A0A3Q0KTW0_SCHMA Loading...

Putative abc transporter

AlphaFold DB , UniProt , Accession A0A3Q0KTW0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 703 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.1	Very low	29.1	Very low	236 Å²	236	147.9 Å²	147.9	100%	1.163	83%	0.83	S	S	*	*				0	120.1	0	-101	174.1	-156	0	0	108.1
2	H	32.5	Very low	28.8	Very low	172 Å²	172	146.7 Å²	146.7	80%	0.796	83%	0.829	S	S	*	*			trans	58.5	91	172.2	-69.2	-76.2	0	0	0	118
3	L	27.8	Very low	28.5	Very low	149 Å²	149	143.3 Å²	143.3	78%	0.78	81%	0.814	S	S	*	*				60	105.4	79.2	-83.9	152.1	0	0	0	114.8	V5	L3-V5 HydrophobicContact CD2-CG2 4.07Å
4	S	30.8	Very low	28.3	Very low	118 Å²	118	141.1 Å²	141.1	83%	0.825	81%	0.811	S	S	*	*				-146.3	123.1	122.9	67.3	0	0	0	0	110.2
5	V	29.3	Very low	28.1	Very low	108 Å²	108	146.7 Å²	146.7	66%	0.655	81%	0.814	S	S	*	*			trans	-93.8	127.5	175.2	167.6	0	0	0	0	106.5	L3	L3-V5 HydrophobicContact CD2-CG2 4.07Å
6	C	29.2	Very low	28	Very low	127 Å²	127	141.1 Å²	141.1	86%	0.858	80%	0.801	S	S	*	*			trans	-118.5	105.6	160.7	-83	0	0	0	0	108.6	G8	C6-G8 PolarHBondContact O-N 3.33Å
7	N	26.4	Very low	27.9	Very low	163 Å²	163	143.5 Å²	143.5	87%	0.872	80%	0.803	S	S	*	*			trans	-56.1	121.3	161.5	-86.9	-18.2	0	0	0	109.6
8	G	30.5	Very low	27.8	Very low	70 Å²	70	144.2 Å²	144.2	72%	0.722	81%	0.805	S	S	*	*			trans	-136.7	97	170.7	0	0	0	0	0	108.5	C6	C6-G8 PolarHBondContact O-N 3.33Å
9	S	29.8	Very low	27.7	Very low	110 Å²	110	144.1 Å²	144.1	77%	0.769	80%	0.803	S	S	*	*			trans	-14	121.6	172.6	42.9	0	0	0	0	117.5	K11	S9-K11 PolarHBondContact O-N 3.34Å; S9-K11 VanDerWaalsContact O-N 3.13Å
10	E	24.9	Very low	27.5	Very low	192 Å²	192	141 Å²	141	90%	0.897	80%	0.804	S	S	*	*			trans	-51.1	112.2	158.2	-73.1	172.4	141.4	0	0	110.2
11	K	26.7	Very low	27.5	Very low	182 Å²	182	144.2 Å²	144.2	79%	0.791	81%	0.81	S	S	*	*			trans	-111.6	96.7	153.3	-81.4	-171.9	177.4	-178.5	0	107.4	S9 T13	S9-K11 PolarHBondContact O-N 3.34Å; S9-K11 VanDerWaalsContact O-N 3.13Å; K11-T13 VanDerWaalsContact C-N 3.35Å; K11-T13 PolarHBondContact O-N 3.35Å
12	T	25.4	Very low	27.1	Very low	133 Å²	133	140.7 Å²	140.7	82%	0.816	79%	0.79	S	S	*	*			trans	-56.3	96.8	157.7	47.8	0	0	0	0	108.4	S14	T12-S14 PolarHBondContact O-N 2.83Å
13	T	25.5	Very low	26.7	Very low	103 Å²	103	138.5 Å²	138.5	63%	0.632	79%	0.792	S	S	*	*			trans	-83.3	97.3	167.2	37.3	0	0	0	0	108.5	K11 W15	K11-T13 VanDerWaalsContact C-N 3.35Å; K11-T13 PolarHBondContact O-N 3.35Å; T13-W15 PolarHBondContact O-N 3.31Å; T13-W15 VanDerWaalsContact O-N 3.13Å
14	S	24.7	Very low	26.9	Very low	112 Å²	112	136.9 Å²	136.9	78%	0.783	79%	0.788	S	S	*	*			trans	-52	110.4	154.9	53.5	0	0	0	0	108.2	T12 G16	T12-S14 PolarHBondContact O-N 2.83Å; S14-G16 PolarHBondContact O-N 3.46Å
15	W	26.5	Very low	27.1	Very low	225 Å²	225	135 Å²	135	85%	0.852	77%	0.771	S	S	*	*			trans	-75.2	79.4	168.3	-74.5	83.9	0	0	0	107.9	T13	T13-W15 PolarHBondContact O-N 3.31Å; T13-W15 VanDerWaalsContact O-N 3.13Å
16	G	26.2	Very low	27.3	Very low	58 Å²	58	137.1 Å²	137.1	60%	0.598	78%	0.779	S	S	*	*			trans	-61.2	136.9	165.9	0	0	0	0	0	109.9	S14	S14-G16 PolarHBondContact O-N 3.46Å
17	E	26.8	Very low	28.1	Very low	181 Å²	181	133.1 Å²	133.1	85%	0.846	75%	0.748	S	S	*	*	S	Bend	trans	-40.8	140.8	158	-64.6	164.8	143.6	0	0	110.2
18	N	24.8	Very low	28.9	Very low	157 Å²	157	131.8 Å²	131.8	84%	0.84	74%	0.737	S	S	*	*			trans	106.9	62.7	180	-56.8	-33.5	0	0	0	116.2
19	N	26.4	Very low	29.9	Very low	142 Å²	142	129.3 Å²	129.3	76%	0.759	71%	0.708	S	S	*	*			trans	-126.3	111.7	143.9	-86.3	-38.4	0	0	0	108.6	F21	N19-F21 PolarHBondContact O-N 2.99Å; N19-F21 VanDerWaalsContact O-N 3.09Å
20	G	23.4	Very low	30.7	Very low	81 Å²	81	131.2 Å²	131.2	84%	0.835	71%	0.71	S	S	*	*			trans	-53.5	111.6	-178.4	0	0	0	0	0	112	Q22	G20-Q22 PolarHBondContact O-N 3.34Å; G20-Q22 VanDerWaalsContact O-N 3.09Å
21	F	27.4	Very low	32.3	Very low	210 Å²	210	127.9 Å²	127.9	92%	0.921	69%	0.694	S	S	*	*			trans	-72.9	93.3	168.9	-126.7	-95.4	0	0	0	107.8	N19	N19-F21 PolarHBondContact O-N 2.99Å; N19-F21 VanDerWaalsContact O-N 3.09Å
22	Q	23.7	Very low	34.2	Very low	161 Å²	161	125.8 Å²	125.8	75%	0.752	69%	0.69	S	S	*	*			trans	-64.5	131	158.4	-78.6	-171.7	-14.6	0	0	107.4	G20 V24	G20-Q22 PolarHBondContact O-N 3.34Å; G20-Q22 VanDerWaalsContact O-N 3.09Å; Q22-V24 VanDerWaalsContact C-N 3.32Å; Q22-V24 PolarHBondContact O-N 3.04Å
23	P	24.6	Very low	36.8	Very low	126 Å²	126	120.1 Å²	120.1	82%	0.818	66%	0.655	S	S	*	*			trans	-69.9	94.6	177.5	28.5	-30.9	0	0	0	107.8	V25	P23-V25 PolarHBondContact O-N 2.97Å
24	V	31.1	Very low	39.9	Very low	115 Å²	115	117 Å²	117	70%	0.697	64%	0.635	S	S	*	*			trans	-72.5	97.8	179.7	177.4	0	0	0	0	108.5	Q22	Q22-V24 VanDerWaalsContact C-N 3.32Å; Q22-V24 PolarHBondContact O-N 3.04Å
25	V	35.6	Very low	43.2	Very low	80 Å²	80	111.7 Å²	111.7	49%	0.485	60%	0.598	S	S	.	*	S	Bend	trans	80	121.6	159.1	-173.5	0	0	0	0	116.1	P23 M27	P23-V25 PolarHBondContact O-N 2.97Å; V25-M27 PolarHBondContact O-N 3.48Å
26	N	33.1	Very low	46.4	Very low	152 Å²	152	105 Å²	105	81%	0.813	57%	0.574	S	S	*	*			trans	-48.6	76.8	168.4	-74.3	-2.7	0	0	0	112.6
27	M	45.9	Very low	49.6	Very low	42 Å²	42	102.2 Å²	102.2	21%	0.207	55%	0.546	C	S	.	.			trans	-106.3	22.1	161.7	-90.8	-159.5	-170.2	0	0	109.9	V25 S29 I156 R223	V25-M27 PolarHBondContact O-N 3.48Å; M27-S29 PolarHBondContact O-N 2.84Å; M27-I156 HydrophobicContact CE-CD1 4.28Å; M27-I156 HydrophobicContact CE-CG1 3.81Å; M27-R223 PolarHBondContact O-NH2 2.82Å
28	E	44.9	Very low	52.8	Low	136 Å²	136	97.8 Å²	97.8	64%	0.636	53%	0.525	S	S	*	.			trans	-64.5	121.7	159.4	-68.6	-176.5	174.1	0	0	107	N30	E28-N30 PolarHBondContact O-N 3.4Å; E28-N30 VanDerWaalsContact O-N 3.08Å
29	S	49.5	Very low	56	Low	17 Å²	17	93.6 Å²	93.6	12%	0.119	50%	0.503	C	S	.	.			trans	-68.3	107.3	166.3	118.9	0	0	0	0	105.7	M27 Q31 G222	M27-S29 PolarHBondContact O-N 2.84Å; S29-Q31 PolarHBondContact O-N 2.95Å; S29-Q31 PolarHBondContact OG-O 3.04Å; S29-G222 WeakPolarHBondContact CB-O 3.17Å; S29-G222 PolarHBondContact OG-O 2.88Å
30	N	47.9	Very low	59.1	Low	151 Å²	151	86.8 Å²	86.8	81%	0.807	47%	0.467	S	S	*	.	S	Bend	trans	-65.7	5.8	179.5	-81.6	-2.4	0	0	0	113.1	E28	E28-N30 PolarHBondContact O-N 3.4Å; E28-N30 VanDerWaalsContact O-N 3.08Å
31	Q	59	Low	62.5	Low	121 Å²	121	86 Å²	86	57%	0.565	44%	0.44	S	S	*	.	S	Bend	trans	-129.1	97.1	-178.4	-67.9	-175.4	-12.2	0	0	109.4	S29 T33	S29-Q31 PolarHBondContact O-N 2.95Å; S29-Q31 PolarHBondContact OG-O 3.04Å; Q31-T33 HydrophobicContact CB-CG2 4.01Å; Q31-T33 PolarHBondContact O-N 3.16Å; Q31-T33 PolarHBondContact O-OG1 2.96Å
32	I	66.8	Low	65.7	Low	138 Å²	138	77.7 Å²	77.7	71%	0.708	40%	0.403	S	S	*	.			trans	-57.9	104.5	166	-58	174.7	0	0	0	106.8
33	T	79.8	Confident	68.9	Low	14 Å²	14	70.9 Å²	70.9	9%	0.086	37%	0.371	C	S	.	.			trans	-122.9	90.8	-174.5	41.8	0	0	0	0	109.8	Q31 I99 P192 T224	Q31-T33 HydrophobicContact CB-CG2 4.01Å; Q31-T33 PolarHBondContact O-N 3.16Å; Q31-T33 PolarHBondContact O-OG1 2.96Å; T33-I99 HydrophobicContact CG2-CG2 4.25Å; T33-P192 WeakPolarHBondContact OG1-CB 3.44Å; T33-T224 PolarHBondContact O-OG1 3.33Å
34	N	90.3	Very high	72	Confident	39 Å²	39	67.3 Å²	67.3	21%	0.209	35%	0.346	C	S	.	.			trans	-73	144.2	171	-63.4	-0.8	0	0	0	109.6	E61 F62 S64 I99 G100	N34-E61 HydrophobicContact CB-CG 4.5Å; N34-E61 PolarHBondContact ND2-OE1 3.1Å; N34-F62 CarbonylContact C-O 3.58Å; N34-F62 WeakPolarHBondContact CA-O 3.36Å; N34-S64 PolarHBondContact OD1-N 3.29Å; N34-S64 VanDerWaalsContact OD1-N 3.09Å; N34-I99 CarbonylContact O-C 3.58Å; N34-I99 WeakPolarHBondContact O-CA 3.43Å; N34-G100 PolarHBondContact O-N 3.24Å
35	L	92.9	Very high	74.6	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	114.2	176	-175.9	71.6	0	0	0	108.8	E61 F62 L85 V97 I99 F109 F195 I226	L35-E61 CarbonylContact O-C 3.51Å; L35-E61 WeakPolarHBondContact O-CA 3.44Å; L35-F62 PolarHBondContact N-O 3.12Å; L35-F62 PolarHBondContact O-N 3.46Å; L35-L85 HydrophobicContact CD2-CB 4.15Å; L35-L85 HydrophobicContact CD2-CD2 4.22Å; L35-V97 HydrophobicContact CD1-CG1 3.74Å; L35-V97 HydrophobicContact CG-CG1 4.49Å; L35-I99 HydrophobicContact CD1-CG1 4.05Å; L35-F109 HydrophobicContact CD1-CE2 4.15Å; L35-F109 HydrophobicContact CD1-CZ 4.36Å; L35-F195 HydrophobicContact CD2-CE1 3.9Å; L35-F195 HydrophobicContact CD2-CZ 3.59Å; L35-I226 HydrophobicContact CD2-CD1 3.85Å
36	K	94.2	Very high	76.9	Confident	83 Å²	83	67.6 Å²	67.6	36%	0.361	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	145.8	-179.7	-173.8	-171.9	-167.6	-161.3	0	110.1	E38 G60 E61 V97 T98	K36-E38 WeakPolarHBondContact CE-OE1 3.42Å; K36-E38 IonicContact NZ-OE1 2.91Å; K36-E38 PolarHBondContact NZ-OE1 3.27Å; K36-G60 WeakPolarHBondContact CA-O 3.2Å; K36-E61 HydrophobicContact CB-CB 4.44Å; K36-E61 HydrophobicContact CB-CG 4.27Å; K36-E61 HydrophobicContact CG-CB 4.32Å; K36-V97 CarbonylContact O-C 3.57Å; K36-V97 WeakPolarHBondContact O-CA 3.23Å; K36-T98 WeakPolarHBondContact CB-OG1 3.05Å; K36-T98 PolarHBondContact N-O 3Å; K36-T98 PolarHBondContact O-N 2.92Å
37	F	94.5	Very high	78.9	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	141.3	176	58.1	-83.1	0	0	0	110.7	L40 I58 S59 G60 F62 L81 L85 D96 V97 Y244	F37-L40 HydrophobicContact CD2-CB 4.25Å; F37-L40 HydrophobicContact CD2-CD2 4.41Å; F37-I58 HydrophobicContact CE2-CD1 4.29Å; F37-I58 HydrophobicContact CE2-CG1 4.16Å; F37-S59 VanDerWaalsContact CE2-C 3.44Å; F37-S59 CarbonylContact O-C 3.58Å; F37-S59 WeakPolarHBondContact O-CA 3.32Å; F37-S59 WeakPolarHBondContact O-CB 3.28Å; F37-G60 WeakPolarHBondContact CD1-O 3.37Å; F37-G60 PolarHBondContact N-O 3.45Å; F37-G60 PolarHBondContact O-N 3.27Å; F37-F62 HydrophobicContact CD1-CE2 4.43Å; F37-F62 HydrophobicContact CE1-CD2 4.07Å; F37-F62 AromaticContact CE1-CE2 3.55Å; F37-F62 HydrophobicContact CE1-CE2 3.55Å; F37-F62 HydrophobicContact CE1-CZ 4.3Å; F37-F62 HydrophobicContact CZ-CE2 4.31Å; F37-L81 HydrophobicContact CE2-CD1 4.2Å; F37-L81 HydrophobicContact CZ-CD1 4.36Å; F37-L81 HydrophobicContact CZ-CD2 4.44Å; F37-L85 HydrophobicContact CB-CD2 4.01Å; F37-L85 HydrophobicContact CD1-CD1 4.41Å; F37-L85 HydrophobicContact CD1-CD2 3.64Å; F37-L85 HydrophobicContact CE1-CD1 4.28Å; F37-L85 HydrophobicContact CE1-CD2 4.3Å; F37-L85 HydrophobicContact CG-CD2 3.9Å; F37-D96 CarbonylContact C-O 3.58Å; F37-D96 VanDerWaalsContact CA-O 3.25Å; F37-D96 WeakPolarHBondContact CA-O 3.36Å; F37-V97 HydrophobicContact CB-CG2 4.16Å; F37-Y244 HydrophobicContact CE2-CE2 4.36Å; F37-Y244 AromaticContact CE2-CZ 3.94Å; F37-Y244 WeakPolarHBondContact CE2-OH 3.48Å; F37-Y244 HydrophobicContact CZ-CD2 4.42Å; F37-Y244 HydrophobicContact CZ-CE1 4.26Å; F37-Y244 AromaticContact CZ-CE2 3.7Å; F37-Y244 HydrophobicContact CZ-CE2 3.7Å; F37-Y244 AromaticContact CZ-CZ 3.6Å
38	E	92.5	Very high	80.4	Confident	88 Å²	88	74.2 Å²	74.2	41%	0.411	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	131.3	-171.8	-64.5	-175	-178.6	0	0	112	K36 L40 G95 D96	K36-E38 WeakPolarHBondContact CE-OE1 3.42Å; K36-E38 IonicContact NZ-OE1 2.91Å; K36-E38 PolarHBondContact NZ-OE1 3.27Å; E38-L40 PolarHBondContact O-N 2.98Å; E38-L40 VanDerWaalsContact O-N 3.15Å; E38-G95 WeakPolarHBondContact O-CA 3.49Å; E38-D96 PolarHBondContact N-O 2.94Å; E38-D96 PolarHBondContact O-N 3.41Å; E38-D96 VanDerWaalsContact O-N 3.14Å
39	D	91.6	Very high	81.7	Confident	69 Å²	69	71.6 Å²	71.6	37%	0.369	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	46.4	40.9	-179.2	-165.5	34.9	0	0	0	113.8	K41 G57 S59	D39-K41 VanDerWaalsContact CG-NZ 3.34Å; D39-K41 PolarHBondContact O-N 2.8Å; D39-K41 VanDerWaalsContact OD1-CE 3.32Å; D39-K41 WeakPolarHBondContact OD1-CE 3.18Å; D39-K41 IonicContact OD1-NZ 3.14Å; D39-K41 PolarHBondContact OD1-NZ 3.42Å; D39-K41 VanDerWaalsContact OD1-NZ 3.14Å; D39-K41 IonicContact OD2-NZ 2.74Å; D39-K41 PolarHBondContact OD2-NZ 2.86Å; D39-G57 WeakPolarHBondContact OD1-CA 3.47Å; D39-S59 PolarHBondContact N-OG 3.34Å
40	L	93	Very high	83.4	Confident	0 Å²	0	72.4 Å²	72.4	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	117	-175.8	-163.9	77.2	0	0	0	110.5	F37 E38 L55 G57 I58 L81 I84 V93 I94 V97	F37-L40 HydrophobicContact CD2-CB 4.25Å; F37-L40 HydrophobicContact CD2-CD2 4.41Å; E38-L40 PolarHBondContact O-N 2.98Å; E38-L40 VanDerWaalsContact O-N 3.15Å; L40-L55 HydrophobicContact CD2-CD1 4.18Å; L40-G57 VanDerWaalsContact O-CA 3.28Å; L40-G57 WeakPolarHBondContact O-CA 3.48Å; L40-G57 PolarHBondContact O-N 3.07Å; L40-I58 HydrophobicContact CB-CG1 4.04Å; L40-I58 WeakPolarHBondContact CB-O 3.48Å; L40-I58 PolarHBondContact N-O 3.38Å; L40-I58 PolarHBondContact O-N 3.27Å; L40-L81 HydrophobicContact CD2-CD1 3.68Å; L40-I84 HydrophobicContact CD1-CG2 3.97Å; L40-I84 HydrophobicContact CD2-CB 4.42Å; L40-I84 HydrophobicContact CD2-CD1 4.45Å; L40-I84 HydrophobicContact CD2-CG2 3.86Å; L40-I84 HydrophobicContact CG-CG2 4.38Å; L40-V93 HydrophobicContact CD1-CG1 3.62Å; L40-V93 HydrophobicContact CG-CG1 4.42Å; L40-I94 CarbonylContact C-O 3.56Å; L40-I94 WeakPolarHBondContact CA-O 3.42Å; L40-V97 HydrophobicContact CD1-CG2 4.21Å
41	K	94.1	Very high	85.3	Confident	64 Å²	64	71.8 Å²	71.8	28%	0.278	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	141.5	174.2	-67.3	160.8	-178.5	143.6	0	109.3	D39 F53 L55 G57 V93 I94	D39-K41 VanDerWaalsContact CG-NZ 3.34Å; D39-K41 PolarHBondContact O-N 2.8Å; D39-K41 VanDerWaalsContact OD1-CE 3.32Å; D39-K41 WeakPolarHBondContact OD1-CE 3.18Å; D39-K41 IonicContact OD1-NZ 3.14Å; D39-K41 PolarHBondContact OD1-NZ 3.42Å; D39-K41 VanDerWaalsContact OD1-NZ 3.14Å; D39-K41 IonicContact OD2-NZ 2.74Å; D39-K41 PolarHBondContact OD2-NZ 2.86Å; K41-F53 HydrophobicContact CB-CD1 4.41Å; K41-F53 HydrophobicContact CB-CE1 4.34Å; K41-L55 WeakPolarHBondContact CA-O 3.32Å; K41-G57 VanDerWaalsContact CG-N 3.27Å; K41-V93 WeakPolarHBondContact O-CA 3.44Å; K41-I94 HydrophobicContact CB-CB 4.19Å; K41-I94 PolarHBondContact N-O 3.5Å; K41-I94 PolarHBondContact O-N 2.89Å
42	Y	93.7	Very high	86.8	Confident	36 Å²	36	71.7 Å²	71.7	14%	0.141	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	131.9	177.4	176.9	-123.9	0	0	0	109.6	V44 F53 I54 L55 I84 C89 Q91 N92 V93	Y42-V44 HydrophobicContact CE1-CG2 3.99Å; Y42-F53 CarbonylContact O-C 3.52Å; Y42-F53 WeakPolarHBondContact O-CA 3.39Å; Y42-I54 HydrophobicContact CD1-CB 3.88Å; Y42-I54 HydrophobicContact CD1-CD1 4.14Å; Y42-I54 HydrophobicContact CD1-CG1 4.41Å; Y42-I54 HydrophobicContact CD1-CG2 4.29Å; Y42-I54 HydrophobicContact CE1-CB 4.47Å; Y42-I54 HydrophobicContact CE1-CD1 3.84Å; Y42-I54 PolarHBondContact O-N 3.03Å; Y42-L55 PolarHBondContact N-O 3.27Å; Y42-L55 VanDerWaalsContact N-O 3.08Å; Y42-L55 PolarHBondContact O-N 3.11Å; Y42-I84 HydrophobicContact CD1-CD1 4.13Å; Y42-I84 HydrophobicContact CD2-CD1 4.06Å; Y42-I84 HydrophobicContact CG-CD1 3.68Å; Y42-C89 VanDerWaalsContact CE2-SG 3.55Å; Y42-Q91 WeakPolarHBondContact CE2-O 3.39Å; Y42-N92 WeakPolarHBondContact CD2-O 3.27Å; Y42-N92 HydrophobicContact CE2-CB 4.33Å; Y42-V93 HydrophobicContact CD2-CG2 3.86Å; Y42-V93 HydrophobicContact CE2-CG2 4.4Å
43	F	92.3	Very high	88	Confident	18 Å²	18	69.4 Å²	69.4	8%	0.079	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	148.8	178.4	64.4	-88.5	0	0	0	112.3	I45 K51 K52 F53 N92 I94	F43-I45 HydrophobicContact CD2-CG1 4.44Å; F43-I45 HydrophobicContact CE2-CG1 4.28Å; F43-K51 HydrophobicContact CB-CB 4.45Å; F43-K51 HydrophobicContact CD2-CB 4.03Å; F43-K51 HydrophobicContact CD2-CD 3.77Å; F43-K51 HydrophobicContact CD2-CG 3.84Å; F43-K51 HydrophobicContact CE2-CD 3.73Å; F43-K51 HydrophobicContact CE2-CG 4.13Å; F43-K51 HydrophobicContact CG-CB 4.45Å; F43-K51 HydrophobicContact CG-CD 4.4Å; F43-K51 HydrophobicContact CZ-CD 4.33Å; F43-K52 CarbonylContact C-O 3.01Å; F43-K52 VanDerWaalsContact CA-O 3.23Å; F43-K52 WeakPolarHBondContact CA-O 3.46Å; F43-F53 HydrophobicContact CB-CD1 3.88Å; F43-F53 HydrophobicContact CB-CE1 4.03Å; F43-F53 HydrophobicContact CB-CG 4.15Å; F43-F53 HydrophobicContact CB-CZ 4.43Å; F43-F53 AromaticContact CD1-CE1 3.96Å; F43-F53 HydrophobicContact CD1-CE1 3.96Å; F43-F53 HydrophobicContact CD1-CZ 4.38Å; F43-F53 HydrophobicContact CG-CE1 4.35Å; F43-N92 HydrophobicContact CD1-CB 4.15Å; F43-N92 WeakPolarHBondContact CD1-O 3.46Å; F43-N92 HydrophobicContact CD2-CB 3.92Å; F43-N92 HydrophobicContact CE1-CB 3.88Å; F43-N92 WeakPolarHBondContact CE1-O 3.48Å; F43-N92 HydrophobicContact CE2-CB 3.63Å; F43-N92 HydrophobicContact CG-CB 4.16Å; F43-N92 HydrophobicContact CZ-CB 3.61Å; F43-N92 PolarHBondContact N-O 3.27Å; F43-N92 WeakPolarHBondContact O-CB 3.5Å; F43-I94 HydrophobicContact CD1-CD1 4.48Å; F43-I94 HydrophobicContact CE1-CD1 4.04Å; F43-I94 HydrophobicContact CE1-CG1 4.38Å
44	V	89.6	Confident	88.6	Confident	50 Å²	50	71 Å²	71	30%	0.303	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	137.2	172.3	177.3	0	0	0	0	108.6	Y42 K52 I54	Y42-V44 HydrophobicContact CE1-CG2 3.99Å; V44-K52 PolarHBondContact N-O 2.64Å; V44-K52 PolarHBondContact O-N 2.88Å; V44-I54 HydrophobicContact CB-CD1 4.36Å; V44-I54 HydrophobicContact CG2-CD1 3.44Å; V44-I54 VanDerWaalsContact CG2-CD1 3.44Å; V44-I54 HydrophobicContact CG2-CG1 4.3Å
45	I	85.7	Confident	88.8	Confident	104 Å²	104	69.1 Å²	69.1	53%	0.533	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	116.7	177.1	-57.9	171.5	0	0	0	107.9	F43	F43-I45 HydrophobicContact CD2-CG1 4.44Å; F43-I45 HydrophobicContact CE2-CG1 4.28Å
46	Q	82.6	Confident	88.8	Confident	98 Å²	98	73.4 Å²	73.4	46%	0.458	37%	0.371	S	S	.	.			trans	-102.9	59.4	179.8	-68.5	-168.6	-22.6	0	0	111	R48 A49 G50 K52	Q46-R48 PolarHBondContact O-N 3.5Å; Q46-R48 VanDerWaalsContact O-N 3.12Å; Q46-A49 HydrophobicContact CB-CB 4.16Å; Q46-A49 WeakPolarHBondContact O-CB 3.47Å; Q46-A49 PolarHBondContact O-N 2.95Å; Q46-G50 PolarHBondContact N-O 3.33Å; Q46-K52 HydrophobicContact CG-CB 4.31Å
47	G	76.7	Confident	88.6	Confident	65 Å²	65	70.3 Å²	70.3	67%	0.67	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	50.5	-119.6	177.5	0	0	0	0	0	112.7	A49	G47-A49 VanDerWaalsContact C-N 3.33Å
48	R	75.8	Confident	88.6	Confident	267 Å²	267	70.5 Å²	70.5	100%	1.008	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-73.7	-18	179.1	-66.7	-175.3	180	172.5	-0.2	114.4	Q46 G50	Q46-R48 PolarHBondContact O-N 3.5Å; Q46-R48 VanDerWaalsContact O-N 3.12Å; R48-G50 PolarHBondContact O-N 3.23Å
49	A	73.1	Confident	88.6	Confident	82 Å²	82	68.1 Å²	68.1	68%	0.678	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-81.9	4.8	-176.6	0	0	0	0	0	113.8	Q46 G47	Q46-A49 HydrophobicContact CB-CB 4.16Å; Q46-A49 WeakPolarHBondContact O-CB 3.47Å; Q46-A49 PolarHBondContact O-N 2.95Å; G47-A49 VanDerWaalsContact C-N 3.33Å
50	G	85.2	Confident	88.7	Confident	34 Å²	34	65.2 Å²	65.2	35%	0.351	34%	0.342	S	S	.	.			trans	83.7	-150.3	176.8	0	0	0	0	0	114.1	Q46 R48	Q46-G50 PolarHBondContact N-O 3.33Å; R48-G50 PolarHBondContact O-N 3.23Å
51	K	88.2	Confident	88.7	Confident	137 Å²	137	68.7 Å²	68.7	60%	0.596	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.2	121.4	-177	-64.3	178.3	-178.8	179.6	0	109.8	F43	F43-K51 HydrophobicContact CB-CB 4.45Å; F43-K51 HydrophobicContact CD2-CB 4.03Å; F43-K51 HydrophobicContact CD2-CD 3.77Å; F43-K51 HydrophobicContact CD2-CG 3.84Å; F43-K51 HydrophobicContact CE2-CD 3.73Å; F43-K51 HydrophobicContact CE2-CG 4.13Å; F43-K51 HydrophobicContact CG-CB 4.45Å; F43-K51 HydrophobicContact CG-CD 4.4Å; F43-K51 HydrophobicContact CZ-CD 4.33Å
52	K	90.2	Very high	88.8	Confident	119 Å²	119	65.6 Å²	65.6	52%	0.517	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	115.7	171.5	-176.7	177.3	-179.7	177.1	0	109.6	F43 V44 Q46 I54	F43-K52 CarbonylContact C-O 3.01Å; F43-K52 VanDerWaalsContact CA-O 3.23Å; F43-K52 WeakPolarHBondContact CA-O 3.46Å; V44-K52 PolarHBondContact N-O 2.64Å; V44-K52 PolarHBondContact O-N 2.88Å; Q46-K52 HydrophobicContact CG-CB 4.31Å; K52-I54 PolarHBondContact O-N 3.21Å
53	F	91.7	Very high	88.8	Confident	91 Å²	91	68.3 Å²	68.3	40%	0.399	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	123.3	173.4	-73.9	-90	0	0	0	110.5	K41 Y42 F43 K56	K41-F53 HydrophobicContact CB-CD1 4.41Å; K41-F53 HydrophobicContact CB-CE1 4.34Å; Y42-F53 CarbonylContact O-C 3.52Å; Y42-F53 WeakPolarHBondContact O-CA 3.39Å; F43-F53 HydrophobicContact CB-CD1 3.88Å; F43-F53 HydrophobicContact CB-CE1 4.03Å; F43-F53 HydrophobicContact CB-CG 4.15Å; F43-F53 HydrophobicContact CB-CZ 4.43Å; F43-F53 AromaticContact CD1-CE1 3.96Å; F43-F53 HydrophobicContact CD1-CE1 3.96Å; F43-F53 HydrophobicContact CD1-CZ 4.38Å; F43-F53 HydrophobicContact CG-CE1 4.35Å; F53-K56 HydrophobicContact CB-CG 4.21Å
54	I	92.8	Very high	88.8	Confident	47 Å²	47	68.7 Å²	68.7	24%	0.241	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	-40.2	173.7	-62.6	-177.1	0	0	0	110	Y42 V44 K52 G249	Y42-I54 HydrophobicContact CD1-CB 3.88Å; Y42-I54 HydrophobicContact CD1-CD1 4.14Å; Y42-I54 HydrophobicContact CD1-CG1 4.41Å; Y42-I54 HydrophobicContact CD1-CG2 4.29Å; Y42-I54 HydrophobicContact CE1-CB 4.47Å; Y42-I54 HydrophobicContact CE1-CD1 3.84Å; Y42-I54 PolarHBondContact O-N 3.03Å; V44-I54 HydrophobicContact CB-CD1 4.36Å; V44-I54 HydrophobicContact CG2-CD1 3.44Å; V44-I54 VanDerWaalsContact CG2-CD1 3.44Å; V44-I54 HydrophobicContact CG2-CG1 4.3Å; K52-I54 PolarHBondContact O-N 3.21Å; I54-G249 WeakPolarHBondContact O-CA 3.35Å
55	L	93.9	Very high	88.9	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	134.8	173.6	-57.2	175.9	0	0	0	109	L40 K41 Y42 I58 L81 I84	L40-L55 HydrophobicContact CD2-CD1 4.18Å; K41-L55 WeakPolarHBondContact CA-O 3.32Å; Y42-L55 PolarHBondContact N-O 3.27Å; Y42-L55 VanDerWaalsContact N-O 3.08Å; Y42-L55 PolarHBondContact O-N 3.11Å; L55-I58 HydrophobicContact CB-CD1 4.46Å; L55-I58 HydrophobicContact CD1-CD1 4.13Å; L55-I58 HydrophobicContact CD2-CD1 3.91Å; L55-I58 HydrophobicContact CG-CD1 4.39Å; L55-L81 HydrophobicContact CD1-CB 4.18Å; L55-I84 HydrophobicContact CD1-CD1 3.62Å
56	K	92.7	Very high	89.3	Confident	90 Å²	90	65.2 Å²	65.2	39%	0.391	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	49.5	-165.4	-63	171.9	-179.8	162.6	0	112.7	F53 D248 G249 H250	F53-K56 HydrophobicContact CB-CG 4.21Å; K56-D248 WeakPolarHBondContact CD-O 3.33Å; K56-D248 WeakPolarHBondContact CE-O 3.36Å; K56-D248 PolarHBondContact NZ-O 3.03Å; K56-G249 PolarHBondContact N-O 3.02Å; K56-H250 VanDerWaalsContact CD-CE1 3.48Å; K56-H250 WeakPolarHBondContact CD-CE1 3.45Å; K56-H250 WeakPolarHBondContact CD-NE2 3.37Å
57	G	91.1	Very high	90	Very high	17 Å²	17	60.6 Å²	60.6	18%	0.175	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	83.5	56.3	175.1	0	0	0	0	0	112.3	D39 L40 K41	D39-G57 WeakPolarHBondContact OD1-CA 3.47Å; L40-G57 VanDerWaalsContact O-CA 3.28Å; L40-G57 WeakPolarHBondContact O-CA 3.48Å; L40-G57 PolarHBondContact O-N 3.07Å; K41-G57 VanDerWaalsContact CG-N 3.27Å
58	I	93.5	Very high	90.9	Very high	5 Å²	5	57.5 Å²	57.5	3%	0.026	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	145.4	-178	60.4	170.7	0	0	0	111.4	F37 L40 L55 L81 L246 G249 C251	F37-I58 HydrophobicContact CE2-CD1 4.29Å; F37-I58 HydrophobicContact CE2-CG1 4.16Å; L40-I58 HydrophobicContact CB-CG1 4.04Å; L40-I58 WeakPolarHBondContact CB-O 3.48Å; L40-I58 PolarHBondContact N-O 3.38Å; L40-I58 PolarHBondContact O-N 3.27Å; L55-I58 HydrophobicContact CB-CD1 4.46Å; L55-I58 HydrophobicContact CD1-CD1 4.13Å; L55-I58 HydrophobicContact CD2-CD1 3.91Å; L55-I58 HydrophobicContact CG-CD1 4.39Å; I58-L81 HydrophobicContact CD1-CD1 3.82Å; I58-L81 HydrophobicContact CD1-CD2 3.96Å; I58-L81 HydrophobicContact CD1-CG 4.32Å; I58-L246 HydrophobicContact CD1-CD2 3.98Å; I58-L246 HydrophobicContact CG2-CD2 4.29Å; I58-G249 VanDerWaalsContact CG2-O 3.31Å; I58-G249 WeakPolarHBondContact CG2-O 3.24Å; I58-C251 HydrophobicContact CG2-CB 4.26Å
59	S	93.5	Very high	91.9	Very high	38 Å²	38	44.8 Å²	44.8	27%	0.266	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	150.8	177.6	-53.6	0	0	0	0	110.8	F37 D39 Y244 R254	F37-S59 VanDerWaalsContact CE2-C 3.44Å; F37-S59 CarbonylContact O-C 3.58Å; F37-S59 WeakPolarHBondContact O-CA 3.32Å; F37-S59 WeakPolarHBondContact O-CB 3.28Å; D39-S59 PolarHBondContact N-OG 3.34Å; S59-Y244 PolarHBondContact O-OH 3.32Å; S59-R254 PolarHBondContact O-NH1 3.16Å
60	G	92.9	Very high	93	Very high	8 Å²	8	40.9 Å²	40.9	8%	0.082	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176.2	170.6	179.5	0	0	0	0	0	113.2	K36 F37	K36-G60 WeakPolarHBondContact CA-O 3.2Å; F37-G60 WeakPolarHBondContact CD1-O 3.37Å; F37-G60 PolarHBondContact N-O 3.45Å; F37-G60 PolarHBondContact O-N 3.27Å
61	E	94.1	Very high	93.5	Very high	72 Å²	72	39.3 Å²	39.3	34%	0.336	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	137.5	175.7	-174.8	-176	-173.5	0	0	109.2	N34 L35 K36 K63	N34-E61 HydrophobicContact CB-CG 4.5Å; N34-E61 PolarHBondContact ND2-OE1 3.1Å; L35-E61 CarbonylContact O-C 3.51Å; L35-E61 WeakPolarHBondContact O-CA 3.44Å; K36-E61 HydrophobicContact CB-CB 4.44Å; K36-E61 HydrophobicContact CB-CG 4.27Å; K36-E61 HydrophobicContact CG-CB 4.32Å; E61-K63 HydrophobicContact CG-CG 4.32Å
62	F	95.4	Very high	93.8	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	124.6	170.2	-61.9	-67.9	0	0	0	109.1	N34 L35 F37 S68 I70 L85 T224 I226 H242 Y244	N34-F62 CarbonylContact C-O 3.58Å; N34-F62 WeakPolarHBondContact CA-O 3.36Å; L35-F62 PolarHBondContact N-O 3.12Å; L35-F62 PolarHBondContact O-N 3.46Å; F37-F62 HydrophobicContact CD1-CE2 4.43Å; F37-F62 HydrophobicContact CE1-CD2 4.07Å; F37-F62 AromaticContact CE1-CE2 3.55Å; F37-F62 HydrophobicContact CE1-CE2 3.55Å; F37-F62 HydrophobicContact CE1-CZ 4.3Å; F37-F62 HydrophobicContact CZ-CE2 4.31Å; F62-S68 WeakPolarHBondContact CD1-OG 3.31Å; F62-I70 HydrophobicContact CZ-CD1 4.03Å; F62-I70 HydrophobicContact CZ-CG1 4.05Å; F62-L85 HydrophobicContact CD2-CD1 4.31Å; F62-L85 HydrophobicContact CE2-CD1 3.62Å; F62-T224 HydrophobicContact CB-CG2 3.91Å; F62-I226 HydrophobicContact CB-CD1 3.81Å; F62-I226 HydrophobicContact CB-CG1 3.98Å; F62-I226 HydrophobicContact CD1-CD1 4.41Å; F62-I226 HydrophobicContact CD1-CG1 4.05Å; F62-I226 HydrophobicContact CD2-CD1 3.44Å; F62-I226 VanDerWaalsContact CD2-CD1 3.44Å; F62-I226 HydrophobicContact CD2-CG1 3.98Å; F62-I226 HydrophobicContact CE1-CG2 4.42Å; F62-I226 HydrophobicContact CE2-CD1 4.07Å; F62-I226 HydrophobicContact CE2-CG1 4.46Å; F62-I226 HydrophobicContact CE2-CG2 4.38Å; F62-I226 HydrophobicContact CG-CD1 3.63Å; F62-I226 HydrophobicContact CG-CG1 3.73Å; F62-I226 HydrophobicContact CZ-CG2 4.23Å; F62-H242 AromaticContact CD1-ND1 4Å; F62-Y244 HydrophobicContact CZ-CD2 4.45Å; F62-Y244 HydrophobicContact CZ-CG 4.28Å
63	K	93.2	Very high	93.9	Very high	92 Å²	92	28.1 Å²	28.1	40%	0.4	15%	0.151	S	C	.	.			trans	-99	149.5	-171.7	-61.1	176.8	-179.3	174.5	0	112	E61 E66	E61-K63 HydrophobicContact CG-CG 4.32Å; K63-E66 HydrophobicContact CB-CG 4.34Å; K63-E66 PolarHBondContact O-N 3.47Å
64	S	92.4	Very high	93.9	Very high	26 Å²	26	28.4 Å²	28.4	18%	0.182	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	135.6	172.3	176.2	0	0	0	0	110.8	N34 G222 T224	N34-S64 PolarHBondContact OD1-N 3.29Å; N34-S64 VanDerWaalsContact OD1-N 3.09Å; S64-G222 PolarHBondContact OG-O 3.12Å; S64-G222 VanDerWaalsContact OG-O 3.06Å; S64-T224 WeakPolarHBondContact CA-OG1 3.38Å; S64-T224 PolarHBondContact N-OG1 3.48Å
65	G	92	Very high	93.8	Very high	25 Å²	25	29.8 Å²	29.8	26%	0.258	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	97.9	-13.3	-177.1	0	0	0	0	0	114.3	A219 R223	G65-A219 VanDerWaalsContact CA-O 3.26Å; G65-A219 WeakPolarHBondContact CA-O 3.05Å; G65-R223 PolarHBondContact N-O 2.89Å
66	E	94.1	Very high	93.7	Very high	57 Å²	57	29.9 Å²	29.9	27%	0.266	19%	0.191	S	C	.	.			trans	-105.5	138.7	-174.2	-64.5	179.3	175.1	0	0	111.8	K63 I225 D241	K63-E66 HydrophobicContact CB-CG 4.34Å; K63-E66 PolarHBondContact O-N 3.47Å; E66-I225 PolarHBondContact O-N 3.13Å; E66-D241 HydrophobicContact CB-CB 4.33Å
67	L	96.6	Very high	93.6	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	110.3	165.6	-180	63.2	0	0	0	109.4	I212 L215 R216 A219 I225 F240 D241 H242	L67-I212 HydrophobicContact CD2-CG2 3.99Å; L67-L215 HydrophobicContact CD1-CB 3.94Å; L67-L215 HydrophobicContact CD2-CB 4.43Å; L67-R216 HydrophobicContact CD2-CB 3.9Å; L67-R216 HydrophobicContact CD2-CG 4.41Å; L67-A219 HydrophobicContact CB-CB 4.16Å; L67-I225 HydrophobicContact CD1-CB 3.98Å; L67-I225 HydrophobicContact CD1-CG2 3.48Å; L67-I225 VanDerWaalsContact CD1-CG2 3.48Å; L67-F240 HydrophobicContact CD1-CD1 4.47Å; L67-F240 HydrophobicContact CD1-CE1 4.03Å; L67-F240 HydrophobicContact CD2-CD1 3.83Å; L67-F240 HydrophobicContact CD2-CE1 3.54Å; L67-F240 HydrophobicContact CD2-CZ 4.14Å; L67-F240 HydrophobicContact CG-CD1 3.6Å; L67-F240 HydrophobicContact CG-CE1 3.53Å; L67-D241 PolarHBondContact N-OD2 2.88Å; L67-D241 PolarHBondContact O-N 3.23Å; L67-H242 PolarHBondContact O-N 3.08Å
68	S	97.1	Very high	93.7	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	126.5	-175.3	-64.9	0	0	0	0	112.7	F62 I225 I226 C227 H242	F62-S68 WeakPolarHBondContact CD1-OG 3.31Å; S68-I225 PolarHBondContact N-O 2.95Å; S68-I226 WeakPolarHBondContact O-CA 3.3Å; S68-C227 PolarHBondContact O-N 2.87Å; S68-C227 PolarHBondContact O-SG 3.14Å; S68-H242 CarbonylContact C-O 3.56Å; S68-H242 WeakPolarHBondContact CA-O 3.45Å
69	A	96.7	Very high	93.5	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	131.5	172.5	0	0	0	0	0	111.8	M71 C227 I229 F240 H242 L243 Y244	A69-M71 HydrophobicContact CB-CG 4.35Å; A69-C227 CarbonylContact C-O 3.57Å; A69-C227 WeakPolarHBondContact CA-O 3.48Å; A69-I229 HydrophobicContact CB-CD1 4.44Å; A69-F240 HydrophobicContact CB-CB 4.38Å; A69-F240 HydrophobicContact CB-CD1 3.54Å; A69-F240 HydrophobicContact CB-CD2 4.29Å; A69-F240 HydrophobicContact CB-CE1 4.04Å; A69-F240 HydrophobicContact CB-CG 3.75Å; A69-H242 PolarHBondContact N-O 3.46Å; A69-L243 HydrophobicContact CB-CD1 4.26Å; A69-L243 WeakPolarHBondContact O-CA 3.27Å; A69-Y244 PolarHBondContact O-N 2.91Å
70	I	96.5	Very high	93.4	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	115.9	165.9	-59.8	175.4	0	0	0	108.1	F62 K78 L81 I226 C227 T228 I229 Y244 L246	F62-I70 HydrophobicContact CZ-CD1 4.03Å; F62-I70 HydrophobicContact CZ-CG1 4.05Å; I70-K78 HydrophobicContact CG2-CB 4.09Å; I70-K78 HydrophobicContact CG2-CG 4.23Å; I70-L81 HydrophobicContact CD1-CD2 4.21Å; I70-I226 HydrophobicContact CD1-CG2 3.54Å; I70-I226 HydrophobicContact CG1-CG2 4.01Å; I70-C227 PolarHBondContact N-O 3.37Å; I70-T228 HydrophobicContact CB-CG2 4.08Å; I70-T228 HydrophobicContact CG2-CG2 4.31Å; I70-T228 WeakPolarHBondContact O-CA 3.44Å; I70-I229 PolarHBondContact O-N 2.92Å; I70-I229 VanDerWaalsContact O-N 3.09Å; I70-Y244 CarbonylContact C-O 3.56Å; I70-Y244 VanDerWaalsContact CA-O 3.28Å; I70-Y244 WeakPolarHBondContact CA-O 3.43Å; I70-L246 HydrophobicContact CG2-CD1 4.31Å
71	M	95.4	Very high	93.5	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.005	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	167.3	-177.3	-66.4	-170.5	64.2	0	0	112	A69 P232 F237 L243 Y244 F245 L246 A278 M282	A69-M71 HydrophobicContact CB-CG 4.35Å; M71-P232 HydrophobicContact CE-CG 3.86Å; M71-P232 HydrophobicContact SD-CG 4.1Å; M71-F237 HydrophobicContact SD-CD2 4.19Å; M71-F237 HydrophobicContact SD-CE2 3.95Å; M71-L243 HydrophobicContact CB-CD1 3.9Å; M71-L243 HydrophobicContact CG-CD1 3.71Å; M71-L243 HydrophobicContact SD-CD1 3.67Å; M71-Y244 PolarHBondContact N-O 3.14Å; M71-F245 HydrophobicContact CB-CD2 3.65Å; M71-F245 HydrophobicContact CB-CE2 3.89Å; M71-F245 HydrophobicContact CB-CG 4.44Å; M71-F245 WeakPolarHBondContact O-CA 3.49Å; M71-L246 PolarHBondContact O-N 3.35Å; M71-A278 HydrophobicContact CE-CB 4.17Å; M71-M282 HydrophobicContact CE-CG 4.31Å; M71-M282 HydrophobicContact CE-SD 4.47Å
72	G	93.6	Very high	93.5	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	16%	0.161	C	C	.	.			trans	148.8	164.6	-178.5	0	0	0	0	0	113.2	K78 L246 M282	G72-K78 WeakPolarHBondContact O-CD 3.38Å; G72-K78 WeakPolarHBondContact O-CE 3.39Å; G72-K78 PolarHBondContact O-NZ 3.49Å; G72-L246 WeakPolarHBondContact CA-O 3.45Å; G72-M282 VanDerWaalsContact C-SD 3.53Å; G72-M282 WeakPolarHBondContact O-CE 3.14Å
73	P	93.2	Very high	93.2	Very high	21 Å²	21	25.7 Å²	25.7	14%	0.136	17%	0.173	C	C	.	.	S	Bend	trans	-57.5	163	176.2	-25.7	35.5	0	0	0	113.8	G75 A76 K78 L246 T247 M282 A285	P73-G75 PolarHBondContact O-N 2.84Å; P73-A76 WeakPolarHBondContact O-CB 3.43Å; P73-A76 PolarHBondContact O-N 3.48Å; P73-K78 PolarHBondContact O-NZ 2.97Å; P73-L246 VanDerWaalsContact CD-O 3.32Å; P73-L246 WeakPolarHBondContact CD-O 3.21Å; P73-T247 HydrophobicContact CG-CG2 4.46Å; P73-M282 HydrophobicContact CG-CE 4.46Å; P73-A285 HydrophobicContact CG-CB 4.05Å
74	S	91.5	Very high	93.1	Very high	97 Å²	97	21.3 Å²	21.3	68%	0.678	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.5	132.8	171.4	-70.9	0	0	0	0	110.5	A76	S74-A76 VanDerWaalsContact C-N 3.31Å; S74-A76 PolarHBondContact O-N 3.49Å
75	G	89.7	Confident	93.2	Very high	77 Å²	77	20.1 Å²	20.1	79%	0.794	15%	0.146	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.7	-3.5	-176.3	0	0	0	0	0	116	P73 G77	P73-G75 PolarHBondContact O-N 2.84Å; G75-G77 PolarHBondContact O-N 2.92Å
76	A	91.7	Very high	93.1	Very high	1 Å²	1	19 Å²	19	1%	0.008	13%	0.134	C	C	.	.	S	Bend	trans	-65.4	-10	-179.7	0	0	0	0	0	115.4	P73 S74 L246 G249	P73-A76 WeakPolarHBondContact O-CB 3.43Å; P73-A76 PolarHBondContact O-N 3.48Å; S74-A76 VanDerWaalsContact C-N 3.31Å; S74-A76 PolarHBondContact O-N 3.49Å; A76-L246 HydrophobicContact CB-CB 4.25Å; A76-L246 WeakPolarHBondContact CB-O 3.32Å; A76-G249 PolarHBondContact O-N 3.48Å
77	G	91.5	Very high	92.7	Very high	7 Å²	7	16.3 Å²	16.3	7%	0.072	12%	0.121	C	C	.	.	S	Bend	trans	99	12.3	179.7	0	0	0	0	0	115.6	G75 S80 L81	G75-G77 PolarHBondContact O-N 2.92Å; G77-S80 WeakPolarHBondContact O-CB 3.32Å; G77-S80 PolarHBondContact O-N 2.83Å; G77-L81 PolarHBondContact O-N 2.99Å
78	K	92.6	Very high	92	Very high	12 Å²	12	17.4 Å²	17.4	5%	0.052	13%	0.126	C	C	.	.	H	α-helix	trans	-52.7	-58.3	-179.2	-55.9	-175.2	-64.1	-82.5	0	113.5	I70 G72 P73 S80 L81 M82 T228	I70-K78 HydrophobicContact CG2-CB 4.09Å; I70-K78 HydrophobicContact CG2-CG 4.23Å; G72-K78 WeakPolarHBondContact O-CD 3.38Å; G72-K78 WeakPolarHBondContact O-CE 3.39Å; G72-K78 PolarHBondContact O-NZ 3.49Å; P73-K78 PolarHBondContact O-NZ 2.97Å; K78-S80 VanDerWaalsContact C-N 3.27Å; K78-S80 PolarHBondContact O-N 3.43Å; K78-L81 PolarHBondContact O-N 2.97Å; K78-M82 PolarHBondContact O-N 3.4Å; K78-T228 HydrophobicContact CB-CG2 4.2Å
79	S	90.5	Very high	91.4	Very high	44 Å²	44	18.4 Å²	18.4	31%	0.308	13%	0.132	S	C	.	.	H	α-helix	trans	-67.3	-29.9	179.4	-44.3	0	0	0	0	111.5	N83	S79-N83 VanDerWaalsContact O-CB 3.3Å; S79-N83 WeakPolarHBondContact O-CB 3.39Å; S79-N83 VanDerWaalsContact O-CG 3.31Å; S79-N83 PolarHBondContact O-N 2.74Å; S79-N83 PolarHBondContact O-ND2 3.14Å
80	S	91.6	Very high	90.6	Very high	32 Å²	32	21 Å²	21	22%	0.224	15%	0.149	C	C	.	.	H	α-helix	trans	-65.5	-46.9	173.4	-57.3	0	0	0	0	111.5	G77 K78 M82 N83 I84	G77-S80 WeakPolarHBondContact O-CB 3.32Å; G77-S80 PolarHBondContact O-N 2.83Å; K78-S80 VanDerWaalsContact C-N 3.27Å; K78-S80 PolarHBondContact O-N 3.43Å; S80-M82 VanDerWaalsContact C-N 3.35Å; S80-M82 PolarHBondContact O-N 3.25Å; S80-N83 PolarHBondContact O-N 3.08Å; S80-I84 WeakPolarHBondContact O-CD1 3.48Å; S80-I84 VanDerWaalsContact O-CG1 3.22Å; S80-I84 WeakPolarHBondContact O-CG1 3.41Å; S80-I84 PolarHBondContact O-N 2.99Å
81	L	94.5	Very high	90	Very high	0 Å²	0	26 Å²	26	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-57.1	-50.3	173.8	171.5	58.4	0	0	0	110.4	F37 L40 L55 I58 I70 G77 K78 N83 I84 L85 Y244 L246	F37-L81 HydrophobicContact CE2-CD1 4.2Å; F37-L81 HydrophobicContact CZ-CD1 4.36Å; F37-L81 HydrophobicContact CZ-CD2 4.44Å; L40-L81 HydrophobicContact CD2-CD1 3.68Å; L55-L81 HydrophobicContact CD1-CB 4.18Å; I58-L81 HydrophobicContact CD1-CD1 3.82Å; I58-L81 HydrophobicContact CD1-CD2 3.96Å; I58-L81 HydrophobicContact CD1-CG 4.32Å; I70-L81 HydrophobicContact CD1-CD2 4.21Å; G77-L81 PolarHBondContact O-N 2.99Å; K78-L81 PolarHBondContact O-N 2.97Å; L81-N83 PolarHBondContact O-N 3.29Å; L81-I84 PolarHBondContact O-N 3.14Å; L81-I84 VanDerWaalsContact O-N 3.15Å; L81-L85 HydrophobicContact CD1-CD1 3.74Å; L81-L85 HydrophobicContact CD1-CD2 4.32Å; L81-L85 HydrophobicContact CD1-CG 3.8Å; L81-L85 HydrophobicContact CG-CD1 3.89Å; L81-L85 HydrophobicContact CG-CG 4.34Å; L81-L85 WeakPolarHBondContact O-CG 3.33Å; L81-L85 PolarHBondContact O-N 3.24Å; L81-Y244 HydrophobicContact CD2-CD1 4.05Å; L81-Y244 HydrophobicContact CD2-CE1 3.79Å; L81-L246 HydrophobicContact CB-CD1 4.19Å; L81-L246 HydrophobicContact CD2-CD1 3.78Å
82	M	93.1	Very high	89.7	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-63.7	-40.7	-177.1	-162.5	177.1	56.1	0	0	112.6	K78 S80 I84 L85 A86 Y115 F195 D197 T228	K78-M82 PolarHBondContact O-N 3.4Å; S80-M82 VanDerWaalsContact C-N 3.35Å; S80-M82 PolarHBondContact O-N 3.25Å; M82-I84 VanDerWaalsContact C-N 3.32Å; M82-I84 PolarHBondContact O-N 3.31Å; M82-L85 PolarHBondContact O-N 3.03Å; M82-A86 VanDerWaalsContact O-CB 3.3Å; M82-A86 WeakPolarHBondContact O-CB 3.26Å; M82-A86 PolarHBondContact O-N 2.87Å; M82-Y115 HydrophobicContact CE-CE2 3.57Å; M82-Y115 WeakPolarHBondContact CE-OH 3.48Å; M82-Y115 HydrophobicContact CG-CE2 3.88Å; M82-Y115 HydrophobicContact SD-CE2 4.14Å; M82-F195 HydrophobicContact CG-CB 4.31Å; M82-F195 HydrophobicContact CG-CD1 3.94Å; M82-F195 HydrophobicContact SD-CB 4.27Å; M82-D197 HydrophobicContact CE-CB 3.29Å; M82-D197 VanDerWaalsContact CE-OD1 3.22Å; M82-D197 WeakPolarHBondContact CE-OD1 3.42Å; M82-T228 HydrophobicContact CB-CG2 4.23Å; M82-T228 HydrophobicContact CE-CG2 3.85Å; M82-T228 HydrophobicContact SD-CG2 3.75Å
83	N	90	Very high	89.5	Confident	48 Å²	48	30.5 Å²	30.5	26%	0.257	20%	0.197	S	C	.	.	H	α-helix	trans	-63.1	-36.4	174.4	-81.5	-54	0	0	0	112.9	S79 S80 L81 G87 Y88 C89 Y115	S79-N83 VanDerWaalsContact O-CB 3.3Å; S79-N83 WeakPolarHBondContact O-CB 3.39Å; S79-N83 VanDerWaalsContact O-CG 3.31Å; S79-N83 PolarHBondContact O-N 2.74Å; S79-N83 PolarHBondContact O-ND2 3.14Å; S80-N83 PolarHBondContact O-N 3.08Å; L81-N83 PolarHBondContact O-N 3.29Å; N83-G87 PolarHBondContact O-N 3.25Å; N83-Y88 PolarHBondContact O-N 3.01Å; N83-C89 HydrophobicContact CB-CB 4.28Å; N83-C89 PolarHBondContact O-N 3.39Å; N83-C89 VanDerWaalsContact O-N 3.11Å; N83-Y115 PolarHBondContact OD1-OH 2.93Å
84	I	91.8	Very high	89.5	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-68.8	-45.8	175.7	-66.7	162.4	0	0	0	110.1	L40 Y42 L55 S80 L81 M82 A86 G87 C89 V93 R104	L40-I84 HydrophobicContact CD1-CG2 3.97Å; L40-I84 HydrophobicContact CD2-CB 4.42Å; L40-I84 HydrophobicContact CD2-CD1 4.45Å; L40-I84 HydrophobicContact CD2-CG2 3.86Å; L40-I84 HydrophobicContact CG-CG2 4.38Å; Y42-I84 HydrophobicContact CD1-CD1 4.13Å; Y42-I84 HydrophobicContact CD2-CD1 4.06Å; Y42-I84 HydrophobicContact CG-CD1 3.68Å; L55-I84 HydrophobicContact CD1-CD1 3.62Å; S80-I84 WeakPolarHBondContact O-CD1 3.48Å; S80-I84 VanDerWaalsContact O-CG1 3.22Å; S80-I84 WeakPolarHBondContact O-CG1 3.41Å; S80-I84 PolarHBondContact O-N 2.99Å; L81-I84 PolarHBondContact O-N 3.14Å; L81-I84 VanDerWaalsContact O-N 3.15Å; M82-I84 VanDerWaalsContact C-N 3.32Å; M82-I84 PolarHBondContact O-N 3.31Å; I84-A86 VanDerWaalsContact C-N 3.34Å; I84-A86 PolarHBondContact O-N 3.42Å; I84-G87 PolarHBondContact O-N 2.88Å; I84-C89 HydrophobicContact CG1-CB 3.98Å; I84-V93 HydrophobicContact CD1-CG2 4.03Å; I84-V93 HydrophobicContact CG1-CG2 3.85Å; I84-V93 HydrophobicContact CG2-CG1 3.77Å; I84-V93 HydrophobicContact CG2-CG2 4.14Å; I84-R104 PolarHBondContact O-NH1 3.33Å; I84-R104 PolarHBondContact O-NH2 2.86Å
85	L	93.1	Very high	89.4	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-63.3	-38.8	178.8	-68.9	176.9	0	0	0	112.4	L35 F37 F62 L81 M82 G87 V97 R104 F109 F195	L35-L85 HydrophobicContact CD2-CB 4.15Å; L35-L85 HydrophobicContact CD2-CD2 4.22Å; F37-L85 HydrophobicContact CB-CD2 4.01Å; F37-L85 HydrophobicContact CD1-CD1 4.41Å; F37-L85 HydrophobicContact CD1-CD2 3.64Å; F37-L85 HydrophobicContact CE1-CD1 4.28Å; F37-L85 HydrophobicContact CE1-CD2 4.3Å; F37-L85 HydrophobicContact CG-CD2 3.9Å; F62-L85 HydrophobicContact CD2-CD1 4.31Å; F62-L85 HydrophobicContact CE2-CD1 3.62Å; L81-L85 HydrophobicContact CD1-CD1 3.74Å; L81-L85 HydrophobicContact CD1-CD2 4.32Å; L81-L85 HydrophobicContact CD1-CG 3.8Å; L81-L85 HydrophobicContact CG-CD1 3.89Å; L81-L85 HydrophobicContact CG-CG 4.34Å; L81-L85 WeakPolarHBondContact O-CG 3.33Å; L81-L85 PolarHBondContact O-N 3.24Å; M82-L85 PolarHBondContact O-N 3.03Å; L85-G87 PolarHBondContact O-N 3.33Å; L85-V97 HydrophobicContact CD2-CG1 4.33Å; L85-V97 HydrophobicContact CD2-CG2 4.41Å; L85-R104 PolarHBondContact O-NH1 2.94Å; L85-F109 WeakPolarHBondContact O-CE1 3.46Å; L85-F109 VanDerWaalsContact O-CZ 3.22Å; L85-F109 WeakPolarHBondContact O-CZ 3.42Å; L85-F195 HydrophobicContact CB-CE1 3.71Å; L85-F195 HydrophobicContact CB-CZ 4.05Å
86	A	89.6	Confident	89.5	Confident	2 Å²	2	31.1 Å²	31.1	2%	0.017	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-9.1	174.7	0	0	0	0	0	114	M82 I84 Y88 Y115 F195	M82-A86 VanDerWaalsContact O-CB 3.3Å; M82-A86 WeakPolarHBondContact O-CB 3.26Å; M82-A86 PolarHBondContact O-N 2.87Å; I84-A86 VanDerWaalsContact C-N 3.34Å; I84-A86 PolarHBondContact O-N 3.42Å; A86-Y88 VanDerWaalsContact C-N 3.29Å; A86-Y88 HydrophobicContact CB-CD2 3.88Å; A86-Y88 HydrophobicContact CB-CE2 4.42Å; A86-Y88 PolarHBondContact O-N 2.92Å; A86-Y115 HydrophobicContact CB-CD2 3.43Å; A86-Y115 VanDerWaalsContact CB-CD2 3.43Å; A86-Y115 HydrophobicContact CB-CE2 4.03Å; A86-Y115 HydrophobicContact CB-CG 4.27Å; A86-F195 HydrophobicContact CB-CD2 3.84Å; A86-F195 HydrophobicContact CB-CE2 4.03Å; A86-F195 HydrophobicContact CB-CG 4.13Å; A86-F195 HydrophobicContact CB-CZ 4.47Å
87	G	87	Confident	89.6	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.9	23.3	-179.2	0	0	0	0	0	113.5	N83 I84 L85 R110	N83-G87 PolarHBondContact O-N 3.25Å; I84-G87 PolarHBondContact O-N 2.88Å; L85-G87 PolarHBondContact O-N 3.33Å; G87-R110 PolarHBondContact O-NH2 3Å
88	Y	82	Confident	89.6	Confident	24 Å²	24	32.5 Å²	32.5	9%	0.094	19%	0.187	C	C	.	.	S	Bend	trans	-85.5	-32.6	174.1	-84.3	-128.2	0	0	0	111	N83 A86 Y115 L510 N511 R703	N83-Y88 PolarHBondContact O-N 3.01Å; A86-Y88 VanDerWaalsContact C-N 3.29Å; A86-Y88 HydrophobicContact CB-CD2 3.88Å; A86-Y88 HydrophobicContact CB-CE2 4.42Å; A86-Y88 PolarHBondContact O-N 2.92Å; Y88-Y115 HydrophobicContact CE1-CD1 4.2Å; Y88-Y115 HydrophobicContact CE1-CG 4.45Å; Y88-Y115 HydrophobicContact CE2-CG 4.23Å; Y88-L510 HydrophobicContact CD1-CD1 3.64Å; Y88-L510 HydrophobicContact CE1-CB 3.67Å; Y88-L510 HydrophobicContact CE1-CD1 3.35Å; Y88-L510 HydrophobicContact CE1-CG 4.1Å; Y88-L510 HydrophobicContact CE2-CB 4.11Å; Y88-L510 VanDerWaalsContact CZ-CB 3.41Å; Y88-L510 WeakPolarHBondContact OH-CB 3.45Å; Y88-N511 PolarHBondContact OH-OD1 3.18Å; Y88-R703 WeakPolarHBondContact O-CA 3.48Å
89	C	83.4	Confident	89.4	Confident	20 Å²	20	33 Å²	33	14%	0.135	19%	0.19	C	C	.	.			trans	-109.7	122.7	170.8	-172.9	0	0	0	0	110.2	Y42 N83 I84	Y42-C89 VanDerWaalsContact CE2-SG 3.55Å; N83-C89 HydrophobicContact CB-CB 4.28Å; N83-C89 PolarHBondContact O-N 3.39Å; N83-C89 VanDerWaalsContact O-N 3.11Å; I84-C89 HydrophobicContact CG1-CB 3.98Å
90	T	81.1	Confident	89.1	Confident	56 Å²	56	33 Å²	33	34%	0.344	20%	0.197	S	C	.	.			trans	-126	-20.3	-178.5	53.9	0	0	0	0	113.5	L106 R703	T90-L106 HydrophobicContact CG2-CD1 3.57Å; T90-L106 HydrophobicContact CG2-CD2 4.17Å; T90-R703 PolarHBondContact N-O 2.7Å; T90-R703 PolarHBondContact OG1-O 2.85Å
91	Q	84.1	Confident	88.5	Confident	104 Å²	104	37.4 Å²	37.4	49%	0.486	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	143.5	178.5	-57.9	-175.5	14.4	0	0	111	Y42 V93 R703	Y42-Q91 WeakPolarHBondContact CE2-O 3.39Å; Q91-V93 PolarHBondContact O-N 2.93Å; Q91-R703 VanDerWaalsContact CD-OXT 3.26Å; Q91-R703 PolarHBondContact NE2-OXT 2.94Å
92	N	88.3	Confident	88.1	Confident	58 Å²	58	41 Å²	41	31%	0.31	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.2	24.7	176.2	-51.3	-36.4	0	0	0	115	Y42 F43	Y42-N92 WeakPolarHBondContact CD2-O 3.27Å; Y42-N92 HydrophobicContact CE2-CB 4.33Å; F43-N92 HydrophobicContact CD1-CB 4.15Å; F43-N92 WeakPolarHBondContact CD1-O 3.46Å; F43-N92 HydrophobicContact CD2-CB 3.92Å; F43-N92 HydrophobicContact CE1-CB 3.88Å; F43-N92 WeakPolarHBondContact CE1-O 3.48Å; F43-N92 HydrophobicContact CE2-CB 3.63Å; F43-N92 HydrophobicContact CG-CB 4.16Å; F43-N92 HydrophobicContact CZ-CB 3.61Å; F43-N92 PolarHBondContact N-O 3.27Å; F43-N92 WeakPolarHBondContact O-CB 3.5Å
93	V	90.3	Very high	87.9	Confident	37 Å²	37	46.4 Å²	46.4	22%	0.224	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	132.4	173.5	-176.9	0	0	0	0	108.3	L40 K41 Y42 I84 Q91	L40-V93 HydrophobicContact CD1-CG1 3.62Å; L40-V93 HydrophobicContact CG-CG1 4.42Å; K41-V93 WeakPolarHBondContact O-CA 3.44Å; Y42-V93 HydrophobicContact CD2-CG2 3.86Å; Y42-V93 HydrophobicContact CE2-CG2 4.4Å; I84-V93 HydrophobicContact CD1-CG2 4.03Å; I84-V93 HydrophobicContact CG1-CG2 3.85Å; I84-V93 HydrophobicContact CG2-CG1 3.77Å; I84-V93 HydrophobicContact CG2-CG2 4.14Å; Q91-V93 PolarHBondContact O-N 2.93Å
94	I	92.3	Very high	87.8	Confident	84 Å²	84	46 Å²	46	43%	0.431	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	143.2	172.7	-55.9	168.5	0	0	0	106.9	L40 K41 F43	L40-I94 CarbonylContact C-O 3.56Å; L40-I94 WeakPolarHBondContact CA-O 3.42Å; K41-I94 HydrophobicContact CB-CB 4.19Å; K41-I94 PolarHBondContact N-O 3.5Å; K41-I94 PolarHBondContact O-N 2.89Å; F43-I94 HydrophobicContact CD1-CD1 4.48Å; F43-I94 HydrophobicContact CE1-CD1 4.04Å; F43-I94 HydrophobicContact CE1-CG1 4.38Å
95	G	90.1	Very high	87.5	Confident	32 Å²	32	49.3 Å²	49.3	33%	0.33	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	107.3	171.8	-175.8	0	0	0	0	0	112	E38	E38-G95 WeakPolarHBondContact O-CA 3.49Å
96	D	91.1	Very high	87	Confident	92 Å²	92	52 Å²	52	49%	0.492	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	143.7	-169.2	-67.7	-44.7	0	0	0	111.6	F37 E38 L103	F37-D96 CarbonylContact C-O 3.58Å; F37-D96 VanDerWaalsContact CA-O 3.25Å; F37-D96 WeakPolarHBondContact CA-O 3.36Å; E38-D96 PolarHBondContact N-O 2.94Å; E38-D96 PolarHBondContact O-N 3.41Å; E38-D96 VanDerWaalsContact O-N 3.14Å; D96-L103 HydrophobicContact CB-CD1 3.98Å
97	V	92.8	Very high	86.4	Confident	8 Å²	8	55.8 Å²	55.8	5%	0.048	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	121.2	171.6	-177.6	0	0	0	0	107.3	L35 K36 F37 L40 L85 R104	L35-V97 HydrophobicContact CD1-CG1 3.74Å; L35-V97 HydrophobicContact CG-CG1 4.49Å; K36-V97 CarbonylContact O-C 3.57Å; K36-V97 WeakPolarHBondContact O-CA 3.23Å; F37-V97 HydrophobicContact CB-CG2 4.16Å; L40-V97 HydrophobicContact CD1-CG2 4.21Å; L85-V97 HydrophobicContact CD2-CG1 4.33Å; L85-V97 HydrophobicContact CD2-CG2 4.41Å; V97-R104 HydrophobicContact CB-CB 4.34Å; V97-R104 HydrophobicContact CG1-CB 4.4Å; V97-R104 WeakPolarHBondContact O-CB 3.31Å; V97-R104 PolarHBondContact O-N 3.01Å
98	T	91.9	Very high	86.1	Confident	29 Å²	29	62.1 Å²	62.1	18%	0.178	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	145	-179	53.8	0	0	0	0	110.6	K36 S102 L103	K36-T98 WeakPolarHBondContact CB-OG1 3.05Å; K36-T98 PolarHBondContact N-O 3Å; K36-T98 PolarHBondContact O-N 2.92Å; T98-S102 CarbonylContact C-O 3.54Å; T98-S102 VanDerWaalsContact CA-O 3.27Å; T98-S102 WeakPolarHBondContact CA-O 3.46Å; T98-S102 WeakPolarHBondContact CB-O 3.41Å; T98-L103 HydrophobicContact CG2-CD1 4.27Å
99	I	88.9	Confident	86.3	Confident	24 Å²	24	61 Å²	61	12%	0.123	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	111.2	176.1	-56.5	155.7	0	0	0	106.4	T33 N34 L35 S101 S102 R104 F109 I112 I193	T33-I99 HydrophobicContact CG2-CG2 4.25Å; N34-I99 CarbonylContact O-C 3.58Å; N34-I99 WeakPolarHBondContact O-CA 3.43Å; L35-I99 HydrophobicContact CD1-CG1 4.05Å; I99-S101 PolarHBondContact O-N 3.33Å; I99-S101 VanDerWaalsContact O-N 3.17Å; I99-S102 PolarHBondContact N-O 3.38Å; I99-S102 PolarHBondContact O-N 3Å; I99-S102 VanDerWaalsContact O-N 3.11Å; I99-R104 HydrophobicContact CD1-CB 3.96Å; I99-R104 HydrophobicContact CD1-CG 3.82Å; I99-R104 HydrophobicContact CG1-CB 4.29Å; I99-R104 HydrophobicContact CG1-CG 4.49Å; I99-F109 HydrophobicContact CD1-CB 4.04Å; I99-F109 HydrophobicContact CD1-CD2 3.26Å; I99-F109 HydrophobicContact CD1-CE2 3.96Å; I99-F109 HydrophobicContact CD1-CG 3.97Å; I99-F109 HydrophobicContact CG1-CD2 3.99Å; I99-F109 HydrophobicContact CG1-CE2 4.18Å; I99-I112 HydrophobicContact CD1-CD1 4.46Å; I99-I112 HydrophobicContact CG2-CD1 4.26Å; I99-I193 HydrophobicContact CG2-CD1 4.28Å
100	G	83.9	Confident	86.2	Confident	44 Å²	44	61.5 Å²	61.5	45%	0.454	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.3	-118.2	-166	0	0	0	0	0	110.4	N34	N34-G100 PolarHBondContact O-N 3.24Å
101	S	79.5	Confident	86	Confident	123 Å²	123	63.3 Å²	63.3	86%	0.86	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	-7.2	179.9	55.4	0	0	0	0	114.8	I99	I99-S101 PolarHBondContact O-N 3.33Å; I99-S101 VanDerWaalsContact O-N 3.17Å
102	S	86.4	Confident	86.1	Confident	75 Å²	75	60.4 Å²	60.4	52%	0.524	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	146	-170.3	-62.3	0	0	0	0	112.6	T98 I99	T98-S102 CarbonylContact C-O 3.54Å; T98-S102 VanDerWaalsContact CA-O 3.27Å; T98-S102 WeakPolarHBondContact CA-O 3.46Å; T98-S102 WeakPolarHBondContact CB-O 3.41Å; I99-S102 PolarHBondContact N-O 3.38Å; I99-S102 PolarHBondContact O-N 3Å; I99-S102 VanDerWaalsContact O-N 3.11Å
103	L	88.1	Confident	86.2	Confident	115 Å²	115	58.1 Å²	58.1	60%	0.602	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.3	139.2	171.4	-170.1	70.6	0	0	0	110.3	D96 T98 N105	D96-L103 HydrophobicContact CB-CD1 3.98Å; T98-L103 HydrophobicContact CG2-CD1 4.27Å; L103-N105 PolarHBondContact O-N 3.39Å; L103-N105 VanDerWaalsContact O-N 3.08Å
104	R	87.7	Confident	86.2	Confident	40 Å²	40	56.5 Å²	56.5	15%	0.151	32%	0.319	C	S	.	.			trans	-64.2	111	-177	176.3	176.7	72.3	168.6	2.2	112	I84 L85 V97 I99 F109	I84-R104 PolarHBondContact O-NH1 3.33Å; I84-R104 PolarHBondContact O-NH2 2.86Å; L85-R104 PolarHBondContact O-NH1 2.94Å; V97-R104 HydrophobicContact CB-CB 4.34Å; V97-R104 HydrophobicContact CG1-CB 4.4Å; V97-R104 WeakPolarHBondContact O-CB 3.31Å; V97-R104 PolarHBondContact O-N 3.01Å; I99-R104 HydrophobicContact CD1-CB 3.96Å; I99-R104 HydrophobicContact CD1-CG 3.82Å; I99-R104 HydrophobicContact CG1-CB 4.29Å; I99-R104 HydrophobicContact CG1-CG 4.49Å; R104-F109 HydrophobicContact CG-CB 3.93Å; R104-F109 HydrophobicContact CG-CD1 4.37Å; R104-F109 HydrophobicContact CG-CD2 4.46Å; R104-F109 HydrophobicContact CG-CG 4Å
105	N	85.5	Confident	86.1	Confident	68 Å²	68	52.6 Å²	52.6	36%	0.364	30%	0.298	S	S	.	.			trans	-82.1	116.6	160.1	-175.8	-43.9	0	0	0	109.9	L103 Q107 Q108 F109	L103-N105 PolarHBondContact O-N 3.39Å; L103-N105 VanDerWaalsContact O-N 3.08Å; N105-Q107 VanDerWaalsContact C-N 3.29Å; N105-Q107 PolarHBondContact O-N 3.08Å; N105-Q107 WeakPolarHBondContact OD1-CB 3.31Å; N105-Q107 PolarHBondContact OD1-N 2.99Å; N105-Q108 HydrophobicContact CB-CB 4.37Å; N105-Q108 HydrophobicContact CB-CG 4.46Å; N105-Q108 PolarHBondContact O-N 2.97Å; N105-F109 WeakPolarHBondContact O-CB 3.42Å; N105-F109 PolarHBondContact O-N 3.04Å
106	L	82.6	Confident	86.1	Confident	56 Å²	56	51.4 Å²	51.4	29%	0.293	28%	0.284	S	S	.	.	H	α-helix	trans	-60.3	-32	-176.5	-68.7	171.7	0	0	0	114.3	T90 R110	T90-L106 HydrophobicContact CG2-CD1 3.57Å; T90-L106 HydrophobicContact CG2-CD2 4.17Å; L106-R110 WeakPolarHBondContact O-CG 3.37Å; L106-R110 PolarHBondContact O-N 3.23Å
107	Q	76.7	Confident	86	Confident	83 Å²	83	50.1 Å²	50.1	39%	0.388	28%	0.277	S	S	.	.	H	α-helix	trans	-70.8	-46	-179.8	-67	170	-23.4	0	0	111	N105 D413	N105-Q107 VanDerWaalsContact C-N 3.29Å; N105-Q107 PolarHBondContact O-N 3.08Å; N105-Q107 WeakPolarHBondContact OD1-CB 3.31Å; N105-Q107 PolarHBondContact OD1-N 2.99Å; Q107-D413 PolarHBondContact NE2-OD1 3.48Å; Q107-D413 PolarHBondContact NE2-OD2 3.26Å
108	Q	80.6	Confident	85.6	Confident	133 Å²	133	53.4 Å²	53.4	62%	0.621	29%	0.291	S	S	*	.	H	α-helix	trans	-71.1	-40.7	177.8	-65.9	179.1	-2.7	0	0	111.1	N105 R110 K111 I112	N105-Q108 HydrophobicContact CB-CB 4.37Å; N105-Q108 HydrophobicContact CB-CG 4.46Å; N105-Q108 PolarHBondContact O-N 2.97Å; Q108-R110 VanDerWaalsContact C-N 3.29Å; Q108-R110 PolarHBondContact O-N 2.92Å; Q108-K111 WeakPolarHBondContact O-CB 2.88Å; Q108-K111 PolarHBondContact O-N 2.97Å; Q108-I112 PolarHBondContact O-N 2.87Å
