarHBondContact O-N 3.24Å; M685-N687 PolarHBondContact O-N 2.8Å; M685-S688 PolarHBondContact O-N 3.49Å; M685-S688 PolarHBondContact O-OG 3.5Å; M685-V689 PolarHBondContact O-N 2.75Å; M685-M705 HydrophobicContact CB-CE 3.75Å; M685-M705 HydrophobicContact CB-SD 4.49Å; M685-M705 HydrophobicContact CE-SD 4.13Å; M685-M705 HydrophobicContact SD-SD 4.29Å; M685-A748 HydrophobicContact CE-CB 4.06Å; M685-L751 HydrophobicContact CE-CD2 4.18Å
686	V	89.7	Confident	88.3	Confident	24 Å²	24	60.2 Å²	60.2	15%	0.145	32%	0.324	C	S	.	.	H	α-helix	trans	-57	-49.5	177.8	175.3	0	0	0	0	110.7	V682 D683 S688 V689 R694 L702 M705 V706	V682-V686 HydrophobicContact CG1-CG2 4.44Å; V682-V686 WeakPolarHBondContact O-CG2 3.22Å; V682-V686 PolarHBondContact O-N 3.14Å; D683-V686 PolarHBondContact O-N 3.28Å; V686-S688 VanDerWaalsContact C-N 3.31Å; V686-S688 PolarHBondContact O-N 3.14Å; V686-V689 PolarHBondContact O-N 3.23Å; V686-R694 PolarHBondContact O-NH2 2.9Å; V686-L702 HydrophobicContact CB-CD2 4.4Å; V686-L702 HydrophobicContact CG2-CD2 4.04Å; V686-M705 HydrophobicContact CG2-CE 3.8Å; V686-V706 HydrophobicContact CG2-CG2 3.93Å
687	N	87.3	Confident	88.3	Confident	114 Å²	114	58.8 Å²	58.8	61%	0.61	32%	0.321	S	S	*	.	H	α-helix	trans	-66.6	-31	-179.6	-72.3	-36.2	0	0	0	113	D683 M685 V689	D683-N687 VanDerWaalsContact O-CB 3.23Å; D683-N687 WeakPolarHBondContact O-CB 3.47Å; D683-N687 VanDerWaalsContact O-CG 3.27Å; D683-N687 PolarHBondContact O-N 3.5Å; D683-N687 PolarHBondContact O-ND2 3.35Å; D683-N687 VanDerWaalsContact O-ND2 3.07Å; M685-N687 PolarHBondContact O-N 2.8Å; N687-V689 VanDerWaalsContact C-N 3.3Å; N687-V689 PolarHBondContact O-N 3.35Å
688	S	84.8	Confident	88.2	Confident	23 Å²	23	54.8 Å²	54.8	16%	0.161	31%	0.307	C	S	.	.	H	α-helix	trans	-68.2	-25.2	175.9	73.4	0	0	0	0	114.1	F641 H644 N684 M685 V686 P690	F641-S688 WeakPolarHBondContact CD2-O 3.42Å; F641-S688 VanDerWaalsContact CE2-O 3.29Å; F641-S688 WeakPolarHBondContact CE2-O 3.19Å; H644-S688 WeakPolarHBondContact ND1-CB 3.48Å; N684-S688 WeakPolarHBondContact O-CB 3.49Å; N684-S688 PolarHBondContact O-N 3.31Å; N684-S688 PolarHBondContact O-OG 3.48Å; M685-S688 PolarHBondContact O-N 3.49Å; M685-S688 PolarHBondContact O-OG 3.5Å; V686-S688 VanDerWaalsContact C-N 3.31Å; V686-S688 PolarHBondContact O-N 3.14Å; S688-P690 VanDerWaalsContact O-CD 3.27Å; S688-P690 WeakPolarHBondContact O-CD 3.4Å
689	V	87.4	Confident	88	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	32%	0.316	C	S	.	.	S	Bend	trans	-74.2	117.6	177.4	-178	0	0	0	0	110.3	F641 L645 M685 V686 N687 L693 R694 V698 L702 L751 I755	F641-V689 HydrophobicContact CE2-CB 4.27Å; F641-V689 HydrophobicContact CE2-CG2 3.99Å; F641-V689 HydrophobicContact CZ-CB 4.39Å; F641-V689 HydrophobicContact CZ-CG1 4.28Å; F641-V689 HydrophobicContact CZ-CG2 4.13Å; L645-V689 HydrophobicContact CD1-CG2 4.49Å; M685-V689 PolarHBondContact O-N 2.75Å; V686-V689 PolarHBondContact O-N 3.23Å; N687-V689 VanDerWaalsContact C-N 3.3Å; N687-V689 PolarHBondContact O-N 3.35Å; V689-L693 HydrophobicContact CG1-CB 4.1Å; V689-R694 HydrophobicContact CB-CG 4.45Å; V689-R694 HydrophobicContact CG1-CG 3.88Å; V689-R694 PolarHBondContact O-NE 2.82Å; V689-R694 PolarHBondContact O-NH2 3.43Å; V689-V698 HydrophobicContact CG1-CG1 3.97Å; V689-L702 HydrophobicContact CB-CD1 4.35Å; V689-L702 HydrophobicContact CG1-CD1 4.31Å; V689-L702 HydrophobicContact CG2-CD2 4.12Å; V689-L751 HydrophobicContact CG2-CD1 4.48Å; V689-I755 HydrophobicContact CG2-CD1 4.02Å
690	P	83.8	Confident	87.9	Confident	38 Å²	38	60.7 Å²	60.7	25%	0.247	34%	0.337	C	S	.	.			trans	-57.5	139.1	177.1	-25	34.4	0	0	0	112.1	F641 S688 H692 L693	F641-P690 HydrophobicContact CD1-CG 4.24Å; F641-P690 HydrophobicContact CD2-CG 4.34Å; F641-P690 HydrophobicContact CG-CG 4.11Å; S688-P690 VanDerWaalsContact O-CD 3.27Å; S688-P690 WeakPolarHBondContact O-CD 3.4Å; P690-H692 WeakPolarHBondContact CB-CE1 3.48Å; P690-H692 PolarHBondContact O-N 2.81Å; P690-L693 HydrophobicContact CG-CD1 4.42Å; P690-L693 PolarHBondContact O-N 2.72Å
691	V	82.4	Confident	87.9	Confident	114 Å²	114	58.4 Å²	58.4	69%	0.691	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-54.2	-34.6	-174.6	-176.6	0	0	0	0	112.7	L693 R694	V691-L693 VanDerWaalsContact C-N 3.29Å; V691-L693 PolarHBondContact O-N 2.85Å; V691-R694 PolarHBondContact O-N 2.73Å
692	H	82.3	Confident	87.9	Confident	126 Å²	126	58 Å²	58	58%	0.583	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-66.5	-26	178.7	63.3	-98	0	0	0	114.2	P690	P690-H692 WeakPolarHBondContact CB-CE1 3.48Å; P690-H692 PolarHBondContact O-N 2.81Å
693	L	84.9	Confident	87.8	Confident	65 Å²	65	62.5 Å²	62.5	34%	0.34	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-86.1	-12	175.5	-61.9	-176.3	0	0	0	113.3	F641 V689 P690 V691 K695 V698	F641-L693 HydrophobicContact CD1-CD1 4.11Å; F641-L693 HydrophobicContact CE1-CD1 3.43Å; F641-L693 VanDerWaalsContact CE1-CD1 3.43Å; F641-L693 HydrophobicContact CZ-CD1 4.11Å; V689-L693 HydrophobicContact CG1-CB 4.1Å; P690-L693 HydrophobicContact CG-CD1 4.42Å; P690-L693 PolarHBondContact O-N 2.72Å; V691-L693 VanDerWaalsContact C-N 3.29Å; V691-L693 PolarHBondContact O-N 2.85Å; L693-K695 PolarHBondContact O-N 2.71Å; L693-V698 VanDerWaalsContact O-CB 3.27Å; L693-V698 WeakPolarHBondContact O-CB 3.41Å; L693-V698 WeakPolarHBondContact O-CG1 3.34Å