109	F	86.4	Confident	85.1	Confident	1 Å²	1	57.6 Å²	57.6	0%	0.004	31%	0.313	C	S	.	.	H	α-helix	trans	-58.1	-40.6	179.9	-177.7	-115.7	0	0	0	112.7	L35 L85 I99 R104 N105 K111 I112 S113 I193 F195	L35-F109 HydrophobicContact CD1-CE2 4.15Å; L35-F109 HydrophobicContact CD1-CZ 4.36Å; L85-F109 WeakPolarHBondContact O-CE1 3.46Å; L85-F109 VanDerWaalsContact O-CZ 3.22Å; L85-F109 WeakPolarHBondContact O-CZ 3.42Å; I99-F109 HydrophobicContact CD1-CB 4.04Å; I99-F109 HydrophobicContact CD1-CD2 3.26Å; I99-F109 HydrophobicContact CD1-CE2 3.96Å; I99-F109 HydrophobicContact CD1-CG 3.97Å; I99-F109 HydrophobicContact CG1-CD2 3.99Å; I99-F109 HydrophobicContact CG1-CE2 4.18Å; R104-F109 HydrophobicContact CG-CB 3.93Å; R104-F109 HydrophobicContact CG-CD1 4.37Å; R104-F109 HydrophobicContact CG-CD2 4.46Å; R104-F109 HydrophobicContact CG-CG 4Å; N105-F109 WeakPolarHBondContact O-CB 3.42Å; N105-F109 PolarHBondContact O-N 3.04Å; F109-K111 PolarHBondContact O-N 3.44Å; F109-I112 HydrophobicContact CD2-CD1 4.36Å; F109-I112 HydrophobicContact CD2-CG1 4.24Å; F109-I112 CarbonylContact O-C 3.56Å; F109-I112 WeakPolarHBondContact O-CG1 3.38Å; F109-I112 PolarHBondContact O-N 3.38Å; F109-I112 VanDerWaalsContact O-N 3.1Å; F109-S113 WeakPolarHBondContact CE1-OG 3.49Å; F109-S113 WeakPolarHBondContact O-CB 3.43Å; F109-S113 PolarHBondContact O-N 2.97Å; F109-S113 PolarHBondContact O-OG 2.95Å; F109-I193 HydrophobicContact CE2-CD1 3.83Å; F109-F195 HydrophobicContact CE1-CE2 4.3Å; F109-F195 AromaticContact CZ-CE2 3.76Å; F109-F195 HydrophobicContact CZ-CE2 3.76Å; F109-F195 AromaticContact CZ-CZ 3.92Å; F109-F195 HydrophobicContact CZ-CZ 3.92Å
110	R	80.9	Confident	84.6	Confident	29 Å²	29	59 Å²	59	11%	0.109	32%	0.32	C	S	.	.	H	α-helix	trans	-67.6	-14.6	176.7	-74.3	178.2	-179.5	152.1	2.8	114.5	G87 L106 Q108 R416 S512	G87-R110 PolarHBondContact O-NH2 3Å; L106-R110 WeakPolarHBondContact O-CG 3.37Å; L106-R110 PolarHBondContact O-N 3.23Å; Q108-R110 VanDerWaalsContact C-N 3.29Å; Q108-R110 PolarHBondContact O-N 2.92Å; R110-R416 VanDerWaalsContact NH1-NH2 3.14Å; R110-S512 PolarHBondContact O-OG 3.19Å
111	K	78.8	Confident	84.6	Confident	94 Å²	94	58.4 Å²	58.4	41%	0.409	31%	0.307	S	S	.	.	H	α-helix	trans	-82.7	-29.7	172.1	-64.7	-177.5	175.3	-177.6	0	111.7	Q108 F109 E417	Q108-K111 WeakPolarHBondContact O-CB 2.88Å; Q108-K111 PolarHBondContact O-N 2.97Å; F109-K111 PolarHBondContact O-N 3.44Å; K111-E417 WeakPolarHBondContact CE-O 3.32Å; K111-E417 VanDerWaalsContact NZ-CB 3.34Å; K111-E417 IonicContact NZ-OE2 3.19Å; K111-E417 PolarHBondContact NZ-OE2 3.49Å
112	I	85.7	Confident	85.2	Confident	44 Å²	44	53.6 Å²	53.6	23%	0.226	27%	0.271	C	S	.	.	H	α-helix	trans	-105.1	-2	-176.1	65.2	166.4	0	0	0	113.9	I99 Q108 F109 P192 I193	I99-I112 HydrophobicContact CD1-CD1 4.46Å; I99-I112 HydrophobicContact CG2-CD1 4.26Å; Q108-I112 PolarHBondContact O-N 2.87Å; F109-I112 HydrophobicContact CD2-CD1 4.36Å; F109-I112 HydrophobicContact CD2-CG1 4.24Å; F109-I112 CarbonylContact O-C 3.56Å; F109-I112 WeakPolarHBondContact O-CG1 3.38Å; F109-I112 PolarHBondContact O-N 3.38Å; F109-I112 VanDerWaalsContact O-N 3.1Å; I112-P192 HydrophobicContact CB-CG 3.93Å; I112-P192 WeakPolarHBondContact O-CD 3.3Å; I112-P192 VanDerWaalsContact O-CG 3.32Å; I112-P192 WeakPolarHBondContact O-CG 3.42Å; I112-I193 PolarHBondContact O-N 3.2Å
113	S	89	Confident	85.4	Confident	9 Å²	9	51.2 Å²	51.2	6%	0.063	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	150.9	178.6	62	0	0	0	0	111.8	F109 I193	F109-S113 WeakPolarHBondContact CE1-OG 3.49Å; F109-S113 WeakPolarHBondContact O-CB 3.43Å; F109-S113 PolarHBondContact O-N 2.97Å; F109-S113 PolarHBondContact O-OG 2.95Å; S113-I193 VanDerWaalsContact CA-O 3.24Å; S113-I193 WeakPolarHBondContact CA-O 3.37Å
114	C	90.5	Very high	85.6	Confident	3 Å²	3	48.3 Å²	48.3	2%	0.02	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	150	168.5	73	0	0	0	0	111.3	E186 P191 I193 F195	C114-E186 HydrophobicContact CB-CB 4.44Å; C114-P191 HydrophobicContact CB-CB 4.33Å; C114-P191 HydrophobicContact CB-CG 3.97Å; C114-P191 VanDerWaalsContact SG-CG 3.55Å; C114-I193 PolarHBondContact N-O 3.33Å; C114-F195 WeakPolarHBondContact O-CD2 3.21Å; C114-F195 PolarHBondContact O-N 3.49Å
115	Y	91	Very high	85.8	Confident	2 Å²	2	47.8 Å²	47.8	1%	0.008	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	122.6	175.9	-171.9	-88.3	0	0	0	109.9	M82 N83 A86 Y88 M117 F195 D197 N511	M82-Y115 HydrophobicContact CE-CE2 3.57Å; M82-Y115 WeakPolarHBondContact CE-OH 3.48Å; M82-Y115 HydrophobicContact CG-CE2 3.88Å; M82-Y115 HydrophobicContact SD-CE2 4.14Å; N83-Y115 PolarHBondContact OD1-OH 2.93Å; A86-Y115 HydrophobicContact CB-CD2 3.43Å; A86-Y115 VanDerWaalsContact CB-CD2 3.43Å; A86-Y115 HydrophobicContact CB-CE2 4.03Å; A86-Y115 HydrophobicContact CB-CG 4.27Å; Y88-Y115 HydrophobicContact CE1-CD1 4.2Å; Y88-Y115 HydrophobicContact CE1-CG 4.45Å; Y88-Y115 HydrophobicContact CE2-CG 4.23Å; Y115-M117 HydrophobicContact CD1-CG 3.85Å; Y115-M117 HydrophobicContact CE1-CB 4.37Å; Y115-M117 HydrophobicContact CE1-CG 3.82Å; Y115-F195 HydrophobicContact CD2-CB 3.51Å; Y115-F195 HydrophobicContact CD2-CG 4.21Å; Y115-F195 HydrophobicContact CE2-CB 4.13Å; Y115-F195 HydrophobicContact CG-CB 4.32Å; Y115-D197 HydrophobicContact CE1-CB 4.43Å; Y115-D197 PolarHBondContact OH-OD2 2.89Å; Y115-N511 PolarHBondContact N-OD1 2.7Å; Y115-N511 VanDerWaalsContact N-OD1 3.13Å; Y115-N511 PolarHBondContact O-ND2 3.21Å; Y115-N511 PolarHBondContact O-OD1 3.11Å
116	I	91.2	Very high	86.2	Confident	7 Å²	7	44.9 Å²	44.9	4%	0.036	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	116.4	175.2	-67	164.5	0	0	0	107.5	I183 E186 M194 F195 F196 D197	I116-I183 HydrophobicContact CD1-CG1 4.28Å; I116-E186 HydrophobicContact CD1-CB 4.08Å; I116-E186 HydrophobicContact CD1-CG 4.16Å; I116-E186 HydrophobicContact CG1-CB 4.33Å; I116-E186 HydrophobicContact CG1-CG 3.88Å; I116-M194 HydrophobicContact CD1-CE 4.42Å; I116-F195 PolarHBondContact N-O 2.95Å; I116-F196 HydrophobicContact CB-CD1 3.99Å; I116-F196 HydrophobicContact CB-CE1 4.36Å; I116-F196 HydrophobicContact CD1-CD1 3.78Å; I116-F196 HydrophobicContact CD1-CE1 3.24Å; I116-F196 HydrophobicContact CD1-CZ 3.79Å; I116-F196 HydrophobicContact CG1-CD1 4.46Å; I116-F196 HydrophobicContact CG1-CE1 4.34Å; I116-F196 HydrophobicContact CG2-CD1 4.22Å; I116-D197 PolarHBondContact O-N 3.28Å
117	M	87.2	Confident	86.8	Confident	66 Å²	66	42.6 Å²	42.6	33%	0.325	21%	0.213	S	C	.	.			trans	-73.1	167.2	-179.3	-50.9	-172.1	75	0	0	111.3	Y115 L121 K179 R507	Y115-M117 HydrophobicContact CD1-CG 3.85Å; Y115-M117 HydrophobicContact CE1-CB 4.37Å; Y115-M117 HydrophobicContact CE1-CG 3.82Å; M117-L121 HydrophobicContact SD-CD1 4.14Å; M117-K179 PolarHBondContact O-NZ 3.32Å; M117-R507 HydrophobicContact SD-CB 4.26Å; M117-R507 HydrophobicContact SD-CG 4.48Å
118	Q	85.3	Confident	87.8	Confident	77 Å²	77	38.7 Å²	38.7	36%	0.36	19%	0.194	S	C	.	.	S	Bend	trans	-59	-52.3	176.7	180	172.7	12.8	0	0	111.3	K179 D197 E198 S201	Q118-K179 PolarHBondContact O-NZ 3.25Å; Q118-D197 VanDerWaalsContact CA-O 3.27Å; Q118-D197 WeakPolarHBondContact CA-O 3.42Å; Q118-D197 HydrophobicContact CB-CB 4.4Å; Q118-E198 HydrophobicContact CG-CB 4.22Å; Q118-E198 PolarHBondContact NE2-OE2 3.43Å; Q118-S201 PolarHBondContact NE2-OG 3.4Å
119	D	81.3	Confident	88.6	Confident	117 Å²	117	33.5 Å²	33.5	63%	0.626	17%	0.171	S	C	*	.	S	Bend	trans	-76.9	128.8	176.5	-65.8	-31.7	0	0	0	111.7	L121	D119-L121 VanDerWaalsContact C-N 3.33Å; D119-L121 HydrophobicContact CB-CD2 4.12Å; D119-L121 HydrophobicContact CB-CG 4.3Å; D119-L121 PolarHBondContact O-N 3.34Å
120	D	79	Confident	89.1	Confident	52 Å²	52	36 Å²	36	28%	0.278	18%	0.183	S	C	.	.			trans	-78.1	82.5	175.8	-65	-29.5	0	0	0	110.7	L122 K179	D120-L122 PolarHBondContact O-N 3.19Å; D120-K179 WeakPolarHBondContact OD1-CD 3.41Å; D120-K179 IonicContact OD1-NZ 3.94Å; D120-K179 PolarHBondContact OD1-NZ 2.93Å; D120-K179 WeakPolarHBondContact OD2-CA 3.46Å; D120-K179 VanDerWaalsContact OD2-CD 3.3Å; D120-K179 WeakPolarHBondContact OD2-CD 3.43Å; D120-K179 PolarHBondContact OD2-N 3.4Å
121	L	83.2	Confident	89.8	Confident	33 Å²	33	34.8 Å²	34.8	17%	0.173	18%	0.179	C	C	.	.			trans	-72	61.3	-176	-63.1	176.9	0	0	0	113.6	M117 D119 I504 R507	M117-L121 HydrophobicContact SD-CD1 4.14Å; D119-L121 VanDerWaalsContact C-N 3.33Å; D119-L121 HydrophobicContact CB-CD2 4.12Å; D119-L121 HydrophobicContact CB-CG 4.3Å; D119-L121 PolarHBondContact O-N 3.34Å; L121-I504 HydrophobicContact CB-CG1 4.09Å; L121-R507 HydrophobicContact CD1-CB 4.46Å; L121-R507 PolarHBondContact O-NH1 3.13Å; L121-R507 PolarHBondContact O-NH2 3.49Å
122	L	91.2	Very high	90.6	Very high	21 Å²	21	30.3 Å²	30.3	11%	0.11	16%	0.159	C	C	.	.			trans	-91.1	149.7	-177.6	-61	170.9	0	0	0	112.2	D120 K178 L181 A182	D120-L122 PolarHBondContact O-N 3.19Å; L122-K178 HydrophobicContact CD1-CB 4.15Å; L122-K178 HydrophobicContact CD1-CG 4.44Å; L122-L181 HydrophobicContact CD1-CB 4.38Å; L122-L181 HydrophobicContact CD1-CD2 4.02Å; L122-L181 HydrophobicContact CD1-CG 4.28Å; L122-L181 HydrophobicContact CD2-CG 4.46Å; L122-A182 HydrophobicContact CD2-CB 4.37Å
123	L	91.9	Very high	91.1	Very high	25 Å²	25	28.8 Å²	28.8	13%	0.131	15%	0.152	C	C	.	.			trans	-74.1	119.5	173.9	-72.7	169	0	0	0	110.1	H125 L126 T170 R432 I504	L123-H125 VanDerWaalsContact C-N 3.33Å; L123-H125 PolarHBondContact O-N 2.78Å; L123-L126 HydrophobicContact CB-CD1 3.99Å; L123-L126 HydrophobicContact CB-CG 4.26Å; L123-L126 HydrophobicContact CD1-CD1 3.71Å; L123-T170 PolarHBondContact O-OG1 3.26Å; L123-R432 HydrophobicContact CD1-CG 3.97Å; L123-I504 HydrophobicContact CD2-CD1 3.77Å; L123-I504 HydrophobicContact CD2-CG2 4.45Å; L123-I504 HydrophobicContact CG-CD1 4.34Å; L123-I504 HydrophobicContact CG-CG2 4.39Å
124	P	91.1	Very high	91.4	Very high	54 Å²	54	29 Å²	29	35%	0.351	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-21.8	-165.4	25.3	-35	0	0	0	115.6	T170 S171	P124-T170 WeakPolarHBondContact CA-OG1 3.46Å; P124-T170 PolarHBondContact O-OG1 2.98Å; P124-T170 VanDerWaalsContact O-OG1 3.13Å; P124-S171 VanDerWaalsContact O-CB 3.28Å; P124-S171 WeakPolarHBondContact O-CB 3.3Å; P124-S171 PolarHBondContact O-N 2.75Å; P124-S171 VanDerWaalsContact O-N 3.16Å; P124-S171 PolarHBondContact O-OG 3.05Å
125	H	92.2	Very high	91.5	Very high	30 Å²	30	28.9 Å²	28.9	14%	0.139	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-3.5	-168.3	-59.1	-48.8	0	0	0	114.5	L123 S436 R439 D440	L123-H125 VanDerWaalsContact C-N 3.33Å; L123-H125 PolarHBondContact O-N 2.78Å; H125-S436 PolarHBondContact CD2-O 3.21Å; H125-R439 HydrophobicContact CB-CB 4.06Å; H125-R439 WeakPolarHBondContact O-CD 3.36Å; H125-R439 PolarHBondContact O-NH1 2.87Å; H125-D440 IonicContact CD2-OD2 3.61Å; H125-D440 IonicContact CE1-OD2 2.7Å; H125-D440 WeakPolarHBondContact NE2-CB 3.43Å; H125-D440 IonicContact NE2-OD1 3.9Å; H125-D440 IonicContact NE2-OD2 2.71Å; H125-D440 PolarHBondContact NE2-OD2 3.15Å
126	L	94.4	Very high	91.7	Very high	6 Å²	6	28.8 Å²	28.8	3%	0.031	15%	0.152	C	C	.	.	S	Bend	trans	-88.4	148.8	174.9	-61.6	179.2	0	0	0	110.4	L123 E130 A131 R169 T170 R432 L435	L123-L126 HydrophobicContact CB-CD1 3.99Å; L123-L126 HydrophobicContact CB-CG 4.26Å; L123-L126 HydrophobicContact CD1-CD1 3.71Å; L126-E130 WeakPolarHBondContact CA-OE2 3.36Å; L126-E130 HydrophobicContact CB-CB 4.35Å; L126-E130 HydrophobicContact CD2-CB 4.42Å; L126-A131 HydrophobicContact CB-CB 4.29Å; L126-R169 WeakPolarHBondContact O-CA 3.27Å; L126-T170 WeakPolarHBondContact O-CG2 3.37Å; L126-T170 PolarHBondContact O-N 2.86Å; L126-R432 HydrophobicContact CD1-CG 3.91Å; L126-L435 HydrophobicContact CD2-CD2 3.94Å
127	S	96.3	Very high	91.8	Very high	9 Å²	9	30.3 Å²	30.3	6%	0.063	16%	0.16	C	C	.	.	B	Isolated β-bridge	trans	-75.5	163.6	166.3	68.3	0	0	0	0	111.2	D129 E130 A131 T168	S127-D129 PolarHBondContact O-N 3.14Å; S127-E130 PolarHBondContact N-OE2 2.86Å; S127-E130 PolarHBondContact O-N 3.01Å; S127-E130 VanDerWaalsContact OG-CD 3.23Å; S127-E130 VanDerWaalsContact OG-CG 3.22Å; S127-E130 WeakPolarHBondContact OG-CG 3.48Å; S127-E130 PolarHBondContact OG-N 2.93Å; S127-E130 PolarHBondContact OG-OE2 2.83Å; S127-A131 VanDerWaalsContact O-CB 3.22Å; S127-A131 WeakPolarHBondContact O-CB 3.2Å; S127-A131 PolarHBondContact O-N 2.95Å; S127-T168 WeakPolarHBondContact CA-O 3.47Å
128	V	96.8	Very high	92.1	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-52	-46.5	171.6	169.4	0	0	0	0	110.6	A131 M132 A165 L166 T168 L173 L181	V128-A131 PolarHBondContact O-N 3.31Å; V128-M132 WeakPolarHBondContact O-CB 3.44Å; V128-M132 VanDerWaalsContact O-CG 3.29Å; V128-M132 WeakPolarHBondContact O-CG 3.38Å; V128-M132 PolarHBondContact O-N 2.97Å; V128-A165 HydrophobicContact CG2-CB 4.29Å; V128-A165 WeakPolarHBondContact CG2-O 3.44Å; V128-L166 WeakPolarHBondContact CB-O 3.05Å; V128-T168 PolarHBondContact N-O 2.83Å; V128-T168 VanDerWaalsContact N-O 3.16Å; V128-L173 HydrophobicContact CG2-CD1 3.77Å; V128-L173 HydrophobicContact CG2-CD2 4.1Å; V128-L173 HydrophobicContact CG2-CG 4.5Å; V128-L181 HydrophobicContact CG1-CD1 4.07Å; V128-L181 HydrophobicContact CG2-CD2 4.17Å
129	D	96.9	Very high	92.3	Very high	25 Å²	25	24.1 Å²	24.1	13%	0.134	13%	0.13	C	C	.	.	H	α-helix	trans	-59.8	-49.5	179.5	-166.8	64.4	0	0	0	112.9	S127 M132 M133 R150 L166	S127-D129 PolarHBondContact O-N 3.14Å; D129-M132 PolarHBondContact O-N 2.99Å; D129-M133 WeakPolarHBondContact O-CB 3.33Å; D129-M133 WeakPolarHBondContact O-CG 3.42Å; D129-M133 PolarHBondContact O-N 2.88Å; D129-R150 IonicContact OD1-CZ 3.58Å; D129-R150 IonicContact OD1-NH1 2.69Å; D129-R150 PolarHBondContact OD1-NH1 2.93Å; D129-R150 IonicContact OD1-NH2 3.18Å; D129-R150 PolarHBondContact OD1-NH2 2.63Å; D129-R150 IonicContact OD2-CZ 3.81Å; D129-R150 IonicContact OD2-NH1 2.91Å; D129-R150 PolarHBondContact OD2-NH1 2.8Å; D129-R150 IonicContact OD2-NH2 3.83Å; D129-L166 HydrophobicContact CB-CD1 3.8Å; D129-L166 HydrophobicContact CB-CG 4.13Å; D129-L166 PolarHBondContact N-O 2.92Å
130	E	96.5	Very high	92.7	Very high	52 Å²	52	19.6 Å²	19.6	24%	0.243	11%	0.106	C	C	.	.	H	α-helix	trans	-66.7	-40.9	-179.2	-70.4	162.1	179.3	0	0	112	L126 S127 M132 M133 C134 R439	L126-E130 WeakPolarHBondContact CA-OE2 3.36Å; L126-E130 HydrophobicContact CB-CB 4.35Å; L126-E130 HydrophobicContact CD2-CB 4.42Å; S127-E130 PolarHBondContact N-OE2 2.86Å; S127-E130 PolarHBondContact O-N 3.01Å; S127-E130 VanDerWaalsContact OG-CD 3.23Å; S127-E130 VanDerWaalsContact OG-CG 3.22Å; S127-E130 WeakPolarHBondContact OG-CG 3.48Å; S127-E130 PolarHBondContact OG-N 2.93Å; S127-E130 PolarHBondContact OG-OE2 2.83Å; E130-M132 VanDerWaalsContact C-N 3.3Å; E130-M132 PolarHBondContact O-N 3.4Å; E130-M133 PolarHBondContact O-N 3.31Å; E130-C134 WeakPolarHBondContact O-CB 3.46Å; E130-C134 PolarHBondContact O-N 3.38Å; E130-R439 IonicContact OE1-CZ 3.57Å; E130-R439 IonicContact OE1-NH1 2.77Å; E130-R439 PolarHBondContact OE1-NH1 3.11Å; E130-R439 IonicContact OE1-NH2 2.79Å; E130-R439 PolarHBondContact OE1-NH2 2.77Å; E130-R439 IonicContact OE2-CZ 3.45Å; E130-R439 IonicContact OE2-NH1 2.81Å; E130-R439 PolarHBondContact OE2-NH1 3.01Å; E130-R439 IonicContact OE2-NH2 3.42Å
131	A	96.1	Very high	93	Very high	4 Å²	4	19.7 Å²	19.7	3%	0.033	11%	0.11	C	C	.	.	H	α-helix	trans	-63.5	-38.3	177.7	0	0	0	0	0	111.2	L126 S127 V128 S135 Q185	L126-A131 HydrophobicContact CB-CB 4.29Å; S127-A131 VanDerWaalsContact O-CB 3.22Å; S127-A131 WeakPolarHBondContact O-CB 3.2Å; S127-A131 PolarHBondContact O-N 2.95Å; V128-A131 PolarHBondContact O-N 3.31Å; A131-S135 PolarHBondContact O-N 3.05Å; A131-Q185 PolarHBondContact O-NE2 3.23Å; A131-Q185 VanDerWaalsContact O-NE2 3.17Å
132	M	96.3	Very high	92.8	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-71.8	-45.9	175.4	-76.1	-60.9	-67.1	0	0	112.5	V128 D129 E130 C134 S135 A136 V153 I156 I157 L181 A184 Q185 V188	V128-M132 WeakPolarHBondContact O-CB 3.44Å; V128-M132 VanDerWaalsContact O-CG 3.29Å; V128-M132 WeakPolarHBondContact O-CG 3.38Å; V128-M132 PolarHBondContact O-N 2.97Å; D129-M132 PolarHBondContact O-N 2.99Å; E130-M132 VanDerWaalsContact C-N 3.3Å; E130-M132 PolarHBondContact O-N 3.4Å; M132-C134 VanDerWaalsContact C-N 3.28Å; M132-C134 PolarHBondContact O-N 2.9Å; M132-S135 PolarHBondContact O-N 3.46Å; M132-A136 WeakPolarHBondContact O-CB 2.99Å; M132-A136 PolarHBondContact O-N 3.16Å; M132-V153 HydrophobicContact CB-CG1 3.63Å; M132-V153 HydrophobicContact CB-CG2 4.35Å; M132-V153 HydrophobicContact CE-CG1 4.41Å; M132-V153 HydrophobicContact CE-CG2 4.49Å; M132-V153 HydrophobicContact CG-CG1 4.41Å; M132-I156 HydrophobicContact CE-CB 4.06Å; M132-I156 HydrophobicContact CE-CD1 4.24Å; M132-I156 HydrophobicContact CE-CG2 3.71Å; M132-I157 HydrophobicContact CG-CD1 4.29Å; M132-I157 HydrophobicContact CG-CG1 4.36Å; M132-L181 HydrophobicContact CG-CD1 4.03Å; M132-L181 HydrophobicContact SD-CD1 4.1Å; M132-A184 HydrophobicContact CE-CB 3.95Å; M132-A184 HydrophobicContact SD-CB 3.48Å; M132-A184 WeakPolarHBondContact SD-CB 3.22Å; M132-Q185 HydrophobicContact SD-CG 3.95Å; M132-V188 HydrophobicContact CE-CG2 3.82Å
133	M	95.8	Very high	92.5	Very high	13 Å²	13	29.4 Å²	29.4	6%	0.064	15%	0.151	C	C	.	.	H	α-helix	trans	-64.2	-34.5	177	-73.9	-56.8	-57.1	0	0	112	D129 E130 A136 N137 Y146 V153	D129-M133 WeakPolarHBondContact O-CB 3.33Å; D129-M133 WeakPolarHBondContact O-CG 3.42Å; D129-M133 PolarHBondContact O-N 2.88Å; E130-M133 PolarHBondContact O-N 3.31Å; M133-A136 PolarHBondContact O-N 3.19Å; M133-N137 WeakPolarHBondContact O-CB 3.34Å; M133-N137 VanDerWaalsContact O-CG 3.28Å; M133-N137 PolarHBondContact O-N 3.05Å; M133-N137 PolarHBondContact O-ND2 3.14Å; M133-N137 VanDerWaalsContact O-ND2 3.14Å; M133-Y146 HydrophobicContact CE-CD2 3.99Å; M133-Y146 HydrophobicContact CE-CE2 3.34Å; M133-V153 HydrophobicContact SD-CB 4.23Å; M133-V153 HydrophobicContact SD-CG1 4.32Å; M133-V153 HydrophobicContact SD-CG2 3.93Å
134	C	95	Very high	92.1	Very high	13 Å²	13	30.3 Å²	30.3	9%	0.088	16%	0.158	C	C	.	.	H	α-helix	trans	-63.2	-48	172.5	-175.9	0	0	0	0	111.5	E130 M132 A136 N137 L138 R432	E130-C134 WeakPolarHBondContact O-CB 3.46Å; E130-C134 PolarHBondContact O-N 3.38Å; M132-C134 VanDerWaalsContact C-N 3.28Å; M132-C134 PolarHBondContact O-N 2.9Å; C134-A136 PolarHBondContact O-N 3.19Å; C134-N137 PolarHBondContact O-N 3.02Å; C134-L138 WeakPolarHBondContact O-CD1 3.19Å; C134-L138 WeakPolarHBondContact O-CG 3.34Å; C134-L138 PolarHBondContact O-N 2.9Å; C134-R432 VanDerWaalsContact SG-CD 3.5Å
135	S	93.9	Very high	92.1	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-58.7	-46.5	174.4	-179.9	0	0	0	0	111.5	A131 M132 N137 L138 K139 Q185	A131-S135 PolarHBondContact O-N 3.05Å; M132-S135 PolarHBondContact O-N 3.46Å; S135-N137 VanDerWaalsContact C-N 3.32Å; S135-N137 PolarHBondContact O-N 3.05Å; S135-L138 PolarHBondContact O-N 3.49Å; S135-L138 VanDerWaalsContact O-N 3.11Å; S135-K139 WeakPolarHBondContact O-CB 3.45Å; S135-K139 WeakPolarHBondContact O-CG 3.19Å; S135-K139 PolarHBondContact O-N 3.29Å; S135-K139 WeakPolarHBondContact OG-CD 3.39Å; S135-Q185 PolarHBondContact OG-O 2.97Å
136	A	94.2	Very high	92.1	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-57.9	-40.5	176.5	0	0	0	0	0	113.2	M132 M133 C134 L138 L140 K149 V153 V188	M132-A136 WeakPolarHBondContact O-CB 2.99Å; M132-A136 PolarHBondContact O-N 3.16Å; M133-A136 PolarHBondContact O-N 3.19Å; C134-A136 PolarHBondContact O-N 3.19Å; A136-L138 VanDerWaalsContact C-N 3.31Å; A136-L138 PolarHBondContact O-N 3.16Å; A136-L140 HydrophobicContact CB-CD1 4.16Å; A136-L140 VanDerWaalsContact O-CB 3.25Å; A136-L140 WeakPolarHBondContact O-CB 3.48Å; A136-L140 PolarHBondContact O-N 2.84Å; A136-K149 HydrophobicContact CB-CB 4.45Å; A136-V153 HydrophobicContact CB-CG2 3.71Å; A136-V188 HydrophobicContact CB-CG1 4.16Å
137	N	93.8	Very high	92.1	Very high	40 Å²	40	42 Å²	42	21%	0.214	22%	0.219	C	C	.	.	H	α-helix	trans	-72.5	-22.8	178.7	-74.6	-32.7	0	0	0	114.1	M133 C134 S135 K149 V428	M133-N137 WeakPolarHBondContact O-CB 3.34Å; M133-N137 VanDerWaalsContact O-CG 3.28Å; M133-N137 PolarHBondContact O-N 3.05Å; M133-N137 PolarHBondContact O-ND2 3.14Å; M133-N137 VanDerWaalsContact O-ND2 3.14Å; C134-N137 PolarHBondContact O-N 3.02Å; S135-N137 VanDerWaalsContact C-N 3.32Å; S135-N137 PolarHBondContact O-N 3.05Å; N137-K149 WeakPolarHBondContact OD1-CD 3.23Å; N137-V428 HydrophobicContact CB-CG1 4.3Å; N137-V428 HydrophobicContact CB-CG2 3.88Å
138	L	93	Very high	91.9	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-94.9	-36.6	-179.1	-67.3	167.4	0	0	0	112.7	C134 S135 A136 Q425 V428 L429 W513 Y514	C134-L138 WeakPolarHBondContact O-CD1 3.19Å; C134-L138 WeakPolarHBondContact O-CG 3.34Å; C134-L138 PolarHBondContact O-N 2.9Å; S135-L138 PolarHBondContact O-N 3.49Å; S135-L138 VanDerWaalsContact O-N 3.11Å; A136-L138 VanDerWaalsContact C-N 3.31Å; A136-L138 PolarHBondContact O-N 3.16Å; L138-Q425 HydrophobicContact CD2-CB 4.3Å; L138-Q425 HydrophobicContact CD2-CG 4.31Å; L138-V428 HydrophobicContact CD1-CG1 4.18Å; L138-V428 HydrophobicContact CD2-CB 4.12Å; L138-V428 HydrophobicContact CD2-CG1 4.08Å; L138-V428 HydrophobicContact CG-CG1 3.96Å; L138-L429 HydrophobicContact CD1-CD2 4.2Å; L138-L429 HydrophobicContact CD2-CG 4.45Å; L138-W513 HydrophobicContact CD1-CE3 3.89Å; L138-W513 HydrophobicContact CD1-CZ3 4.49Å; L138-Y514 HydrophobicContact CD1-CD1 3.95Å; L138-Y514 HydrophobicContact CD1-CE1 4.33Å; L138-Y514 HydrophobicContact CD2-CD1 4.37Å
139	K	90.4	Very high	91.7	Very high	13 Å²	13	45 Å²	45	6%	0.057	24%	0.238	C	C	.	.	H	α-helix	trans	-96.5	-24.3	-173	-62.1	-175	75	-178.7	0	114.5	S135 Q185 E186 V188 N189 A419 W513	S135-K139 WeakPolarHBondContact O-CB 3.45Å; S135-K139 WeakPolarHBondContact O-CG 3.19Å; S135-K139 PolarHBondContact O-N 3.29Å; S135-K139 WeakPolarHBondContact OG-CD 3.39Å; K139-Q185 PolarHBondContact NZ-O 3.12Å; K139-E186 PolarHBondContact NZ-O 3.2Å; K139-E186 IonicContact NZ-OE2 3.6Å; K139-E186 PolarHBondContact NZ-OE2 2.86Å; K139-V188 HydrophobicContact CB-CG1 4.23Å; K139-N189 HydrophobicContact CB-CB 4.33Å; K139-N189 VanDerWaalsContact CE-CG 3.43Å; K139-N189 WeakPolarHBondContact CE-OD1 3.28Å; K139-N189 PolarHBondContact NZ-OD1 2.77Å; K139-A419 WeakPolarHBondContact O-CB 3.32Å; K139-W513 HydrophobicContact CD-CD2 4.23Å; K139-W513 HydrophobicContact CD-CG 4.25Å; K139-W513 HydrophobicContact CD-CZ2 4.43Å; K139-W513 HydrophobicContact CG-CD2 4.31Å; K139-W513 HydrophobicContact CG-CG 4.12Å
140	L	89.2	Confident	91.6	Very high	22 Å²	22	46.4 Å²	46.4	12%	0.115	24%	0.241	C	C	.	.	S	Bend	trans	-91.2	151.4	175.8	-60.1	174.2	0	0	0	110.8	A136 K149 I152 V188	A136-L140 HydrophobicContact CB-CD1 4.16Å; A136-L140 VanDerWaalsContact O-CB 3.25Å; A136-L140 WeakPolarHBondContact O-CB 3.48Å; A136-L140 PolarHBondContact O-N 2.84Å; L140-K149 HydrophobicContact CD1-CB 4.3Å; L140-K149 HydrophobicContact CD1-CG 3.88Å; L140-I152 HydrophobicContact CD1-CD1 3.85Å; L140-V188 HydrophobicContact CD1-CG1 4.14Å; L140-V188 HydrophobicContact CD2-CG1 4.22Å; L140-V188 WeakPolarHBondContact CD2-O 3.09Å; L140-V188 HydrophobicContact CG-CG1 3.86Å
141	S	84.6	Confident	91.6	Very high	53 Å²	53	50.6 Å²	50.6	37%	0.371	26%	0.259	S	S	.	.			trans	-57.1	148.5	177.5	-175.3	0	0	0	0	111.8	K143 T144	S141-K143 PolarHBondContact O-N 2.92Å; S141-K143 PolarHBondContact OG-N 3.44Å; S141-T144 WeakPolarHBondContact O-CB 3.32Å; S141-T144 PolarHBondContact O-N 2.8Å; S141-T144 VanDerWaalsContact O-N 3.16Å; S141-T144 PolarHBondContact O-OG1 2.79Å
142	E	79.9	Confident	91.4	Very high	69 Å²	69	52.8 Å²	52.8	32%	0.322	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-24.9	174	-60.3	-160.5	162.5	0	0	113.5	T144 A420 N421 T424	E142-T144 PolarHBondContact O-N 2.94Å; E142-A420 HydrophobicContact CG-CB 4.46Å; E142-N421 VanDerWaalsContact CD-ND2 3.32Å; E142-N421 WeakPolarHBondContact OE1-CA 3.24Å; E142-N421 WeakPolarHBondContact OE1-CB 3.43Å; E142-N421 PolarHBondContact OE1-N 2.61Å; E142-N421 PolarHBondContact OE2-ND2 3.42Å; E142-T424 WeakPolarHBondContact OE1-CB 3.48Å; E142-T424 PolarHBondContact OE1-OG1 3.09Å
143	K	83.2	Confident	91.4	Very high	190 Å²	190	52.8 Å²	52.8	83%	0.826	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-17.2	177.1	-62.2	-177.1	-179.7	-179.7	0	112.6	S141 N145	S141-K143 PolarHBondContact O-N 2.92Å; S141-K143 PolarHBondContact OG-N 3.44Å; K143-N145 PolarHBondContact O-N 3.14Å
144	T	85.3	Confident	91.4	Very high	43 Å²	43	54 Å²	54	26%	0.264	28%	0.276	S	S	.	.	S	Bend	trans	-80.1	115.8	179.9	-50.6	0	0	0	0	110.3	S141 E142 K149	S141-T144 WeakPolarHBondContact O-CB 3.32Å; S141-T144 PolarHBondContact O-N 2.8Å; S141-T144 VanDerWaalsContact O-N 3.16Å; S141-T144 PolarHBondContact O-OG1 2.79Å; E142-T144 PolarHBondContact O-N 2.94Å; T144-K149 HydrophobicContact CG2-CG 3.77Å; T144-K149 VanDerWaalsContact O-CE 3.25Å; T144-K149 WeakPolarHBondContact O-CE 3.1Å
145	N	91	Very high	91.3	Very high	117 Å²	117	55.6 Å²	55.6	63%	0.626	28%	0.284	S	S	*	.			trans	-57	150.7	177.9	-69.7	-9.2	0	0	0	112.2	K143 A147 S148 K149	K143-N145 PolarHBondContact O-N 3.14Å; N145-A147 VanDerWaalsContact C-N 3.29Å; N145-A147 PolarHBondContact O-N 3.12Å; N145-S148 WeakPolarHBondContact O-CB 3.42Å; N145-S148 PolarHBondContact O-N 3.3Å; N145-K149 PolarHBondContact O-N 2.65Å
146	Y	92	Very high	91.3	Very high	147 Å²	147	55.6 Å²	55.6	58%	0.576	28%	0.284	S	S	*	.	H	α-helix	trans	-53.5	-44	178.8	-179.6	-92.9	0	0	0	112.7	M133 S148 K149 R150	M133-Y146 HydrophobicContact CE-CD2 3.99Å; M133-Y146 HydrophobicContact CE-CE2 3.34Å; Y146-S148 VanDerWaalsContact C-N 3.31Å; Y146-S148 PolarHBondContact O-N 3.26Å; Y146-K149 PolarHBondContact O-N 3.28Å; Y146-R150 WeakPolarHBondContact O-CB 3.45Å; Y146-R150 PolarHBondContact O-N 3.05Å
147	A	93.1	Very high	91.4	Very high	73 Å²	73	55.6 Å²	55.6	60%	0.603	28%	0.284	S	S	*	.	H	α-helix	trans	-60.3	-39.3	177.6	0	0	0	0	0	112.6	N145 R150 K151	N145-A147 VanDerWaalsContact C-N 3.29Å; N145-A147 PolarHBondContact O-N 3.12Å; A147-R150 PolarHBondContact O-N 3.21Å; A147-K151 PolarHBondContact O-N 2.95Å
148	S	92.8	Very high	91.3	Very high	57 Å²	57	58 Å²	58	40%	0.399	30%	0.297	S	S	.	.	H	α-helix	trans	-69.2	-42.8	176.2	-53.4	0	0	0	0	111.6	N145 Y146 R150 K151 I152	N145-S148 WeakPolarHBondContact O-CB 3.42Å; N145-S148 PolarHBondContact O-N 3.3Å; Y146-S148 VanDerWaalsContact C-N 3.31Å; Y146-S148 PolarHBondContact O-N 3.26Å; S148-R150 VanDerWaalsContact C-N 3.3Å; S148-R150 PolarHBondContact O-N 2.9Å; S148-K151 PolarHBondContact O-N 2.9Å; S148-I152 WeakPolarHBondContact O-CG1 3.4Å; S148-I152 PolarHBondContact O-N 3.17Å; S148-I152 VanDerWaalsContact O-N 3.09Å
149	K	93.4	Very high	91.2	Very high	14 Å²	14	61.2 Å²	61.2	6%	0.061	31%	0.313	C	S	.	.	H	α-helix	trans	-58.1	-44.6	173.3	-67.2	-175	172.6	175	0	110.9	A136 N137 L140 T144 N145 Y146 I152 V153	A136-K149 HydrophobicContact CB-CB 4.45Å; N137-K149 WeakPolarHBondContact OD1-CD 3.23Å; L140-K149 HydrophobicContact CD1-CB 4.3Å; L140-K149 HydrophobicContact CD1-CG 3.88Å; T144-K149 HydrophobicContact CG2-CG 3.77Å; T144-K149 VanDerWaalsContact O-CE 3.25Å; T144-K149 WeakPolarHBondContact O-CE 3.1Å; N145-K149 PolarHBondContact O-N 2.65Å; Y146-K149 PolarHBondContact O-N 3.28Å; K149-I152 PolarHBondContact O-N 3.28Å; K149-V153 WeakPolarHBondContact O-CG2 3.44Å; K149-V153 PolarHBondContact O-N 3.39Å
150	R	94.9	Very high	91.2	Very high	54 Å²	54	60.9 Å²	60.9	20%	0.204	31%	0.312	C	S	.	.	H	α-helix	trans	-62	-45.3	178.5	-175.9	62.9	-173.5	-160.4	14.6	112.1	D129 Y146 A147 S148 I152 V153 D154	D129-R150 IonicContact OD1-CZ 3.58Å; D129-R150 IonicContact OD1-NH1 2.69Å; D129-R150 PolarHBondContact OD1-NH1 2.93Å; D129-R150 IonicContact OD1-NH2 3.18Å; D129-R150 PolarHBondContact OD1-NH2 2.63Å; D129-R150 IonicContact OD2-CZ 3.81Å; D129-R150 IonicContact OD2-NH1 2.91Å; D129-R150 PolarHBondContact OD2-NH1 2.8Å; D129-R150 IonicContact OD2-NH2 3.83Å; Y146-R150 WeakPolarHBondContact O-CB 3.45Å; Y146-R150 PolarHBondContact O-N 3.05Å; A147-R150 PolarHBondContact O-N 3.21Å; S148-R150 VanDerWaalsContact C-N 3.3Å; S148-R150 PolarHBondContact O-N 2.9Å; R150-I152 VanDerWaalsContact C-N 3.32Å; R150-I152 PolarHBondContact O-N 3.11Å; R150-V153 WeakPolarHBondContact O-CB 3.43Å; R150-V153 PolarHBondContact O-N 2.76Å; R150-V153 VanDerWaalsContact O-N 3.13Å; R150-D154 IonicContact CZ-OD1 2.63Å; R150-D154 IonicContact NE-OD1 3.57Å; R150-D154 PolarHBondContact NE-OD1 3.29Å; R150-D154 IonicContact NE-OD2 2.73Å; R150-D154 PolarHBondContact NE-OD2 2.81Å; R150-D154 IonicContact NH2-OD1 3.53Å; R150-D154 PolarHBondContact NH2-OD1 3.29Å; R150-D154 PolarHBondContact O-N 2.72Å
151	K	94.9	Very high	91.3	Very high	141 Å²	141	62 Å²	62	61%	0.613	33%	0.328	S	S	*	.	H	α-helix	trans	-58.6	-41.8	176	-170.7	177.6	-177.8	178.6	0	112.3	A147 S148 N155	A147-K151 PolarHBondContact O-N 2.95Å; S148-K151 PolarHBondContact O-N 2.9Å; K151-N155 WeakPolarHBondContact O-CB 3.47Å; K151-N155 PolarHBondContact O-N 3.21Å; K151-N155 PolarHBondContact O-ND2 3.08Å; K151-N155 PolarHBondContact O-OD1 2.83Å
152	I	93.3	Very high	91.8	Very high	50 Å²	50	59.5 Å²	59.5	26%	0.256	31%	0.311	S	S	.	.	H	α-helix	trans	-61.9	-46.4	175.2	-66.3	164.5	0	0	0	110.4	L140 S148 K149 R150 N155 I156	L140-I152 HydrophobicContact CD1-CD1 3.85Å; S148-I152 WeakPolarHBondContact O-CG1 3.4Å; S148-I152 PolarHBondContact O-N 3.17Å; S148-I152 VanDerWaalsContact O-N 3.09Å; K149-I152 PolarHBondContact O-N 3.28Å; R150-I152 VanDerWaalsContact C-N 3.32Å; R150-I152 PolarHBondContact O-N 3.11Å; I152-N155 PolarHBondContact O-N 3.36Å; I152-I156 HydrophobicContact CG2-CD1 3.88Å; I152-I156 WeakPolarHBondContact O-CG1 3.32Å; I152-I156 PolarHBondContact O-N 2.92Å
153	V	95.1	Very high	92.4	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-60.5	-49.6	178.3	167	0	0	0	0	111.5	M132 M133 A136 K149 R150 N155 I156 I157	M132-V153 HydrophobicContact CB-CG1 3.63Å; M132-V153 HydrophobicContact CB-CG2 4.35Å; M132-V153 HydrophobicContact CE-CG1 4.41Å; M132-V153 HydrophobicContact CE-CG2 4.49Å; M132-V153 HydrophobicContact CG-CG1 4.41Å; M133-V153 HydrophobicContact SD-CB 4.23Å; M133-V153 HydrophobicContact SD-CG1 4.32Å; M133-V153 HydrophobicContact SD-CG2 3.93Å; A136-V153 HydrophobicContact CB-CG2 3.71Å; K149-V153 WeakPolarHBondContact O-CG2 3.44Å; K149-V153 PolarHBondContact O-N 3.39Å; R150-V153 WeakPolarHBondContact O-CB 3.43Å; R150-V153 PolarHBondContact O-N 2.76Å; R150-V153 VanDerWaalsContact O-N 3.13Å; V153-N155 VanDerWaalsContact C-N 3.29Å; V153-N155 PolarHBondContact O-N 3.37Å; V153-I156 PolarHBondContact O-N 3.44Å; V153-I156 VanDerWaalsContact O-N 3.16Å; V153-I157 HydrophobicContact CG1-CD1 3.59Å; V153-I157 HydrophobicContact CG1-CG1 4.29Å; V153-I157 VanDerWaalsContact O-CG1 3.29Å; V153-I157 WeakPolarHBondContact O-CG1 3.41Å; V153-I157 PolarHBondContact O-N 3.2Å
154	D	95.7	Very high	92.9	Very high	38 Å²	38	62.4 Å²	62.4	20%	0.203	32%	0.322	C	S	.	.	H	α-helix	trans	-61.6	-38.2	-179.7	-72	-39.5	0	0	0	111.5	R150 I157 N158 R163	R150-D154 IonicContact CZ-OD1 2.63Å; R150-D154 IonicContact NE-OD1 3.57Å; R150-D154 PolarHBondContact NE-OD1 3.29Å; R150-D154 IonicContact NE-OD2 2.73Å; R150-D154 PolarHBondContact NE-OD2 2.81Å; R150-D154 IonicContact NH2-OD1 3.53Å; R150-D154 PolarHBondContact NH2-OD1 3.29Å; R150-D154 PolarHBondContact O-N 2.72Å; D154-I157 PolarHBondContact O-N 3.18Å; D154-N158 WeakPolarHBondContact O-CB 3.3Å; D154-N158 VanDerWaalsContact O-CG 3.24Å; D154-N158 PolarHBondContact O-N 3.44Å; D154-N158 PolarHBondContact O-ND2 3.05Å; D154-R163 IonicContact OD1-NH1 2.88Å
155	N	93.8	Very high	93.4	Very high	46 Å²	46	60.5 Å²	60.5	25%	0.246	31%	0.311	C	S	.	.	H	α-helix	trans	-62.5	-45.1	174.2	-70.9	-16	0	0	0	112.3	K151 I152 V153 N158 L159	K151-N155 WeakPolarHBondContact O-CB 3.47Å; K151-N155 PolarHBondContact O-N 3.21Å; K151-N155 PolarHBondContact O-ND2 3.08Å; K151-N155 PolarHBondContact O-OD1 2.83Å; I152-N155 PolarHBondContact O-N 3.36Å; V153-N155 VanDerWaalsContact C-N 3.29Å; V153-N155 PolarHBondContact O-N 3.37Å; N155-N158 PolarHBondContact O-N 2.83Å; N155-L159 WeakPolarHBondContact O-CB 3.35Å; N155-L159 PolarHBondContact O-N 2.89Å
156	I	93.9	Very high	93.6	Very high	1 Å²	1	55.4 Å²	55.4	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-64.3	-42.9	178.3	-67.7	167	0	0	0	110.6	M27 M132 I152 V153 N158 L159 L160 A184 L187 V188	M27-I156 HydrophobicContact CE-CD1 4.28Å; M27-I156 HydrophobicContact CE-CG1 3.81Å; M132-I156 HydrophobicContact CE-CB 4.06Å; M132-I156 HydrophobicContact CE-CD1 4.24Å; M132-I156 HydrophobicContact CE-CG2 3.71Å; I152-I156 HydrophobicContact CG2-CD1 3.88Å; I152-I156 WeakPolarHBondContact O-CG1 3.32Å; I152-I156 PolarHBondContact O-N 2.92Å; V153-I156 PolarHBondContact O-N 3.44Å; V153-I156 VanDerWaalsContact O-N 3.16Å; I156-N158 VanDerWaalsContact C-N 3.31Å; I156-N158 PolarHBondContact O-N 2.71Å; I156-L159 PolarHBondContact O-N 3.13Å; I156-L160 HydrophobicContact CG2-CD1 3.65Å; I156-L160 HydrophobicContact CG2-CG 4.39Å; I156-L160 WeakPolarHBondContact O-CB 3.25Å; I156-L160 WeakPolarHBondContact O-CG 3.4Å; I156-L160 PolarHBondContact O-N 3.38Å; I156-A184 HydrophobicContact CG2-CB 3.82Å; I156-L187 HydrophobicContact CD1-CB 4.46Å; I156-V188 HydrophobicContact CD1-CG2 4.08Å
157	I	94.9	Very high	93.8	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-61.5	-41.9	179	-71.4	175	0	0	0	111	M132 V153 D154 G161 L162 R163 L166	M132-I157 HydrophobicContact CG-CD1 4.29Å; M132-I157 HydrophobicContact CG-CG1 4.36Å; V153-I157 HydrophobicContact CG1-CD1 3.59Å; V153-I157 HydrophobicContact CG1-CG1 4.29Å; V153-I157 VanDerWaalsContact O-CG1 3.29Å; V153-I157 WeakPolarHBondContact O-CG1 3.41Å; V153-I157 PolarHBondContact O-N 3.2Å; D154-I157 PolarHBondContact O-N 3.18Å; I157-G161 PolarHBondContact O-N 3Å; I157-G161 VanDerWaalsContact O-N 3.16Å; I157-L162 HydrophobicContact CG2-CB 4.13Å; I157-L162 PolarHBondContact O-N 2.84Å; I157-R163 HydrophobicContact CG2-CB 4.47Å; I157-L166 HydrophobicContact CD1-CD1 3.48Å; I157-L166 VanDerWaalsContact CD1-CD1 3.48Å; I157-L166 HydrophobicContact CG2-CD1 4.35Å
158	N	93.7	Very high	93.9	Very high	91 Å²	91	54.2 Å²	54.2	49%	0.487	27%	0.274	S	S	.	.	H	α-helix	trans	-68.3	-44.7	176.4	-69.5	-23.1	0	0	0	111.7	D154 N155 I156 L160 G161	D154-N158 WeakPolarHBondContact O-CB 3.3Å; D154-N158 VanDerWaalsContact O-CG 3.24Å; D154-N158 PolarHBondContact O-N 3.44Å; D154-N158 PolarHBondContact O-ND2 3.05Å; N155-N158 PolarHBondContact O-N 2.83Å; I156-N158 VanDerWaalsContact C-N 3.31Å; I156-N158 PolarHBondContact O-N 2.71Å; N158-L160 PolarHBondContact O-N 3.19Å; N158-G161 PolarHBondContact O-N 3.28Å; N158-G161 VanDerWaalsContact O-N 3.11Å
159	L	89.9	Confident	94	Very high	66 Å²	66	56.1 Å²	56.1	35%	0.346	27%	0.272	S	S	.	.	H	α-helix	trans	-56.8	-38.7	178.1	178.1	65.6	0	0	0	112.4	N155 I156 L218	N155-L159 WeakPolarHBondContact O-CB 3.35Å; N155-L159 PolarHBondContact O-N 2.89Å; I156-L159 PolarHBondContact O-N 3.13Å; L159-L218 HydrophobicContact CD2-CD2 4.23Å
160	L	91.1	Very high	94	Very high	7 Å²	7	55.7 Å²	55.7	4%	0.037	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-1.8	-177.6	-62.6	174.5	0	0	0	113.5	I156 N158 L162 R180 A184 L187 L214	I156-L160 HydrophobicContact CG2-CD1 3.65Å; I156-L160 HydrophobicContact CG2-CG 4.39Å; I156-L160 WeakPolarHBondContact O-CB 3.25Å; I156-L160 WeakPolarHBondContact O-CG 3.4Å; I156-L160 PolarHBondContact O-N 3.38Å; N158-L160 PolarHBondContact O-N 3.19Å; L160-L162 VanDerWaalsContact C-N 3.35Å; L160-L162 HydrophobicContact CB-CD1 4.15Å; L160-L162 HydrophobicContact CB-CG 4.15Å; L160-L162 HydrophobicContact CD1-CD1 4.47Å; L160-L162 PolarHBondContact O-N 3.09Å; L160-R180 WeakPolarHBondContact O-CD 3.49Å; L160-R180 PolarHBondContact O-NH1 2.82Å; L160-A184 HydrophobicContact CD1-CB 3.23Å; L160-L187 HydrophobicContact CD1-CD1 4.3Å; L160-L187 HydrophobicContact CD2-CD1 4.39Å; L160-L214 HydrophobicContact CD2-CD1 3.46Å; L160-L214 VanDerWaalsContact CD2-CD1 3.46Å; L160-L214 HydrophobicContact CD2-CD2 3.22Å; L160-L214 HydrophobicContact CD2-CG 3.88Å
161	G	91.4	Very high	93.9	Very high	44 Å²	44	55.8 Å²	55.8	45%	0.454	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.6	41.1	-178.7	0	0	0	0	0	112.8	I157 N158 R180	I157-G161 PolarHBondContact O-N 3Å; I157-G161 VanDerWaalsContact O-N 3.16Å; N158-G161 PolarHBondContact O-N 3.28Å; N158-G161 VanDerWaalsContact O-N 3.11Å; G161-R180 PolarHBondContact O-NH1 3.15Å
162	L	93.6	Very high	93.8	Very high	1 Å²	1	55.6 Å²	55.6	1%	0.005	28%	0.281	C	S	.	.			trans	-100.9	8.6	178.4	-70.2	175.2	0	0	0	112.9	I157 L160 E164 A165 L166 Q177 R180 L181 A184	I157-L162 HydrophobicContact CG2-CB 4.13Å; I157-L162 PolarHBondContact O-N 2.84Å; L160-L162 VanDerWaalsContact C-N 3.35Å; L160-L162 HydrophobicContact CB-CD1 4.15Å; L160-L162 HydrophobicContact CB-CG 4.15Å; L160-L162 HydrophobicContact CD1-CD1 4.47Å; L160-L162 PolarHBondContact O-N 3.09Å; L162-E164 PolarHBondContact O-N 2.75Å; L162-A165 PolarHBondContact O-N 3.48Å; L162-A165 VanDerWaalsContact O-N 3.13Å; L162-L166 PolarHBondContact O-N 3.43Å; L162-Q177 HydrophobicContact CD2-CB 4.38Å; L162-R180 HydrophobicContact CD1-CB 4.24Å; L162-R180 HydrophobicContact CD2-CB 3.97Å; L162-R180 HydrophobicContact CG-CB 4.27Å; L162-L181 HydrophobicContact CD1-CB 4.25Å; L162-A184 HydrophobicContact CD1-CB 4.19Å
163	R	94.2	Very high	93.8	Very high	134 Å²	134	53.6 Å²	53.6	51%	0.506	27%	0.271	S	S	.	.	S	Bend	trans	-60.8	-41.6	-174.2	-173.7	64.8	-179.8	-178.8	2.4	113	D154 I157 A165 L166	D154-R163 IonicContact OD1-NH1 2.88Å; I157-R163 HydrophobicContact CG2-CB 4.47Å; R163-A165 PolarHBondContact O-N 3.41Å; R163-L166 WeakPolarHBondContact O-CB 3.4Å; R163-L166 PolarHBondContact O-N 3.04Å
164	E	93.8	Very high	93.6	Very high	186 Å²	186	56.5 Å²	56.5	87%	0.869	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-30.5	178.3	-63.9	174.4	-179.5	0	0	112.3	L162	L162-E164 PolarHBondContact O-N 2.75Å
165	A	94	Very high	93.3	Very high	4 Å²	4	56.5 Å²	56.5	3%	0.033	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	5.8	-176.6	0	0	0	0	0	113.6	V128 L162 R163 H167 T168 L173	V128-A165 HydrophobicContact CG2-CB 4.29Å; V128-A165 WeakPolarHBondContact CG2-O 3.44Å; L162-A165 PolarHBondContact O-N 3.48Å; L162-A165 VanDerWaalsContact O-N 3.13Å; R163-A165 PolarHBondContact O-N 3.41Å; A165-H167 VanDerWaalsContact C-N 3.3Å; A165-H167 PolarHBondContact O-N 2.91Å; A165-H167 VanDerWaalsContact O-N 3.15Å; A165-T168 WeakPolarHBondContact O-CB 3.4Å; A165-T168 PolarHBondContact O-N 3.15Å; A165-L173 HydrophobicContact CB-CD2 3.67Å
166	L	95.7	Very high	93.1	Very high	10 Å²	10	54.7 Å²	54.7	5%	0.052	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.3	-44	-169.4	-176.4	66.3	0	0	0	114.1	V128 D129 I157 L162 R163	V128-L166 WeakPolarHBondContact CB-O 3.05Å; D129-L166 HydrophobicContact CB-CD1 3.8Å; D129-L166 HydrophobicContact CB-CG 4.13Å; D129-L166 PolarHBondContact N-O 2.92Å; I157-L166 HydrophobicContact CD1-CD1 3.48Å; I157-L166 VanDerWaalsContact CD1-CD1 3.48Å; I157-L166 HydrophobicContact CG2-CD1 4.35Å; L162-L166 PolarHBondContact O-N 3.43Å; R163-L166 WeakPolarHBondContact O-CB 3.4Å; R163-L166 PolarHBondContact O-N 3.04Å
167	H	96	Very high	93	Very high	149 Å²	149	56.8 Å²	56.8	69%	0.69	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	1.7	-178.8	-58.3	-57.7	0	0	0	113.4	A165	A165-H167 VanDerWaalsContact C-N 3.3Å; A165-H167 PolarHBondContact O-N 2.91Å; A165-H167 VanDerWaalsContact O-N 3.15Å
168	T	96.1	Very high	92.9	Very high	46 Å²	46	60 Å²	60	28%	0.282	32%	0.316	S	S	.	.	S	Bend	trans	-79.1	138.8	179.2	-56.6	0	0	0	0	109.9	S127 V128 A165 Q172 L173	S127-T168 WeakPolarHBondContact CA-O 3.47Å; V128-T168 PolarHBondContact N-O 2.83Å; V128-T168 VanDerWaalsContact N-O 3.16Å; A165-T168 WeakPolarHBondContact O-CB 3.4Å; A165-T168 PolarHBondContact O-N 3.15Å; T168-Q172 HydrophobicContact CG2-CB 3.8Å; T168-L173 HydrophobicContact CG2-CD2 3.81Å
169	R	94.7	Very high	92.8	Very high	97 Å²	97	55.9 Å²	55.9	37%	0.366	29%	0.294	S	S	.	.	B	Isolated β-bridge	trans	-70	143.9	175.8	-65.5	-177.1	-172.7	178.6	3.2	110.2	L126 S171 Q172	L126-R169 WeakPolarHBondContact O-CA 3.27Å; R169-S171 PolarHBondContact O-N 3.15Å; R169-S171 VanDerWaalsContact O-N 3.14Å; R169-Q172 PolarHBondContact O-N 3.32Å
170	T	93.7	Very high	92.9	Very high	4 Å²	4	55.9 Å²	55.9	3%	0.025	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-56.1	-33.8	-179.9	57.8	0	0	0	0	113.1	L123 P124 L126 Q172 L173 K178 L181	L123-T170 PolarHBondContact O-OG1 3.26Å; P124-T170 WeakPolarHBondContact CA-OG1 3.46Å; P124-T170 PolarHBondContact O-OG1 2.98Å; P124-T170 VanDerWaalsContact O-OG1 3.13Å; L126-T170 WeakPolarHBondContact O-CG2 3.37Å; L126-T170 PolarHBondContact O-N 2.86Å; T170-Q172 PolarHBondContact O-N 3.46Å; T170-L173 PolarHBondContact O-N 3.07Å; T170-K178 WeakPolarHBondContact O-CE 3.47Å; T170-L181 HydrophobicContact CG2-CD2 3.54Å
171	S	91.9	Very high	93.1	Very high	57 Å²	57	55.6 Å²	55.6	40%	0.399	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-57.6	-32.1	174.2	43	0	0	0	0	113.6	P124 R169 K178	P124-S171 VanDerWaalsContact O-CB 3.28Å; P124-S171 WeakPolarHBondContact O-CB 3.3Å; P124-S171 PolarHBondContact O-N 2.75Å; P124-S171 VanDerWaalsContact O-N 3.16Å; P124-S171 PolarHBondContact O-OG 3.05Å; R169-S171 PolarHBondContact O-N 3.15Å; R169-S171 VanDerWaalsContact O-N 3.14Å; S171-K178 PolarHBondContact O-NZ 2.82Å
172	Q	93.9	Very high	93.2	Very high	137 Å²	137	53.8 Å²	53.8	64%	0.64	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-94.4	-1.5	-175.8	-64.9	172.9	-23.1	0	0	113.9	T168 R169 T170	T168-Q172 HydrophobicContact CG2-CB 3.8Å; R169-Q172 PolarHBondContact O-N 3.32Å; T170-Q172 PolarHBondContact O-N 3.46Å
173	L	93.3	Very high	93.2	Very high	8 Å²	8	53.8 Å²	53.8	4%	0.042	27%	0.268	C	S	.	.	S	Bend	trans	-76.1	147.8	178.7	-64.3	179.2	0	0	0	112.2	V128 A165 T168 T170 Q177 K178 L181	V128-L173 HydrophobicContact CG2-CD1 3.77Å; V128-L173 HydrophobicContact CG2-CD2 4.1Å; V128-L173 HydrophobicContact CG2-CG 4.5Å; A165-L173 HydrophobicContact CB-CD2 3.67Å; T168-L173 HydrophobicContact CG2-CD2 3.81Å; T170-L173 PolarHBondContact O-N 3.07Å; L173-Q177 HydrophobicContact CB-CB 4.02Å; L173-Q177 HydrophobicContact CD2-CB 4.31Å; L173-K178 HydrophobicContact CB-CG 3.65Å; L173-K178 HydrophobicContact CD1-CG 4.43Å; L173-K178 WeakPolarHBondContact O-CE 3.49Å; L173-K178 PolarHBondContact O-NZ 2.79Å; L173-L181 HydrophobicContact CD1-CD2 3.84Å
174	S	91.4	Very high	93.2	Very high	60 Å²	60	47.4 Å²	47.4	42%	0.42	24%	0.244	S	C	.	.			trans	-65.1	159.3	169.3	77.8	0	0	0	0	111.4	G176 Q177 K178	S174-G176 VanDerWaalsContact C-N 3.31Å; S174-G176 PolarHBondContact O-N 3.27Å; S174-Q177 VanDerWaalsContact N-OE1 3.07Å; S174-Q177 PolarHBondContact O-N 3.42Å; S174-Q177 WeakPolarHBondContact OG-CG 3.35Å; S174-Q177 PolarHBondContact OG-N 2.82Å; S174-Q177 PolarHBondContact OG-OE1 3.28Å; S174-K178 WeakPolarHBondContact O-CG 3.25Å; S174-K178 PolarHBondContact O-N 3.31Å
175	G	88.8	Confident	93.2	Very high	39 Å²	39	39.1 Å²	39.1	40%	0.402	21%	0.206	S	C	.	.	H	α-helix	trans	-53.7	-46.2	178.8	0	0	0	0	0	112.8	Q177 K178 K179 L203	G175-Q177 PolarHBondContact O-N 2.7Å; G175-K178 PolarHBondContact O-N 3.43Å; G175-K179 PolarHBondContact O-N 3.09Å; G175-L203 VanDerWaalsContact C-CD2 3.41Å
176	G	89.5	Confident	93.1	Very high	8 Å²	8	39.1 Å²	39.1	8%	0.082	21%	0.205	C	C	.	.	H	α-helix	trans	-66.4	-32.5	176.8	0	0	0	0	0	114.1	S174 R180	S174-G176 VanDerWaalsContact C-N 3.31Å; S174-G176 PolarHBondContact O-N 3.27Å; G176-R180 VanDerWaalsContact O-CG 3.31Å; G176-R180 WeakPolarHBondContact O-CG 3.46Å; G176-R180 PolarHBondContact O-N 3.11Å; G176-R180 VanDerWaalsContact O-N 3.1Å; G176-R180 PolarHBondContact O-NE 2.91Å
177	Q	92.5	Very high	92.9	Very high	45 Å²	45	38.7 Å²	38.7	21%	0.21	20%	0.203	C	C	.	.	H	α-helix	trans	-71.5	-41.6	173.3	-74.2	170.4	-18.2	0	0	111.8	L162 L173 S174 G175 K179 R180 L181	L162-Q177 HydrophobicContact CD2-CB 4.38Å; L173-Q177 HydrophobicContact CB-CB 4.02Å; L173-Q177 HydrophobicContact CD2-CB 4.31Å; S174-Q177 VanDerWaalsContact N-OE1 3.07Å; S174-Q177 PolarHBondContact O-N 3.42Å; S174-Q177 WeakPolarHBondContact OG-CG 3.35Å; S174-Q177 PolarHBondContact OG-N 2.82Å; S174-Q177 PolarHBondContact OG-OE1 3.28Å; G175-Q177 PolarHBondContact O-N 2.7Å; Q177-K179 VanDerWaalsContact C-N 3.32Å; Q177-K179 PolarHBondContact O-N 3.35Å; Q177-R180 PolarHBondContact O-N 2.88Å; Q177-L181 WeakPolarHBondContact O-CB 3.43Å; Q177-L181 PolarHBondContact O-N 3.41Å
178	K	92.7	Very high	92.7	Very high	67 Å²	67	31.9 Å²	31.9	29%	0.291	17%	0.172	S	C	.	.	H	α-helix	trans	-58	-45.8	173.4	-73.2	176.6	174.7	160.5	0	110.7	L122 T170 S171 L173 S174 G175 L181 A182	L122-K178 HydrophobicContact CD1-CB 4.15Å; L122-K178 HydrophobicContact CD1-CG 4.44Å; T170-K178 WeakPolarHBondContact O-CE 3.47Å; S171-K178 PolarHBondContact O-NZ 2.82Å; L173-K178 HydrophobicContact CB-CG 3.65Å; L173-K178 HydrophobicContact CD1-CG 4.43Å; L173-K178 WeakPolarHBondContact O-CE 3.49Å; L173-K178 PolarHBondContact O-NZ 2.79Å; S174-K178 WeakPolarHBondContact O-CG 3.25Å; S174-K178 PolarHBondContact O-N 3.31Å; G175-K178 PolarHBondContact O-N 3.43Å; K178-L181 PolarHBondContact O-N 2.88Å; K178-A182 PolarHBondContact O-N 3.35Å
179	K	91	Very high	92.2	Very high	5 Å²	5	32.2 Å²	32.2	2%	0.022	17%	0.172	C	C	.	.	H	α-helix	trans	-60.7	-50.1	177.4	-162.7	62.3	168.8	-172.9	0	111.3	M117 Q118 D120 G175 Q177 L181 A182 I183 L203	M117-K179 PolarHBondContact O-NZ 3.32Å; Q118-K179 PolarHBondContact O-NZ 3.25Å; D120-K179 WeakPolarHBondContact OD1-CD 3.41Å; D120-K179 IonicContact OD1-NZ 3.94Å; D120-K179 PolarHBondContact OD1-NZ 2.93Å; D120-K179 WeakPolarHBondContact OD2-CA 3.46Å; D120-K179 VanDerWaalsContact OD2-CD 3.3Å; D120-K179 WeakPolarHBondContact OD2-CD 3.43Å; D120-K179 PolarHBondContact OD2-N 3.4Å; G175-K179 PolarHBondContact O-N 3.09Å; Q177-K179 VanDerWaalsContact C-N 3.32Å; Q177-K179 PolarHBondContact O-N 3.35Å; K179-L181 VanDerWaalsContact C-N 3.28Å; K179-L181 PolarHBondContact O-N 3.01Å; K179-A182 WeakPolarHBondContact O-CB 3.49Å; K179-A182 PolarHBondContact O-N 2.91Å; K179-A182 VanDerWaalsContact O-N 3.09Å; K179-I183 WeakPolarHBondContact O-CG1 3.35Å; K179-I183 PolarHBondContact O-N 2.86Å; K179-L203 HydrophobicContact CG-CD1 4.43Å
180	R	92.3	Very high	91.8	Very high	66 Å²	66	29.5 Å²	29.5	25%	0.249	17%	0.165	C	C	.	.	H	α-helix	trans	-57.6	-39.2	176.5	-73.9	-175.3	-70.5	159.1	-9.2	112.5	L160 G161 L162 G176 Q177 I183 A184 L214	L160-R180 WeakPolarHBondContact O-CD 3.49Å; L160-R180 PolarHBondContact O-NH1 2.82Å; G161-R180 PolarHBondContact O-NH1 3.15Å; L162-R180 HydrophobicContact CD1-CB 4.24Å; L162-R180 HydrophobicContact CD2-CB 3.97Å; L162-R180 HydrophobicContact CG-CB 4.27Å; G176-R180 VanDerWaalsContact O-CG 3.31Å; G176-R180 WeakPolarHBondContact O-CG 3.46Å; G176-R180 PolarHBondContact O-N 3.11Å; G176-R180 VanDerWaalsContact O-N 3.1Å; G176-R180 PolarHBondContact O-NE 2.91Å; Q177-R180 PolarHBondContact O-N 2.88Å; R180-I183 PolarHBondContact O-N 2.72Å; R180-A184 WeakPolarHBondContact O-CB 3.41Å; R180-A184 PolarHBondContact O-N 2.77Å; R180-L214 HydrophobicContact CG-CD2 4.37Å
181	L	95	Very high	91.6	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-65.4	-41.9	174.6	177	60	0	0	0	112.3	L122 V128 M132 L162 T170 L173 Q177 K178 K179 I183 A184 Q185	L122-L181 HydrophobicContact CD1-CB 4.38Å; L122-L181 HydrophobicContact CD1-CD2 4.02Å; L122-L181 HydrophobicContact CD1-CG 4.28Å; L122-L181 HydrophobicContact CD2-CG 4.46Å; V128-L181 HydrophobicContact CG1-CD1 4.07Å; V128-L181 HydrophobicContact CG2-CD2 4.17Å; M132-L181 HydrophobicContact CG-CD1 4.03Å; M132-L181 HydrophobicContact SD-CD1 4.1Å; L162-L181 HydrophobicContact CD1-CB 4.25Å; T170-L181 HydrophobicContact CG2-CD2 3.54Å; L173-L181 HydrophobicContact CD1-CD2 3.84Å; Q177-L181 WeakPolarHBondContact O-CB 3.43Å; Q177-L181 PolarHBondContact O-N 3.41Å; K178-L181 PolarHBondContact O-N 2.88Å; K179-L181 VanDerWaalsContact C-N 3.28Å; K179-L181 PolarHBondContact O-N 3.01Å; L181-I183 VanDerWaalsContact C-N 3.29Å; L181-I183 PolarHBondContact O-N 3.17Å; L181-A184 HydrophobicContact CD1-CB 4.41Å; L181-A184 VanDerWaalsContact O-CB 3.27Å; L181-A184 WeakPolarHBondContact O-CB 3.24Å; L181-A184 PolarHBondContact O-N 2.88Å; L181-A184 VanDerWaalsContact O-N 3.11Å; L181-Q185 HydrophobicContact CD1-CG 4.25Å; L181-Q185 WeakPolarHBondContact O-CG 3.3Å; L181-Q185 PolarHBondContact O-N 3.09Å
182	A	93.6	Very high	91.6	Very high	7 Å²	7	27.3 Å²	27.3	6%	0.058	15%	0.149	C	C	.	.	H	α-helix	trans	-59.9	-41.4	175.9	0	0	0	0	0	111.4	L122 K178 K179 E186	L122-A182 HydrophobicContact CD2-CB 4.37Å; K178-A182 PolarHBondContact O-N 3.35Å; K179-A182 WeakPolarHBondContact O-CB 3.49Å; K179-A182 PolarHBondContact O-N 2.91Å; K179-A182 VanDerWaalsContact O-N 3.09Å; A182-E186 PolarHBondContact O-N 3.45Å
183	I	92.8	Very high	91.5	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-63.7	-44.7	172.4	-55.3	-179.4	0	0	0	110.6	I116 K179 R180 L181 Q185 E186 L187 F196 L214 L215 L218	I116-I183 HydrophobicContact CD1-CG1 4.28Å; K179-I183 WeakPolarHBondContact O-CG1 3.35Å; K179-I183 PolarHBondContact O-N 2.86Å; R180-I183 PolarHBondContact O-N 2.72Å; L181-I183 VanDerWaalsContact C-N 3.29Å; L181-I183 PolarHBondContact O-N 3.17Å; I183-Q185 PolarHBondContact O-N 2.89Å; I183-E186 PolarHBondContact O-N 3.16Å; I183-E186 VanDerWaalsContact O-N 3.1Å; I183-L187 HydrophobicContact CG2-CD1 3.82Å; I183-L187 HydrophobicContact CG2-CG 4.12Å; I183-L187 WeakPolarHBondContact O-CG 3.4Å; I183-L187 PolarHBondContact O-N 2.87Å; I183-F196 HydrophobicContact CD1-CE1 4.02Å; I183-F196 HydrophobicContact CG1-CE1 3.92Å; I183-F196 HydrophobicContact CG2-CE1 4.41Å; I183-L214 HydrophobicContact CD1-CD2 4.25Å; I183-L215 HydrophobicContact CD1-CD2 4.05Å; I183-L218 HydrophobicContact CG2-CD1 4.19Å
184	A	94.2	Very high	91.5	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-55.5	-48	-179.6	0	0	0	0	0	112.6	M132 I156 L160 L162 R180 L181 E186 L187	M132-A184 HydrophobicContact CE-CB 3.95Å; M132-A184 HydrophobicContact SD-CB 3.48Å; M132-A184 WeakPolarHBondContact SD-CB 3.22Å; I156-A184 HydrophobicContact CG2-CB 3.82Å; L160-A184 HydrophobicContact CD1-CB 3.23Å; L162-A184 HydrophobicContact CD1-CB 4.19Å; R180-A184 WeakPolarHBondContact O-CB 3.41Å; R180-A184 PolarHBondContact O-N 2.77Å; L181-A184 HydrophobicContact CD1-CB 4.41Å; L181-A184 VanDerWaalsContact O-CB 3.27Å; L181-A184 WeakPolarHBondContact O-CB 3.24Å; L181-A184 PolarHBondContact O-N 2.88Å; L181-A184 VanDerWaalsContact O-N 3.11Å; A184-E186 PolarHBondContact O-N 3.25Å; A184-L187 PolarHBondContact O-N 2.86Å
185	Q	94.3	Very high	91.7	Very high	13 Å²	13	17.5 Å²	17.5	6%	0.061	10%	0.096	C	C	.	.	H	α-helix	trans	-62.8	-31.2	-179.7	-69.5	-174.7	-48.3	0	0	112	A131 M132 S135 K139 L181 I183 W513	A131-Q185 PolarHBondContact O-NE2 3.23Å; A131-Q185 VanDerWaalsContact O-NE2 3.17Å; M132-Q185 HydrophobicContact SD-CG 3.95Å; S135-Q185 PolarHBondContact OG-O 2.97Å; K139-Q185 PolarHBondContact NZ-O 3.12Å; L181-Q185 HydrophobicContact CD1-CG 4.25Å; L181-Q185 WeakPolarHBondContact O-CG 3.3Å; L181-Q185 PolarHBondContact O-N 3.09Å; I183-Q185 PolarHBondContact O-N 2.89Å; Q185-W513 HydrophobicContact CB-CH2 3.94Å; Q185-W513 HydrophobicContact CB-CZ2 3.87Å; Q185-W513 HydrophobicContact CG-CH2 4.29Å
186	E	91	Very high	92	Very high	4 Å²	4	15.7 Å²	15.7	2%	0.019	8%	0.077	C	C	.	.	H	α-helix	trans	-82.1	-27.4	177.6	-65.2	-56.9	161.3	0	0	113.6	C114 I116 K139 A182 I183 A184 V188 N189 P191 N511 W513	C114-E186 HydrophobicContact CB-CB 4.44Å; I116-E186 HydrophobicContact CD1-CB 4.08Å; I116-E186 HydrophobicContact CD1-CG 4.16Å; I116-E186 HydrophobicContact CG1-CB 4.33Å; I116-E186 HydrophobicContact CG1-CG 3.88Å; K139-E186 PolarHBondContact NZ-O 3.2Å; K139-E186 IonicContact NZ-OE2 3.6Å; K139-E186 PolarHBondContact NZ-OE2 2.86Å; A182-E186 PolarHBondContact O-N 3.45Å; I183-E186 PolarHBondContact O-N 3.16Å; I183-E186 VanDerWaalsContact O-N 3.1Å; A184-E186 PolarHBondContact O-N 3.25Å; E186-V188 VanDerWaalsContact C-N 3.25Å; E186-V188 PolarHBondContact O-N 3.16Å; E186-N189 PolarHBondContact O-OD1 3.44Å; E186-P191 WeakPolarHBondContact O-CD 3.22Å; E186-N511 VanDerWaalsContact CD-ND2 3.26Å; E186-N511 PolarHBondContact OE1-ND2 3.11Å; E186-W513 PolarHBondContact OE1-NE1 2.89Å
187	L	91.7	Very high	92.2	Very high	1 Å²	1	16.1 Å²	16.1	1%	0.005	8%	0.078	C	C	.	.	H	α-helix	trans	-72.6	-12.6	176.7	-73.6	174.4	0	0	0	114.6	I156 L160 I183 A184 N189 N190 M194 L218	I156-L187 HydrophobicContact CD1-CB 4.46Å; L160-L187 HydrophobicContact CD1-CD1 4.3Å; L160-L187 HydrophobicContact CD2-CD1 4.39Å; I183-L187 HydrophobicContact CG2-CD1 3.82Å; I183-L187 HydrophobicContact CG2-CG 4.12Å; I183-L187 WeakPolarHBondContact O-CG 3.4Å; I183-L187 PolarHBondContact O-N 2.87Å; A184-L187 PolarHBondContact O-N 2.86Å; L187-N189 VanDerWaalsContact C-N 3.3Å; L187-N189 PolarHBondContact O-N 3.03Å; L187-N190 WeakPolarHBondContact O-CA 3.33Å; L187-N190 PolarHBondContact O-N 3.19Å; L187-M194 HydrophobicContact CD2-CE 3.62Å; L187-M194 HydrophobicContact CD2-SD 3.78Å; L187-M194 HydrophobicContact CG-CE 4.18Å; L187-L218 HydrophobicContact CD1-CD1 3.92Å; L187-L218 HydrophobicContact CD1-CD2 3.94Å; L187-L218 HydrophobicContact CD2-CD1 4.27Å; L187-L218 HydrophobicContact CD2-CD2 4.16Å
188	V	91.8	Very high	92.1	Very high	6 Å²	6	15.7 Å²	15.7	4%	0.036	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54	-40.9	-177.5	169.5	0	0	0	0	113.5	M132 A136 K139 L140 I156 E186	M132-V188 HydrophobicContact CE-CG2 3.82Å; A136-V188 HydrophobicContact CB-CG1 4.16Å; K139-V188 HydrophobicContact CB-CG1 4.23Å; L140-V188 HydrophobicContact CD1-CG1 4.14Å; L140-V188 HydrophobicContact CD2-CG1 4.22Å; L140-V188 WeakPolarHBondContact CD2-O 3.09Å; L140-V188 HydrophobicContact CG-CG1 3.86Å; I156-V188 HydrophobicContact CD1-CG2 4.08Å; E186-V188 VanDerWaalsContact C-N 3.25Å; E186-V188 PolarHBondContact O-N 3.16Å