694	R	85.9	Confident	87.9	Confident	84 Å²	84	60.5 Å²	60.5	32%	0.317	34%	0.337	S	S	.	.			trans	-76.3	61.3	-178.8	-57.6	-172.1	-169	-179.5	4.3	111.9	V686 V689 V691 L702	V686-R694 PolarHBondContact O-NH2 2.9Å; V689-R694 HydrophobicContact CB-CG 4.45Å; V689-R694 HydrophobicContact CG1-CG 3.88Å; V689-R694 PolarHBondContact O-NE 2.82Å; V689-R694 PolarHBondContact O-NH2 3.43Å; V691-R694 PolarHBondContact O-N 2.73Å; R694-L702 HydrophobicContact CB-CD1 4.32Å; R694-L702 HydrophobicContact CG-CD1 3.79Å
695	K	84.3	Confident	87.9	Confident	153 Å²	153	57.4 Å²	57.4	67%	0.665	32%	0.321	S	S	*	.	S	Bend	trans	-136	161.3	-179.7	-63.1	-177.8	-177.7	178	0	110.6	L693 A697 V698 A699	L693-K695 PolarHBondContact O-N 2.71Å; K695-A697 PolarHBondContact O-N 3.08Å; K695-V698 PolarHBondContact O-N 2.88Å; K695-V698 VanDerWaalsContact O-N 3.12Å; K695-A699 PolarHBondContact O-N 3.2Å
696	G	89.1	Confident	88	Confident	54 Å²	54	59.9 Å²	59.9	56%	0.557	34%	0.336	S	S	*	.	H	α-helix	trans	54.8	-124.8	171	0	0	0	0	0	114.1	V698 K700	G696-V698 VanDerWaalsContact C-N 3.34Å; G696-K700 WeakPolarHBondContact O-CG 3.41Å; G696-K700 PolarHBondContact O-N 3.1Å
697	A	89.5	Confident	88	Confident	53 Å²	53	63.8 Å²	63.8	44%	0.438	36%	0.356	S	S	.	.	H	α-helix	trans	-66.5	-32.4	-179.5	0	0	0	0	0	113.4	K695 S701 A754	K695-A697 PolarHBondContact O-N 3.08Å; A697-S701 WeakPolarHBondContact O-CB 3.49Å; A697-S701 PolarHBondContact O-N 2.68Å; A697-S701 PolarHBondContact O-OG 3.21Å; A697-A754 HydrophobicContact CB-CB 3.89Å
698	V	89.5	Confident	88.3	Confident	13 Å²	13	58.9 Å²	58.9	8%	0.079	33%	0.331	C	S	.	.	H	α-helix	trans	-66.5	-47.7	177.3	-179.8	0	0	0	0	110.1	V689 L693 K695 G696 S701 L702 L751 A754 I755	V689-V698 HydrophobicContact CG1-CG1 3.97Å; L693-V698 VanDerWaalsContact O-CB 3.27Å; L693-V698 WeakPolarHBondContact O-CB 3.41Å; L693-V698 WeakPolarHBondContact O-CG1 3.34Å; K695-V698 PolarHBondContact O-N 2.88Å; K695-V698 VanDerWaalsContact O-N 3.12Å; G696-V698 VanDerWaalsContact C-N 3.34Å; V698-S701 PolarHBondContact O-N 3.08Å; V698-S701 VanDerWaalsContact O-N 3.16Å; V698-L702 HydrophobicContact CG1-CD1 4.15Å; V698-L702 HydrophobicContact CG1-CG 4.46Å; V698-L702 WeakPolarHBondContact O-CG 3.4Å; V698-L702 PolarHBondContact O-N 2.71Å; V698-L751 HydrophobicContact CG1-CD1 3.86Å; V698-A754 HydrophobicContact CG2-CB 3.96Å; V698-A754 VanDerWaalsContact CG2-O 3.22Å; V698-A754 WeakPolarHBondContact CG2-O 3.29Å; V698-I755 HydrophobicContact CG1-CD1 4.36Å; V698-I755 HydrophobicContact CG1-CG1 4.19Å; V698-I755 HydrophobicContact CG2-CG1 3.96Å
699	A	87.6	Confident	88.7	Confident	23 Å²	23	58.1 Å²	58.1	19%	0.19	33%	0.325	C	S	.	.	H	α-helix	trans	-56.4	-53	176	0	0	0	0	0	111.4	K695 S701 L702 D703	K695-A699 PolarHBondContact O-N 3.2Å; A699-S701 PolarHBondContact O-N 2.85Å; A699-S701 VanDerWaalsContact O-N 3.16Å; A699-L702 WeakPolarHBondContact O-CB 3.37Å; A699-L702 PolarHBondContact O-N 3.29Å; A699-D703 VanDerWaalsContact O-CG 3.22Å; A699-D703 PolarHBondContact O-N 3.17Å
700	K	89.6	Confident	88.7	Confident	158 Å²	158	62.7 Å²	62.7	69%	0.687	35%	0.349	S	S	*	.	H	α-helix	trans	-56.4	-34.5	176.6	-68.8	-180	-179.9	-175.8	0	113.7	G696 A704	G696-K700 WeakPolarHBondContact O-CG 3.41Å; G696-K700 PolarHBondContact O-N 3.1Å; K700-A704 WeakPolarHBondContact O-CB 3.23Å; K700-A704 PolarHBondContact O-N 2.85Å
701	S	91.3	Very high	89	Confident	13 Å²	13	64.9 Å²	64.9	9%	0.091	36%	0.359	C	S	.	.	H	α-helix	trans	-76.2	-33.1	178.5	-56.9	0	0	0	0	112.4	A697 V698 A699 M705	A697-S701 WeakPolarHBondContact O-CB 3.49Å; A697-S701 PolarHBondContact O-N 2.68Å; A697-S701 PolarHBondContact O-OG 3.21Å; V698-S701 PolarHBondContact O-N 3.08Å; V698-S701 VanDerWaalsContact O-N 3.16Å; A699-S701 PolarHBondContact O-N 2.85Å; A699-S701 VanDerWaalsContact O-N 3.16Å; S701-M705 VanDerWaalsContact O-CB 3.29Å; S701-M705 WeakPolarHBondContact O-CB 3.32Å; S701-M705 PolarHBondContact O-N 3.48Å; S701-M705 VanDerWaalsContact O-N 3.13Å
702	L	92	Very high	89.4	Confident	8 Å²	8	59.4 Å²	59.4	4%	0.042	33%	0.326	C	S	.	.	H	α-helix	trans	-68.1	-49.1	172	-69.8	172.6	0	0	0	110.9	V686 V689 R694 V698 A699 A704 M705 V706 L751	V686-L702 HydrophobicContact CB-CD2 4.4Å; V686-L702 HydrophobicContact CG2-CD2 4.04Å; V689-L702 HydrophobicContact CB-CD1 4.35Å; V689-L702 HydrophobicContact CG1-CD1 4.31Å; V689-L702 HydrophobicContact CG2-CD2 4.12Å; R694-L702 HydrophobicContact CB-CD1 4.32Å; R694-L702 HydrophobicContact CG-CD1 3.79Å; V698-L702 HydrophobicContact CG1-CD1 4.15Å; V698-L702 HydrophobicContact CG1-CG 4.46Å; V698-L702 WeakPolarHBondContact O-CG 3.4Å; V698-L702 PolarHBondContact O-N 2.71Å; A699-L702 WeakPolarHBondContact O-CB 3.37Å; A699-L702 PolarHBondContact O-N 3.29Å; L702-A704 PolarHBondContact O-N 3.07Å; L702-M705 HydrophobicContact CD2-CE 4.05Å; L702-M705 WeakPolarHBondContact O-CB 3.27Å; L702-M705 PolarHBondContact O-N 2.97Å; L702-V706 WeakPolarHBondContact O-CG2 3.36Å; L702-V706 PolarHBondContact O-N 3.49Å; L702-L751 HydrophobicContact CD2-CD1 3.7Å; L702-L751 HydrophobicContact CD2-CD2 3.68Å; L702-L751 HydrophobicContact CD2-CG 4.35Å; L702-L751 HydrophobicContact CG-CD1 3.8Å
703	D	89.4	Confident	89.7	Confident	97 Å²	97	55 Å²	55	52%	0.519	31%	0.308	S	S	.	.	H	α-helix	trans	-58	-49.9	178.2	-59.3	-28.8	0	0	0	110.3	A699 M705 V706 D707	A699-D703 VanDerWaalsContact O-CG 3.22Å; A699-D703 PolarHBondContact O-N 3.17Å; D703-M705 PolarHBondContact O-N 2.8Å; D703-V706 PolarHBondContact O-N 3.29Å; D703-D707 WeakPolarHBondContact O-CB 3.42Å; D703-D707 PolarHBondContact O-N 2.76Å
704	A	92.5	Very high	89.7	Confident	45 Å²	45	55 Å²	55	37%	0.372	31%	0.31	S	S	.	.	H	α-helix	trans	-61.3	-28.8	176.3	0	0	0	0	0	113.8	K700 L702 A708 A747	K700-A704 WeakPolarHBondContact O-CB 3.23Å; K700-A704 PolarHBondContact O-N 2.85Å; L702-A704 PolarHBondContact O-N 3.07Å; A704-A708 WeakPolarHBondContact O-CB 3.4Å; A704-A708 PolarHBondContact O-N 3.42Å; A704-A747 HydrophobicContact CB-CB 4.27Å
705	M	92.2	Very high	89.6	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-75.7	-39.2	177	-171.7	172.5	65.8	0	0	111.5	V682 M685 V686 S701 L702 D703 C709 A747 A748 L751	V682-M705 HydrophobicContact CG1-CE 4.23Å; V682-M705 HydrophobicContact CG1-CG 4.06Å; V682-M705 HydrophobicContact CG2-CG 4.18Å; M685-M705 HydrophobicContact CB-CE 3.75Å; M685-M705 HydrophobicContact CB-SD 4.49Å; M685-M705 HydrophobicContact CE-SD 4.13Å; M685-M705 HydrophobicContact SD-SD 4.29Å; V686-M705 HydrophobicContact CG2-CE 3.8Å; S701-M705 VanDerWaalsContact O-CB 3.29Å; S701-M705 WeakPolarHBondContact O-CB 3.32Å; S701-M705 PolarHBondContact O-N 3.48Å; S701-M705 VanDerWaalsContact O-N 3.13Å; L702-M705 HydrophobicContact CD2-CE 4.05Å; L702-M705 WeakPolarHBondContact O-CB 3.27Å; L702-M705 PolarHBondContact O-N 2.97Å; D703-M705 PolarHBondContact O-N 2.8Å; M705-C709 VanDerWaalsContact O-CB 3.27Å; M705-C709 WeakPolarHBondContact O-CB 3.34Å; M705-C709 PolarHBondContact O-N 2.89Å; M705-A747 HydrophobicContact CB-CB 3.76Å; M705-A747 HydrophobicContact CG-CB 4.31Å; M705-A748 HydrophobicContact SD-CB 3.96Å; M705-L751 HydrophobicContact CE-CD2 3.78Å; M705-L751 HydrophobicContact SD-CD2 4.19Å
706	V	91.6	Very high	89.5	Confident	53 Å²	53	45.6 Å²	45.6	32%	0.321	27%	0.273	S	S	.	.	H	α-helix	trans	-66.6	-47.6	172.9	175.2	0	0	0	0	110.3	V686 L702 D703 A708 C709 L710	V686-V706 HydrophobicContact CG2-CG2 3.93Å; L702-V706 WeakPolarHBondContact O-CG2 3.36Å; L702-V706 PolarHBondContact O-N 3.49Å; D703-V706 PolarHBondContact O-N 3.29Å; V706-A708 PolarHBondContact O-N 3.41Å; V706-C709 WeakPolarHBondContact O-CB 3.45Å; V706-C709 PolarHBondContact O-N 3.22Å; V706-C709 VanDerWaalsContact O-N 3.12Å; V706-L710 HydrophobicContact CG1-CD1 4.04Å; V706-L710 HydrophobicContact CG1-CG 4.44Å; V706-L710 WeakPolarHBondContact O-CG 3.49Å; V706-L710 PolarHBondContact O-N 2.75Å
707	D	90.7	Very high	88.9	Confident	106 Å²	106	46.7 Å²	46.7	57%	0.567	28%	0.277	S	S	*	.	H	α-helix	trans	-60	-44.9	177.6	-76.7	-18.2	0	0	0	112.3	D703 C709 L710 L711	D703-D707 WeakPolarHBondContact O-CB 3.42Å; D703-D707 PolarHBondContact O-N 2.76Å; D707-C709 VanDerWaalsContact C-N 3.3Å; D707-C709 PolarHBondContact O-N 3.28Å; D707-L710 PolarHBondContact O-N 3.16Å; D707-L711 WeakPolarHBondContact O-CB 3.48Å; D707-L711 PolarHBondContact O-N 2.77Å
708	A	93.2	Very high	87.9	Confident	10 Å²	10	52.9 Å²	52.9	8%	0.083	29%	0.289	C	S	.	.	H	α-helix	trans	-65.1	-34.7	175.8	0	0	0	0	0	112.1	A704 V706 L711 L712 E743 V744	A704-A708 WeakPolarHBondContact O-CB 3.4Å; A704-A708 PolarHBondContact O-N 3.42Å; V706-A708 PolarHBondContact O-N 3.41Å; A708-L711 PolarHBondContact O-N 3.2Å; A708-L712 WeakPolarHBondContact O-CB 3.22Å; A708-L712 PolarHBondContact O-N 2.91Å; A708-E743 HydrophobicContact CB-CB 4.06Å; A708-V744 VanDerWaalsContact C-CG2 3.46Å; A708-V744 HydrophobicContact CB-CB 4.42Å; A708-V744 HydrophobicContact CB-CG2 3.7Å; A708-V744 WeakPolarHBondContact O-CG2 3.27Å
709	C	92.8	Very high	86.7	Confident	7 Å²	7	56.8 Å²	56.8	5%	0.047	30%	0.303	C	S	.	.	H	α-helix	trans	-70.5	-41	176.5	-165.3	0	0	0	0	111.7	V682 M705 V706 D707 L712 T713 V744	V682-C709 HydrophobicContact CG1-CB 4.23Å; V682-C709 HydrophobicContact CG2-CB 4.34Å; M705-C709 VanDerWaalsContact O-CB 3.27Å; M705-C709 WeakPolarHBondContact O-CB 3.34Å; M705-C709 PolarHBondContact O-N 2.89Å; V706-C709 WeakPolarHBondContact O-CB 3.45Å; V706-C709 PolarHBondContact O-N 3.22Å; V706-C709 VanDerWaalsContact O-N 3.12Å; D707-C709 VanDerWaalsContact C-N 3.3Å; D707-C709 PolarHBondContact O-N 3.28Å; C709-L712 PolarHBondContact O-N 3.13Å; C709-T713 WeakPolarHBondContact O-CB 3.16Å; C709-T713 PolarHBondContact O-N 3.46Å; C709-T713 PolarHBondContact O-OG1 2.72Å; C709-V744 HydrophobicContact CB-CG2 4.41Å
710	L	88.6	Confident	85.1	Confident	96 Å²	96	58.5 Å²	58.5	50%	0.503	31%	0.312	S	S	.	.	H	α-helix	trans	-61.2	-44.2	171.2	-73.2	170.4	0	0	0	111.2	V706 D707 T713 V714	V706-L710 HydrophobicContact CG1-CD1 4.04Å; V706-L710 HydrophobicContact CG1-CG 4.44Å; V706-L710 WeakPolarHBondContact O-CG 3.49Å; V706-L710 PolarHBondContact O-N 2.75Å; D707-L710 PolarHBondContact O-N 3.16Å; L710-T713 WeakPolarHBondContact O-CB 3.4Å; L710-T713 PolarHBondContact O-N 3.34Å; L710-T713 VanDerWaalsContact O-N 3.16Å; L710-V714 WeakPolarHBondContact O-CG2 3.48Å; L710-V714 PolarHBondContact O-N 2.93Å
711	L	89.3	Confident	83.2	Confident	84 Å²	84	56.8 Å²	56.8	44%	0.44	32%	0.315	S	S	.	.	H	α-helix	trans	-61.7	-45.7	176.6	-176.8	61.6	0	0	0	111.8	D707 A708 T713 V714 H715 A740	D707-L711 WeakPolarHBondContact O-CB 3.48Å; D707-L711 PolarHBondContact O-N 2.77Å; A708-L711 PolarHBondContact O-N 3.2Å; L711-T713 VanDerWaalsContact C-N 3.28Å; L711-T713 PolarHBondContact O-N 3.39Å; L711-V714 PolarHBondContact O-N 2.69Å; L711-H715 WeakPolarHBondContact CD1-NE2 3.45Å; L711-H715 PolarHBondContact O-CD2 2.93Å; L711-H715 PolarHBondContact O-N 3.05Å; L711-A740 HydrophobicContact CG-CB 4.49Å