189	N	86.2	Confident	92.1	Very high	52 Å²	52	12.5 Å²	12.5	28%	0.278	6%	0.062	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	7.1	177	66.4	-37.8	0	0	0	113.6	K139 E186 L187 P191	K139-N189 HydrophobicContact CB-CB 4.33Å; K139-N189 VanDerWaalsContact CE-CG 3.43Å; K139-N189 WeakPolarHBondContact CE-OD1 3.28Å; K139-N189 PolarHBondContact NZ-OD1 2.77Å; E186-N189 PolarHBondContact O-OD1 3.44Å; L187-N189 VanDerWaalsContact C-N 3.3Å; L187-N189 PolarHBondContact O-N 3.03Å; N189-P191 WeakPolarHBondContact OD1-CD 3.33Å
190	N	87.3	Confident	92	Very high	41 Å²	41	13.4 Å²	13.4	22%	0.219	7%	0.068	C	C	.	.			trans	47.1	60.9	-179.5	-168.6	26.6	0	0	0	114.7	L187 R223	L187-N190 WeakPolarHBondContact O-CA 3.33Å; L187-N190 PolarHBondContact O-N 3.19Å; N190-R223 VanDerWaalsContact OD1-CZ 3.32Å; N190-R223 PolarHBondContact OD1-NE 3.44Å; N190-R223 PolarHBondContact OD1-NH2 2.83Å
191	P	89	Confident	91.8	Very high	1 Å²	1	13 Å²	13	1%	0.006	8%	0.075	C	C	.	.			trans	-68.2	133.3	-178.3	28.1	-31.7	0	0	0	110.9	C114 E186 N189 M194	C114-P191 HydrophobicContact CB-CB 4.33Å; C114-P191 HydrophobicContact CB-CG 3.97Å; C114-P191 VanDerWaalsContact SG-CG 3.55Å; E186-P191 WeakPolarHBondContact O-CD 3.22Å; N189-P191 WeakPolarHBondContact OD1-CD 3.33Å; P191-M194 HydrophobicContact CG-CE 4.44Å; P191-M194 HydrophobicContact CG-CG 4.09Å; P191-M194 HydrophobicContact CG-SD 4.49Å
192	P	90.4	Very high	91.3	Very high	13 Å²	13	16.9 Å²	16.9	8%	0.084	12%	0.115	C	C	.	.	S	Bend	trans	-71.2	-27.5	178.3	27.9	-37.9	0	0	0	113.5	T33 I112 R223 T224	T33-P192 WeakPolarHBondContact OG1-CB 3.44Å; I112-P192 HydrophobicContact CB-CG 3.93Å; I112-P192 WeakPolarHBondContact O-CD 3.3Å; I112-P192 VanDerWaalsContact O-CG 3.32Å; I112-P192 WeakPolarHBondContact O-CG 3.42Å; P192-R223 CarbonylContact O-C 3.57Å; P192-R223 WeakPolarHBondContact O-CA 3.21Å; P192-T224 PolarHBondContact O-N 3.45Å
193	I	93	Very high	91	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	126.1	178.2	-56.9	172.9	0	0	0	109.4	I99 F109 I112 S113 C114 F195 T224	I99-I193 HydrophobicContact CG2-CD1 4.28Å; F109-I193 HydrophobicContact CE2-CD1 3.83Å; I112-I193 PolarHBondContact O-N 3.2Å; S113-I193 VanDerWaalsContact CA-O 3.24Å; S113-I193 WeakPolarHBondContact CA-O 3.37Å; C114-I193 PolarHBondContact N-O 3.33Å; I193-F195 HydrophobicContact CG2-CD2 4.32Å; I193-F195 HydrophobicContact CG2-CE2 3.6Å; I193-F195 HydrophobicContact CG2-CZ 3.79Å; I193-T224 WeakPolarHBondContact CA-O 3.3Å
194	M	94	Very high	90.8	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	129.3	-178.7	-53.9	-175.4	74.6	0	0	111.2	I116 L187 P191 F196 T224 I225 I226	I116-M194 HydrophobicContact CD1-CE 4.42Å; L187-M194 HydrophobicContact CD2-CE 3.62Å; L187-M194 HydrophobicContact CD2-SD 3.78Å; L187-M194 HydrophobicContact CG-CE 4.18Å; P191-M194 HydrophobicContact CG-CE 4.44Å; P191-M194 HydrophobicContact CG-CG 4.09Å; P191-M194 HydrophobicContact CG-SD 4.49Å; M194-F196 HydrophobicContact CB-CD2 4.35Å; M194-F196 HydrophobicContact CB-CE2 3.53Å; M194-F196 HydrophobicContact CB-CZ 4.18Å; M194-F196 HydrophobicContact CE-CE2 4.27Å; M194-F196 HydrophobicContact CE-CZ 3.71Å; M194-F196 HydrophobicContact SD-CE2 4.46Å; M194-F196 HydrophobicContact SD-CZ 4.35Å; M194-T224 PolarHBondContact N-O 2.9Å; M194-I225 HydrophobicContact CB-CG1 4.33Å; M194-I225 WeakPolarHBondContact O-CA 3.49Å; M194-I225 HydrophobicContact SD-CD1 4.43Å; M194-I226 PolarHBondContact O-N 2.96Å
195	F	95.2	Very high	90.5	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	135.7	175.7	-59.4	-86.4	0	0	0	110.5	L35 M82 L85 A86 F109 C114 Y115 I116 I193 I226	L35-F195 HydrophobicContact CD2-CE1 3.9Å; L35-F195 HydrophobicContact CD2-CZ 3.59Å; M82-F195 HydrophobicContact CG-CB 4.31Å; M82-F195 HydrophobicContact CG-CD1 3.94Å; M82-F195 HydrophobicContact SD-CB 4.27Å; L85-F195 HydrophobicContact CB-CE1 3.71Å; L85-F195 HydrophobicContact CB-CZ 4.05Å; A86-F195 HydrophobicContact CB-CD2 3.84Å; A86-F195 HydrophobicContact CB-CE2 4.03Å; A86-F195 HydrophobicContact CB-CG 4.13Å; A86-F195 HydrophobicContact CB-CZ 4.47Å; F109-F195 HydrophobicContact CE1-CE2 4.3Å; F109-F195 AromaticContact CZ-CE2 3.76Å; F109-F195 HydrophobicContact CZ-CE2 3.76Å; F109-F195 AromaticContact CZ-CZ 3.92Å; F109-F195 HydrophobicContact CZ-CZ 3.92Å; C114-F195 WeakPolarHBondContact O-CD2 3.21Å; C114-F195 PolarHBondContact O-N 3.49Å; Y115-F195 HydrophobicContact CD2-CB 3.51Å; Y115-F195 HydrophobicContact CD2-CG 4.21Å; Y115-F195 HydrophobicContact CE2-CB 4.13Å; Y115-F195 HydrophobicContact CG-CB 4.32Å; I116-F195 PolarHBondContact N-O 2.95Å; I193-F195 HydrophobicContact CG2-CD2 4.32Å; I193-F195 HydrophobicContact CG2-CE2 3.6Å; I193-F195 HydrophobicContact CG2-CZ 3.79Å; F195-I226 CarbonylContact C-O 3.58Å; F195-I226 VanDerWaalsContact CA-O 3.3Å; F195-I226 WeakPolarHBondContact CA-O 3.44Å; F195-I226 HydrophobicContact CD1-CB 3.97Å; F195-I226 HydrophobicContact CD1-CD1 3.96Å; F195-I226 HydrophobicContact CD1-CG2 4.27Å; F195-I226 HydrophobicContact CE1-CB 4.34Å; F195-I226 HydrophobicContact CE1-CD1 3.44Å; F195-I226 VanDerWaalsContact CE1-CD1 3.44Å; F195-I226 HydrophobicContact CE1-CG1 4.48Å; F195-I226 HydrophobicContact CZ-CD1 4.17Å
196	F	94.9	Very high	90.2	Very high	1 Å²	1	29 Å²	29	0%	0.004	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	114	179.5	-63.6	-98.4	0	0	0	110.6	I116 I183 M194 E198 P199 L215 I225 I226 C227 T228	I116-F196 HydrophobicContact CB-CD1 3.99Å; I116-F196 HydrophobicContact CB-CE1 4.36Å; I116-F196 HydrophobicContact CD1-CD1 3.78Å; I116-F196 HydrophobicContact CD1-CE1 3.24Å; I116-F196 HydrophobicContact CD1-CZ 3.79Å; I116-F196 HydrophobicContact CG1-CD1 4.46Å; I116-F196 HydrophobicContact CG1-CE1 4.34Å; I116-F196 HydrophobicContact CG2-CD1 4.22Å; I183-F196 HydrophobicContact CD1-CE1 4.02Å; I183-F196 HydrophobicContact CG1-CE1 3.92Å; I183-F196 HydrophobicContact CG2-CE1 4.41Å; M194-F196 HydrophobicContact CB-CD2 4.35Å; M194-F196 HydrophobicContact CB-CE2 3.53Å; M194-F196 HydrophobicContact CB-CZ 4.18Å; M194-F196 HydrophobicContact CE-CE2 4.27Å; M194-F196 HydrophobicContact CE-CZ 3.71Å; M194-F196 HydrophobicContact SD-CE2 4.46Å; M194-F196 HydrophobicContact SD-CZ 4.35Å; F196-E198 PolarHBondContact O-N 2.93Å; F196-P199 HydrophobicContact CB-CB 4.17Å; F196-P199 HydrophobicContact CB-CG 4.02Å; F196-P199 HydrophobicContact CD1-CB 4.48Å; F196-L215 HydrophobicContact CD1-CD1 4.35Å; F196-L215 HydrophobicContact CD1-CD2 4.1Å; F196-L215 HydrophobicContact CD2-CD1 4.43Å; F196-L215 HydrophobicContact CD2-CD2 4.33Å; F196-L215 HydrophobicContact CE1-CD2 3.46Å; F196-L215 VanDerWaalsContact CE1-CD2 3.46Å; F196-L215 HydrophobicContact CE2-CD2 3.77Å; F196-L215 HydrophobicContact CG-CD1 4.29Å; F196-L215 HydrophobicContact CG-CD2 4.49Å; F196-L215 HydrophobicContact CZ-CD2 3.29Å; F196-I225 HydrophobicContact CD2-CG2 3.73Å; F196-I225 HydrophobicContact CE2-CG2 3.58Å; F196-I226 PolarHBondContact N-O 3.28Å; F196-C227 HydrophobicContact CB-CB 3.81Å; F196-C227 CarbonylContact O-C 3.56Å; F196-C227 WeakPolarHBondContact O-CA 3.5Å; F196-T228 PolarHBondContact O-N 3Å
197	D	92.6	Very high	90.2	Very high	16 Å²	16	30 Å²	30	9%	0.086	20%	0.202	C	C	.	.	S	Bend	trans	-82.1	112.6	173.1	-144.1	-8.9	0	0	0	109.8	M82 Y115 I116 Q118 T228	M82-D197 HydrophobicContact CE-CB 3.29Å; M82-D197 VanDerWaalsContact CE-OD1 3.22Å; M82-D197 WeakPolarHBondContact CE-OD1 3.42Å; Y115-D197 HydrophobicContact CE1-CB 4.43Å; Y115-D197 PolarHBondContact OH-OD2 2.89Å; I116-D197 PolarHBondContact O-N 3.28Å; Q118-D197 VanDerWaalsContact CA-O 3.27Å; Q118-D197 WeakPolarHBondContact CA-O 3.42Å; Q118-D197 HydrophobicContact CB-CB 4.4Å; D197-T228 VanDerWaalsContact CA-OG1 3.31Å; D197-T228 WeakPolarHBondContact CA-OG1 3.42Å; D197-T228 PolarHBondContact OD1-OG1 3.49Å
198	E	91.2	Very high	90.2	Very high	37 Å²	37	30.5 Å²	30.5	17%	0.173	21%	0.205	C	C	.	.	S	Bend	trans	44.4	58.8	174.6	-60.6	-169.8	176.2	0	0	114	Q118 F196 T200 S201 T228	Q118-E198 HydrophobicContact CG-CB 4.22Å; Q118-E198 PolarHBondContact NE2-OE2 3.43Å; F196-E198 PolarHBondContact O-N 2.93Å; E198-T200 PolarHBondContact O-N 2.9Å; E198-S201 VanDerWaalsContact O-CB 3.29Å; E198-S201 WeakPolarHBondContact O-CB 3.28Å; E198-S201 PolarHBondContact O-N 3.44Å; E198-T228 VanDerWaalsContact CA-O 3.22Å; E198-T228 WeakPolarHBondContact CA-O 3.26Å; E198-T228 PolarHBondContact N-O 3.37Å; E198-T228 PolarHBondContact N-OG1 3.36Å
199	P	91.9	Very high	90.2	Very high	0 Å²	0	33 Å²	33	0%	0	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-16.4	-172	27.2	-34.8	0	0	0	114.2	F196 I212 L215 C227 T228	F196-P199 HydrophobicContact CB-CB 4.17Å; F196-P199 HydrophobicContact CB-CG 4.02Å; F196-P199 HydrophobicContact CD1-CB 4.48Å; P199-I212 HydrophobicContact CG-CD1 4.2Å; P199-L215 HydrophobicContact CB-CD1 4.37Å; P199-L215 HydrophobicContact CG-CD1 4.17Å; P199-C227 HydrophobicContact CG-CB 4.01Å; P199-T228 WeakPolarHBondContact CD-O 3.33Å
200	T	90.3	Very high	90.4	Very high	24 Å²	24	36.5 Å²	36.5	15%	0.147	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-6.5	178.1	52.2	0	0	0	0	113.4	E198 G202 L203 C208 I212	E198-T200 PolarHBondContact O-N 2.9Å; T200-G202 PolarHBondContact O-N 3.02Å; T200-L203 PolarHBondContact O-N 3.08Å; T200-C208 HydrophobicContact CG2-CB 4.29Å; T200-C208 PolarHBondContact O-SG 3.1Å; T200-I212 HydrophobicContact CG2-CD1 3.82Å; T200-I212 HydrophobicContact CG2-CG1 3.84Å
201	S	87.4	Confident	90.6	Very high	58 Å²	58	34.8 Å²	34.8	41%	0.406	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	132.4	-178.9	-179.5	0	0	0	0	111.5	Q118 E198 L203	Q118-S201 PolarHBondContact NE2-OG 3.4Å; E198-S201 VanDerWaalsContact O-CB 3.29Å; E198-S201 WeakPolarHBondContact O-CB 3.28Å; E198-S201 PolarHBondContact O-N 3.44Å; S201-L203 VanDerWaalsContact C-N 3.27Å; S201-L203 PolarHBondContact O-N 2.87Å
202	G	83.5	Confident	90.9	Very high	80 Å²	80	34.7 Å²	34.7	83%	0.825	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.6	11.4	176.4	0	0	0	0	0	115.5	T200	T200-G202 PolarHBondContact O-N 3.02Å
203	L	87.9	Confident	91	Very high	29 Å²	29	35.4 Å²	35.4	15%	0.152	23%	0.226	C	C	.	.			trans	-105.6	150.1	177	-63	-176.6	0	0	0	111.5	G175 K179 T200 S201 C208 C211	G175-L203 VanDerWaalsContact C-CD2 3.41Å; K179-L203 HydrophobicContact CG-CD1 4.43Å; T200-L203 PolarHBondContact O-N 3.08Å; S201-L203 VanDerWaalsContact C-N 3.27Å; S201-L203 PolarHBondContact O-N 2.87Å; L203-C208 VanDerWaalsContact CB-SG 3.52Å; L203-C211 HydrophobicContact CD1-CB 4.28Å
204	D	88.7	Confident	91	Very high	89 Å²	89	36 Å²	36	48%	0.476	23%	0.229	S	C	.	.			trans	-71.1	164.2	167	66.8	-84.3	0	0	0	111.4	A206 S207 C208	D204-A206 VanDerWaalsContact C-N 3.31Å; D204-A206 PolarHBondContact O-N 2.85Å; D204-A206 WeakPolarHBondContact OD2-CB 3.47Å; D204-A206 PolarHBondContact OD2-N 2.99Å; D204-A206 VanDerWaalsContact OD2-N 3.1Å; D204-S207 PolarHBondContact O-N 2.9Å; D204-S207 WeakPolarHBondContact OD1-CB 3.35Å; D204-S207 PolarHBondContact OD1-OG 2.93Å; D204-S207 PolarHBondContact OD2-N 2.68Å; D204-S207 PolarHBondContact OD2-OG 3.3Å; D204-C208 WeakPolarHBondContact O-CB 3.31Å; D204-C208 PolarHBondContact O-N 3.28Å; D204-C208 PolarHBondContact O-SG 3.23Å
205	S	87.8	Confident	91	Very high	104 Å²	104	36 Å²	36	73%	0.727	23%	0.229	S	C	*	.	H	α-helix	trans	-59.5	-36.1	-174.5	56.3	0	0	0	0	113.9	F209	S205-F209 PolarHBondContact O-N 3.41Å; S205-F209 VanDerWaalsContact O-N 3.16Å
206	A	89.4	Confident	91	Very high	52 Å²	52	38.7 Å²	38.7	43%	0.43	24%	0.239	S	C	.	.	H	α-helix	trans	-73.1	-44.2	178.2	0	0	0	0	0	111.3	D204 C208 F209 H210	D204-A206 VanDerWaalsContact C-N 3.31Å; D204-A206 PolarHBondContact O-N 2.85Å; D204-A206 WeakPolarHBondContact OD2-CB 3.47Å; D204-A206 PolarHBondContact OD2-N 2.99Å; D204-A206 VanDerWaalsContact OD2-N 3.1Å; A206-C208 VanDerWaalsContact C-N 3.33Å; A206-C208 PolarHBondContact O-N 3.29Å; A206-F209 PolarHBondContact O-N 2.96Å; A206-H210 PolarHBondContact O-N 3.06Å
207	S	89.5	Confident	90.8	Very high	26 Å²	26	46 Å²	46	18%	0.182	27%	0.266	C	S	.	.	H	α-helix	trans	-61.4	-39.4	174.2	-68.4	0	0	0	0	112.5	D204 H210 C211	D204-S207 PolarHBondContact O-N 2.9Å; D204-S207 WeakPolarHBondContact OD1-CB 3.35Å; D204-S207 PolarHBondContact OD1-OG 2.93Å; D204-S207 PolarHBondContact OD2-N 2.68Å; D204-S207 PolarHBondContact OD2-OG 3.3Å; S207-H210 PolarHBondContact O-N 2.84Å; S207-C211 WeakPolarHBondContact O-CB 3.43Å; S207-C211 PolarHBondContact O-N 3.19Å
208	C	91.6	Very high	90.8	Very high	11 Å²	11	45.5 Å²	45.5	7%	0.074	26%	0.264	C	S	.	.	H	α-helix	trans	-57.9	-50.4	172.9	-80.7	0	0	0	0	111.8	T200 L203 D204 A206 H210 C211 I212 I236	T200-C208 HydrophobicContact CG2-CB 4.29Å; T200-C208 PolarHBondContact O-SG 3.1Å; L203-C208 VanDerWaalsContact CB-SG 3.52Å; D204-C208 WeakPolarHBondContact O-CB 3.31Å; D204-C208 PolarHBondContact O-N 3.28Å; D204-C208 PolarHBondContact O-SG 3.23Å; A206-C208 VanDerWaalsContact C-N 3.33Å; A206-C208 PolarHBondContact O-N 3.29Å; C208-H210 VanDerWaalsContact C-N 3.34Å; C208-H210 PolarHBondContact O-N 2.9Å; C208-C211 PolarHBondContact O-N 2.9Å; C208-I212 PolarHBondContact O-N 3.03Å; C208-I236 HydrophobicContact CB-CD1 3.74Å
209	F	91.9	Very high	90.9	Very high	60 Å²	60	43.7 Å²	43.7	26%	0.263	26%	0.256	S	S	.	.	H	α-helix	trans	-59.8	-44.1	179.4	-179.3	-98.8	0	0	0	111.8	S205 A206 S213 K235 L239	S205-F209 PolarHBondContact O-N 3.41Å; S205-F209 VanDerWaalsContact O-N 3.16Å; A206-F209 PolarHBondContact O-N 2.96Å; F209-S213 WeakPolarHBondContact O-CB 3.49Å; F209-S213 PolarHBondContact O-N 3.13Å; F209-S213 PolarHBondContact O-OG 3.3Å; F209-K235 HydrophobicContact CD2-CD 4.14Å; F209-K235 HydrophobicContact CD2-CG 4.14Å; F209-K235 HydrophobicContact CE2-CD 4.1Å; F209-K235 VanDerWaalsContact CE2-CE 3.43Å; F209-K235 HydrophobicContact CE2-CG 3.99Å; F209-L239 HydrophobicContact CD2-CD1 3.97Å; F209-L239 HydrophobicContact CE2-CD1 3.82Å; F209-L239 HydrophobicContact CE2-CD2 4.49Å
210	H	90.7	Very high	90.9	Very high	124 Å²	124	51.6 Å²	51.6	57%	0.574	29%	0.285	S	S	*	.	H	α-helix	trans	-63.4	-41	175.5	-69.7	156.6	0	0	0	112.7	A206 S207 C208 L214	A206-H210 PolarHBondContact O-N 3.06Å; S207-H210 PolarHBondContact O-N 2.84Å; C208-H210 VanDerWaalsContact C-N 3.34Å; C208-H210 PolarHBondContact O-N 2.9Å; H210-L214 VanDerWaalsContact O-CB 3.32Å; H210-L214 WeakPolarHBondContact O-CB 3.35Å; H210-L214 PolarHBondContact O-N 3.17Å
211	C	92	Very high	90.8	Very high	5 Å²	5	51.7 Å²	51.7	3%	0.034	29%	0.291	C	S	.	.	H	α-helix	trans	-63	-51.7	178.2	-174.5	0	0	0	0	111.5	L203 S207 C208 S213 L214 L215	L203-C211 HydrophobicContact CD1-CB 4.28Å; S207-C211 WeakPolarHBondContact O-CB 3.43Å; S207-C211 PolarHBondContact O-N 3.19Å; C208-C211 PolarHBondContact O-N 2.9Å; C211-S213 PolarHBondContact O-N 3.18Å; C211-L214 WeakPolarHBondContact O-CB 3.22Å; C211-L214 PolarHBondContact O-N 3.09Å; C211-L215 WeakPolarHBondContact O-CG 3.22Å; C211-L215 PolarHBondContact O-N 3.3Å
212	I	94.6	Very high	90.9	Very high	0 Å²	0	50 Å²	50	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-66.5	-38.3	179.7	-62	-51.1	0	0	0	111.6	L67 P199 T200 C208 L214 L215 R216 I229 I236 L239 F240	L67-I212 HydrophobicContact CD2-CG2 3.99Å; P199-I212 HydrophobicContact CG-CD1 4.2Å; T200-I212 HydrophobicContact CG2-CD1 3.82Å; T200-I212 HydrophobicContact CG2-CG1 3.84Å; C208-I212 PolarHBondContact O-N 3.03Å; I212-L214 VanDerWaalsContact C-N 3.28Å; I212-L214 PolarHBondContact O-N 2.7Å; I212-L215 HydrophobicContact CD1-CD1 4Å; I212-L215 PolarHBondContact O-N 3.3Å; I212-R216 WeakPolarHBondContact O-CB 3.34Å; I212-R216 PolarHBondContact O-N 3.05Å; I212-I229 HydrophobicContact CD1-CD1 4.44Å; I212-I236 HydrophobicContact CG1-CG2 3.99Å; I212-I236 HydrophobicContact CG2-CG2 4.41Å; I212-L239 HydrophobicContact CB-CD1 4.15Å; I212-L239 HydrophobicContact CG2-CB 3.8Å; I212-L239 HydrophobicContact CG2-CD1 3.68Å; I212-L239 HydrophobicContact CG2-CG 4.41Å; I212-F240 HydrophobicContact CD1-CZ 4Å; I212-F240 HydrophobicContact CG1-CZ 4.34Å; I212-F240 HydrophobicContact CG2-CE1 4.45Å; I212-F240 HydrophobicContact CG2-CE2 3.99Å; I212-F240 HydrophobicContact CG2-CZ 3.64Å
213	S	93.2	Very high	91.3	Very high	27 Å²	27	46.4 Å²	46.4	19%	0.189	24%	0.244	C	C	.	.	H	α-helix	trans	-60.7	-38.9	174.3	-64.2	0	0	0	0	112.2	F209 C211 R217	F209-S213 WeakPolarHBondContact O-CB 3.49Å; F209-S213 PolarHBondContact O-N 3.13Å; F209-S213 PolarHBondContact O-OG 3.3Å; C211-S213 PolarHBondContact O-N 3.18Å; S213-R217 PolarHBondContact O-N 2.87Å
214	L	92	Very high	91.6	Very high	12 Å²	12	45 Å²	45	6%	0.063	24%	0.237	C	C	.	.	H	α-helix	trans	-64.8	-47.3	173.1	167.3	68.4	0	0	0	111.3	L160 R180 I183 H210 C211 I212 R216 R217 L218	L160-L214 HydrophobicContact CD2-CD1 3.46Å; L160-L214 VanDerWaalsContact CD2-CD1 3.46Å; L160-L214 HydrophobicContact CD2-CD2 3.22Å; L160-L214 HydrophobicContact CD2-CG 3.88Å; R180-L214 HydrophobicContact CG-CD2 4.37Å; I183-L214 HydrophobicContact CD1-CD2 4.25Å; H210-L214 VanDerWaalsContact O-CB 3.32Å; H210-L214 WeakPolarHBondContact O-CB 3.35Å; H210-L214 PolarHBondContact O-N 3.17Å; C211-L214 WeakPolarHBondContact O-CB 3.22Å; C211-L214 PolarHBondContact O-N 3.09Å; I212-L214 VanDerWaalsContact C-N 3.28Å; I212-L214 PolarHBondContact O-N 2.7Å; L214-R216 VanDerWaalsContact C-N 3.29Å; L214-R216 PolarHBondContact O-N 3.44Å; L214-R217 WeakPolarHBondContact O-CB 3.31Å; L214-R217 PolarHBondContact O-N 3.12Å; L214-R217 VanDerWaalsContact O-N 3.12Å; L214-L218 HydrophobicContact CD1-CD1 4.26Å; L214-L218 HydrophobicContact CD1-CG 4.25Å; L214-L218 HydrophobicContact CG-CD1 4.18Å; L214-L218 WeakPolarHBondContact O-CG 3.35Å; L214-L218 PolarHBondContact O-N 3.46Å
215	L	94.3	Very high	92	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-58	-43.8	176.5	-65.4	-174.5	0	0	0	111.1	L67 I183 F196 P199 C211 I212 R217 L218 A219 I225	L67-L215 HydrophobicContact CD1-CB 3.94Å; L67-L215 HydrophobicContact CD2-CB 4.43Å; I183-L215 HydrophobicContact CD1-CD2 4.05Å; F196-L215 HydrophobicContact CD1-CD1 4.35Å; F196-L215 HydrophobicContact CD1-CD2 4.1Å; F196-L215 HydrophobicContact CD2-CD1 4.43Å; F196-L215 HydrophobicContact CD2-CD2 4.33Å; F196-L215 HydrophobicContact CE1-CD2 3.46Å; F196-L215 VanDerWaalsContact CE1-CD2 3.46Å; F196-L215 HydrophobicContact CE2-CD2 3.77Å; F196-L215 HydrophobicContact CG-CD1 4.29Å; F196-L215 HydrophobicContact CG-CD2 4.49Å; F196-L215 HydrophobicContact CZ-CD2 3.29Å; P199-L215 HydrophobicContact CB-CD1 4.37Å; P199-L215 HydrophobicContact CG-CD1 4.17Å; C211-L215 WeakPolarHBondContact O-CG 3.22Å; C211-L215 PolarHBondContact O-N 3.3Å; I212-L215 HydrophobicContact CD1-CD1 4Å; I212-L215 PolarHBondContact O-N 3.3Å; L215-R217 VanDerWaalsContact C-N 3.31Å; L215-R217 PolarHBondContact O-N 3.03Å; L215-L218 HydrophobicContact CD2-CD1 4.42Å; L215-L218 PolarHBondContact O-N 2.87Å; L215-L218 VanDerWaalsContact O-N 3.14Å; L215-A219 PolarHBondContact O-N 2.8Å; L215-I225 WeakPolarHBondContact O-CD1 3.49Å
216	R	94.9	Very high	92.4	Very high	57 Å²	57	35.9 Å²	35.9	22%	0.215	18%	0.18	C	C	.	.	H	α-helix	trans	-59.5	-42	175.6	-166.1	179.7	-169.9	-178	5.7	112.1	L67 I212 L214 L218 A219 R220 L239 D241	L67-R216 HydrophobicContact CD2-CB 3.9Å; L67-R216 HydrophobicContact CD2-CG 4.41Å; I212-R216 WeakPolarHBondContact O-CB 3.34Å; I212-R216 PolarHBondContact O-N 3.05Å; L214-R216 VanDerWaalsContact C-N 3.29Å; L214-R216 PolarHBondContact O-N 3.44Å; R216-L218 VanDerWaalsContact C-N 3.35Å; R216-A219 PolarHBondContact O-N 3.38Å; R216-R220 VanDerWaalsContact CZ-NH2 3.29Å; R216-R220 WeakPolarHBondContact O-CG 3.31Å; R216-R220 PolarHBondContact O-N 3.45Å; R216-L239 VanDerWaalsContact CD-O 3.31Å; R216-L239 WeakPolarHBondContact CD-O 3.45Å; R216-L239 PolarHBondContact NE-O 2.69Å; R216-D241 IonicContact CZ-OD1 3.93Å; R216-D241 IonicContact NE-OD1 3.31Å; R216-D241 IonicContact NH2-OD1 3.76Å; R216-D241 PolarHBondContact NH2-OD1 3.36Å
217	R	92.5	Very high	92.7	Very high	154 Å²	154	33.4 Å²	33.4	58%	0.581	16%	0.159	S	C	*	.	H	α-helix	trans	-63	-40.5	175.7	-167.6	-175.9	-58	167.9	1.4	111.9	S213 L214 L215 G221	S213-R217 PolarHBondContact O-N 2.87Å; L214-R217 WeakPolarHBondContact O-CB 3.31Å; L214-R217 PolarHBondContact O-N 3.12Å; L214-R217 VanDerWaalsContact O-N 3.12Å; L215-R217 VanDerWaalsContact C-N 3.31Å; L215-R217 PolarHBondContact O-N 3.03Å; R217-G221 PolarHBondContact O-N 3.37Å
218	L	91.5	Very high	93	Very high	6 Å²	6	32.1 Å²	32.1	3%	0.031	15%	0.15	C	C	.	.	H	α-helix	trans	-67.5	-38.9	176.6	-68	170.4	0	0	0	112.3	L159 I183 L187 L214 L215 R216 G221 R223 I225	L159-L218 HydrophobicContact CD2-CD2 4.23Å; I183-L218 HydrophobicContact CG2-CD1 4.19Å; L187-L218 HydrophobicContact CD1-CD1 3.92Å; L187-L218 HydrophobicContact CD1-CD2 3.94Å; L187-L218 HydrophobicContact CD2-CD1 4.27Å; L187-L218 HydrophobicContact CD2-CD2 4.16Å; L214-L218 HydrophobicContact CD1-CD1 4.26Å; L214-L218 HydrophobicContact CD1-CG 4.25Å; L214-L218 HydrophobicContact CG-CD1 4.18Å; L214-L218 WeakPolarHBondContact O-CG 3.35Å; L214-L218 PolarHBondContact O-N 3.46Å; L215-L218 HydrophobicContact CD2-CD1 4.42Å; L215-L218 PolarHBondContact O-N 2.87Å; L215-L218 VanDerWaalsContact O-N 3.14Å; R216-L218 VanDerWaalsContact C-N 3.35Å; L218-G221 PolarHBondContact O-N 2.85Å; L218-R223 PolarHBondContact O-NH1 3.39Å; L218-I225 HydrophobicContact CB-CD1 3.6Å
219	A	93.8	Very high	93	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-62.1	-49.8	175.5	0	0	0	0	0	110.7	G65 L67 L215 R216 G221 G222 R223 I225	G65-A219 VanDerWaalsContact CA-O 3.26Å; G65-A219 WeakPolarHBondContact CA-O 3.05Å; L67-A219 HydrophobicContact CB-CB 4.16Å; L215-A219 PolarHBondContact O-N 2.8Å; R216-A219 PolarHBondContact O-N 3.38Å; A219-G221 PolarHBondContact O-N 3.18Å; A219-G222 PolarHBondContact O-N 3.38Å; A219-R223 PolarHBondContact O-N 3.05Å; A219-R223 VanDerWaalsContact O-N 3.08Å; A219-I225 HydrophobicContact CB-CB 4.25Å; A219-I225 HydrophobicContact CB-CD1 3.94Å; A219-I225 HydrophobicContact CB-CG1 4.07Å
220	R	92.2	Very high	92.7	Very high	166 Å²	166	32.2 Å²	32.2	63%	0.626	15%	0.15	S	C	*	.	H	α-helix	trans	-56.2	-23.1	175.9	-74.1	178.3	178	-176.8	-1.7	114	R216 G222	R216-R220 VanDerWaalsContact CZ-NH2 3.29Å; R216-R220 WeakPolarHBondContact O-CG 3.31Å; R216-R220 PolarHBondContact O-N 3.45Å; R220-G222 PolarHBondContact O-N 3.28Å
221	G	88.1	Confident	92.4	Very high	25 Å²	25	31.8 Å²	31.8	26%	0.258	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75	15.5	170.4	0	0	0	0	0	115	R217 L218 A219	R217-G221 PolarHBondContact O-N 3.37Å; L218-G221 PolarHBondContact O-N 2.85Å; A219-G221 PolarHBondContact O-N 3.18Å
222	G	89.1	Confident	92.3	Very high	22 Å²	22	31.9 Å²	31.9	23%	0.227	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.8	29.6	178.2	0	0	0	0	0	114.5	S29 S64 A219 R220	S29-G222 WeakPolarHBondContact CB-O 3.17Å; S29-G222 PolarHBondContact OG-O 2.88Å; S64-G222 PolarHBondContact OG-O 3.12Å; S64-G222 VanDerWaalsContact OG-O 3.06Å; A219-G222 PolarHBondContact O-N 3.38Å; R220-G222 PolarHBondContact O-N 3.28Å
223	R	91.6	Very high	92.1	Very high	6 Å²	6	34.9 Å²	34.9	2%	0.023	17%	0.17	C	C	.	.			trans	-104	147.9	173.6	-65.7	174.4	-168.8	68.9	7.5	110.4	M27 G65 N190 P192 L218 A219 I225	M27-R223 PolarHBondContact O-NH2 2.82Å; G65-R223 PolarHBondContact N-O 2.89Å; N190-R223 VanDerWaalsContact OD1-CZ 3.32Å; N190-R223 PolarHBondContact OD1-NE 3.44Å; N190-R223 PolarHBondContact OD1-NH2 2.83Å; P192-R223 CarbonylContact O-C 3.57Å; P192-R223 WeakPolarHBondContact O-CA 3.21Å; L218-R223 PolarHBondContact O-NH1 3.39Å; A219-R223 PolarHBondContact O-N 3.05Å; A219-R223 VanDerWaalsContact O-N 3.08Å; R223-I225 HydrophobicContact CB-CD1 4.41Å; R223-I225 HydrophobicContact CB-CG1 4.05Å
224	T	94.3	Very high	92	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	108	168	-54.9	0	0	0	0	107.7	T33 F62 S64 P192 I193 M194 I226	T33-T224 PolarHBondContact O-OG1 3.33Å; F62-T224 HydrophobicContact CB-CG2 3.91Å; S64-T224 WeakPolarHBondContact CA-OG1 3.38Å; S64-T224 PolarHBondContact N-OG1 3.48Å; P192-T224 PolarHBondContact O-N 3.45Å; I193-T224 WeakPolarHBondContact CA-O 3.3Å; M194-T224 PolarHBondContact N-O 2.9Å; T224-I226 HydrophobicContact CG2-CD1 4.28Å; T224-I226 HydrophobicContact CG2-CG1 4.37Å
225	I	96	Very high	92	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	121.4	-178.8	-60.2	-170.8	0	0	0	110	E66 L67 S68 M194 F196 L215 L218 A219 R223	E66-I225 PolarHBondContact O-N 3.13Å; L67-I225 HydrophobicContact CD1-CB 3.98Å; L67-I225 HydrophobicContact CD1-CG2 3.48Å; L67-I225 VanDerWaalsContact CD1-CG2 3.48Å; S68-I225 PolarHBondContact N-O 2.95Å; M194-I225 HydrophobicContact CB-CG1 4.33Å; M194-I225 WeakPolarHBondContact O-CA 3.49Å; M194-I225 HydrophobicContact SD-CD1 4.43Å; F196-I225 HydrophobicContact CD2-CG2 3.73Å; F196-I225 HydrophobicContact CE2-CG2 3.58Å; L215-I225 WeakPolarHBondContact O-CD1 3.49Å; L218-I225 HydrophobicContact CB-CD1 3.6Å; A219-I225 HydrophobicContact CB-CB 4.25Å; A219-I225 HydrophobicContact CB-CD1 3.94Å; A219-I225 HydrophobicContact CB-CG1 4.07Å; R223-I225 HydrophobicContact CB-CD1 4.41Å; R223-I225 HydrophobicContact CB-CG1 4.05Å
226	I	96.8	Very high	91.9	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	125.8	-178.9	-58.2	159.5	0	0	0	107.7	L35 F62 S68 I70 M194 F195 F196 T224	L35-I226 HydrophobicContact CD2-CD1 3.85Å; F62-I226 HydrophobicContact CB-CD1 3.81Å; F62-I226 HydrophobicContact CB-CG1 3.98Å; F62-I226 HydrophobicContact CD1-CD1 4.41Å; F62-I226 HydrophobicContact CD1-CG1 4.05Å; F62-I226 HydrophobicContact CD2-CD1 3.44Å; F62-I226 VanDerWaalsContact CD2-CD1 3.44Å; F62-I226 HydrophobicContact CD2-CG1 3.98Å; F62-I226 HydrophobicContact CE1-CG2 4.42Å; F62-I226 HydrophobicContact CE2-CD1 4.07Å; F62-I226 HydrophobicContact CE2-CG1 4.46Å; F62-I226 HydrophobicContact CE2-CG2 4.38Å; F62-I226 HydrophobicContact CG-CD1 3.63Å; F62-I226 HydrophobicContact CG-CG1 3.73Å; F62-I226 HydrophobicContact CZ-CG2 4.23Å; S68-I226 WeakPolarHBondContact O-CA 3.3Å; I70-I226 HydrophobicContact CD1-CG2 3.54Å; I70-I226 HydrophobicContact CG1-CG2 4.01Å; M194-I226 PolarHBondContact O-N 2.96Å; F195-I226 CarbonylContact C-O 3.58Å; F195-I226 VanDerWaalsContact CA-O 3.3Å; F195-I226 WeakPolarHBondContact CA-O 3.44Å; F195-I226 HydrophobicContact CD1-CB 3.97Å; F195-I226 HydrophobicContact CD1-CD1 3.96Å; F195-I226 HydrophobicContact CD1-CG2 4.27Å; F195-I226 HydrophobicContact CE1-CB 4.34Å; F195-I226 HydrophobicContact CE1-CD1 3.44Å; F195-I226 VanDerWaalsContact CE1-CD1 3.44Å; F195-I226 HydrophobicContact CE1-CG1 4.48Å; F195-I226 HydrophobicContact CZ-CD1 4.17Å; F196-I226 PolarHBondContact N-O 3.28Å; T224-I226 HydrophobicContact CG2-CD1 4.28Å; T224-I226 HydrophobicContact CG2-CG1 4.37Å
227	C	96	Very high	91.9	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	145.9	175.5	61.8	0	0	0	0	112.5	S68 A69 I70 F196 P199 F240	S68-C227 PolarHBondContact O-N 2.87Å; S68-C227 PolarHBondContact O-SG 3.14Å; A69-C227 CarbonylContact C-O 3.57Å; A69-C227 WeakPolarHBondContact CA-O 3.48Å; I70-C227 PolarHBondContact N-O 3.37Å; F196-C227 HydrophobicContact CB-CB 3.81Å; F196-C227 CarbonylContact O-C 3.56Å; F196-C227 WeakPolarHBondContact O-CA 3.5Å; P199-C227 HydrophobicContact CG-CB 4.01Å; C227-F240 WeakPolarHBondContact SG-CE1 3.47Å
228	T	95.3	Very high	91.9	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	135.8	166.1	50.4	0	0	0	0	109	I70 K78 M82 F196 D197 E198 P199	I70-T228 HydrophobicContact CB-CG2 4.08Å; I70-T228 HydrophobicContact CG2-CG2 4.31Å; I70-T228 WeakPolarHBondContact O-CA 3.44Å; K78-T228 HydrophobicContact CB-CG2 4.2Å; M82-T228 HydrophobicContact CB-CG2 4.23Å; M82-T228 HydrophobicContact CE-CG2 3.85Å; M82-T228 HydrophobicContact SD-CG2 3.75Å; F196-T228 PolarHBondContact O-N 3Å; D197-T228 VanDerWaalsContact CA-OG1 3.31Å; D197-T228 WeakPolarHBondContact CA-OG1 3.42Å; D197-T228 PolarHBondContact OD1-OG1 3.49Å; E198-T228 VanDerWaalsContact CA-O 3.22Å; E198-T228 WeakPolarHBondContact CA-O 3.26Å; E198-T228 PolarHBondContact N-O 3.37Å; E198-T228 PolarHBondContact N-OG1 3.36Å; P199-T228 WeakPolarHBondContact CD-O 3.33Å
229	I	92.3	Very high	92	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.005	20%	0.203	C	C	.	.			trans	-135.2	137.8	179.6	-63.1	-177	0	0	0	110.2	A69 I70 I212 P232 F240	A69-I229 HydrophobicContact CB-CD1 4.44Å; I70-I229 PolarHBondContact O-N 2.92Å; I70-I229 VanDerWaalsContact O-N 3.09Å; I212-I229 HydrophobicContact CD1-CD1 4.44Å; I229-P232 HydrophobicContact CG2-CB 3.79Å; I229-P232 HydrophobicContact CG2-CG 3.88Å; I229-F240 HydrophobicContact CD1-CD2 4.33Å; I229-F240 HydrophobicContact CD1-CE1 3.58Å; I229-F240 HydrophobicContact CD1-CE2 3.32Å; I229-F240 HydrophobicContact CD1-CZ 2.91Å; I229-F240 HydrophobicContact CG1-CZ 4.36Å
230	H	84.8	Confident	92.1	Very high	72 Å²	72	40 Å²	40	33%	0.333	21%	0.205	S	C	.	.	S	Bend	trans	-104.8	127.4	171.1	-163.7	-82.6	0	0	0	108.9
231	Q	84.8	Confident	92.3	Very high	114 Å²	114	34.2 Å²	34.2	53%	0.533	19%	0.187	S	C	.	.	S	Bend	trans	34	69.6	172	-68.2	173.9	-30.1	0	0	115.1
232	P	89.8	Confident	92.7	Very high	7 Å²	7	34 Å²	34	5%	0.045	18%	0.179	C	C	.	.			trans	-73.6	147	177.5	29.5	-29.6	0	0	0	111.2	M71 I229 I236 F237 N276 A278	M71-P232 HydrophobicContact CE-CG 3.86Å; M71-P232 HydrophobicContact SD-CG 4.1Å; I229-P232 HydrophobicContact CG2-CB 3.79Å; I229-P232 HydrophobicContact CG2-CG 3.88Å; P232-I236 HydrophobicContact CB-CB 4.2Å; P232-I236 HydrophobicContact CB-CG2 3.87Å; P232-F237 HydrophobicContact CB-CB 4.44Å; P232-F237 HydrophobicContact CG-CB 4.13Å; P232-F237 HydrophobicContact CG-CD2 4.04Å; P232-F237 HydrophobicContact CG-CG 4.49Å; P232-N276 PolarHBondContact O-ND2 3.45Å; P232-A278 HydrophobicContact CG-CB 4.04Å
233	S	90.7	Very high	93	Very high	63 Å²	63	33 Å²	33	44%	0.441	17%	0.168	S	C	.	.			trans	-60.8	152.1	165.9	67.8	0	0	0	0	110.9	K235 I236 F237	S233-K235 PolarHBondContact O-N 3.19Å; S233-K235 VanDerWaalsContact O-N 3.15Å; S233-I236 WeakPolarHBondContact O-CA 3.38Å; S233-I236 PolarHBondContact O-N 2.85Å; S233-I236 WeakPolarHBondContact OG-CG1 3.36Å; S233-F237 PolarHBondContact O-N 3.05Å
234	A	90.8	Very high	93.2	Very high	39 Å²	39	32.8 Å²	32.8	32%	0.322	17%	0.167	S	C	.	.	H	α-helix	trans	-51	-42.6	179.9	0	0	0	0	0	112.6	I236 F237 E238 N276	A234-I236 VanDerWaalsContact C-N 3.32Å; A234-I236 PolarHBondContact O-N 3.46Å; A234-F237 WeakPolarHBondContact O-CB 3.36Å; A234-F237 PolarHBondContact O-N 3.2Å; A234-E238 WeakPolarHBondContact O-CG 3.39Å; A234-E238 PolarHBondContact O-N 3.19Å; A234-N276 HydrophobicContact CB-CB 4.48Å
235	K	91.5	Very high	93.2	Very high	131 Å²	131	32.8 Å²	32.8	57%	0.57	17%	0.168	S	C	*	.	H	α-helix	trans	-61.3	-36.2	176.9	-172.3	176.4	-175.3	178.2	0	113.4	F209 S233	F209-K235 HydrophobicContact CD2-CD 4.14Å; F209-K235 HydrophobicContact CD2-CG 4.14Å; F209-K235 HydrophobicContact CE2-CD 4.1Å; F209-K235 VanDerWaalsContact CE2-CE 3.43Å; F209-K235 HydrophobicContact CE2-CG 3.99Å; S233-K235 PolarHBondContact O-N 3.19Å; S233-K235 VanDerWaalsContact O-N 3.15Å
236	I	93.1	Very high	93.2	Very high	14 Å²	14	32.8 Å²	32.8	7%	0.072	17%	0.168	C	C	.	.	H	α-helix	trans	-76	-40.3	176	-71.1	170.6	0	0	0	109.9	C208 I212 P232 S233 A234 E238 L239 F240	C208-I236 HydrophobicContact CB-CD1 3.74Å; I212-I236 HydrophobicContact CG1-CG2 3.99Å; I212-I236 HydrophobicContact CG2-CG2 4.41Å; P232-I236 HydrophobicContact CB-CB 4.2Å; P232-I236 HydrophobicContact CB-CG2 3.87Å; S233-I236 WeakPolarHBondContact O-CA 3.38Å; S233-I236 PolarHBondContact O-N 2.85Å; S233-I236 WeakPolarHBondContact OG-CG1 3.36Å; A234-I236 VanDerWaalsContact C-N 3.32Å; A234-I236 PolarHBondContact O-N 3.46Å; I236-E238 VanDerWaalsContact C-N 3.33Å; I236-E238 PolarHBondContact O-N 2.71Å; I236-L239 WeakPolarHBondContact O-CB 3.33Å; I236-L239 PolarHBondContact O-N 3.29Å; I236-L239 VanDerWaalsContact O-N 3.09Å; I236-F240 HydrophobicContact CG2-CE2 3.9Å; I236-F240 WeakPolarHBondContact O-CD2 3.08Å; I236-F240 VanDerWaalsContact O-CE2 3.31Å; I236-F240 WeakPolarHBondContact O-CE2 3.32Å
237	F	94	Very high	93	Very high	8 Å²	8	33 Å²	33	4%	0.035	17%	0.169	C	C	.	.	H	α-helix	trans	-60	-41	-179.6	-175.3	-116.9	0	0	0	112.5	M71 P232 S233 A234 L239 F240 L243 V257 L260 P277 A278	M71-F237 HydrophobicContact SD-CD2 4.19Å; M71-F237 HydrophobicContact SD-CE2 3.95Å; P232-F237 HydrophobicContact CB-CB 4.44Å; P232-F237 HydrophobicContact CG-CB 4.13Å; P232-F237 HydrophobicContact CG-CD2 4.04Å; P232-F237 HydrophobicContact CG-CG 4.49Å; S233-F237 PolarHBondContact O-N 3.05Å; A234-F237 WeakPolarHBondContact O-CB 3.36Å; A234-F237 PolarHBondContact O-N 3.2Å; F237-L239 PolarHBondContact O-N 2.63Å; F237-L239 VanDerWaalsContact O-N 3.16Å; F237-F240 PolarHBondContact O-N 3.09Å; F237-F240 VanDerWaalsContact O-N 3.16Å; F237-L243 HydrophobicContact CE2-CD1 4.32Å; F237-L243 HydrophobicContact CE2-CD2 4.14Å; F237-L243 HydrophobicContact CZ-CD2 4.02Å; F237-V257 HydrophobicContact CD1-CG1 3.9Å; F237-V257 HydrophobicContact CE1-CG1 3.42Å; F237-V257 VanDerWaalsContact CE1-CG1 3.42Å; F237-V257 HydrophobicContact CE2-CG1 4.15Å; F237-V257 HydrophobicContact CG-CG1 4.45Å; F237-V257 HydrophobicContact CZ-CG1 3.56Å; F237-L260 HydrophobicContact CE1-CD2 4.09Å; F237-L260 HydrophobicContact CZ-CD2 3.66Å; F237-P277 HydrophobicContact CE1-CB 4.18Å; F237-A278 HydrophobicContact CB-CB 4.31Å; F237-A278 HydrophobicContact CD1-CB 4.05Å; F237-A278 HydrophobicContact CD2-CB 3.68Å; F237-A278 HydrophobicContact CE1-CB 4.25Å; F237-A278 HydrophobicContact CE2-CB 3.91Å; F237-A278 HydrophobicContact CG-CB 3.75Å; F237-A278 HydrophobicContact CZ-CB 4.19Å
238	E	93.1	Very high	92.7	Very high	143 Å²	143	37.4 Å²	37.4	67%	0.668	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-15.4	175.9	-72.9	176.7	-179.3	0	0	114.6	A234 I236 F240	A234-E238 WeakPolarHBondContact O-CG 3.39Å; A234-E238 PolarHBondContact O-N 3.19Å; I236-E238 VanDerWaalsContact C-N 3.33Å; I236-E238 PolarHBondContact O-N 2.71Å; E238-F240 VanDerWaalsContact C-N 3.32Å
239	L	94.7	Very high	92.5	Very high	21 Å²	21	37.5 Å²	37.5	11%	0.11	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-16.9	176.6	-63.4	176.3	0	0	0	113	F209 I212 R216 I236 F237	F209-L239 HydrophobicContact CD2-CD1 3.97Å; F209-L239 HydrophobicContact CE2-CD1 3.82Å; F209-L239 HydrophobicContact CE2-CD2 4.49Å; I212-L239 HydrophobicContact CB-CD1 4.15Å; I212-L239 HydrophobicContact CG2-CB 3.8Å; I212-L239 HydrophobicContact CG2-CD1 3.68Å; I212-L239 HydrophobicContact CG2-CG 4.41Å; R216-L239 VanDerWaalsContact CD-O 3.31Å; R216-L239 WeakPolarHBondContact CD-O 3.45Å; R216-L239 PolarHBondContact NE-O 2.69Å; I236-L239 WeakPolarHBondContact O-CB 3.33Å; I236-L239 PolarHBondContact O-N 3.29Å; I236-L239 VanDerWaalsContact O-N 3.09Å; F237-L239 PolarHBondContact O-N 2.63Å; F237-L239 VanDerWaalsContact O-N 3.16Å
240	F	96.2	Very high	92.5	Very high	7 Å²	7	39.5 Å²	39.5	3%	0.031	20%	0.202	C	C	.	.			trans	-79.2	136.8	178.3	-69.1	-76.6	0	0	0	111.1	L67 A69 I212 C227 I229 I236 F237 E238 V257	L67-F240 HydrophobicContact CD1-CD1 4.47Å; L67-F240 HydrophobicContact CD1-CE1 4.03Å; L67-F240 HydrophobicContact CD2-CD1 3.83Å; L67-F240 HydrophobicContact CD2-CE1 3.54Å; L67-F240 HydrophobicContact CD2-CZ 4.14Å; L67-F240 HydrophobicContact CG-CD1 3.6Å; L67-F240 HydrophobicContact CG-CE1 3.53Å; A69-F240 HydrophobicContact CB-CB 4.38Å; A69-F240 HydrophobicContact CB-CD1 3.54Å; A69-F240 HydrophobicContact CB-CD2 4.29Å; A69-F240 HydrophobicContact CB-CE1 4.04Å; A69-F240 HydrophobicContact CB-CG 3.75Å; I212-F240 HydrophobicContact CD1-CZ 4Å; I212-F240 HydrophobicContact CG1-CZ 4.34Å; I212-F240 HydrophobicContact CG2-CE1 4.45Å; I212-F240 HydrophobicContact CG2-CE2 3.99Å; I212-F240 HydrophobicContact CG2-CZ 3.64Å; C227-F240 WeakPolarHBondContact SG-CE1 3.47Å; I229-F240 HydrophobicContact CD1-CD2 4.33Å; I229-F240 HydrophobicContact CD1-CE1 3.58Å; I229-F240 HydrophobicContact CD1-CE2 3.32Å; I229-F240 HydrophobicContact CD1-CZ 2.91Å; I229-F240 HydrophobicContact CG1-CZ 4.36Å; I236-F240 HydrophobicContact CG2-CE2 3.9Å; I236-F240 WeakPolarHBondContact O-CD2 3.08Å; I236-F240 VanDerWaalsContact O-CE2 3.31Å; I236-F240 WeakPolarHBondContact O-CE2 3.32Å; F237-F240 PolarHBondContact O-N 3.09Å; F237-F240 VanDerWaalsContact O-N 3.16Å; E238-F240 VanDerWaalsContact C-N 3.32Å; F240-V257 HydrophobicContact CB-CG2 3.68Å; F240-V257 WeakPolarHBondContact O-CB 3.35Å; F240-V257 VanDerWaalsContact O-CG2 3.24Å; F240-V257 WeakPolarHBondContact O-CG2 3.18Å
241	D	95.7	Very high	93	Very high	46 Å²	46	36.8 Å²	36.8	25%	0.246	19%	0.191	C	C	.	.	S	Bend	trans	-88.7	-35.7	177.8	-51.6	-60.3	0	0	0	110	E66 L67 R216 P256 V257	E66-D241 HydrophobicContact CB-CB 4.33Å; L67-D241 PolarHBondContact N-OD2 2.88Å; L67-D241 PolarHBondContact O-N 3.23Å; R216-D241 IonicContact CZ-OD1 3.93Å; R216-D241 IonicContact NE-OD1 3.31Å; R216-D241 IonicContact NH2-OD1 3.76Å; R216-D241 PolarHBondContact NH2-OD1 3.36Å; D241-P256 VanDerWaalsContact O-CA 3.32Å; D241-P256 WeakPolarHBondContact O-CA 3.3Å; D241-V257 PolarHBondContact O-N 2.88Å
242	H	95.5	Very high	93.4	Very high	21 Å²	21	31.4 Å²	31.4	10%	0.097	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	142.1	-178.1	-178.3	-95.7	0	0	0	112.2	F62 L67 S68 A69 G255	F62-H242 AromaticContact CD1-ND1 4Å; L67-H242 PolarHBondContact O-N 3.08Å; S68-H242 CarbonylContact C-O 3.56Å; S68-H242 WeakPolarHBondContact CA-O 3.45Å; A69-H242 PolarHBondContact N-O 3.46Å; H242-G255 VanDerWaalsContact CD2-C 3.44Å; H242-G255 VanDerWaalsContact CD2-CA 3.47Å; H242-G255 WeakPolarHBondContact CD2-CA 3.47Å; H242-G255 PolarHBondContact CD2-O 2.88Å; H242-G255 WeakPolarHBondContact NE2-CA 3.04Å; H242-G255 PolarHBondContact NE2-N 3.27Å
243	L	95.8	Very high	93.5	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.005	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	131.3	177.8	173.5	69.1	0	0	0	110.4	A69 M71 F237 F245 Y253 R254 G255 V257 L260	A69-L243 HydrophobicContact CB-CD1 4.26Å; A69-L243 WeakPolarHBondContact O-CA 3.27Å; M71-L243 HydrophobicContact CB-CD1 3.9Å; M71-L243 HydrophobicContact CG-CD1 3.71Å; M71-L243 HydrophobicContact SD-CD1 3.67Å; F237-L243 HydrophobicContact CE2-CD1 4.32Å; F237-L243 HydrophobicContact CE2-CD2 4.14Å; F237-L243 HydrophobicContact CZ-CD2 4.02Å; L243-F245 HydrophobicContact CD1-CD2 4.49Å; L243-Y253 HydrophobicContact CB-CD1 4.19Å; L243-Y253 HydrophobicContact CB-CE1 4Å; L243-Y253 HydrophobicContact CD2-CD1 3.77Å; L243-Y253 HydrophobicContact CD2-CE1 3.96Å; L243-Y253 HydrophobicContact CG-CD1 3.94Å; L243-Y253 HydrophobicContact CG-CE1 4.21Å; L243-R254 CarbonylContact O-C 3.55Å; L243-R254 VanDerWaalsContact O-CA 3.32Å; L243-R254 WeakPolarHBondContact O-CA 3.27Å; L243-G255 PolarHBondContact N-O 3.46Å; L243-G255 PolarHBondContact O-N 2.87Å; L243-V257 HydrophobicContact CB-CG2 3.98Å; L243-L260 HydrophobicContact CD2-CD1 4.33Å; L243-L260 HydrophobicContact CD2-CD2 3.91Å
244	Y	95.7	Very high	93.6	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	116.3	170.9	-164.9	-84.8	0	0	0	109.2	F37 S59 F62 A69 I70 M71 L81 L246 C251 R254	F37-Y244 HydrophobicContact CE2-CE2 4.36Å; F37-Y244 AromaticContact CE2-CZ 3.94Å; F37-Y244 WeakPolarHBondContact CE2-OH 3.48Å; F37-Y244 HydrophobicContact CZ-CD2 4.42Å; F37-Y244 HydrophobicContact CZ-CE1 4.26Å; F37-Y244 AromaticContact CZ-CE2 3.7Å; F37-Y244 HydrophobicContact CZ-CE2 3.7Å; F37-Y244 AromaticContact CZ-CZ 3.6Å; S59-Y244 PolarHBondContact O-OH 3.32Å; F62-Y244 HydrophobicContact CZ-CD2 4.45Å; F62-Y244 HydrophobicContact CZ-CG 4.28Å; A69-Y244 PolarHBondContact O-N 2.91Å; I70-Y244 CarbonylContact C-O 3.56Å; I70-Y244 VanDerWaalsContact CA-O 3.28Å; I70-Y244 WeakPolarHBondContact CA-O 3.43Å; M71-Y244 PolarHBondContact N-O 3.14Å; L81-Y244 HydrophobicContact CD2-CD1 4.05Å; L81-Y244 HydrophobicContact CD2-CE1 3.79Å; Y244-L246 HydrophobicContact CD1-CD2 4.48Å; Y244-L246 HydrophobicContact CD1-CG 4.19Å; Y244-L246 HydrophobicContact CE1-CD2 3.78Å; Y244-L246 HydrophobicContact CE1-CG 3.98Å; Y244-C251 HydrophobicContact CE1-CB 4.16Å; Y244-C251 VanDerWaalsContact CZ-SG 3.52Å; Y244-C251 WeakPolarHBondContact OH-CB 3.43Å; Y244-R254 HydrophobicContact CD2-CB 3.67Å; Y244-R254 HydrophobicContact CE2-CB 3.85Å
245	F	95.5	Very high	93.7	Very high	1 Å²	1	29.9 Å²	29.9	0%	0.004	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	128.9	-171.2	-156.3	-71.1	0	0	0	112.1	M71 L243 C251 I252 Y253 F281 M282 A285	M71-F245 HydrophobicContact CB-CD2 3.65Å; M71-F245 HydrophobicContact CB-CE2 3.89Å; M71-F245 HydrophobicContact CB-CG 4.44Å; M71-F245 WeakPolarHBondContact O-CA 3.49Å; L243-F245 HydrophobicContact CD1-CD2 4.49Å; F245-C251 WeakPolarHBondContact O-CA 3.4Å; F245-I252 HydrophobicContact CB-CG1 4.08Å; F245-I252 HydrophobicContact CD1-CD1 3.39Å; F245-I252 HydrophobicContact CD1-CG1 3.45Å; F245-I252 VanDerWaalsContact CD1-CG1 3.45Å; F245-I252 HydrophobicContact CE1-CD1 3.62Å; F245-I252 HydrophobicContact CE1-CG1 4.2Å; F245-I252 HydrophobicContact CG-CD1 4.25Å; F245-I252 HydrophobicContact CG-CG1 4.11Å; F245-I252 PolarHBondContact O-N 3.42Å; F245-Y253 PolarHBondContact N-O 3.49Å; F245-F281 HydrophobicContact CB-CD1 4.36Å; F245-F281 HydrophobicContact CB-CE1 3.54Å; F245-F281 HydrophobicContact CB-CZ 4.33Å; F245-F281 HydrophobicContact CD1-CD1 4.35Å; F245-F281 AromaticContact CD1-CE1 3.89Å; F245-F281 HydrophobicContact CD1-CE1 3.89Å; F245-F281 HydrophobicContact CD1-CZ 4.4Å; F245-F281 AromaticContact CD2-CD1 3.22Å; F245-F281 HydrophobicContact CD2-CD1 3.22Å; F245-F281 AromaticContact CD2-CE1 3.31Å; F245-F281 HydrophobicContact CD2-CE1 3.31Å; F245-F281 HydrophobicContact CD2-CG 4.35Å; F245-F281 HydrophobicContact CD2-CZ 4.48Å; F245-F281 HydrophobicContact CE1-CD1 4.45Å; F245-F281 HydrophobicContact CE1-CE1 4.36Å; F245-F281 HydrophobicContact CE2-CB 4.46Å; F245-F281 AromaticContact CE2-CD1 3.36Å; F245-F281 HydrophobicContact CE2-CD1 3.36Å; F245-F281 AromaticContact CE2-CE1 3.86Å; F245-F281 HydrophobicContact CE2-CE1 3.86Å; F245-F281 HydrophobicContact CE2-CG 4.1Å; F245-F281 AromaticContact CG-CD1 3.74Å; F245-F281 HydrophobicContact CG-CD1 3.74Å; F245-F281 AromaticContact CG-CE1 3.3Å; F245-F281 HydrophobicContact CG-CE1 3.3Å; F245-F281 HydrophobicContact CG-CZ 4.17Å; F245-F281 AromaticContact CZ-CD1 3.97Å; F245-F281 HydrophobicContact CZ-CD1 3.97Å; F245-F281 HydrophobicContact CZ-CE1 4.32Å; F245-F281 HydrophobicContact CZ-CG 4.43Å; F245-M282 HydrophobicContact CE1-SD 4.38Å; F245-M282 HydrophobicContact CE2-CG 4.07Å; F245-M282 HydrophobicContact CE2-SD 3.67Å; F245-M282 HydrophobicContact CZ-CG 4Å; F245-M282 HydrophobicContact CZ-SD 3.35Å; F245-M282 WeakPolarHBondContact CZ-SD 3.28Å; F245-A285 HydrophobicContact CE1-CB 3.45Å; F245-A285 VanDerWaalsContact CE1-CB 3.45Å; F245-A285 HydrophobicContact CZ-CB 3.82Å
246	L	94.3	Very high	93.8	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	142.8	-177.5	-72.9	172.2	0	0	0	112.6	I58 I70 M71 G72 P73 A76 L81 Y244 H250 C251	I58-L246 HydrophobicContact CD1-CD2 3.98Å; I58-L246 HydrophobicContact CG2-CD2 4.29Å; I70-L246 HydrophobicContact CG2-CD1 4.31Å; M71-L246 PolarHBondContact O-N 3.35Å; G72-L246 WeakPolarHBondContact CA-O 3.45Å; P73-L246 VanDerWaalsContact CD-O 3.32Å; P73-L246 WeakPolarHBondContact CD-O 3.21Å; A76-L246 HydrophobicContact CB-CB 4.25Å; A76-L246 WeakPolarHBondContact CB-O 3.32Å; L81-L246 HydrophobicContact CB-CD1 4.19Å; L81-L246 HydrophobicContact CD2-CD1 3.78Å; Y244-L246 HydrophobicContact CD1-CD2 4.48Å; Y244-L246 HydrophobicContact CD1-CG 4.19Å; Y244-L246 HydrophobicContact CE1-CD2 3.78Å; Y244-L246 HydrophobicContact CE1-CG 3.98Å; L246-H250 CarbonylContact C-O 3.55Å; L246-H250 VanDerWaalsContact CA-O 3.31Å; L246-H250 WeakPolarHBondContact CA-O 3.2Å; L246-H250 WeakPolarHBondContact CD2-O 2.9Å; L246-C251 HydrophobicContact CD2-CB 4.38Å
247	T	93.7	Very high	93.8	Very high	5 Å²	5	25.9 Å²	25.9	3%	0.031	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	126.8	171.4	-50.3	0	0	0	0	108.9	P73 G249 H250 I252 A285 Y293	P73-T247 HydrophobicContact CG-CG2 4.46Å; T247-G249 PolarHBondContact O-N 3.37Å; T247-H250 PolarHBondContact N-O 3.1Å; T247-H250 PolarHBondContact O-N 3.27Å; T247-I252 WeakPolarHBondContact OG1-CD1 3.29Å; T247-A285 HydrophobicContact CG2-CB 4.37Å; T247-A285 WeakPolarHBondContact CG2-O 3.3Å; T247-Y293 HydrophobicContact CG2-CG 4.42Å
248	D	90.1	Very high	93.7	Very high	92 Å²	92	30.2 Å²	30.2	49%	0.492	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.2	37	-179.3	-74.5	-15.3	0	0	0	116	K56 H250	K56-D248 WeakPolarHBondContact CD-O 3.33Å; K56-D248 WeakPolarHBondContact CE-O 3.36Å; K56-D248 PolarHBondContact NZ-O 3.03Å; D248-H250 VanDerWaalsContact C-N 3.32Å
249	G	90.6	Very high	93.7	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.01	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.4	4.6	179.7	0	0	0	0	0	115.4	I54 K56 I58 A76 T247	I54-G249 WeakPolarHBondContact O-CA 3.35Å; K56-G249 PolarHBondContact N-O 3.02Å; I58-G249 VanDerWaalsContact CG2-O 3.31Å; I58-G249 WeakPolarHBondContact CG2-O 3.24Å; A76-G249 PolarHBondContact O-N 3.48Å; T247-G249 PolarHBondContact O-N 3.37Å
250	H	93	Very high	93.6	Very high	43 Å²	43	22.8 Å²	22.8	20%	0.199	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	149.7	174.1	-61.7	-72.4	0	0	0	111.2	K56 L246 T247 D248 A297	K56-H250 VanDerWaalsContact CD-CE1 3.48Å; K56-H250 WeakPolarHBondContact CD-CE1 3.45Å; K56-H250 WeakPolarHBondContact CD-NE2 3.37Å; L246-H250 CarbonylContact C-O 3.55Å; L246-H250 VanDerWaalsContact CA-O 3.31Å; L246-H250 WeakPolarHBondContact CA-O 3.2Å; L246-H250 WeakPolarHBondContact CD2-O 2.9Å; T247-H250 PolarHBondContact N-O 3.1Å; T247-H250 PolarHBondContact O-N 3.27Å; D248-H250 VanDerWaalsContact C-N 3.32Å; H250-A297 HydrophobicContact CB-CB 4.11Å
251	C	93.9	Very high	93.4	Very high	16 Å²	16	25.4 Å²	25.4	11%	0.108	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	121.8	170.8	176.6	0	0	0	0	109.3	I58 Y244 F245 L246 Y253 A297	I58-C251 HydrophobicContact CG2-CB 4.26Å; Y244-C251 HydrophobicContact CE1-CB 4.16Å; Y244-C251 VanDerWaalsContact CZ-SG 3.52Å; Y244-C251 WeakPolarHBondContact OH-CB 3.43Å; F245-C251 WeakPolarHBondContact O-CA 3.4Å; L246-C251 HydrophobicContact CD2-CB 4.38Å; C251-Y253 PolarHBondContact SG-O 3.43Å; C251-Y253 VanDerWaalsContact SG-O 3.33Å; C251-A297 WeakPolarHBondContact O-CA 3.43Å
252	I	93	Very high	93.1	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	-16.2	-179.8	63.2	162.4	0	0	0	113.2	F245 T247 Y263 F281 A285 L296 A297	F245-I252 HydrophobicContact CB-CG1 4.08Å; F245-I252 HydrophobicContact CD1-CD1 3.39Å; F245-I252 HydrophobicContact CD1-CG1 3.45Å; F245-I252 VanDerWaalsContact CD1-CG1 3.45Å; F245-I252 HydrophobicContact CE1-CD1 3.62Å; F245-I252 HydrophobicContact CE1-CG1 4.2Å; F245-I252 HydrophobicContact CG-CD1 4.25Å; F245-I252 HydrophobicContact CG-CG1 4.11Å; F245-I252 PolarHBondContact O-N 3.42Å; T247-I252 WeakPolarHBondContact OG1-CD1 3.29Å; I252-Y263 PolarHBondContact O-OH 3.47Å; I252-F281 HydrophobicContact CD1-CE1 4.1Å; I252-F281 HydrophobicContact CD1-CE2 3.75Å; I252-F281 HydrophobicContact CD1-CZ 3.42Å; I252-F281 VanDerWaalsContact CD1-CZ 3.42Å; I252-F281 HydrophobicContact CG1-CE1 4.33Å; I252-F281 HydrophobicContact CG1-CE2 4.5Å; I252-F281 HydrophobicContact CG1-CZ 3.74Å; I252-A285 HydrophobicContact CD1-CB 3.97Å; I252-L296 HydrophobicContact CB-CB 3.87Å; I252-L296 HydrophobicContact CD1-CD1 4.35Å; I252-L296 HydrophobicContact CG2-CB 4.25Å; I252-A297 HydrophobicContact CG2-CB 4.28Å
253	Y	93.7	Very high	92.9	Very high	1 Å²	1	24.5 Å²	24.5	0%	0.004	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	142.6	174.1	-177.7	-97.7	0	0	0	110.5	L243 F245 C251 P256 C259 L260 Y263 F281 L305	L243-Y253 HydrophobicContact CB-CD1 4.19Å; L243-Y253 HydrophobicContact CB-CE1 4Å; L243-Y253 HydrophobicContact CD2-CD1 3.77Å; L243-Y253 HydrophobicContact CD2-CE1 3.96Å; L243-Y253 HydrophobicContact CG-CD1 3.94Å; L243-Y253 HydrophobicContact CG-CE1 4.21Å; F245-Y253 PolarHBondContact N-O 3.49Å; C251-Y253 PolarHBondContact SG-O 3.43Å; C251-Y253 VanDerWaalsContact SG-O 3.33Å; Y253-P256 PolarHBondContact OH-O 3.24Å; Y253-C259 WeakPolarHBondContact OH-CB 3.32Å; Y253-L260 HydrophobicContact CD1-CD1 4.29Å; Y253-L260 HydrophobicContact CD2-CD1 4.15Å; Y253-L260 HydrophobicContact CE1-CD1 4.36Å; Y253-L260 HydrophobicContact CE2-CD1 4.2Å; Y253-L260 HydrophobicContact CG-CD1 4.17Å; Y253-L260 PolarHBondContact OH-N 3.19Å; Y253-Y263 AromaticContact CD2-CD1 3.42Å; Y253-Y263 HydrophobicContact CD2-CD1 3.42Å; Y253-Y263 VanDerWaalsContact CD2-CD1 3.42Å; Y253-Y263 HydrophobicContact CD2-CD2 4.33Å; Y253-Y263 AromaticContact CD2-CE1 3.65Å; Y253-Y263 HydrophobicContact CD2-CE1 3.65Å; Y253-Y263 AromaticContact CD2-CG 3.77Å; Y253-Y263 HydrophobicContact CD2-CG 3.77Å; Y253-Y263 AromaticContact CE2-CD1 3.82Å; Y253-Y263 HydrophobicContact CE2-CD1 3.82Å; Y253-Y263 HydrophobicContact CE2-CD2 4.39Å; Y253-Y263 HydrophobicContact CE2-CE1 4.46Å; Y253-Y263 AromaticContact CE2-CG 3.76Å; Y253-Y263 HydrophobicContact CE2-CG 3.76Å; Y253-F281 HydrophobicContact CG-CE1 4.31Å; Y253-F281 HydrophobicContact CG-CZ 4.45Å; Y253-L305 HydrophobicContact CE2-CD1 3.63Å; Y253-L305 HydrophobicContact CE2-CD2 3.82Å; Y253-L305 HydrophobicContact CE2-CG 4.39Å
254	R	92.7	Very high	92.6	Very high	70 Å²	70	24.4 Å²	24.4	26%	0.264	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	117	172.3	59.9	-172.9	-177.8	166.8	5.6	108.9	S59 L243 Y244 L305	S59-R254 PolarHBondContact O-NH1 3.16Å; L243-R254 CarbonylContact O-C 3.55Å; L243-R254 VanDerWaalsContact O-CA 3.32Å; L243-R254 WeakPolarHBondContact O-CA 3.27Å; Y244-R254 HydrophobicContact CD2-CB 3.67Å; Y244-R254 HydrophobicContact CE2-CB 3.85Å; R254-L305 WeakPolarHBondContact O-CD2 3.26Å
255	G	92.1	Very high	92.4	Very high	6 Å²	6	27.1 Å²	27.1	6%	0.062	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	156.2	-167.6	176.8	0	0	0	0	0	114	H242 L243	H242-G255 VanDerWaalsContact CD2-C 3.44Å; H242-G255 VanDerWaalsContact CD2-CA 3.47Å; H242-G255 WeakPolarHBondContact CD2-CA 3.47Å; H242-G255 PolarHBondContact CD2-O 2.88Å; H242-G255 WeakPolarHBondContact NE2-CA 3.04Å; H242-G255 PolarHBondContact NE2-N 3.27Å; L243-G255 PolarHBondContact N-O 3.46Å; L243-G255 PolarHBondContact O-N 2.87Å
256	P	93.9	Very high	92	Very high	45 Å²	45	29.6 Å²	29.6	29%	0.292	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	143.4	-175.2	-22.4	33.4	0	0	0	113	D241 Y253 S258 C259	D241-P256 VanDerWaalsContact O-CA 3.32Å; D241-P256 WeakPolarHBondContact O-CA 3.3Å; Y253-P256 PolarHBondContact OH-O 3.24Å; P256-S258 VanDerWaalsContact C-N 3.27Å; P256-S258 PolarHBondContact O-N 3.26Å; P256-C259 PolarHBondContact O-N 3.38Å; P256-C259 VanDerWaalsContact O-N 3.12Å
257	V	93.6	Very high	91.7	Very high	17 Å²	17	31 Å²	31	10%	0.103	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-60.9	-36.9	-179.9	175.5	0	0	0	0	112.6	F237 F240 D241 L243 C259 L260	F237-V257 HydrophobicContact CD1-CG1 3.9Å; F237-V257 HydrophobicContact CE1-CG1 3.42Å; F237-V257 VanDerWaalsContact CE1-CG1 3.42Å; F237-V257 HydrophobicContact CE2-CG1 4.15Å; F237-V257 HydrophobicContact CG-CG1 4.45Å; F237-V257 HydrophobicContact CZ-CG1 3.56Å; F240-V257 HydrophobicContact CB-CG2 3.68Å; F240-V257 WeakPolarHBondContact O-CB 3.35Å; F240-V257 VanDerWaalsContact O-CG2 3.24Å; F240-V257 WeakPolarHBondContact O-CG2 3.18Å; D241-V257 PolarHBondContact O-N 2.88Å; L243-V257 HydrophobicContact CB-CG2 3.98Å; V257-C259 PolarHBondContact O-N 2.95Å; V257-C259 VanDerWaalsContact O-N 3.14Å; V257-L260 WeakPolarHBondContact O-CB 3.32Å; V257-L260 PolarHBondContact O-N 2.91Å; V257-L260 VanDerWaalsContact O-N 3.16Å
258	S	91.5	Very high	91.5	Very high	99 Å²	99	36.5 Å²	36.5	69%	0.692	22%	0.218	S	C	*	.	G	3₁₀ helix	trans	-61.9	-21.1	178.1	57	0	0	0	0	114.5	P256	P256-S258 VanDerWaalsContact C-N 3.27Å; P256-S258 PolarHBondContact O-N 3.26Å
259	C	92.4	Very high	91.4	Very high	6 Å²	6	32.8 Å²	32.8	4%	0.041	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-92.6	-4.6	-178.2	-60.6	0	0	0	0	113	Y253 P256 V257 P262 Y263 L305 L312	Y253-C259 WeakPolarHBondContact OH-CB 3.32Å; P256-C259 PolarHBondContact O-N 3.38Å; P256-C259 VanDerWaalsContact O-N 3.12Å; V257-C259 PolarHBondContact O-N 2.95Å; V257-C259 VanDerWaalsContact O-N 3.14Å; C259-P262 WeakPolarHBondContact O-CD 3.25Å; C259-Y263 VanDerWaalsContact O-CB 3.26Å; C259-Y263 WeakPolarHBondContact O-CB 3.32Å; C259-Y263 PolarHBondContact O-N 2.73Å; C259-L305 HydrophobicContact CB-CD1 4.17Å; C259-L312 HydrophobicContact CB-CD1 4.33Å; C259-L312 VanDerWaalsContact SG-CD1 3.59Å