712	L	91	Very high	80.9	Confident	0 Å²	0	61 Å²	61	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-58.5	-40.8	173.2	177	61.2	0	0	0	111.6	I659 V675 V678 A708 C709 H715 C716 V737 A740 S741 V744	I659-L712 HydrophobicContact CD1-CD2 3.96Å; V675-L712 HydrophobicContact CG2-CD2 4.48Å; V675-L712 HydrophobicContact CG2-CG 4.03Å; V678-L712 HydrophobicContact CG1-CD2 4.12Å; A708-L712 WeakPolarHBondContact O-CB 3.22Å; A708-L712 PolarHBondContact O-N 2.91Å; C709-L712 PolarHBondContact O-N 3.13Å; L712-H715 PolarHBondContact O-N 3.26Å; L712-C716 WeakPolarHBondContact O-CB 3.35Å; L712-C716 PolarHBondContact O-N 3.44Å; L712-C716 PolarHBondContact O-SG 3.06Å; L712-C716 VanDerWaalsContact O-SG 3.34Å; L712-V737 HydrophobicContact CD1-CG1 4.01Å; L712-A740 HydrophobicContact CB-CB 3.93Å; L712-A740 HydrophobicContact CD1-CB 4Å; L712-S741 WeakPolarHBondContact CD1-OG 3.3Å; L712-V744 HydrophobicContact CB-CG2 4.45Å; L712-V744 HydrophobicContact CD2-CG2 4.19Å
713	T	88.3	Confident	78.3	Confident	34 Å²	34	65.2 Å²	65.2	21%	0.209	37%	0.374	C	S	.	.	H	α-helix	trans	-62.4	-46.9	176	-53	0	0	0	0	111.7	V675 Q679 C709 L710 L711 H715 C716 A717	V675-T713 HydrophobicContact CG1-CG2 3.99Å; V675-T713 WeakPolarHBondContact CG1-OG1 3.49Å; Q679-T713 VanDerWaalsContact NE2-CG2 3.28Å; Q679-T713 PolarHBondContact NE2-OG1 3.38Å; C709-T713 WeakPolarHBondContact O-CB 3.16Å; C709-T713 PolarHBondContact O-N 3.46Å; C709-T713 PolarHBondContact O-OG1 2.72Å; L710-T713 WeakPolarHBondContact O-CB 3.4Å; L710-T713 PolarHBondContact O-N 3.34Å; L710-T713 VanDerWaalsContact O-N 3.16Å; L711-T713 VanDerWaalsContact C-N 3.28Å; L711-T713 PolarHBondContact O-N 3.39Å; T713-H715 PolarHBondContact O-N 3.08Å; T713-C716 PolarHBondContact O-N 3.44Å; T713-A717 WeakPolarHBondContact O-CB 3.1Å; T713-A717 PolarHBondContact O-N 3.24Å
714	V	84.5	Confident	76.2	Confident	65 Å²	65	69.6 Å²	69.6	39%	0.394	39%	0.392	S	S	.	.	H	α-helix	trans	-63.4	-40.6	177.8	170.9	0	0	0	0	111.5	L710 L711 A717 R718	L710-V714 WeakPolarHBondContact O-CG2 3.48Å; L710-V714 PolarHBondContact O-N 2.93Å; L711-V714 PolarHBondContact O-N 2.69Å; V714-A717 PolarHBondContact O-N 3.29Å; V714-R718 HydrophobicContact CG1-CG 4.48Å; V714-R718 WeakPolarHBondContact O-CB 3.47Å; V714-R718 VanDerWaalsContact O-CG 3.28Å; V714-R718 WeakPolarHBondContact O-CG 3.43Å; V714-R718 PolarHBondContact O-N 2.75Å; V714-R718 VanDerWaalsContact O-N 3.15Å
715	H	85.1	Confident	74.1	Confident	30 Å²	30	75.2 Å²	75.2	14%	0.139	41%	0.41	C	S	.	.	H	α-helix	trans	-63.6	-48.5	174.9	-76.1	-64	0	0	0	111.6	L711 L712 T713 A717 R718 F733 Q736 V737	L711-H715 WeakPolarHBondContact CD1-NE2 3.45Å; L711-H715 PolarHBondContact O-CD2 2.93Å; L711-H715 PolarHBondContact O-N 3.05Å; L712-H715 PolarHBondContact O-N 3.26Å; T713-H715 PolarHBondContact O-N 3.08Å; H715-A717 VanDerWaalsContact C-N 3.29Å; H715-A717 PolarHBondContact O-N 3.05Å; H715-R718 PolarHBondContact O-N 2.83Å; H715-F733 WeakPolarHBondContact O-CE2 3.28Å; H715-F733 WeakPolarHBondContact O-CZ 3.23Å; H715-Q736 PolarHBondContact CE1-OE1 3.46Å; H715-Q736 PolarHBondContact ND1-OE1 3Å; H715-V737 HydrophobicContact CB-CG2 4.14Å
716	C	82.4	Confident	72.3	Confident	8 Å²	8	80.2 Å²	80.2	5%	0.054	43%	0.434	C	S	.	.	H	α-helix	trans	-65.7	-28.9	179.5	-68.1	0	0	0	0	113.5	F671 V675 L712 T713	F671-C716 HydrophobicContact CB-CB 4.05Å; V675-C716 HydrophobicContact CG2-CB 3.67Å; V675-C716 WeakPolarHBondContact CG2-SG 3.16Å; L712-C716 WeakPolarHBondContact O-CB 3.35Å; L712-C716 PolarHBondContact O-N 3.44Å; L712-C716 PolarHBondContact O-SG 3.06Å; L712-C716 VanDerWaalsContact O-SG 3.34Å; T713-C716 PolarHBondContact O-N 3.44Å
717	A	77	Confident	70.6	Confident	78 Å²	78	83.2 Å²	83.2	65%	0.645	45%	0.448	S	S	*	.	H	α-helix	trans	-75.8	-26.6	175.1	0	0	0	0	0	113.8	T713 V714 H715 Y719	T713-A717 WeakPolarHBondContact O-CB 3.1Å; T713-A717 PolarHBondContact O-N 3.24Å; V714-A717 PolarHBondContact O-N 3.29Å; H715-A717 VanDerWaalsContact C-N 3.29Å; H715-A717 PolarHBondContact O-N 3.05Å; A717-Y719 PolarHBondContact O-N 2.94Å
718	R	67.9	Low	69.1	Low	182 Å²	182	83.7 Å²	83.7	69%	0.687	45%	0.454	S	S	*	.			trans	-81.6	39.6	-177.2	-78.2	179.7	175.2	-173.5	1.1	113.7	V714 H715 P720 F733	V714-R718 HydrophobicContact CG1-CG 4.48Å; V714-R718 WeakPolarHBondContact O-CB 3.47Å; V714-R718 VanDerWaalsContact O-CG 3.28Å; V714-R718 WeakPolarHBondContact O-CG 3.43Å; V714-R718 PolarHBondContact O-N 2.75Å; V714-R718 VanDerWaalsContact O-N 3.15Å; H715-R718 PolarHBondContact O-N 2.83Å; R718-P720 WeakPolarHBondContact O-CD 3.39Å; R718-F733 WeakPolarHBondContact O-CE2 3.44Å
719	Y	63.1	Low	68.1	Low	96 Å²	96	86.7 Å²	86.7	38%	0.376	47%	0.469	S	S	.	.			trans	-61.1	123.4	177.1	-175.1	-102.5	0	0	0	110.3	H668 A717 V721 F733	H668-Y719 HydrophobicContact CB-CD2 3.93Å; H668-Y719 HydrophobicContact CB-CE2 3.6Å; H668-Y719 AromaticContact CG-CE2 3.5Å; H668-Y719 AromaticContact ND1-CE2 3.7Å; A717-Y719 PolarHBondContact O-N 2.94Å; Y719-V721 HydrophobicContact CD1-CG2 4.27Å; Y719-V721 PolarHBondContact O-N 3.39Å; Y719-F733 HydrophobicContact CD2-CZ 4.43Å
720	P	54.7	Low	67.1	Low	59 Å²	59	88.4 Å²	88.4	38%	0.383	48%	0.475	S	S	.	.			trans	-71.4	102.5	-178.4	27.5	-32.8	0	0	0	110.1	R718	R718-P720 WeakPolarHBondContact O-CD 3.39Å