260	L	92.2	Very high	91.4	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-63.4	-50.8	-176.7	177.6	63	0	0	0	112.3	F237 L243 Y253 V257 Y263 L264 P277 F281	F237-L260 HydrophobicContact CE1-CD2 4.09Å; F237-L260 HydrophobicContact CZ-CD2 3.66Å; L243-L260 HydrophobicContact CD2-CD1 4.33Å; L243-L260 HydrophobicContact CD2-CD2 3.91Å; Y253-L260 HydrophobicContact CD1-CD1 4.29Å; Y253-L260 HydrophobicContact CD2-CD1 4.15Å; Y253-L260 HydrophobicContact CE1-CD1 4.36Å; Y253-L260 HydrophobicContact CE2-CD1 4.2Å; Y253-L260 HydrophobicContact CG-CD1 4.17Å; Y253-L260 PolarHBondContact OH-N 3.19Å; V257-L260 WeakPolarHBondContact O-CB 3.32Å; V257-L260 PolarHBondContact O-N 2.91Å; V257-L260 VanDerWaalsContact O-N 3.16Å; L260-Y263 WeakPolarHBondContact O-CB 3.37Å; L260-Y263 PolarHBondContact O-N 2.92Å; L260-L264 HydrophobicContact CD1-CD1 4.21Å; L260-L264 HydrophobicContact CD1-CG 4.28Å; L260-L264 HydrophobicContact CG-CD1 4.12Å; L260-L264 WeakPolarHBondContact O-CG 3.4Å; L260-L264 PolarHBondContact O-N 2.97Å; L260-P277 HydrophobicContact CD2-CB 4.47Å; L260-F281 HydrophobicContact CD1-CD1 3.72Å; L260-F281 HydrophobicContact CD1-CD2 4.38Å; L260-F281 HydrophobicContact CD1-CE1 3.82Å; L260-F281 HydrophobicContact CD1-CE2 4.47Å; L260-F281 HydrophobicContact CD1-CG 4.02Å; L260-F281 HydrophobicContact CD1-CZ 4.22Å; L260-F281 HydrophobicContact CD2-CB 4.27Å; L260-F281 HydrophobicContact CD2-CD1 4.21Å; L260-F281 HydrophobicContact CD2-CG 4.44Å
261	V	92.4	Very high	91.3	Very high	63 Å²	63	38.2 Å²	38.2	38%	0.382	23%	0.228	S	C	.	.	H	α-helix	trans	-63.2	-45.7	-178.8	177.5	0	0	0	0	111.6	Y263 L264 A265 C271 P277	V261-Y263 VanDerWaalsContact C-N 3.33Å; V261-Y263 PolarHBondContact O-N 3.42Å; V261-L264 PolarHBondContact O-N 3.42Å; V261-A265 PolarHBondContact O-N 3.11Å; V261-C271 HydrophobicContact CG1-CB 4.44Å; V261-P277 HydrophobicContact CG2-CB 3.91Å; V261-P277 HydrophobicContact CG2-CG 4Å
262	P	90.7	Very high	91.2	Very high	46 Å²	46	39.1 Å²	39.1	30%	0.299	23%	0.234	S	C	.	.	H	α-helix	trans	-58.2	-39.2	170.4	-27.6	35.5	0	0	0	114.4	C259 A265 S266 I308 L312	C259-P262 WeakPolarHBondContact O-CD 3.25Å; P262-A265 PolarHBondContact O-N 3.35Å; P262-S266 PolarHBondContact O-N 3.05Å; P262-I308 HydrophobicContact CB-CG2 4.02Å; P262-L312 HydrophobicContact CB-CD1 4.35Å; P262-L312 HydrophobicContact CG-CD1 4.12Å
263	Y	90.1	Very high	91	Very high	1 Å²	1	45.1 Å²	45.1	0%	0.004	28%	0.276	C	S	.	.	H	α-helix	trans	-62.8	-44.7	176.3	171.2	-101.4	0	0	0	111.9	I252 Y253 C259 L260 V261 S266 Q267 L296 A299 L305 I308	I252-Y263 PolarHBondContact O-OH 3.47Å; Y253-Y263 AromaticContact CD2-CD1 3.42Å; Y253-Y263 HydrophobicContact CD2-CD1 3.42Å; Y253-Y263 VanDerWaalsContact CD2-CD1 3.42Å; Y253-Y263 HydrophobicContact CD2-CD2 4.33Å; Y253-Y263 AromaticContact CD2-CE1 3.65Å; Y253-Y263 HydrophobicContact CD2-CE1 3.65Å; Y253-Y263 AromaticContact CD2-CG 3.77Å; Y253-Y263 HydrophobicContact CD2-CG 3.77Å; Y253-Y263 AromaticContact CE2-CD1 3.82Å; Y253-Y263 HydrophobicContact CE2-CD1 3.82Å; Y253-Y263 HydrophobicContact CE2-CD2 4.39Å; Y253-Y263 HydrophobicContact CE2-CE1 4.46Å; Y253-Y263 AromaticContact CE2-CG 3.76Å; Y253-Y263 HydrophobicContact CE2-CG 3.76Å; C259-Y263 VanDerWaalsContact O-CB 3.26Å; C259-Y263 WeakPolarHBondContact O-CB 3.32Å; C259-Y263 PolarHBondContact O-N 2.73Å; L260-Y263 WeakPolarHBondContact O-CB 3.37Å; L260-Y263 PolarHBondContact O-N 2.92Å; V261-Y263 VanDerWaalsContact C-N 3.33Å; V261-Y263 PolarHBondContact O-N 3.42Å; Y263-S266 WeakPolarHBondContact O-CB 3.33Å; Y263-S266 PolarHBondContact O-N 2.71Å; Y263-S266 PolarHBondContact O-OG 2.99Å; Y263-Q267 PolarHBondContact O-N 3.48Å; Y263-L296 HydrophobicContact CE1-CD2 3.96Å; Y263-L296 PolarHBondContact OH-O 3.49Å; Y263-A299 HydrophobicContact CE2-CB 4.43Å; Y263-L305 HydrophobicContact CD2-CD1 3.97Å; Y263-L305 HydrophobicContact CG-CD1 4.22Å; Y263-I308 HydrophobicContact CD2-CD1 4.16Å
264	L	90.7	Very high	90.8	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-61.6	-45	175.8	-69.6	170.9	0	0	0	111.5	L260 V261 S266 Q267 D268 L269 Y280 F281	L260-L264 HydrophobicContact CD1-CD1 4.21Å; L260-L264 HydrophobicContact CD1-CG 4.28Å; L260-L264 HydrophobicContact CG-CD1 4.12Å; L260-L264 WeakPolarHBondContact O-CG 3.4Å; L260-L264 PolarHBondContact O-N 2.97Å; V261-L264 PolarHBondContact O-N 3.42Å; L264-S266 VanDerWaalsContact C-N 3.25Å; L264-S266 PolarHBondContact O-N 2.99Å; L264-Q267 CarbonylContact O-C 3.53Å; L264-Q267 WeakPolarHBondContact O-CA 2.95Å; L264-Q267 PolarHBondContact O-N 3.16Å; L264-D268 PolarHBondContact O-N 2.95Å; L264-L269 CarbonylContact C-O 3.52Å; L264-L269 HydrophobicContact CB-CB 4.12Å; L264-L269 VanDerWaalsContact CB-O 3.32Å; L264-L269 WeakPolarHBondContact CB-O 3.47Å; L264-L269 HydrophobicContact CD2-CB 4.24Å; L264-L269 HydrophobicContact CD2-CD1 3.97Å; L264-L269 WeakPolarHBondContact O-CA 3.48Å; L264-L269 WeakPolarHBondContact O-CB 3.4Å; L264-L269 PolarHBondContact O-N 2.93Å; L264-L269 VanDerWaalsContact O-O 3.11Å; L264-Y280 HydrophobicContact CD1-CD1 3.89Å; L264-Y280 HydrophobicContact CD1-CE1 4.1Å; L264-F281 HydrophobicContact CD1-CB 4.48Å; L264-F281 HydrophobicContact CD1-CD2 4.29Å; L264-F281 HydrophobicContact CD2-CD2 3.6Å; L264-F281 HydrophobicContact CD2-CE2 3.75Å; L264-F281 HydrophobicContact CG-CD2 4.42Å
265	A	90.4	Very high	90.8	Very high	57 Å²	57	53.5 Å²	53.5	47%	0.471	31%	0.311	S	S	.	.	H	α-helix	trans	-59.2	-35.6	176.4	0	0	0	0	0	112.6	V261 P262 Q267 D268 L269	V261-A265 PolarHBondContact O-N 3.11Å; P262-A265 PolarHBondContact O-N 3.35Å; A265-Q267 PolarHBondContact O-N 3.26Å; A265-D268 PolarHBondContact O-N 3.21Å; A265-L269 PolarHBondContact N-O 2.99Å
266	S	87.8	Confident	90.8	Very high	53 Å²	53	54.2 Å²	54.2	37%	0.371	31%	0.313	S	S	.	.	H	α-helix	trans	-66.8	-17.9	175.3	82.2	0	0	0	0	114.2	P262 Y263 L264	P262-S266 PolarHBondContact O-N 3.05Å; Y263-S266 WeakPolarHBondContact O-CB 3.33Å; Y263-S266 PolarHBondContact O-N 2.71Å; Y263-S266 PolarHBondContact O-OG 2.99Å; L264-S266 VanDerWaalsContact C-N 3.25Å; L264-S266 PolarHBondContact O-N 2.99Å
267	Q	88	Confident	90.8	Very high	28 Å²	28	53.7 Å²	53.7	13%	0.131	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.2	19.6	179.1	-60.2	-56.6	-52.6	0	0	112	Y263 L264 A265 L269 L296	Y263-Q267 PolarHBondContact O-N 3.48Å; L264-Q267 CarbonylContact O-C 3.53Å; L264-Q267 WeakPolarHBondContact O-CA 2.95Å; L264-Q267 PolarHBondContact O-N 3.16Å; A265-Q267 PolarHBondContact O-N 3.26Å; Q267-L269 HydrophobicContact CB-CD1 4.47Å; Q267-L269 PolarHBondContact O-N 2.94Å; Q267-L296 HydrophobicContact CB-CD2 4.02Å; Q267-L296 HydrophobicContact CG-CD2 3.81Å
268	D	88.2	Confident	90.7	Very high	122 Å²	122	53 Å²	53	65%	0.652	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.2	22.1	-178.3	-45.2	-61.5	0	0	0	113.7	L264 A265 R295	L264-D268 PolarHBondContact O-N 2.95Å; A265-D268 PolarHBondContact O-N 3.21Å; D268-R295 IonicContact OD2-CZ 3.62Å; D268-R295 IonicContact OD2-NH1 3.46Å; D268-R295 PolarHBondContact OD2-NH1 3.43Å; D268-R295 IonicContact OD2-NH2 2.83Å; D268-R295 PolarHBondContact OD2-NH2 3.28Å
269	L	89.2	Confident	90.8	Very high	13 Å²	13	50.4 Å²	50.4	7%	0.068	28%	0.284	C	S	.	.			trans	-107.6	102.8	177.9	-64.9	168.7	0	0	0	109.6	L264 A265 Q267 Y280 V284 L296	L264-L269 CarbonylContact C-O 3.52Å; L264-L269 HydrophobicContact CB-CB 4.12Å; L264-L269 VanDerWaalsContact CB-O 3.32Å; L264-L269 WeakPolarHBondContact CB-O 3.47Å; L264-L269 HydrophobicContact CD2-CB 4.24Å; L264-L269 HydrophobicContact CD2-CD1 3.97Å; L264-L269 WeakPolarHBondContact O-CA 3.48Å; L264-L269 WeakPolarHBondContact O-CB 3.4Å; L264-L269 PolarHBondContact O-N 2.93Å; L264-L269 VanDerWaalsContact O-O 3.11Å; A265-L269 PolarHBondContact N-O 2.99Å; Q267-L269 HydrophobicContact CB-CD1 4.47Å; Q267-L269 PolarHBondContact O-N 2.94Å; L269-Y280 HydrophobicContact CB-CE1 4.49Å; L269-V284 HydrophobicContact CD1-CG1 3.77Å; L269-V284 HydrophobicContact CD2-CG2 4.48Å; L269-L296 HydrophobicContact CD1-CD1 4.38Å; L269-L296 HydrophobicContact CD1-CD2 4.32Å
270	I	90.5	Very high	90.9	Very high	138 Å²	138	50.6 Å²	50.6	71%	0.708	28%	0.284	S	S	*	.			trans	-93.6	110.5	-177.1	-57.5	172.9	0	0	0	109.3	P272 Y280	I270-P272 WeakPolarHBondContact O-CD 3.18Å; I270-Y280 PolarHBondContact O-OH 2.91Å
271	C	90.3	Very high	91	Very high	20 Å²	20	50.6 Å²	50.6	14%	0.135	28%	0.284	C	S	.	.			trans	-72.5	122.1	172.8	-174.3	0	0	0	0	110	V261 Y280	V261-C271 HydrophobicContact CG1-CB 4.44Å; C271-Y280 HydrophobicContact CB-CD1 3.66Å; C271-Y280 HydrophobicContact CB-CE1 3.91Å; C271-Y280 HydrophobicContact CB-CG 4.19Å
272	P	91.8	Very high	91	Very high	36 Å²	36	48 Å²	48	23%	0.234	27%	0.268	C	S	.	.			trans	-61.7	147	173	-19.4	31.5	0	0	0	111.5	I270 Y274 H275	I270-P272 WeakPolarHBondContact O-CD 3.18Å; P272-Y274 VanDerWaalsContact C-N 3.33Å; P272-Y274 HydrophobicContact CB-CD1 4.12Å; P272-Y274 HydrophobicContact CB-CE1 3.64Å; P272-Y274 HydrophobicContact CB-CE2 4.12Å; P272-Y274 PolarHBondContact O-N 3.4Å; P272-H275 HydrophobicContact CB-CB 4.13Å; P272-H275 HydrophobicContact CG-CB 4.34Å; P272-H275 WeakPolarHBondContact O-CB 3.31Å; P272-H275 PolarHBondContact O-N 3.26Å; P272-H275 VanDerWaalsContact O-N 3.14Å
273	S	88.8	Confident	91	Very high	126 Å²	126	47.8 Å²	47.8	88%	0.881	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-28.1	-175.4	54.1	0	0	0	0	114.4	H275	S273-H275 VanDerWaalsContact C-N 3.29Å
274	Y	90.5	Very high	91.1	Very high	202 Å²	202	47.8 Å²	47.8	79%	0.792	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-5.6	176.4	57.8	-95.8	0	0	0	112.8	P272	P272-Y274 VanDerWaalsContact C-N 3.33Å; P272-Y274 HydrophobicContact CB-CD1 4.12Å; P272-Y274 HydrophobicContact CB-CE1 3.64Å; P272-Y274 HydrophobicContact CB-CE2 4.12Å; P272-Y274 PolarHBondContact O-N 3.4Å
275	H	91.1	Very high	91.2	Very high	45 Å²	45	48.1 Å²	48.1	21%	0.208	27%	0.266	C	S	.	.	S	Bend	trans	-94.9	139.2	-178.2	-153	-80.3	0	0	0	110.5	P272 S273 P277 Y280 E283	P272-H275 HydrophobicContact CB-CB 4.13Å; P272-H275 HydrophobicContact CG-CB 4.34Å; P272-H275 WeakPolarHBondContact O-CB 3.31Å; P272-H275 PolarHBondContact O-N 3.26Å; P272-H275 VanDerWaalsContact O-N 3.14Å; S273-H275 VanDerWaalsContact C-N 3.29Å; H275-P277 VanDerWaalsContact O-CD 3.3Å; H275-P277 WeakPolarHBondContact O-CD 3.16Å; H275-Y280 PolarHBondContact CE1-N 3.44Å; H275-Y280 WeakPolarHBondContact ND1-CB 3.48Å; H275-Y280 PolarHBondContact ND1-N 2.98Å; H275-E283 IonicContact CE1-OE1 3.47Å; H275-E283 PolarHBondContact CE1-OE1 3.04Å; H275-E283 IonicContact CE1-OE2 3.88Å; H275-E283 IonicContact NE2-OE1 3.45Å; H275-E283 PolarHBondContact NE2-OE1 2.89Å; H275-E283 IonicContact NE2-OE2 2.71Å
276	N	92.6	Very high	91.2	Very high	21 Å²	21	49.1 Å²	49.1	11%	0.112	27%	0.268	C	S	.	.			trans	-64.8	122.4	171.5	178.8	5.7	0	0	0	108.9	P232 A234 A278 D279 Y280	P232-N276 PolarHBondContact O-ND2 3.45Å; A234-N276 HydrophobicContact CB-CB 4.48Å; N276-A278 PolarHBondContact O-N 3.41Å; N276-A278 PolarHBondContact OD1-N 2.92Å; N276-D279 HydrophobicContact CB-CB 4.08Å; N276-D279 VanDerWaalsContact CB-OD2 3.28Å; N276-D279 WeakPolarHBondContact CB-OD2 3.33Å; N276-D279 VanDerWaalsContact ND2-CG 3.32Å; N276-D279 PolarHBondContact ND2-OD2 3.35Å; N276-D279 PolarHBondContact O-N 3.37Å; N276-D279 VanDerWaalsContact O-N 3.13Å; N276-Y280 PolarHBondContact O-N 2.84Å
277	P	93.4	Very high	91.2	Very high	33 Å²	33	47.8 Å²	47.8	21%	0.214	26%	0.263	C	S	.	.	H	α-helix	trans	-58.9	-31.4	-179.7	-26.6	35.7	0	0	0	113.4	F237 L260 V261 H275 F281	F237-P277 HydrophobicContact CE1-CB 4.18Å; L260-P277 HydrophobicContact CD2-CB 4.47Å; V261-P277 HydrophobicContact CG2-CB 3.91Å; V261-P277 HydrophobicContact CG2-CG 4Å; H275-P277 VanDerWaalsContact O-CD 3.3Å; H275-P277 WeakPolarHBondContact O-CD 3.16Å; P277-F281 WeakPolarHBondContact O-CB 3.33Å; P277-F281 PolarHBondContact O-N 2.96Å
278	A	93.2	Very high	91.2	Very high	2 Å²	2	52.9 Å²	52.9	2%	0.017	29%	0.287	C	S	.	.	H	α-helix	trans	-67.2	-44.2	177.3	0	0	0	0	0	111.8	M71 P232 F237 N276 F281 M282	M71-A278 HydrophobicContact CE-CB 4.17Å; P232-A278 HydrophobicContact CG-CB 4.04Å; F237-A278 HydrophobicContact CB-CB 4.31Å; F237-A278 HydrophobicContact CD1-CB 4.05Å; F237-A278 HydrophobicContact CD2-CB 3.68Å; F237-A278 HydrophobicContact CE1-CB 4.25Å; F237-A278 HydrophobicContact CE2-CB 3.91Å; F237-A278 HydrophobicContact CG-CB 3.75Å; F237-A278 HydrophobicContact CZ-CB 4.19Å; N276-A278 PolarHBondContact O-N 3.41Å; N276-A278 PolarHBondContact OD1-N 2.92Å; A278-F281 PolarHBondContact O-N 3.26Å; A278-M282 VanDerWaalsContact O-CG 3.25Å; A278-M282 WeakPolarHBondContact O-CG 3.35Å; A278-M282 PolarHBondContact O-N 3.38Å
279	D	93.3	Very high	91	Very high	45 Å²	45	51.9 Å²	51.9	24%	0.241	28%	0.275	C	S	.	.	H	α-helix	trans	-70.9	-43.1	179.2	-62.9	-30.8	0	0	0	110.6	N276 F281 M282 E283	N276-D279 HydrophobicContact CB-CB 4.08Å; N276-D279 VanDerWaalsContact CB-OD2 3.28Å; N276-D279 WeakPolarHBondContact CB-OD2 3.33Å; N276-D279 VanDerWaalsContact ND2-CG 3.32Å; N276-D279 PolarHBondContact ND2-OD2 3.35Å; N276-D279 PolarHBondContact O-N 3.37Å; N276-D279 VanDerWaalsContact O-N 3.13Å; D279-F281 VanDerWaalsContact C-N 3.27Å; D279-F281 PolarHBondContact O-N 3.02Å; D279-M282 WeakPolarHBondContact O-CA 3.49Å; D279-M282 WeakPolarHBondContact O-CB 3.4Å; D279-M282 PolarHBondContact O-N 3.43Å; D279-E283 WeakPolarHBondContact O-CG 3.46Å; D279-E283 PolarHBondContact O-N 3.35Å
280	Y	93.6	Very high	90.8	Very high	10 Å²	10	52.7 Å²	52.7	4%	0.039	29%	0.286	C	S	.	.	H	α-helix	trans	-56.2	-44.9	175.1	-177.8	-107.8	0	0	0	111	L264 L269 I270 C271 H275 N276 M282 E283 V284 Y289	L264-Y280 HydrophobicContact CD1-CD1 3.89Å; L264-Y280 HydrophobicContact CD1-CE1 4.1Å; L269-Y280 HydrophobicContact CB-CE1 4.49Å; I270-Y280 PolarHBondContact O-OH 2.91Å; C271-Y280 HydrophobicContact CB-CD1 3.66Å; C271-Y280 HydrophobicContact CB-CE1 3.91Å; C271-Y280 HydrophobicContact CB-CG 4.19Å; H275-Y280 PolarHBondContact CE1-N 3.44Å; H275-Y280 WeakPolarHBondContact ND1-CB 3.48Å; H275-Y280 PolarHBondContact ND1-N 2.98Å; N276-Y280 PolarHBondContact O-N 2.84Å; Y280-M282 VanDerWaalsContact C-N 3.32Å; Y280-M282 PolarHBondContact O-N 3.06Å; Y280-E283 PolarHBondContact O-N 2.91Å; Y280-V284 HydrophobicContact CD1-CG2 4.33Å; Y280-V284 HydrophobicContact CE1-CG2 3.95Å; Y280-V284 HydrophobicContact CE2-CG2 4.42Å; Y280-V284 VanDerWaalsContact O-CG2 3.32Å; Y280-V284 WeakPolarHBondContact O-CG2 3.48Å; Y280-V284 PolarHBondContact O-N 2.98Å; Y280-Y289 HydrophobicContact CD2-CE2 4.04Å; Y280-Y289 AromaticContact CD2-CZ 4Å; Y280-Y289 HydrophobicContact CE2-CD1 4.49Å; Y280-Y289 HydrophobicContact CE2-CD2 4.36Å; Y280-Y289 AromaticContact CE2-CE1 3.97Å; Y280-Y289 HydrophobicContact CE2-CE1 3.97Å; Y280-Y289 AromaticContact CE2-CE2 3.82Å; Y280-Y289 HydrophobicContact CE2-CE2 3.82Å; Y280-Y289 AromaticContact CE2-CZ 3.62Å
281	F	93.7	Very high	90.5	Very high	1 Å²	1	52.8 Å²	52.8	0%	0.004	29%	0.288	C	S	.	.	H	α-helix	trans	-70.1	-30.9	179.6	-167.2	-140.1	0	0	0	113	F245 I252 Y253 L260 L264 P277 A278 D279 A285 L296	F245-F281 HydrophobicContact CB-CD1 4.36Å; F245-F281 HydrophobicContact CB-CE1 3.54Å; F245-F281 HydrophobicContact CB-CZ 4.33Å; F245-F281 HydrophobicContact CD1-CD1 4.35Å; F245-F281 AromaticContact CD1-CE1 3.89Å; F245-F281 HydrophobicContact CD1-CE1 3.89Å; F245-F281 HydrophobicContact CD1-CZ 4.4Å; F245-F281 AromaticContact CD2-CD1 3.22Å; F245-F281 HydrophobicContact CD2-CD1 3.22Å; F245-F281 AromaticContact CD2-CE1 3.31Å; F245-F281 HydrophobicContact CD2-CE1 3.31Å; F245-F281 HydrophobicContact CD2-CG 4.35Å; F245-F281 HydrophobicContact CD2-CZ 4.48Å; F245-F281 HydrophobicContact CE1-CD1 4.45Å; F245-F281 HydrophobicContact CE1-CE1 4.36Å; F245-F281 HydrophobicContact CE2-CB 4.46Å; F245-F281 AromaticContact CE2-CD1 3.36Å; F245-F281 HydrophobicContact CE2-CD1 3.36Å; F245-F281 AromaticContact CE2-CE1 3.86Å; F245-F281 HydrophobicContact CE2-CE1 3.86Å; F245-F281 HydrophobicContact CE2-CG 4.1Å; F245-F281 AromaticContact CG-CD1 3.74Å; F245-F281 HydrophobicContact CG-CD1 3.74Å; F245-F281 AromaticContact CG-CE1 3.3Å; F245-F281 HydrophobicContact CG-CE1 3.3Å; F245-F281 HydrophobicContact CG-CZ 4.17Å; F245-F281 AromaticContact CZ-CD1 3.97Å; F245-F281 HydrophobicContact CZ-CD1 3.97Å; F245-F281 HydrophobicContact CZ-CE1 4.32Å; F245-F281 HydrophobicContact CZ-CG 4.43Å; I252-F281 HydrophobicContact CD1-CE1 4.1Å; I252-F281 HydrophobicContact CD1-CE2 3.75Å; I252-F281 HydrophobicContact CD1-CZ 3.42Å; I252-F281 VanDerWaalsContact CD1-CZ 3.42Å; I252-F281 HydrophobicContact CG1-CE1 4.33Å; I252-F281 HydrophobicContact CG1-CE2 4.5Å; I252-F281 HydrophobicContact CG1-CZ 3.74Å; Y253-F281 HydrophobicContact CG-CE1 4.31Å; Y253-F281 HydrophobicContact CG-CZ 4.45Å; L260-F281 HydrophobicContact CD1-CD1 3.72Å; L260-F281 HydrophobicContact CD1-CD2 4.38Å; L260-F281 HydrophobicContact CD1-CE1 3.82Å; L260-F281 HydrophobicContact CD1-CE2 4.47Å; L260-F281 HydrophobicContact CD1-CG 4.02Å; L260-F281 HydrophobicContact CD1-CZ 4.22Å; L260-F281 HydrophobicContact CD2-CB 4.27Å; L260-F281 HydrophobicContact CD2-CD1 4.21Å; L260-F281 HydrophobicContact CD2-CG 4.44Å; L264-F281 HydrophobicContact CD1-CB 4.48Å; L264-F281 HydrophobicContact CD1-CD2 4.29Å; L264-F281 HydrophobicContact CD2-CD2 3.6Å; L264-F281 HydrophobicContact CD2-CE2 3.75Å; L264-F281 HydrophobicContact CG-CD2 4.42Å; P277-F281 WeakPolarHBondContact O-CB 3.33Å; P277-F281 PolarHBondContact O-N 2.96Å; A278-F281 PolarHBondContact O-N 3.26Å; D279-F281 VanDerWaalsContact C-N 3.27Å; D279-F281 PolarHBondContact O-N 3.02Å; F281-A285 WeakPolarHBondContact O-CB 3.47Å; F281-A285 PolarHBondContact O-N 2.89Å; F281-L296 HydrophobicContact CE2-CD1 4.13Å
282	M	92.3	Very high	90.2	Very high	10 Å²	10	54.6 Å²	54.6	5%	0.049	29%	0.294	C	S	.	.	H	α-helix	trans	-65	-44.6	170.4	-73.9	-73.4	-55.9	0	0	112.2	M71 G72 P73 F245 A278 D279 Y280 A285 C286	M71-M282 HydrophobicContact CE-CG 4.31Å; M71-M282 HydrophobicContact CE-SD 4.47Å; G72-M282 VanDerWaalsContact C-SD 3.53Å; G72-M282 WeakPolarHBondContact O-CE 3.14Å; P73-M282 HydrophobicContact CG-CE 4.46Å; F245-M282 HydrophobicContact CE1-SD 4.38Å; F245-M282 HydrophobicContact CE2-CG 4.07Å; F245-M282 HydrophobicContact CE2-SD 3.67Å; F245-M282 HydrophobicContact CZ-CG 4Å; F245-M282 HydrophobicContact CZ-SD 3.35Å; F245-M282 WeakPolarHBondContact CZ-SD 3.28Å; A278-M282 VanDerWaalsContact O-CG 3.25Å; A278-M282 WeakPolarHBondContact O-CG 3.35Å; A278-M282 PolarHBondContact O-N 3.38Å; D279-M282 WeakPolarHBondContact O-CA 3.49Å; D279-M282 WeakPolarHBondContact O-CB 3.4Å; D279-M282 PolarHBondContact O-N 3.43Å; Y280-M282 VanDerWaalsContact C-N 3.32Å; Y280-M282 PolarHBondContact O-N 3.06Å; M282-A285 WeakPolarHBondContact O-CB 3.49Å; M282-A285 PolarHBondContact O-N 3.38Å; M282-C286 PolarHBondContact O-N 2.89Å; M282-C286 PolarHBondContact O-SG 3.33Å
283	E	92.2	Very high	89.8	Confident	40 Å²	40	55.8 Å²	55.8	19%	0.187	30%	0.295	C	S	.	.	H	α-helix	trans	-62.6	-44	176.8	-68.1	165.4	-164.6	0	0	111.8	H275 D279 Y280 A285 C286 G287 E288 Y289	H275-E283 IonicContact CE1-OE1 3.47Å; H275-E283 PolarHBondContact CE1-OE1 3.04Å; H275-E283 IonicContact CE1-OE2 3.88Å; H275-E283 IonicContact NE2-OE1 3.45Å; H275-E283 PolarHBondContact NE2-OE1 2.89Å; H275-E283 IonicContact NE2-OE2 2.71Å; D279-E283 WeakPolarHBondContact O-CG 3.46Å; D279-E283 PolarHBondContact O-N 3.35Å; Y280-E283 PolarHBondContact O-N 2.91Å; E283-A285 VanDerWaalsContact C-N 3.29Å; E283-A285 PolarHBondContact O-N 3.18Å; E283-C286 PolarHBondContact O-N 3.35Å; E283-C286 VanDerWaalsContact O-N 3.16Å; E283-G287 PolarHBondContact O-N 3.27Å; E283-G287 VanDerWaalsContact O-N 3.14Å; E283-E288 HydrophobicContact CB-CB 4.27Å; E283-E288 HydrophobicContact CB-CG 4.4Å; E283-E288 PolarHBondContact O-N 3.01Å; E283-E288 VanDerWaalsContact O-N 3.08Å; E283-Y289 HydrophobicContact CB-CD2 4.16Å; E283-Y289 HydrophobicContact CB-CE2 3.62Å; E283-Y289 WeakPolarHBondContact OE2-CE2 3.16Å; E283-Y289 PolarHBondContact OE2-OH 2.91Å
284	V	92.2	Very high	89.7	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.006	27%	0.271	C	S	.	.	H	α-helix	trans	-58	-42.9	172.6	169.9	0	0	0	0	111	L269 Y280 C286 G287 Y289 L296	L269-V284 HydrophobicContact CD1-CG1 3.77Å; L269-V284 HydrophobicContact CD2-CG2 4.48Å; Y280-V284 HydrophobicContact CD1-CG2 4.33Å; Y280-V284 HydrophobicContact CE1-CG2 3.95Å; Y280-V284 HydrophobicContact CE2-CG2 4.42Å; Y280-V284 VanDerWaalsContact O-CG2 3.32Å; Y280-V284 WeakPolarHBondContact O-CG2 3.48Å; Y280-V284 PolarHBondContact O-N 2.98Å; V284-C286 VanDerWaalsContact C-N 3.33Å; V284-G287 PolarHBondContact O-N 2.73Å; V284-Y289 HydrophobicContact CG2-CD2 3.68Å; V284-Y289 HydrophobicContact CG2-CE2 4.35Å; V284-Y289 HydrophobicContact CG2-CG 4.24Å; V284-L296 HydrophobicContact CG1-CD1 3.96Å
285	A	91.2	Very high	89.6	Confident	7 Å²	7	49.3 Å²	49.3	6%	0.058	25%	0.254	C	S	.	.	H	α-helix	trans	-69.8	-28.8	178.2	0	0	0	0	0	113.5	P73 F245 T247 I252 F281 M282 E283 G287	P73-A285 HydrophobicContact CG-CB 4.05Å; F245-A285 HydrophobicContact CE1-CB 3.45Å; F245-A285 VanDerWaalsContact CE1-CB 3.45Å; F245-A285 HydrophobicContact CZ-CB 3.82Å; T247-A285 HydrophobicContact CG2-CB 4.37Å; T247-A285 WeakPolarHBondContact CG2-O 3.3Å; I252-A285 HydrophobicContact CD1-CB 3.97Å; F281-A285 WeakPolarHBondContact O-CB 3.47Å; F281-A285 PolarHBondContact O-N 2.89Å; M282-A285 WeakPolarHBondContact O-CB 3.49Å; M282-A285 PolarHBondContact O-N 3.38Å; E283-A285 VanDerWaalsContact C-N 3.29Å; E283-A285 PolarHBondContact O-N 3.18Å; A285-G287 VanDerWaalsContact C-N 3.26Å
286	C	90.6	Very high	89.6	Confident	78 Å²	78	47.2 Å²	47.2	53%	0.527	24%	0.244	S	C	.	.	H	α-helix	trans	-77.8	-9.2	173.7	-71.6	0	0	0	0	113.3	M282 E283 V284	M282-C286 PolarHBondContact O-N 2.89Å; M282-C286 PolarHBondContact O-SG 3.33Å; E283-C286 PolarHBondContact O-N 3.35Å; E283-C286 VanDerWaalsContact O-N 3.16Å; V284-C286 VanDerWaalsContact C-N 3.33Å
287	G	88.7	Confident	89.3	Confident	25 Å²	25	46.8 Å²	46.8	26%	0.258	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.1	11.6	178.1	0	0	0	0	0	114.9	E283 V284 A285 Y289 G290	E283-G287 PolarHBondContact O-N 3.27Å; E283-G287 VanDerWaalsContact O-N 3.14Å; V284-G287 PolarHBondContact O-N 2.73Å; A285-G287 VanDerWaalsContact C-N 3.26Å; G287-Y289 PolarHBondContact O-N 3.43Å; G287-G290 PolarHBondContact O-N 2.79Å
288	E	87.1	Confident	89	Confident	135 Å²	135	50 Å²	50	63%	0.631	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-29.2	-178.6	-65.1	-172	-168	0	0	112.8	E283	E283-E288 HydrophobicContact CB-CB 4.27Å; E283-E288 HydrophobicContact CB-CG 4.4Å; E283-E288 PolarHBondContact O-N 3.01Å; E283-E288 VanDerWaalsContact O-N 3.08Å
289	Y	84.7	Confident	88.7	Confident	102 Å²	102	50.3 Å²	50.3	40%	0.4	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99	11.5	175.1	-60.6	-88.4	0	0	0	112.6	Y280 E283 V284 G287 H292	Y280-Y289 HydrophobicContact CD2-CE2 4.04Å; Y280-Y289 AromaticContact CD2-CZ 4Å; Y280-Y289 HydrophobicContact CE2-CD1 4.49Å; Y280-Y289 HydrophobicContact CE2-CD2 4.36Å; Y280-Y289 AromaticContact CE2-CE1 3.97Å; Y280-Y289 HydrophobicContact CE2-CE1 3.97Å; Y280-Y289 AromaticContact CE2-CE2 3.82Å; Y280-Y289 HydrophobicContact CE2-CE2 3.82Å; Y280-Y289 AromaticContact CE2-CZ 3.62Å; E283-Y289 HydrophobicContact CB-CD2 4.16Å; E283-Y289 HydrophobicContact CB-CE2 3.62Å; E283-Y289 WeakPolarHBondContact OE2-CE2 3.16Å; E283-Y289 PolarHBondContact OE2-OH 2.91Å; V284-Y289 HydrophobicContact CG2-CD2 3.68Å; V284-Y289 HydrophobicContact CG2-CE2 4.35Å; V284-Y289 HydrophobicContact CG2-CG 4.24Å; G287-Y289 PolarHBondContact O-N 3.43Å; Y289-H292 PolarHBondContact O-CD2 2.66Å; Y289-H292 PolarHBondContact O-NE2 2.67Å
290	G	84.8	Confident	88.3	Confident	30 Å²	30	48.6 Å²	48.6	31%	0.309	25%	0.251	S	S	.	.			trans	105	164.5	-175	0	0	0	0	0	113.7	G287 H292	G287-G290 PolarHBondContact O-N 2.79Å; G290-H292 VanDerWaalsContact C-N 3.28Å; G290-H292 PolarHBondContact O-CD2 2.83Å; G290-H292 PolarHBondContact O-N 3.24Å
291	D	84.3	Confident	87.6	Confident	139 Å²	139	57.8 Å²	57.8	74%	0.743	29%	0.286	S	S	*	.	S	Bend	trans	-74.8	76.8	-177.4	-76	-28.2	0	0	0	112.1
292	H	84.6	Confident	87	Confident	58 Å²	58	67 Å²	67	27%	0.269	32%	0.32	S	S	.	.			trans	-96.6	-10.9	-179.5	-63.2	-47.3	0	0	0	113.9	Y289 G290 M294 R295 L296	Y289-H292 PolarHBondContact O-CD2 2.66Å; Y289-H292 PolarHBondContact O-NE2 2.67Å; G290-H292 VanDerWaalsContact C-N 3.28Å; G290-H292 PolarHBondContact O-CD2 2.83Å; G290-H292 PolarHBondContact O-N 3.24Å; H292-M294 VanDerWaalsContact C-N 3.26Å; H292-M294 PolarHBondContact O-N 3.2Å; H292-M294 VanDerWaalsContact O-N 3.16Å; H292-R295 WeakPolarHBondContact O-CB 3.15Å; H292-R295 PolarHBondContact O-N 3.33Å; H292-L296 HydrophobicContact CB-CD1 4.41Å; H292-L296 WeakPolarHBondContact O-CG 3.45Å; H292-L296 PolarHBondContact O-N 2.9Å
293	Y	83.1	Confident	85.9	Confident	61 Å²	61	71.6 Å²	71.6	24%	0.239	34%	0.342	C	S	.	.	H	α-helix	trans	-58.6	-35.7	-171.7	77.2	-90.1	0	0	0	112.9	T247 L296 A297	T247-Y293 HydrophobicContact CG2-CG 4.42Å; Y293-L296 PolarHBondContact O-N 2.87Å; Y293-A297 VanDerWaalsContact O-CB 3.27Å; Y293-A297 WeakPolarHBondContact O-CB 3.17Å; Y293-A297 PolarHBondContact O-N 3.38Å
294	M	86.6	Confident	84.8	Confident	80 Å²	80	71.1 Å²	71.1	39%	0.394	34%	0.342	S	S	.	.	H	α-helix	trans	-70.5	-38.9	178.4	-164.1	68.5	79	0	0	111.7	H292 A297 M298	H292-M294 VanDerWaalsContact C-N 3.26Å; H292-M294 PolarHBondContact O-N 3.2Å; H292-M294 VanDerWaalsContact O-N 3.16Å; M294-A297 PolarHBondContact O-N 3.44Å; M294-M298 HydrophobicContact CG-CE 3.72Å; M294-M298 WeakPolarHBondContact O-CG 3.38Å; M294-M298 PolarHBondContact O-N 2.92Å
295	R	89.2	Confident	83.6	Confident	113 Å²	113	71.7 Å²	71.7	43%	0.426	35%	0.345	S	S	.	.	H	α-helix	trans	-60.8	-46.4	172.8	179	-178.7	172.3	177.4	1.1	110.2	D268 H292 M298 A299	D268-R295 IonicContact OD2-CZ 3.62Å; D268-R295 IonicContact OD2-NH1 3.46Å; D268-R295 PolarHBondContact OD2-NH1 3.43Å; D268-R295 IonicContact OD2-NH2 2.83Å; D268-R295 PolarHBondContact OD2-NH2 3.28Å; H292-R295 WeakPolarHBondContact O-CB 3.15Å; H292-R295 PolarHBondContact O-N 3.33Å; R295-M298 PolarHBondContact O-N 3.15Å; R295-A299 WeakPolarHBondContact O-CB 3.43Å; R295-A299 PolarHBondContact O-N 2.91Å
296	L	89.2	Confident	82.7	Confident	1 Å²	1	75.1 Å²	75.1	1%	0.005	36%	0.362	C	S	.	.	H	α-helix	trans	-65.7	-39	177.7	-63.7	173.4	0	0	0	112.3	I252 Y263 Q267 L269 F281 V284 H292 Y293 M298 A299 A300	I252-L296 HydrophobicContact CB-CB 3.87Å; I252-L296 HydrophobicContact CD1-CD1 4.35Å; I252-L296 HydrophobicContact CG2-CB 4.25Å; Y263-L296 HydrophobicContact CE1-CD2 3.96Å; Y263-L296 PolarHBondContact OH-O 3.49Å; Q267-L296 HydrophobicContact CB-CD2 4.02Å; Q267-L296 HydrophobicContact CG-CD2 3.81Å; L269-L296 HydrophobicContact CD1-CD1 4.38Å; L269-L296 HydrophobicContact CD1-CD2 4.32Å; F281-L296 HydrophobicContact CE2-CD1 4.13Å; V284-L296 HydrophobicContact CG1-CD1 3.96Å; H292-L296 HydrophobicContact CB-CD1 4.41Å; H292-L296 WeakPolarHBondContact O-CG 3.45Å; H292-L296 PolarHBondContact O-N 2.9Å; Y293-L296 PolarHBondContact O-N 2.87Å; L296-M298 PolarHBondContact O-N 3.39Å; L296-A299 PolarHBondContact O-N 3.45Å; L296-A300 WeakPolarHBondContact O-CB 3.24Å; L296-A300 PolarHBondContact O-N 3.16Å
297	A	87.9	Confident	81.7	Confident	12 Å²	12	78.1 Å²	78.1	10%	0.099	37%	0.369	C	S	.	.	H	α-helix	trans	-63.9	-40.2	175.3	0	0	0	0	0	112	H250 C251 I252 Y293 M294 R301	H250-A297 HydrophobicContact CB-CB 4.11Å; C251-A297 WeakPolarHBondContact O-CA 3.43Å; I252-A297 HydrophobicContact CG2-CB 4.28Å; Y293-A297 VanDerWaalsContact O-CB 3.27Å; Y293-A297 WeakPolarHBondContact O-CB 3.17Å; Y293-A297 PolarHBondContact O-N 3.38Å; M294-A297 PolarHBondContact O-N 3.44Å; A297-R301 WeakPolarHBondContact O-CB 3.37Å; A297-R301 PolarHBondContact O-N 3.18Å; A297-R301 VanDerWaalsContact O-N 3.11Å
298	M	86.5	Confident	80.9	Confident	101 Å²	101	78.2 Å²	78.2	50%	0.498	36%	0.363	S	S	.	.	H	α-helix	trans	-66	-41.3	173.4	-69.6	-169.7	-139.8	0	0	111.8	M294 R295 L296 R301 R302	M294-M298 HydrophobicContact CG-CE 3.72Å; M294-M298 WeakPolarHBondContact O-CG 3.38Å; M294-M298 PolarHBondContact O-N 2.92Å; R295-M298 PolarHBondContact O-N 3.15Å; L296-M298 PolarHBondContact O-N 3.39Å; M298-R301 PolarHBondContact O-N 3.44Å; M298-R302 WeakPolarHBondContact O-CG 3.44Å; M298-R302 PolarHBondContact O-N 3.43Å
299	A	86.8	Confident	80.2	Confident	7 Å²	7	72.8 Å²	72.8	6%	0.058	34%	0.339	C	S	.	.	H	α-helix	trans	-61.8	-47.8	176.5	0	0	0	0	0	111.6	Y263 R295 L296 R301 R302 Q303 T304	Y263-A299 HydrophobicContact CE2-CB 4.43Å; R295-A299 WeakPolarHBondContact O-CB 3.43Å; R295-A299 PolarHBondContact O-N 2.91Å; L296-A299 PolarHBondContact O-N 3.45Å; A299-R301 VanDerWaalsContact C-N 3.25Å; A299-R301 PolarHBondContact O-N 2.61Å; A299-R302 PolarHBondContact O-N 3.1Å; A299-R302 VanDerWaalsContact O-N 3.1Å; A299-Q303 PolarHBondContact O-N 3.25Å; A299-T304 PolarHBondContact O-OG1 2.8Å; A299-T304 VanDerWaalsContact O-OG1 3.07Å
300	A	84	Confident	79.8	Confident	9 Å²	9	71.8 Å²	71.8	7%	0.074	34%	0.34	C	S	.	.	H	α-helix	trans	-59.6	-34.8	176.4	0	0	0	0	0	112.9	L296	L296-A300 WeakPolarHBondContact O-CB 3.24Å; L296-A300 PolarHBondContact O-N 3.16Å
301	R	80.9	Confident	79.3	Confident	204 Å²	204	77.4 Å²	77.4	77%	0.77	35%	0.353	S	S	*	.	H	α-helix	trans	-73.8	-34	175.9	-168	173.8	-175.1	161.9	3.1	113	A297 M298 A299 Q303	A297-R301 WeakPolarHBondContact O-CB 3.37Å; A297-R301 PolarHBondContact O-N 3.18Å; A297-R301 VanDerWaalsContact O-N 3.11Å; M298-R301 PolarHBondContact O-N 3.44Å; A299-R301 VanDerWaalsContact C-N 3.25Å; A299-R301 PolarHBondContact O-N 2.61Å; R301-Q303 PolarHBondContact O-N 3.04Å
302	R	79.2	Confident	78.8	Confident	193 Å²	193	73.2 Å²	73.2	73%	0.728	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	0.1	177	-74.3	-179.9	-176.8	176	2.3	114.2	M298 A299 T304	M298-R302 WeakPolarHBondContact O-CG 3.44Å; M298-R302 PolarHBondContact O-N 3.43Å; A299-R302 PolarHBondContact O-N 3.1Å; A299-R302 VanDerWaalsContact O-N 3.1Å; R302-T304 HydrophobicContact CB-CG2 4.4Å; R302-T304 PolarHBondContact O-N 2.88Å
303	Q	71	Confident	78.4	Confident	107 Å²	107	76.4 Å²	76.4	50%	0.5	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.9	28.3	-179.2	-66.6	-177	-78.4	0	0	114	A299 R301 L305 D306	A299-Q303 PolarHBondContact O-N 3.25Å; R301-Q303 PolarHBondContact O-N 3.04Å; Q303-L305 PolarHBondContact O-N 3.37Å; Q303-D306 HydrophobicContact CB-CB 4.48Å; Q303-D306 WeakPolarHBondContact CB-OD2 3.13Å; Q303-D306 PolarHBondContact NE2-OD2 3.37Å; Q303-D306 WeakPolarHBondContact O-CB 3.32Å; Q303-D306 PolarHBondContact O-N 3Å
304	T	68.3	Low	77.9	Confident	30 Å²	30	80.9 Å²	80.9	18%	0.184	36%	0.364	C	S	.	.	H	α-helix	trans	-57	-23.9	175	46.5	0	0	0	0	112.9	A299 R302 D306 E307 I308	A299-T304 PolarHBondContact O-OG1 2.8Å; A299-T304 VanDerWaalsContact O-OG1 3.07Å; R302-T304 HydrophobicContact CB-CG2 4.4Å; R302-T304 PolarHBondContact O-N 2.88Å; T304-D306 VanDerWaalsContact C-N 3.34Å; T304-E307 PolarHBondContact O-N 2.75Å; T304-I308 PolarHBondContact O-N 3.31Å
305	L	67.4	Low	77.4	Confident	13 Å²	13	82.4 Å²	82.4	7%	0.068	37%	0.369	C	S	.	.	H	α-helix	trans	-67.6	-32.1	175	-165.4	69.7	0	0	0	113.2	Y253 R254 C259 Y263 Q303 E307 I308 V309	Y253-L305 HydrophobicContact CE2-CD1 3.63Å; Y253-L305 HydrophobicContact CE2-CD2 3.82Å; Y253-L305 HydrophobicContact CE2-CG 4.39Å; R254-L305 WeakPolarHBondContact O-CD2 3.26Å; C259-L305 HydrophobicContact CB-CD1 4.17Å; Y263-L305 HydrophobicContact CD2-CD1 3.97Å; Y263-L305 HydrophobicContact CG-CD1 4.22Å; Q303-L305 PolarHBondContact O-N 3.37Å; L305-E307 PolarHBondContact O-N 3.32Å; L305-I308 HydrophobicContact CD1-CB 4.47Å; L305-I308 HydrophobicContact CD1-CD1 4.47Å; L305-I308 PolarHBondContact O-N 3.43Å; L305-I308 VanDerWaalsContact O-N 3.12Å; L305-V309 HydrophobicContact CG-CG2 4.1Å; L305-V309 WeakPolarHBondContact O-CB 3.14Å; L305-V309 VanDerWaalsContact O-CG2 3.31Å; L305-V309 WeakPolarHBondContact O-CG2 3.39Å; L305-V309 PolarHBondContact O-N 2.95Å
306	D	71.7	Confident	76.4	Confident	79 Å²	79	83.9 Å²	83.9	42%	0.422	38%	0.378	S	S	.	.	H	α-helix	trans	-62.8	-37	-179.9	-68.1	-27.2	0	0	0	110	Q303 T304 V309 D310	Q303-D306 HydrophobicContact CB-CB 4.48Å; Q303-D306 WeakPolarHBondContact CB-OD2 3.13Å; Q303-D306 PolarHBondContact NE2-OD2 3.37Å; Q303-D306 WeakPolarHBondContact O-CB 3.32Å; Q303-D306 PolarHBondContact O-N 3Å; T304-D306 VanDerWaalsContact C-N 3.34Å; D306-V309 PolarHBondContact O-N 3.48Å; D306-D310 WeakPolarHBondContact O-CB 3.38Å; D306-D310 PolarHBondContact O-N 3.1Å
307	E	69.1	Low	75.1	Confident	142 Å²	142	88.6 Å²	88.6	66%	0.664	41%	0.407	S	S	*	.	H	α-helix	trans	-63.6	-42.4	173.3	-59.6	178.3	173.8	0	0	112.6	T304 L305 D310 Y311	T304-E307 PolarHBondContact O-N 2.75Å; L305-E307 PolarHBondContact O-N 3.32Å; E307-D310 PolarHBondContact O-N 3.46Å; E307-Y311 WeakPolarHBondContact O-CB 3.44Å; E307-Y311 PolarHBondContact O-N 2.82Å
308	I	72.6	Confident	73.6	Confident	26 Å²	26	94.8 Å²	94.8	13%	0.133	43%	0.432	C	S	.	.	H	α-helix	trans	-68.9	-43.2	179.2	-62.8	173.8	0	0	0	110.7	P262 Y263 T304 L305 D310 Y311 L312	P262-I308 HydrophobicContact CB-CG2 4.02Å; Y263-I308 HydrophobicContact CD2-CD1 4.16Å; T304-I308 PolarHBondContact O-N 3.31Å; L305-I308 HydrophobicContact CD1-CB 4.47Å; L305-I308 HydrophobicContact CD1-CD1 4.47Å; L305-I308 PolarHBondContact O-N 3.43Å; L305-I308 VanDerWaalsContact O-N 3.12Å; I308-D310 VanDerWaalsContact C-N 3.31Å; I308-D310 PolarHBondContact O-N 3.13Å; I308-Y311 PolarHBondContact O-N 2.97Å; I308-L312 HydrophobicContact CG2-CD1 3.94Å; I308-L312 HydrophobicContact CG2-CG 4.36Å; I308-L312 WeakPolarHBondContact O-CB 3.37Å; I308-L312 WeakPolarHBondContact O-CG 3.31Å; I308-L312 PolarHBondContact O-N 3.47Å
309	V	73.4	Confident	72.1	Confident	22 Å²	22	94.2 Å²	94.2	13%	0.133	43%	0.43	C	S	.	.	H	α-helix	trans	-61.6	-43.4	177.2	169.6	0	0	0	0	110	L305 D306 L312 K313	L305-V309 HydrophobicContact CG-CG2 4.1Å; L305-V309 WeakPolarHBondContact O-CB 3.14Å; L305-V309 VanDerWaalsContact O-CG2 3.31Å; L305-V309 WeakPolarHBondContact O-CG2 3.39Å; L305-V309 PolarHBondContact O-N 2.95Å; D306-V309 PolarHBondContact O-N 3.48Å; V309-L312 PolarHBondContact O-N 3.12Å; V309-K313 HydrophobicContact CG1-CD 4.1Å; V309-K313 HydrophobicContact CG1-CG 4.45Å; V309-K313 WeakPolarHBondContact O-CB 3.4Å; V309-K313 VanDerWaalsContact O-CG 3.3Å; V309-K313 WeakPolarHBondContact O-CG 3.36Å; V309-K313 PolarHBondContact O-N 3.4Å
310	D	74.9	Confident	70.3	Confident	80 Å²	80	98.3 Å²	98.3	43%	0.428	45%	0.451	S	S	.	.	H	α-helix	trans	-66.1	-40	176.6	-78.8	-9.1	0	0	0	112.3	D306 E307 I308 K314	D306-D310 WeakPolarHBondContact O-CB 3.38Å; D306-D310 PolarHBondContact O-N 3.1Å; E307-D310 PolarHBondContact O-N 3.46Å; I308-D310 VanDerWaalsContact C-N 3.31Å; I308-D310 PolarHBondContact O-N 3.13Å; D310-K314 WeakPolarHBondContact O-CB 3.49Å; D310-K314 VanDerWaalsContact O-CG 3.27Å; D310-K314 WeakPolarHBondContact O-CG 3.31Å; D310-K314 PolarHBondContact O-N 3.21Å
311	Y	74.1	Confident	68.8	Low	149 Å²	149	100.6 Å²	100.6	58%	0.584	47%	0.467	S	S	*	.	H	α-helix	trans	-59.8	-47.5	172.7	175.9	-96.6	0	0	0	111.9	E307 I308 K314 K315	E307-Y311 WeakPolarHBondContact O-CB 3.44Å; E307-Y311 PolarHBondContact O-N 2.82Å; I308-Y311 PolarHBondContact O-N 2.97Å; Y311-K314 PolarHBondContact O-N 3.04Å; Y311-K315 HydrophobicContact CE1-CD 4.44Å; Y311-K315 WeakPolarHBondContact O-CB 3.21Å; Y311-K315 PolarHBondContact O-N 3.27Å
312	L	74.4	Confident	67.1	Low	50 Å²	50	93.8 Å²	93.8	26%	0.262	45%	0.448	S	S	.	.	H	α-helix	trans	-68.7	-38	-179.6	-70	173.8	0	0	0	112.5	C259 P262 I308 V309 K315 K316	C259-L312 HydrophobicContact CB-CD1 4.33Å; C259-L312 VanDerWaalsContact SG-CD1 3.59Å; P262-L312 HydrophobicContact CB-CD1 4.35Å; P262-L312 HydrophobicContact CG-CD1 4.12Å; I308-L312 HydrophobicContact CG2-CD1 3.94Å; I308-L312 HydrophobicContact CG2-CG 4.36Å; I308-L312 WeakPolarHBondContact O-CB 3.37Å; I308-L312 WeakPolarHBondContact O-CG 3.31Å; I308-L312 PolarHBondContact O-N 3.47Å; V309-L312 PolarHBondContact O-N 3.12Å; L312-K315 PolarHBondContact O-N 2.88Å; L312-K316 WeakPolarHBondContact O-CB 3.44Å; L312-K316 PolarHBondContact O-N 2.98Å
313	K	75.5	Confident	65.3	Low	125 Å²	125	89.3 Å²	89.3	54%	0.543	44%	0.438	S	S	.	.	H	α-helix	trans	-60.2	-48.5	172.3	-78.9	175.5	-177.4	169.7	0	111	V309 K315 K316 V317	V309-K313 HydrophobicContact CG1-CD 4.1Å; V309-K313 HydrophobicContact CG1-CG 4.45Å; V309-K313 WeakPolarHBondContact O-CB 3.4Å; V309-K313 VanDerWaalsContact O-CG 3.3Å; V309-K313 WeakPolarHBondContact O-CG 3.36Å; V309-K313 PolarHBondContact O-N 3.4Å; K313-K315 VanDerWaalsContact C-N 3.34Å; K313-K315 PolarHBondContact O-N 3.22Å; K313-K316 PolarHBondContact O-N 3.48Å; K313-V317 WeakPolarHBondContact O-CG2 3.4Å; K313-V317 PolarHBondContact O-N 3.48Å
314	K	74	Confident	63.9	Low	156 Å²	156	90.4 Å²	90.4	68%	0.678	45%	0.445	S	S	*	.	H	α-helix	trans	-59.3	-43.7	176.8	-73.7	172.9	-175.9	175.9	0	111.6	D310 Y311 K316 V317 F318	D310-K314 WeakPolarHBondContact O-CB 3.49Å; D310-K314 VanDerWaalsContact O-CG 3.27Å; D310-K314 WeakPolarHBondContact O-CG 3.31Å; D310-K314 PolarHBondContact O-N 3.21Å; Y311-K314 PolarHBondContact O-N 3.04Å; K314-K316 PolarHBondContact O-N 2.8Å; K314-V317 PolarHBondContact O-N 2.87Å; K314-F318 WeakPolarHBondContact O-CB 3.14Å; K314-F318 PolarHBondContact O-N 3.43Å
315	K	74.9	Confident	62.4	Low	112 Å²	112	97.2 Å²	97.2	49%	0.487	48%	0.475	S	S	.	.	H	α-helix	trans	-62.6	-41.1	176.6	-169.4	177	-179.4	178.2	0	112.5	Y311 L312 K313 F318 L319	Y311-K315 HydrophobicContact CE1-CD 4.44Å; Y311-K315 WeakPolarHBondContact O-CB 3.21Å; Y311-K315 PolarHBondContact O-N 3.27Å; L312-K315 PolarHBondContact O-N 2.88Å; K313-K315 VanDerWaalsContact C-N 3.34Å; K313-K315 PolarHBondContact O-N 3.22Å; K315-F318 PolarHBondContact O-N 3.02Å; K315-L319 HydrophobicContact CG-CD1 4.24Å; K315-L319 PolarHBondContact O-N 3.23Å
316	K	67.9	Low	60.8	Low	143 Å²	143	101.4 Å²	101.4	62%	0.622	50%	0.501	S	S	*	.	H	α-helix	trans	-68.4	-39.2	178.3	-163.6	176.2	-175.4	179.3	0	112.3	L312 K313 K314 L319 N320	L312-K316 WeakPolarHBondContact O-CB 3.44Å; L312-K316 PolarHBondContact O-N 2.98Å; K313-K316 PolarHBondContact O-N 3.48Å; K314-K316 PolarHBondContact O-N 2.8Å; K316-L319 PolarHBondContact O-N 3.27Å; K316-N320 WeakPolarHBondContact O-CB 3.46Å; K316-N320 PolarHBondContact O-N 3.45Å
317	V	62.9	Low	58.8	Low	101 Å²	101	104.3 Å²	104.3	61%	0.612	52%	0.517	S	S	*	.	H	α-helix	trans	-63.2	-43.3	173.3	172.8	0	0	0	0	110.7	K313 K314 N320 S321	K313-V317 WeakPolarHBondContact O-CG2 3.4Å; K313-V317 PolarHBondContact O-N 3.48Å; K314-V317 PolarHBondContact O-N 2.87Å; V317-N320 PolarHBondContact O-N 2.94Å; V317-S321 PolarHBondContact O-N 2.83Å; V317-S321 PolarHBondContact O-OG 3.3Å
318	F	56.3	Low	56.9	Low	142 Å²	142	106.5 Å²	106.5	62%	0.623	53%	0.527	S	S	*	.	H	α-helix	trans	-59.5	-50.2	176.5	-171.2	-98.5	0	0	0	111.7	K314 K315 N320 S321 T322	K314-F318 WeakPolarHBondContact O-CB 3.14Å; K314-F318 PolarHBondContact O-N 3.43Å; K315-F318 PolarHBondContact O-N 3.02Å; F318-N320 PolarHBondContact O-N 3.15Å; F318-S321 WeakPolarHBondContact CA-OG 3.39Å; F318-S321 PolarHBondContact O-N 2.91Å; F318-S321 VanDerWaalsContact O-N 3.11Å; F318-S321 PolarHBondContact O-OG 2.88Å; F318-T322 PolarHBondContact O-N 2.87Å; F318-T322 PolarHBondContact O-OG1 3.15Å
319	L	55.1	Low	54.7	Low	89 Å²	89	110.7 Å²	110.7	47%	0.466	56%	0.557	S	S	.	*	H	α-helix	trans	-57.9	-44.3	176.1	-88.2	150.4	0	0	0	112.8	K315 K316 S321 T322 I323	K315-L319 HydrophobicContact CG-CD1 4.24Å; K315-L319 PolarHBondContact O-N 3.23Å; K316-L319 PolarHBondContact O-N 3.27Å; L319-S321 VanDerWaalsContact C-N 3.31Å; L319-S321 PolarHBondContact O-N 3.09Å; L319-T322 PolarHBondContact O-N 3.4Å; L319-I323 WeakPolarHBondContact O-CD1 3.47Å; L319-I323 VanDerWaalsContact O-CG1 3.23Å; L319-I323 WeakPolarHBondContact O-CG1 3.39Å; L319-I323 PolarHBondContact O-N 3.26Å
320	N	48.4	Very low	52.5	Low	92 Å²	92	115.8 Å²	115.8	49%	0.492	59%	0.591	S	S	.	*	H	α-helix	trans	-66.6	-32.2	177.3	-75.1	-0.8	0	0	0	112.5	K316 V317 F318 I324	K316-N320 WeakPolarHBondContact O-CB 3.46Å; K316-N320 PolarHBondContact O-N 3.45Å; V317-N320 PolarHBondContact O-N 2.94Å; F318-N320 PolarHBondContact O-N 3.15Å; N320-I324 WeakPolarHBondContact O-CD1 3.46Å; N320-I324 VanDerWaalsContact O-CG1 3.3Å; N320-I324 WeakPolarHBondContact O-CG1 3.29Å; N320-I324 PolarHBondContact O-N 2.77Å
321	S	52.3	Low	50.4	Low	57 Å²	57	119.4 Å²	119.4	40%	0.399	61%	0.608	S	S	.	*	H	α-helix	trans	-74.2	-32.3	175	61.4	0	0	0	0	113.4	V317 F318 L319 I324	V317-S321 PolarHBondContact O-N 2.83Å; V317-S321 PolarHBondContact O-OG 3.3Å; F318-S321 WeakPolarHBondContact CA-OG 3.39Å; F318-S321 PolarHBondContact O-N 2.91Å; F318-S321 VanDerWaalsContact O-N 3.11Å; F318-S321 PolarHBondContact O-OG 2.88Å; L319-S321 VanDerWaalsContact C-N 3.31Å; L319-S321 PolarHBondContact O-N 3.09Å; S321-I324 PolarHBondContact O-N 3.21Å
322	T	45.2	Very low	48.1	Very low	61 Å²	61	118.9 Å²	118.9	37%	0.374	62%	0.616	S	S	.	*	H	α-helix	trans	-71.8	-36.1	175.1	-44.6	0	0	0	0	111.5	F318 L319 I324 Q325	F318-T322 PolarHBondContact O-N 2.87Å; F318-T322 PolarHBondContact O-OG1 3.15Å; L319-T322 PolarHBondContact O-N 3.4Å; T322-I324 VanDerWaalsContact C-N 3.28Å; T322-I324 PolarHBondContact O-N 3.33Å; T322-Q325 PolarHBondContact O-N 3.02Å
323	I	43.2	Very low	45.7	Very low	100 Å²	100	123.9 Å²	123.9	51%	0.513	64%	0.643	S	S	.	*	H	α-helix	trans	-68.7	-26.2	177.4	-66.2	164.8	0	0	0	111.8	L319 Q325	L319-I323 WeakPolarHBondContact O-CD1 3.47Å; L319-I323 VanDerWaalsContact O-CG1 3.23Å; L319-I323 WeakPolarHBondContact O-CG1 3.39Å; L319-I323 PolarHBondContact O-N 3.26Å; I323-Q325 VanDerWaalsContact C-N 3.33Å
324	I	41.2	Very low	43.5	Very low	129 Å²	129	125.6 Å²	125.6	66%	0.662	66%	0.656	S	S	*	*	H	α-helix	trans	-78.4	-16.7	175.6	-66.1	167.4	0	0	0	112.3	N320 S321 T322	N320-I324 WeakPolarHBondContact O-CD1 3.46Å; N320-I324 VanDerWaalsContact O-CG1 3.3Å; N320-I324 WeakPolarHBondContact O-CG1 3.29Å; N320-I324 PolarHBondContact O-N 2.77Å; S321-I324 PolarHBondContact O-N 3.21Å; T322-I324 VanDerWaalsContact C-N 3.28Å; T322-I324 PolarHBondContact O-N 3.33Å
325	Q	37.3	Very low	41.2	Very low	174 Å²	174	126.7 Å²	126.7	81%	0.813	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	-3.6	176.9	-72	-174.1	-24.6	0	0	114.1	T322 I323	T322-Q325 PolarHBondContact O-N 3.02Å; I323-Q325 VanDerWaalsContact C-N 3.33Å
326	T	33.4	Very low	38.9	Very low	101 Å²	101	128.8 Å²	128.8	62%	0.62	68%	0.679	S	S	*	*			trans	-121.7	63	175.7	58.7	0	0	0	0	110.2
327	N	29.7	Very low	37	Very low	140 Å²	140	126.7 Å²	126.7	75%	0.749	68%	0.678	S	S	*	*			trans	-115.9	65.6	170.2	-94	-7	0	0	0	110.1
328	E	28.5	Very low	35.2	Very low	188 Å²	188	127 Å²	127	88%	0.879	68%	0.684	S	S	*	*			trans	-131.7	93.4	151.9	-82.1	-171.2	163.3	0	0	106.8
329	C	25.8	Very low	33.8	Very low	113 Å²	113	127.1 Å²	127.1	76%	0.764	69%	0.691	S	S	*	*			trans	177.1	119.5	148.8	-96	0	0	0	0	109.1
330	P	26.9	Very low	32.6	Very low	129 Å²	129	129.2 Å²	129.2	84%	0.838	71%	0.708	S	S	*	*			trans	-91.4	111	171.6	32.6	-23.7	0	0	0	108.6
331	I	32.4	Very low	31.6	Very low	156 Å²	156	132.6 Å²	132.6	80%	0.8	72%	0.724	S	S	*	*			trans	-139.5	105.1	169.8	-55.1	-179.3	0	0	0	109.9
332	D	24.4	Very low	30.5	Very low	138 Å²	138	135.4 Å²	135.4	74%	0.738	74%	0.741	S	S	*	*			trans	-54.1	153.5	160.9	-66.9	-51.7	0	0	0	112
333	N	25.2	Very low	29.6	Very low	155 Å²	155	137.8 Å²	137.8	83%	0.829	76%	0.76	S	S	*	*			trans	75.3	89.4	165.3	-53.6	-39.1	0	0	0	117.8
334	I	28.5	Very low	28.9	Very low	161 Å²	161	144.7 Å²	144.7	83%	0.826	78%	0.78	S	S	*	*			trans	-127.8	97.9	145	-60.8	-179.4	0	0	0	108.8	I336	I334-I336 HydrophobicContact CG2-CG1 4.45Å; I334-I336 PolarHBondContact O-N 2.82Å
335	Q	24.9	Very low	28.3	Very low	179 Å²	179	145 Å²	145	84%	0.836	78%	0.783	S	S	*	*			trans	-63.9	119.6	158.5	-77.3	173.9	-38.1	0	0	108.4	V337	Q335-V337 PolarHBondContact O-N 3.09Å
336	I	27.9	Very low	28	Very low	156 Å²	156	145.8 Å²	145.8	80%	0.8	79%	0.786	S	S	*	*			trans	-85.6	97.3	164.2	-61.8	174.4	0	0	0	106.7	I334 S338	I334-I336 HydrophobicContact CG2-CG1 4.45Å; I334-I336 PolarHBondContact O-N 2.82Å; I336-S338 PolarHBondContact O-N 2.99Å
337	V	26.8	Very low	27.7	Very low	100 Å²	100	144.2 Å²	144.2	61%	0.606	79%	0.791	S	S	*	*			trans	-59.2	119.5	168.3	177.4	0	0	0	0	108	Q335 D339	Q335-V337 PolarHBondContact O-N 3.09Å; V337-D339 WeakPolarHBondContact CG1-OD1 3.27Å
338	S	26.5	Very low	27.6	Very low	107 Å²	107	142.9 Å²	142.9	75%	0.748	79%	0.792	S	S	*	*			trans	-88.5	99.3	164.6	24.8	0	0	0	0	106.7	I336 T340	I336-S338 PolarHBondContact O-N 2.99Å; S338-T340 PolarHBondContact O-N 3.45Å; S338-T340 VanDerWaalsContact O-N 3.14Å
339	D	27.4	Very low	27.7	Very low	144 Å²	144	139.1 Å²	139.1	77%	0.77	79%	0.787	S	S	*	*			trans	-62.9	117.1	176.2	-82	-29.3	0	0	0	110.1	V337	V337-D339 WeakPolarHBondContact CG1-OD1 3.27Å
340	T	28.1	Very low	27.8	Very low	133 Å²	133	138.5 Å²	138.5	82%	0.816	78%	0.783	S	S	*	*			trans	-78.8	115.5	171.8	-5.7	0	0	0	0	106.8	S338 P342	S338-T340 PolarHBondContact O-N 3.45Å; S338-T340 VanDerWaalsContact O-N 3.14Å; T340-P342 WeakPolarHBondContact O-CD 3.48Å
341	I	28.1	Very low	27.7	Very low	163 Å²	163	137.6 Å²	137.6	84%	0.836	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-86	117.3	170.4	-62.5	167.7	0	0	0	107.7
342	P	28.4	Very low	27.6	Very low	116 Å²	116	135.7 Å²	135.7	75%	0.753	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-88.2	128.8	165.2	19.9	-3.8	0	0	0	110	T340	T340-P342 WeakPolarHBondContact O-CD 3.48Å
343	S	27.2	Very low	27.5	Very low	111 Å²	111	134.6 Å²	134.6	78%	0.776	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-50.7	130.5	165.4	47	0	0	0	0	112.9
344	R	29.4	Very low	27.7	Very low	245 Å²	245	133.1 Å²	133.1	93%	0.925	78%	0.783	S	S	*	*			trans	-161	143.9	145.6	-112.4	170.3	-176.8	177.8	1	113
345	D	26.5	Very low	27.6	Very low	135 Å²	135	130.5 Å²	130.5	72%	0.722	78%	0.779	S	S	*	*			trans	-70.9	167.7	-166	-63.5	-66	0	0	0	116.8
346	H	31.4	Very low	27.7	Very low	191 Å²	191	131.2 Å²	131.2	88%	0.884	78%	0.779	S	S	*	*			trans	95.9	123.2	151.3	-62.5	-61.5	0	0	0	119.5
347	G	28.5	Very low	27.6	Very low	69 Å²	69	129 Å²	129	71%	0.711	78%	0.776	S	S	*	*				116.1	90.9	129.9	0	0	0	0	0	116.3
348	S	26.6	Very low	27.4	Very low	112 Å²	112	129.1 Å²	129.1	78%	0.783	78%	0.782	S	S	*	*			trans	4.9	124.7	143.8	55	0	0	0	0	118.5
349	S	29.7	Very low	27.4	Very low	109 Å²	109	130.3 Å²	130.3	76%	0.762	79%	0.787	S	S	*	*				153.4	134.2	106.3	54.3	0	0	0	0	113.7
350	S	28.4	Very low	27.3	Very low	99 Å²	99	130.1 Å²	130.1	69%	0.692	79%	0.785	S	S	*	*			trans	58.7	114.2	145.4	58.5	0	0	0	0	121.9
351	S	25.6	Very low	27.3	Very low	110 Å²	110	131.8 Å²	131.8	77%	0.769	79%	0.787	S	S	*	*				56.4	113.5	129.1	65.7	0	0	0	0	119.9
352	S	29.8	Very low	27.1	Very low	116 Å²	116	132.8 Å²	132.8	81%	0.811	79%	0.785	S	S	*	*				162.2	125.3	107	58.6	0	0	0	0	110.4
353	S	23.5	Very low	27.1	Very low	115 Å²	115	136.4 Å²	136.4	80%	0.804	79%	0.791	S	S	*	*			trans	-66.5	157.7	168.8	44.4	0	0	0	0	112.5
354	P	29.4	Very low	27.2	Very low	125 Å²	125	138.6 Å²	138.6	81%	0.812	79%	0.794	S	S	*	*				-137.6	146.7	122.3	27.5	-9.4	0	0	0	115.2
355	S	25.6	Very low	27	Very low	105 Å²	105	134.1 Å²	134.1	73%	0.734	79%	0.789	S	S	*	*			trans	-58	156.5	167.9	49.2	0	0	0	0	115.8
356	F	27	Very low	27.1	Very low	194 Å²	194	136.8 Å²	136.8	85%	0.851	79%	0.794	S	S	*	*			trans	-165.6	107.5	137.7	-126.4	-105.3	0	0	0	109.8
357	C	25.2	Very low	27	Very low	109 Å²	109	137.6 Å²	137.6	74%	0.736	80%	0.795	S	S	*	*				91.5	111.7	104	-84.4	0	0	0	0	116.6
358	S	22.2	Very low	26.8	Very low	104 Å²	104	143.5 Å²	143.5	73%	0.727	80%	0.801	S	S	*	*			trans	-104.9	156.7	164.7	48.7	0	0	0	0	111
359	P	27.4	Very low	26.7	Very low	131 Å²	131	147.7 Å²	147.7	85%	0.851	81%	0.805	S	S	*	*			trans	-103.5	146.5	160	16.3	2.8	0	0	0	113.6
360	I	25	Very low	26.6	Very low	140 Å²	140	147.5 Å²	147.5	72%	0.718	81%	0.81	S	S	*	*			trans	-88.3	141.5	-171	-68.1	155.5	0	0	0	111.3	K362	I360-K362 HydrophobicContact CG2-CG 4.2Å
361	I	27.9	Very low	26.3	Very low	169 Å²	169	152.1 Å²	152.1	87%	0.867	82%	0.818	S	S	*	*			trans	-132.3	123.2	152.4	-60.4	-179.6	0	0	0	108.5
362	K	24.3	Very low	26.3	Very low	183 Å²	183	155.1 Å²	155.1	80%	0.796	82%	0.82	S	S	*	*			trans	-83.5	144.4	178.7	-69.5	175	173.3	177.7	0	111	I360	I360-K362 HydrophobicContact CG2-CG 4.2Å
363	H	28.3	Very low	26.2	Very low	192 Å²	192	156.6 Å²	156.6	89%	0.889	82%	0.817	S	S	*	*			trans	-149.8	140.2	146.4	-114.1	-73.6	0	0	0	111.5
364	D	29.6	Very low	26.5	Very low	157 Å²	157	157.7 Å²	157.7	84%	0.84	82%	0.818	S	S	*	*			trans	-65.6	153.9	-162.9	-88.5	-43.7	0	0	0	118.7
365	D	25.3	Very low	26.1	Very low	151 Å²	151	161.1 Å²	161.1	81%	0.807	82%	0.821	S	S	*	*			trans	-58.6	145.9	164	-80.4	-52.3	0	0	0	114.8
366	K	29.4	Very low	26.2	Very low	192 Å²	192	161.2 Å²	161.2	84%	0.835	82%	0.821	S	S	*	*			trans	177.6	117.8	130.1	-101.5	165.6	-169.1	173.8	0	114.3
367	K	28.9	Very low	26.2	Very low	208 Å²	208	159.8 Å²	159.8	90%	0.904	82%	0.817	S	S	*	*				132.1	129.3	127	-83.4	176.3	176.3	-179.7	0	116.3
368	K	24.1	Very low	26.3	Very low	193 Å²	193	162 Å²	162	84%	0.839	82%	0.817	S	S	*	*			trans	-120.2	155.2	-173.7	-126.5	178.3	-172.1	172.1	0	108
369	K	23.6	Very low	26.5	Very low	200 Å²	200	162.4 Å²	162.4	87%	0.87	82%	0.82	S	S	*	*			trans	86.3	122.3	153.4	-68	173.7	173.8	179.3	0	120.3
370	A	27.3	Very low	26.5	Very low	105 Å²	105	162.3 Å²	162.3	87%	0.868	82%	0.819	S	S	*	*				-153.1	128.6	118.9	0	0	0	0	0	111.3
371	K	23.5	Very low	26.6	Very low	196 Å²	196	160.7 Å²	160.7	85%	0.852	82%	0.82	S	S	*	*			trans	-86.5	158.6	165.8	-75.9	171.9	165.8	179.5	0	107.4
372	Q	25.4	Very low	26.6	Very low	173 Å²	173	162 Å²	162	81%	0.808	82%	0.822	S	S	*	*				148.5	138.6	87.2	-143.7	170.1	-6.5	0	0	103.6
373	I	28.2	Very low	26.6	Very low	147 Å²	147	160.1 Å²	160.1	75%	0.754	82%	0.82	S	S	*	*				160.6	129.8	85	-48.7	-176.6	0	0	0	102.1
374	V	28.2	Very low	26.3	Very low	137 Å²	137	160.3 Å²	160.3	83%	0.83	82%	0.821	S	S	*	*				177	143.7	78.4	171.9	0	0	0	0	107.1
375	K	22.8	Very low	26.1	Very low	197 Å²	197	160.1 Å²	160.1	86%	0.857	82%	0.817	S	S	*	*			trans	-86.1	148.1	178.8	-68.4	167.3	167	178.5	0	112.8
376	S	26.9	Very low	26	Very low	107 Å²	107	158.4 Å²	158.4	75%	0.748	82%	0.817	S	S	*	*				173.4	120.1	124.1	53.3	0	0	0	0	114.5
377	Q	26.7	Very low	25.9	Very low	164 Å²	164	155.1 Å²	155.1	77%	0.766	81%	0.812	S	S	*	*			trans	71.2	115.7	141	-68.9	-179.5	-72.4	0	0	124.5
378	E	28.2	Very low	25.9	Very low	156 Å²	156	152.1 Å²	152.1	73%	0.729	81%	0.806	S	S	*	*				84.6	91.9	128.2	-73.4	166.5	-151.2	0	0	123.4
379	S	25.5	Very low	25.9	Very low	112 Å²	112	149.5 Å²	149.5	78%	0.783	80%	0.8	S	S	*	*				65.6	147.6	128	66.4	0	0	0	0	122.6
380	P	27.8	Very low	26.1	Very low	130 Å²	130	146 Å²	146	84%	0.844	80%	0.797	S	S	*	*				-118.1	149.7	-128.9	39.6	-29.4	0	0	0	116.4
381	S	26.6	Very low	26.2	Very low	106 Å²	106	148.6 Å²	148.6	74%	0.741	79%	0.791	S	S	*	*			trans	-147.9	121.3	157.8	59.1	0	0	0	0	110.3
382	H	28.2	Very low	26.7	Very low	195 Å²	195	144.6 Å²	144.6	90%	0.903	79%	0.785	S	S	*	*			trans	23	101.7	163.7	-68.1	-80.3	0	0	0	118.1	E384	H382-E384 PolarHBondContact O-N 3.48Å
383	I	25	Very low	26.9	Very low	145 Å²	145	144 Å²	144	74%	0.744	79%	0.788	S	S	*	*			trans	-80.9	104.6	172.9	-64.9	171.6	0	0	0	109.3	M385	I383-M385 HydrophobicContact CG2-CB 4.06Å; I383-M385 HydrophobicContact CG2-CE 3.5Å; I383-M385 VanDerWaalsContact CG2-CE 3.5Å; I383-M385 HydrophobicContact CG2-SD 4.44Å
384	E	22.1	Very low	27	Very low	195 Å²	195	140.3 Å²	140.3	91%	0.911	79%	0.786	S	S	*	*			trans	-73.2	131.8	144.5	-80.2	-176.6	147.4	0	0	108.1	H382	H382-E384 PolarHBondContact O-N 3.48Å
385	M	25.2	Very low	27.1	Very low	153 Å²	153	139.6 Å²	139.6	75%	0.754	78%	0.784	S	S	*	*			trans	-125.9	100.2	174.2	-159.6	145.7	-79.3	0	0	110	I383	I383-M385 HydrophobicContact CG2-CB 4.06Å; I383-M385 HydrophobicContact CG2-CE 3.5Å; I383-M385 VanDerWaalsContact CG2-CE 3.5Å; I383-M385 HydrophobicContact CG2-SD 4.44Å
386	S	22.1	Very low	27.2	Very low	116 Å²	116	137.5 Å²	137.5	81%	0.811	78%	0.78	S	S	*	*			trans	-74.2	137.6	165	51.8	0	0	0	0	111.1
387	V	28.5	Very low	27.1	Very low	123 Å²	123	139.8 Å²	139.8	75%	0.745	78%	0.779	S	S	*	*			trans	-126	103	169.2	178.6	0	0	0	0	110.1
388	L	27.8	Very low	27	Very low	145 Å²	145	138.2 Å²	138.2	76%	0.759	78%	0.781	S	S	*	*			trans	37.6	106.6	139	-63.5	160.6	0	0	0	119.4
389	L	24.5	Very low	27	Very low	137 Å²	137	136.7 Å²	136.7	72%	0.717	78%	0.777	S	S	*	*				78.5	145.6	88	-77.4	-173.1	0	0	0	115.1
390	P	28.8	Very low	27.1	Very low	126 Å²	126	138.5 Å²	138.5	82%	0.818	78%	0.777	S	S	*	*			cis	-141.2	162	44.2	37	-15.5	0	0	0	119.2
391	H	27.5	Very low	27	Very low	161 Å²	161	142.2 Å²	142.2	75%	0.745	78%	0.784	S	S	*	*			trans	-72.6	162.1	169.8	-89.1	-62.3	0	0	0	113.4
392	P	34.2	Very low	27	Very low	111 Å²	111	139.9 Å²	139.9	72%	0.721	78%	0.776	S	S	*	*				-146.7	137.9	96.2	34.3	-15.3	0	0	0	116.6
393	N	30.6	Very low	26.9	Very low	161 Å²	161	137.9 Å²	137.9	86%	0.861	77%	0.771	S	S	*	*			trans	44.4	113.2	135.8	-54.8	-15.2	0	0	0	121.7
394	G	30.9	Very low	27	Very low	69 Å²	69	137 Å²	137	71%	0.711	77%	0.772	S	S	*	*			trans	-168.4	134.7	153.9	0	0	0	0	0	109.6
395	P	29	Very low	27.1	Very low	122 Å²	122	133.9 Å²	133.9	79%	0.792	76%	0.762	S	S	*	*			trans	-77	151.1	-159.4	31	-34.3	0	0	0	113.9	H397	P395-H397 PolarHBondContact O-N 3.29Å
396	I	24.6	Very low	27.2	Very low	153 Å²	153	130.7 Å²	130.7	79%	0.785	76%	0.755	S	S	*	*			trans	-65	114.2	174.9	-63.3	163.1	0	0	0	109.3
397	H	26.7	Very low	27.4	Very low	155 Å²	155	131.6 Å²	131.6	72%	0.718	75%	0.75	S	S	*	*			trans	-107.5	100.3	154.4	-87.8	-76.8	0	0	0	108.4	P395 I399	P395-H397 PolarHBondContact O-N 3.29Å; H397-I399 HydrophobicContact CB-CG1 4.46Å; H397-I399 PolarHBondContact O-N 3.1Å
398	T	24.2	Very low	27.2	Very low	131 Å²	131	131.4 Å²	131.4	80%	0.804	75%	0.753	S	S	*	*			trans	-67.2	105.6	151.4	24.4	0	0	0	0	108
399	I	28.1	Very low	27.1	Very low	125 Å²	125	130.2 Å²	130.2	64%	0.641	75%	0.746	S	S	*	*			trans	-136.8	111.2	165.5	-62.9	-178.8	0	0	0	108.6	H397	H397-I399 HydrophobicContact CB-CG1 4.46Å; H397-I399 PolarHBondContact O-N 3.1Å
400	D	27	Very low	27.1	Very low	149 Å²	149	133.2 Å²	133.2	80%	0.797	75%	0.753	S	S	*	*			trans	49.8	129.9	143.2	-69.1	-35.2	0	0	0	123.3	G402	D400-G402 PolarHBondContact O-N 2.98Å
401	Q	26.6	Very low	27.2	Very low	209 Å²	209	135.3 Å²	135.3	98%	0.977	75%	0.746	S	S	*	*			trans	-45.6	104	146.3	-68.4	173	-21.9	0	0	110.1
402	G	25.5	Very low	27.2	Very low	56 Å²	56	131.7 Å²	131.7	58%	0.577	73%	0.732	S	S	*	*			trans	-165.5	108.2	176.3	0	0	0	0	0	111.8	D400	D400-G402 PolarHBondContact O-N 2.98Å
403	L	26	Very low	27.4	Very low	153 Å²	153	128.7 Å²	128.7	80%	0.801	71%	0.71	S	S	*	*			trans	49.7	71.3	147	-71.2	137.7	0	0	0	116.9	N405	L403-N405 VanDerWaalsContact C-N 3.31Å; L403-N405 PolarHBondContact O-N 3.11Å
404	V	27.5	Very low	27.4	Very low	127 Å²	127	127.2 Å²	127.2	77%	0.77	71%	0.709	S	S	*	*			trans	-92.1	83.4	144.1	-177.1	0	0	0	0	107.2	S406	V404-S406 WeakPolarHBondContact CG1-OG 3.33Å; V404-S406 PolarHBondContact O-N 3.41Å
405	N	23.5	Very low	27.5	Very low	130 Å²	130	127.6 Å²	127.6	70%	0.695	70%	0.701	S	S	*	*			trans	-55	83.7	146.7	-77.3	-18.7	0	0	0	107.2	L403 D407	L403-N405 VanDerWaalsContact C-N 3.31Å; L403-N405 PolarHBondContact O-N 3.11Å; N405-D407 VanDerWaalsContact C-N 3.33Å
406	S	28.2	Very low	28.6	Very low	86 Å²	86	124.9 Å²	124.9	60%	0.601	68%	0.675	S	S	*	*			trans	-88.5	93.4	145.7	-72.4	0	0	0	0	104.3	V404 C408	V404-S406 WeakPolarHBondContact CG1-OG 3.33Å; V404-S406 PolarHBondContact O-N 3.41Å; S406-C408 PolarHBondContact O-N 2.98Å
407	D	25.8	Very low	30.3	Very low	135 Å²	135	124.6 Å²	124.6	72%	0.722	67%	0.67	S	S	*	*			trans	-43.2	101	150.4	-77.3	-46.3	0	0	0	106.4	N405 I409	N405-D407 VanDerWaalsContact C-N 3.33Å; D407-I409 PolarHBondContact O-N 3.39Å
408	C	24.9	Very low	32.8	Very low	118 Å²	118	118.5 Å²	118.5	80%	0.797	64%	0.642	S	S	*	*			trans	-61.8	86.6	162	-77.6	0	0	0	0	104.3	S406 K410	S406-C408 PolarHBondContact O-N 2.98Å; C408-K410 PolarHBondContact O-N 3.03Å
409	I	26.4	Very low	35.5	Very low	120 Å²	120	114.4 Å²	114.4	62%	0.615	62%	0.622	S	S	*	*			trans	-52.9	114.7	178.4	-58	175.3	0	0	0	105.4	D407 Y411	D407-I409 PolarHBondContact O-N 3.39Å; I409-Y411 HydrophobicContact CB-CD2 3.88Å; I409-Y411 HydrophobicContact CB-CE2 4.04Å; I409-Y411 HydrophobicContact CD1-CE2 4.29Å; I409-Y411 HydrophobicContact CG2-CD2 3.31Å; I409-Y411 HydrophobicContact CG2-CE2 3.3Å; I409-Y411 HydrophobicContact CG2-CG 4.21Å; I409-Y411 PolarHBondContact O-N 3.26Å
410	K	24.2	Very low	38.2	Very low	200 Å²	200	108.6 Å²	108.6	87%	0.87	59%	0.592	S	S	*	*			trans	-60.6	73.6	170.9	-69.9	173.1	176.9	170.3	0	108.3	C408 D412	C408-K410 PolarHBondContact O-N 3.03Å; K410-D412 PolarHBondContact O-N 3.09Å
411	Y	29.2	Very low	41.1	Very low	171 Å²	171	106.2 Å²	106.2	67%	0.671	58%	0.58	S	S	*	*			trans	-82.4	71.3	165	-86.4	-74.2	0	0	0	108.8	I409 D413	I409-Y411 HydrophobicContact CB-CD2 3.88Å; I409-Y411 HydrophobicContact CB-CE2 4.04Å; I409-Y411 HydrophobicContact CD1-CE2 4.29Å; I409-Y411 HydrophobicContact CG2-CD2 3.31Å; I409-Y411 HydrophobicContact CG2-CE2 3.3Å; I409-Y411 HydrophobicContact CG2-CG 4.21Å; I409-Y411 PolarHBondContact O-N 3.26Å; Y411-D413 HydrophobicContact CD1-CB 4.49Å; Y411-D413 PolarHBondContact O-N 3.45Å; Y411-D413 VanDerWaalsContact O-N 3.09Å
412	D	28.7	Very low	44.1	Very low	84 Å²	84	102.2 Å²	102.2	45%	0.449	56%	0.561	S	S	.	*			trans	-70.7	80.3	139.4	-100.6	-3.4	0	0	0	106.5	K410 P414 R696 R700	K410-D412 PolarHBondContact O-N 3.09Å; D412-P414 WeakPolarHBondContact O-CD 3.35Å; D412-P414 WeakPolarHBondContact O-CG 3.44Å; D412-R696 IonicContact OD1-CZ 3.29Å; D412-R696 IonicContact OD1-NH2 3.68Å; D412-R696 PolarHBondContact OD1-NH2 3.05Å; D412-R696 IonicContact OD2-CZ 3.63Å; D412-R696 IonicContact OD2-NH1 3.21Å; D412-R696 IonicContact OD2-NH2 3.86Å; D412-R696 PolarHBondContact OD2-NH2 2.88Å; D412-R700 IonicContact OD1-CZ 2.63Å; D412-R700 IonicContact OD1-NH2 3.66Å; D412-R700 PolarHBondContact OD1-NH2 3.32Å
413	D	37.4	Very low	47.3	Very low	48 Å²	48	104.2 Å²	104.2	26%	0.257	56%	0.558	S	S	.	*			trans	-59	104.1	-175.2	-176.4	16.3	0	0	0	111.4	Q107 Y411 S415	Q107-D413 PolarHBondContact NE2-OD1 3.48Å; Q107-D413 PolarHBondContact NE2-OD2 3.26Å; Y411-D413 HydrophobicContact CD1-CB 4.49Å; Y411-D413 PolarHBondContact O-N 3.45Å; Y411-D413 VanDerWaalsContact O-N 3.09Å; D413-S415 VanDerWaalsContact C-N 3.27Å; D413-S415 PolarHBondContact O-N 2.9Å; D413-S415 PolarHBondContact OD1-N 2.85Å; D413-S415 PolarHBondContact OD1-OG 3.18Å; D413-S415 VanDerWaalsContact OD1-OG 3.13Å
414	P	32.1	Very low	50.4	Low	130 Å²	130	98.8 Å²	98.8	84%	0.844	53%	0.531	S	S	*	.			trans	-82.2	-1.5	-178.3	-4.5	25.2	0	0	0	112.5	D412	D412-P414 WeakPolarHBondContact O-CD 3.35Å; D412-P414 WeakPolarHBondContact O-CG 3.44Å
415	S	31.6	Very low	53.6	Low	78 Å²	78	92.9 Å²	92.9	55%	0.545	50%	0.495	S	S	.	.			trans	-120.2	40	-171.5	58.4	0	0	0	0	114.3	D413 E417	D413-S415 VanDerWaalsContact C-N 3.27Å; D413-S415 PolarHBondContact O-N 2.9Å; D413-S415 PolarHBondContact OD1-N 2.85Å; D413-S415 PolarHBondContact OD1-OG 3.18Å; D413-S415 VanDerWaalsContact OD1-OG 3.13Å; S415-E417 PolarHBondContact O-N 3.41Å
416	R	52	Low	57	Low	64 Å²	64	88 Å²	88	24%	0.242	47%	0.467	C	S	.	.			trans	-67.1	90.4	153.1	-72.4	-170.5	176.6	-150.3	-11.4	108.9	R110 F418 H509	R110-R416 VanDerWaalsContact NH1-NH2 3.14Å; R416-F418 HydrophobicContact CB-CD2 3.96Å; R416-F418 HydrophobicContact CB-CE2 3.46Å; R416-F418 VanDerWaalsContact CB-CE2 3.46Å; R416-F418 HydrophobicContact CB-CZ 3.95Å; R416-F418 HydrophobicContact CG-CE2 4.39Å; R416-F418 WeakPolarHBondContact O-CD2 3.32Å; R416-F418 PolarHBondContact O-N 3.17Å; R416-H509 PolarHBondContact NH1-CE1 2.88Å; R416-H509 PolarHBondContact NH1-NE2 3.13Å
417	E	61.5	Low	60.2	Low	147 Å²	147	91.3 Å²	91.3	69%	0.687	47%	0.467	S	S	*	.			trans	-70.8	85.7	170.6	-135.9	-177.6	-176.9	0	0	108.1	K111 S415	K111-E417 WeakPolarHBondContact CE-O 3.32Å; K111-E417 VanDerWaalsContact NZ-CB 3.34Å; K111-E417 IonicContact NZ-OE2 3.19Å; K111-E417 PolarHBondContact NZ-OE2 3.49Å; S415-E417 PolarHBondContact O-N 3.41Å
418	F	77.9	Confident	63.5	Low	27 Å²	27	86.1 Å²	86.1	12%	0.118	44%	0.44	C	S	.	.			trans	-66.8	147.3	164.2	-65.4	-80.2	0	0	0	108.5	R416 A420 S512 Y514 S515	R416-F418 HydrophobicContact CB-CD2 3.96Å; R416-F418 HydrophobicContact CB-CE2 3.46Å; R416-F418 VanDerWaalsContact CB-CE2 3.46Å; R416-F418 HydrophobicContact CB-CZ 3.95Å; R416-F418 HydrophobicContact CG-CE2 4.39Å; R416-F418 WeakPolarHBondContact O-CD2 3.32Å; R416-F418 PolarHBondContact O-N 3.17Å; F418-A420 VanDerWaalsContact C-N 3.29Å; F418-A420 PolarHBondContact O-N 3.37Å; F418-S512 WeakPolarHBondContact CD1-O 3.24Å; F418-Y514 WeakPolarHBondContact CE1-O 3.49Å; F418-Y514 VanDerWaalsContact CZ-O 3.3Å; F418-Y514 WeakPolarHBondContact CZ-O 3.18Å; F418-S515 VanDerWaalsContact CE2-CB 3.5Å
419	A	81	Confident	66.9	Low	46 Å²	46	80.5 Å²	80.5	38%	0.38	40%	0.402	S	S	.	.	S	Bend	trans	-65	-34.9	-177	0	0	0	0	0	112.8	K139	K139-A419 WeakPolarHBondContact O-CB 3.32Å
420	A	84.5	Confident	70.2	Confident	2 Å²	2	76.3 Å²	76.3	2%	0.017	38%	0.381	C	S	.	.	S	Bend	trans	-94.1	146.7	173.9	0	0	0	0	0	111.5	E142 F418 T424 Q425	E142-A420 HydrophobicContact CG-CB 4.46Å; F418-A420 VanDerWaalsContact C-N 3.29Å; F418-A420 PolarHBondContact O-N 3.37Å; A420-T424 HydrophobicContact CB-CG2 4.34Å; A420-Q425 HydrophobicContact CB-CG 4.09Å; A420-Q425 PolarHBondContact O-NE2 3.43Å
421	N	88.4	Confident	73.6	Confident	100 Å²	100	71.4 Å²	71.4	54%	0.535	37%	0.367	S	S	.	.			trans	-68	157.1	173.3	-66.4	-32.5	0	0	0	110.7	E142 L423 T424 Q425	E142-N421 VanDerWaalsContact CD-ND2 3.32Å; E142-N421 WeakPolarHBondContact OE1-CA 3.24Å; E142-N421 WeakPolarHBondContact OE1-CB 3.43Å; E142-N421 PolarHBondContact OE1-N 2.61Å; E142-N421 PolarHBondContact OE2-ND2 3.42Å; N421-L423 PolarHBondContact O-N 3.49Å; N421-T424 PolarHBondContact O-N 2.99Å; N421-T424 VanDerWaalsContact O-N 3.09Å; N421-Q425 WeakPolarHBondContact O-CG 3.12Å; N421-Q425 PolarHBondContact O-N 2.52Å
422	Q	89.7	Confident	76.8	Confident	125 Å²	125	64 Å²	64	58%	0.584	34%	0.338	S	S	*	.	H	α-helix	trans	-58.6	-34.6	-176.1	-64.7	-179.9	14.4	0	0	113.1	F426	Q422-F426 WeakPolarHBondContact O-CB 3.33Å; Q422-F426 PolarHBondContact O-N 2.79Å
423	L	92	Very high	79.8	Confident	98 Å²	98	60.4 Å²	60.4	51%	0.513	32%	0.319	S	S	.	.	H	α-helix	trans	-68.3	-41.6	177.5	-177	62.9	0	0	0	112	N421 F426 R427	N421-L423 PolarHBondContact O-N 3.49Å; L423-F426 HydrophobicContact CD1-CD1 4.45Å; L423-F426 PolarHBondContact O-N 3.24Å; L423-R427 WeakPolarHBondContact O-CG 3.44Å; L423-R427 PolarHBondContact O-N 2.85Å
424	T	91.7	Very high	82.5	Confident	39 Å²	39	60.7 Å²	60.7	24%	0.239	32%	0.32	C	S	.	.	H	α-helix	trans	-67.5	-43	176.8	-58.9	0	0	0	0	110.8	E142 A420 N421 F426 R427 V428	E142-T424 WeakPolarHBondContact OE1-CB 3.48Å; E142-T424 PolarHBondContact OE1-OG1 3.09Å; A420-T424 HydrophobicContact CB-CG2 4.34Å; N421-T424 PolarHBondContact O-N 2.99Å; N421-T424 VanDerWaalsContact O-N 3.09Å; T424-F426 VanDerWaalsContact C-N 3.31Å; T424-F426 PolarHBondContact O-N 3.25Å; T424-R427 PolarHBondContact O-N 2.84Å; T424-V428 HydrophobicContact CG2-CG2 4.27Å; T424-V428 WeakPolarHBondContact O-CB 3.22Å; T424-V428 VanDerWaalsContact O-CG2 3.26Å; T424-V428 WeakPolarHBondContact O-CG2 3.44Å; T424-V428 PolarHBondContact O-N 3.32Å
425	Q	94.4	Very high	85.4	Confident	2 Å²	2	56.8 Å²	56.8	1%	0.009	29%	0.292	C	S	.	.	H	α-helix	trans	-53	-52.2	170.7	-65.7	170.8	25.3	0	0	110.3	L138 A420 N421 R427 V428 L429 S515 A518	L138-Q425 HydrophobicContact CD2-CB 4.3Å; L138-Q425 HydrophobicContact CD2-CG 4.31Å; A420-Q425 HydrophobicContact CB-CG 4.09Å; A420-Q425 PolarHBondContact O-NE2 3.43Å; N421-Q425 WeakPolarHBondContact O-CG 3.12Å; N421-Q425 PolarHBondContact O-N 2.52Å; Q425-R427 PolarHBondContact O-N 3.12Å; Q425-V428 PolarHBondContact O-N 3.46Å; Q425-L429 VanDerWaalsContact O-CB 3.27Å; Q425-L429 WeakPolarHBondContact O-CB 3.37Å; Q425-L429 WeakPolarHBondContact O-CD1 3.49Å; Q425-L429 WeakPolarHBondContact O-CG 3.38Å; Q425-L429 PolarHBondContact O-N 3.05Å; Q425-S515 PolarHBondContact OE1-OG 3.37Å; Q425-S515 VanDerWaalsContact OE1-OG 3.05Å; Q425-A518 HydrophobicContact CB-CB 3.67Å
426	F	95.2	Very high	88.2	Confident	27 Å²	27	54 Å²	54	12%	0.118	27%	0.272	C	S	.	.	H	α-helix	trans	-59.4	-47.9	179.8	170.5	-103.1	0	0	0	112.6	Q422 L423 T424 L429 L430 M521 A522 L525	Q422-F426 WeakPolarHBondContact O-CB 3.33Å; Q422-F426 PolarHBondContact O-N 2.79Å; L423-F426 HydrophobicContact CD1-CD1 4.45Å; L423-F426 PolarHBondContact O-N 3.24Å; T424-F426 VanDerWaalsContact C-N 3.31Å; T424-F426 PolarHBondContact O-N 3.25Å; F426-L429 PolarHBondContact O-N 3.19Å; F426-L430 HydrophobicContact CE1-CD2 4.23Å; F426-L430 HydrophobicContact CZ-CD2 4.16Å; F426-L430 WeakPolarHBondContact O-CB 3.21Å; F426-L430 PolarHBondContact O-N 3.35Å; F426-M521 HydrophobicContact CB-CE 4.22Å; F426-M521 HydrophobicContact CD1-CE 4.07Å; F426-M521 HydrophobicContact CD2-CB 4.07Å; F426-M521 HydrophobicContact CD2-CE 3.31Å; F426-M521 HydrophobicContact CD2-CG 4.08Å; F426-M521 HydrophobicContact CE1-CE 4.26Å; F426-M521 HydrophobicContact CE2-CB 4.03Å; F426-M521 HydrophobicContact CE2-CE 3.53Å; F426-M521 HydrophobicContact CE2-CG 3.67Å; F426-M521 HydrophobicContact CE2-SD 4.38Å; F426-M521 HydrophobicContact CG-CE 3.59Å; F426-M521 HydrophobicContact CZ-CE 4Å; F426-M521 HydrophobicContact CZ-CG 4.47Å; F426-A522 HydrophobicContact CD2-CB 3.79Å; F426-A522 HydrophobicContact CE2-CB 4.08Å; F426-L525 HydrophobicContact CZ-CD2 3.76Å
427	R	95.4	Very high	90	Very high	156 Å²	156	52.2 Å²	52.2	59%	0.589	27%	0.267	S	S	*	.	H	α-helix	trans	-61	-48.5	179.6	-75.9	179.5	177.1	-179	-0.4	112.1	L423 T424 Q425 L429 L430 V431	L423-R427 WeakPolarHBondContact O-CG 3.44Å; L423-R427 PolarHBondContact O-N 2.85Å; T424-R427 PolarHBondContact O-N 2.84Å; Q425-R427 PolarHBondContact O-N 3.12Å; R427-L429 PolarHBondContact O-N 2.84Å; R427-L430 PolarHBondContact O-N 3.33Å; R427-V431 WeakPolarHBondContact O-CG2 3.35Å; R427-V431 PolarHBondContact O-N 2.94Å
428	V	95	Very high	91.3	Very high	26 Å²	26	51.1 Å²	51.1	16%	0.158	26%	0.263	C	S	.	.	H	α-helix	trans	-62.5	-44.9	179.7	173.8	0	0	0	0	110.5	N137 L138 T424 Q425 R432	N137-V428 HydrophobicContact CB-CG1 4.3Å; N137-V428 HydrophobicContact CB-CG2 3.88Å; L138-V428 HydrophobicContact CD1-CG1 4.18Å; L138-V428 HydrophobicContact CD2-CB 4.12Å; L138-V428 HydrophobicContact CD2-CG1 4.08Å; L138-V428 HydrophobicContact CG-CG1 3.96Å; T424-V428 HydrophobicContact CG2-CG2 4.27Å; T424-V428 WeakPolarHBondContact O-CB 3.22Å; T424-V428 VanDerWaalsContact O-CG2 3.26Å; T424-V428 WeakPolarHBondContact O-CG2 3.44Å; T424-V428 PolarHBondContact O-N 3.32Å; Q425-V428 PolarHBondContact O-N 3.46Å; V428-R432 VanDerWaalsContact O-CB 3.23Å; V428-R432 WeakPolarHBondContact O-CB 3.43Å; V428-R432 PolarHBondContact O-N 3.09Å
429	L	95.9	Very high	92	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-66.9	-37.2	178.6	-67.3	170.7	0	0	0	112.4	L138 Q425 F426 R427 R432 N433 Y514 A518 A522	L138-L429 HydrophobicContact CD1-CD2 4.2Å; L138-L429 HydrophobicContact CD2-CG 4.45Å; Q425-L429 VanDerWaalsContact O-CB 3.27Å; Q425-L429 WeakPolarHBondContact O-CB 3.37Å; Q425-L429 WeakPolarHBondContact O-CD1 3.49Å; Q425-L429 WeakPolarHBondContact O-CG 3.38Å; Q425-L429 PolarHBondContact O-N 3.05Å; F426-L429 PolarHBondContact O-N 3.19Å; R427-L429 PolarHBondContact O-N 2.84Å; L429-R432 VanDerWaalsContact CD2-NH2 3.34Å; L429-R432 PolarHBondContact O-N 3.19Å; L429-N433 WeakPolarHBondContact O-CB 3.39Å; L429-N433 PolarHBondContact O-N 3.16Å; L429-N433 PolarHBondContact O-ND2 3.44Å; L429-N433 PolarHBondContact O-OD1 3.46Å; L429-Y514 HydrophobicContact CD1-CD1 4.09Å; L429-Y514 HydrophobicContact CD1-CD2 3.83Å; L429-Y514 HydrophobicContact CD1-CE1 4.49Å; L429-Y514 HydrophobicContact CD1-CE2 4.25Å; L429-Y514 HydrophobicContact CD1-CG 3.73Å; L429-Y514 HydrophobicContact CD2-CD1 3.86Å; L429-Y514 HydrophobicContact CD2-CE1 3.68Å; L429-Y514 HydrophobicContact CD2-CG 4.35Å; L429-Y514 HydrophobicContact CG-CD1 4.45Å; L429-A518 HydrophobicContact CD1-CB 4.18Å; L429-A522 HydrophobicContact CB-CB 3.61Å
430	L	96.1	Very high	92.3	Very high	33 Å²	33	52.7 Å²	52.7	17%	0.173	26%	0.262	C	S	.	.	H	α-helix	trans	-63.5	-50.9	177.4	-176.5	71.1	0	0	0	110.6	F426 R427 R432 N433 I434 A522 L525 A526	F426-L430 HydrophobicContact CE1-CD2 4.23Å; F426-L430 HydrophobicContact CZ-CD2 4.16Å; F426-L430 WeakPolarHBondContact O-CB 3.21Å; F426-L430 PolarHBondContact O-N 3.35Å; R427-L430 PolarHBondContact O-N 3.33Å; L430-R432 VanDerWaalsContact C-N 3.34Å; L430-R432 PolarHBondContact O-N 3.11Å; L430-N433 PolarHBondContact O-N 2.97Å; L430-I434 HydrophobicContact CD1-CD1 4.23Å; L430-I434 HydrophobicContact CG-CD1 3.99Å; L430-I434 WeakPolarHBondContact O-CG1 3.38Å; L430-I434 PolarHBondContact O-N 2.76Å; L430-A522 HydrophobicContact CB-CB 4.34Å; L430-A522 WeakPolarHBondContact CD1-O 3.5Å; L430-L525 HydrophobicContact CD1-CB 3.97Å; L430-L525 HydrophobicContact CD1-CD2 4.23Å; L430-L525 HydrophobicContact CD1-CG 4.24Å; L430-L525 HydrophobicContact CD2-CD2 4.34Å; L430-A526 HydrophobicContact CD1-CB 4.1Å
431	V	95.8	Very high	92	Very high	97 Å²	97	55.5 Å²	55.5	59%	0.588	28%	0.281	S	S	*	.	H	α-helix	trans	-60.5	-45	177.1	173.2	0	0	0	0	110.6	R427 N433 I434 L435	R427-V431 WeakPolarHBondContact O-CG2 3.35Å; R427-V431 PolarHBondContact O-N 2.94Å; V431-N433 VanDerWaalsContact C-N 3.34Å; V431-N433 PolarHBondContact O-N 3.28Å; V431-I434 PolarHBondContact O-N 3.3Å; V431-L435 VanDerWaalsContact O-CB 3.28Å; V431-L435 WeakPolarHBondContact O-CB 3.41Å; V431-L435 PolarHBondContact O-N 3.45Å
432	R	95.3	Very high	91.9	Very high	14 Å²	14	55.6 Å²	55.6	5%	0.053	29%	0.286	C	S	.	.	H	α-helix	trans	-56.2	-47.6	176.4	-175.9	-176	80	167.7	2.3	111.9	L123 L126 C134 V428 L429 L430 S436 E508	L123-R432 HydrophobicContact CD1-CG 3.97Å; L126-R432 HydrophobicContact CD1-CG 3.91Å; C134-R432 VanDerWaalsContact SG-CD 3.5Å; V428-R432 VanDerWaalsContact O-CB 3.23Å; V428-R432 WeakPolarHBondContact O-CB 3.43Å; V428-R432 PolarHBondContact O-N 3.09Å; L429-R432 VanDerWaalsContact CD2-NH2 3.34Å; L429-R432 PolarHBondContact O-N 3.19Å; L430-R432 VanDerWaalsContact C-N 3.34Å; L430-R432 PolarHBondContact O-N 3.11Å; R432-S436 WeakPolarHBondContact O-CB 3.13Å; R432-S436 PolarHBondContact O-N 3.26Å; R432-E508 IonicContact CZ-OE2 3.83Å; R432-E508 IonicContact NH1-OE1 3.22Å; R432-E508 PolarHBondContact NH1-OE1 3.33Å; R432-E508 IonicContact NH1-OE2 2.63Å; R432-E508 PolarHBondContact NH1-OE2 3.33Å; R432-E508 IonicContact NH2-OE2 2.66Å; R432-E508 PolarHBondContact NH2-OE2 2.93Å
433	N	93.3	Very high	91.7	Very high	10 Å²	10	51.9 Å²	51.9	5%	0.053	27%	0.27	C	S	.	.	H	α-helix	trans	-68.8	-44.3	-177.8	-71	-13.5	0	0	0	111.5	L429 L430 V431 L435 S436 I437 K523 A526	L429-N433 WeakPolarHBondContact O-CB 3.39Å; L429-N433 PolarHBondContact O-N 3.16Å; L429-N433 PolarHBondContact O-ND2 3.44Å; L429-N433 PolarHBondContact O-OD1 3.46Å; L430-N433 PolarHBondContact O-N 2.97Å; V431-N433 VanDerWaalsContact C-N 3.34Å; V431-N433 PolarHBondContact O-N 3.28Å; N433-L435 PolarHBondContact O-N 3.43Å; N433-S436 PolarHBondContact O-N 2.7Å; N433-I437 WeakPolarHBondContact O-CD1 3.45Å; N433-I437 VanDerWaalsContact O-CG1 3.27Å; N433-I437 WeakPolarHBondContact O-CG1 3.37Å; N433-I437 PolarHBondContact O-N 2.76Å; N433-K523 WeakPolarHBondContact ND2-CA 3.48Å; N433-A526 HydrophobicContact CB-CB 3.58Å
434	I	93.3	Very high	91.5	Very high	53 Å²	53	48.7 Å²	48.7	27%	0.272	25%	0.254	S	S	.	.	H	α-helix	trans	-60.1	-47.1	176.3	-68.8	170.1	0	0	0	110.4	L430 V431 S436 I437 M438 A526	L430-I434 HydrophobicContact CD1-CD1 4.23Å; L430-I434 HydrophobicContact CG-CD1 3.99Å; L430-I434 WeakPolarHBondContact O-CG1 3.38Å; L430-I434 PolarHBondContact O-N 2.76Å; V431-I434 PolarHBondContact O-N 3.3Å; I434-S436 VanDerWaalsContact C-N 3.31Å; I434-S436 PolarHBondContact O-N 3.23Å; I434-I437 PolarHBondContact O-N 3.31Å; I434-M438 HydrophobicContact CG2-CG 4.33Å; I434-M438 HydrophobicContact CG2-SD 4.02Å; I434-M438 WeakPolarHBondContact O-CG 3.11Å; I434-M438 PolarHBondContact O-N 3.14Å; I434-A526 HydrophobicContact CG1-CB 3.98Å
435	L	92.7	Very high	91.4	Very high	49 Å²	49	52 Å²	52	26%	0.257	27%	0.267	S	S	.	.	H	α-helix	trans	-61	-41.8	178.7	-172.6	65.1	0	0	0	111.8	L126 V431 N433 M438 R439	L126-L435 HydrophobicContact CD2-CD2 3.94Å; V431-L435 VanDerWaalsContact O-CB 3.28Å; V431-L435 WeakPolarHBondContact O-CB 3.41Å; V431-L435 PolarHBondContact O-N 3.45Å; N433-L435 PolarHBondContact O-N 3.43Å; L435-M438 PolarHBondContact O-N 2.94Å; L435-R439 HydrophobicContact CD1-CG 4.42Å; L435-R439 WeakPolarHBondContact O-CB 3.22Å; L435-R439 WeakPolarHBondContact O-CG 3.37Å; L435-R439 PolarHBondContact O-N 2.99Å
436	S	91	Very high	91.2	Very high	19 Å²	19	57.2 Å²	57.2	13%	0.133	29%	0.294	C	S	.	.	H	α-helix	trans	-61.9	-42.2	176.2	-170.8	0	0	0	0	111.9	H125 R432 N433 I434 D440	H125-S436 PolarHBondContact CD2-O 3.21Å; R432-S436 WeakPolarHBondContact O-CB 3.13Å; R432-S436 PolarHBondContact O-N 3.26Å; N433-S436 PolarHBondContact O-N 2.7Å; I434-S436 VanDerWaalsContact C-N 3.31Å; I434-S436 PolarHBondContact O-N 3.23Å; S436-D440 PolarHBondContact O-N 3.34Å; S436-D440 VanDerWaalsContact O-N 3.11Å
437	I	89.3	Confident	91	Very high	26 Å²	26	57.5 Å²	57.5	13%	0.133	29%	0.294	C	S	.	.	H	α-helix	trans	-67	-46.9	178.1	-65.6	160.3	0	0	0	110.6	N433 I434 R439 D440 T444 A526 D527 F530	N433-I437 WeakPolarHBondContact O-CD1 3.45Å; N433-I437 VanDerWaalsContact O-CG1 3.27Å; N433-I437 WeakPolarHBondContact O-CG1 3.37Å; N433-I437 PolarHBondContact O-N 2.76Å; I434-I437 PolarHBondContact O-N 3.31Å; I437-R439 VanDerWaalsContact C-N 3.27Å; I437-R439 PolarHBondContact O-N 3.3Å; I437-D440 PolarHBondContact O-N 3.42Å; I437-T444 PolarHBondContact O-OG1 3.37Å; I437-A526 HydrophobicContact CD1-CB 4.25Å; I437-D527 WeakPolarHBondContact CD1-OD1 3.24Å; I437-F530 HydrophobicContact CB-CE2 4.13Å; I437-F530 HydrophobicContact CB-CZ 4.34Å; I437-F530 HydrophobicContact CD1-CD2 4.43Å; I437-F530 HydrophobicContact CD1-CE2 4.29Å; I437-F530 HydrophobicContact CG2-CD1 4.24Å; I437-F530 HydrophobicContact CG2-CD2 3.84Å; I437-F530 HydrophobicContact CG2-CE1 4.09Å; I437-F530 HydrophobicContact CG2-CE2 3.67Å; I437-F530 HydrophobicContact CG2-CG 4.13Å; I437-F530 HydrophobicContact CG2-CZ 3.81Å
438	M	89.2	Confident	90.9	Very high	124 Å²	124	52.4 Å²	52.4	61%	0.611	28%	0.279	S	S	*	.	H	α-helix	trans	-62.4	-33.8	-179.8	-71	-174.4	70.5	0	0	113.1	I434 L435 F530	I434-M438 HydrophobicContact CG2-CG 4.33Å; I434-M438 HydrophobicContact CG2-SD 4.02Å; I434-M438 WeakPolarHBondContact O-CG 3.11Å; I434-M438 PolarHBondContact O-N 3.14Å; L435-M438 PolarHBondContact O-N 2.94Å; M438-F530 HydrophobicContact CG-CE1 4.15Å; M438-F530 HydrophobicContact CG-CZ 3.68Å
439	R	92	Very high	90.9	Very high	68 Å²	68	55 Å²	55	26%	0.257	29%	0.294	S	S	.	.	H	α-helix	trans	-86.2	-15.6	-179.6	-71.7	-178.5	176.3	178	5	114.1	H125 E130 L435 I437 S441	H125-R439 HydrophobicContact CB-CB 4.06Å; H125-R439 WeakPolarHBondContact O-CD 3.36Å; H125-R439 PolarHBondContact O-NH1 2.87Å; E130-R439 IonicContact OE1-CZ 3.57Å; E130-R439 IonicContact OE1-NH1 2.77Å; E130-R439 PolarHBondContact OE1-NH1 3.11Å; E130-R439 IonicContact OE1-NH2 2.79Å; E130-R439 PolarHBondContact OE1-NH2 2.77Å; E130-R439 IonicContact OE2-CZ 3.45Å; E130-R439 IonicContact OE2-NH1 2.81Å; E130-R439 PolarHBondContact OE2-NH1 3.01Å; E130-R439 IonicContact OE2-NH2 3.42Å; L435-R439 HydrophobicContact CD1-CG 4.42Å; L435-R439 WeakPolarHBondContact O-CB 3.22Å; L435-R439 WeakPolarHBondContact O-CG 3.37Å; L435-R439 PolarHBondContact O-N 2.99Å; I437-R439 VanDerWaalsContact C-N 3.27Å; I437-R439 PolarHBondContact O-N 3.3Å; R439-S441 PolarHBondContact O-N 3.09Å
440	D	88	Confident	90.8	Very high	39 Å²	39	57.1 Å²	57.1	21%	0.209	31%	0.309	C	S	.	.			trans	-73.6	76.8	168.4	-159.9	-30.7	0	0	0	109.8	H125 S436 I437 T442 L443 T444	H125-D440 IonicContact CD2-OD2 3.61Å; H125-D440 IonicContact CE1-OD2 2.7Å; H125-D440 WeakPolarHBondContact NE2-CB 3.43Å; H125-D440 IonicContact NE2-OD1 3.9Å; H125-D440 IonicContact NE2-OD2 2.71Å; H125-D440 PolarHBondContact NE2-OD2 3.15Å; S436-D440 PolarHBondContact O-N 3.34Å; S436-D440 VanDerWaalsContact O-N 3.11Å; I437-D440 PolarHBondContact O-N 3.42Å; D440-T442 VanDerWaalsContact C-N 3.3Å; D440-T442 PolarHBondContact O-N 3.28Å; D440-L443 WeakPolarHBondContact OD1-CB 3.3Å; D440-L443 PolarHBondContact OD1-N 3.39Å; D440-L443 VanDerWaalsContact OD1-N 3.12Å; D440-T444 VanDerWaalsContact O-CB 3.26Å; D440-T444 WeakPolarHBondContact O-CB 2.99Å; D440-T444 PolarHBondContact O-N 2.91Å; D440-T444 PolarHBondContact O-OG1 3.34Å; D440-T444 VanDerWaalsContact O-OG1 3.06Å
441	S	77.6	Confident	90.8	Very high	60 Å²	60	55.7 Å²	55.7	42%	0.42	30%	0.302	S	S	.	.	H	α-helix	trans	-60.4	-42.1	-177.3	178.5	0	0	0	0	110.7	R439 H445	R439-S441 PolarHBondContact O-N 3.09Å; S441-H445 VanDerWaalsContact O-CB 3.23Å; S441-H445 WeakPolarHBondContact O-CB 3.33Å; S441-H445 PolarHBondContact O-CD2 3.49Å; S441-H445 VanDerWaalsContact O-CG 3.27Å; S441-H445 PolarHBondContact O-N 2.85Å; S441-H445 PolarHBondContact OG-CD2 2.87Å; S441-H445 PolarHBondContact OG-NE2 3.3Å
442	T	87.6	Confident	90.9	Very high	103 Å²	103	54.1 Å²	54.1	63%	0.632	29%	0.289	S	S	*	.	H	α-helix	trans	-60.5	-52.8	-179.1	-49	0	0	0	0	111.3	D440 L446	D440-T442 VanDerWaalsContact C-N 3.3Å; D440-T442 PolarHBondContact O-N 3.28Å; T442-L446 HydrophobicContact CG2-CD1 3.99Å; T442-L446 VanDerWaalsContact O-CB 3.29Å; T442-L446 WeakPolarHBondContact O-CB 3.31Å; T442-L446 WeakPolarHBondContact O-CD1 3.23Å; T442-L446 WeakPolarHBondContact O-CG 3.12Å; T442-L446 PolarHBondContact O-N 2.92Å; T442-L446 VanDerWaalsContact O-N 3.12Å
443	L	85.7	Confident	91	Very high	47 Å²	47	57.6 Å²	57.6	25%	0.246	31%	0.312	C	S	.	.	H	α-helix	trans	-71.8	-41.7	-175.9	-169.5	60.9	0	0	0	112.1	D440 R447 P493 T497	D440-L443 WeakPolarHBondContact OD1-CB 3.3Å; D440-L443 PolarHBondContact OD1-N 3.39Å; D440-L443 VanDerWaalsContact OD1-N 3.12Å; L443-R447 VanDerWaalsContact CD2-NH2 3.34Å; L443-R447 WeakPolarHBondContact O-CB 3.43Å; L443-R447 VanDerWaalsContact O-CG 3.26Å; L443-R447 WeakPolarHBondContact O-CG 3.39Å; L443-R447 PolarHBondContact O-N 3.46Å; L443-P493 HydrophobicContact CD1-CB 4.48Å; L443-T497 HydrophobicContact CD2-CG2 3.68Å
444	T	87.3	Confident	91.1	Very high	31 Å²	31	59 Å²	59	19%	0.19	32%	0.321	C	S	.	.	H	α-helix	trans	-69.9	-41.3	-177.3	-60.2	0	0	0	0	111.8	I437 D440 R447 L448 F534	I437-T444 PolarHBondContact O-OG1 3.37Å; D440-T444 VanDerWaalsContact O-CB 3.26Å; D440-T444 WeakPolarHBondContact O-CB 2.99Å; D440-T444 PolarHBondContact O-N 2.91Å; D440-T444 PolarHBondContact O-OG1 3.34Å; D440-T444 VanDerWaalsContact O-OG1 3.06Å; T444-R447 PolarHBondContact O-N 3.4Å; T444-L448 PolarHBondContact O-N 3.06Å; T444-F534 HydrophobicContact CG2-CZ 4.22Å
445	H	88.8	Confident	91.3	Very high	108 Å²	108	56.5 Å²	56.5	50%	0.5	31%	0.308	S	S	.	.	H	α-helix	trans	-69.1	-43	175.5	-68.1	-54.7	0	0	0	112.2	S441 R447 L448 V449	S441-H445 VanDerWaalsContact O-CB 3.23Å; S441-H445 WeakPolarHBondContact O-CB 3.33Å; S441-H445 PolarHBondContact O-CD2 3.49Å; S441-H445 VanDerWaalsContact O-CG 3.27Å; S441-H445 PolarHBondContact O-N 2.85Å; S441-H445 PolarHBondContact OG-CD2 2.87Å; S441-H445 PolarHBondContact OG-NE2 3.3Å; H445-R447 PolarHBondContact O-N 3.26Å; H445-L448 PolarHBondContact O-N 3.3Å; H445-L448 VanDerWaalsContact O-N 3.16Å; H445-V449 WeakPolarHBondContact O-CB 3.33Å; H445-V449 VanDerWaalsContact O-CG2 3.26Å; H445-V449 WeakPolarHBondContact O-CG2 3.4Å; H445-V449 PolarHBondContact O-N 3.07Å
446	L	90.7	Very high	91.6	Very high	112 Å²	112	58 Å²	58	59%	0.586	32%	0.315	S	S	*	.	H	α-helix	trans	-60.6	-37.4	177.2	-73.1	174.3	0	0	0	111.7	T442 S450	T442-L446 HydrophobicContact CG2-CD1 3.99Å; T442-L446 VanDerWaalsContact O-CB 3.29Å; T442-L446 WeakPolarHBondContact O-CB 3.31Å; T442-L446 WeakPolarHBondContact O-CD1 3.23Å; T442-L446 WeakPolarHBondContact O-CG 3.12Å; T442-L446 PolarHBondContact O-N 2.92Å; T442-L446 VanDerWaalsContact O-N 3.12Å; L446-S450 VanDerWaalsContact O-CB 3.26Å; L446-S450 WeakPolarHBondContact O-CB 3.5Å; L446-S450 PolarHBondContact O-N 3.35Å; L446-S450 PolarHBondContact O-OG 3.11Å
447	R	91.1	Very high	91.8	Very high	33 Å²	33	61.8 Å²	61.8	13%	0.125	33%	0.334	C	S	.	.	H	α-helix	trans	-63.3	-50.1	172.2	-73.6	179.6	-166.2	-170.1	12.3	111.6	L443 T444 H445 S450 H451 P493 F534	L443-R447 VanDerWaalsContact CD2-NH2 3.34Å; L443-R447 WeakPolarHBondContact O-CB 3.43Å; L443-R447 VanDerWaalsContact O-CG 3.26Å; L443-R447 WeakPolarHBondContact O-CG 3.39Å; L443-R447 PolarHBondContact O-N 3.46Å; T444-R447 PolarHBondContact O-N 3.4Å; H445-R447 PolarHBondContact O-N 3.26Å; R447-S450 PolarHBondContact O-N 3.07Å; R447-S450 PolarHBondContact O-OG 3.43Å; R447-H451 PolarHBondContact O-N 3.01Å; R447-H451 VanDerWaalsContact O-N 3.11Å; R447-H451 PolarHBondContact O-ND1 3.36Å; R447-P493 VanDerWaalsContact CZ-CB 3.4Å; R447-F534 HydrophobicContact CB-CE1 4.48Å; R447-F534 HydrophobicContact CB-CE2 4.08Å; R447-F534 HydrophobicContact CB-CZ 4.06Å
448	L	93	Very high	92.2	Very high	49 Å²	49	61.4 Å²	61.4	26%	0.257	33%	0.332	S	S	.	.	H	α-helix	trans	-61.7	-48.1	179.9	-177.7	59.1	0	0	0	112.2	T444 H445 S450 H451 I452 F533 F534	T444-L448 PolarHBondContact O-N 3.06Å; H445-L448 PolarHBondContact O-N 3.3Å; H445-L448 VanDerWaalsContact O-N 3.16Å; L448-S450 PolarHBondContact O-N 3.5Å; L448-H451 PolarHBondContact O-N 3.18Å; L448-I452 HydrophobicContact CD1-CD1 4.07Å; L448-I452 HydrophobicContact CD1-CG1 4.49Å; L448-I452 HydrophobicContact CG-CD1 4.03Å; L448-I452 WeakPolarHBondContact O-CG1 3.42Å; L448-I452 PolarHBondContact O-N 3.15Å; L448-I452 VanDerWaalsContact O-N 3.07Å; L448-F533 HydrophobicContact CD1-CE1 3.95Å; L448-F534 HydrophobicContact CB-CD1 4.46Å; L448-F534 HydrophobicContact CB-CE1 3.99Å; L448-F534 HydrophobicContact CD1-CD1 4.15Å; L448-F534 HydrophobicContact CD1-CE1 4.27Å
449	V	94.9	Very high	92.5	Very high	80 Å²	80	55.5 Å²	55.5	49%	0.485	30%	0.303	S	S	.	.	H	α-helix	trans	-61.6	-45.1	-179.6	172.2	0	0	0	0	110.7	H445 H451 I452 V453	H445-V449 WeakPolarHBondContact O-CB 3.33Å; H445-V449 VanDerWaalsContact O-CG2 3.26Å; H445-V449 WeakPolarHBondContact O-CG2 3.4Å; H445-V449 PolarHBondContact O-N 3.07Å; V449-H451 PolarHBondContact O-N 3.06Å; V449-I452 PolarHBondContact O-N 3.01Å; V449-V453 HydrophobicContact CG1-CG2 4.01Å; V449-V453 WeakPolarHBondContact O-CB 2.86Å; V449-V453 VanDerWaalsContact O-CG2 3.3Å; V449-V453 WeakPolarHBondContact O-CG2 3.46Å; V449-V453 PolarHBondContact O-N 2.9Å
450	S	94.5	Very high	92.6	Very high	45 Å²	45	56.5 Å²	56.5	32%	0.315	32%	0.316	S	S	.	.	H	α-helix	trans	-62.5	-39.4	177.5	55.6	0	0	0	0	112.7	L446 R447 L448 I452 V454	L446-S450 VanDerWaalsContact O-CB 3.26Å; L446-S450 WeakPolarHBondContact O-CB 3.5Å; L446-S450 PolarHBondContact O-N 3.35Å; L446-S450 PolarHBondContact O-OG 3.11Å; R447-S450 PolarHBondContact O-N 3.07Å; R447-S450 PolarHBondContact O-OG 3.43Å; L448-S450 PolarHBondContact O-N 3.5Å; S450-I452 PolarHBondContact O-N 3.12Å; S450-V454 VanDerWaalsContact O-CB 3.23Å; S450-V454 WeakPolarHBondContact O-CB 3.34Å; S450-V454 VanDerWaalsContact O-CG2 3.23Å; S450-V454 WeakPolarHBondContact O-CG2 3.35Å; S450-V454 PolarHBondContact O-N 2.93Å
451	H	96.2	Very high	92.9	Very high	3 Å²	3	59.9 Å²	59.9	1%	0.014	33%	0.333	C	S	.	.	H	α-helix	trans	-64.2	-39.6	175.3	-75.4	72.2	0	0	0	112.1	R447 L448 V449 G455 F485 Y538	R447-H451 PolarHBondContact O-N 3.01Å; R447-H451 VanDerWaalsContact O-N 3.11Å; R447-H451 PolarHBondContact O-ND1 3.36Å; L448-H451 PolarHBondContact O-N 3.18Å; V449-H451 PolarHBondContact O-N 3.06Å; H451-G455 WeakPolarHBondContact O-CA 3.36Å; H451-G455 PolarHBondContact O-N 3.11Å; H451-F485 HydrophobicContact CB-CE1 4.34Å; H451-F485 HydrophobicContact CB-CZ 4.47Å; H451-F485 AromaticContact CD2-CE1 3.63Å; H451-F485 AromaticContact CG-CE1 3.84Å; H451-F485 AromaticContact CG-CZ 3.99Å; H451-Y538 WeakPolarHBondContact O-CD2 3.18Å
452	I	97.5	Very high	93.7	Very high	63 Å²	63	58.9 Å²	58.9	32%	0.323	32%	0.321	S	S	.	.	H	α-helix	trans	-69.8	-51.2	177.7	-65.2	168.8	0	0	0	110.7	L448 V449 S450 G455 I456 V537 I541	L448-I452 HydrophobicContact CD1-CD1 4.07Å; L448-I452 HydrophobicContact CD1-CG1 4.49Å; L448-I452 HydrophobicContact CG-CD1 4.03Å; L448-I452 WeakPolarHBondContact O-CG1 3.42Å; L448-I452 PolarHBondContact O-N 3.15Å; L448-I452 VanDerWaalsContact O-N 3.07Å; V449-I452 PolarHBondContact O-N 3.01Å; S450-I452 PolarHBondContact O-N 3.12Å; I452-G455 PolarHBondContact O-N 3.16Å; I452-I456 HydrophobicContact CG2-CD1 3.82Å; I452-I456 WeakPolarHBondContact O-CG1 3.34Å; I452-I456 PolarHBondContact O-N 2.64Å; I452-V537 HydrophobicContact CG1-CG1 4Å; I452-I541 HydrophobicContact CG1-CD1 4.39Å; I452-I541 HydrophobicContact CG2-CD1 4.41Å
453	V	97.2	Very high	94	Very high	88 Å²	88	58.3 Å²	58.3	53%	0.533	31%	0.309	S	S	.	.	H	α-helix	trans	-62.6	-47.7	-176.7	171.9	0	0	0	0	111.2	V449 I456 L457	V449-V453 HydrophobicContact CG1-CG2 4.01Å; V449-V453 WeakPolarHBondContact O-CB 2.86Å; V449-V453 VanDerWaalsContact O-CG2 3.3Å; V449-V453 WeakPolarHBondContact O-CG2 3.46Å; V449-V453 PolarHBondContact O-N 2.9Å; V453-I456 PolarHBondContact O-N 2.84Å; V453-L457 WeakPolarHBondContact O-CB 3.45Å; V453-L457 PolarHBondContact O-N 3.47Å
454	V	96.6	Very high	94.4	Very high	39 Å²	39	61.8 Å²	61.8	24%	0.236	32%	0.319	C	S	.	.	H	α-helix	trans	-69.2	-36.1	178.5	178.9	0	0	0	0	110.9	S450 L457 I458 F485 Y538	S450-V454 VanDerWaalsContact O-CB 3.23Å; S450-V454 WeakPolarHBondContact O-CB 3.34Å; S450-V454 VanDerWaalsContact O-CG2 3.23Å; S450-V454 WeakPolarHBondContact O-CG2 3.35Å; S450-V454 PolarHBondContact O-N 2.93Å; V454-L457 PolarHBondContact O-N 3.27Å; V454-I458 HydrophobicContact CG1-CD1 3.74Å; V454-I458 HydrophobicContact CG1-CG1 4.25Å; V454-I458 WeakPolarHBondContact O-CB 3.26Å; V454-I458 WeakPolarHBondContact O-CG1 3.47Å; V454-I458 PolarHBondContact O-N 3.31Å; V454-F485 HydrophobicContact CB-CD2 4.21Å; V454-F485 HydrophobicContact CB-CE1 4.47Å; V454-F485 HydrophobicContact CB-CE2 3.84Å; V454-F485 HydrophobicContact CB-CZ 3.99Å; V454-F485 HydrophobicContact CG1-CD1 4.37Å; V454-F485 HydrophobicContact CG1-CD2 3.69Å; V454-F485 HydrophobicContact CG1-CE2 3.86Å; V454-F485 HydrophobicContact CG1-CG 3.96Å; V454-F485 HydrophobicContact CG1-CZ 4.28Å; V454-F485 HydrophobicContact CG2-CD2 4.35Å; V454-F485 HydrophobicContact CG2-CE2 3.81Å; V454-F485 HydrophobicContact CG2-CZ 4.27Å; V454-Y538 HydrophobicContact CG1-CE2 4.29Å
455	G	97	Very high	94.5	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-61.6	-44.7	175	0	0	0	0	0	112.9	H451 I452 G459 T542	H451-G455 WeakPolarHBondContact O-CA 3.36Å; H451-G455 PolarHBondContact O-N 3.11Å; I452-G455 PolarHBondContact O-N 3.16Å; G455-G459 PolarHBondContact O-N 2.81Å; G455-T542 WeakPolarHBondContact O-CG2 3.49Å
456	I	97.5	Very high	94.6	Very high	81 Å²	81	55.3 Å²	55.3	42%	0.415	29%	0.287	S	S	.	.	H	α-helix	trans	-64.7	-46.1	174.4	-66.8	167.9	0	0	0	110.3	I452 V453 I458 G459 V460 I541	I452-I456 HydrophobicContact CG2-CD1 3.82Å; I452-I456 WeakPolarHBondContact O-CG1 3.34Å; I452-I456 PolarHBondContact O-N 2.64Å; V453-I456 PolarHBondContact O-N 2.84Å; I456-I458 PolarHBondContact O-N 2.97Å; I456-G459 PolarHBondContact O-N 3.29Å; I456-V460 HydrophobicContact CG2-CG2 4.29Å; I456-V460 WeakPolarHBondContact O-CG2 3.3Å; I456-V460 PolarHBondContact O-N 3.44Å; I456-I541 HydrophobicContact CG1-CG2 4.13Å
457	L	97	Very high	94.5	Very high	99 Å²	99	53 Å²	53	52%	0.518	28%	0.275	S	S	.	.	H	α-helix	trans	-58.4	-50.7	179.7	179.9	64.5	0	0	0	111.8	V453 V454 G459 V460 L461	V453-L457 WeakPolarHBondContact O-CB 3.45Å; V453-L457 PolarHBondContact O-N 3.47Å; V454-L457 PolarHBondContact O-N 3.27Å; L457-G459 VanDerWaalsContact C-N 3.34Å; L457-V460 PolarHBondContact O-N 2.97Å; L457-L461 HydrophobicContact CD1-CD1 4.4Å; L457-L461 HydrophobicContact CG-CD1 4.23Å; L457-L461 VanDerWaalsContact O-CG 3.31Å; L457-L461 WeakPolarHBondContact O-CG 3.26Å; L457-L461 PolarHBondContact O-N 3.43Å
458	I	95.9	Very high	94.3	Very high	18 Å²	18	52 Å²	52	9%	0.092	27%	0.273	C	S	.	.	H	α-helix	trans	-64.3	-40.6	177.2	-71	175.9	0	0	0	110.6	V454 I456 V460 L461 Y462 F478 F481 Y538 T542	V454-I458 HydrophobicContact CG1-CD1 3.74Å; V454-I458 HydrophobicContact CG1-CG1 4.25Å; V454-I458 WeakPolarHBondContact O-CB 3.26Å; V454-I458 WeakPolarHBondContact O-CG1 3.47Å; V454-I458 PolarHBondContact O-N 3.31Å; I456-I458 PolarHBondContact O-N 2.97Å; I458-V460 VanDerWaalsContact C-N 3.34Å; I458-V460 PolarHBondContact O-N 2.77Å; I458-L461 PolarHBondContact O-N 3.01Å; I458-Y462 HydrophobicContact CG2-CD2 4.08Å; I458-Y462 WeakPolarHBondContact O-CD2 3.48Å; I458-Y462 PolarHBondContact O-N 3.4Å; I458-F478 HydrophobicContact CG2-CD2 3.7Å; I458-F478 HydrophobicContact CG2-CE2 3.95Å; I458-F481 HydrophobicContact CD1-CB 4.46Å; I458-Y538 WeakPolarHBondContact CD1-OH 3.43Å; I458-T542 HydrophobicContact CB-CG2 4.42Å; I458-T542 HydrophobicContact CG2-CG2 4.24Å
459	G	95.5	Very high	94	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-60.5	-38.5	175.8	0	0	0	0	0	113.6	G455 I456 L457 F463	G455-G459 PolarHBondContact O-N 2.81Å; I456-G459 PolarHBondContact O-N 3.29Å; L457-G459 VanDerWaalsContact C-N 3.34Å; G459-F463 VanDerWaalsContact O-CA 3.3Å; G459-F463 WeakPolarHBondContact O-CA 3.16Å; G459-F463 PolarHBondContact O-N 2.95Å; G459-F463 VanDerWaalsContact O-N 3.11Å
460	V	95.7	Very high	93.5	Very high	89 Å²	89	48.3 Å²	48.3	54%	0.539	25%	0.247	S	C	.	.	H	α-helix	trans	-70.8	-44.9	175.3	171.8	0	0	0	0	111.2	I456 L457 I458 Y462 F463 M545	I456-V460 HydrophobicContact CG2-CG2 4.29Å; I456-V460 WeakPolarHBondContact O-CG2 3.3Å; I456-V460 PolarHBondContact O-N 3.44Å; L457-V460 PolarHBondContact O-N 2.97Å; I458-V460 VanDerWaalsContact C-N 3.34Å; I458-V460 PolarHBondContact O-N 2.77Å; V460-Y462 VanDerWaalsContact C-N 3.29Å; V460-Y462 PolarHBondContact O-N 3.32Å; V460-F463 WeakPolarHBondContact O-CB 3.46Å; V460-F463 PolarHBondContact O-N 3.17Å; V460-M545 HydrophobicContact CG2-CE 3.78Å
461	L	94.4	Very high	93.2	Very high	110 Å²	110	47.3 Å²	47.3	58%	0.576	24%	0.238	S	C	*	.	H	α-helix	trans	-61.2	-38	-179.1	-72.8	172.9	0	0	0	112.4	L457 I458	L457-L461 HydrophobicContact CD1-CD1 4.4Å; L457-L461 HydrophobicContact CG-CD1 4.23Å; L457-L461 VanDerWaalsContact O-CG 3.31Å; L457-L461 WeakPolarHBondContact O-CG 3.26Å; L457-L461 PolarHBondContact O-N 3.43Å; I458-L461 PolarHBondContact O-N 3.01Å
462	Y	94.2	Very high	92.9	Very high	39 Å²	39	47.3 Å²	47.3	15%	0.153	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.9	25.2	-179.4	-64.5	-82	0	0	0	113.3	I458 V460 R464 V465 S474 A477 F478 F481 T546	I458-Y462 HydrophobicContact CG2-CD2 4.08Å; I458-Y462 WeakPolarHBondContact O-CD2 3.48Å; I458-Y462 PolarHBondContact O-N 3.4Å; V460-Y462 VanDerWaalsContact C-N 3.29Å; V460-Y462 PolarHBondContact O-N 3.32Å; Y462-R464 PolarHBondContact O-N 2.92Å; Y462-V465 WeakPolarHBondContact O-CB 3.22Å; Y462-V465 VanDerWaalsContact O-CG2 3.31Å; Y462-V465 WeakPolarHBondContact O-CG2 3.29Å; Y462-V465 PolarHBondContact O-N 2.97Å; Y462-V465 VanDerWaalsContact O-N 3.16Å; Y462-S474 WeakPolarHBondContact CD1-O 3.43Å; Y462-S474 WeakPolarHBondContact CE1-O 3.49Å; Y462-A477 HydrophobicContact CE1-CB 4.22Å; Y462-F478 HydrophobicContact CD1-CB 3.8Å; Y462-F478 HydrophobicContact CD2-CB 3.96Å; Y462-F478 HydrophobicContact CD2-CD2 4.34Å; Y462-F478 HydrophobicContact CE1-CB 4.18Å; Y462-F478 HydrophobicContact CE2-CB 4.32Å; Y462-F478 HydrophobicContact CG-CB 3.68Å; Y462-F478 HydrophobicContact CG-CD2 4.48Å; Y462-F478 HydrophobicContact CG-CG 4.42Å; Y462-F481 HydrophobicContact CE2-CD2 4.38Å; Y462-F481 WeakPolarHBondContact OH-CD2 3.37Å; Y462-F481 WeakPolarHBondContact OH-CE2 3.27Å; Y462-T546 WeakPolarHBondContact O-CG2 3.45Å
463	F	94	Very high	92.5	Very high	90 Å²	90	48 Å²	48	40%	0.395	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	124.2	-176.4	-171.8	-113.6	0	0	0	111.8	G459 V460 V465 M545	G459-F463 VanDerWaalsContact O-CA 3.3Å; G459-F463 WeakPolarHBondContact O-CA 3.16Å; G459-F463 PolarHBondContact O-N 2.95Å; G459-F463 VanDerWaalsContact O-N 3.11Å; V460-F463 WeakPolarHBondContact O-CB 3.46Å; V460-F463 PolarHBondContact O-N 3.17Å; F463-V465 VanDerWaalsContact C-N 3.25Å; F463-V465 PolarHBondContact O-N 3.43Å; F463-M545 VanDerWaalsContact CD2-O 3.26Å; F463-M545 WeakPolarHBondContact CD2-O 3.29Å
464	R	92.7	Very high	92.2	Very high	121 Å²	121	45.4 Å²	45.4	46%	0.457	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.2	24.7	179.8	-50.3	-170	158.1	161.2	0	116.6	Y462 M545 T546 E547	Y462-R464 PolarHBondContact O-N 2.92Å; R464-M545 PolarHBondContact N-O 3.31Å; R464-T546 CarbonylContact C-O 3.57Å; R464-E547 HydrophobicContact CB-CG 4.16Å; R464-E547 WeakPolarHBondContact CB-OE2 3.43Å; R464-E547 WeakPolarHBondContact CD-OE1 3.47Å; R464-E547 HydrophobicContact CG-CG 3.89Å; R464-E547 VanDerWaalsContact CG-OE1 3.22Å; R464-E547 WeakPolarHBondContact CG-OE1 3.13Å; R464-E547 IonicContact CZ-OE1 3.83Å; R464-E547 IonicContact NE-OE1 2.79Å; R464-E547 PolarHBondContact NE-OE1 3.36Å; R464-E547 IonicContact NH2-OE1 3.84Å
465	V	90.7	Very high	92	Very high	2 Å²	2	43.5 Å²	43.5	1%	0.012	22%	0.216	C	C	.	.			trans	-76.8	-24.1	-178.7	170.7	0	0	0	0	112.7	Y462 F463 N467 L468 E471 N475 T546	Y462-V465 WeakPolarHBondContact O-CB 3.22Å; Y462-V465 VanDerWaalsContact O-CG2 3.31Å; Y462-V465 WeakPolarHBondContact O-CG2 3.29Å; Y462-V465 PolarHBondContact O-N 2.97Å; Y462-V465 VanDerWaalsContact O-N 3.16Å; F463-V465 VanDerWaalsContact C-N 3.25Å; F463-V465 PolarHBondContact O-N 3.43Å; V465-N467 VanDerWaalsContact C-N 3.31Å; V465-N467 PolarHBondContact O-N 3.4Å; V465-N467 VanDerWaalsContact O-N 3.14Å; V465-L468 PolarHBondContact O-N 2.91Å; V465-L468 VanDerWaalsContact O-N 3.16Å; V465-E471 HydrophobicContact CG1-CB 3.95Å; V465-N475 HydrophobicContact CG1-CB 3.88Å; V465-T546 PolarHBondContact N-O 3.46Å
466	G	89.7	Confident	91.9	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-32.4	-167.3	0	0	0	0	0	115.8	T546 R638	G466-T546 WeakPolarHBondContact CA-O 3.29Å; G466-T546 PolarHBondContact N-O 3.05Å; G466-R638 PolarHBondContact O-NH2 3.32Å
467	N	88.6	Confident	91.7	Very high	63 Å²	63	40.1 Å²	40.1	34%	0.337	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-2.3	-178.2	-71.6	-34.1	0	0	0	114.9	V465 E547 R638 D642	V465-N467 VanDerWaalsContact C-N 3.31Å; V465-N467 PolarHBondContact O-N 3.4Å; V465-N467 VanDerWaalsContact O-N 3.14Å; N467-E547 PolarHBondContact ND2-O 3.38Å; N467-R638 PolarHBondContact OD1-NH2 3.37Å; N467-D642 PolarHBondContact O-N 3.49Å
468	L	88.6	Confident	91.6	Very high	14 Å²	14	35.4 Å²	35.4	7%	0.073	18%	0.175	C	C	.	.	B	Isolated β-bridge	trans	-85.2	116.9	-176.4	-65.1	176.8	0	0	0	111.7	V465 Y470 E471 R645	V465-L468 PolarHBondContact O-N 2.91Å; V465-L468 VanDerWaalsContact O-N 3.16Å; L468-Y470 VanDerWaalsContact C-N 3.3Å; L468-Y470 PolarHBondContact O-N 3.02Å; L468-E471 HydrophobicContact CB-CB 4.02Å; L468-E471 HydrophobicContact CB-CG 4.38Å; L468-E471 HydrophobicContact CD1-CB 4.47Å; L468-E471 HydrophobicContact CD1-CG 4.22Å; L468-E471 PolarHBondContact O-N 2.82Å; L468-R645 HydrophobicContact CD2-CB 3.84Å; L468-R645 HydrophobicContact CD2-CG 4Å
469	G	85.9	Confident	91.6	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.01	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-21.7	-178.9	0	0	0	0	0	114.6	V472 D642 C655 L656	G469-V472 WeakPolarHBondContact O-CG2 3.47Å; G469-D642 PolarHBondContact N-O 3.11Å; G469-C655 VanDerWaalsContact CA-SG 3.58Å; G469-L656 PolarHBondContact O-N 3Å; G469-L656 VanDerWaalsContact O-N 3.1Å
470	Y	85.3	Confident	91.5	Very high	50 Å²	50	34.9 Å²	34.9	20%	0.196	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-20.4	174.5	-64	-71.9	0	0	0	113.8	L468 C643 K646 S652 Y653 C655	L468-Y470 VanDerWaalsContact C-N 3.3Å; L468-Y470 PolarHBondContact O-N 3.02Å; Y470-C643 HydrophobicContact CE2-CB 4.43Å; Y470-C643 WeakPolarHBondContact CE2-O 3.33Å; Y470-C643 PolarHBondContact OH-O 2.89Å; Y470-K646 HydrophobicContact CD2-CG 3.75Å; Y470-K646 HydrophobicContact CE2-CD 4.14Å; Y470-K646 HydrophobicContact CE2-CG 3.38Å; Y470-K646 WeakPolarHBondContact OH-CE 3.1Å; Y470-S652 WeakPolarHBondContact CD1-OG 3.27Å; Y470-S652 VanDerWaalsContact CE1-OG 3.32Å; Y470-S652 WeakPolarHBondContact CE1-OG 3.11Å; Y470-Y653 WeakPolarHBondContact CD1-O 3.26Å; Y470-C655 HydrophobicContact CD1-CB 3.87Å; Y470-C655 HydrophobicContact CE1-CB 3.45Å; Y470-C655 VanDerWaalsContact CE1-CB 3.45Å; Y470-C655 HydrophobicContact CE2-CB 4.41Å
471	E	87.7	Confident	91.5	Very high	24 Å²	24	34.3 Å²	34.3	11%	0.112	16%	0.163	C	C	.	.			trans	-111.7	25	-171	-67.4	-84.4	-162.5	0	0	111.1	V465 L468 I473 S474 N475	V465-E471 HydrophobicContact CG1-CB 3.95Å; L468-E471 HydrophobicContact CB-CB 4.02Å; L468-E471 HydrophobicContact CB-CG 4.38Å; L468-E471 HydrophobicContact CD1-CB 4.47Å; L468-E471 HydrophobicContact CD1-CG 4.22Å; L468-E471 PolarHBondContact O-N 2.82Å; E471-I473 VanDerWaalsContact C-N 3.28Å; E471-I473 PolarHBondContact O-N 3.35Å; E471-S474 CarbonylContact O-C 3.56Å; E471-S474 WeakPolarHBondContact O-CA 3.4Å; E471-S474 WeakPolarHBondContact O-CB 3.24Å; E471-S474 PolarHBondContact O-N 3.26Å; E471-S474 VanDerWaalsContact OE2-CB 3.29Å; E471-S474 WeakPolarHBondContact OE2-CB 3.43Å; E471-S474 PolarHBondContact OE2-OG 3.22Å; E471-N475 PolarHBondContact O-N 3.17Å
472	V	88.9	Confident	91.5	Very high	2 Å²	2	29.1 Å²	29.1	1%	0.012	14%	0.135	C	C	.	.	H	α-helix	trans	-58	-39.5	179	170.8	0	0	0	0	112	G469 S474 N475 A476 L641 L656 I662	G469-V472 WeakPolarHBondContact O-CG2 3.47Å; V472-S474 VanDerWaalsContact C-N 3.32Å; V472-S474 PolarHBondContact O-N 3.37Å; V472-N475 PolarHBondContact O-N 3.4Å; V472-A476 WeakPolarHBondContact O-CB 3.44Å; V472-A476 PolarHBondContact O-N 2.98Å; V472-L641 HydrophobicContact CG2-CD2 4.06Å; V472-L656 HydrophobicContact CB-CD1 4.2Å; V472-L656 HydrophobicContact CG1-CD1 4.19Å; V472-L656 HydrophobicContact CG2-CB 4.06Å; V472-I662 HydrophobicContact CG1-CB 4.32Å; V472-I662 HydrophobicContact CG1-CD1 3.92Å; V472-I662 HydrophobicContact CG1-CG1 3.95Å; V472-I662 HydrophobicContact CG1-CG2 3.55Å; V472-I662 HydrophobicContact CG2-CD1 3.76Å; V472-I662 HydrophobicContact CG2-CG1 4.28Å
473	I	88.7	Confident	91.6	Very high	78 Å²	78	27.5 Å²	27.5	40%	0.4	13%	0.129	S	C	.	.	H	α-helix	trans	-64.6	-39.6	175.4	-61.7	171.4	0	0	0	110.6	E471 A476 A477 Y653	E471-I473 VanDerWaalsContact C-N 3.28Å; E471-I473 PolarHBondContact O-N 3.35Å; I473-A476 WeakPolarHBondContact O-CB 3.18Å; I473-A476 PolarHBondContact O-N 2.86Å; I473-A477 PolarHBondContact O-N 2.92Å; I473-Y653 HydrophobicContact CD1-CD1 4.15Å; I473-Y653 HydrophobicContact CD1-CD2 4.3Å; I473-Y653 HydrophobicContact CD1-CE1 4.07Å; I473-Y653 HydrophobicContact CD1-CE2 4.23Å; I473-Y653 HydrophobicContact CD1-CG 4.26Å
474	S	91.5	Very high	91.6	Very high	33 Å²	33	24.6 Å²	24.6	23%	0.231	12%	0.118	C	C	.	.	H	α-helix	trans	-65.6	-39	175.1	-60.8	0	0	0	0	111.4	Y462 E471 V472 A477 F478	Y462-S474 WeakPolarHBondContact CD1-O 3.43Å; Y462-S474 WeakPolarHBondContact CE1-O 3.49Å; E471-S474 CarbonylContact O-C 3.56Å; E471-S474 WeakPolarHBondContact O-CA 3.4Å; E471-S474 WeakPolarHBondContact O-CB 3.24Å; E471-S474 PolarHBondContact O-N 3.26Å; E471-S474 VanDerWaalsContact OE2-CB 3.29Å; E471-S474 WeakPolarHBondContact OE2-CB 3.43Å; E471-S474 PolarHBondContact OE2-OG 3.22Å; V472-S474 VanDerWaalsContact C-N 3.32Å; V472-S474 PolarHBondContact O-N 3.37Å; S474-A477 WeakPolarHBondContact O-CB 3.43Å; S474-A477 PolarHBondContact O-N 3.16Å; S474-F478 PolarHBondContact O-N 3.05Å
475	N	93.3	Very high	91.7	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-66.5	-39	173.9	-160.6	41.3	0	0	0	112	V465 E471 V472 A477 F478 V479 Q548 Y634	V465-N475 HydrophobicContact CG1-CB 3.88Å; E471-N475 PolarHBondContact O-N 3.17Å; V472-N475 PolarHBondContact O-N 3.4Å; N475-A477 VanDerWaalsContact C-N 3.33Å; N475-A477 PolarHBondContact O-N 3.06Å; N475-F478 VanDerWaalsContact O-CB 3.32Å; N475-F478 WeakPolarHBondContact O-CB 3.47Å; N475-F478 PolarHBondContact O-N 3.24Å; N475-V479 WeakPolarHBondContact O-CG2 3.39Å; N475-V479 PolarHBondContact O-N 2.84Å; N475-Q548 PolarHBondContact ND2-OE1 2.86Å; N475-Q548 PolarHBondContact OD1-NE2 3.47Å; N475-Y634 VanDerWaalsContact CB-OH 3.29Å; N475-Y634 WeakPolarHBondContact CB-OH 3.18Å; N475-Y634 PolarHBondContact ND2-OH 3.27Å
476	A	93.1	Very high	92	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-61.9	-42.2	173.4	0	0	0	0	0	111.2	V472 I473 F478 V479 F480 F602 F626 I630 L666	V472-A476 WeakPolarHBondContact O-CB 3.44Å; V472-A476 PolarHBondContact O-N 2.98Å; I473-A476 WeakPolarHBondContact O-CB 3.18Å; I473-A476 PolarHBondContact O-N 2.86Å; A476-F478 VanDerWaalsContact C-N 3.33Å; A476-F478 PolarHBondContact O-N 2.85Å; A476-V479 PolarHBondContact O-N 3.32Å; A476-F480 WeakPolarHBondContact O-CB 3.5Å; A476-F480 PolarHBondContact O-N 3.42Å; A476-F602 HydrophobicContact CB-CE2 4.34Å; A476-F626 HydrophobicContact CB-CZ 4.19Å; A476-F626 WeakPolarHBondContact O-CE2 3.45Å; A476-I630 HydrophobicContact CB-CD1 4.04Å; A476-L666 HydrophobicContact CB-CD1 4.08Å; A476-L666 HydrophobicContact CB-CD2 4.37Å
477	A	93.8	Very high	92.2	Very high	10 Å²	10	20.4 Å²	20.4	8%	0.083	10%	0.103	C	C	.	.	H	α-helix	trans	-60.4	-42.1	173.5	0	0	0	0	0	111.9	Y462 I473 S474 N475 V479 F480 F481 F602	Y462-A477 HydrophobicContact CE1-CB 4.22Å; I473-A477 PolarHBondContact O-N 2.92Å; S474-A477 WeakPolarHBondContact O-CB 3.43Å; S474-A477 PolarHBondContact O-N 3.16Å; N475-A477 VanDerWaalsContact C-N 3.33Å; N475-A477 PolarHBondContact O-N 3.06Å; A477-V479 PolarHBondContact O-N 3.36Å; A477-F480 WeakPolarHBondContact O-CB 3.19Å; A477-F480 PolarHBondContact O-N 3.37Å; A477-F481 HydrophobicContact CB-CD2 4.37Å; A477-F481 HydrophobicContact CB-CE2 4.25Å; A477-F481 WeakPolarHBondContact O-CD2 3.08Å; A477-F481 PolarHBondContact O-N 2.95Å; A477-F602 HydrophobicContact CB-CE2 3.92Å; A477-F602 HydrophobicContact CB-CZ 3.6Å
478	F	95.3	Very high	92.5	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-55.7	-50.7	173.5	155.3	-109.7	0	0	0	112.4	I458 Y462 S474 N475 A476 F480 F481 T482 T542 T546 Q548	I458-F478 HydrophobicContact CG2-CD2 3.7Å; I458-F478 HydrophobicContact CG2-CE2 3.95Å; Y462-F478 HydrophobicContact CD1-CB 3.8Å; Y462-F478 HydrophobicContact CD2-CB 3.96Å; Y462-F478 HydrophobicContact CD2-CD2 4.34Å; Y462-F478 HydrophobicContact CE1-CB 4.18Å; Y462-F478 HydrophobicContact CE2-CB 4.32Å; Y462-F478 HydrophobicContact CG-CB 3.68Å; Y462-F478 HydrophobicContact CG-CD2 4.48Å; Y462-F478 HydrophobicContact CG-CG 4.42Å; S474-F478 PolarHBondContact O-N 3.05Å; N475-F478 VanDerWaalsContact O-CB 3.32Å; N475-F478 WeakPolarHBondContact O-CB 3.47Å; N475-F478 PolarHBondContact O-N 3.24Å; A476-F478 VanDerWaalsContact C-N 3.33Å; A476-F478 PolarHBondContact O-N 2.85Å; F478-F480 VanDerWaalsContact C-N 3.29Å; F478-F480 PolarHBondContact O-N 3Å; F478-F481 PolarHBondContact O-N 3.49Å; F478-T482 WeakPolarHBondContact CE2-OG1 3.46Å; F478-T482 WeakPolarHBondContact O-CB 3.45Å; F478-T482 PolarHBondContact O-N 3.47Å; F478-T482 PolarHBondContact O-OG1 2.84Å; F478-T482 VanDerWaalsContact O-OG1 3.11Å; F478-T542 HydrophobicContact CE2-CG2 4.32Å; F478-T546 HydrophobicContact CD1-CG2 4.4Å; F478-T546 HydrophobicContact CD2-CG2 3.92Å; F478-T546 HydrophobicContact CE1-CG2 4.31Å; F478-T546 HydrophobicContact CE2-CG2 3.85Å; F478-T546 HydrophobicContact CG-CG2 4.21Å; F478-T546 HydrophobicContact CZ-CG2 4.04Å; F478-Q548 HydrophobicContact CE1-CG 4.27Å
479	V	95.1	Very high	92.8	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-59.8	-44.4	178.8	173.6	0	0	0	0	110.3	N475 A476 A477 T482 L483 F626 A629 I630 I633	N475-V479 WeakPolarHBondContact O-CG2 3.39Å; N475-V479 PolarHBondContact O-N 2.84Å; A476-V479 PolarHBondContact O-N 3.32Å; A477-V479 PolarHBondContact O-N 3.36Å; V479-T482 WeakPolarHBondContact O-CB 3.35Å; V479-T482 PolarHBondContact O-N 3.48Å; V479-L483 HydrophobicContact CG1-CD1 4.13Å; V479-L483 WeakPolarHBondContact O-CG 3.33Å; V479-L483 PolarHBondContact O-N 3.33Å; V479-F626 HydrophobicContact CB-CE2 4.38Å; V479-F626 HydrophobicContact CG1-CD2 4.07Å; V479-F626 HydrophobicContact CG1-CE2 4.29Å; V479-A629 HydrophobicContact CG1-CB 3.43Å; V479-A629 VanDerWaalsContact CG1-CB 3.43Å; V479-I630 HydrophobicContact CB-CD1 4.24Å; V479-I630 HydrophobicContact CG1-CD1 4.33Å; V479-I630 HydrophobicContact CG2-CD1 4.21Å; V479-I633 HydrophobicContact CG2-CD1 3.33Å
480	F	94.7	Very high	93.2	Very high	6 Å²	6	20 Å²	20	3%	0.026	10%	0.101	C	C	.	.	H	α-helix	trans	-60.6	-51.5	178	175	-103.1	0	0	0	112.7	A476 A477 F478 T482 L483 L484 L597 S600 F602 F603 F626	A476-F480 WeakPolarHBondContact O-CB 3.5Å; A476-F480 PolarHBondContact O-N 3.42Å; A477-F480 WeakPolarHBondContact O-CB 3.19Å; A477-F480 PolarHBondContact O-N 3.37Å; F478-F480 VanDerWaalsContact C-N 3.29Å; F478-F480 PolarHBondContact O-N 3Å; F480-T482 VanDerWaalsContact C-N 3.28Å; F480-T482 PolarHBondContact O-N 3.17Å; F480-L483 PolarHBondContact O-N 2.98Å; F480-L484 HydrophobicContact CE1-CD2 4.43Å; F480-L484 WeakPolarHBondContact O-CB 3.41Å; F480-L484 PolarHBondContact O-N 3.26Å; F480-L597 HydrophobicContact CE1-CD1 4.11Å; F480-L597 HydrophobicContact CE2-CD1 3.45Å; F480-L597 VanDerWaalsContact CE2-CD1 3.45Å; F480-L597 HydrophobicContact CE2-CG 4.27Å; F480-L597 HydrophobicContact CZ-CD1 3.12Å; F480-L597 HydrophobicContact CZ-CD2 4.26Å; F480-L597 HydrophobicContact CZ-CG 3.64Å; F480-S600 WeakPolarHBondContact CE2-OG 3.38Å; F480-F602 HydrophobicContact CB-CB 4.3Å; F480-F602 HydrophobicContact CB-CD1 4.27Å; F480-F602 HydrophobicContact CB-CD2 4.18Å; F480-F602 HydrophobicContact CB-CG 3.98Å; F480-F602 AromaticContact CD1-CD1 3.59Å; F480-F602 HydrophobicContact CD1-CD1 3.59Å; F480-F602 AromaticContact CD1-CE1 3.99Å; F480-F602 HydrophobicContact CD1-CE1 3.99Å; F480-F602 HydrophobicContact CD1-CG 4.12Å; F480-F602 HydrophobicContact CD2-CB 3.57Å; F480-F602 HydrophobicContact CD2-CD1 4.14Å; F480-F602 AromaticContact CD2-CG 3.97Å; F480-F602 HydrophobicContact CD2-CG 3.97Å; F480-F602 AromaticContact CE1-CD1 3.85Å; F480-F602 HydrophobicContact CE1-CD1 3.85Å; F480-F602 HydrophobicContact CE1-CE1 4.36Å; F480-F602 HydrophobicContact CE2-CB 3.96Å; F480-F602 HydrophobicContact CE2-CD1 4.37Å; F480-F602 HydrophobicContact CE2-CG 4.49Å; F480-F602 HydrophobicContact CG-CB 3.89Å; F480-F602 AromaticContact CG-CD1 3.72Å; F480-F602 HydrophobicContact CG-CD1 3.72Å; F480-F602 HydrophobicContact CG-CD2 4.42Å; F480-F602 HydrophobicContact CG-CE1 4.39Å; F480-F602 AromaticContact CG-CG 3.74Å; F480-F602 HydrophobicContact CG-CG 3.74Å; F480-F602 HydrophobicContact CZ-CD1 4.19Å; F480-F603 HydrophobicContact CE1-CD2 4.23Å; F480-F603 AromaticContact CE1-CE2 3.38Å; F480-F603 HydrophobicContact CE1-CE2 3.38Å; F480-F603 AromaticContact CE1-CZ 3.74Å; F480-F603 HydrophobicContact CE1-CZ 3.74Å; F480-F603 HydrophobicContact CE2-CE2 4.42Å; F480-F603 AromaticContact CZ-CD2 3.8Å; F480-F603 HydrophobicContact CZ-CD2 3.8Å; F480-F603 AromaticContact CZ-CE2 3.3Å; F480-F603 HydrophobicContact CZ-CE2 3.3Å; F480-F603 HydrophobicContact CZ-CZ 4.14Å; F480-F626 HydrophobicContact CB-CD2 4.02Å; F480-F626 HydrophobicContact CB-CE2 3.85Å; F480-F626 HydrophobicContact CD2-CD2 4.44Å