721	V	49.7	Very low	66.5	Low	122 Å²	122	86.4 Å²	86.4	74%	0.739	47%	0.473	S	S	*	.			trans	-80.7	123.3	169.2	-178.3	0	0	0	0	108.6	Y719	Y719-V721 HydrophobicContact CD1-CG2 4.27Å; Y719-V721 PolarHBondContact O-N 3.39Å
722	S	42.6	Very low	66.1	Low	102 Å²	102	90.1 Å²	90.1	71%	0.713	48%	0.481	S	S	*	.	S	Bend	trans	86.2	149.7	168.1	79.3	0	0	0	0	120.2
723	S	38.9	Very low	65.8	Low	96 Å²	96	90.8 Å²	90.8	67%	0.671	48%	0.484	S	S	*	.	S	Bend	trans	72	84.2	169.5	54.8	0	0	0	0	120.6	E725	S723-E725 VanDerWaalsContact C-N 3.32Å; S723-E725 PolarHBondContact O-N 2.96Å
724	Q	44.7	Very low	65.7	Low	189 Å²	189	89.5 Å²	89.5	88%	0.883	48%	0.477	S	S	*	.	S	Bend	trans	55.2	-26.1	137.6	-69.8	-174.2	-30.3	0	0	122.7	E726	Q724-E726 PolarHBondContact O-N 3.05Å; Q724-E726 VanDerWaalsContact O-N 3.16Å
725	E	47.3	Very low	65.8	Low	162 Å²	162	92.7 Å²	92.7	76%	0.757	49%	0.485	S	S	*	.			trans	-83.7	22.1	174	-62.8	-165	147.6	0	0	112.8	S723 N727	S723-E725 VanDerWaalsContact C-N 3.32Å; S723-E725 PolarHBondContact O-N 2.96Å; E725-N727 VanDerWaalsContact C-N 3.31Å; E725-N727 PolarHBondContact O-N 3.45Å
726	E	55.2	Low	65.8	Low	106 Å²	106	94.3 Å²	94.3	50%	0.495	49%	0.493	S	S	.	.	H	α-helix	trans	-56.9	-28.5	-153.2	-69.1	-168.9	-173.5	0	0	117	Q724 K730	Q724-E726 PolarHBondContact O-N 3.05Å; Q724-E726 VanDerWaalsContact O-N 3.16Å; E726-K730 VanDerWaalsContact O-CB 3.32Å; E726-K730 WeakPolarHBondContact O-CB 3.42Å; E726-K730 VanDerWaalsContact O-CD 3.3Å; E726-K730 WeakPolarHBondContact O-CD 2.86Å; E726-K730 WeakPolarHBondContact O-CG 3.3Å; E726-K730 PolarHBondContact O-N 3.46Å; E726-K730 VanDerWaalsContact O-N 3.16Å; E726-K730 IonicContact OE2-NZ 3.04Å; E726-K730 PolarHBondContact OE2-NZ 3.11Å
727	N	56.6	Low	66.1	Low	116 Å²	116	94 Å²	94	62%	0.62	49%	0.49	S	S	*	.	H	α-helix	trans	-83.3	-34.6	-165.7	-139.6	-11.8	0	0	0	113.2	E725 A731	E725-N727 VanDerWaalsContact C-N 3.31Å; E725-N727 PolarHBondContact O-N 3.45Å; N727-A731 PolarHBondContact O-N 2.8Å
728	V	58.9	Low	66.7	Low	115 Å²	115	92.2 Å²	92.2	70%	0.697	47%	0.47	S	S	*	.	H	α-helix	trans	-73.4	-43.1	178.6	-179.7	0	0	0	0	110.3	A731 R732	V728-A731 PolarHBondContact O-N 3.18Å; V728-R732 WeakPolarHBondContact O-CB 3.29Å; V728-R732 PolarHBondContact O-N 2.98Å
729	D	71.1	Confident	67.7	Low	73 Å²	73	88.5 Å²	88.5	39%	0.39	46%	0.46	S	S	.	.	H	α-helix	trans	-70.5	-34.6	178.3	-90.1	-17.5	0	0	0	113	A731 R732 F733	D729-A731 VanDerWaalsContact C-N 3.35Å; D729-A731 PolarHBondContact O-N 3.04Å; D729-R732 PolarHBondContact O-N 3.07Å; D729-F733 WeakPolarHBondContact O-CB 3.26Å; D729-F733 PolarHBondContact O-N 3.24Å
730	K	72.8	Confident	69.1	Low	43 Å²	43	84 Å²	84	19%	0.187	44%	0.444	C	S	.	.	H	α-helix	trans	-60.9	-42.1	170.7	-76.9	170.4	-166.3	172.8	0	112.2	E726 F733 C734	E726-K730 VanDerWaalsContact O-CB 3.32Å; E726-K730 WeakPolarHBondContact O-CB 3.42Å; E726-K730 VanDerWaalsContact O-CD 3.3Å; E726-K730 WeakPolarHBondContact O-CD 2.86Å; E726-K730 WeakPolarHBondContact O-CG 3.3Å; E726-K730 PolarHBondContact O-N 3.46Å; E726-K730 VanDerWaalsContact O-N 3.16Å; E726-K730 IonicContact OE2-NZ 3.04Å; E726-K730 PolarHBondContact OE2-NZ 3.11Å; K730-F733 PolarHBondContact O-N 2.65Å; K730-C734 WeakPolarHBondContact O-CB 3.36Å; K730-C734 PolarHBondContact O-N 2.94Å
731	A	75.8	Confident	70.8	Confident	55 Å²	55	81.2 Å²	81.2	46%	0.455	43%	0.425	S	S	.	.	H	α-helix	trans	-64.8	-43.5	175.9	0	0	0	0	0	111.9	N727 V728 D729 C734 F735	N727-A731 PolarHBondContact O-N 2.8Å; V728-A731 PolarHBondContact O-N 3.18Å; D729-A731 VanDerWaalsContact C-N 3.35Å; D729-A731 PolarHBondContact O-N 3.04Å; A731-C734 PolarHBondContact O-N 3.02Å; A731-F735 WeakPolarHBondContact O-CB 3.3Å; A731-F735 PolarHBondContact O-N 3.26Å
732	R	81.4	Confident	72.8	Confident	162 Å²	162	81.9 Å²	81.9	61%	0.611	42%	0.415	S	S	*	.	H	α-helix	trans	-65.2	-38.8	176.8	-167.4	180	-173.1	-177.6	2.1	112.4	V728 D729 F735 Q736	V728-R732 WeakPolarHBondContact O-CB 3.29Å; V728-R732 PolarHBondContact O-N 2.98Å; D729-R732 PolarHBondContact O-N 3.07Å; R732-F735 PolarHBondContact O-N 3.31Å; R732-Q736 WeakPolarHBondContact O-CG 3.47Å; R732-Q736 PolarHBondContact O-N 3.14Å
733	F	84.5	Confident	75.2	Confident	13 Å²	13	80.6 Å²	80.6	6%	0.057	40%	0.398	C	S	.	.	H	α-helix	trans	-62.3	-52.3	173.7	177.6	-86.1	0	0	0	111.2	H668 F671 H715 R718 Y719 D729 K730 F735 Q736 V737	H668-F733 AromaticContact CE1-CD1 3.83Å; H668-F733 AromaticContact ND1-CD1 3.6Å; H668-F733 AromaticContact ND1-CE1 3.6Å; F671-F733 AromaticContact CD2-CE1 3.84Å; F671-F733 HydrophobicContact CD2-CE1 3.84Å; F671-F733 HydrophobicContact CE2-CD1 4.33Å; F671-F733 AromaticContact CE2-CE1 3.7Å; F671-F733 HydrophobicContact CE2-CE1 3.7Å; H715-F733 WeakPolarHBondContact O-CE2 3.28Å; H715-F733 WeakPolarHBondContact O-CZ 3.23Å; R718-F733 WeakPolarHBondContact O-CE2 3.44Å; Y719-F733 HydrophobicContact CD2-CZ 4.43Å; D729-F733 WeakPolarHBondContact O-CB 3.26Å; D729-F733 PolarHBondContact O-N 3.24Å; K730-F733 PolarHBondContact O-N 2.65Å; F733-F735 VanDerWaalsContact C-N 3.26Å; F733-F735 PolarHBondContact O-N 3.41Å; F733-Q736 WeakPolarHBondContact O-CB 3.44Å; F733-Q736 PolarHBondContact O-N 2.76Å; F733-Q736 VanDerWaalsContact O-N 3.09Å; F733-V737 HydrophobicContact CD1-CG2 4.18Å; F733-V737 HydrophobicContact CE1-CG2 3.81Å; F733-V737 HydrophobicContact CZ-CG2 4.14Å; F733-V737 WeakPolarHBondContact O-CG2 3.31Å; F733-V737 PolarHBondContact O-N 3.3Å