481	F	94.9	Very high	93.6	Very high	78 Å²	78	17.7 Å²	17.7	34%	0.342	9%	0.091	S	C	.	.	H	α-helix	trans	-64.9	-32.1	179.2	-74.2	-59.1	0	0	0	112.7	I458 Y462 A477 F478 L484 F485	I458-F481 HydrophobicContact CD1-CB 4.46Å; Y462-F481 HydrophobicContact CE2-CD2 4.38Å; Y462-F481 WeakPolarHBondContact OH-CD2 3.37Å; Y462-F481 WeakPolarHBondContact OH-CE2 3.27Å; A477-F481 HydrophobicContact CB-CD2 4.37Å; A477-F481 HydrophobicContact CB-CE2 4.25Å; A477-F481 WeakPolarHBondContact O-CD2 3.08Å; A477-F481 PolarHBondContact O-N 2.95Å; F478-F481 PolarHBondContact O-N 3.49Å; F481-L484 HydrophobicContact CD1-CD2 4.12Å; F481-L484 HydrophobicContact CE1-CD2 4.5Å; F481-L484 PolarHBondContact O-N 3.41Å; F481-F485 WeakPolarHBondContact O-CB 3.25Å; F481-F485 PolarHBondContact O-N 3.14Å
482	T	95.4	Very high	93.8	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-61.2	-51.5	172	-75.7	0	0	0	0	111.8	F478 V479 F480 L484 F485 L486 Y538 F558	F478-T482 WeakPolarHBondContact CE2-OG1 3.46Å; F478-T482 WeakPolarHBondContact O-CB 3.45Å; F478-T482 PolarHBondContact O-N 3.47Å; F478-T482 PolarHBondContact O-OG1 2.84Å; F478-T482 VanDerWaalsContact O-OG1 3.11Å; V479-T482 WeakPolarHBondContact O-CB 3.35Å; V479-T482 PolarHBondContact O-N 3.48Å; F480-T482 VanDerWaalsContact C-N 3.28Å; F480-T482 PolarHBondContact O-N 3.17Å; T482-L484 VanDerWaalsContact C-N 3.3Å; T482-L484 PolarHBondContact O-N 3.48Å; T482-F485 PolarHBondContact O-N 3.03Å; T482-L486 HydrophobicContact CG2-CD1 4.28Å; T482-L486 WeakPolarHBondContact O-CG 3.5Å; T482-L486 PolarHBondContact O-N 3.38Å; T482-L486 VanDerWaalsContact O-N 3.11Å; T482-Y538 WeakPolarHBondContact CA-OH 3.19Å; T482-Y538 HydrophobicContact CG2-CD1 4.45Å; T482-Y538 HydrophobicContact CG2-CE1 3.57Å; T482-Y538 PolarHBondContact OG1-OH 3.47Å; T482-Y538 VanDerWaalsContact OG1-OH 3.12Å; T482-F558 HydrophobicContact CG2-CE1 4.5Å; T482-F558 HydrophobicContact CG2-CZ 3.92Å
483	L	95.2	Very high	94	Very high	5 Å²	5	19.9 Å²	19.9	3%	0.026	10%	0.104	C	C	.	.	H	α-helix	trans	-65.2	-36.5	178.5	-64.9	172	0	0	0	111.8	V479 F480 L486 M487 T565 S625 F626 A629	V479-L483 HydrophobicContact CG1-CD1 4.13Å; V479-L483 WeakPolarHBondContact O-CG 3.33Å; V479-L483 PolarHBondContact O-N 3.33Å; F480-L483 PolarHBondContact O-N 2.98Å; L483-L486 PolarHBondContact O-N 3.46Å; L483-M487 WeakPolarHBondContact O-CB 3.39Å; L483-M487 PolarHBondContact O-N 3.49Å; L483-T565 HydrophobicContact CB-CG2 4.47Å; L483-T565 HydrophobicContact CD2-CG2 4.34Å; L483-S625 VanDerWaalsContact CD1-C 3.48Å; L483-S625 WeakPolarHBondContact CD1-O 3.35Å; L483-F626 HydrophobicContact CD1-CB 4.12Å; L483-A629 HydrophobicContact CD1-CB 4.28Å
484	L	94.3	Very high	94.2	Very high	29 Å²	29	16.3 Å²	16.3	15%	0.152	9%	0.086	C	C	.	.	H	α-helix	trans	-61.4	-49.7	176.4	179.4	57.2	0	0	0	112.3	F480 F481 T482 M487 F488 L597	F480-L484 HydrophobicContact CE1-CD2 4.43Å; F480-L484 WeakPolarHBondContact O-CB 3.41Å; F480-L484 PolarHBondContact O-N 3.26Å; F481-L484 HydrophobicContact CD1-CD2 4.12Å; F481-L484 HydrophobicContact CE1-CD2 4.5Å; F481-L484 PolarHBondContact O-N 3.41Å; T482-L484 VanDerWaalsContact C-N 3.3Å; T482-L484 PolarHBondContact O-N 3.48Å; L484-M487 HydrophobicContact CD1-CE 3.88Å; L484-M487 PolarHBondContact O-N 2.94Å; L484-F488 HydrophobicContact CD1-CD2 3.53Å; L484-F488 HydrophobicContact CD1-CE2 3.44Å; L484-F488 VanDerWaalsContact CD1-CE2 3.44Å; L484-F488 HydrophobicContact CG-CD2 4.16Å; L484-F488 HydrophobicContact CG-CE2 4.38Å; L484-F488 PolarHBondContact O-N 3.46Å; L484-L597 HydrophobicContact CB-CD1 4.45Å; L484-L597 HydrophobicContact CD1-CD1 3.35Å; L484-L597 HydrophobicContact CD1-CD2 3.92Å; L484-L597 HydrophobicContact CD1-CG 4.21Å; L484-L597 HydrophobicContact CD2-CD1 4.2Å; L484-L597 HydrophobicContact CD2-CD2 4.08Å; L484-L597 HydrophobicContact CG-CD1 4.2Å
485	F	95.6	Very high	94.3	Very high	36 Å²	36	14.8 Å²	14.8	16%	0.158	8%	0.075	C	C	.	.	H	α-helix	trans	-59.9	-48.8	177.9	172.2	-105.1	0	0	0	110.7	H451 V454 F481 T482 M487 F488 A489 Y538	H451-F485 HydrophobicContact CB-CE1 4.34Å; H451-F485 HydrophobicContact CB-CZ 4.47Å; H451-F485 AromaticContact CD2-CE1 3.63Å; H451-F485 AromaticContact CG-CE1 3.84Å; H451-F485 AromaticContact CG-CZ 3.99Å; V454-F485 HydrophobicContact CB-CD2 4.21Å; V454-F485 HydrophobicContact CB-CE1 4.47Å; V454-F485 HydrophobicContact CB-CE2 3.84Å; V454-F485 HydrophobicContact CB-CZ 3.99Å; V454-F485 HydrophobicContact CG1-CD1 4.37Å; V454-F485 HydrophobicContact CG1-CD2 3.69Å; V454-F485 HydrophobicContact CG1-CE2 3.86Å; V454-F485 HydrophobicContact CG1-CG 3.96Å; V454-F485 HydrophobicContact CG1-CZ 4.28Å; V454-F485 HydrophobicContact CG2-CD2 4.35Å; V454-F485 HydrophobicContact CG2-CE2 3.81Å; V454-F485 HydrophobicContact CG2-CZ 4.27Å; F481-F485 WeakPolarHBondContact O-CB 3.25Å; F481-F485 PolarHBondContact O-N 3.14Å; T482-F485 PolarHBondContact O-N 3.03Å; F485-M487 VanDerWaalsContact C-N 3.26Å; F485-M487 PolarHBondContact O-N 3.29Å; F485-F488 PolarHBondContact O-N 3.13Å; F485-A489 HydrophobicContact CE1-CB 4.38Å; F485-A489 HydrophobicContact CE2-CB 4.26Å; F485-A489 HydrophobicContact CZ-CB 4.13Å; F485-A489 WeakPolarHBondContact O-CB 3.36Å; F485-A489 PolarHBondContact O-N 3.32Å; F485-Y538 AromaticContact CD1-CD2 3.56Å; F485-Y538 HydrophobicContact CD1-CD2 3.56Å; F485-Y538 HydrophobicContact CD1-CE1 4.39Å; F485-Y538 AromaticContact CD1-CE2 3.33Å; F485-Y538 HydrophobicContact CD1-CE2 3.33Å; F485-Y538 HydrophobicContact CD1-CG 4.17Å; F485-Y538 AromaticContact CD1-CZ 3.81Å; F485-Y538 AromaticContact CE1-CD2 3.41Å; F485-Y538 HydrophobicContact CE1-CD2 3.41Å; F485-Y538 VanDerWaalsContact CE1-CD2 3.41Å; F485-Y538 AromaticContact CE1-CE2 3.64Å; F485-Y538 HydrophobicContact CE1-CE2 3.64Å; F485-Y538 HydrophobicContact CE1-CG 4.1Å; F485-Y538 HydrophobicContact CG-CE2 4.17Å; F485-Y538 HydrophobicContact CZ-CD2 4.5Å
486	L	95.9	Very high	94.1	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-62.8	-30.1	-179.9	-68.9	177.2	0	0	0	113.6	T482 L483 S490 P535 Y538 S566	T482-L486 HydrophobicContact CG2-CD1 4.28Å; T482-L486 WeakPolarHBondContact O-CG 3.5Å; T482-L486 PolarHBondContact O-N 3.38Å; T482-L486 VanDerWaalsContact O-N 3.11Å; L483-L486 PolarHBondContact O-N 3.46Å; L486-S490 PolarHBondContact O-OG 2.87Å; L486-P535 HydrophobicContact CD1-CB 4.38Å; L486-P535 HydrophobicContact CD2-CB 3.86Å; L486-P535 HydrophobicContact CD2-CG 4.07Å; L486-Y538 HydrophobicContact CD1-CD1 4.3Å; L486-Y538 HydrophobicContact CD2-CD1 3.86Å; L486-Y538 HydrophobicContact CD2-CG 4.13Å; L486-Y538 HydrophobicContact CG-CD1 4.12Å; L486-Y538 HydrophobicContact CG-CE1 4.38Å; L486-S566 PolarHBondContact O-OG 3.09Å
487	M	94.9	Very high	93.9	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-69.6	-52.5	172.9	-179.5	-167	75	0	0	111.3	L483 L484 F485 S490 L491 T565 I596 F621 T622	L483-M487 WeakPolarHBondContact O-CB 3.39Å; L483-M487 PolarHBondContact O-N 3.49Å; L484-M487 HydrophobicContact CD1-CE 3.88Å; L484-M487 PolarHBondContact O-N 2.94Å; F485-M487 VanDerWaalsContact C-N 3.26Å; F485-M487 PolarHBondContact O-N 3.29Å; M487-S490 PolarHBondContact O-N 3.31Å; M487-S490 PolarHBondContact O-OG 2.94Å; M487-S490 VanDerWaalsContact O-OG 3.07Å; M487-L491 WeakPolarHBondContact O-CB 3.47Å; M487-L491 PolarHBondContact O-N 3.26Å; M487-T565 HydrophobicContact CB-CG2 4.48Å; M487-I596 HydrophobicContact SD-CG2 4.45Å; M487-F621 HydrophobicContact CG-CE2 4.24Å; M487-F621 HydrophobicContact CG-CZ 3.88Å; M487-F621 HydrophobicContact SD-CE2 4.25Å; M487-F621 HydrophobicContact SD-CZ 3.71Å; M487-T622 HydrophobicContact SD-CG2 3.67Å
488	F	94.7	Very high	93.8	Very high	52 Å²	52	20.9 Å²	20.9	23%	0.228	11%	0.105	C	C	.	.	H	α-helix	trans	-70.5	-34.2	-177.1	-84.3	-58.7	0	0	0	113	L484 F485 S490 L491 M492	L484-F488 HydrophobicContact CD1-CD2 3.53Å; L484-F488 HydrophobicContact CD1-CE2 3.44Å; L484-F488 VanDerWaalsContact CD1-CE2 3.44Å; L484-F488 HydrophobicContact CG-CD2 4.16Å; L484-F488 HydrophobicContact CG-CE2 4.38Å; L484-F488 PolarHBondContact O-N 3.46Å; F485-F488 PolarHBondContact O-N 3.13Å; F488-S490 PolarHBondContact O-N 3.41Å; F488-L491 HydrophobicContact CD1-CD2 4.03Å; F488-L491 HydrophobicContact CE1-CD2 4.06Å; F488-L491 PolarHBondContact O-N 3.33Å; F488-M492 HydrophobicContact CD1-CE 3.41Å; F488-M492 VanDerWaalsContact CD1-CE 3.41Å; F488-M492 HydrophobicContact CD1-CG 4.34Å; F488-M492 HydrophobicContact CE1-CE 3.49Å; F488-M492 VanDerWaalsContact CE1-CE 3.49Å; F488-M492 PolarHBondContact O-N 3.01Å
489	A	94.2	Very high	93.5	Very high	18 Å²	18	21.7 Å²	21.7	15%	0.149	11%	0.111	C	C	.	.	H	α-helix	trans	-65.4	-24.2	177.4	0	0	0	0	0	113	F485 P493	F485-A489 HydrophobicContact CE1-CB 4.38Å; F485-A489 HydrophobicContact CE2-CB 4.26Å; F485-A489 HydrophobicContact CZ-CB 4.13Å; F485-A489 WeakPolarHBondContact O-CB 3.36Å; F485-A489 PolarHBondContact O-N 3.32Å; A489-P493 VanDerWaalsContact O-CD 3.32Å; A489-P493 WeakPolarHBondContact O-CD 3.16Å; A489-P493 WeakPolarHBondContact O-CG 3.46Å
490	S	94.4	Very high	93.1	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-94.3	-37	172.3	70.7	0	0	0	0	113.2	L486 M487 F488 T494 S566 Q570	L486-S490 PolarHBondContact O-OG 2.87Å; M487-S490 PolarHBondContact O-N 3.31Å; M487-S490 PolarHBondContact O-OG 2.94Å; M487-S490 VanDerWaalsContact O-OG 3.07Å; F488-S490 PolarHBondContact O-N 3.41Å; S490-T494 PolarHBondContact O-OG1 3Å; S490-S566 VanDerWaalsContact CB-O 3.25Å; S490-S566 WeakPolarHBondContact CB-O 2.96Å; S490-S566 WeakPolarHBondContact CB-OG 3.25Å; S490-S566 PolarHBondContact OG-O 2.96Å; S490-Q570 PolarHBondContact OG-N 3.24Å
491	L	94.2	Very high	92.8	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-64.5	-55.9	-178.9	178.1	66.3	0	0	0	112.4	M487 F488 T494 V495 G569 L572 G573 I576	M487-L491 WeakPolarHBondContact O-CB 3.47Å; M487-L491 PolarHBondContact O-N 3.26Å; F488-L491 HydrophobicContact CD1-CD2 4.03Å; F488-L491 HydrophobicContact CE1-CD2 4.06Å; F488-L491 PolarHBondContact O-N 3.33Å; L491-T494 PolarHBondContact O-N 3.43Å; L491-V495 HydrophobicContact CD1-CG2 4.07Å; L491-V495 HydrophobicContact CG-CG2 4.33Å; L491-V495 VanDerWaalsContact O-CG2 3.31Å; L491-V495 WeakPolarHBondContact O-CG2 3.46Å; L491-V495 PolarHBondContact O-N 3.13Å; L491-G569 WeakPolarHBondContact CD1-O 3.43Å; L491-L572 HydrophobicContact CD1-CB 4.06Å; L491-L572 HydrophobicContact CD1-CD2 4.2Å; L491-L572 HydrophobicContact CD1-CG 4Å; L491-G573 VanDerWaalsContact CD1-CA 3.45Å; L491-G573 VanDerWaalsContact CD1-N 3.28Å; L491-I576 HydrophobicContact CD1-CD1 4.39Å
492	M	92.9	Very high	92.5	Very high	52 Å²	52	24.9 Å²	24.9	26%	0.256	13%	0.13	S	C	.	.	H	α-helix	trans	-64.2	-46.1	-168.5	-68.6	-63.5	163.5	0	0	113.8	F488 T494 V495 M496 P590	F488-M492 HydrophobicContact CD1-CE 3.41Å; F488-M492 VanDerWaalsContact CD1-CE 3.41Å; F488-M492 HydrophobicContact CD1-CG 4.34Å; F488-M492 HydrophobicContact CE1-CE 3.49Å; F488-M492 VanDerWaalsContact CE1-CE 3.49Å; F488-M492 PolarHBondContact O-N 3.01Å; M492-T494 VanDerWaalsContact C-N 3.28Å; M492-T494 PolarHBondContact O-N 2.54Å; M492-V495 PolarHBondContact O-N 3.24Å; M492-M496 PolarHBondContact O-N 3.28Å; M492-P590 HydrophobicContact CE-CB 4.34Å; M492-P590 HydrophobicContact CE-CG 3.62Å
493	P	92.3	Very high	92.1	Very high	20 Å²	20	26.5 Å²	26.5	13%	0.13	14%	0.141	C	C	.	.	H	α-helix	trans	-62.6	-36.9	179.6	-25.1	37.4	0	0	0	112.7	L443 R447 A489 M496 T497	L443-P493 HydrophobicContact CD1-CB 4.48Å; R447-P493 VanDerWaalsContact CZ-CB 3.4Å; A489-P493 VanDerWaalsContact O-CD 3.32Å; A489-P493 WeakPolarHBondContact O-CD 3.16Å; A489-P493 WeakPolarHBondContact O-CG 3.46Å; P493-M496 PolarHBondContact O-N 2.72Å; P493-T497 WeakPolarHBondContact O-CG2 3.47Å; P493-T497 PolarHBondContact O-N 2.92Å; P493-T497 PolarHBondContact O-OG1 3.32Å; P493-T497 VanDerWaalsContact O-OG1 3.07Å
494	T	92.8	Very high	91.9	Very high	4 Å²	4	27.1 Å²	27.1	3%	0.025	14%	0.144	C	C	.	.	H	α-helix	trans	-69.8	-37.6	178.5	-62.4	0	0	0	0	112.6	S490 L491 M492 M496 F498 Q570 L574	S490-T494 PolarHBondContact O-OG1 3Å; L491-T494 PolarHBondContact O-N 3.43Å; M492-T494 VanDerWaalsContact C-N 3.28Å; M492-T494 PolarHBondContact O-N 2.54Å; T494-M496 PolarHBondContact O-N 3.12Å; T494-F498 VanDerWaalsContact O-CB 3.26Å; T494-F498 WeakPolarHBondContact O-CB 3.21Å; T494-F498 PolarHBondContact O-N 3.28Å; T494-F498 VanDerWaalsContact O-N 3.15Å; T494-Q570 HydrophobicContact CG2-CG 4.37Å; T494-Q570 WeakPolarHBondContact OG1-CG 3.34Å; T494-L574 HydrophobicContact CG2-CB 4.37Å; T494-L574 HydrophobicContact CG2-CD2 3.47Å; T494-L574 VanDerWaalsContact CG2-CD2 3.47Å; T494-L574 HydrophobicContact CG2-CG 3.59Å
495	V	93.1	Very high	91.7	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.006	14%	0.137	C	C	.	.	H	α-helix	trans	-58.3	-33.5	173.8	165.4	0	0	0	0	111.7	L491 M492 P499 I576 A585	L491-V495 HydrophobicContact CD1-CG2 4.07Å; L491-V495 HydrophobicContact CG-CG2 4.33Å; L491-V495 VanDerWaalsContact O-CG2 3.31Å; L491-V495 WeakPolarHBondContact O-CG2 3.46Å; L491-V495 PolarHBondContact O-N 3.13Å; M492-V495 PolarHBondContact O-N 3.24Å; V495-P499 WeakPolarHBondContact O-CD 3.28Å; V495-P499 VanDerWaalsContact O-CG 3.23Å; V495-P499 WeakPolarHBondContact O-CG 3.32Å; V495-I576 HydrophobicContact CG1-CG2 4.26Å; V495-I576 HydrophobicContact CG2-CB 4.22Å; V495-I576 HydrophobicContact CG2-CG2 4.06Å; V495-A585 HydrophobicContact CG1-CB 3.69Å; V495-A585 WeakPolarHBondContact CG1-O 3.45Å
496	M	89.5	Confident	91.3	Very high	102 Å²	102	24.4 Å²	24.4	50%	0.502	13%	0.131	S	C	.	.	H	α-helix	trans	-86.2	-45.1	-179.3	-65.5	-174.6	75	0	0	113.6	M492 P493 T494 L582 V586	M492-M496 PolarHBondContact O-N 3.28Å; P493-M496 PolarHBondContact O-N 2.72Å; T494-M496 PolarHBondContact O-N 3.12Å; M496-L582 HydrophobicContact CB-CD1 4.34Å; M496-L582 WeakPolarHBondContact O-CD1 3.26Å; M496-V586 HydrophobicContact CG-CG2 3.98Å
497	T	89.3	Confident	90.9	Very high	34 Å²	34	25 Å²	25	21%	0.209	13%	0.134	C	C	.	.	H	α-helix	trans	-77.5	-37.2	-172.8	56.8	0	0	0	0	112.8	L443 P493 L500 E501	L443-T497 HydrophobicContact CD2-CG2 3.68Å; P493-T497 WeakPolarHBondContact O-CG2 3.47Å; P493-T497 PolarHBondContact O-N 2.92Å; P493-T497 PolarHBondContact O-OG1 3.32Å; P493-T497 VanDerWaalsContact O-OG1 3.07Å; T497-L500 WeakPolarHBondContact O-CB 3.46Å; T497-L500 PolarHBondContact O-N 3.14Å; T497-L500 VanDerWaalsContact O-N 3.15Å; T497-E501 PolarHBondContact O-N 3.27Å; T497-E501 VanDerWaalsContact O-N 3.12Å
498	F	90.8	Very high	90.7	Very high	1 Å²	1	25.2 Å²	25.2	0%	0.004	13%	0.134	C	C	.	.	H	α-helix	trans	-65.3	-42.6	-172.9	-168.3	-86.7	0	0	0	113.9	T494 L500 E501 I502 K523 L574 T578 L695	T494-F498 VanDerWaalsContact O-CB 3.26Å; T494-F498 WeakPolarHBondContact O-CB 3.21Å; T494-F498 PolarHBondContact O-N 3.28Å; T494-F498 VanDerWaalsContact O-N 3.15Å; F498-L500 PolarHBondContact O-N 3.05Å; F498-E501 PolarHBondContact O-N 2.8Å; F498-I502 HydrophobicContact CE1-CB 4.47Å; F498-I502 HydrophobicContact CE1-CD1 4.25Å; F498-I502 HydrophobicContact CE1-CG1 4.33Å; F498-I502 PolarHBondContact O-N 3.16Å; F498-K523 HydrophobicContact CE2-CG 4.34Å; F498-L574 HydrophobicContact CB-CD2 4.18Å; F498-L574 HydrophobicContact CD2-CD2 3.28Å; F498-L574 HydrophobicContact CE2-CD2 3.78Å; F498-L574 HydrophobicContact CG-CD2 3.75Å; F498-T578 HydrophobicContact CD1-CG2 3.81Å; F498-T578 HydrophobicContact CE1-CG2 3.07Å; F498-T578 HydrophobicContact CZ-CG2 3.55Å; F498-L695 HydrophobicContact CZ-CD2 4.42Å
499	P	89.3	Confident	90.3	Very high	17 Å²	17	23.2 Å²	23.2	11%	0.11	13%	0.126	C	C	.	.	H	α-helix	trans	-60.4	-24.9	173.5	-24.7	33.7	0	0	0	114.9	V495 I502 L582 A585	V495-P499 WeakPolarHBondContact O-CD 3.28Å; V495-P499 VanDerWaalsContact O-CG 3.23Å; V495-P499 WeakPolarHBondContact O-CG 3.32Å; P499-I502 WeakPolarHBondContact O-CG2 3.07Å; P499-L582 HydrophobicContact CB-CB 4.23Å; P499-L582 HydrophobicContact CG-CD1 4.48Å; P499-A585 HydrophobicContact CG-CB 4.4Å
500	L	86.2	Confident	89.8	Confident	104 Å²	104	23.3 Å²	23.3	55%	0.545	12%	0.124	S	C	.	.	H	α-helix	trans	-79.9	-40	176.1	-65.3	173.9	0	0	0	111.1	T497 F498 I502 S503 L582	T497-L500 WeakPolarHBondContact O-CB 3.46Å; T497-L500 PolarHBondContact O-N 3.14Å; T497-L500 VanDerWaalsContact O-N 3.15Å; F498-L500 PolarHBondContact O-N 3.05Å; L500-I502 VanDerWaalsContact C-N 3.31Å; L500-I502 PolarHBondContact O-N 3.23Å; L500-S503 PolarHBondContact O-OG 3.3Å; L500-L582 HydrophobicContact CD2-CD2 4.04Å; L500-L582 HydrophobicContact CG-CD2 4.35Å
501	E	89.1	Confident	89.4	Confident	43 Å²	43	23.6 Å²	23.6	20%	0.201	13%	0.125	C	C	.	.	H	α-helix	trans	-68.9	-29	177.2	-68.6	178.1	-162.7	0	0	112.9	T497 F498 S503 I504 F505 K523	T497-E501 PolarHBondContact O-N 3.27Å; T497-E501 VanDerWaalsContact O-N 3.12Å; F498-E501 PolarHBondContact O-N 2.8Å; E501-S503 VanDerWaalsContact C-N 3.26Å; E501-S503 PolarHBondContact O-N 3.04Å; E501-I504 WeakPolarHBondContact O-CB 3.41Å; E501-I504 PolarHBondContact O-N 3.37Å; E501-F505 PolarHBondContact O-N 2.9Å; E501-K523 IonicContact OE1-NZ 3Å; E501-K523 PolarHBondContact OE1-NZ 2.97Å; E501-K523 WeakPolarHBondContact OE2-CD 3.49Å; E501-K523 WeakPolarHBondContact OE2-CE 3.45Å; E501-K523 IonicContact OE2-NZ 2.94Å; E501-K523 PolarHBondContact OE2-NZ 3.16Å
502	I	89.4	Confident	89	Confident	4 Å²	4	25.1 Å²	25.1	2%	0.021	14%	0.136	C	C	.	.	H	α-helix	trans	-62.1	-32.8	-175.8	-151.9	-178.1	0	0	0	112.4	F498 P499 L500 F505 F506 L695	F498-I502 HydrophobicContact CE1-CB 4.47Å; F498-I502 HydrophobicContact CE1-CD1 4.25Å; F498-I502 HydrophobicContact CE1-CG1 4.33Å; F498-I502 PolarHBondContact O-N 3.16Å; P499-I502 WeakPolarHBondContact O-CG2 3.07Å; L500-I502 VanDerWaalsContact C-N 3.31Å; L500-I502 PolarHBondContact O-N 3.23Å; I502-F505 WeakPolarHBondContact O-CB 3.36Å; I502-F505 PolarHBondContact O-N 3.46Å; I502-F506 HydrophobicContact CB-CE2 4.38Å; I502-F506 HydrophobicContact CD1-CE2 3.67Å; I502-F506 HydrophobicContact CD1-CZ 4.04Å; I502-F506 HydrophobicContact CG1-CD2 4.05Å; I502-F506 HydrophobicContact CG1-CE2 3.54Å; I502-F506 HydrophobicContact CG1-CZ 4.16Å; I502-F506 HydrophobicContact CG2-CD2 4.44Å; I502-F506 HydrophobicContact CG2-CE2 4.18Å; I502-F506 WeakPolarHBondContact O-CD2 3.19Å; I502-F506 WeakPolarHBondContact O-CG 3.32Å; I502-F506 PolarHBondContact O-N 2.78Å; I502-L695 HydrophobicContact CD1-CD1 3.59Å; I502-L695 HydrophobicContact CG1-CD1 3.81Å
503	S	85.7	Confident	88.9	Confident	35 Å²	35	22.7 Å²	22.7	25%	0.245	12%	0.124	C	C	.	.	H	α-helix	trans	-68.3	-44	179.3	58.3	0	0	0	0	111	L500 E501 F505 F506 R507	L500-S503 PolarHBondContact O-OG 3.3Å; E501-S503 VanDerWaalsContact C-N 3.26Å; E501-S503 PolarHBondContact O-N 3.04Å; S503-F505 VanDerWaalsContact C-N 3.32Å; S503-F505 PolarHBondContact O-N 2.63Å; S503-F506 PolarHBondContact O-N 3.5Å; S503-R507 PolarHBondContact O-N 3.44Å; S503-R507 VanDerWaalsContact O-N 3.16Å
504	I	90.6	Very high	88.9	Confident	17 Å²	17	21.8 Å²	21.8	9%	0.087	12%	0.118	C	C	.	.	H	α-helix	trans	-57.9	-48.3	173.1	-55.5	176.6	0	0	0	109.6	L121 L123 E501 F506 R507 E508	L121-I504 HydrophobicContact CB-CG1 4.09Å; L123-I504 HydrophobicContact CD2-CD1 3.77Å; L123-I504 HydrophobicContact CD2-CG2 4.45Å; L123-I504 HydrophobicContact CG-CD1 4.34Å; L123-I504 HydrophobicContact CG-CG2 4.39Å; E501-I504 WeakPolarHBondContact O-CB 3.41Å; E501-I504 PolarHBondContact O-N 3.37Å; I504-F506 PolarHBondContact O-N 3.07Å; I504-R507 PolarHBondContact O-N 3.24Å; I504-E508 HydrophobicContact CG2-CG 4.45Å; I504-E508 WeakPolarHBondContact CG2-OE1 3.38Å; I504-E508 WeakPolarHBondContact O-CG 3.44Å; I504-E508 PolarHBondContact O-N 2.56Å
505	F	91.5	Very high	88.8	Confident	1 Å²	1	22.1 Å²	22.1	0%	0.004	12%	0.121	C	C	.	.	H	α-helix	trans	-57	-47.4	176.7	164.6	-98.6	0	0	0	112.2	E501 I502 S503 R507 E508 H509 Y514 L516 Y519 L695 I699	E501-F505 PolarHBondContact O-N 2.9Å; I502-F505 WeakPolarHBondContact O-CB 3.36Å; I502-F505 PolarHBondContact O-N 3.46Å; S503-F505 VanDerWaalsContact C-N 3.32Å; S503-F505 PolarHBondContact O-N 2.63Å; F505-R507 VanDerWaalsContact C-N 3.35Å; F505-R507 PolarHBondContact O-N 3.32Å; F505-E508 PolarHBondContact O-N 3.26Å; F505-H509 HydrophobicContact CD2-CB 4.47Å; F505-H509 HydrophobicContact CE1-CB 4.38Å; F505-H509 HydrophobicContact CE2-CB 3.96Å; F505-H509 HydrophobicContact CZ-CB 3.89Å; F505-H509 AromaticContact CZ-CG 3.93Å; F505-H509 WeakPolarHBondContact O-CB 3.33Å; F505-H509 PolarHBondContact O-N 2.94Å; F505-Y514 AromaticContact CD2-CE2 3.64Å; F505-Y514 HydrophobicContact CD2-CE2 3.64Å; F505-Y514 HydrophobicContact CE2-CD2 4.45Å; F505-Y514 AromaticContact CE2-CE2 3.75Å; F505-Y514 HydrophobicContact CE2-CE2 3.75Å; F505-L516 HydrophobicContact CE1-CD1 4.2Å; F505-L516 HydrophobicContact CE2-CD1 4.32Å; F505-L516 HydrophobicContact CZ-CB 4.31Å; F505-L516 HydrophobicContact CZ-CD1 3.6Å; F505-Y519 HydrophobicContact CB-CE1 4.17Å; F505-Y519 HydrophobicContact CB-CE2 4.06Å; F505-Y519 HydrophobicContact CD1-CE1 4.49Å; F505-Y519 AromaticContact CD2-CD1 3.32Å; F505-Y519 HydrophobicContact CD2-CD1 3.32Å; F505-Y519 AromaticContact CD2-CD2 3.61Å; F505-Y519 HydrophobicContact CD2-CD2 3.61Å; F505-Y519 AromaticContact CD2-CE1 3.68Å; F505-Y519 HydrophobicContact CD2-CE1 3.68Å; F505-Y519 AromaticContact CD2-CE2 3.95Å; F505-Y519 HydrophobicContact CD2-CE2 3.95Å; F505-Y519 AromaticContact CD2-CG 3.29Å; F505-Y519 HydrophobicContact CD2-CG 3.29Å; F505-Y519 AromaticContact CD2-CZ 3.99Å; F505-Y519 AromaticContact CE2-CD1 3.54Å; F505-Y519 HydrophobicContact CE2-CD1 3.54Å; F505-Y519 HydrophobicContact CE2-CD2 4.32Å; F505-Y519 HydrophobicContact CE2-CE1 4.27Å; F505-Y519 AromaticContact CE2-CG 3.57Å; F505-Y519 HydrophobicContact CE2-CG 3.57Å; F505-Y519 AromaticContact CG-CD1 3.94Å; F505-Y519 HydrophobicContact CG-CD1 3.94Å; F505-Y519 HydrophobicContact CG-CD2 4.41Å; F505-Y519 AromaticContact CG-CE1 3.83Å; F505-Y519 HydrophobicContact CG-CE1 3.83Å; F505-Y519 HydrophobicContact CG-CE2 4.31Å; F505-Y519 HydrophobicContact CG-CG 4.24Å; F505-Y519 HydrophobicContact CZ-CD1 4.31Å; F505-L695 HydrophobicContact CD1-CD1 4.47Å; F505-L695 HydrophobicContact CE1-CD1 4.32Å; F505-I699 HydrophobicContact CE1-CD1 3.61Å; F505-I699 HydrophobicContact CE1-CG1 4.01Å; F505-I699 HydrophobicContact CZ-CD1 3.85Å
506	F	86.8	Confident	88.7	Confident	8 Å²	8	22.9 Å²	22.9	4%	0.035	13%	0.125	C	C	.	.	H	α-helix	trans	-59.2	-46.1	-179.5	-80.3	-61.6	0	0	0	111.8	I502 S503 I504 L510 R698 I699 R702	I502-F506 HydrophobicContact CB-CE2 4.38Å; I502-F506 HydrophobicContact CD1-CE2 3.67Å; I502-F506 HydrophobicContact CD1-CZ 4.04Å; I502-F506 HydrophobicContact CG1-CD2 4.05Å; I502-F506 HydrophobicContact CG1-CE2 3.54Å; I502-F506 HydrophobicContact CG1-CZ 4.16Å; I502-F506 HydrophobicContact CG2-CD2 4.44Å; I502-F506 HydrophobicContact CG2-CE2 4.18Å; I502-F506 WeakPolarHBondContact O-CD2 3.19Å; I502-F506 WeakPolarHBondContact O-CG 3.32Å; I502-F506 PolarHBondContact O-N 2.78Å; S503-F506 PolarHBondContact O-N 3.5Å; I504-F506 PolarHBondContact O-N 3.07Å; F506-L510 VanDerWaalsContact O-CB 3.31Å; F506-L510 WeakPolarHBondContact O-CB 3.18Å; F506-L510 WeakPolarHBondContact O-CG 3.34Å; F506-L510 PolarHBondContact O-N 3.38Å; F506-R698 HydrophobicContact CZ-CB 4.34Å; F506-R698 HydrophobicContact CZ-CG 3.94Å; F506-I699 HydrophobicContact CD1-CG1 4.01Å; F506-I699 HydrophobicContact CE1-CB 4.08Å; F506-I699 HydrophobicContact CE1-CG1 3.34Å; F506-I699 HydrophobicContact CZ-CG1 4.25Å; F506-R702 VanDerWaalsContact CE2-NH1 3.28Å
507	R	86.9	Confident	88.9	Confident	13 Å²	13	24 Å²	24	5%	0.049	13%	0.127	C	C	.	.	H	α-helix	trans	-59	-54.6	176.8	-179.5	-157.9	64.1	-168.1	-8.5	111.1	M117 L121 S503 I504 F505 H509 L510 N511	M117-R507 HydrophobicContact SD-CB 4.26Å; M117-R507 HydrophobicContact SD-CG 4.48Å; L121-R507 HydrophobicContact CD1-CB 4.46Å; L121-R507 PolarHBondContact O-NH1 3.13Å; L121-R507 PolarHBondContact O-NH2 3.49Å; S503-R507 PolarHBondContact O-N 3.44Å; S503-R507 VanDerWaalsContact O-N 3.16Å; I504-R507 PolarHBondContact O-N 3.24Å; F505-R507 VanDerWaalsContact C-N 3.35Å; F505-R507 PolarHBondContact O-N 3.32Å; R507-H509 VanDerWaalsContact C-N 3.32Å; R507-H509 PolarHBondContact O-N 3.07Å; R507-L510 PolarHBondContact O-N 2.9Å; R507-N511 WeakPolarHBondContact O-CB 3.46Å; R507-N511 PolarHBondContact O-N 3.49Å
508	E	90.5	Very high	89.1	Confident	3 Å²	3	22.6 Å²	22.6	1%	0.014	12%	0.118	C	C	.	.	H	α-helix	trans	-61.6	-40.6	-177.4	-69.7	177.4	179.8	0	0	111.8	R432 I504 F505 N511 S512 W513 Y514	R432-E508 IonicContact CZ-OE2 3.83Å; R432-E508 IonicContact NH1-OE1 3.22Å; R432-E508 PolarHBondContact NH1-OE1 3.33Å; R432-E508 IonicContact NH1-OE2 2.63Å; R432-E508 PolarHBondContact NH1-OE2 3.33Å; R432-E508 IonicContact NH2-OE2 2.66Å; R432-E508 PolarHBondContact NH2-OE2 2.93Å; I504-E508 HydrophobicContact CG2-CG 4.45Å; I504-E508 WeakPolarHBondContact CG2-OE1 3.38Å; I504-E508 WeakPolarHBondContact O-CG 3.44Å; I504-E508 PolarHBondContact O-N 2.56Å; F505-E508 PolarHBondContact O-N 3.26Å; E508-N511 CarbonylContact O-C 3.55Å; E508-S512 PolarHBondContact O-N 2.94Å; E508-W513 HydrophobicContact CB-CB 4.11Å; E508-W513 HydrophobicContact CB-CD2 4.02Å; E508-W513 HydrophobicContact CB-CE3 4.33Å; E508-W513 HydrophobicContact CB-CG 3.93Å; E508-W513 HydrophobicContact CG-CD2 3.88Å; E508-W513 HydrophobicContact CG-CE3 3.94Å; E508-W513 HydrophobicContact CG-CG 4.32Å; E508-W513 HydrophobicContact CG-CH2 4.48Å; E508-W513 HydrophobicContact CG-CZ2 4.43Å; E508-W513 HydrophobicContact CG-CZ3 4.25Å; E508-W513 VanDerWaalsContact O-CB 3.28Å; E508-W513 WeakPolarHBondContact O-CB 3.49Å; E508-W513 VanDerWaalsContact O-CD1 3.28Å; E508-W513 PolarHBondContact O-N 3.16Å; E508-Y514 HydrophobicContact CB-CE1 3.7Å; E508-Y514 HydrophobicContact CG-CE1 4.42Å; E508-Y514 WeakPolarHBondContact OE2-CE1 3.46Å; E508-Y514 PolarHBondContact OE2-OH 3.27Å
509	H	87.9	Confident	89.2	Confident	10 Å²	10	22.8 Å²	22.8	5%	0.046	12%	0.119	C	C	.	.	H	α-helix	trans	-69.2	-35.6	178.6	179.9	65.2	0	0	0	113.3	R416 F505 R507 S512 Y514	R416-H509 PolarHBondContact NH1-CE1 2.88Å; R416-H509 PolarHBondContact NH1-NE2 3.13Å; F505-H509 HydrophobicContact CD2-CB 4.47Å; F505-H509 HydrophobicContact CE1-CB 4.38Å; F505-H509 HydrophobicContact CE2-CB 3.96Å; F505-H509 HydrophobicContact CZ-CB 3.89Å; F505-H509 AromaticContact CZ-CG 3.93Å; F505-H509 WeakPolarHBondContact O-CB 3.33Å; F505-H509 PolarHBondContact O-N 2.94Å; R507-H509 VanDerWaalsContact C-N 3.32Å; R507-H509 PolarHBondContact O-N 3.07Å; H509-S512 PolarHBondContact O-N 3.15Å; H509-Y514 PolarHBondContact ND1-O 3.34Å
510	L	83.5	Confident	89.5	Confident	21 Å²	21	22.9 Å²	22.9	11%	0.11	12%	0.117	C	C	.	.	H	α-helix	trans	-77.7	-30.8	178.5	-68.7	171.1	0	0	0	112.1	Y88 F506 R507 S512	Y88-L510 HydrophobicContact CD1-CD1 3.64Å; Y88-L510 HydrophobicContact CE1-CB 3.67Å; Y88-L510 HydrophobicContact CE1-CD1 3.35Å; Y88-L510 HydrophobicContact CE1-CG 4.1Å; Y88-L510 HydrophobicContact CE2-CB 4.11Å; Y88-L510 VanDerWaalsContact CZ-CB 3.41Å; Y88-L510 WeakPolarHBondContact OH-CB 3.45Å; F506-L510 VanDerWaalsContact O-CB 3.31Å; F506-L510 WeakPolarHBondContact O-CB 3.18Å; F506-L510 WeakPolarHBondContact O-CG 3.34Å; F506-L510 PolarHBondContact O-N 3.38Å; R507-L510 PolarHBondContact O-N 2.9Å; L510-S512 PolarHBondContact O-N 3.39Å
511	N	86.2	Confident	89.8	Confident	6 Å²	6	23 Å²	23	3%	0.032	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	17.5	167.8	-70.3	-14.5	0	0	0	113.3	Y88 Y115 E186 R507 E508 W513	Y88-N511 PolarHBondContact OH-OD1 3.18Å; Y115-N511 PolarHBondContact N-OD1 2.7Å; Y115-N511 VanDerWaalsContact N-OD1 3.13Å; Y115-N511 PolarHBondContact O-ND2 3.21Å; Y115-N511 PolarHBondContact O-OD1 3.11Å; E186-N511 VanDerWaalsContact CD-ND2 3.26Å; E186-N511 PolarHBondContact OE1-ND2 3.11Å; R507-N511 WeakPolarHBondContact O-CB 3.46Å; R507-N511 PolarHBondContact O-N 3.49Å; E508-N511 CarbonylContact O-C 3.55Å; N511-W513 VanDerWaalsContact C-N 3.35Å; N511-W513 PolarHBondContact O-N 3.11Å
512	S	85.2	Confident	90.1	Very high	32 Å²	32	21 Å²	21	22%	0.224	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.1	32.5	172.3	-53.5	0	0	0	0	115.7	R110 F418 E508 H509 L510	R110-S512 PolarHBondContact O-OG 3.19Å; F418-S512 WeakPolarHBondContact CD1-O 3.24Å; E508-S512 PolarHBondContact O-N 2.94Å; H509-S512 PolarHBondContact O-N 3.15Å; L510-S512 PolarHBondContact O-N 3.39Å
513	W	89.9	Confident	90.3	Very high	1 Å²	1	21.1 Å²	21.1	0%	0.004	11%	0.107	C	C	.	.	S	Bend	trans	-69.8	-45.1	175.2	-69.9	41.5	0	0	0	111.8	L138 K139 Q185 E186 E508 N511	L138-W513 HydrophobicContact CD1-CE3 3.89Å; L138-W513 HydrophobicContact CD1-CZ3 4.49Å; K139-W513 HydrophobicContact CD-CD2 4.23Å; K139-W513 HydrophobicContact CD-CG 4.25Å; K139-W513 HydrophobicContact CD-CZ2 4.43Å; K139-W513 HydrophobicContact CG-CD2 4.31Å; K139-W513 HydrophobicContact CG-CG 4.12Å; Q185-W513 HydrophobicContact CB-CH2 3.94Å; Q185-W513 HydrophobicContact CB-CZ2 3.87Å; Q185-W513 HydrophobicContact CG-CH2 4.29Å; E186-W513 PolarHBondContact OE1-NE1 2.89Å; E508-W513 HydrophobicContact CB-CB 4.11Å; E508-W513 HydrophobicContact CB-CD2 4.02Å; E508-W513 HydrophobicContact CB-CE3 4.33Å; E508-W513 HydrophobicContact CB-CG 3.93Å; E508-W513 HydrophobicContact CG-CD2 3.88Å; E508-W513 HydrophobicContact CG-CE3 3.94Å; E508-W513 HydrophobicContact CG-CG 4.32Å; E508-W513 HydrophobicContact CG-CH2 4.48Å; E508-W513 HydrophobicContact CG-CZ2 4.43Å; E508-W513 HydrophobicContact CG-CZ3 4.25Å; E508-W513 VanDerWaalsContact O-CB 3.28Å; E508-W513 WeakPolarHBondContact O-CB 3.49Å; E508-W513 VanDerWaalsContact O-CD1 3.28Å; E508-W513 PolarHBondContact O-N 3.16Å; N511-W513 VanDerWaalsContact C-N 3.35Å; N511-W513 PolarHBondContact O-N 3.11Å
514	Y	91.9	Very high	90.6	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.103	C	C	.	.			trans	-162.6	166.2	-176.2	51.5	-98.7	0	0	0	113.5	L138 F418 L429 F505 E508 H509 Y519	L138-Y514 HydrophobicContact CD1-CD1 3.95Å; L138-Y514 HydrophobicContact CD1-CE1 4.33Å; L138-Y514 HydrophobicContact CD2-CD1 4.37Å; F418-Y514 WeakPolarHBondContact CE1-O 3.49Å; F418-Y514 VanDerWaalsContact CZ-O 3.3Å; F418-Y514 WeakPolarHBondContact CZ-O 3.18Å; L429-Y514 HydrophobicContact CD1-CD1 4.09Å; L429-Y514 HydrophobicContact CD1-CD2 3.83Å; L429-Y514 HydrophobicContact CD1-CE1 4.49Å; L429-Y514 HydrophobicContact CD1-CE2 4.25Å; L429-Y514 HydrophobicContact CD1-CG 3.73Å; L429-Y514 HydrophobicContact CD2-CD1 3.86Å; L429-Y514 HydrophobicContact CD2-CE1 3.68Å; L429-Y514 HydrophobicContact CD2-CG 4.35Å; L429-Y514 HydrophobicContact CG-CD1 4.45Å; F505-Y514 AromaticContact CD2-CE2 3.64Å; F505-Y514 HydrophobicContact CD2-CE2 3.64Å; F505-Y514 HydrophobicContact CE2-CD2 4.45Å; F505-Y514 AromaticContact CE2-CE2 3.75Å; F505-Y514 HydrophobicContact CE2-CE2 3.75Å; E508-Y514 HydrophobicContact CB-CE1 3.7Å; E508-Y514 HydrophobicContact CG-CE1 4.42Å; E508-Y514 WeakPolarHBondContact OE2-CE1 3.46Å; E508-Y514 PolarHBondContact OE2-OH 3.27Å; H509-Y514 PolarHBondContact ND1-O 3.34Å; Y514-Y519 AromaticContact CE2-CD2 3.99Å; Y514-Y519 HydrophobicContact CE2-CD2 3.99Å; Y514-Y519 HydrophobicContact CE2-CG 4.07Å
515	S	91.1	Very high	90.8	Very high	12 Å²	12	23.7 Å²	23.7	8%	0.084	12%	0.12	C	C	.	.			trans	-77.4	152.1	178.9	69.1	0	0	0	0	113.1	F418 Q425 K517 A518 Y519	F418-S515 VanDerWaalsContact CE2-CB 3.5Å; Q425-S515 PolarHBondContact OE1-OG 3.37Å; Q425-S515 VanDerWaalsContact OE1-OG 3.05Å; S515-K517 PolarHBondContact O-N 3.1Å; S515-A518 PolarHBondContact O-N 3.38Å; S515-A518 WeakPolarHBondContact OG-CB 3.35Å; S515-A518 PolarHBondContact OG-N 2.95Å; S515-Y519 PolarHBondContact O-N 3.39Å
516	L	91.7	Very high	90.9	Very high	17 Å²	17	23.7 Å²	23.7	9%	0.089	12%	0.12	C	C	.	.	H	α-helix	trans	-55.2	-40.6	172	170.5	61.5	0	0	0	112	F505 Y519 Y520 Y692 L695 R696 I699	F505-L516 HydrophobicContact CE1-CD1 4.2Å; F505-L516 HydrophobicContact CE2-CD1 4.32Å; F505-L516 HydrophobicContact CZ-CB 4.31Å; F505-L516 HydrophobicContact CZ-CD1 3.6Å; L516-Y519 PolarHBondContact O-N 2.97Å; L516-Y520 WeakPolarHBondContact O-CB 3.46Å; L516-Y520 PolarHBondContact O-N 2.73Å; L516-Y692 HydrophobicContact CD2-CE2 3.95Å; L516-Y692 HydrophobicContact CG-CE2 3.85Å; L516-L695 HydrophobicContact CD1-CD2 3.5Å; L516-L695 HydrophobicContact CD1-CG 3.76Å; L516-R696 HydrophobicContact CD2-CB 3.78Å; L516-R696 HydrophobicContact CD2-CG 3.95Å; L516-I699 HydrophobicContact CB-CD1 4.37Å; L516-I699 HydrophobicContact CD1-CD1 3.66Å; L516-I699 HydrophobicContact CD2-CD1 3.73Å; L516-I699 HydrophobicContact CG-CD1 4.1Å
517	K	92.7	Very high	91.1	Very high	126 Å²	126	23.9 Å²	23.9	55%	0.548	12%	0.121	S	C	.	.	H	α-helix	trans	-61	-49.4	-178.8	-64.7	-179.1	-177.6	180	0	111.2	S515 Y519 Y520 M521 Y692	S515-K517 PolarHBondContact O-N 3.1Å; K517-Y519 PolarHBondContact O-N 3.06Å; K517-Y520 PolarHBondContact O-N 2.93Å; K517-M521 WeakPolarHBondContact O-CB 3.27Å; K517-M521 PolarHBondContact O-N 3.08Å; K517-M521 VanDerWaalsContact O-N 3.12Å; K517-Y692 HydrophobicContact CG-CE2 4.46Å; K517-Y692 WeakPolarHBondContact CG-OH 3.36Å
518	A	93.6	Very high	91.3	Very high	4 Å²	4	24.9 Å²	24.9	3%	0.033	13%	0.129	C	C	.	.	H	α-helix	trans	-61.1	-44.3	179.7	0	0	0	0	0	111.8	Q425 L429 S515 A522	Q425-A518 HydrophobicContact CB-CB 3.67Å; L429-A518 HydrophobicContact CD1-CB 4.18Å; S515-A518 PolarHBondContact O-N 3.38Å; S515-A518 WeakPolarHBondContact OG-CB 3.35Å; S515-A518 PolarHBondContact OG-N 2.95Å; A518-A522 WeakPolarHBondContact O-CB 3.49Å; A518-A522 PolarHBondContact O-N 2.97Å
519	Y	94.4	Very high	91.5	Very high	4 Å²	4	28.2 Å²	28.2	2%	0.016	15%	0.15	C	C	.	.	H	α-helix	trans	-62.5	-52.4	177.7	170.9	-98.8	0	0	0	113	F505 Y514 S515 L516 K517 M521 A522 K523 L695	F505-Y519 HydrophobicContact CB-CE1 4.17Å; F505-Y519 HydrophobicContact CB-CE2 4.06Å; F505-Y519 HydrophobicContact CD1-CE1 4.49Å; F505-Y519 AromaticContact CD2-CD1 3.32Å; F505-Y519 HydrophobicContact CD2-CD1 3.32Å; F505-Y519 AromaticContact CD2-CD2 3.61Å; F505-Y519 HydrophobicContact CD2-CD2 3.61Å; F505-Y519 AromaticContact CD2-CE1 3.68Å; F505-Y519 HydrophobicContact CD2-CE1 3.68Å; F505-Y519 AromaticContact CD2-CE2 3.95Å; F505-Y519 HydrophobicContact CD2-CE2 3.95Å; F505-Y519 AromaticContact CD2-CG 3.29Å; F505-Y519 HydrophobicContact CD2-CG 3.29Å; F505-Y519 AromaticContact CD2-CZ 3.99Å; F505-Y519 AromaticContact CE2-CD1 3.54Å; F505-Y519 HydrophobicContact CE2-CD1 3.54Å; F505-Y519 HydrophobicContact CE2-CD2 4.32Å; F505-Y519 HydrophobicContact CE2-CE1 4.27Å; F505-Y519 AromaticContact CE2-CG 3.57Å; F505-Y519 HydrophobicContact CE2-CG 3.57Å; F505-Y519 AromaticContact CG-CD1 3.94Å; F505-Y519 HydrophobicContact CG-CD1 3.94Å; F505-Y519 HydrophobicContact CG-CD2 4.41Å; F505-Y519 AromaticContact CG-CE1 3.83Å; F505-Y519 HydrophobicContact CG-CE1 3.83Å; F505-Y519 HydrophobicContact CG-CE2 4.31Å; F505-Y519 HydrophobicContact CG-CG 4.24Å; F505-Y519 HydrophobicContact CZ-CD1 4.31Å; Y514-Y519 AromaticContact CE2-CD2 3.99Å; Y514-Y519 HydrophobicContact CE2-CD2 3.99Å; Y514-Y519 HydrophobicContact CE2-CG 4.07Å; S515-Y519 PolarHBondContact O-N 3.39Å; L516-Y519 PolarHBondContact O-N 2.97Å; K517-Y519 PolarHBondContact O-N 3.06Å; Y519-M521 VanDerWaalsContact C-N 3.3Å; Y519-M521 PolarHBondContact O-N 3.46Å; Y519-A522 PolarHBondContact O-N 2.9Å; Y519-K523 WeakPolarHBondContact O-CB 3.46Å; Y519-K523 PolarHBondContact O-N 3.29Å; Y519-L695 HydrophobicContact CD1-CD2 4.43Å; Y519-L695 HydrophobicContact CE1-CD2 4.29Å
520	Y	94	Very high	91.6	Very high	20 Å²	20	29.4 Å²	29.4	8%	0.078	16%	0.156	C	C	.	.	H	α-helix	trans	-64	-39.1	-174.6	-170.2	-99.6	0	0	0	111.9	L516 K517 S524 R688 Y692 L695	L516-Y520 WeakPolarHBondContact O-CB 3.46Å; L516-Y520 PolarHBondContact O-N 2.73Å; K517-Y520 PolarHBondContact O-N 2.93Å; Y520-S524 VanDerWaalsContact O-CB 3.24Å; Y520-S524 WeakPolarHBondContact O-CB 3.32Å; Y520-S524 PolarHBondContact O-N 3.48Å; Y520-S524 PolarHBondContact O-OG 2.92Å; Y520-R688 WeakPolarHBondContact CE1-O 3.32Å; Y520-R688 PolarHBondContact OH-O 3.15Å; Y520-Y692 AromaticContact CD1-CD2 3.82Å; Y520-Y692 HydrophobicContact CD1-CD2 3.82Å; Y520-Y692 HydrophobicContact CD1-CG 4.33Å; Y520-Y692 HydrophobicContact CE1-CD2 4.44Å; Y520-Y692 AromaticContact CG-CD2 3.88Å; Y520-Y692 HydrophobicContact CG-CD2 3.88Å; Y520-Y692 PolarHBondContact OH-N 2.83Å; Y520-L695 HydrophobicContact CD2-CD2 3.91Å
521	M	93.9	Very high	92.1	Very high	106 Å²	106	28.6 Å²	28.6	52%	0.522	15%	0.151	S	C	.	.	H	α-helix	trans	-67.5	-45.7	175.9	-166	170.3	75.4	0	0	111.5	F426 K517 Y519 S524 L525	F426-M521 HydrophobicContact CB-CE 4.22Å; F426-M521 HydrophobicContact CD1-CE 4.07Å; F426-M521 HydrophobicContact CD2-CB 4.07Å; F426-M521 HydrophobicContact CD2-CE 3.31Å; F426-M521 HydrophobicContact CD2-CG 4.08Å; F426-M521 HydrophobicContact CE1-CE 4.26Å; F426-M521 HydrophobicContact CE2-CB 4.03Å; F426-M521 HydrophobicContact CE2-CE 3.53Å; F426-M521 HydrophobicContact CE2-CG 3.67Å; F426-M521 HydrophobicContact CE2-SD 4.38Å; F426-M521 HydrophobicContact CG-CE 3.59Å; F426-M521 HydrophobicContact CZ-CE 4Å; F426-M521 HydrophobicContact CZ-CG 4.47Å; K517-M521 WeakPolarHBondContact O-CB 3.27Å; K517-M521 PolarHBondContact O-N 3.08Å; K517-M521 VanDerWaalsContact O-N 3.12Å; Y519-M521 VanDerWaalsContact C-N 3.3Å; Y519-M521 PolarHBondContact O-N 3.46Å; M521-S524 PolarHBondContact O-N 3.47Å; M521-L525 WeakPolarHBondContact O-CB 3.39Å; M521-L525 PolarHBondContact O-N 2.99Å
522	A	95.5	Very high	92.5	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-62.7	-44.3	178.5	0	0	0	0	0	112.1	F426 L429 L430 A518 Y519 A526	F426-A522 HydrophobicContact CD2-CB 3.79Å; F426-A522 HydrophobicContact CE2-CB 4.08Å; L429-A522 HydrophobicContact CB-CB 3.61Å; L430-A522 HydrophobicContact CB-CB 4.34Å; L430-A522 WeakPolarHBondContact CD1-O 3.5Å; A518-A522 WeakPolarHBondContact O-CB 3.49Å; A518-A522 PolarHBondContact O-N 2.97Å; Y519-A522 PolarHBondContact O-N 2.9Å; A522-A526 VanDerWaalsContact O-CB 3.24Å; A522-A526 WeakPolarHBondContact O-CB 3.42Å; A522-A526 PolarHBondContact O-N 3.35Å
523	K	93.2	Very high	93	Very high	8 Å²	8	34.8 Å²	34.8	4%	0.035	18%	0.176	C	C	.	.	H	α-helix	trans	-64	-44.8	176.2	-179.9	62.4	-176	-171.9	0	111.3	N433 F498 E501 Y519 L525 A526 D527	N433-K523 WeakPolarHBondContact ND2-CA 3.48Å; F498-K523 HydrophobicContact CE2-CG 4.34Å; E501-K523 IonicContact OE1-NZ 3Å; E501-K523 PolarHBondContact OE1-NZ 2.97Å; E501-K523 WeakPolarHBondContact OE2-CD 3.49Å; E501-K523 WeakPolarHBondContact OE2-CE 3.45Å; E501-K523 IonicContact OE2-NZ 2.94Å; E501-K523 PolarHBondContact OE2-NZ 3.16Å; Y519-K523 WeakPolarHBondContact O-CB 3.46Å; Y519-K523 PolarHBondContact O-N 3.29Å; K523-L525 VanDerWaalsContact C-N 3.31Å; K523-L525 PolarHBondContact O-N 3.31Å; K523-A526 PolarHBondContact O-N 2.95Å; K523-D527 IonicContact NZ-OD1 3.81Å
524	S	92.2	Very high	93.2	Very high	21 Å²	21	35 Å²	35	15%	0.147	18%	0.177	C	C	.	.	H	α-helix	trans	-61.3	-39.6	-179.6	-67.2	0	0	0	0	112.7	Y520 M521 V528 R688	Y520-S524 VanDerWaalsContact O-CB 3.24Å; Y520-S524 WeakPolarHBondContact O-CB 3.32Å; Y520-S524 PolarHBondContact O-N 3.48Å; Y520-S524 PolarHBondContact O-OG 2.92Å; M521-S524 PolarHBondContact O-N 3.47Å; S524-V528 WeakPolarHBondContact O-CG2 3.34Å; S524-R688 VanDerWaalsContact CA-NH1 3.33Å; S524-R688 PolarHBondContact OG-NH1 3.49Å
525	L	94.1	Very high	93.4	Very high	85 Å²	85	35.1 Å²	35.1	45%	0.445	18%	0.178	S	C	.	.	H	α-helix	trans	-81.4	-31.6	-179.3	-168.2	65.6	0	0	0	113.1	F426 L430 M521 K523 D527 V528 P529	F426-L525 HydrophobicContact CZ-CD2 3.76Å; L430-L525 HydrophobicContact CD1-CB 3.97Å; L430-L525 HydrophobicContact CD1-CD2 4.23Å; L430-L525 HydrophobicContact CD1-CG 4.24Å; L430-L525 HydrophobicContact CD2-CD2 4.34Å; M521-L525 WeakPolarHBondContact O-CB 3.39Å; M521-L525 PolarHBondContact O-N 2.99Å; K523-L525 VanDerWaalsContact C-N 3.31Å; K523-L525 PolarHBondContact O-N 3.31Å; L525-D527 PolarHBondContact O-N 3.03Å; L525-V528 PolarHBondContact O-N 3.5Å; L525-P529 WeakPolarHBondContact O-CD 3.33Å
526	A	93.2	Very high	93.7	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-60.5	-33.2	-179.3	0	0	0	0	0	113.3	L430 N433 I434 I437 A522 K523 F530	L430-A526 HydrophobicContact CD1-CB 4.1Å; N433-A526 HydrophobicContact CB-CB 3.58Å; I434-A526 HydrophobicContact CG1-CB 3.98Å; I437-A526 HydrophobicContact CD1-CB 4.25Å; A522-A526 VanDerWaalsContact O-CB 3.24Å; A522-A526 WeakPolarHBondContact O-CB 3.42Å; A522-A526 PolarHBondContact O-N 3.35Å; K523-A526 PolarHBondContact O-N 2.95Å; A526-F530 WeakPolarHBondContact O-CD2 3.34Å
527	D	91	Very high	93.9	Very high	13 Å²	13	38.2 Å²	38.2	7%	0.07	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-21.1	-178.8	-66.5	-32	0	0	0	113.2	I437 K523 L525 F530 Q531 Q570	I437-D527 WeakPolarHBondContact CD1-OD1 3.24Å; K523-D527 IonicContact NZ-OD1 3.81Å; L525-D527 PolarHBondContact O-N 3.03Å; D527-F530 PolarHBondContact O-N 3.09Å; D527-Q531 WeakPolarHBondContact O-CB 3.23Å; D527-Q531 PolarHBondContact O-N 2.96Å; D527-Q570 VanDerWaalsContact CG-NE2 3.31Å; D527-Q570 PolarHBondContact OD2-NE2 2.98Å
528	V	92.3	Very high	94.1	Very high	34 Å²	34	32.2 Å²	32.2	21%	0.206	17%	0.168	C	C	.	.	H	α-helix	trans	-59.2	-46.4	-172.4	170.9	0	0	0	0	113.3	S524 L525 F530 Q531 I532 L567	S524-V528 WeakPolarHBondContact O-CG2 3.34Å; L525-V528 PolarHBondContact O-N 3.5Å; V528-F530 VanDerWaalsContact C-N 3.3Å; V528-F530 PolarHBondContact O-N 3.14Å; V528-Q531 CarbonylContact O-C 3.58Å; V528-Q531 PolarHBondContact O-N 3.38Å; V528-Q531 VanDerWaalsContact O-N 3.13Å; V528-I532 HydrophobicContact CG1-CD1 3.61Å; V528-I532 HydrophobicContact CG1-CG1 4.26Å; V528-I532 WeakPolarHBondContact O-CG1 3.49Å; V528-I532 PolarHBondContact O-N 3.45Å; V528-L567 HydrophobicContact CG2-CD2 4.36Å
529	P	93.1	Very high	94.2	Very high	72 Å²	72	32 Å²	32	47%	0.468	17%	0.167	S	C	.	.	H	α-helix	trans	-58.2	-41.5	179.7	-25.7	35.2	0	0	0	112.9	L525 I532 F533	L525-P529 WeakPolarHBondContact O-CD 3.33Å; P529-I532 PolarHBondContact O-N 3.02Å; P529-F533 WeakPolarHBondContact O-CB 3.19Å; P529-F533 PolarHBondContact O-N 3.5Å
530	F	91.2	Very high	94.3	Very high	36 Å²	36	33.6 Å²	33.6	16%	0.158	18%	0.178	C	C	.	.	H	α-helix	trans	-70.3	-37.7	177.7	-57.4	-81.1	0	0	0	111.4	I437 M438 A526 D527 V528 I532 F533 F534	I437-F530 HydrophobicContact CB-CE2 4.13Å; I437-F530 HydrophobicContact CB-CZ 4.34Å; I437-F530 HydrophobicContact CD1-CD2 4.43Å; I437-F530 HydrophobicContact CD1-CE2 4.29Å; I437-F530 HydrophobicContact CG2-CD1 4.24Å; I437-F530 HydrophobicContact CG2-CD2 3.84Å; I437-F530 HydrophobicContact CG2-CE1 4.09Å; I437-F530 HydrophobicContact CG2-CE2 3.67Å; I437-F530 HydrophobicContact CG2-CG 4.13Å; I437-F530 HydrophobicContact CG2-CZ 3.81Å; M438-F530 HydrophobicContact CG-CE1 4.15Å; M438-F530 HydrophobicContact CG-CZ 3.68Å; A526-F530 WeakPolarHBondContact O-CD2 3.34Å; D527-F530 PolarHBondContact O-N 3.09Å; V528-F530 VanDerWaalsContact C-N 3.3Å; V528-F530 PolarHBondContact O-N 3.14Å; F530-I532 PolarHBondContact O-N 3.28Å; F530-F533 PolarHBondContact O-N 3.41Å; F530-F534 HydrophobicContact CB-CD2 4.49Å; F530-F534 HydrophobicContact CB-CE2 3.94Å; F530-F534 WeakPolarHBondContact O-CD2 3.43Å; F530-F534 PolarHBondContact O-N 3.34Å; F530-F534 VanDerWaalsContact O-N 3.11Å
531	Q	93.2	Very high	94.4	Very high	4 Å²	4	34.7 Å²	34.7	2%	0.019	19%	0.185	C	C	.	.	H	α-helix	trans	-70.6	-19.5	177.2	-155.5	58.7	60.7	0	0	113.4	D527 V528 P535 S566 L567	D527-Q531 WeakPolarHBondContact O-CB 3.23Å; D527-Q531 PolarHBondContact O-N 2.96Å; V528-Q531 CarbonylContact O-C 3.58Å; V528-Q531 PolarHBondContact O-N 3.38Å; V528-Q531 VanDerWaalsContact O-N 3.13Å; Q531-P535 WeakPolarHBondContact O-CD 3.39Å; Q531-P535 WeakPolarHBondContact O-CG 3.21Å; Q531-S566 PolarHBondContact NE2-OG 3.48Å; Q531-L567 HydrophobicContact CB-CD2 4.04Å; Q531-L567 HydrophobicContact CG-CD2 3.85Å; Q531-L567 HydrophobicContact CG-CG 4.3Å
532	I	95.1	Very high	94.5	Very high	63 Å²	63	29.6 Å²	29.6	32%	0.323	16%	0.16	S	C	.	.	H	α-helix	trans	-83.5	-44.8	170	-69.2	168.1	0	0	0	109.9	V528 P529 F530 P535 I536 I563	V528-I532 HydrophobicContact CG1-CD1 3.61Å; V528-I532 HydrophobicContact CG1-CG1 4.26Å; V528-I532 WeakPolarHBondContact O-CG1 3.49Å; V528-I532 PolarHBondContact O-N 3.45Å; P529-I532 PolarHBondContact O-N 3.02Å; F530-I532 PolarHBondContact O-N 3.28Å; I532-P535 WeakPolarHBondContact O-CD 3.26Å; I532-I536 HydrophobicContact CG2-CD1 3.54Å; I532-I536 HydrophobicContact CG2-CG1 4.48Å; I532-I536 WeakPolarHBondContact O-CD1 3.42Å; I532-I536 WeakPolarHBondContact O-CG1 3.36Å; I532-I536 PolarHBondContact O-N 3.46Å; I532-I563 HydrophobicContact CG1-CG2 3.95Å; I532-I563 HydrophobicContact CG2-CD1 4.15Å
533	F	95.1	Very high	94.6	Very high	104 Å²	104	29.7 Å²	29.7	46%	0.456	16%	0.16	S	C	.	.	H	α-helix	trans	-62.1	-49.5	-175.7	177.6	-106.6	0	0	0	113.6	L448 P529 F530 I536 V537	L448-F533 HydrophobicContact CD1-CE1 3.95Å; P529-F533 WeakPolarHBondContact O-CB 3.19Å; P529-F533 PolarHBondContact O-N 3.5Å; F530-F533 PolarHBondContact O-N 3.41Å; F533-I536 PolarHBondContact O-N 2.91Å; F533-V537 HydrophobicContact CD2-CG2 4.41Å; F533-V537 HydrophobicContact CE1-CG2 4.19Å; F533-V537 HydrophobicContact CE2-CG2 3.97Å; F533-V537 HydrophobicContact CZ-CG2 3.85Å; F533-V537 PolarHBondContact O-N 2.94Å; F533-V537 VanDerWaalsContact O-N 3.14Å
534	F	94.9	Very high	94.7	Very high	7 Å²	7	35.8 Å²	35.8	3%	0.031	18%	0.183	C	C	.	.	H	α-helix	trans	-65.8	-44.2	-174.6	-56.8	-53.6	0	0	0	114	T444 R447 L448 F530 I536 V537 Y538	T444-F534 HydrophobicContact CG2-CZ 4.22Å; R447-F534 HydrophobicContact CB-CE1 4.48Å; R447-F534 HydrophobicContact CB-CE2 4.08Å; R447-F534 HydrophobicContact CB-CZ 4.06Å; L448-F534 HydrophobicContact CB-CD1 4.46Å; L448-F534 HydrophobicContact CB-CE1 3.99Å; L448-F534 HydrophobicContact CD1-CD1 4.15Å; L448-F534 HydrophobicContact CD1-CE1 4.27Å; F530-F534 HydrophobicContact CB-CD2 4.49Å; F530-F534 HydrophobicContact CB-CE2 3.94Å; F530-F534 WeakPolarHBondContact O-CD2 3.43Å; F530-F534 PolarHBondContact O-N 3.34Å; F530-F534 VanDerWaalsContact O-N 3.11Å; F534-I536 VanDerWaalsContact C-N 3.31Å; F534-I536 PolarHBondContact O-N 2.95Å; F534-V537 PolarHBondContact O-N 3.27Å; F534-Y538 PolarHBondContact O-N 2.85Å
535	P	95.7	Very high	94.9	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.006	19%	0.188	C	C	.	.	H	α-helix	trans	-62.8	-34.2	173.3	-25.5	37.3	0	0	0	113.3	L486 Q531 I532 Y538 A539 I563	L486-P535 HydrophobicContact CD1-CB 4.38Å; L486-P535 HydrophobicContact CD2-CB 3.86Å; L486-P535 HydrophobicContact CD2-CG 4.07Å; Q531-P535 WeakPolarHBondContact O-CD 3.39Å; Q531-P535 WeakPolarHBondContact O-CG 3.21Å; I532-P535 WeakPolarHBondContact O-CD 3.26Å; P535-Y538 PolarHBondContact O-N 2.79Å; P535-A539 WeakPolarHBondContact O-CB 3.37Å; P535-A539 PolarHBondContact O-N 3.23Å; P535-I563 HydrophobicContact CB-CG1 4.13Å
536	I	96.8	Very high	94.9	Very high	60 Å²	60	33.1 Å²	33.1	31%	0.308	17%	0.166	S	C	.	.	H	α-helix	trans	-61.5	-47.3	175.6	-71.3	169.3	0	0	0	110.7	I532 F533 F534 S540 I563	I532-I536 HydrophobicContact CG2-CD1 3.54Å; I532-I536 HydrophobicContact CG2-CG1 4.48Å; I532-I536 WeakPolarHBondContact O-CD1 3.42Å; I532-I536 WeakPolarHBondContact O-CG1 3.36Å; I532-I536 PolarHBondContact O-N 3.46Å; F533-I536 PolarHBondContact O-N 2.91Å; F534-I536 VanDerWaalsContact C-N 3.31Å; F534-I536 PolarHBondContact O-N 2.95Å; I536-S540 VanDerWaalsContact O-CB 3.27Å; I536-S540 WeakPolarHBondContact O-CB 3.41Å; I536-S540 PolarHBondContact O-N 3.42Å; I536-S540 PolarHBondContact O-OG 3.48Å; I536-I563 HydrophobicContact CD1-CD1 4.33Å; I536-I563 HydrophobicContact CG1-CD1 4.06Å
537	V	96.7	Very high	94.9	Very high	35 Å²	35	36 Å²	36	21%	0.212	18%	0.18	C	C	.	.	H	α-helix	trans	-60.7	-50.2	178.1	174.4	0	0	0	0	110.5	I452 F533 F534 S540 I541	I452-V537 HydrophobicContact CG1-CG1 4Å; F533-V537 HydrophobicContact CD2-CG2 4.41Å; F533-V537 HydrophobicContact CE1-CG2 4.19Å; F533-V537 HydrophobicContact CE2-CG2 3.97Å; F533-V537 HydrophobicContact CZ-CG2 3.85Å; F533-V537 PolarHBondContact O-N 2.94Å; F533-V537 VanDerWaalsContact O-N 3.14Å; F534-V537 PolarHBondContact O-N 3.27Å; V537-S540 PolarHBondContact O-N 3.45Å; V537-I541 HydrophobicContact CG1-CD1 4.24Å; V537-I541 WeakPolarHBondContact O-CG1 3.15Å; V537-I541 PolarHBondContact O-N 3.49Å
538	Y	97.4	Very high	95	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-62.4	-48.1	-179.5	172.4	-84.6	0	0	0	113	H451 V454 I458 T482 F485 L486 F534 P535 S540 I541 T542	H451-Y538 WeakPolarHBondContact O-CD2 3.18Å; V454-Y538 HydrophobicContact CG1-CE2 4.29Å; I458-Y538 WeakPolarHBondContact CD1-OH 3.43Å; T482-Y538 WeakPolarHBondContact CA-OH 3.19Å; T482-Y538 HydrophobicContact CG2-CD1 4.45Å; T482-Y538 HydrophobicContact CG2-CE1 3.57Å; T482-Y538 PolarHBondContact OG1-OH 3.47Å; T482-Y538 VanDerWaalsContact OG1-OH 3.12Å; F485-Y538 AromaticContact CD1-CD2 3.56Å; F485-Y538 HydrophobicContact CD1-CD2 3.56Å; F485-Y538 HydrophobicContact CD1-CE1 4.39Å; F485-Y538 AromaticContact CD1-CE2 3.33Å; F485-Y538 HydrophobicContact CD1-CE2 3.33Å; F485-Y538 HydrophobicContact CD1-CG 4.17Å; F485-Y538 AromaticContact CD1-CZ 3.81Å; F485-Y538 AromaticContact CE1-CD2 3.41Å; F485-Y538 HydrophobicContact CE1-CD2 3.41Å; F485-Y538 VanDerWaalsContact CE1-CD2 3.41Å; F485-Y538 AromaticContact CE1-CE2 3.64Å; F485-Y538 HydrophobicContact CE1-CE2 3.64Å; F485-Y538 HydrophobicContact CE1-CG 4.1Å; F485-Y538 HydrophobicContact CG-CE2 4.17Å; F485-Y538 HydrophobicContact CZ-CD2 4.5Å; L486-Y538 HydrophobicContact CD1-CD1 4.3Å; L486-Y538 HydrophobicContact CD2-CD1 3.86Å; L486-Y538 HydrophobicContact CD2-CG 4.13Å; L486-Y538 HydrophobicContact CG-CD1 4.12Å; L486-Y538 HydrophobicContact CG-CE1 4.38Å; F534-Y538 PolarHBondContact O-N 2.85Å; P535-Y538 PolarHBondContact O-N 2.79Å; Y538-S540 VanDerWaalsContact C-N 3.34Å; Y538-S540 PolarHBondContact O-N 2.91Å; Y538-I541 PolarHBondContact O-N 2.71Å; Y538-T542 HydrophobicContact CE1-CG2 3.95Å; Y538-T542 HydrophobicContact CE2-CG2 4.14Å; Y538-T542 PolarHBondContact O-N 3.45Å; Y538-T542 VanDerWaalsContact O-N 3.11Å; Y538-T542 PolarHBondContact O-OG1 3.3Å
539	A	96	Very high	95	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-69.7	-32.7	-177.1	0	0	0	0	0	111.7	P535 T542 Y543 F558 L559	P535-A539 WeakPolarHBondContact O-CB 3.37Å; P535-A539 PolarHBondContact O-N 3.23Å; A539-T542 WeakPolarHBondContact CA-OG1 3.36Å; A539-T542 PolarHBondContact O-OG1 3.09Å; A539-Y543 WeakPolarHBondContact O-CB 3.5Å; A539-Y543 PolarHBondContact O-N 2.82Å; A539-F558 HydrophobicContact CB-CD1 4.45Å; A539-F558 HydrophobicContact CB-CE1 4.17Å; A539-L559 HydrophobicContact CB-CD2 3.49Å; A539-L559 VanDerWaalsContact CB-CD2 3.49Å
540	S	96	Very high	94.8	Very high	37 Å²	37	38 Å²	38	26%	0.259	19%	0.186	S	C	.	.	H	α-helix	trans	-63.2	-46	174	-59.2	0	0	0	0	111.2	I536 V537 Y538	I536-S540 VanDerWaalsContact O-CB 3.27Å; I536-S540 WeakPolarHBondContact O-CB 3.41Å; I536-S540 PolarHBondContact O-N 3.42Å; I536-S540 PolarHBondContact O-OG 3.48Å; V537-S540 PolarHBondContact O-N 3.45Å; Y538-S540 VanDerWaalsContact C-N 3.34Å; Y538-S540 PolarHBondContact O-N 2.91Å
541	I	96.4	Very high	94.8	Very high	42 Å²	42	39.1 Å²	39.1	22%	0.215	19%	0.194	C	C	.	.	H	α-helix	trans	-60.7	-51.4	178.1	-65.2	165.7	0	0	0	110.3	I452 I456 V537 Y538 M545	I452-I541 HydrophobicContact CG1-CD1 4.39Å; I452-I541 HydrophobicContact CG2-CD1 4.41Å; I456-I541 HydrophobicContact CG1-CG2 4.13Å; V537-I541 HydrophobicContact CG1-CD1 4.24Å; V537-I541 WeakPolarHBondContact O-CG1 3.15Å; V537-I541 PolarHBondContact O-N 3.49Å; Y538-I541 PolarHBondContact O-N 2.71Å; I541-M545 HydrophobicContact CG2-SD 3.57Å; I541-M545 VanDerWaalsContact CG2-SD 3.57Å; I541-M545 WeakPolarHBondContact O-CB 3.49Å; I541-M545 WeakPolarHBondContact O-CG 3.27Å; I541-M545 PolarHBondContact O-N 2.89Å; I541-M545 VanDerWaalsContact O-N 3.15Å
542	T	96.4	Very high	94.8	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-72.5	-39.1	-172.6	49.5	0	0	0	0	113.9	G455 I458 F478 Y538 A539 W544 T546	G455-T542 WeakPolarHBondContact O-CG2 3.49Å; I458-T542 HydrophobicContact CB-CG2 4.42Å; I458-T542 HydrophobicContact CG2-CG2 4.24Å; F478-T542 HydrophobicContact CE2-CG2 4.32Å; Y538-T542 HydrophobicContact CE1-CG2 3.95Å; Y538-T542 HydrophobicContact CE2-CG2 4.14Å; Y538-T542 PolarHBondContact O-N 3.45Å; Y538-T542 VanDerWaalsContact O-N 3.11Å; Y538-T542 PolarHBondContact O-OG1 3.3Å; A539-T542 WeakPolarHBondContact CA-OG1 3.36Å; A539-T542 PolarHBondContact O-OG1 3.09Å; T542-W544 PolarHBondContact O-N 2.95Å; T542-T546 WeakPolarHBondContact O-CB 3.43Å; T542-T546 VanDerWaalsContact O-CG2 3.27Å; T542-T546 WeakPolarHBondContact O-CG2 3.25Å; T542-T546 PolarHBondContact O-N 2.99Å; T542-T546 VanDerWaalsContact O-N 3.11Å; T542-T546 PolarHBondContact O-OG1 3.44Å
543	Y	96.3	Very high	94.7	Very high	2 Å²	2	43.9 Å²	43.9	1%	0.008	23%	0.229	C	C	.	.	H	α-helix	trans	-62.4	-44.3	-179.3	-170.4	-87.1	0	0	0	112.1	A539 T546 Q548 P549 F555 F558	A539-Y543 WeakPolarHBondContact O-CB 3.5Å; A539-Y543 PolarHBondContact O-N 2.82Å; Y543-T546 PolarHBondContact O-OG1 2.98Å; Y543-Q548 HydrophobicContact CD1-CB 3.95Å; Y543-Q548 HydrophobicContact CD2-CB 3.7Å; Y543-Q548 HydrophobicContact CD2-CG 3.82Å; Y543-Q548 HydrophobicContact CE1-CB 3.71Å; Y543-Q548 HydrophobicContact CE2-CB 3.47Å; Y543-Q548 VanDerWaalsContact CE2-CB 3.47Å; Y543-Q548 HydrophobicContact CE2-CG 4Å; Y543-Q548 HydrophobicContact CG-CB 3.94Å; Y543-Q548 HydrophobicContact CG-CG 4.16Å; Y543-Q548 VanDerWaalsContact CZ-CB 3.46Å; Y543-Q548 PolarHBondContact O-N 3.04Å; Y543-P549 WeakPolarHBondContact CE1-O 3.26Å; Y543-P549 PolarHBondContact OH-O 3.34Å; Y543-F555 AromaticContact CD1-CD2 3.56Å; Y543-F555 HydrophobicContact CD1-CD2 3.56Å; Y543-F555 HydrophobicContact CD1-CE2 4.15Å; Y543-F555 HydrophobicContact CD1-CG 4.46Å; Y543-F555 AromaticContact CD2-CD2 3.99Å; Y543-F555 HydrophobicContact CD2-CD2 3.99Å; Y543-F555 HydrophobicContact CE1-CB 4.12Å; Y543-F555 AromaticContact CE1-CD2 3.88Å; Y543-F555 HydrophobicContact CE1-CD2 3.88Å; Y543-F555 HydrophobicContact CE1-CG 4.4Å; Y543-F555 HydrophobicContact CE2-CD2 4.25Å; Y543-F555 AromaticContact CG-CD2 3.63Å; Y543-F555 HydrophobicContact CG-CD2 3.63Å; Y543-F555 HydrophobicContact CG-CE2 4.04Å; Y543-F558 HydrophobicContact CD2-CB 4.46Å; Y543-F558 AromaticContact CD2-CD1 3.74Å; Y543-F558 HydrophobicContact CD2-CD1 3.74Å; Y543-F558 HydrophobicContact CD2-CE1 4.17Å; Y543-F558 HydrophobicContact CD2-CG 4.11Å; Y543-F558 HydrophobicContact CE2-CB 4.27Å; Y543-F558 HydrophobicContact CE2-CD1 4.36Å; Y543-F558 HydrophobicContact CE2-CG 4.29Å
544	W	95.4	Very high	94.6	Very high	136 Å²	136	39.4 Å²	39.4	52%	0.515	21%	0.209	S	C	.	.	H	α-helix	trans	-76	-41.7	179.9	-65.9	116	0	0	0	112.6	T542 T546 E547 N550	T542-W544 PolarHBondContact O-N 2.95Å; W544-T546 VanDerWaalsContact C-N 3.26Å; W544-T546 PolarHBondContact O-N 2.85Å; W544-E547 PolarHBondContact O-N 3.32Å; W544-N550 WeakPolarHBondContact CH2-OD1 3.37Å
545	M	95.8	Very high	94.7	Very high	49 Å²	49	40.8 Å²	40.8	24%	0.241	22%	0.215	C	C	.	.	H	α-helix	trans	-63.6	-30.6	178.1	-72.8	-179.1	75.4	0	0	113.3	V460 F463 R464 I541 E547	V460-M545 HydrophobicContact CG2-CE 3.78Å; F463-M545 VanDerWaalsContact CD2-O 3.26Å; F463-M545 WeakPolarHBondContact CD2-O 3.29Å; R464-M545 PolarHBondContact N-O 3.31Å; I541-M545 HydrophobicContact CG2-SD 3.57Å; I541-M545 VanDerWaalsContact CG2-SD 3.57Å; I541-M545 WeakPolarHBondContact O-CB 3.49Å; I541-M545 WeakPolarHBondContact O-CG 3.27Å; I541-M545 PolarHBondContact O-N 2.89Å; I541-M545 VanDerWaalsContact O-N 3.15Å; M545-E547 VanDerWaalsContact C-N 3.34Å
546	T	95	Very high	94.7	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	1.2	179.4	59.7	0	0	0	0	113.7	Y462 R464 V465 G466 F478 T542 Y543 W544 Q548	Y462-T546 WeakPolarHBondContact O-CG2 3.45Å; R464-T546 CarbonylContact C-O 3.57Å; V465-T546 PolarHBondContact N-O 3.46Å; G466-T546 WeakPolarHBondContact CA-O 3.29Å; G466-T546 PolarHBondContact N-O 3.05Å; F478-T546 HydrophobicContact CD1-CG2 4.4Å; F478-T546 HydrophobicContact CD2-CG2 3.92Å; F478-T546 HydrophobicContact CE1-CG2 4.31Å; F478-T546 HydrophobicContact CE2-CG2 3.85Å; F478-T546 HydrophobicContact CG-CG2 4.21Å; F478-T546 HydrophobicContact CZ-CG2 4.04Å; T542-T546 WeakPolarHBondContact O-CB 3.43Å; T542-T546 VanDerWaalsContact O-CG2 3.27Å; T542-T546 WeakPolarHBondContact O-CG2 3.25Å; T542-T546 PolarHBondContact O-N 2.99Å; T542-T546 VanDerWaalsContact O-N 3.11Å; T542-T546 PolarHBondContact O-OG1 3.44Å; Y543-T546 PolarHBondContact O-OG1 2.98Å; W544-T546 VanDerWaalsContact C-N 3.26Å; W544-T546 PolarHBondContact O-N 2.85Å; T546-Q548 PolarHBondContact O-N 3.44Å; T546-Q548 WeakPolarHBondContact OG1-CG 3.26Å; T546-Q548 PolarHBondContact OG1-NE2 2.95Å
547	E	93.5	Very high	94.6	Very high	60 Å²	60	44 Å²	44	28%	0.28	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.3	47.2	-176.5	-63.7	-175.5	176	0	0	113.4	R464 N467 W544 M545	R464-E547 HydrophobicContact CB-CG 4.16Å; R464-E547 WeakPolarHBondContact CB-OE2 3.43Å; R464-E547 WeakPolarHBondContact CD-OE1 3.47Å; R464-E547 HydrophobicContact CG-CG 3.89Å; R464-E547 VanDerWaalsContact CG-OE1 3.22Å; R464-E547 WeakPolarHBondContact CG-OE1 3.13Å; R464-E547 IonicContact CZ-OE1 3.83Å; R464-E547 IonicContact NE-OE1 2.79Å; R464-E547 PolarHBondContact NE-OE1 3.36Å; R464-E547 IonicContact NH2-OE1 3.84Å; N467-E547 PolarHBondContact ND2-O 3.38Å; W544-E547 PolarHBondContact O-N 3.32Å; M545-E547 VanDerWaalsContact C-N 3.34Å
548	Q	93.5	Very high	94.6	Very high	6 Å²	6	42.3 Å²	42.3	3%	0.028	22%	0.221	C	C	.	.			trans	-64	161.8	167.8	-59.9	-52.1	-41.1	0	0	110.9	N475 F478 Y543 T546 N550	N475-Q548 PolarHBondContact ND2-OE1 2.86Å; N475-Q548 PolarHBondContact OD1-NE2 3.47Å; F478-Q548 HydrophobicContact CE1-CG 4.27Å; Y543-Q548 HydrophobicContact CD1-CB 3.95Å; Y543-Q548 HydrophobicContact CD2-CB 3.7Å; Y543-Q548 HydrophobicContact CD2-CG 3.82Å; Y543-Q548 HydrophobicContact CE1-CB 3.71Å; Y543-Q548 HydrophobicContact CE2-CB 3.47Å; Y543-Q548 VanDerWaalsContact CE2-CB 3.47Å; Y543-Q548 HydrophobicContact CE2-CG 4Å; Y543-Q548 HydrophobicContact CG-CB 3.94Å; Y543-Q548 HydrophobicContact CG-CG 4.16Å; Y543-Q548 VanDerWaalsContact CZ-CB 3.46Å; Y543-Q548 PolarHBondContact O-N 3.04Å; T546-Q548 PolarHBondContact O-N 3.44Å; T546-Q548 WeakPolarHBondContact OG1-CG 3.26Å; T546-Q548 PolarHBondContact OG1-NE2 2.95Å; Q548-N550 PolarHBondContact O-N 3.45Å
549	P	91.5	Very high	94.6	Very high	14 Å²	14	43.4 Å²	43.4	9%	0.091	23%	0.227	C	C	.	.			trans	-49.8	130.8	-177.1	-31.6	38.3	0	0	0	113.8	Y543 D551	Y543-P549 WeakPolarHBondContact CE1-O 3.26Å; Y543-P549 PolarHBondContact OH-O 3.34Å; P549-D551 PolarHBondContact O-N 3.42Å
550	N	88.6	Confident	94.6	Very high	141 Å²	141	46.9 Å²	46.9	75%	0.754	24%	0.244	S	C	*	.			trans	-78.9	66.6	177.5	-169	16.1	0	0	0	111.2	W544 Q548	W544-N550 WeakPolarHBondContact CH2-OD1 3.37Å; Q548-N550 PolarHBondContact O-N 3.45Å
551	D	91.1	Very high	94.6	Very high	61 Å²	61	45.1 Å²	45.1	33%	0.326	23%	0.232	S	C	.	.			trans	-130.1	120.9	177.1	177.1	1.4	0	0	0	109	P549 L553 R554 F555	P549-D551 PolarHBondContact O-N 3.42Å; D551-L553 VanDerWaalsContact C-N 3.26Å; D551-L553 PolarHBondContact O-N 3.32Å; D551-L553 PolarHBondContact OD1-N 2.84Å; D551-R554 HydrophobicContact CB-CB 4.24Å; D551-R554 HydrophobicContact CB-CG 4.02Å; D551-R554 PolarHBondContact O-N 3.06Å; D551-R554 WeakPolarHBondContact OD2-CG 3.38Å; D551-R554 IonicContact OD2-NE 3.94Å; D551-R554 PolarHBondContact OD2-NE 3.23Å; D551-F555 PolarHBondContact O-N 3.07Å
552	A	92.6	Very high	94.6	Very high	70 Å²	70	43.1 Å²	43.1	58%	0.579	22%	0.222	S	C	*	.	H	α-helix	trans	-59.8	-36.3	-176.9	0	0	0	0	0	112.2	F555 I556	A552-F555 PolarHBondContact O-N 3.12Å; A552-I556 VanDerWaalsContact O-CG1 3.27Å; A552-I556 WeakPolarHBondContact O-CG1 3.41Å; A552-I556 PolarHBondContact O-N 3.16Å
553	L	94	Very high	94.6	Very high	96 Å²	96	44.5 Å²	44.5	50%	0.503	23%	0.229	S	C	.	.	H	α-helix	trans	-67.7	-42	-179.5	-177.4	63.1	0	0	0	111	D551 I556 Q557	D551-L553 VanDerWaalsContact C-N 3.26Å; D551-L553 PolarHBondContact O-N 3.32Å; D551-L553 PolarHBondContact OD1-N 2.84Å; L553-I556 PolarHBondContact O-N 3.19Å; L553-Q557 HydrophobicContact CD1-CG 4.49Å; L553-Q557 WeakPolarHBondContact O-CB 3.2Å; L553-Q557 VanDerWaalsContact O-CG 3.29Å; L553-Q557 WeakPolarHBondContact O-CG 3.39Å; L553-Q557 PolarHBondContact O-N 3.32Å
554	R	94	Very high	94.7	Very high	11 Å²	11	45.9 Å²	45.9	4%	0.042	24%	0.235	C	C	.	.	H	α-helix	trans	-65.1	-42.4	176.8	-65.5	176.8	-164	-126.9	-2.1	111.4	D551 Q557 F558 I632 I633 G635 N636 R638	D551-R554 HydrophobicContact CB-CB 4.24Å; D551-R554 HydrophobicContact CB-CG 4.02Å; D551-R554 PolarHBondContact O-N 3.06Å; D551-R554 WeakPolarHBondContact OD2-CG 3.38Å; D551-R554 IonicContact OD2-NE 3.94Å; D551-R554 PolarHBondContact OD2-NE 3.23Å; R554-Q557 PolarHBondContact O-N 3.39Å; R554-F558 VanDerWaalsContact O-CB 3.28Å; R554-F558 WeakPolarHBondContact O-CB 3.45Å; R554-F558 PolarHBondContact O-N 3.43Å; R554-I632 HydrophobicContact CB-CG2 4.1Å; R554-I632 VanDerWaalsContact O-CG2 3.26Å; R554-I632 WeakPolarHBondContact O-CG2 3.42Å; R554-I633 PolarHBondContact NH1-O 3.07Å; R554-G635 PolarHBondContact NH1-O 2.86Å; R554-G635 PolarHBondContact NH2-O 3.04Å; R554-N636 PolarHBondContact NH2-O 3.28Å; R554-R638 VanDerWaalsContact NH2-CA 3.33Å
555	F	95.3	Very high	94.7	Very high	35 Å²	35	39.4 Å²	39.4	15%	0.154	21%	0.211	C	C	.	.	H	α-helix	trans	-60.6	-47.9	176.1	178.7	-114.8	0	0	0	111.5	Y543 D551 A552 Q557 F558 L559	Y543-F555 AromaticContact CD1-CD2 3.56Å; Y543-F555 HydrophobicContact CD1-CD2 3.56Å; Y543-F555 HydrophobicContact CD1-CE2 4.15Å; Y543-F555 HydrophobicContact CD1-CG 4.46Å; Y543-F555 AromaticContact CD2-CD2 3.99Å; Y543-F555 HydrophobicContact CD2-CD2 3.99Å; Y543-F555 HydrophobicContact CE1-CB 4.12Å; Y543-F555 AromaticContact CE1-CD2 3.88Å; Y543-F555 HydrophobicContact CE1-CD2 3.88Å; Y543-F555 HydrophobicContact CE1-CG 4.4Å; Y543-F555 HydrophobicContact CE2-CD2 4.25Å; Y543-F555 AromaticContact CG-CD2 3.63Å; Y543-F555 HydrophobicContact CG-CD2 3.63Å; Y543-F555 HydrophobicContact CG-CE2 4.04Å; D551-F555 PolarHBondContact O-N 3.07Å; A552-F555 PolarHBondContact O-N 3.12Å; F555-Q557 PolarHBondContact O-N 3.05Å; F555-F558 PolarHBondContact O-N 2.91Å; F555-L559 HydrophobicContact CD1-CD1 4.06Å; F555-L559 HydrophobicContact CE1-CD1 3.52Å; F555-L559 HydrophobicContact CE1-CG 4.2Å; F555-L559 HydrophobicContact CE2-CD1 4.33Å; F555-L559 HydrophobicContact CE2-CD2 4.17Å; F555-L559 HydrophobicContact CE2-CG 4.16Å; F555-L559 HydrophobicContact CZ-CD1 3.68Å; F555-L559 HydrophobicContact CZ-CD2 4.08Å; F555-L559 HydrophobicContact CZ-CG 4Å; F555-L559 WeakPolarHBondContact O-CG 3.37Å; F555-L559 PolarHBondContact O-N 3.31Å
556	I	95.9	Very high	94.7	Very high	88 Å²	88	37 Å²	37	45%	0.451	20%	0.199	S	C	.	.	H	α-helix	trans	-62.1	-44.4	178	-68.8	166.6	0	0	0	111.2	A552 L553 F558 L559 I560	A552-I556 VanDerWaalsContact O-CG1 3.27Å; A552-I556 WeakPolarHBondContact O-CG1 3.41Å; A552-I556 PolarHBondContact O-N 3.16Å; L553-I556 PolarHBondContact O-N 3.19Å; I556-F558 VanDerWaalsContact C-N 3.32Å; I556-F558 PolarHBondContact O-N 3.48Å; I556-L559 WeakPolarHBondContact O-CB 3.47Å; I556-L559 PolarHBondContact O-N 2.72Å; I556-I560 HydrophobicContact CG2-CD1 3.86Å; I556-I560 HydrophobicContact CG2-CG1 4.44Å; I556-I560 VanDerWaalsContact O-CG1 3.29Å; I556-I560 WeakPolarHBondContact O-CG1 3.25Å; I556-I560 PolarHBondContact O-N 3.25Å
557	Q	95.5	Very high	94.8	Very high	41 Å²	41	38.2 Å²	38.2	19%	0.192	21%	0.205	C	C	.	.	H	α-helix	trans	-62.8	-39.6	176.8	-73.2	177.2	-17.1	0	0	112	L553 R554 F555 I560 I561 I632 F677	L553-Q557 HydrophobicContact CD1-CG 4.49Å; L553-Q557 WeakPolarHBondContact O-CB 3.2Å; L553-Q557 VanDerWaalsContact O-CG 3.29Å; L553-Q557 WeakPolarHBondContact O-CG 3.39Å; L553-Q557 PolarHBondContact O-N 3.32Å; R554-Q557 PolarHBondContact O-N 3.39Å; F555-Q557 PolarHBondContact O-N 3.05Å; Q557-I560 PolarHBondContact O-N 3.43Å; Q557-I561 PolarHBondContact O-N 2.99Å; Q557-I632 HydrophobicContact CB-CD1 3.75Å; Q557-I632 HydrophobicContact CB-CG1 3.88Å; Q557-I632 HydrophobicContact CB-CG2 3.8Å; Q557-F677 HydrophobicContact CB-CZ 4.16Å; Q557-F677 HydrophobicContact CG-CZ 4.38Å
558	F	96.1	Very high	94.9	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-65.4	-36.8	175.2	-175.4	-98.8	0	0	0	112.3	T482 A539 Y543 R554 F555 I556 I561 S562 A629 I632 I633	T482-F558 HydrophobicContact CG2-CE1 4.5Å; T482-F558 HydrophobicContact CG2-CZ 3.92Å; A539-F558 HydrophobicContact CB-CD1 4.45Å; A539-F558 HydrophobicContact CB-CE1 4.17Å; Y543-F558 HydrophobicContact CD2-CB 4.46Å; Y543-F558 AromaticContact CD2-CD1 3.74Å; Y543-F558 HydrophobicContact CD2-CD1 3.74Å; Y543-F558 HydrophobicContact CD2-CE1 4.17Å; Y543-F558 HydrophobicContact CD2-CG 4.11Å; Y543-F558 HydrophobicContact CE2-CB 4.27Å; Y543-F558 HydrophobicContact CE2-CD1 4.36Å; Y543-F558 HydrophobicContact CE2-CG 4.29Å; R554-F558 VanDerWaalsContact O-CB 3.28Å; R554-F558 WeakPolarHBondContact O-CB 3.45Å; R554-F558 PolarHBondContact O-N 3.43Å; F555-F558 PolarHBondContact O-N 2.91Å; I556-F558 VanDerWaalsContact C-N 3.32Å; I556-F558 PolarHBondContact O-N 3.48Å; F558-I561 WeakPolarHBondContact O-CG2 3.22Å; F558-S562 VanDerWaalsContact O-CB 3.26Å; F558-S562 WeakPolarHBondContact O-CB 3.38Å; F558-S562 PolarHBondContact O-N 3.06Å; F558-S562 VanDerWaalsContact O-N 3.13Å; F558-S562 PolarHBondContact O-OG 3.32Å; F558-A629 HydrophobicContact CD2-CB 4.37Å; F558-A629 HydrophobicContact CE2-CB 4.3Å; F558-I632 HydrophobicContact CB-CG2 4.37Å; F558-I633 HydrophobicContact CD2-CD1 4.19Å; F558-I633 HydrophobicContact CD2-CG1 4.5Å; F558-I633 HydrophobicContact CE2-CD1 4.06Å
559	L	96.6	Very high	95	Very high	23 Å²	23	35.1 Å²	35.1	12%	0.12	19%	0.191	C	C	.	.	H	α-helix	trans	-64.4	-46.1	171.3	-70.8	-179.1	0	0	0	111.7	A539 F555 I556 I561 S562 I563	A539-L559 HydrophobicContact CB-CD2 3.49Å; A539-L559 VanDerWaalsContact CB-CD2 3.49Å; F555-L559 HydrophobicContact CD1-CD1 4.06Å; F555-L559 HydrophobicContact CE1-CD1 3.52Å; F555-L559 HydrophobicContact CE1-CG 4.2Å; F555-L559 HydrophobicContact CE2-CD1 4.33Å; F555-L559 HydrophobicContact CE2-CD2 4.17Å; F555-L559 HydrophobicContact CE2-CG 4.16Å; F555-L559 HydrophobicContact CZ-CD1 3.68Å; F555-L559 HydrophobicContact CZ-CD2 4.08Å; F555-L559 HydrophobicContact CZ-CG 4Å; F555-L559 WeakPolarHBondContact O-CG 3.37Å; F555-L559 PolarHBondContact O-N 3.31Å; I556-L559 WeakPolarHBondContact O-CB 3.47Å; I556-L559 PolarHBondContact O-N 2.72Å; L559-I561 PolarHBondContact O-N 2.9Å; L559-S562 WeakPolarHBondContact O-CB 3.31Å; L559-S562 PolarHBondContact O-N 3.03Å; L559-I563 WeakPolarHBondContact O-CB 3.46Å; L559-I563 WeakPolarHBondContact O-CD1 3.35Å; L559-I563 VanDerWaalsContact O-CG1 3.25Å; L559-I563 WeakPolarHBondContact O-CG1 3.48Å; L559-I563 PolarHBondContact O-N 3.26Å
560	I	96.7	Very high	95.2	Very high	73 Å²	73	34.5 Å²	34.5	37%	0.374	19%	0.187	S	C	.	.	H	α-helix	trans	-60.4	-46.7	-179.3	-67.8	165.9	0	0	0	110.7	I556 Q557 S562 I563 Q564 F677	I556-I560 HydrophobicContact CG2-CD1 3.86Å; I556-I560 HydrophobicContact CG2-CG1 4.44Å; I556-I560 VanDerWaalsContact O-CG1 3.29Å; I556-I560 WeakPolarHBondContact O-CG1 3.25Å; I556-I560 PolarHBondContact O-N 3.25Å; Q557-I560 PolarHBondContact O-N 3.43Å; I560-S562 VanDerWaalsContact C-N 3.32Å; I560-S562 PolarHBondContact O-N 2.98Å; I560-I563 PolarHBondContact O-N 3.11Å; I560-Q564 HydrophobicContact CG2-CG 4.44Å; I560-Q564 WeakPolarHBondContact O-CB 3.2Å; I560-Q564 WeakPolarHBondContact O-CG 3.28Å; I560-Q564 PolarHBondContact O-N 2.86Å; I560-F677 HydrophobicContact CB-CE1 3.99Å; I560-F677 HydrophobicContact CG2-CD1 3.9Å; I560-F677 HydrophobicContact CG2-CE1 3.54Å; I560-F677 HydrophobicContact CG2-CZ 4.36Å
561	I	96.4	Very high	95.6	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-67.4	-35	-179.5	-157.1	165.2	0	0	0	111.9	Q557 F558 L559 T565 S625 A629 I632 F677 L680	Q557-I561 PolarHBondContact O-N 2.99Å; F558-I561 WeakPolarHBondContact O-CG2 3.22Å; L559-I561 PolarHBondContact O-N 2.9Å; I561-T565 WeakPolarHBondContact O-CB 3.5Å; I561-T565 PolarHBondContact O-N 3.35Å; I561-T565 PolarHBondContact O-OG1 3.41Å; I561-S625 WeakPolarHBondContact CD1-O 3.33Å; I561-A629 HydrophobicContact CD1-CB 4.48Å; I561-A629 HydrophobicContact CG2-CB 4.21Å; I561-I632 HydrophobicContact CB-CD1 4.42Å; I561-I632 HydrophobicContact CD1-CD1 4.33Å; I561-I632 HydrophobicContact CG2-CD1 4.19Å; I561-F677 HydrophobicContact CB-CE1 3.92Å; I561-F677 HydrophobicContact CG1-CE1 4.43Å; I561-L680 HydrophobicContact CD1-CD1 4.41Å; I561-L680 HydrophobicContact CG1-CD1 3.78Å
562	S	96.7	Very high	95.8	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-63.5	-46.7	174	-66.9	0	0	0	0	111.7	F558 L559 I560 T565 S566	F558-S562 VanDerWaalsContact O-CB 3.26Å; F558-S562 WeakPolarHBondContact O-CB 3.38Å; F558-S562 PolarHBondContact O-N 3.06Å; F558-S562 VanDerWaalsContact O-N 3.13Å; F558-S562 PolarHBondContact O-OG 3.32Å; L559-S562 WeakPolarHBondContact O-CB 3.31Å; L559-S562 PolarHBondContact O-N 3.03Å; I560-S562 VanDerWaalsContact C-N 3.32Å; I560-S562 PolarHBondContact O-N 2.98Å; S562-T565 PolarHBondContact O-N 2.91Å; S562-S566 WeakPolarHBondContact O-CB 3.37Å; S562-S566 PolarHBondContact O-N 3.48Å; S562-S566 VanDerWaalsContact O-N 3.11Å
563	I	97.1	Very high	95.9	Very high	28 Å²	28	22.6 Å²	22.6	14%	0.144	11%	0.113	C	C	.	.	H	α-helix	trans	-63.5	-46.7	176.7	-68.8	163.4	0	0	0	110.7	I532 P535 I536 L559 I560 T565 S566 L567	I532-I563 HydrophobicContact CG1-CG2 3.95Å; I532-I563 HydrophobicContact CG2-CD1 4.15Å; P535-I563 HydrophobicContact CB-CG1 4.13Å; I536-I563 HydrophobicContact CD1-CD1 4.33Å; I536-I563 HydrophobicContact CG1-CD1 4.06Å; L559-I563 WeakPolarHBondContact O-CB 3.46Å; L559-I563 WeakPolarHBondContact O-CD1 3.35Å; L559-I563 VanDerWaalsContact O-CG1 3.25Å; L559-I563 WeakPolarHBondContact O-CG1 3.48Å; L559-I563 PolarHBondContact O-N 3.26Å; I560-I563 PolarHBondContact O-N 3.11Å; I563-T565 PolarHBondContact O-N 2.9Å; I563-S566 WeakPolarHBondContact O-CB 3.35Å; I563-S566 PolarHBondContact O-N 2.88Å; I563-L567 HydrophobicContact CG2-CD1 3.87Å; I563-L567 HydrophobicContact CG2-CG 4.32Å; I563-L567 WeakPolarHBondContact O-CG 3.39Å; I563-L567 PolarHBondContact O-N 2.69Å
564	Q	96.4	Very high	95.9	Very high	31 Å²	31	18.1 Å²	18.1	15%	0.145	9%	0.09	C	C	.	.	H	α-helix	trans	-60.6	-44.6	178.2	-77.4	-174.8	-17.5	0	0	112.3	I560 S566 L567 V568 L680 C681	I560-Q564 HydrophobicContact CG2-CG 4.44Å; I560-Q564 WeakPolarHBondContact O-CB 3.2Å; I560-Q564 WeakPolarHBondContact O-CG 3.28Å; I560-Q564 PolarHBondContact O-N 2.86Å; Q564-S566 PolarHBondContact O-N 2.68Å; Q564-L567 PolarHBondContact O-N 2.95Å; Q564-V568 WeakPolarHBondContact O-CG2 3.46Å; Q564-V568 PolarHBondContact O-N 3.46Å; Q564-L680 HydrophobicContact CB-CB 4.29Å; Q564-L680 HydrophobicContact CB-CD1 4.18Å; Q564-C681 PolarHBondContact NE2-SG 2.88Å
565	T	96.1	Very high	96	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-56.7	-43.5	175.9	-56.8	0	0	0	0	110.7	L483 M487 I561 S562 I563 V568 G569 F621 S625	L483-T565 HydrophobicContact CB-CG2 4.47Å; L483-T565 HydrophobicContact CD2-CG2 4.34Å; M487-T565 HydrophobicContact CB-CG2 4.48Å; I561-T565 WeakPolarHBondContact O-CB 3.5Å; I561-T565 PolarHBondContact O-N 3.35Å; I561-T565 PolarHBondContact O-OG1 3.41Å; S562-T565 PolarHBondContact O-N 2.91Å; I563-T565 PolarHBondContact O-N 2.9Å; T565-V568 PolarHBondContact O-N 2.88Å; T565-G569 PolarHBondContact O-N 3.19Å; T565-F621 HydrophobicContact CG2-CE2 4.26Å; T565-S625 WeakPolarHBondContact OG1-CB 3.09Å; T565-S625 PolarHBondContact OG1-OG 3.37Å
566	S	96.3	Very high	96	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-67.6	-40.5	178.9	-147.8	0	0	0	0	112.5	L486 S490 Q531 S562 I563 Q564 G569 Q570	L486-S566 PolarHBondContact O-OG 3.09Å; S490-S566 VanDerWaalsContact CB-O 3.25Å; S490-S566 WeakPolarHBondContact CB-O 2.96Å; S490-S566 WeakPolarHBondContact CB-OG 3.25Å; S490-S566 PolarHBondContact OG-O 2.96Å; Q531-S566 PolarHBondContact NE2-OG 3.48Å; S562-S566 WeakPolarHBondContact O-CB 3.37Å; S562-S566 PolarHBondContact O-N 3.48Å; S562-S566 VanDerWaalsContact O-N 3.11Å; I563-S566 WeakPolarHBondContact O-CB 3.35Å; I563-S566 PolarHBondContact O-N 2.88Å; Q564-S566 PolarHBondContact O-N 2.68Å; S566-G569 PolarHBondContact O-N 2.67Å; S566-Q570 WeakPolarHBondContact O-CB 3.38Å; S566-Q570 PolarHBondContact O-N 3.33Å
567	L	96.6	Very high	95.8	Very high	24 Å²	24	12.9 Å²	12.9	13%	0.126	7%	0.065	C	C	.	.	H	α-helix	trans	-65.3	-38.2	175.1	-73.1	169.7	0	0	0	113.1	V528 Q531 I563 Q564 S571 F684	V528-L567 HydrophobicContact CG2-CD2 4.36Å; Q531-L567 HydrophobicContact CB-CD2 4.04Å; Q531-L567 HydrophobicContact CG-CD2 3.85Å; Q531-L567 HydrophobicContact CG-CG 4.3Å; I563-L567 HydrophobicContact CG2-CD1 3.87Å; I563-L567 HydrophobicContact CG2-CG 4.32Å; I563-L567 WeakPolarHBondContact O-CG 3.39Å; I563-L567 PolarHBondContact O-N 2.69Å; Q564-L567 PolarHBondContact O-N 2.95Å; L567-S571 PolarHBondContact O-N 3.46Å; L567-S571 VanDerWaalsContact O-N 3.08Å; L567-S571 PolarHBondContact O-OG 3.47Å; L567-F684 HydrophobicContact CB-CD2 3.93Å; L567-F684 HydrophobicContact CB-CE2 4.03Å; L567-F684 HydrophobicContact CD2-CE2 4.43Å
568	V	96.6	Very high	95.7	Very high	1 Å²	1	10.9 Å²	10.9	1%	0.006	6%	0.056	C	C	.	.	H	α-helix	trans	-67.3	-45.8	174.5	176.8	0	0	0	0	110.2	Q564 T565 Q570 S571 L572 F621 L680 F683 F684 L687	Q564-V568 WeakPolarHBondContact O-CG2 3.46Å; Q564-V568 PolarHBondContact O-N 3.46Å; T565-V568 PolarHBondContact O-N 2.88Å; V568-Q570 VanDerWaalsContact C-N 3.33Å; V568-Q570 PolarHBondContact O-N 3.13Å; V568-S571 WeakPolarHBondContact O-CB 3.34Å; V568-S571 PolarHBondContact O-N 2.92Å; V568-L572 PolarHBondContact O-N 3.03Å; V568-F621 HydrophobicContact CB-CD2 4.04Å; V568-F621 HydrophobicContact CB-CE2 4.18Å; V568-F621 HydrophobicContact CB-CG 4.39Å; V568-F621 HydrophobicContact CG1-CB 4.02Å; V568-F621 HydrophobicContact CG1-CD1 3.63Å; V568-F621 HydrophobicContact CG1-CD2 3.58Å; V568-F621 HydrophobicContact CG1-CE1 3.89Å; V568-F621 HydrophobicContact CG1-CE2 3.86Å; V568-F621 HydrophobicContact CG1-CG 3.46Å; V568-F621 VanDerWaalsContact CG1-CG 3.46Å; V568-F621 HydrophobicContact CG1-CZ 4Å; V568-L680 WeakPolarHBondContact CG2-O 3.43Å; V568-F683 HydrophobicContact CG1-CB 4.14Å; V568-F683 HydrophobicContact CG2-CB 4.32Å; V568-F684 HydrophobicContact CG2-CB 3.92Å; V568-L687 HydrophobicContact CG1-CD1 3.94Å
569	G	95.5	Very high	95.5	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-56.9	-43.1	174.9	0	0	0	0	0	113	L491 T565 S566 S571 L572 G573	L491-G569 WeakPolarHBondContact CD1-O 3.43Å; T565-G569 PolarHBondContact O-N 3.19Å; S566-G569 PolarHBondContact O-N 2.67Å; G569-S571 VanDerWaalsContact C-N 3.33Å; G569-S571 PolarHBondContact O-N 3.18Å; G569-L572 PolarHBondContact O-N 3.11Å; G569-G573 PolarHBondContact O-N 2.66Å
570	Q	95.4	Very high	95.2	Very high	2 Å²	2	13.6 Å²	13.6	1%	0.009	8%	0.079	C	C	.	.	H	α-helix	trans	-62	-40.8	174.3	-167	-159.1	6.3	0	0	112	S490 T494 D527 S566 V568 G573 L574	S490-Q570 PolarHBondContact OG-N 3.24Å; T494-Q570 HydrophobicContact CG2-CG 4.37Å; T494-Q570 WeakPolarHBondContact OG1-CG 3.34Å; D527-Q570 VanDerWaalsContact CG-NE2 3.31Å; D527-Q570 PolarHBondContact OD2-NE2 2.98Å; S566-Q570 WeakPolarHBondContact O-CB 3.38Å; S566-Q570 PolarHBondContact O-N 3.33Å; V568-Q570 VanDerWaalsContact C-N 3.33Å; V568-Q570 PolarHBondContact O-N 3.13Å; Q570-G573 WeakPolarHBondContact O-CA 3.35Å; Q570-G573 PolarHBondContact O-N 2.63Å; Q570-G573 VanDerWaalsContact O-N 3.11Å; Q570-L574 PolarHBondContact O-N 3.43Å
571	S	96	Very high	94.9	Very high	0 Å²	0	13 Å²	13	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-66.8	-37.9	-179.5	-55.2	0	0	0	0	111.7	L567 V568 G569 G573 L574 V575 F684 R688	L567-S571 PolarHBondContact O-N 3.46Å; L567-S571 VanDerWaalsContact O-N 3.08Å; L567-S571 PolarHBondContact O-OG 3.47Å; V568-S571 WeakPolarHBondContact O-CB 3.34Å; V568-S571 PolarHBondContact O-N 2.92Å; G569-S571 VanDerWaalsContact C-N 3.33Å; G569-S571 PolarHBondContact O-N 3.18Å; S571-G573 VanDerWaalsContact C-N 3.3Å; S571-G573 PolarHBondContact O-N 2.94Å; S571-L574 PolarHBondContact O-N 3.2Å; S571-V575 WeakPolarHBondContact O-CG2 3.44Å; S571-V575 PolarHBondContact O-N 3.18Å; S571-V575 VanDerWaalsContact O-N 3.09Å; S571-F684 WeakPolarHBondContact OG-CD2 3.08Å; S571-R688 PolarHBondContact OG-NE 3.26Å
572	L	95.3	Very high	94.6	Very high	22 Å²	22	15.8 Å²	15.8	12%	0.115	10%	0.096	C	C	.	.	H	α-helix	trans	-61.5	-40.7	169.9	-178.6	62.4	0	0	0	111.2	L491 V568 G569 L574 V575 I576 I596 F621 L687	L491-L572 HydrophobicContact CD1-CB 4.06Å; L491-L572 HydrophobicContact CD1-CD2 4.2Å; L491-L572 HydrophobicContact CD1-CG 4Å; V568-L572 PolarHBondContact O-N 3.03Å; G569-L572 PolarHBondContact O-N 3.11Å; L572-L574 VanDerWaalsContact C-N 3.33Å; L572-L574 PolarHBondContact O-N 3.4Å; L572-V575 PolarHBondContact O-N 2.98Å; L572-I576 HydrophobicContact CD1-CD1 4.36Å; L572-I576 HydrophobicContact CG-CD1 4.1Å; L572-I576 WeakPolarHBondContact O-CG1 3.23Å; L572-I576 PolarHBondContact O-N 3.28Å; L572-I596 HydrophobicContact CD2-CD1 3.69Å; L572-F621 HydrophobicContact CD2-CE1 4.48Å; L572-L687 HydrophobicContact CB-CD1 4.18Å
573	G	95.4	Very high	94.5	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-61.2	-39	175.6	0	0	0	0	0	113.4	L491 G569 Q570 S571 I576 G577	L491-G573 VanDerWaalsContact CD1-CA 3.45Å; L491-G573 VanDerWaalsContact CD1-N 3.28Å; G569-G573 PolarHBondContact O-N 2.66Å; Q570-G573 WeakPolarHBondContact O-CA 3.35Å; Q570-G573 PolarHBondContact O-N 2.63Å; Q570-G573 VanDerWaalsContact O-N 3.11Å; S571-G573 VanDerWaalsContact C-N 3.3Å; S571-G573 PolarHBondContact O-N 2.94Å; G573-I576 PolarHBondContact O-N 2.9Å; G573-G577 PolarHBondContact O-N 3.35Å
574	L	94	Very high	94.4	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.005	15%	0.145	C	C	.	.	H	α-helix	trans	-65.1	-41.4	173.3	-70.5	174.1	0	0	0	112	T494 F498 Q570 S571 L572 G577 T578 R688	T494-L574 HydrophobicContact CG2-CB 4.37Å; T494-L574 HydrophobicContact CG2-CD2 3.47Å; T494-L574 VanDerWaalsContact CG2-CD2 3.47Å; T494-L574 HydrophobicContact CG2-CG 3.59Å; F498-L574 HydrophobicContact CB-CD2 4.18Å; F498-L574 HydrophobicContact CD2-CD2 3.28Å; F498-L574 HydrophobicContact CE2-CD2 3.78Å; F498-L574 HydrophobicContact CG-CD2 3.75Å; Q570-L574 PolarHBondContact O-N 3.43Å; S571-L574 PolarHBondContact O-N 3.2Å; L572-L574 VanDerWaalsContact C-N 3.33Å; L572-L574 PolarHBondContact O-N 3.4Å; L574-G577 PolarHBondContact O-N 2.81Å; L574-T578 VanDerWaalsContact O-CB 3.29Å; L574-T578 WeakPolarHBondContact O-CB 3.14Å; L574-T578 WeakPolarHBondContact O-CG2 3.47Å; L574-T578 PolarHBondContact O-N 3Å; L574-T578 PolarHBondContact O-OG1 3.46Å; L574-R688 VanDerWaalsContact CD1-CZ 3.47Å
575	V	95.6	Very high	94.2	Very high	17 Å²	17	24 Å²	24	10%	0.103	14%	0.139	C	C	.	.	H	α-helix	trans	-61.6	-47.3	176.6	169.4	0	0	0	0	110.6	S571 L572 T578 A579 L687 L690 I694	S571-V575 WeakPolarHBondContact O-CG2 3.44Å; S571-V575 PolarHBondContact O-N 3.18Å; S571-V575 VanDerWaalsContact O-N 3.09Å; L572-V575 PolarHBondContact O-N 2.98Å; V575-T578 WeakPolarHBondContact CA-OG1 3.28Å; V575-T578 PolarHBondContact O-N 2.87Å; V575-T578 PolarHBondContact O-OG1 2.55Å; V575-A579 VanDerWaalsContact O-CB 3.25Å; V575-A579 WeakPolarHBondContact O-CB 3.45Å; V575-A579 PolarHBondContact O-N 2.89Å; V575-L687 HydrophobicContact CG2-CB 4.47Å; V575-L687 HydrophobicContact CG2-CD2 4.37Å; V575-L687 VanDerWaalsContact CG2-O 3.31Å; V575-L687 WeakPolarHBondContact CG2-O 3.44Å; V575-L690 HydrophobicContact CG1-CD2 4.24Å; V575-L690 HydrophobicContact CG2-CB 4.49Å; V575-L690 HydrophobicContact CG2-CD2 4.41Å; V575-L690 HydrophobicContact CG2-CG 4.42Å; V575-I694 HydrophobicContact CG1-CD1 3.81Å
576	I	95.3	Very high	94	Very high	7 Å²	7	26.8 Å²	26.8	4%	0.036	16%	0.156	C	C	.	.	H	α-helix	trans	-62.4	-47	177.5	-68.1	170.3	0	0	0	110.9	L491 V495 L572 G573 A579 T580 A585 L588 T592	L491-I576 HydrophobicContact CD1-CD1 4.39Å; V495-I576 HydrophobicContact CG1-CG2 4.26Å; V495-I576 HydrophobicContact CG2-CB 4.22Å; V495-I576 HydrophobicContact CG2-CG2 4.06Å; L572-I576 HydrophobicContact CD1-CD1 4.36Å; L572-I576 HydrophobicContact CG-CD1 4.1Å; L572-I576 WeakPolarHBondContact O-CG1 3.23Å; L572-I576 PolarHBondContact O-N 3.28Å; G573-I576 PolarHBondContact O-N 2.9Å; I576-A579 PolarHBondContact O-N 2.92Å; I576-T580 PolarHBondContact O-N 3.32Å; I576-T580 VanDerWaalsContact O-N 3.11Å; I576-T580 PolarHBondContact O-OG1 3.22Å; I576-A585 HydrophobicContact CG2-CB 3.99Å; I576-L588 HydrophobicContact CD1-CG 4.49Å; I576-L588 HydrophobicContact CG1-CD2 4.21Å; I576-L588 HydrophobicContact CG1-CG 4.48Å; I576-L588 HydrophobicContact CG2-CB 4.13Å; I576-L588 HydrophobicContact CG2-CD2 4.1Å; I576-L588 HydrophobicContact CG2-CG 4.37Å; I576-T592 HydrophobicContact CD1-CG2 4.31Å; I576-T592 WeakPolarHBondContact CD1-OG1 3.32Å
577	G	93.1	Very high	93.9	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-68.3	-34	-179	0	0	0	0	0	114	G573 L574	G573-G577 PolarHBondContact O-N 3.35Å; L574-G577 PolarHBondContact O-N 2.81Å
578	T	92.2	Very high	93.8	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-72	-34.9	174.2	52.1	0	0	0	0	112.3	F498 L574 V575 L695 R698	F498-T578 HydrophobicContact CD1-CG2 3.81Å; F498-T578 HydrophobicContact CE1-CG2 3.07Å; F498-T578 HydrophobicContact CZ-CG2 3.55Å; L574-T578 VanDerWaalsContact O-CB 3.29Å; L574-T578 WeakPolarHBondContact O-CB 3.14Å; L574-T578 WeakPolarHBondContact O-CG2 3.47Å; L574-T578 PolarHBondContact O-N 3Å; L574-T578 PolarHBondContact O-OG1 3.46Å; V575-T578 WeakPolarHBondContact CA-OG1 3.28Å; V575-T578 PolarHBondContact O-N 2.87Å; V575-T578 PolarHBondContact O-OG1 2.55Å; T578-L695 HydrophobicContact CG2-CB 4.25Å; T578-R698 WeakPolarHBondContact O-CD 3.4Å; T578-R698 PolarHBondContact O-NH1 3.48Å
579	A	91.7	Very high	93.6	Very high	53 Å²	53	36 Å²	36	44%	0.438	20%	0.197	S	C	.	.	H	α-helix	trans	-81.5	-35.1	-173.8	0	0	0	0	0	113.3	V575 I576 I694	V575-A579 VanDerWaalsContact O-CB 3.25Å; V575-A579 WeakPolarHBondContact O-CB 3.45Å; V575-A579 PolarHBondContact O-N 2.89Å; I576-A579 PolarHBondContact O-N 2.92Å; A579-I694 HydrophobicContact CB-CG2 4.06Å
580	T	89.9	Confident	93.4	Very high	26 Å²	26	38.4 Å²	38.4	16%	0.16	21%	0.213	C	C	.	.	S	Bend	trans	-116.3	174.6	-166.6	62.8	0	0	0	0	112.9	I576 V584 A585 L588 R698	I576-T580 PolarHBondContact O-N 3.32Å; I576-T580 VanDerWaalsContact O-N 3.11Å; I576-T580 PolarHBondContact O-OG1 3.22Å; T580-V584 HydrophobicContact CG2-CG1 3.98Å; T580-A585 WeakPolarHBondContact OG1-CA 3.36Å; T580-A585 VanDerWaalsContact OG1-CB 3.26Å; T580-A585 WeakPolarHBondContact OG1-CB 3.23Å; T580-L588 HydrophobicContact CG2-CD2 4.22Å; T580-R698 PolarHBondContact O-NH1 2.9Å
581	S	90.8	Very high	93.3	Very high	60 Å²	60	42.7 Å²	42.7	42%	0.42	24%	0.239	S	C	.	.			trans	-82.4	156.9	166	55.2	0	0	0	0	110.2	Q583 V584 A585	S581-Q583 VanDerWaalsContact C-N 3.32Å; S581-Q583 PolarHBondContact O-N 2.92Å; S581-V584 PolarHBondContact O-N 3.05Å; S581-V584 VanDerWaalsContact O-N 3.16Å; S581-V584 WeakPolarHBondContact OG-CG2 3.26Å; S581-A585 WeakPolarHBondContact O-CB 3.28Å; S581-A585 PolarHBondContact O-N 3.09Å
582	L	90.9	Very high	93.1	Very high	60 Å²	60	44.5 Å²	44.5	31%	0.314	25%	0.25	S	S	.	.	H	α-helix	trans	-48.3	-48.3	-177.9	179.1	60.5	0	0	0	114	M496 P499 L500 A585 V586	M496-L582 HydrophobicContact CB-CD1 4.34Å; M496-L582 WeakPolarHBondContact O-CD1 3.26Å; P499-L582 HydrophobicContact CB-CB 4.23Å; P499-L582 HydrophobicContact CG-CD1 4.48Å; L500-L582 HydrophobicContact CD2-CD2 4.04Å; L500-L582 HydrophobicContact CG-CD2 4.35Å; L582-A585 WeakPolarHBondContact O-CB 3.08Å; L582-A585 PolarHBondContact O-N 3.3Å; L582-V586 HydrophobicContact CD1-CG2 4.21Å; L582-V586 WeakPolarHBondContact O-CG2 3.44Å; L582-V586 PolarHBondContact O-N 3.42Å; L582-V586 VanDerWaalsContact O-N 3.1Å
583	Q	93.9	Very high	92.8	Very high	156 Å²	156	43.4 Å²	43.4	73%	0.729	25%	0.245	S	C	*	.	H	α-helix	trans	-58.9	-52.3	-178.8	-66.9	173.1	-8.4	0	0	111.6	S581 A585 V586 F587	S581-Q583 VanDerWaalsContact C-N 3.32Å; S581-Q583 PolarHBondContact O-N 2.92Å; Q583-A585 VanDerWaalsContact C-N 3.32Å; Q583-A585 PolarHBondContact O-N 2.99Å; Q583-V586 PolarHBondContact O-N 3.2Å; Q583-F587 WeakPolarHBondContact O-CD2 3.47Å; Q583-F587 PolarHBondContact O-N 3.47Å
584	V	94.4	Very high	92.5	Very high	74 Å²	74	47.8 Å²	47.8	45%	0.448	27%	0.267	S	S	.	.	H	α-helix	trans	-62.4	-39	177	178.7	0	0	0	0	111.8	T580 S581 V586 F587 L588	T580-V584 HydrophobicContact CG2-CG1 3.98Å; S581-V584 PolarHBondContact O-N 3.05Å; S581-V584 VanDerWaalsContact O-N 3.16Å; S581-V584 WeakPolarHBondContact OG-CG2 3.26Å; V584-V586 PolarHBondContact O-N 2.98Å; V584-F587 PolarHBondContact O-N 3.26Å; V584-L588 WeakPolarHBondContact O-CB 3.29Å; V584-L588 PolarHBondContact O-N 3.5Å
585	A	93.1	Very high	92.2	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-60	-45.8	-178.9	0	0	0	0	0	111.5	V495 P499 I576 T580 S581 L582 Q583 F587 L588 G589	V495-A585 HydrophobicContact CG1-CB 3.69Å; V495-A585 WeakPolarHBondContact CG1-O 3.45Å; P499-A585 HydrophobicContact CG-CB 4.4Å; I576-A585 HydrophobicContact CG2-CB 3.99Å; T580-A585 WeakPolarHBondContact OG1-CA 3.36Å; T580-A585 VanDerWaalsContact OG1-CB 3.26Å; T580-A585 WeakPolarHBondContact OG1-CB 3.23Å; S581-A585 WeakPolarHBondContact O-CB 3.28Å; S581-A585 PolarHBondContact O-N 3.09Å; L582-A585 WeakPolarHBondContact O-CB 3.08Å; L582-A585 PolarHBondContact O-N 3.3Å; Q583-A585 VanDerWaalsContact C-N 3.32Å; Q583-A585 PolarHBondContact O-N 2.99Å; A585-F587 VanDerWaalsContact C-N 3.31Å; A585-F587 PolarHBondContact O-N 3.41Å; A585-L588 PolarHBondContact O-N 2.88Å; A585-L588 VanDerWaalsContact O-N 3.15Å; A585-G589 PolarHBondContact O-N 3.14Å
586	V	92.7	Very high	92	Very high	60 Å²	60	51.2 Å²	51.2	36%	0.364	29%	0.288	S	S	.	.	H	α-helix	trans	-61.1	-38.3	179.1	172.9	0	0	0	0	111.8	M496 L582 Q583 V584 P590	M496-V586 HydrophobicContact CG-CG2 3.98Å; L582-V586 HydrophobicContact CD1-CG2 4.21Å; L582-V586 WeakPolarHBondContact O-CG2 3.44Å; L582-V586 PolarHBondContact O-N 3.42Å; L582-V586 VanDerWaalsContact O-N 3.1Å; Q583-V586 PolarHBondContact O-N 3.2Å; V584-V586 PolarHBondContact O-N 2.98Å; V586-P590 WeakPolarHBondContact O-CD 3.39Å
587	F	94.2	Very high	91.7	Very high	158 Å²	158	52.3 Å²	52.3	69%	0.693	29%	0.294	S	S	*	.	H	α-helix	trans	-71.9	-38.9	173.5	-73.9	-72.7	0	0	0	112.8	Q583 V584 A585 G589 P590 V591	Q583-F587 WeakPolarHBondContact O-CD2 3.47Å; Q583-F587 PolarHBondContact O-N 3.47Å; V584-F587 PolarHBondContact O-N 3.26Å; A585-F587 VanDerWaalsContact C-N 3.31Å; A585-F587 PolarHBondContact O-N 3.41Å; F587-G589 VanDerWaalsContact C-N 3.31Å; F587-G589 PolarHBondContact O-N 3.31Å; F587-P590 WeakPolarHBondContact O-CD 3.35Å; F587-V591 VanDerWaalsContact O-CG2 3.24Å; F587-V591 WeakPolarHBondContact O-CG2 3.34Å
588	L	93.4	Very high	91.6	Very high	59 Å²	59	56 Å²	56	31%	0.309	31%	0.313	S	S	.	.	H	α-helix	trans	-70.8	-27.7	-176.4	-168.1	61.7	0	0	0	112.5	I576 T580 V584 A585 V591 T592	I576-L588 HydrophobicContact CD1-CG 4.49Å; I576-L588 HydrophobicContact CG1-CD2 4.21Å; I576-L588 HydrophobicContact CG1-CG 4.48Å; I576-L588 HydrophobicContact CG2-CB 4.13Å; I576-L588 HydrophobicContact CG2-CD2 4.1Å; I576-L588 HydrophobicContact CG2-CG 4.37Å; T580-L588 HydrophobicContact CG2-CD2 4.22Å; V584-L588 WeakPolarHBondContact O-CB 3.29Å; V584-L588 PolarHBondContact O-N 3.5Å; A585-L588 PolarHBondContact O-N 2.88Å; A585-L588 VanDerWaalsContact O-N 3.15Å; L588-V591 PolarHBondContact O-N 2.95Å; L588-T592 HydrophobicContact CD1-CG2 3.7Å; L588-T592 HydrophobicContact CG-CG2 3.76Å; L588-T592 WeakPolarHBondContact O-CB 3.47Å; L588-T592 VanDerWaalsContact O-CG2 3.32Å; L588-T592 WeakPolarHBondContact O-CG2 3.09Å; L588-T592 PolarHBondContact O-N 3.37Å; L588-T592 PolarHBondContact O-OG1 2.87Å
589	G	92.4	Very high	91.5	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-52.3	-62.7	177.3	0	0	0	0	0	113.1	A585 F587 T592 G593	A585-G589 PolarHBondContact O-N 3.14Å; F587-G589 VanDerWaalsContact C-N 3.31Å; F587-G589 PolarHBondContact O-N 3.31Å; G589-T592 PolarHBondContact O-OG1 3.4Å; G589-G593 PolarHBondContact O-N 3.49Å; G589-G593 VanDerWaalsContact O-N 3.11Å
590	P	92.1	Very high	91.3	Very high	52 Å²	52	54.9 Å²	54.9	34%	0.338	30%	0.298	S	S	.	.	H	α-helix	trans	-66	-39.7	179.5	-21.1	31.9	0	0	0	112.6	M492 V586 F587 T592 G593 I594	M492-P590 HydrophobicContact CE-CB 4.34Å; M492-P590 HydrophobicContact CE-CG 3.62Å; V586-P590 WeakPolarHBondContact O-CD 3.39Å; F587-P590 WeakPolarHBondContact O-CD 3.35Å; P590-T592 VanDerWaalsContact C-N 3.29Å; P590-T592 PolarHBondContact O-N 3.4Å; P590-G593 PolarHBondContact O-N 3.29Å; P590-G593 VanDerWaalsContact O-N 3.09Å; P590-I594 WeakPolarHBondContact O-CG1 3.48Å; P590-I594 PolarHBondContact O-N 3.46Å
591	V	93.6	Very high	91.1	Very high	91 Å²	91	54.2 Å²	54.2	55%	0.552	30%	0.297	S	S	*	.	H	α-helix	trans	-61.9	-36.4	-178	172.6	0	0	0	0	111.8	F587 L588 P595	F587-V591 VanDerWaalsContact O-CG2 3.24Å; F587-V591 WeakPolarHBondContact O-CG2 3.34Å; L588-V591 PolarHBondContact O-N 2.95Å; V591-P595 WeakPolarHBondContact O-CD 3.26Å
592	T	91.2	Very high	90.9	Very high	38 Å²	38	53.8 Å²	53.8	23%	0.233	29%	0.287	C	S	.	.	H	α-helix	trans	-78.4	-32.1	173.8	53.6	0	0	0	0	112.7	I576 L588 G589 P590 I596	I576-T592 HydrophobicContact CD1-CG2 4.31Å; I576-T592 WeakPolarHBondContact CD1-OG1 3.32Å; L588-T592 HydrophobicContact CD1-CG2 3.7Å; L588-T592 HydrophobicContact CG-CG2 3.76Å; L588-T592 WeakPolarHBondContact O-CB 3.47Å; L588-T592 VanDerWaalsContact O-CG2 3.32Å; L588-T592 WeakPolarHBondContact O-CG2 3.09Å; L588-T592 PolarHBondContact O-N 3.37Å; L588-T592 PolarHBondContact O-OG1 2.87Å; G589-T592 PolarHBondContact O-OG1 3.4Å; P590-T592 VanDerWaalsContact C-N 3.29Å; P590-T592 PolarHBondContact O-N 3.4Å; T592-I596 WeakPolarHBondContact O-CD1 3.34Å; T592-I596 WeakPolarHBondContact O-CG1 3.33Å
593	G	89.1	Confident	90.6	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-66.4	-36.9	177.4	0	0	0	0	0	113.9	G589 P590 I596 L597	G589-G593 PolarHBondContact O-N 3.49Å; G589-G593 VanDerWaalsContact O-N 3.11Å; P590-G593 PolarHBondContact O-N 3.29Å; P590-G593 VanDerWaalsContact O-N 3.09Å; G593-I596 PolarHBondContact O-N 3.33Å; G593-L597 WeakPolarHBondContact O-CB 3.44Å; G593-L597 PolarHBondContact O-N 2.97Å
594	I	89.7	Confident	90.1	Very high	92 Å²	92	52 Å²	52	47%	0.472	28%	0.278	S	S	.	.	H	α-helix	trans	-62.9	-50.3	-175.5	-68.2	162.1	0	0	0	112.8	P590 I596 L597 L598	P590-I594 WeakPolarHBondContact O-CG1 3.48Å; P590-I594 PolarHBondContact O-N 3.46Å; I594-I596 VanDerWaalsContact C-N 3.33Å; I594-I596 PolarHBondContact O-N 3.48Å; I594-L597 VanDerWaalsContact O-CB 3.3Å; I594-L597 WeakPolarHBondContact O-CB 3.3Å; I594-L597 PolarHBondContact O-N 2.89Å; I594-L597 VanDerWaalsContact O-N 3.14Å; I594-L598 HydrophobicContact CG2-CD1 4Å; I594-L598 HydrophobicContact CG2-CG 4.33Å; I594-L598 WeakPolarHBondContact O-CG 3.26Å; I594-L598 PolarHBondContact O-N 2.75Å
595	P	87.8	Confident	89.4	Confident	60 Å²	60	51.6 Å²	51.6	39%	0.39	27%	0.273	S	S	.	.	H	α-helix	trans	-60.8	-41.8	176.1	-25.5	34.9	0	0	0	112.7	V591 L597 L598 F599	V591-P595 WeakPolarHBondContact O-CD 3.26Å; P595-L597 PolarHBondContact O-N 3.11Å; P595-L598 PolarHBondContact O-N 3.47Å; P595-F599 VanDerWaalsContact O-CD2 3.22Å; P595-F599 WeakPolarHBondContact O-CD2 3.19Å; P595-F599 PolarHBondContact O-N 2.72Å
596	I	90.8	Very high	88.5	Confident	30 Å²	30	53.1 Å²	53.1	15%	0.154	28%	0.281	C	S	.	.	H	α-helix	trans	-57	-42.7	176.4	-64.8	171.4	0	0	0	109.3	M487 L572 T592 G593 I594 S600 S620 F621 T622	M487-I596 HydrophobicContact SD-CG2 4.45Å; L572-I596 HydrophobicContact CD2-CD1 3.69Å; T592-I596 WeakPolarHBondContact O-CD1 3.34Å; T592-I596 WeakPolarHBondContact O-CG1 3.33Å; G593-I596 PolarHBondContact O-N 3.33Å; I594-I596 VanDerWaalsContact C-N 3.33Å; I594-I596 PolarHBondContact O-N 3.48Å; I596-S600 PolarHBondContact O-N 2.94Å; I596-S620 WeakPolarHBondContact CG2-OG 3.4Å; I596-S620 WeakPolarHBondContact O-CB 3.21Å; I596-S620 PolarHBondContact O-OG 3.38Å; I596-F621 HydrophobicContact CD1-CE1 4.04Å; I596-F621 HydrophobicContact CG2-CD1 4.15Å; I596-F621 HydrophobicContact CG2-CE1 3.85Å; I596-F621 HydrophobicContact CG2-CZ 4.29Å; I596-T622 HydrophobicContact CG2-CG2 3.61Å; I596-T622 PolarHBondContact O-OG1 3.3Å; I596-T622 VanDerWaalsContact O-OG1 3.04Å
597	L	89.7	Confident	87.8	Confident	29 Å²	29	59.1 Å²	59.1	15%	0.152	30%	0.298	C	S	.	.	H	α-helix	trans	-65.6	-47.7	179	-170	64.1	0	0	0	113.7	F480 L484 G593 I594 P595 F599 S600	F480-L597 HydrophobicContact CE1-CD1 4.11Å; F480-L597 HydrophobicContact CE2-CD1 3.45Å; F480-L597 VanDerWaalsContact CE2-CD1 3.45Å; F480-L597 HydrophobicContact CE2-CG 4.27Å; F480-L597 HydrophobicContact CZ-CD1 3.12Å; F480-L597 HydrophobicContact CZ-CD2 4.26Å; F480-L597 HydrophobicContact CZ-CG 3.64Å; L484-L597 HydrophobicContact CB-CD1 4.45Å; L484-L597 HydrophobicContact CD1-CD1 3.35Å; L484-L597 HydrophobicContact CD1-CD2 3.92Å; L484-L597 HydrophobicContact CD1-CG 4.21Å; L484-L597 HydrophobicContact CD2-CD1 4.2Å; L484-L597 HydrophobicContact CD2-CD2 4.08Å; L484-L597 HydrophobicContact CG-CD1 4.2Å; G593-L597 WeakPolarHBondContact O-CB 3.44Å; G593-L597 PolarHBondContact O-N 2.97Å; I594-L597 VanDerWaalsContact O-CB 3.3Å; I594-L597 WeakPolarHBondContact O-CB 3.3Å; I594-L597 PolarHBondContact O-N 2.89Å; I594-L597 VanDerWaalsContact O-N 3.14Å; P595-L597 PolarHBondContact O-N 3.11Å; L597-F599 PolarHBondContact O-N 3.16Å; L597-S600 WeakPolarHBondContact O-CB 3.12Å; L597-S600 PolarHBondContact O-N 3.12Å; L597-S600 VanDerWaalsContact O-N 3.12Å; L597-S600 PolarHBondContact O-OG 2.81Å
598	L	90	Very high	87.4	Confident	77 Å²	77	55.2 Å²	55.2	40%	0.403	30%	0.295	S	S	.	.	H	α-helix	trans	-59.9	-35.6	-177.5	-73.8	172.2	0	0	0	111.6	I594 P595	I594-L598 HydrophobicContact CG2-CD1 4Å; I594-L598 HydrophobicContact CG2-CG 4.33Å; I594-L598 WeakPolarHBondContact O-CG 3.26Å; I594-L598 PolarHBondContact O-N 2.75Å; P595-L598 PolarHBondContact O-N 3.47Å
599	F	89.2	Confident	87	Confident	30 Å²	30	52.9 Å²	52.9	13%	0.132	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	14	179.8	-67.2	-68	0	0	0	114.8	P595 L597 G601 I609 I616	P595-F599 VanDerWaalsContact O-CD2 3.22Å; P595-F599 WeakPolarHBondContact O-CD2 3.19Å; P595-F599 PolarHBondContact O-N 2.72Å; L597-F599 PolarHBondContact O-N 3.16Å; F599-G601 PolarHBondContact O-N 2.91Å; F599-I609 HydrophobicContact CD1-CD1 3.67Å; F599-I609 HydrophobicContact CE1-CD1 3.88Å; F599-I609 HydrophobicContact CE1-CG1 4.29Å; F599-I609 HydrophobicContact CE1-CG2 4.13Å; F599-I616 HydrophobicContact CD2-CG2 3.67Å; F599-I616 HydrophobicContact CE2-CB 4.33Å; F599-I616 HydrophobicContact CE2-CG2 3.63Å; F599-I616 HydrophobicContact CG-CG2 4.36Å; F599-I616 HydrophobicContact CZ-CB 4.49Å; F599-I616 HydrophobicContact CZ-CG2 4.26Å
600	S	89.4	Confident	86.8	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.007	30%	0.301	C	S	.	.	S	Bend	trans	-65.1	-14.8	176.2	61.1	0	0	0	0	114.8	F480 I596 L597 F602 R623	F480-S600 WeakPolarHBondContact CE2-OG 3.38Å; I596-S600 PolarHBondContact O-N 2.94Å; L597-S600 WeakPolarHBondContact O-CB 3.12Å; L597-S600 PolarHBondContact O-N 3.12Å; L597-S600 VanDerWaalsContact O-N 3.12Å; L597-S600 PolarHBondContact O-OG 2.81Å; S600-F602 PolarHBondContact OG-N 2.92Å; S600-R623 VanDerWaalsContact O-CA 3.27Å; S600-R623 WeakPolarHBondContact O-CA 2.98Å
601	G	85	Confident	86.7	Confident	12 Å²	12	62 Å²	62	12%	0.124	32%	0.324	C	S	.	.	S	Bend	trans	87.9	-2.9	-175.1	0	0	0	0	0	115.2	F599 L604	F599-G601 PolarHBondContact O-N 2.91Å; G601-L604 WeakPolarHBondContact CA-O 3.48Å
602	F	87.3	Confident	86.5	Confident	50 Å²	50	65.8 Å²	65.8	22%	0.219	33%	0.329	C	S	.	.	S	Bend	trans	-82.5	-50.6	172.3	176.5	-105.6	0	0	0	112.5	A476 A477 F480 S600 F626	A476-F602 HydrophobicContact CB-CE2 4.34Å; A477-F602 HydrophobicContact CB-CE2 3.92Å; A477-F602 HydrophobicContact CB-CZ 3.6Å; F480-F602 HydrophobicContact CB-CB 4.3Å; F480-F602 HydrophobicContact CB-CD1 4.27Å; F480-F602 HydrophobicContact CB-CD2 4.18Å; F480-F602 HydrophobicContact CB-CG 3.98Å; F480-F602 AromaticContact CD1-CD1 3.59Å; F480-F602 HydrophobicContact CD1-CD1 3.59Å; F480-F602 AromaticContact CD1-CE1 3.99Å; F480-F602 HydrophobicContact CD1-CE1 3.99Å; F480-F602 HydrophobicContact CD1-CG 4.12Å; F480-F602 HydrophobicContact CD2-CB 3.57Å; F480-F602 HydrophobicContact CD2-CD1 4.14Å; F480-F602 AromaticContact CD2-CG 3.97Å; F480-F602 HydrophobicContact CD2-CG 3.97Å; F480-F602 AromaticContact CE1-CD1 3.85Å; F480-F602 HydrophobicContact CE1-CD1 3.85Å; F480-F602 HydrophobicContact CE1-CE1 4.36Å; F480-F602 HydrophobicContact CE2-CB 3.96Å; F480-F602 HydrophobicContact CE2-CD1 4.37Å; F480-F602 HydrophobicContact CE2-CG 4.49Å; F480-F602 HydrophobicContact CG-CB 3.89Å; F480-F602 AromaticContact CG-CD1 3.72Å; F480-F602 HydrophobicContact CG-CD1 3.72Å; F480-F602 HydrophobicContact CG-CD2 4.42Å; F480-F602 HydrophobicContact CG-CE1 4.39Å; F480-F602 AromaticContact CG-CG 3.74Å; F480-F602 HydrophobicContact CG-CG 3.74Å; F480-F602 HydrophobicContact CZ-CD1 4.19Å; S600-F602 PolarHBondContact OG-N 2.92Å; F602-F626 HydrophobicContact CB-CE1 4.14Å; F602-F626 HydrophobicContact CB-CE2 4.41Å; F602-F626 HydrophobicContact CB-CZ 4.06Å; F602-F626 HydrophobicContact CD2-CE2 4.27Å; F602-F626 AromaticContact CD2-CZ 3.87Å; F602-F626 HydrophobicContact CD2-CZ 3.87Å; F602-F626 HydrophobicContact CG-CZ 4.43Å
603	F	84.7	Confident	86.3	Confident	110 Å²	110	66.8 Å²	66.8	48%	0.482	33%	0.332	S	S	.	.	S	Bend	trans	-83.4	-33.2	-178.3	-70.1	-63.3	0	0	0	113.8	F480	F480-F603 HydrophobicContact CE1-CD2 4.23Å; F480-F603 AromaticContact CE1-CE2 3.38Å; F480-F603 HydrophobicContact CE1-CE2 3.38Å; F480-F603 AromaticContact CE1-CZ 3.74Å; F480-F603 HydrophobicContact CE1-CZ 3.74Å; F480-F603 HydrophobicContact CE2-CE2 4.42Å; F480-F603 AromaticContact CZ-CD2 3.8Å; F480-F603 HydrophobicContact CZ-CD2 3.8Å; F480-F603 AromaticContact CZ-CE2 3.3Å; F480-F603 HydrophobicContact CZ-CE2 3.3Å; F480-F603 HydrophobicContact CZ-CZ 4.14Å
604	L	83.1	Confident	86.2	Confident	69 Å²	69	69.6 Å²	69.6	36%	0.361	35%	0.346	S	S	.	.	S	Bend	trans	-125.9	118.5	-177.6	-65.8	175.3	0	0	0	109.5	G601 I609	G601-L604 WeakPolarHBondContact CA-O 3.48Å; L604-I609 HydrophobicContact CB-CD1 4.33Å; L604-I609 HydrophobicContact CB-CG1 4.23Å
605	N	78.4	Confident	86.1	Confident	66 Å²	66	73.1 Å²	73.1	35%	0.353	35%	0.353	S	S	.	.			trans	-68.5	142.6	169.6	-76.7	-33	0	0	0	110	Y607 A608 I609 N667	N605-Y607 PolarHBondContact O-N 3.35Å; N605-Y607 VanDerWaalsContact O-N 3.16Å; N605-A608 HydrophobicContact CB-CB 4.42Å; N605-A608 WeakPolarHBondContact O-CB 3.42Å; N605-A608 PolarHBondContact O-N 2.91Å; N605-I609 PolarHBondContact O-N 2.86Å; N605-N667 PolarHBondContact ND2-ND2 3.44Å
606	L	74.7	Confident	86	Confident	31 Å²	31	72.3 Å²	72.3	16%	0.162	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-51.3	-42	179.1	-80.6	-178.1	0	0	0	113	A608 I609 Q614 S617 R623	L606-A608 VanDerWaalsContact C-N 3.27Å; L606-A608 PolarHBondContact O-N 3.02Å; L606-I609 PolarHBondContact O-N 3.37Å; L606-Q614 PolarHBondContact O-NE2 3.49Å; L606-S617 WeakPolarHBondContact CD2-OG 3.25Å; L606-R623 VanDerWaalsContact CD2-NH1 3.35Å; L606-R623 VanDerWaalsContact CG-NH1 3.3Å
607	Y	78.6	Confident	85.8	Confident	187 Å²	187	70.9 Å²	70.9	73%	0.733	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-71.2	-21.4	-177.5	-58.6	-69.5	0	0	0	113.4	N605 N667	N605-Y607 PolarHBondContact O-N 3.35Å; N605-Y607 VanDerWaalsContact O-N 3.16Å; Y607-N667 HydrophobicContact CE2-CB 4.42Å
608	A	84.9	Confident	85.7	Confident	75 Å²	75	74.9 Å²	74.9	62%	0.62	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-82.3	-17.6	176	0	0	0	0	0	112.5	N605 L606	N605-A608 HydrophobicContact CB-CB 4.42Å; N605-A608 WeakPolarHBondContact O-CB 3.42Å; N605-A608 PolarHBondContact O-N 2.91Å; L606-A608 VanDerWaalsContact C-N 3.27Å; L606-A608 PolarHBondContact O-N 3.02Å
609	I	85.4	Confident	85.6	Confident	10 Å²	10	76.3 Å²	76.3	5%	0.051	36%	0.362	C	S	.	.	S	Bend	trans	-79	129.2	179.2	-59.8	164.8	0	0	0	108.7	F599 L604 N605 L606 K611 L613 Q614	F599-I609 HydrophobicContact CD1-CD1 3.67Å; F599-I609 HydrophobicContact CE1-CD1 3.88Å; F599-I609 HydrophobicContact CE1-CG1 4.29Å; F599-I609 HydrophobicContact CE1-CG2 4.13Å; L604-I609 HydrophobicContact CB-CD1 4.33Å; L604-I609 HydrophobicContact CB-CG1 4.23Å; N605-I609 PolarHBondContact O-N 2.86Å; L606-I609 PolarHBondContact O-N 3.37Å; I609-K611 PolarHBondContact O-N 3.25Å; I609-L613 HydrophobicContact CG2-CB 3.72Å; I609-Q614 HydrophobicContact CB-CG 4.02Å; I609-Q614 HydrophobicContact CG2-CG 3.99Å; I609-Q614 WeakPolarHBondContact O-CG 3.18Å; I609-Q614 PolarHBondContact O-NE2 3.38Å
610	P	89.2	Confident	85.8	Confident	60 Å²	60	75 Å²	75	39%	0.39	36%	0.356	S	S	.	.			trans	-54	138.3	175.1	-25.4	33.4	0	0	0	111.8	Y612 L613 Q614	P610-Y612 HydrophobicContact CB-CD1 3.66Å; P610-Y612 HydrophobicContact CB-CE1 3.19Å; P610-Y612 HydrophobicContact CG-CE1 4.05Å; P610-Y612 PolarHBondContact O-N 3.11Å; P610-L613 PolarHBondContact O-N 3.28Å; P610-Q614 PolarHBondContact O-N 2.95Å
611	K	88.1	Confident	86	Confident	185 Å²	185	75.2 Å²	75.2	80%	0.804	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.6	-35.4	-173.5	-68.1	-175.7	-179.8	179.6	0	113.9	I609 L613 Q614	I609-K611 PolarHBondContact O-N 3.25Å; K611-L613 VanDerWaalsContact C-N 3.31Å; K611-L613 PolarHBondContact O-N 3.42Å; K611-Q614 PolarHBondContact O-N 3.06Å
612	Y	89.9	Confident	86.4	Confident	170 Å²	170	75 Å²	75	67%	0.667	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-18.8	179.1	66.6	-91.4	0	0	0	114.6	P610 W615	P610-Y612 HydrophobicContact CB-CD1 3.66Å; P610-Y612 HydrophobicContact CB-CE1 3.19Å; P610-Y612 HydrophobicContact CG-CE1 4.05Å; P610-Y612 PolarHBondContact O-N 3.11Å; Y612-W615 PolarHBondContact O-NE1 2.98Å
613	L	88.4	Confident	86.6	Confident	58 Å²	58	73.3 Å²	73.3	30%	0.304	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	-11.9	175.9	-65.6	173	0	0	0	113.5	I609 P610 K611 W615 I616	I609-L613 HydrophobicContact CG2-CB 3.72Å; P610-L613 PolarHBondContact O-N 3.28Å; K611-L613 VanDerWaalsContact C-N 3.31Å; K611-L613 PolarHBondContact O-N 3.42Å; L613-W615 PolarHBondContact O-N 3.04Å; L613-W615 VanDerWaalsContact O-N 3.12Å; L613-I616 HydrophobicContact CD2-CD1 3.68Å; L613-I616 WeakPolarHBondContact O-CB 3.4Å; L613-I616 PolarHBondContact O-N 3.46Å
614	Q	85.7	Confident	87.1	Confident	60 Å²	60	69.4 Å²	69.4	28%	0.28	33%	0.328	S	S	.	.	H	α-helix	trans	-55.9	-33.9	-175.6	-76.8	178.2	-6.7	0	0	112.7	L606 I609 P610 K611 I616 S617	L606-Q614 PolarHBondContact O-NE2 3.49Å; I609-Q614 HydrophobicContact CB-CG 4.02Å; I609-Q614 HydrophobicContact CG2-CG 3.99Å; I609-Q614 WeakPolarHBondContact O-CG 3.18Å; I609-Q614 PolarHBondContact O-NE2 3.38Å; P610-Q614 PolarHBondContact O-N 2.95Å; K611-Q614 PolarHBondContact O-N 3.06Å; Q614-I616 VanDerWaalsContact C-N 3.25Å; Q614-I616 PolarHBondContact O-N 3.23Å; Q614-S617 WeakPolarHBondContact O-CB 3.34Å; Q614-S617 PolarHBondContact O-N 3.42Å; Q614-S617 PolarHBondContact O-OG 3.13Å
615	W	87.9	Confident	87.7	Confident	165 Å²	165	66.1 Å²	66.1	63%	0.625	31%	0.31	S	S	*	.	H	α-helix	trans	-61.9	-30.5	179.8	69.2	-90.7	0	0	0	113.6	Y612 L613 S617 F618	Y612-W615 PolarHBondContact O-NE1 2.98Å; L613-W615 PolarHBondContact O-N 3.04Å; L613-W615 VanDerWaalsContact O-N 3.12Å; W615-S617 PolarHBondContact O-N 2.76Å; W615-F618 PolarHBondContact O-N 3.41Å; W615-F618 VanDerWaalsContact O-N 3.15Å
616	I	86	Confident	88.4	Confident	44 Å²	44	63.2 Å²	63.2	23%	0.226	30%	0.295	C	S	.	.	H	α-helix	trans	-63.2	-29.3	177.7	-59.8	174.6	0	0	0	110.5	F599 L613 Q614 F618 L619	F599-I616 HydrophobicContact CD2-CG2 3.67Å; F599-I616 HydrophobicContact CE2-CB 4.33Å; F599-I616 HydrophobicContact CE2-CG2 3.63Å; F599-I616 HydrophobicContact CG-CG2 4.36Å; F599-I616 HydrophobicContact CZ-CB 4.49Å; F599-I616 HydrophobicContact CZ-CG2 4.26Å; L613-I616 HydrophobicContact CD2-CD1 3.68Å; L613-I616 WeakPolarHBondContact O-CB 3.4Å; L613-I616 PolarHBondContact O-N 3.46Å; Q614-I616 VanDerWaalsContact C-N 3.25Å; Q614-I616 PolarHBondContact O-N 3.23Å; I616-F618 VanDerWaalsContact C-N 3.28Å; I616-F618 PolarHBondContact O-N 3.02Å; I616-L619 VanDerWaalsContact O-CB 3.3Å; I616-L619 WeakPolarHBondContact O-CB 3.33Å; I616-L619 PolarHBondContact O-N 3Å
617	S	85.9	Confident	89.3	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-65.3	-30.7	178.1	75.8	0	0	0	0	113.7	L606 Q614 W615 L619 S620 R623	L606-S617 WeakPolarHBondContact CD2-OG 3.25Å; Q614-S617 WeakPolarHBondContact O-CB 3.34Å; Q614-S617 PolarHBondContact O-N 3.42Å; Q614-S617 PolarHBondContact O-OG 3.13Å; W615-S617 PolarHBondContact O-N 2.76Å; S617-L619 PolarHBondContact O-N 3.44Å; S617-S620 PolarHBondContact O-N 3.11Å; S617-R623 VanDerWaalsContact O-CD 3.26Å; S617-R623 WeakPolarHBondContact O-CD 3.5Å
618	F	87.6	Confident	90.1	Very high	112 Å²	112	53 Å²	53	49%	0.491	25%	0.253	S	S	.	.	H	α-helix	trans	-74.5	-15.8	173.5	-59.6	-70.3	0	0	0	112.7	W615 I616 S620 Y624	W615-F618 PolarHBondContact O-N 3.41Å; W615-F618 VanDerWaalsContact O-N 3.15Å; I616-F618 VanDerWaalsContact C-N 3.28Å; I616-F618 PolarHBondContact O-N 3.02Å; F618-S620 VanDerWaalsContact C-N 3.33Å; F618-Y624 WeakPolarHBondContact O-CE2 3.48Å
619	L	88.8	Confident	90.5	Very high	108 Å²	108	49.4 Å²	49.4	57%	0.565	22%	0.224	S	C	*	.	H	α-helix	trans	-80.2	-17.8	173.3	-166.4	65	0	0	0	112.1	I616 S617 F621 F683	I616-L619 VanDerWaalsContact O-CB 3.3Å; I616-L619 WeakPolarHBondContact O-CB 3.33Å; I616-L619 PolarHBondContact O-N 3Å; S617-L619 PolarHBondContact O-N 3.44Å; L619-F621 PolarHBondContact O-N 3.27Å; L619-F683 HydrophobicContact CD1-CE1 4.38Å; L619-F683 WeakPolarHBondContact O-CZ 3.39Å