734	C	85	Confident	77.8	Confident	8 Å²	8	76 Å²	76	5%	0.054	37%	0.366	C	S	.	.	H	α-helix	trans	-58.5	-38.8	176.2	-76.8	0	0	0	0	111.8	A663 H668 K730 A731 V737 I738	A663-C734 HydrophobicContact CB-CB 4.24Å; H668-C734 VanDerWaalsContact CE1-SG 3.57Å; K730-C734 WeakPolarHBondContact O-CB 3.36Å; K730-C734 PolarHBondContact O-N 2.94Å; A731-C734 PolarHBondContact O-N 3.02Å; C734-V737 PolarHBondContact O-N 3.33Å; C734-I738 WeakPolarHBondContact O-CB 3.47Å; C734-I738 WeakPolarHBondContact O-CD1 3.4Å; C734-I738 WeakPolarHBondContact O-CG1 3.45Å; C734-I738 PolarHBondContact O-N 2.82Å
735	F	86.3	Confident	80.1	Confident	131 Å²	131	68.8 Å²	68.8	58%	0.575	34%	0.339	S	S	*	.	H	α-helix	trans	-62	-42.8	174.7	-174.4	-91.3	0	0	0	112.5	A731 R732 F733 I738 Q739	A731-F735 WeakPolarHBondContact O-CB 3.3Å; A731-F735 PolarHBondContact O-N 3.26Å; R732-F735 PolarHBondContact O-N 3.31Å; F733-F735 VanDerWaalsContact C-N 3.26Å; F733-F735 PolarHBondContact O-N 3.41Å; F735-I738 PolarHBondContact O-N 2.91Å; F735-Q739 WeakPolarHBondContact O-CB 3.17Å; F735-Q739 PolarHBondContact O-N 3.49Å
736	Q	86.7	Confident	82.2	Confident	65 Å²	65	66.2 Å²	66.2	30%	0.304	33%	0.325	S	S	.	.	H	α-helix	trans	-63.3	-44.2	175.1	-71.2	171.8	27.3	0	0	112.3	H715 R732 F733 I738 Q739 A740	H715-Q736 PolarHBondContact CE1-OE1 3.46Å; H715-Q736 PolarHBondContact ND1-OE1 3Å; R732-Q736 WeakPolarHBondContact O-CG 3.47Å; R732-Q736 PolarHBondContact O-N 3.14Å; F733-Q736 WeakPolarHBondContact O-CB 3.44Å; F733-Q736 PolarHBondContact O-N 2.76Å; F733-Q736 VanDerWaalsContact O-N 3.09Å; Q736-I738 PolarHBondContact O-N 2.95Å; Q736-Q739 PolarHBondContact O-N 3.31Å; Q736-A740 WeakPolarHBondContact O-CB 3.29Å; Q736-A740 PolarHBondContact O-N 2.84Å
737	V	88.7	Confident	84	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-61.7	-43.6	176.4	172.5	0	0	0	0	111.1	I659 F671 L712 H715 F733 C734 S741	I659-V737 HydrophobicContact CG2-CG1 3.59Å; F671-V737 HydrophobicContact CD1-CG1 4.02Å; F671-V737 HydrophobicContact CE1-CG1 3.75Å; F671-V737 HydrophobicContact CZ-CG1 4.12Å; L712-V737 HydrophobicContact CD1-CG1 4.01Å; H715-V737 HydrophobicContact CB-CG2 4.14Å; F733-V737 HydrophobicContact CD1-CG2 4.18Å; F733-V737 HydrophobicContact CE1-CG2 3.81Å; F733-V737 HydrophobicContact CZ-CG2 4.14Å; F733-V737 WeakPolarHBondContact O-CG2 3.31Å; F733-V737 PolarHBondContact O-N 3.3Å; C734-V737 PolarHBondContact O-N 3.33Å; V737-S741 WeakPolarHBondContact O-CB 3.34Å; V737-S741 PolarHBondContact O-N 2.85Å; V737-S741 PolarHBondContact O-OG 3.2Å
738	I	88.9	Confident	85.7	Confident	41 Å²	41	56 Å²	56	21%	0.21	28%	0.275	C	S	.	.	H	α-helix	trans	-60.1	-48.6	174	-72.1	165.3	0	0	0	110.7	L660 A663 C734 F735 Q736 S741 Y742	L660-I738 HydrophobicContact CD2-CB 4.16Å; L660-I738 HydrophobicContact CD2-CG1 3.9Å; L660-I738 HydrophobicContact CD2-CG2 3.77Å; A663-I738 HydrophobicContact CB-CD1 3.82Å; A663-I738 HydrophobicContact CB-CG1 3.74Å; C734-I738 WeakPolarHBondContact O-CB 3.47Å; C734-I738 WeakPolarHBondContact O-CD1 3.4Å; C734-I738 WeakPolarHBondContact O-CG1 3.45Å; C734-I738 PolarHBondContact O-N 2.82Å; F735-I738 PolarHBondContact O-N 2.91Å; Q736-I738 PolarHBondContact O-N 2.95Å; I738-S741 WeakPolarHBondContact O-CB 3.39Å; I738-S741 PolarHBondContact O-N 2.8Å; I738-Y742 HydrophobicContact CG2-CD2 3.75Å; I738-Y742 HydrophobicContact CG2-CE2 3.58Å; I738-Y742 VanDerWaalsContact O-CD2 3.24Å; I738-Y742 WeakPolarHBondContact O-CD2 3.26Å; I738-Y742 PolarHBondContact O-N 3.07Å
739	Q	89.5	Confident	87.2	Confident	104 Å²	104	55.8 Å²	55.8	49%	0.486	27%	0.265	S	S	.	.	H	α-helix	trans	-62.7	-44.9	-179.3	-175.6	176.9	-15.7	0	0	112	F735 Q736 S741 Y742 E743	F735-Q739 WeakPolarHBondContact O-CB 3.17Å; F735-Q739 PolarHBondContact O-N 3.49Å; Q736-Q739 PolarHBondContact O-N 3.31Å; Q739-S741 VanDerWaalsContact C-N 3.33Å; Q739-S741 PolarHBondContact O-N 3.07Å; Q739-Y742 WeakPolarHBondContact O-CB 3.31Å; Q739-Y742 PolarHBondContact O-N 3.29Å; Q739-E743 PolarHBondContact O-N 3.01Å; Q739-E743 VanDerWaalsContact O-N 3.08Å
740	A	90.8	Very high	88.2	Confident	3 Å²	3	56.7 Å²	56.7	3%	0.025	27%	0.267	C	S	.	.	H	α-helix	trans	-63.2	-38.4	175.5	0	0	0	0	0	112	L711 L712 Q736 Y742 E743 V744	L711-A740 HydrophobicContact CG-CB 4.49Å; L712-A740 HydrophobicContact CB-CB 3.93Å; L712-A740 HydrophobicContact CD1-CB 4Å; Q736-A740 WeakPolarHBondContact O-CB 3.29Å; Q736-A740 PolarHBondContact O-N 2.84Å; A740-Y742 VanDerWaalsContact C-N 3.31Å; A740-Y742 PolarHBondContact O-N 2.89Å; A740-E743 PolarHBondContact O-N 3.43Å; A740-V744 PolarHBondContact O-N 3.24Å; A740-V744 VanDerWaalsContact O-N 3.08Å
741	S	91.2	Very high	89.1	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-61.5	-38.2	173.6	-53.5	0	0	0	0	112.4	I659 L712 V737 I738 Q739 V744 A745	I659-S741 WeakPolarHBondContact CG2-OG 3.41Å; L712-S741 WeakPolarHBondContact CD1-OG 3.3Å; V737-S741 WeakPolarHBondContact O-CB 3.34Å; V737-S741 PolarHBondContact O-N 2.85Å; V737-S741 PolarHBondContact O-OG 3.2Å; I738-S741 WeakPolarHBondContact O-CB 3.39Å; I738-S741 PolarHBondContact O-N 2.8Å; Q739-S741 VanDerWaalsContact C-N 3.33Å; Q739-S741 PolarHBondContact O-N 3.07Å; S741-V744 PolarHBondContact O-N 3.32Å; S741-A745 PolarHBondContact O-N 2.81Å; S741-A745 VanDerWaalsContact O-N 3.1Å
742	Y	92.5	Very high	89.7	Confident	136 Å²	136	53.7 Å²	53.7	53%	0.533	24%	0.244	S	C	.	.	H	α-helix	trans	-66.8	-36.9	174.3	-85.3	-67.6	0	0	0	112.8	L660 I738 Q739 A740 A745 K746	L660-Y742 HydrophobicContact CD2-CE2 4.16Å; I738-Y742 HydrophobicContact CG2-CD2 3.75Å; I738-Y742 HydrophobicContact CG2-CE2 3.58Å; I738-Y742 VanDerWaalsContact O-CD2 3.24Å; I738-Y742 WeakPolarHBondContact O-CD2 3.26Å; I738-Y742 PolarHBondContact O-N 3.07Å; Q739-Y742 WeakPolarHBondContact O-CB 3.31Å; Q739-Y742 PolarHBondContact O-N 3.29Å; A740-Y742 VanDerWaalsContact C-N 3.31Å; A740-Y742 PolarHBondContact O-N 2.89Å; Y742-A745 PolarHBondContact O-N 3.41Å; Y742-K746 WeakPolarHBondContact O-CB 3.44Å; Y742-K746 PolarHBondContact O-N 2.79Å
743	E	92.9	Very high	90	Very high	74 Å²	74	46.9 Å²	46.9	35%	0.346	22%	0.22	S	C	.	.	H	α-helix	trans	-66.3	-37.5	174.8	-69.8	-62	139	0	0	111.9	A708 Q739 A740 K746 A747	A708-E743 HydrophobicContact CB-CB 4.06Å; Q739-E743 PolarHBondContact O-N 3.01Å; Q739-E743 VanDerWaalsContact O-N 3.08Å; A740-E743 PolarHBondContact O-N 3.43Å; E743-K746 PolarHBondContact O-N 3.3Å; E743-K746 IonicContact OE1-NZ 3.08Å; E743-K746 PolarHBondContact OE1-NZ 2.86Å; E743-K746 WeakPolarHBondContact OE2-CD 3.29Å; E743-K746 WeakPolarHBondContact OE2-CE 3.24Å; E743-K746 IonicContact OE2-NZ 3.91Å; E743-K746 PolarHBondContact OE2-NZ 2.72Å; E743-A747 WeakPolarHBondContact O-CB 3.48Å; E743-A747 PolarHBondContact O-N 3.11Å
744	V	93	Very high	90.1	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-60.9	-47.9	171.2	178.6	0	0	0	0	111.2	L652 I656 V678 V682 A708 C709 L712 A740 S741 K746 A747 A748	L652-V744 HydrophobicContact CD1-CG1 4.09Å; L652-V744 HydrophobicContact CD2-CG1 4.21Å; I656-V744 HydrophobicContact CD1-CB 4.25Å; I656-V744 HydrophobicContact CD1-CG1 4.07Å; V678-V744 HydrophobicContact CG1-CG1 4.24Å; V682-V744 HydrophobicContact CG2-CG1 4.11Å; A708-V744 VanDerWaalsContact C-CG2 3.46Å; A708-V744 HydrophobicContact CB-CB 4.42Å; A708-V744 HydrophobicContact CB-CG2 3.7Å; A708-V744 WeakPolarHBondContact O-CG2 3.27Å; C709-V744 HydrophobicContact CB-CG2 4.41Å; L712-V744 HydrophobicContact CB-CG2 4.45Å; L712-V744 HydrophobicContact CD2-CG2 4.19Å; A740-V744 PolarHBondContact O-N 3.24Å; A740-V744 VanDerWaalsContact O-N 3.08Å; S741-V744 PolarHBondContact O-N 3.32Å; V744-K746 VanDerWaalsContact C-N 3.29Å; V744-K746 PolarHBondContact O-N 3.19Å; V744-A747 PolarHBondContact O-N 2.92Å; V744-A748 WeakPolarHBondContact O-CB 3.26Å; V744-A748 PolarHBondContact O-N 3.23Å
745	A	92.8	Very high	90.1	Very high	38 Å²	38	48.1 Å²	48.1	31%	0.314	23%	0.227	S	C	.	.	H	α-helix	trans	-61.2	-37.9	177	0	0	0	0	0	112.6	I656 S741 Y742 K749	I656-A745 HydrophobicContact CD1-CB 3.83Å; S741-A745 PolarHBondContact O-N 2.81Å; S741-A745 VanDerWaalsContact O-N 3.1Å; Y742-A745 PolarHBondContact O-N 3.41Å; A745-K749 WeakPolarHBondContact O-CB 3.12Å; A745-K749 PolarHBondContact O-N 3.04Å
746	K	92.6	Very high	89.7	Confident	107 Å²	107	49.1 Å²	49.1	47%	0.465	23%	0.234	S	C	.	.	H	α-helix	trans	-68.7	-43	178	174.6	-179.6	160.2	-147.8	0	111.6	Y742 E743 V744 K749 Q750	Y742-K746 WeakPolarHBondContact O-CB 3.44Å; Y742-K746 PolarHBondContact O-N 2.79Å; E743-K746 PolarHBondContact O-N 3.3Å; E743-K746 IonicContact OE1-NZ 3.08Å; E743-K746 PolarHBondContact OE1-NZ 2.86Å; E743-K746 WeakPolarHBondContact OE2-CD 3.29Å; E743-K746 WeakPolarHBondContact OE2-CE 3.24Å; E743-K746 IonicContact OE2-NZ 3.91Å; E743-K746 PolarHBondContact OE2-NZ 2.72Å; V744-K746 VanDerWaalsContact C-N 3.29Å; V744-K746 PolarHBondContact O-N 3.19Å; K746-K749 WeakPolarHBondContact O-CB 3.06Å; K746-K749 PolarHBondContact O-N 2.99Å; K746-Q750 WeakPolarHBondContact O-CG 3.22Å; K746-Q750 PolarHBondContact O-N 2.91Å
747	A	92.7	Very high	89.1	Confident	7 Å²	7	53.4 Å²	53.4	6%	0.058	25%	0.254	C	S	.	.	H	α-helix	trans	-64.2	-45.3	175	0	0	0	0	0	111.7	A704 M705 E743 V744 K749 Q750 L751	A704-A747 HydrophobicContact CB-CB 4.27Å; M705-A747 HydrophobicContact CB-CB 3.76Å; M705-A747 HydrophobicContact CG-CB 4.31Å; E743-A747 WeakPolarHBondContact O-CB 3.48Å; E743-A747 PolarHBondContact O-N 3.11Å; V744-A747 PolarHBondContact O-N 2.92Å; A747-K749 VanDerWaalsContact C-N 3.28Å; A747-K749 PolarHBondContact O-N 2.84Å; A747-Q750 PolarHBondContact O-N 3.38Å; A747-Q750 VanDerWaalsContact O-N 3.1Å; A747-L751 PolarHBondContact O-N 3.07Å
748	A	92.3	Very high	89.1	Confident	2 Å²	2	56.1 Å²	56.1	2%	0.017	27%	0.267	C	S	.	.	H	α-helix	trans	-59.6	-37.2	173	0	0	0	0	0	112.7	L652 M685 M705 V744 L751 M752	L652-A748 HydrophobicContact CD2-CB 3.5Å; L652-A748 VanDerWaalsContact CD2-CB 3.5Å; M685-A748 HydrophobicContact CE-CB 4.06Å; M705-A748 HydrophobicContact SD-CB 3.96Å; V744-A748 WeakPolarHBondContact O-CB 3.26Å; V744-A748 PolarHBondContact O-N 3.23Å; A748-L751 PolarHBondContact O-N 3.42Å; A748-M752 WeakPolarHBondContact O-CG 3.44Å; A748-M752 PolarHBondContact O-N 3.32Å
749	K	90.7	Very high	89.1	Confident	110 Å²	110	56.8 Å²	56.8	48%	0.478	27%	0.269	S	S	.	.	H	α-helix	trans	-65.2	-42.7	172.8	-169.2	-168.7	178	-156.7	0	112	Y442 A745 K746 A747 L751 M752 I753	Y442-K749 WeakPolarHBondContact OH-CE 3.36Å; Y442-K749 PolarHBondContact OH-NZ 2.9Å; A745-K749 WeakPolarHBondContact O-CB 3.12Å; A745-K749 PolarHBondContact O-N 3.04Å; K746-K749 WeakPolarHBondContact O-CB 3.06Å; K746-K749 PolarHBondContact O-N 2.99Å; A747-K749 VanDerWaalsContact C-N 3.28Å; A747-K749 PolarHBondContact O-N 2.84Å; K749-L751 VanDerWaalsContact C-N 3.34Å; K749-M752 PolarHBondContact O-N 3.46Å; K749-I753 HydrophobicContact CG-CD1 4.27Å; K749-I753 WeakPolarHBondContact O-CD1 3.42Å; K749-I753 VanDerWaalsContact O-CG1 3.28Å; K749-I753 WeakPolarHBondContact O-CG1 3.41Å; K749-I753 PolarHBondContact O-N 3.33Å; K749-I753 VanDerWaalsContact O-N 3.11Å
750	Q	90.9	Very high	89.1	Confident	92 Å²	92	54.2 Å²	54.2	43%	0.43	26%	0.257	S	S	.	.	H	α-helix	trans	-64.4	-38.9	175.5	-67.2	-61.1	-13.5	0	0	111.8	K746 A747 M752 I753 A754	K746-Q750 WeakPolarHBondContact O-CG 3.22Å; K746-Q750 PolarHBondContact O-N 2.91Å; A747-Q750 PolarHBondContact O-N 3.38Å; A747-Q750 VanDerWaalsContact O-N 3.1Å; Q750-M752 PolarHBondContact O-N 3Å; Q750-I753 PolarHBondContact O-N 2.92Å; Q750-I753 VanDerWaalsContact O-N 3.16Å; Q750-A754 WeakPolarHBondContact O-CB 3.31Å; Q750-A754 PolarHBondContact O-N 3.31Å
751	L	91.1	Very high	89	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-58.8	-46.7	173.6	-177.8	64	0	0	0	111.8	L645 M685 V689 V698 L702 M705 A747 A748 K749 I753 A754 I755	L645-L751 HydrophobicContact CD1-CD2 4.27Å; M685-L751 HydrophobicContact CE-CD2 4.18Å; V689-L751 HydrophobicContact CG2-CD1 4.48Å; V698-L751 HydrophobicContact CG1-CD1 3.86Å; L702-L751 HydrophobicContact CD2-CD1 3.7Å; L702-L751 HydrophobicContact CD2-CD2 3.68Å; L702-L751 HydrophobicContact CD2-CG 4.35Å; L702-L751 HydrophobicContact CG-CD1 3.8Å; M705-L751 HydrophobicContact CE-CD2 3.78Å; M705-L751 HydrophobicContact SD-CD2 4.19Å; A747-L751 PolarHBondContact O-N 3.07Å; A748-L751 PolarHBondContact O-N 3.42Å; K749-L751 VanDerWaalsContact C-N 3.34Å; L751-I753 VanDerWaalsContact C-N 3.27Å; L751-I753 PolarHBondContact O-N 2.81Å; L751-A754 PolarHBondContact O-N 2.85Å; L751-I755 HydrophobicContact CD1-CD1 3.6Å; L751-I755 HydrophobicContact CD1-CG1 4.38Å; L751-I755 HydrophobicContact CG-CD1 3.77Å; L751-I755 WeakPolarHBondContact O-CD1 3.48Å; L751-I755 WeakPolarHBondContact O-CG1 3.5Å; L751-I755 PolarHBondContact O-N 3.08Å; L751-I755 VanDerWaalsContact O-N 3.1Å
752	M	89.2	Confident	88.8	Confident	34 Å²	34	60.8 Å²	60.8	17%	0.167	29%	0.288	C	S	.	.	H	α-helix	trans	-62.9	-30.7	176.5	-75	-59.8	-54.5	0	0	113.3	L645 V646 T649 A748 K749 Q750 Q756	L645-M752 HydrophobicContact CD2-SD 3.71Å; L645-M752 HydrophobicContact CG-SD 3.78Å; V646-M752 HydrophobicContact CG2-CE 3.74Å; T649-M752 HydrophobicContact CG2-CG 4.3Å; A748-M752 WeakPolarHBondContact O-CG 3.44Å; A748-M752 PolarHBondContact O-N 3.32Å; K749-M752 PolarHBondContact O-N 3.46Å; Q750-M752 PolarHBondContact O-N 3Å; M752-Q756 VanDerWaalsContact O-CG 3.26Å; M752-Q756 WeakPolarHBondContact O-CG 3.45Å
753	I	87.9	Confident	88.6	Confident	19 Å²	19	55.8 Å²	55.8	10%	0.097	27%	0.272	C	S	.	.	H	α-helix	trans	-74.7	-48.9	174.4	-64.8	159.5	0	0	0	110	P440 Y442 K749 Q750 L751 I755 Q756 Q757	P440-I753 HydrophobicContact CB-CG2 4.08Å; P440-I753 HydrophobicContact CG-CG2 3.57Å; Y442-I753 HydrophobicContact CE2-CD1 4.38Å; Y442-I753 WeakPolarHBondContact OH-CD1 3.09Å; K749-I753 HydrophobicContact CG-CD1 4.27Å; K749-I753 WeakPolarHBondContact O-CD1 3.42Å; K749-I753 VanDerWaalsContact O-CG1 3.28Å; K749-I753 WeakPolarHBondContact O-CG1 3.41Å; K749-I753 PolarHBondContact O-N 3.33Å; K749-I753 VanDerWaalsContact O-N 3.11Å; Q750-I753 PolarHBondContact O-N 2.92Å; Q750-I753 VanDerWaalsContact O-N 3.16Å; L751-I753 VanDerWaalsContact C-N 3.27Å; L751-I753 PolarHBondContact O-N 2.81Å; I753-I755 PolarHBondContact O-N 3.31Å; I753-I755 VanDerWaalsContact O-N 3.14Å; I753-Q756 PolarHBondContact O-N 3.48Å; I753-Q757 PolarHBondContact O-N 3.14Å
754	A	87	Confident	88.3	Confident	9 Å²	9	54.5 Å²	54.5	7%	0.074	27%	0.266	C	S	.	.	H	α-helix	trans	-65.9	-14.7	-177.3	0	0	0	0	0	114.4	A697 V698 Q750 L751	A697-A754 HydrophobicContact CB-CB 3.89Å; V698-A754 HydrophobicContact CG2-CB 3.96Å; V698-A754 VanDerWaalsContact CG2-O 3.22Å; V698-A754 WeakPolarHBondContact CG2-O 3.29Å; Q750-A754 WeakPolarHBondContact O-CB 3.31Å; Q750-A754 PolarHBondContact O-N 3.31Å; L751-A754 PolarHBondContact O-N 2.85Å
755	I	83.9	Confident	87.9	Confident	38 Å²	38	58.7 Å²	58.7	20%	0.195	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97	-14.5	173.5	-69.7	163.6	0	0	0	112	F641 L645 V689 V698 L751 I753	F641-I755 HydrophobicContact CE1-CG2 3.88Å; F641-I755 HydrophobicContact CZ-CD1 3.99Å; F641-I755 HydrophobicContact CZ-CG2 4.04Å; L645-I755 HydrophobicContact CD2-CD1 3.39Å; V689-I755 HydrophobicContact CG2-CD1 4.02Å; V698-I755 HydrophobicContact CG1-CD1 4.36Å; V698-I755 HydrophobicContact CG1-CG1 4.19Å; V698-I755 HydrophobicContact CG2-CG1 3.96Å; L751-I755 HydrophobicContact CD1-CD1 3.6Å; L751-I755 HydrophobicContact CD1-CG1 4.38Å; L751-I755 HydrophobicContact CG-CD1 3.77Å; L751-I755 WeakPolarHBondContact O-CD1 3.48Å; L751-I755 WeakPolarHBondContact O-CG1 3.5Å; L751-I755 PolarHBondContact O-N 3.08Å; L751-I755 VanDerWaalsContact O-N 3.1Å; I753-I755 PolarHBondContact O-N 3.31Å; I753-I755 VanDerWaalsContact O-N 3.14Å
756	Q	77.7	Confident	87.5	Confident	153 Å²	153	60.4 Å²	60.4	72%	0.715	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-14.3	172	-74.5	174.8	2.8	0	0	112.9	M752 I753	M752-Q756 VanDerWaalsContact O-CG 3.26Å; M752-Q756 WeakPolarHBondContact O-CG 3.45Å; I753-Q756 PolarHBondContact O-N 3.48Å
757	Q	73.9	Confident	87	Confident	154 Å²	154	56.2 Å²	56.2	72%	0.72	27%	0.268	S	S	*	.			trans	-90.6	0	170	-63.1	-177.1	-65.3	0	0	110.5	P440 I753	P440-Q757 HydrophobicContact CB-CG 4.47Å; I753-Q757 PolarHBondContact O-N 3.14Å

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