620	S	92.5	Very high	90.9	Very high	2 Å²	2	48.9 Å²	48.9	1%	0.014	22%	0.221	C	C	.	.			trans	-79.4	105.5	177.3	-179.4	0	0	0	0	111	I596 S617 F618 T622 R623 Y624	I596-S620 WeakPolarHBondContact CG2-OG 3.4Å; I596-S620 WeakPolarHBondContact O-CB 3.21Å; I596-S620 PolarHBondContact O-OG 3.38Å; S617-S620 PolarHBondContact O-N 3.11Å; F618-S620 VanDerWaalsContact C-N 3.33Å; S620-T622 PolarHBondContact O-N 3.29Å; S620-T622 PolarHBondContact OG-N 3.3Å; S620-T622 PolarHBondContact OG-OG1 3.33Å; S620-R623 WeakPolarHBondContact O-CB 3.43Å; S620-R623 PolarHBondContact O-N 2.88Å; S620-R623 VanDerWaalsContact O-N 3.11Å; S620-Y624 WeakPolarHBondContact O-CD2 3.38Å
621	F	94.1	Very high	91.1	Very high	5 Å²	5	46.7 Å²	46.7	2%	0.022	21%	0.205	C	C	.	.	H	α-helix	trans	-60.7	-30.8	172.9	68.7	-94	0	0	0	112.3	M487 T565 V568 L572 I596 L619 R623 Y624 S625 L680 F683	M487-F621 HydrophobicContact CG-CE2 4.24Å; M487-F621 HydrophobicContact CG-CZ 3.88Å; M487-F621 HydrophobicContact SD-CE2 4.25Å; M487-F621 HydrophobicContact SD-CZ 3.71Å; T565-F621 HydrophobicContact CG2-CE2 4.26Å; V568-F621 HydrophobicContact CB-CD2 4.04Å; V568-F621 HydrophobicContact CB-CE2 4.18Å; V568-F621 HydrophobicContact CB-CG 4.39Å; V568-F621 HydrophobicContact CG1-CB 4.02Å; V568-F621 HydrophobicContact CG1-CD1 3.63Å; V568-F621 HydrophobicContact CG1-CD2 3.58Å; V568-F621 HydrophobicContact CG1-CE1 3.89Å; V568-F621 HydrophobicContact CG1-CE2 3.86Å; V568-F621 HydrophobicContact CG1-CG 3.46Å; V568-F621 VanDerWaalsContact CG1-CG 3.46Å; V568-F621 HydrophobicContact CG1-CZ 4Å; L572-F621 HydrophobicContact CD2-CE1 4.48Å; I596-F621 HydrophobicContact CD1-CE1 4.04Å; I596-F621 HydrophobicContact CG2-CD1 4.15Å; I596-F621 HydrophobicContact CG2-CE1 3.85Å; I596-F621 HydrophobicContact CG2-CZ 4.29Å; L619-F621 PolarHBondContact O-N 3.27Å; F621-R623 PolarHBondContact O-N 3.45Å; F621-Y624 PolarHBondContact O-N 2.92Å; F621-Y624 VanDerWaalsContact O-N 3.11Å; F621-S625 PolarHBondContact O-N 2.9Å; F621-S625 VanDerWaalsContact O-N 3.1Å; F621-S625 PolarHBondContact O-OG 3.02Å; F621-L680 HydrophobicContact CB-CD2 4.02Å; F621-L680 HydrophobicContact CD2-CD2 4.42Å; F621-L680 WeakPolarHBondContact O-CD2 3.3Å; F621-F683 HydrophobicContact CB-CB 4.38Å; F621-F683 HydrophobicContact CB-CD1 4.37Å; F621-F683 HydrophobicContact CB-CD2 3.87Å; F621-F683 HydrophobicContact CB-CE2 4.21Å; F621-F683 HydrophobicContact CB-CG 3.96Å
622	T	92.9	Very high	91.4	Very high	8 Å²	8	37.9 Å²	37.9	5%	0.049	17%	0.167	C	C	.	.	H	α-helix	trans	-63.3	-23.4	178.1	64	0	0	0	0	112.7	M487 I596 S620 S625 F626	M487-T622 HydrophobicContact SD-CG2 3.67Å; I596-T622 HydrophobicContact CG2-CG2 3.61Å; I596-T622 PolarHBondContact O-OG1 3.3Å; I596-T622 VanDerWaalsContact O-OG1 3.04Å; S620-T622 PolarHBondContact O-N 3.29Å; S620-T622 PolarHBondContact OG-N 3.3Å; S620-T622 PolarHBondContact OG-OG1 3.33Å; T622-S625 PolarHBondContact O-N 2.99Å; T622-F626 VanDerWaalsContact O-CB 3.29Å; T622-F626 WeakPolarHBondContact O-CB 3.32Å; T622-F626 PolarHBondContact O-N 2.58Å
623	R	92.7	Very high	91.6	Very high	15 Å²	15	29.8 Å²	29.8	6%	0.057	14%	0.135	C	C	.	.	H	α-helix	trans	-61.7	-48.1	172.2	-177.6	-174.7	165.9	62.7	19.1	112.3	S600 L606 S617 S620 F621 F626 S627 P669	S600-R623 VanDerWaalsContact O-CA 3.27Å; S600-R623 WeakPolarHBondContact O-CA 2.98Å; L606-R623 VanDerWaalsContact CD2-NH1 3.35Å; L606-R623 VanDerWaalsContact CG-NH1 3.3Å; S617-R623 VanDerWaalsContact O-CD 3.26Å; S617-R623 WeakPolarHBondContact O-CD 3.5Å; S620-R623 WeakPolarHBondContact O-CB 3.43Å; S620-R623 PolarHBondContact O-N 2.88Å; S620-R623 VanDerWaalsContact O-N 3.11Å; F621-R623 PolarHBondContact O-N 3.45Å; R623-F626 PolarHBondContact O-N 3.49Å; R623-S627 VanDerWaalsContact O-CB 3.25Å; R623-S627 WeakPolarHBondContact O-CB 3.2Å; R623-S627 PolarHBondContact O-N 3.47Å; R623-P669 VanDerWaalsContact NH2-CG 3.34Å
624	Y	93.9	Very high	91.7	Very high	27 Å²	27	27.1 Å²	27.1	11%	0.106	12%	0.121	C	C	.	.	H	α-helix	trans	-69	-39	178.6	-59.9	-83.6	0	0	0	111	F618 S620 F621 F626 G628 Y671 V679 F683	F618-Y624 WeakPolarHBondContact O-CE2 3.48Å; S620-Y624 WeakPolarHBondContact O-CD2 3.38Å; F621-Y624 PolarHBondContact O-N 2.92Å; F621-Y624 VanDerWaalsContact O-N 3.11Å; Y624-F626 PolarHBondContact O-N 2.89Å; Y624-G628 PolarHBondContact O-N 3.49Å; Y624-Y671 WeakPolarHBondContact CD1-OH 3.49Å; Y624-V679 HydrophobicContact CD1-CB 4.06Å; Y624-V679 HydrophobicContact CD1-CG1 3.83Å; Y624-V679 HydrophobicContact CD1-CG2 4.21Å; Y624-V679 HydrophobicContact CD2-CG1 3.64Å; Y624-V679 HydrophobicContact CE1-CB 4.3Å; Y624-V679 HydrophobicContact CE1-CG1 3.86Å; Y624-V679 HydrophobicContact CE1-CG2 4.09Å; Y624-V679 HydrophobicContact CE2-CG1 3.68Å; Y624-V679 HydrophobicContact CG-CB 4.21Å; Y624-V679 HydrophobicContact CG-CG1 3.7Å; Y624-F683 HydrophobicContact CD2-CE2 4.21Å; Y624-F683 HydrophobicContact CE2-CE2 4.02Å
625	S	95.2	Very high	91.8	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-57.9	-47.3	171.9	-59.6	0	0	0	0	112.3	L483 I561 T565 F621 T622 A629 L680	L483-S625 VanDerWaalsContact CD1-C 3.48Å; L483-S625 WeakPolarHBondContact CD1-O 3.35Å; I561-S625 WeakPolarHBondContact CD1-O 3.33Å; T565-S625 WeakPolarHBondContact OG1-CB 3.09Å; T565-S625 PolarHBondContact OG1-OG 3.37Å; F621-S625 PolarHBondContact O-N 2.9Å; F621-S625 VanDerWaalsContact O-N 3.1Å; F621-S625 PolarHBondContact O-OG 3.02Å; T622-S625 PolarHBondContact O-N 2.99Å; S625-A629 VanDerWaalsContact O-CB 3.26Å; S625-A629 WeakPolarHBondContact O-CB 3.23Å; S625-A629 PolarHBondContact O-N 3.32Å; S625-L680 WeakPolarHBondContact OG-CD2 3.43Å
626	F	94.6	Very high	91.5	Very high	5 Å²	5	21.1 Å²	21.1	2%	0.022	11%	0.106	C	C	.	.	H	α-helix	trans	-68.6	-50.6	-179	179.2	-108.1	0	0	0	111.8	A476 V479 F480 L483 F602 T622 R623 Y624 G628 A629 I630 I668	A476-F626 HydrophobicContact CB-CZ 4.19Å; A476-F626 WeakPolarHBondContact O-CE2 3.45Å; V479-F626 HydrophobicContact CB-CE2 4.38Å; V479-F626 HydrophobicContact CG1-CD2 4.07Å; V479-F626 HydrophobicContact CG1-CE2 4.29Å; F480-F626 HydrophobicContact CB-CD2 4.02Å; F480-F626 HydrophobicContact CB-CE2 3.85Å; F480-F626 HydrophobicContact CD2-CD2 4.44Å; L483-F626 HydrophobicContact CD1-CB 4.12Å; F602-F626 HydrophobicContact CB-CE1 4.14Å; F602-F626 HydrophobicContact CB-CE2 4.41Å; F602-F626 HydrophobicContact CB-CZ 4.06Å; F602-F626 HydrophobicContact CD2-CE2 4.27Å; F602-F626 AromaticContact CD2-CZ 3.87Å; F602-F626 HydrophobicContact CD2-CZ 3.87Å; F602-F626 HydrophobicContact CG-CZ 4.43Å; T622-F626 VanDerWaalsContact O-CB 3.29Å; T622-F626 WeakPolarHBondContact O-CB 3.32Å; T622-F626 PolarHBondContact O-N 2.58Å; R623-F626 PolarHBondContact O-N 3.49Å; Y624-F626 PolarHBondContact O-N 2.89Å; F626-G628 PolarHBondContact O-N 2.98Å; F626-A629 PolarHBondContact O-N 2.95Å; F626-I630 HydrophobicContact CD2-CG1 4.28Å; F626-I630 HydrophobicContact CE1-CG1 4.16Å; F626-I630 HydrophobicContact CE2-CD1 4Å; F626-I630 HydrophobicContact CE2-CG1 3.87Å; F626-I630 HydrophobicContact CZ-CD1 4.05Å; F626-I630 HydrophobicContact CZ-CG1 3.81Å; F626-I630 WeakPolarHBondContact O-CG1 3.37Å; F626-I630 PolarHBondContact O-N 3.26Å; F626-I668 HydrophobicContact CE1-CD1 4.33Å
627	S	92.9	Very high	91.3	Very high	3 Å²	3	27.1 Å²	27.1	2%	0.021	14%	0.139	C	C	.	.	H	α-helix	trans	-54.8	-49.6	175.5	165.7	0	0	0	0	111.8	R623 A629 I630 K631	R623-S627 VanDerWaalsContact O-CB 3.25Å; R623-S627 WeakPolarHBondContact O-CB 3.2Å; R623-S627 PolarHBondContact O-N 3.47Å; S627-A629 PolarHBondContact O-N 3.23Å; S627-I630 PolarHBondContact O-N 3.12Å; S627-K631 VanDerWaalsContact O-CG 3.3Å; S627-K631 WeakPolarHBondContact O-CG 3.45Å; S627-K631 PolarHBondContact O-N 3.01Å; S627-K631 VanDerWaalsContact OG-CE 3.28Å; S627-K631 WeakPolarHBondContact OG-CE 3.46Å; S627-K631 PolarHBondContact OG-NZ 2.86Å
628	G	94.7	Very high	91.4	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-61.7	-42.8	178.5	0	0	0	0	0	112.3	Y624 F626 K631 I632 D676	Y624-G628 PolarHBondContact O-N 3.49Å; F626-G628 PolarHBondContact O-N 2.98Å; G628-K631 PolarHBondContact O-N 2.94Å; G628-I632 WeakPolarHBondContact O-CD1 3.46Å; G628-I632 WeakPolarHBondContact O-CG1 3.44Å; G628-I632 PolarHBondContact O-N 3.31Å; G628-D676 WeakPolarHBondContact CA-OD2 3.3Å
629	A	95	Very high	91.4	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-65.8	-41.3	-180	0	0	0	0	0	112.2	V479 L483 F558 I561 S625 F626 S627 I632 I633	V479-A629 HydrophobicContact CG1-CB 3.43Å; V479-A629 VanDerWaalsContact CG1-CB 3.43Å; L483-A629 HydrophobicContact CD1-CB 4.28Å; F558-A629 HydrophobicContact CD2-CB 4.37Å; F558-A629 HydrophobicContact CE2-CB 4.3Å; I561-A629 HydrophobicContact CD1-CB 4.48Å; I561-A629 HydrophobicContact CG2-CB 4.21Å; S625-A629 VanDerWaalsContact O-CB 3.26Å; S625-A629 WeakPolarHBondContact O-CB 3.23Å; S625-A629 PolarHBondContact O-N 3.32Å; F626-A629 PolarHBondContact O-N 2.95Å; S627-A629 PolarHBondContact O-N 3.23Å; A629-I632 PolarHBondContact O-N 3.45Å; A629-I633 WeakPolarHBondContact O-CG1 3.29Å; A629-I633 PolarHBondContact O-N 2.86Å
630	I	93.9	Very high	91.2	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-63.1	-43.6	174.5	-66.5	-65.9	0	0	0	110.9	A476 V479 F626 S627 I632 I633 Y634 F663 L666 I668	A476-I630 HydrophobicContact CB-CD1 4.04Å; V479-I630 HydrophobicContact CB-CD1 4.24Å; V479-I630 HydrophobicContact CG1-CD1 4.33Å; V479-I630 HydrophobicContact CG2-CD1 4.21Å; F626-I630 HydrophobicContact CD2-CG1 4.28Å; F626-I630 HydrophobicContact CE1-CG1 4.16Å; F626-I630 HydrophobicContact CE2-CD1 4Å; F626-I630 HydrophobicContact CE2-CG1 3.87Å; F626-I630 HydrophobicContact CZ-CD1 4.05Å; F626-I630 HydrophobicContact CZ-CG1 3.81Å; F626-I630 WeakPolarHBondContact O-CG1 3.37Å; F626-I630 PolarHBondContact O-N 3.26Å; S627-I630 PolarHBondContact O-N 3.12Å; I630-I632 PolarHBondContact O-N 2.99Å; I630-I633 PolarHBondContact O-N 3.29Å; I630-Y634 HydrophobicContact CD1-CE2 4.37Å; I630-Y634 HydrophobicContact CG2-CD2 4.01Å; I630-Y634 WeakPolarHBondContact O-CD2 3.2Å; I630-Y634 PolarHBondContact O-N 3.44Å; I630-F663 HydrophobicContact CG2-CD1 4.36Å; I630-F663 HydrophobicContact CG2-CE1 4.26Å; I630-L666 HydrophobicContact CD1-CD1 4.38Å; I630-L666 HydrophobicContact CG2-CD1 4.01Å; I630-I668 HydrophobicContact CG2-CD1 4.32Å; I630-I668 HydrophobicContact CG2-CG1 3.98Å
631	K	93	Very high	91	Very high	14 Å²	14	28.4 Å²	28.4	6%	0.061	15%	0.154	C	C	.	.	H	α-helix	trans	-64	-36.2	175	-69	172.8	-167.4	171.5	0	113	S627 G628 G635 F663 I668 P669 Y671 V673 D676	S627-K631 VanDerWaalsContact O-CG 3.3Å; S627-K631 WeakPolarHBondContact O-CG 3.45Å; S627-K631 PolarHBondContact O-N 3.01Å; S627-K631 VanDerWaalsContact OG-CE 3.28Å; S627-K631 WeakPolarHBondContact OG-CE 3.46Å; S627-K631 PolarHBondContact OG-NZ 2.86Å; G628-K631 PolarHBondContact O-N 2.94Å; K631-G635 WeakPolarHBondContact O-CA 3.42Å; K631-G635 PolarHBondContact O-N 3.48Å; K631-F663 HydrophobicContact CB-CE1 4.45Å; K631-F663 HydrophobicContact CG-CE1 4.16Å; K631-I668 HydrophobicContact CD-CG2 4.31Å; K631-I668 VanDerWaalsContact CE-CG2 3.45Å; K631-I668 HydrophobicContact CG-CG2 3.95Å; K631-P669 WeakPolarHBondContact CE-O 3.43Å; K631-P669 PolarHBondContact NZ-O 3.4Å; K631-Y671 WeakPolarHBondContact CE-O 3.43Å; K631-Y671 VanDerWaalsContact NZ-CD2 3.32Å; K631-Y671 PolarHBondContact NZ-O 3.5Å; K631-V673 HydrophobicContact CB-CG2 3.46Å; K631-V673 VanDerWaalsContact CB-CG2 3.46Å; K631-V673 HydrophobicContact CD-CG2 3.96Å; K631-V673 HydrophobicContact CG-CG2 4.36Å; K631-D676 IonicContact NZ-OD2 2.9Å; K631-D676 PolarHBondContact NZ-OD2 3.24Å
632	I	93.7	Very high	90.7	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-66	-44.8	175.5	-69.1	158	0	0	0	110.6	R554 Q557 F558 I561 G628 A629 I630 V673 F677	R554-I632 HydrophobicContact CB-CG2 4.1Å; R554-I632 VanDerWaalsContact O-CG2 3.26Å; R554-I632 WeakPolarHBondContact O-CG2 3.42Å; Q557-I632 HydrophobicContact CB-CD1 3.75Å; Q557-I632 HydrophobicContact CB-CG1 3.88Å; Q557-I632 HydrophobicContact CB-CG2 3.8Å; F558-I632 HydrophobicContact CB-CG2 4.37Å; I561-I632 HydrophobicContact CB-CD1 4.42Å; I561-I632 HydrophobicContact CD1-CD1 4.33Å; I561-I632 HydrophobicContact CG2-CD1 4.19Å; G628-I632 WeakPolarHBondContact O-CD1 3.46Å; G628-I632 WeakPolarHBondContact O-CG1 3.44Å; G628-I632 PolarHBondContact O-N 3.31Å; A629-I632 PolarHBondContact O-N 3.45Å; I630-I632 PolarHBondContact O-N 2.99Å; I632-V673 HydrophobicContact CD1-CG1 4Å; I632-V673 HydrophobicContact CG1-CG1 3.78Å; I632-F677 HydrophobicContact CD1-CZ 3.97Å
633	I	93.4	Very high	90.2	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-70.7	-43.6	-176.9	-71.9	166.4	0	0	0	111.6	V479 R554 F558 A629 I630 R638	V479-I633 HydrophobicContact CG2-CD1 3.33Å; R554-I633 PolarHBondContact NH1-O 3.07Å; F558-I633 HydrophobicContact CD2-CD1 4.19Å; F558-I633 HydrophobicContact CD2-CG1 4.5Å; F558-I633 HydrophobicContact CE2-CD1 4.06Å; A629-I633 WeakPolarHBondContact O-CG1 3.29Å; A629-I633 PolarHBondContact O-N 2.86Å; I630-I633 PolarHBondContact O-N 3.29Å; I633-R638 WeakPolarHBondContact O-CD 3.46Å; I633-R638 PolarHBondContact O-NH1 2.82Å
634	Y	91.8	Very high	89.5	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.008	21%	0.21	C	C	.	.	H	α-helix	trans	-102.5	-14.6	-173.7	-66.9	-69	0	0	0	114.7	N475 I630 L641 P659 I662	N475-Y634 VanDerWaalsContact CB-OH 3.29Å; N475-Y634 WeakPolarHBondContact CB-OH 3.18Å; N475-Y634 PolarHBondContact ND2-OH 3.27Å; I630-Y634 HydrophobicContact CD1-CE2 4.37Å; I630-Y634 HydrophobicContact CG2-CD2 4.01Å; I630-Y634 WeakPolarHBondContact O-CD2 3.2Å; I630-Y634 PolarHBondContact O-N 3.44Å; Y634-L641 HydrophobicContact CD1-CD1 4.29Å; Y634-L641 HydrophobicContact CE1-CD1 4.26Å; Y634-L641 HydrophobicContact CE1-CD2 3.81Å; Y634-P659 WeakPolarHBondContact O-CB 3.29Å; Y634-I662 HydrophobicContact CD1-CD1 3.31Å; Y634-I662 HydrophobicContact CD2-CG2 3.92Å; Y634-I662 HydrophobicContact CE1-CD1 3.33Å; Y634-I662 HydrophobicContact CE2-CG2 4.08Å; Y634-I662 HydrophobicContact CG-CD1 3.92Å; Y634-I662 HydrophobicContact CG-CG2 4.13Å
635	G	87.3	Confident	88.6	Confident	12 Å²	12	43.8 Å²	43.8	12%	0.124	23%	0.23	C	C	.	.			trans	-81.7	-160.5	-179.2	0	0	0	0	0	114.1	R554 K631 N637 R638	R554-G635 PolarHBondContact NH1-O 2.86Å; R554-G635 PolarHBondContact NH2-O 3.04Å; K631-G635 WeakPolarHBondContact O-CA 3.42Å; K631-G635 PolarHBondContact O-N 3.48Å; G635-N637 PolarHBondContact O-N 3.11Å; G635-R638 PolarHBondContact O-N 3.36Å
636	N	81.8	Confident	87.3	Confident	87 Å²	87	49.7 Å²	49.7	47%	0.465	26%	0.256	S	S	.	.	S	Bend	trans	50.5	51.4	174.7	-61.2	-18.5	0	0	0	114.4	R554 R638	R554-N636 PolarHBondContact NH2-O 3.28Å; N636-R638 VanDerWaalsContact C-N 3.33Å; N636-R638 PolarHBondContact O-N 2.92Å
637	N	82	Confident	85.8	Confident	170 Å²	170	55.4 Å²	55.4	91%	0.909	28%	0.278	S	S	*	.	S	Bend	trans	52.4	45.6	178.4	-61.1	-21	0	0	0	113.6	G635	G635-N637 PolarHBondContact O-N 3.11Å
638	R	86.8	Confident	84.4	Confident	21 Å²	21	62.5 Å²	62.5	8%	0.079	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-59.8	142.3	173.3	-164.7	-174.2	174.8	155.7	-7.5	110	G466 N467 R554 I633 G635 N636 P659	G466-R638 PolarHBondContact O-NH2 3.32Å; N467-R638 PolarHBondContact OD1-NH2 3.37Å; R554-R638 VanDerWaalsContact NH2-CA 3.33Å; I633-R638 WeakPolarHBondContact O-CD 3.46Å; I633-R638 PolarHBondContact O-NH1 2.82Å; G635-R638 PolarHBondContact O-N 3.36Å; N636-R638 VanDerWaalsContact C-N 3.33Å; N636-R638 PolarHBondContact O-N 2.92Å; R638-P659 HydrophobicContact CB-CB 4.4Å; R638-P659 HydrophobicContact CB-CG 3.88Å; R638-P659 HydrophobicContact CG-CG 4.49Å
639	T	87.6	Confident	82.5	Confident	111 Å²	111	70 Å²	70	68%	0.681	35%	0.354	S	S	*	.	P	Polyproline II helix	trans	-58.8	153.8	167.5	56.4	0	0	0	0	110.8
640	D	86.3	Confident	80.7	Confident	106 Å²	106	77 Å²	77	57%	0.567	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-57.9	146.4	175.5	-70.5	-22.3	0	0	0	110.9	G657	D640-G657 WeakPolarHBondContact CA-O 3.29Å
641	L	88.2	Confident	78.8	Confident	11 Å²	11	86 Å²	86	6%	0.058	43%	0.428	C	S	.	.	P	Polyproline II helix	trans	-76.8	150.1	179.7	-76	91.3	0	0	0	111.4	V472 Y634 C643 G657 P659 I662	V472-L641 HydrophobicContact CG2-CD2 4.06Å; Y634-L641 HydrophobicContact CD1-CD1 4.29Å; Y634-L641 HydrophobicContact CE1-CD1 4.26Å; Y634-L641 HydrophobicContact CE1-CD2 3.81Å; L641-C643 PolarHBondContact O-N 3.46Å; L641-C643 VanDerWaalsContact O-N 3.14Å; L641-G657 PolarHBondContact N-O 3.31Å; L641-P659 HydrophobicContact CD1-CG 4.03Å; L641-I662 HydrophobicContact CD1-CD1 3.82Å; L641-I662 HydrophobicContact CD2-CD1 4.4Å
642	D	86.4	Confident	77.1	Confident	48 Å²	48	88.4 Å²	88.4	26%	0.257	45%	0.448	S	S	.	.	B	Isolated β-bridge	trans	-67.8	110.9	177.5	-176.3	-7.8	0	0	0	109.6	N467 G469 D644 R645	N467-D642 PolarHBondContact O-N 3.49Å; G469-D642 PolarHBondContact N-O 3.11Å; D642-D644 WeakPolarHBondContact OD1-CA 3.3Å; D642-D644 WeakPolarHBondContact OD1-CB 3.49Å; D642-D644 PolarHBondContact OD1-N 3.05Å; D642-R645 PolarHBondContact OD1-N 3.33Å; D642-R645 VanDerWaalsContact OD2-CB 3.25Å; D642-R645 WeakPolarHBondContact OD2-CB 3.37Å; D642-R645 IonicContact OD2-NE 3.08Å
643	C	83.8	Confident	75.9	Confident	35 Å²	35	95.7 Å²	95.7	24%	0.236	48%	0.476	C	S	.	.			trans	-103.5	3	174.8	-71	0	0	0	0	112.9	Y470 L641 C655 G657	Y470-C643 HydrophobicContact CE2-CB 4.43Å; Y470-C643 WeakPolarHBondContact CE2-O 3.33Å; Y470-C643 PolarHBondContact OH-O 2.89Å; L641-C643 PolarHBondContact O-N 3.46Å; L641-C643 VanDerWaalsContact O-N 3.14Å; C643-C655 WeakPolarHBondContact CA-SG 3.38Å; C643-C655 HydrophobicContact CB-CB 3.88Å; C643-C655 WeakPolarHBondContact CB-SG 3.46Å; C643-C655 WeakPolarHBondContact SG-CB 3.28Å; C643-C655 CovalentContact SG-SG 2.02Å; C643-C655 PolarHBondContact SG-SG 3.48Å; C643-G657 VanDerWaalsContact SG-CA 3.54Å
644	D	78.3	Confident	75.2	Confident	154 Å²	154	100.8 Å²	100.8	82%	0.824	51%	0.509	S	S	*	.	S	Bend	trans	-91.5	-37	178.9	-63.1	-27.8	0	0	0	109.8	D642 K646	D642-D644 WeakPolarHBondContact OD1-CA 3.3Å; D642-D644 WeakPolarHBondContact OD1-CB 3.49Å; D642-D644 PolarHBondContact OD1-N 3.05Å; D644-K646 PolarHBondContact O-N 3.43Å
645	R	73.9	Confident	74.8	Confident	140 Å²	140	102.4 Å²	102.4	53%	0.528	52%	0.52	S	S	.	.			trans	-79.6	101.1	178.3	-163.1	179.2	-60.8	-172.6	-2	111.3	L468 D642	L468-R645 HydrophobicContact CD2-CB 3.84Å; L468-R645 HydrophobicContact CD2-CG 4Å; D642-R645 PolarHBondContact OD1-N 3.33Å; D642-R645 VanDerWaalsContact OD2-CB 3.25Å; D642-R645 WeakPolarHBondContact OD2-CB 3.37Å; D642-R645 IonicContact OD2-NE 3.08Å
646	K	67.2	Low	74.7	Confident	125 Å²	125	103.5 Å²	103.5	54%	0.543	52%	0.523	S	S	.	.	P	Polyproline II helix	trans	-95.4	133.6	169.5	-71.5	178.7	-179.9	175.1	0	111.1	Y470 D644 I648	Y470-K646 HydrophobicContact CD2-CG 3.75Å; Y470-K646 HydrophobicContact CE2-CD 4.14Å; Y470-K646 HydrophobicContact CE2-CG 3.38Å; Y470-K646 WeakPolarHBondContact OH-CE 3.1Å; D644-K646 PolarHBondContact O-N 3.43Å; K646-I648 PolarHBondContact O-N 3Å
647	R	63.5	Low	74.6	Confident	125 Å²	125	100 Å²	100	47%	0.472	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-69.1	125.2	159	-95.3	-178.3	164	175.9	-3.2	107.9
648	I	63.2	Low	74.8	Confident	151 Å²	151	97.7 Å²	97.7	77%	0.774	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	137.4	-176.7	-60.1	168	0	0	0	110.1	K646	K646-I648 PolarHBondContact O-N 3Å
649	N	56.1	Low	74.8	Confident	159 Å²	159	97.3 Å²	97.3	85%	0.85	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.7	36.2	167.7	-64.2	-15.6	0	0	0	119.3
650	K	55.9	Low	74.6	Confident	145 Å²	145	95.4 Å²	95.4	63%	0.63	49%	0.485	S	S	*	.	S	Bend	trans	-117.1	139.3	164.2	-84.7	-178.2	175.7	-179.8	0	112.1	S652	K650-S652 PolarHBondContact O-N 3.33Å
651	M	54.9	Low	74.5	Confident	189 Å²	189	94.5 Å²	94.5	93%	0.931	48%	0.479	S	S	*	.			trans	-47.5	108.1	167.7	-170.8	98.9	103.7	0	0	107.9	Y653	M651-Y653 PolarHBondContact O-N 3.41Å
652	S	58.1	Low	74.5	Confident	66 Å²	66	94 Å²	94	46%	0.462	48%	0.476	S	S	.	.			trans	-84.6	114.6	-167.5	-166.4	0	0	0	0	109	Y470 K650	Y470-S652 WeakPolarHBondContact CD1-OG 3.27Å; Y470-S652 VanDerWaalsContact CE1-OG 3.32Å; Y470-S652 WeakPolarHBondContact CE1-OG 3.11Å; K650-S652 PolarHBondContact O-N 3.33Å
653	Y	67.8	Low	74.5	Confident	153 Å²	153	93.7 Å²	93.7	60%	0.6	47%	0.473	S	S	*	.	P	Polyproline II helix	trans	-54.5	153.5	159.4	-68.6	-81.1	0	0	0	109.3	Y470 I473 M651 C655	Y470-Y653 WeakPolarHBondContact CD1-O 3.26Å; I473-Y653 HydrophobicContact CD1-CD1 4.15Å; I473-Y653 HydrophobicContact CD1-CD2 4.3Å; I473-Y653 HydrophobicContact CD1-CE1 4.07Å; I473-Y653 HydrophobicContact CD1-CE2 4.23Å; I473-Y653 HydrophobicContact CD1-CG 4.26Å; M651-Y653 PolarHBondContact O-N 3.41Å; Y653-C655 PolarHBondContact O-N 2.92Å
654	P	79	Confident	74.5	Confident	106 Å²	106	99.1 Å²	99.1	69%	0.688	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-55.8	136.8	173.1	24.2	-33.3	0	0	0	109.2	L656	P654-L656 PolarHBondContact O-N 3.06Å
655	C	83.8	Confident	74.7	Confident	36 Å²	36	94.4 Å²	94.4	24%	0.243	48%	0.477	C	S	.	.	P	Polyproline II helix	trans	-64.5	123.2	179.6	-160.7	0	0	0	0	109.8	G469 Y470 C643 Y653 G657	G469-C655 VanDerWaalsContact CA-SG 3.58Å; Y470-C655 HydrophobicContact CD1-CB 3.87Å; Y470-C655 HydrophobicContact CE1-CB 3.45Å; Y470-C655 VanDerWaalsContact CE1-CB 3.45Å; Y470-C655 HydrophobicContact CE2-CB 4.41Å; C643-C655 WeakPolarHBondContact CA-SG 3.38Å; C643-C655 HydrophobicContact CB-CB 3.88Å; C643-C655 WeakPolarHBondContact CB-SG 3.46Å; C643-C655 WeakPolarHBondContact SG-CB 3.28Å; C643-C655 CovalentContact SG-SG 2.02Å; C643-C655 PolarHBondContact SG-SG 3.48Å; Y653-C655 PolarHBondContact O-N 2.92Å; C655-G657 VanDerWaalsContact C-N 3.3Å; C655-G657 PolarHBondContact O-N 3.35Å
656	L	84.1	Confident	75.2	Confident	35 Å²	35	89.1 Å²	89.1	18%	0.183	46%	0.459	C	S	.	.			trans	-91.9	71.1	172.6	-70.6	165	0	0	0	108.6	G469 V472 P654 M661 I662 A665	G469-L656 PolarHBondContact O-N 3Å; G469-L656 VanDerWaalsContact O-N 3.1Å; V472-L656 HydrophobicContact CB-CD1 4.2Å; V472-L656 HydrophobicContact CG1-CD1 4.19Å; V472-L656 HydrophobicContact CG2-CB 4.06Å; P654-L656 PolarHBondContact O-N 3.06Å; L656-M661 HydrophobicContact CD2-CB 3.82Å; L656-I662 HydrophobicContact CB-CG1 4Å; L656-A665 HydrophobicContact CD1-CB 3.9Å; L656-A665 HydrophobicContact CD2-CB 4.16Å
657	G	80.4	Confident	76	Confident	15 Å²	15	86.1 Å²	86.1	16%	0.155	45%	0.449	C	S	.	.			trans	-66.5	-40.8	-177.4	0	0	0	0	0	112.8	D640 L641 C643 C655	D640-G657 WeakPolarHBondContact CA-O 3.29Å; L641-G657 PolarHBondContact N-O 3.31Å; C643-G657 VanDerWaalsContact SG-CA 3.54Å; C655-G657 VanDerWaalsContact C-N 3.3Å; C655-G657 PolarHBondContact O-N 3.35Å
658	K	86.6	Confident	77	Confident	121 Å²	121	80.8 Å²	80.8	53%	0.526	43%	0.43	S	S	.	.	S	Bend	trans	-86.3	123.6	-179.4	-65.8	-167.8	-178.6	178.8	0	111	A660 M661	K658-A660 PolarHBondContact O-N 2.67Å; K658-A660 VanDerWaalsContact O-N 3.13Å; K658-M661 HydrophobicContact CB-CE 4.28Å; K658-M661 HydrophobicContact CB-CG 4.2Å; K658-M661 HydrophobicContact CD-CE 4.13Å; K658-M661 HydrophobicContact CG-CE 4.39Å; K658-M661 WeakPolarHBondContact O-CB 3.44Å; K658-M661 PolarHBondContact O-N 2.97Å
659	P	86	Confident	77.9	Confident	13 Å²	13	75.2 Å²	75.2	8%	0.084	40%	0.403	C	S	.	.	H	α-helix	trans	-57.8	-30.7	-179.2	-21.9	28.6	0	0	0	114.5	Y634 R638 L641 M661 I662	Y634-P659 WeakPolarHBondContact O-CB 3.29Å; R638-P659 HydrophobicContact CB-CB 4.4Å; R638-P659 HydrophobicContact CB-CG 3.88Å; R638-P659 HydrophobicContact CG-CG 4.49Å; L641-P659 HydrophobicContact CD1-CG 4.03Å; P659-M661 VanDerWaalsContact C-N 3.27Å; P659-M661 PolarHBondContact O-N 3.31Å; P659-I662 VanDerWaalsContact O-CB 3.3Å; P659-I662 WeakPolarHBondContact O-CB 3.29Å; P659-I662 PolarHBondContact O-N 3.26Å
660	A	83.8	Confident	79.1	Confident	70 Å²	70	75 Å²	75	58%	0.579	40%	0.402	S	S	*	.	H	α-helix	trans	-62	-32.4	176.6	0	0	0	0	0	113.2	K658 I662	K658-A660 PolarHBondContact O-N 2.67Å; K658-A660 VanDerWaalsContact O-N 3.13Å; A660-I662 PolarHBondContact O-N 3.14Å
661	M	84.4	Confident	80.6	Confident	88 Å²	88	71.2 Å²	71.2	43%	0.433	38%	0.384	S	S	.	.	H	α-helix	trans	-70.2	-24.7	176.4	-62.7	-173.4	-168.7	0	0	111.9	L656 K658 P659 Q664 A665	L656-M661 HydrophobicContact CD2-CB 3.82Å; K658-M661 HydrophobicContact CB-CE 4.28Å; K658-M661 HydrophobicContact CB-CG 4.2Å; K658-M661 HydrophobicContact CD-CE 4.13Å; K658-M661 HydrophobicContact CG-CE 4.39Å; K658-M661 WeakPolarHBondContact O-CB 3.44Å; K658-M661 PolarHBondContact O-N 2.97Å; P659-M661 VanDerWaalsContact C-N 3.27Å; P659-M661 PolarHBondContact O-N 3.31Å; M661-Q664 PolarHBondContact O-N 2.78Å; M661-A665 VanDerWaalsContact O-CB 3.28Å; M661-A665 WeakPolarHBondContact O-CB 3.31Å; M661-A665 PolarHBondContact O-N 3.24Å
662	I	86.9	Confident	82.3	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-67.8	-38.5	-178.4	-60.5	177.5	0	0	0	110.8	V472 Y634 L641 L656 P659 A660 Q664 A665 L666	V472-I662 HydrophobicContact CG1-CB 4.32Å; V472-I662 HydrophobicContact CG1-CD1 3.92Å; V472-I662 HydrophobicContact CG1-CG1 3.95Å; V472-I662 HydrophobicContact CG1-CG2 3.55Å; V472-I662 HydrophobicContact CG2-CD1 3.76Å; V472-I662 HydrophobicContact CG2-CG1 4.28Å; Y634-I662 HydrophobicContact CD1-CD1 3.31Å; Y634-I662 HydrophobicContact CD2-CG2 3.92Å; Y634-I662 HydrophobicContact CE1-CD1 3.33Å; Y634-I662 HydrophobicContact CE2-CG2 4.08Å; Y634-I662 HydrophobicContact CG-CD1 3.92Å; Y634-I662 HydrophobicContact CG-CG2 4.13Å; L641-I662 HydrophobicContact CD1-CD1 3.82Å; L641-I662 HydrophobicContact CD2-CD1 4.4Å; L656-I662 HydrophobicContact CB-CG1 4Å; P659-I662 VanDerWaalsContact O-CB 3.3Å; P659-I662 WeakPolarHBondContact O-CB 3.29Å; P659-I662 PolarHBondContact O-N 3.26Å; A660-I662 PolarHBondContact O-N 3.14Å; I662-Q664 VanDerWaalsContact C-N 3.34Å; I662-Q664 PolarHBondContact O-N 2.87Å; I662-A665 PolarHBondContact O-N 3.39Å; I662-L666 HydrophobicContact CG2-CD1 3.71Å; I662-L666 HydrophobicContact CG2-CG 4.28Å; I662-L666 WeakPolarHBondContact O-CB 3.36Å; I662-L666 WeakPolarHBondContact O-CG 3.33Å; I662-L666 PolarHBondContact O-N 3.23Å
663	F	87	Confident	83.9	Confident	41 Å²	41	63.5 Å²	63.5	18%	0.18	35%	0.348	C	S	.	.	H	α-helix	trans	-64.1	-40.8	177	-59.4	-41	0	0	0	112.1	I630 K631 N667 I668	I630-F663 HydrophobicContact CG2-CD1 4.36Å; I630-F663 HydrophobicContact CG2-CE1 4.26Å; K631-F663 HydrophobicContact CB-CE1 4.45Å; K631-F663 HydrophobicContact CG-CE1 4.16Å; F663-N667 PolarHBondContact O-N 3.46Å; F663-I668 HydrophobicContact CB-CB 4.41Å; F663-I668 HydrophobicContact CD1-CB 4.32Å; F663-I668 HydrophobicContact CD1-CG2 4.45Å; F663-I668 PolarHBondContact O-N 2.95Å
664	Q	84	Confident	85.1	Confident	150 Å²	150	60.3 Å²	60.3	70%	0.701	35%	0.348	S	S	*	.	H	α-helix	trans	-68.3	-44.9	175.1	-65.9	179.7	-7.8	0	0	111.3	M661 I662 L666 N667	M661-Q664 PolarHBondContact O-N 2.78Å; I662-Q664 VanDerWaalsContact C-N 3.34Å; I662-Q664 PolarHBondContact O-N 2.87Å; Q664-L666 VanDerWaalsContact C-N 3.3Å; Q664-L666 PolarHBondContact O-N 3.45Å; Q664-N667 PolarHBondContact O-N 2.95Å; Q664-N667 VanDerWaalsContact O-N 3.16Å
665	A	83.1	Confident	85.8	Confident	54 Å²	54	59.2 Å²	59.2	45%	0.446	34%	0.336	S	S	.	.	H	α-helix	trans	-62.2	-35.9	179.2	0	0	0	0	0	112.8	L656 M661 I662	L656-A665 HydrophobicContact CD1-CB 3.9Å; L656-A665 HydrophobicContact CD2-CB 4.16Å; M661-A665 VanDerWaalsContact O-CB 3.28Å; M661-A665 WeakPolarHBondContact O-CB 3.31Å; M661-A665 PolarHBondContact O-N 3.24Å; I662-A665 PolarHBondContact O-N 3.39Å
666	L	83.3	Confident	86.3	Confident	30 Å²	30	57.5 Å²	57.5	16%	0.157	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	5.2	178.2	-64.4	177.5	0	0	0	113.6	A476 I630 I662 Q664 I668	A476-L666 HydrophobicContact CB-CD1 4.08Å; A476-L666 HydrophobicContact CB-CD2 4.37Å; I630-L666 HydrophobicContact CD1-CD1 4.38Å; I630-L666 HydrophobicContact CG2-CD1 4.01Å; I662-L666 HydrophobicContact CG2-CD1 3.71Å; I662-L666 HydrophobicContact CG2-CG 4.28Å; I662-L666 WeakPolarHBondContact O-CB 3.36Å; I662-L666 WeakPolarHBondContact O-CG 3.33Å; I662-L666 PolarHBondContact O-N 3.23Å; Q664-L666 VanDerWaalsContact C-N 3.3Å; Q664-L666 PolarHBondContact O-N 3.45Å; L666-I668 HydrophobicContact CB-CD1 4.19Å; L666-I668 HydrophobicContact CB-CG1 3.8Å; L666-I668 PolarHBondContact O-N 2.89Å
667	N	83.9	Confident	86.9	Confident	62 Å²	62	57.5 Å²	57.5	33%	0.332	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.2	40.8	-176.1	-68.8	-65.2	0	0	0	113.8	N605 Y607 F663 Q664	N605-N667 PolarHBondContact ND2-ND2 3.44Å; Y607-N667 HydrophobicContact CE2-CB 4.42Å; F663-N667 PolarHBondContact O-N 3.46Å; Q664-N667 PolarHBondContact O-N 2.95Å; Q664-N667 VanDerWaalsContact O-N 3.16Å
668	I	84.8	Confident	87.6	Confident	13 Å²	13	58.3 Å²	58.3	7%	0.067	33%	0.331	C	S	.	.			trans	-77	129.3	177.8	-58.8	-61	0	0	0	108.7	F626 I630 K631 F663 L666	F626-I668 HydrophobicContact CE1-CD1 4.33Å; I630-I668 HydrophobicContact CG2-CD1 4.32Å; I630-I668 HydrophobicContact CG2-CG1 3.98Å; K631-I668 HydrophobicContact CD-CG2 4.31Å; K631-I668 VanDerWaalsContact CE-CG2 3.45Å; K631-I668 HydrophobicContact CG-CG2 3.95Å; F663-I668 HydrophobicContact CB-CB 4.41Å; F663-I668 HydrophobicContact CD1-CB 4.32Å; F663-I668 HydrophobicContact CD1-CG2 4.45Å; F663-I668 PolarHBondContact O-N 2.95Å; L666-I668 HydrophobicContact CB-CD1 4.19Å; L666-I668 HydrophobicContact CB-CG1 3.8Å; L666-I668 PolarHBondContact O-N 2.89Å
669	P	82.4	Confident	88.1	Confident	33 Å²	33	53.9 Å²	53.9	21%	0.214	31%	0.314	C	S	.	.			trans	-63.2	139.6	-178.6	-23.6	33.6	0	0	0	114.1	R623 K631 Y671	R623-P669 VanDerWaalsContact NH2-CG 3.34Å; K631-P669 WeakPolarHBondContact CE-O 3.43Å; K631-P669 PolarHBondContact NZ-O 3.4Å; P669-Y671 HydrophobicContact CB-CD1 3.55Å; P669-Y671 HydrophobicContact CB-CE1 3.43Å; P669-Y671 VanDerWaalsContact CB-CE1 3.43Å; P669-Y671 HydrophobicContact CG-CE1 3.98Å; P669-Y671 PolarHBondContact O-N 3.35Å
670	D	81.6	Confident	88.6	Confident	156 Å²	156	53.3 Å²	53.3	83%	0.834	31%	0.31	S	S	*	.	S	Bend	trans	-78.5	58.3	-177.5	-64.3	-37.8	0	0	0	113.4
671	Y	87	Confident	89.2	Confident	64 Å²	64	52.7 Å²	52.7	25%	0.251	30%	0.301	S	S	.	.	S	Bend	trans	-129.9	160.7	171.2	68.8	-108.2	0	0	0	111.4	Y624 K631 P669 I675 D676	Y624-Y671 WeakPolarHBondContact CD1-OH 3.49Å; K631-Y671 WeakPolarHBondContact CE-O 3.43Å; K631-Y671 VanDerWaalsContact NZ-CD2 3.32Å; K631-Y671 PolarHBondContact NZ-O 3.5Å; P669-Y671 HydrophobicContact CB-CD1 3.55Å; P669-Y671 HydrophobicContact CB-CE1 3.43Å; P669-Y671 VanDerWaalsContact CB-CE1 3.43Å; P669-Y671 HydrophobicContact CG-CE1 3.98Å; P669-Y671 PolarHBondContact O-N 3.35Å; Y671-I675 HydrophobicContact CD2-CB 3.6Å; Y671-I675 HydrophobicContact CD2-CD1 3.87Å; Y671-I675 HydrophobicContact CD2-CG1 4.14Å; Y671-I675 HydrophobicContact CD2-CG2 3.95Å; Y671-I675 HydrophobicContact CE2-CB 3.75Å; Y671-I675 HydrophobicContact CE2-CG2 3.86Å; Y671-I675 HydrophobicContact CG-CD1 4.12Å; Y671-D676 VanDerWaalsContact CE2-OD1 3.31Å; Y671-D676 WeakPolarHBondContact CE2-OD1 3.31Å; Y671-D676 WeakPolarHBondContact CE2-OD2 3.38Å; Y671-D676 VanDerWaalsContact CZ-OD1 3.32Å; Y671-D676 PolarHBondContact OH-OD1 3.06Å
672	S	90.5	Very high	89.8	Confident	69 Å²	69	54 Å²	54	48%	0.483	31%	0.308	S	S	.	.			trans	-67	147.9	-173.8	65.3	0	0	0	0	113.8	S674 I675	S672-S674 PolarHBondContact O-N 3Å; S672-S674 VanDerWaalsContact O-N 3.09Å; S672-I675 PolarHBondContact O-N 3.33Å
673	V	91.4	Very high	90.2	Very high	24 Å²	24	55.5 Å²	55.5	15%	0.145	32%	0.315	C	S	.	.	H	α-helix	trans	-56.7	-28.4	177.7	-172.9	0	0	0	0	112.4	K631 I632 I675 D676 F677	K631-V673 HydrophobicContact CB-CG2 3.46Å; K631-V673 VanDerWaalsContact CB-CG2 3.46Å; K631-V673 HydrophobicContact CD-CG2 3.96Å; K631-V673 HydrophobicContact CG-CG2 4.36Å; I632-V673 HydrophobicContact CD1-CG1 4Å; I632-V673 HydrophobicContact CG1-CG1 3.78Å; V673-I675 PolarHBondContact O-N 2.84Å; V673-D676 WeakPolarHBondContact O-CB 3.27Å; V673-D676 PolarHBondContact O-N 3.19Å; V673-F677 HydrophobicContact CG1-CD2 3.98Å; V673-F677 HydrophobicContact CG1-CE2 3.54Å; V673-F677 HydrophobicContact CG1-CZ 4.19Å; V673-F677 WeakPolarHBondContact O-CD2 3.43Å; V673-F677 PolarHBondContact O-N 3.31Å; V673-F677 VanDerWaalsContact O-N 3.14Å
674	S	93	Very high	90.7	Very high	87 Å²	87	56.2 Å²	56.2	61%	0.608	32%	0.318	S	S	*	.	H	α-helix	trans	-57	-32	176.7	-53	0	0	0	0	113.4	S672 G678	S672-S674 PolarHBondContact O-N 3Å; S672-S674 VanDerWaalsContact O-N 3.09Å; S674-G678 PolarHBondContact O-N 3.34Å
675	I	94.1	Very high	91.3	Very high	83 Å²	83	53.9 Å²	53.9	43%	0.426	31%	0.31	S	S	.	.	H	α-helix	trans	-70	-39.5	176	-59.6	-177.2	0	0	0	110.4	Y671 S672 V673 F677 G678 V679	Y671-I675 HydrophobicContact CD2-CB 3.6Å; Y671-I675 HydrophobicContact CD2-CD1 3.87Å; Y671-I675 HydrophobicContact CD2-CG1 4.14Å; Y671-I675 HydrophobicContact CD2-CG2 3.95Å; Y671-I675 HydrophobicContact CE2-CB 3.75Å; Y671-I675 HydrophobicContact CE2-CG2 3.86Å; Y671-I675 HydrophobicContact CG-CD1 4.12Å; S672-I675 PolarHBondContact O-N 3.33Å; V673-I675 PolarHBondContact O-N 2.84Å; I675-F677 PolarHBondContact O-N 3.23Å; I675-G678 PolarHBondContact O-N 3.34Å; I675-V679 HydrophobicContact CG2-CG2 4.1Å; I675-V679 WeakPolarHBondContact O-CB 3.33Å; I675-V679 WeakPolarHBondContact O-CG2 3.37Å; I675-V679 PolarHBondContact O-N 3.38Å
676	D	94.3	Very high	91.9	Very high	0 Å²	0	57 Å²	57	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-60.5	-46.2	176.2	-67.3	-52.6	0	0	0	110.5	G628 K631 Y671 V673 G678 V679 L680	G628-D676 WeakPolarHBondContact CA-OD2 3.3Å; K631-D676 IonicContact NZ-OD2 2.9Å; K631-D676 PolarHBondContact NZ-OD2 3.24Å; Y671-D676 VanDerWaalsContact CE2-OD1 3.31Å; Y671-D676 WeakPolarHBondContact CE2-OD1 3.31Å; Y671-D676 WeakPolarHBondContact CE2-OD2 3.38Å; Y671-D676 VanDerWaalsContact CZ-OD1 3.32Å; Y671-D676 PolarHBondContact OH-OD1 3.06Å; V673-D676 WeakPolarHBondContact O-CB 3.27Å; V673-D676 PolarHBondContact O-N 3.19Å; D676-G678 PolarHBondContact O-N 3.35Å; D676-V679 PolarHBondContact O-N 3.23Å; D676-L680 WeakPolarHBondContact O-CG 3.39Å; D676-L680 PolarHBondContact O-N 2.9Å; D676-L680 VanDerWaalsContact O-N 3.09Å
677	F	96.3	Very high	92.5	Very high	34 Å²	34	56.5 Å²	56.5	15%	0.149	31%	0.311	C	S	.	.	H	α-helix	trans	-60.4	-43.8	173.7	-71.1	-58	0	0	0	112.8	Q557 I560 I561 I632 V673 I675 L680 C681	Q557-F677 HydrophobicContact CB-CZ 4.16Å; Q557-F677 HydrophobicContact CG-CZ 4.38Å; I560-F677 HydrophobicContact CB-CE1 3.99Å; I560-F677 HydrophobicContact CG2-CD1 3.9Å; I560-F677 HydrophobicContact CG2-CE1 3.54Å; I560-F677 HydrophobicContact CG2-CZ 4.36Å; I561-F677 HydrophobicContact CB-CE1 3.92Å; I561-F677 HydrophobicContact CG1-CE1 4.43Å; I632-F677 HydrophobicContact CD1-CZ 3.97Å; V673-F677 HydrophobicContact CG1-CD2 3.98Å; V673-F677 HydrophobicContact CG1-CE2 3.54Å; V673-F677 HydrophobicContact CG1-CZ 4.19Å; V673-F677 WeakPolarHBondContact O-CD2 3.43Å; V673-F677 PolarHBondContact O-N 3.31Å; V673-F677 VanDerWaalsContact O-N 3.14Å; I675-F677 PolarHBondContact O-N 3.23Å; F677-L680 PolarHBondContact O-N 3.23Å; F677-C681 PolarHBondContact O-N 3.1Å; F677-C681 VanDerWaalsContact O-N 3.09Å; F677-C681 PolarHBondContact O-SG 3.11Å
678	G	96.4	Very high	93	Very high	32 Å²	32	54.3 Å²	54.3	33%	0.33	30%	0.298	S	S	.	.	H	α-helix	trans	-63.4	-44.3	179.5	0	0	0	0	0	112.6	S674 I675 D676 C681 I682	S674-G678 PolarHBondContact O-N 3.34Å; I675-G678 PolarHBondContact O-N 3.34Å; D676-G678 PolarHBondContact O-N 3.35Å; G678-C681 WeakPolarHBondContact O-CB 3.36Å; G678-C681 PolarHBondContact O-N 3.21Å; G678-I682 WeakPolarHBondContact O-CG1 3.4Å; G678-I682 PolarHBondContact O-N 3.16Å
679	V	95.9	Very high	93.6	Very high	29 Å²	29	58.2 Å²	58.2	18%	0.176	32%	0.318	C	S	.	.	H	α-helix	trans	-64.9	-42.5	178.9	173.3	0	0	0	0	111.1	Y624 I675 D676 C681 I682 F683	Y624-V679 HydrophobicContact CD1-CB 4.06Å; Y624-V679 HydrophobicContact CD1-CG1 3.83Å; Y624-V679 HydrophobicContact CD1-CG2 4.21Å; Y624-V679 HydrophobicContact CD2-CG1 3.64Å; Y624-V679 HydrophobicContact CE1-CB 4.3Å; Y624-V679 HydrophobicContact CE1-CG1 3.86Å; Y624-V679 HydrophobicContact CE1-CG2 4.09Å; Y624-V679 HydrophobicContact CE2-CG1 3.68Å; Y624-V679 HydrophobicContact CG-CB 4.21Å; Y624-V679 HydrophobicContact CG-CG1 3.7Å; I675-V679 HydrophobicContact CG2-CG2 4.1Å; I675-V679 WeakPolarHBondContact O-CB 3.33Å; I675-V679 WeakPolarHBondContact O-CG2 3.37Å; I675-V679 PolarHBondContact O-N 3.38Å; D676-V679 PolarHBondContact O-N 3.23Å; V679-C681 VanDerWaalsContact C-N 3.34Å; V679-C681 PolarHBondContact O-N 3.43Å; V679-I682 WeakPolarHBondContact O-CB 3.46Å; V679-I682 PolarHBondContact O-N 2.88Å; V679-I682 VanDerWaalsContact O-N 3.14Å; V679-F683 HydrophobicContact CG1-CD2 3.68Å; V679-F683 HydrophobicContact CG1-CE2 3.59Å; V679-F683 WeakPolarHBondContact O-CD2 3.45Å; V679-F683 PolarHBondContact O-N 2.78Å
680	L	96.4	Very high	94.2	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-62	-39.9	175.4	-71	175	0	0	0	112.3	I561 Q564 V568 F621 S625 D676 F677 F683 F684	I561-L680 HydrophobicContact CD1-CD1 4.41Å; I561-L680 HydrophobicContact CG1-CD1 3.78Å; Q564-L680 HydrophobicContact CB-CB 4.29Å; Q564-L680 HydrophobicContact CB-CD1 4.18Å; V568-L680 WeakPolarHBondContact CG2-O 3.43Å; F621-L680 HydrophobicContact CB-CD2 4.02Å; F621-L680 HydrophobicContact CD2-CD2 4.42Å; F621-L680 WeakPolarHBondContact O-CD2 3.3Å; S625-L680 WeakPolarHBondContact OG-CD2 3.43Å; D676-L680 WeakPolarHBondContact O-CG 3.39Å; D676-L680 PolarHBondContact O-N 2.9Å; D676-L680 VanDerWaalsContact O-N 3.09Å; F677-L680 PolarHBondContact O-N 3.23Å; L680-F683 PolarHBondContact O-N 3.33Å; L680-F684 WeakPolarHBondContact O-CB 3.41Å; L680-F684 PolarHBondContact O-N 2.8Å
681	C	96.6	Very high	94.9	Very high	57 Å²	57	52.2 Å²	52.2	39%	0.385	28%	0.284	S	S	.	.	H	α-helix	trans	-61	-42.1	171.8	-77.4	0	0	0	0	112.3	Q564 F677 G678 V679 F684 L685	Q564-C681 PolarHBondContact NE2-SG 2.88Å; F677-C681 PolarHBondContact O-N 3.1Å; F677-C681 VanDerWaalsContact O-N 3.09Å; F677-C681 PolarHBondContact O-SG 3.11Å; G678-C681 WeakPolarHBondContact O-CB 3.36Å; G678-C681 PolarHBondContact O-N 3.21Å; V679-C681 VanDerWaalsContact C-N 3.34Å; V679-C681 PolarHBondContact O-N 3.43Å; C681-F684 PolarHBondContact O-N 3.14Å; C681-L685 WeakPolarHBondContact O-CG 3.13Å; C681-L685 PolarHBondContact O-N 3.02Å
682	I	97.1	Very high	95.2	Very high	115 Å²	115	51.1 Å²	51.1	59%	0.59	28%	0.28	S	S	*	.	H	α-helix	trans	-62.8	-46.6	176.7	-68.7	165.2	0	0	0	110.7	G678 V679 F684 L685 F686	G678-I682 WeakPolarHBondContact O-CG1 3.4Å; G678-I682 PolarHBondContact O-N 3.16Å; V679-I682 WeakPolarHBondContact O-CB 3.46Å; V679-I682 PolarHBondContact O-N 2.88Å; V679-I682 VanDerWaalsContact O-N 3.14Å; I682-F684 VanDerWaalsContact C-N 3.33Å; I682-F684 PolarHBondContact O-N 3.16Å; I682-L685 PolarHBondContact O-N 3.41Å; I682-F686 VanDerWaalsContact O-CB 3.24Å; I682-F686 WeakPolarHBondContact O-CB 3.41Å; I682-F686 PolarHBondContact O-N 2.73Å
683	F	96.1	Very high	95.5	Very high	33 Å²	33	54.4 Å²	54.4	15%	0.145	28%	0.282	C	S	.	.	H	α-helix	trans	-59	-44	175.8	-88.2	-71.6	0	0	0	112.2	V568 L619 F621 Y624 V679 L680 F686 L687	V568-F683 HydrophobicContact CG1-CB 4.14Å; V568-F683 HydrophobicContact CG2-CB 4.32Å; L619-F683 HydrophobicContact CD1-CE1 4.38Å; L619-F683 WeakPolarHBondContact O-CZ 3.39Å; F621-F683 HydrophobicContact CB-CB 4.38Å; F621-F683 HydrophobicContact CB-CD1 4.37Å; F621-F683 HydrophobicContact CB-CD2 3.87Å; F621-F683 HydrophobicContact CB-CE2 4.21Å; F621-F683 HydrophobicContact CB-CG 3.96Å; Y624-F683 HydrophobicContact CD2-CE2 4.21Å; Y624-F683 HydrophobicContact CE2-CE2 4.02Å; V679-F683 HydrophobicContact CG1-CD2 3.68Å; V679-F683 HydrophobicContact CG1-CE2 3.59Å; V679-F683 WeakPolarHBondContact O-CD2 3.45Å; V679-F683 PolarHBondContact O-N 2.78Å; L680-F683 PolarHBondContact O-N 3.33Å; F683-F686 PolarHBondContact O-N 2.71Å; F683-L687 WeakPolarHBondContact O-CB 3.37Å; F683-L687 WeakPolarHBondContact O-CG 3.27Å; F683-L687 PolarHBondContact O-N 3.49Å
684	F	96.4	Very high	95.6	Very high	56 Å²	56	55 Å²	55	25%	0.246	28%	0.284	C	S	.	.	H	α-helix	trans	-57.9	-52.1	176.6	170.9	-105.5	0	0	0	111.4	L567 V568 S571 L680 C681 I682 R688	L567-F684 HydrophobicContact CB-CD2 3.93Å; L567-F684 HydrophobicContact CB-CE2 4.03Å; L567-F684 HydrophobicContact CD2-CE2 4.43Å; V568-F684 HydrophobicContact CG2-CB 3.92Å; S571-F684 WeakPolarHBondContact OG-CD2 3.08Å; L680-F684 WeakPolarHBondContact O-CB 3.41Å; L680-F684 PolarHBondContact O-N 2.8Å; C681-F684 PolarHBondContact O-N 3.14Å; I682-F684 VanDerWaalsContact C-N 3.33Å; I682-F684 PolarHBondContact O-N 3.16Å; F684-R688 HydrophobicContact CD2-CG 4.27Å; F684-R688 HydrophobicContact CE2-CG 3.97Å; F684-R688 HydrophobicContact CZ-CG 4.1Å; F684-R688 WeakPolarHBondContact O-CB 2.99Å; F684-R688 WeakPolarHBondContact O-CG 3.04Å; F684-R688 PolarHBondContact O-N 2.89Å
685	L	96.1	Very high	95.6	Very high	100 Å²	100	50.8 Å²	50.8	52%	0.524	26%	0.255	S	S	.	.	H	α-helix	trans	-64	-44	179.6	-67.9	176.2	0	0	0	111.9	C681 I682 R688 I689	C681-L685 WeakPolarHBondContact O-CG 3.13Å; C681-L685 PolarHBondContact O-N 3.02Å; I682-L685 PolarHBondContact O-N 3.41Å; L685-R688 PolarHBondContact O-N 3.11Å; L685-I689 WeakPolarHBondContact O-CB 3.1Å; L685-I689 VanDerWaalsContact O-CG1 3.22Å; L685-I689 WeakPolarHBondContact O-CG1 3.22Å; L685-I689 PolarHBondContact O-N 3.13Å
686	F	96.7	Very high	95.5	Very high	121 Å²	121	49.4 Å²	49.4	53%	0.531	25%	0.245	S	C	.	.	H	α-helix	trans	-59.1	-51.2	178.9	173.1	-101.4	0	0	0	111.9	I682 F683 R688 I689 L690	I682-F686 VanDerWaalsContact O-CB 3.24Å; I682-F686 WeakPolarHBondContact O-CB 3.41Å; I682-F686 PolarHBondContact O-N 2.73Å; F683-F686 PolarHBondContact O-N 2.71Å; F686-R688 VanDerWaalsContact C-N 3.32Å; F686-R688 PolarHBondContact O-N 3.27Å; F686-I689 PolarHBondContact O-N 2.85Å; F686-L690 HydrophobicContact CE1-CD2 4.25Å; F686-L690 HydrophobicContact CZ-CD2 4.45Å; F686-L690 WeakPolarHBondContact O-CB 3.5Å; F686-L690 PolarHBondContact O-N 2.93Å
687	L	96	Very high	95.3	Very high	18 Å²	18	56.5 Å²	56.5	9%	0.094	27%	0.271	C	S	.	.	H	α-helix	trans	-64.9	-36.1	179.4	-70.1	173.8	0	0	0	111.8	V568 L572 V575 F683 L690 G691	V568-L687 HydrophobicContact CG1-CD1 3.94Å; L572-L687 HydrophobicContact CB-CD1 4.18Å; V575-L687 HydrophobicContact CG2-CB 4.47Å; V575-L687 HydrophobicContact CG2-CD2 4.37Å; V575-L687 VanDerWaalsContact CG2-O 3.31Å; V575-L687 WeakPolarHBondContact CG2-O 3.44Å; F683-L687 WeakPolarHBondContact O-CB 3.37Å; F683-L687 WeakPolarHBondContact O-CG 3.27Å; F683-L687 PolarHBondContact O-N 3.49Å; L687-L690 PolarHBondContact O-N 2.98Å; L687-G691 PolarHBondContact O-N 2.9Å
688	R	95	Very high	94.9	Very high	17 Å²	17	57 Å²	57	6%	0.064	27%	0.272	C	S	.	.	H	α-helix	trans	-65.9	-41.8	174.6	-72.4	-73.3	175.2	160.1	1.3	112.2	Y520 S524 S571 L574 F684 L685 F686 Y692	Y520-R688 WeakPolarHBondContact CE1-O 3.32Å; Y520-R688 PolarHBondContact OH-O 3.15Å; S524-R688 VanDerWaalsContact CA-NH1 3.33Å; S524-R688 PolarHBondContact OG-NH1 3.49Å; S571-R688 PolarHBondContact OG-NE 3.26Å; L574-R688 VanDerWaalsContact CD1-CZ 3.47Å; F684-R688 HydrophobicContact CD2-CG 4.27Å; F684-R688 HydrophobicContact CE2-CG 3.97Å; F684-R688 HydrophobicContact CZ-CG 4.1Å; F684-R688 WeakPolarHBondContact O-CB 2.99Å; F684-R688 WeakPolarHBondContact O-CG 3.04Å; F684-R688 PolarHBondContact O-N 2.89Å; L685-R688 PolarHBondContact O-N 3.11Å; F686-R688 VanDerWaalsContact C-N 3.32Å; F686-R688 PolarHBondContact O-N 3.27Å; R688-Y692 PolarHBondContact O-N 3.18Å; R688-Y692 VanDerWaalsContact O-N 3.17Å
689	I	95.9	Very high	94.3	Very high	94 Å²	94	55.9 Å²	55.9	48%	0.482	26%	0.259	S	S	.	.	H	α-helix	trans	-66.8	-44.6	176.6	-69.3	166	0	0	0	110	L685 F686 G691 Y692 Y693	L685-I689 WeakPolarHBondContact O-CB 3.1Å; L685-I689 VanDerWaalsContact O-CG1 3.22Å; L685-I689 WeakPolarHBondContact O-CG1 3.22Å; L685-I689 PolarHBondContact O-N 3.13Å; F686-I689 PolarHBondContact O-N 2.85Å; I689-G691 PolarHBondContact O-N 2.97Å; I689-Y692 WeakPolarHBondContact O-CB 3.03Å; I689-Y692 PolarHBondContact O-N 2.86Å; I689-Y693 HydrophobicContact CG2-CD2 3.63Å; I689-Y693 HydrophobicContact CG2-CE2 3.44Å; I689-Y693 VanDerWaalsContact CG2-CE2 3.44Å; I689-Y693 VanDerWaalsContact O-CD2 3.24Å; I689-Y693 WeakPolarHBondContact O-CD2 3.26Å; I689-Y693 PolarHBondContact O-N 3.44Å
690	L	96.2	Very high	93.6	Very high	64 Å²	64	60.3 Å²	60.3	34%	0.335	27%	0.272	S	S	.	.	H	α-helix	trans	-58	-47.6	176.5	-179.1	61.2	0	0	0	111.6	V575 F686 L687 Y692 Y693 I694	V575-L690 HydrophobicContact CG1-CD2 4.24Å; V575-L690 HydrophobicContact CG2-CB 4.49Å; V575-L690 HydrophobicContact CG2-CD2 4.41Å; V575-L690 HydrophobicContact CG2-CG 4.42Å; F686-L690 HydrophobicContact CE1-CD2 4.25Å; F686-L690 HydrophobicContact CZ-CD2 4.45Å; F686-L690 WeakPolarHBondContact O-CB 3.5Å; F686-L690 PolarHBondContact O-N 2.93Å; L687-L690 PolarHBondContact O-N 2.98Å; L690-Y692 VanDerWaalsContact C-N 3.3Å; L690-Y692 PolarHBondContact O-N 3.34Å; L690-Y693 PolarHBondContact O-N 3.3Å; L690-I694 HydrophobicContact CD1-CD1 4.05Å; L690-I694 HydrophobicContact CD1-CG1 4.29Å; L690-I694 HydrophobicContact CG-CD1 3.84Å; L690-I694 HydrophobicContact CG-CG1 4.49Å; L690-I694 WeakPolarHBondContact O-CG1 3Å; L690-I694 PolarHBondContact O-N 3.4Å
691	G	94.8	Very high	92.7	Very high	0 Å²	0	68.8 Å²	68.8	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-58	-39.4	176.1	0	0	0	0	0	113.1	L687 I689 L695	L687-G691 PolarHBondContact O-N 2.9Å; I689-G691 PolarHBondContact O-N 2.97Å; G691-L695 WeakPolarHBondContact O-CB 3.46Å; G691-L695 PolarHBondContact O-N 2.97Å
692	Y	95.1	Very high	91.4	Very high	41 Å²	41	72.5 Å²	72.5	16%	0.161	31%	0.31	C	S	.	.	H	α-helix	trans	-64.1	-45.5	175	175	-99.4	0	0	0	112.2	L516 K517 Y520 R688 I689 L690 L695 R696	L516-Y692 HydrophobicContact CD2-CE2 3.95Å; L516-Y692 HydrophobicContact CG-CE2 3.85Å; K517-Y692 HydrophobicContact CG-CE2 4.46Å; K517-Y692 WeakPolarHBondContact CG-OH 3.36Å; Y520-Y692 AromaticContact CD1-CD2 3.82Å; Y520-Y692 HydrophobicContact CD1-CD2 3.82Å; Y520-Y692 HydrophobicContact CD1-CG 4.33Å; Y520-Y692 HydrophobicContact CE1-CD2 4.44Å; Y520-Y692 AromaticContact CG-CD2 3.88Å; Y520-Y692 HydrophobicContact CG-CD2 3.88Å; Y520-Y692 PolarHBondContact OH-N 2.83Å; R688-Y692 PolarHBondContact O-N 3.18Å; R688-Y692 VanDerWaalsContact O-N 3.17Å; I689-Y692 WeakPolarHBondContact O-CB 3.03Å; I689-Y692 PolarHBondContact O-N 2.86Å; L690-Y692 VanDerWaalsContact C-N 3.3Å; L690-Y692 PolarHBondContact O-N 3.34Å; Y692-L695 PolarHBondContact O-N 3.42Å; Y692-R696 WeakPolarHBondContact O-CB 3.21Å; Y692-R696 PolarHBondContact O-N 3.03Å
693	Y	95.2	Very high	89.7	Confident	138 Å²	138	70.2 Å²	70.2	54%	0.541	29%	0.294	S	S	.	.	H	α-helix	trans	-67	-39.1	178.8	-80.1	-72.5	0	0	0	112.5	I689 L690 R696 W697	I689-Y693 HydrophobicContact CG2-CD2 3.63Å; I689-Y693 HydrophobicContact CG2-CE2 3.44Å; I689-Y693 VanDerWaalsContact CG2-CE2 3.44Å; I689-Y693 VanDerWaalsContact O-CD2 3.24Å; I689-Y693 WeakPolarHBondContact O-CD2 3.26Å; I689-Y693 PolarHBondContact O-N 3.44Å; L690-Y693 PolarHBondContact O-N 3.3Å; Y693-R696 PolarHBondContact O-N 3.24Å; Y693-W697 WeakPolarHBondContact O-CB 3.49Å; Y693-W697 PolarHBondContact O-N 3.31Å
694	I	94.4	Very high	89.4	Confident	35 Å²	35	72.1 Å²	72.1	18%	0.179	30%	0.301	C	S	.	.	H	α-helix	trans	-61.4	-47.5	174.1	-69.2	168.3	0	0	0	110.3	V575 A579 L690 R696 W697 R698	V575-I694 HydrophobicContact CG1-CD1 3.81Å; A579-I694 HydrophobicContact CB-CG2 4.06Å; L690-I694 HydrophobicContact CD1-CD1 4.05Å; L690-I694 HydrophobicContact CD1-CG1 4.29Å; L690-I694 HydrophobicContact CG-CD1 3.84Å; L690-I694 HydrophobicContact CG-CG1 4.49Å; L690-I694 WeakPolarHBondContact O-CG1 3Å; L690-I694 PolarHBondContact O-N 3.4Å; I694-R696 VanDerWaalsContact C-N 3.34Å; I694-R696 PolarHBondContact O-N 3.3Å; I694-W697 PolarHBondContact O-N 2.63Å; I694-R698 WeakPolarHBondContact O-CB 3.25Å; I694-R698 PolarHBondContact O-N 2.02Å
695	L	92.2	Very high	89.1	Confident	0 Å²	0	72.9 Å²	72.9	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-60.7	-44.5	177.2	-177.8	59.4	0	0	0	111.4	F498 I502 F505 L516 Y519 Y520 T578 G691 Y692 W697 R698 I699	F498-L695 HydrophobicContact CZ-CD2 4.42Å; I502-L695 HydrophobicContact CD1-CD1 3.59Å; I502-L695 HydrophobicContact CG1-CD1 3.81Å; F505-L695 HydrophobicContact CD1-CD1 4.47Å; F505-L695 HydrophobicContact CE1-CD1 4.32Å; L516-L695 HydrophobicContact CD1-CD2 3.5Å; L516-L695 HydrophobicContact CD1-CG 3.76Å; Y519-L695 HydrophobicContact CD1-CD2 4.43Å; Y519-L695 HydrophobicContact CE1-CD2 4.29Å; Y520-L695 HydrophobicContact CD2-CD2 3.91Å; T578-L695 HydrophobicContact CG2-CB 4.25Å; G691-L695 WeakPolarHBondContact O-CB 3.46Å; G691-L695 PolarHBondContact O-N 2.97Å; Y692-L695 PolarHBondContact O-N 3.42Å; L695-W697 PolarHBondContact O-N 3.25Å; L695-R698 PolarHBondContact O-N 3.14Å; L695-I699 HydrophobicContact CG-CD1 4.37Å; L695-I699 WeakPolarHBondContact O-CD1 3.11Å; L695-I699 WeakPolarHBondContact O-CG1 3.35Å; L695-I699 PolarHBondContact O-N 2.92Å
696	R	91.7	Very high	88.7	Confident	54 Å²	54	71.4 Å²	71.4	20%	0.204	29%	0.292	C	S	.	.	H	α-helix	trans	-59.7	-43.9	175.7	-170.7	179.9	-171.9	-180	6.3	112.1	D412 L516 Y692 Y693 I694 I699 R700	D412-R696 IonicContact OD1-CZ 3.29Å; D412-R696 IonicContact OD1-NH2 3.68Å; D412-R696 PolarHBondContact OD1-NH2 3.05Å; D412-R696 IonicContact OD2-CZ 3.63Å; D412-R696 IonicContact OD2-NH1 3.21Å; D412-R696 IonicContact OD2-NH2 3.86Å; D412-R696 PolarHBondContact OD2-NH2 2.88Å; L516-R696 HydrophobicContact CD2-CB 3.78Å; L516-R696 HydrophobicContact CD2-CG 3.95Å; Y692-R696 WeakPolarHBondContact O-CB 3.21Å; Y692-R696 PolarHBondContact O-N 3.03Å; Y693-R696 PolarHBondContact O-N 3.24Å; I694-R696 VanDerWaalsContact C-N 3.34Å; I694-R696 PolarHBondContact O-N 3.3Å; R696-I699 PolarHBondContact O-N 3.37Å; R696-R700 PolarHBondContact O-N 3.47Å
697	W	90.5	Very high	88.2	Confident	148 Å²	148	68.5 Å²	68.5	56%	0.561	28%	0.278	S	S	*	.	H	α-helix	trans	-64.2	-43.2	176.8	177.5	82.1	0	0	0	111.6	Y693 I694 L695 I699 R700 R701	Y693-W697 WeakPolarHBondContact O-CB 3.49Å; Y693-W697 PolarHBondContact O-N 3.31Å; I694-W697 PolarHBondContact O-N 2.63Å; L695-W697 PolarHBondContact O-N 3.25Å; W697-I699 VanDerWaalsContact C-N 3.32Å; W697-I699 PolarHBondContact O-N 3.18Å; W697-R700 PolarHBondContact O-N 3.21Å; W697-R700 VanDerWaalsContact O-N 3.12Å; W697-R701 VanDerWaalsContact CH2-NH1 3.32Å; W697-R701 PolarHBondContact O-N 2.86Å
698	R	88.1	Confident	87.7	Confident	46 Å²	46	71.6 Å²	71.6	17%	0.174	29%	0.29	C	S	.	.	H	α-helix	trans	-62.1	-37	177.9	-163.2	173.6	178.3	163.8	0.3	112.4	F506 T578 T580 I694 L695 R702	F506-R698 HydrophobicContact CZ-CB 4.34Å; F506-R698 HydrophobicContact CZ-CG 3.94Å; T578-R698 WeakPolarHBondContact O-CD 3.4Å; T578-R698 PolarHBondContact O-NH1 3.48Å; T580-R698 PolarHBondContact O-NH1 2.9Å; I694-R698 WeakPolarHBondContact O-CB 3.25Å; I694-R698 PolarHBondContact O-N 2.02Å; L695-R698 PolarHBondContact O-N 3.14Å; R698-R702 PolarHBondContact O-N 3.43Å
699	I	83.5	Confident	87.2	Confident	8 Å²	8	75.3 Å²	75.3	4%	0.041	31%	0.305	C	S	.	.	H	α-helix	trans	-64.1	-43.6	172.6	-63.6	156.8	0	0	0	111.7	F505 F506 L516 L695 R696 W697 R702	F505-I699 HydrophobicContact CE1-CD1 3.61Å; F505-I699 HydrophobicContact CE1-CG1 4.01Å; F505-I699 HydrophobicContact CZ-CD1 3.85Å; F506-I699 HydrophobicContact CD1-CG1 4.01Å; F506-I699 HydrophobicContact CE1-CB 4.08Å; F506-I699 HydrophobicContact CE1-CG1 3.34Å; F506-I699 HydrophobicContact CZ-CG1 4.25Å; L516-I699 HydrophobicContact CB-CD1 4.37Å; L516-I699 HydrophobicContact CD1-CD1 3.66Å; L516-I699 HydrophobicContact CD2-CD1 3.73Å; L516-I699 HydrophobicContact CG-CD1 4.1Å; L695-I699 HydrophobicContact CG-CD1 4.37Å; L695-I699 WeakPolarHBondContact O-CD1 3.11Å; L695-I699 WeakPolarHBondContact O-CG1 3.35Å; L695-I699 PolarHBondContact O-N 2.92Å; R696-I699 PolarHBondContact O-N 3.37Å; W697-I699 VanDerWaalsContact C-N 3.32Å; W697-I699 PolarHBondContact O-N 3.18Å; I699-R702 PolarHBondContact O-N 3.19Å
700	R	81.6	Confident	86.6	Confident	121 Å²	121	73.9 Å²	73.9	46%	0.457	29%	0.292	S	S	.	.	H	α-helix	trans	-65.3	-40.7	178.8	-71.7	-178.4	-177.4	156.8	-3.8	111.6	D412 R696 W697 R702 R703	D412-R700 IonicContact OD1-CZ 2.63Å; D412-R700 IonicContact OD1-NH2 3.66Å; D412-R700 PolarHBondContact OD1-NH2 3.32Å; R696-R700 PolarHBondContact O-N 3.47Å; W697-R700 PolarHBondContact O-N 3.21Å; W697-R700 VanDerWaalsContact O-N 3.12Å; R700-R702 VanDerWaalsContact C-N 3.33Å; R700-R702 PolarHBondContact O-N 2.95Å; R700-R703 PolarHBondContact O-N 3.31Å
701	R	78.4	Confident	85.9	Confident	178 Å²	178	74.7 Å²	74.7	67%	0.672	29%	0.289	S	S	*	.	H	α-helix	trans	-69.4	-26.7	-179.5	-169.6	176.1	179.8	-173.3	1.4	113.9	W697 R703	W697-R701 VanDerWaalsContact CH2-NH1 3.32Å; W697-R701 PolarHBondContact O-N 2.86Å; R701-R703 VanDerWaalsContact C-N 3.27Å
702	R	68.9	Low	85.1	Confident	136 Å²	136	80.9 Å²	80.9	51%	0.513	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-7.7	175.9	-79.3	-171.2	173.3	-166.2	-3.1	113.9	F506 R698 I699 R700	F506-R702 VanDerWaalsContact CE2-NH1 3.28Å; R698-R702 PolarHBondContact O-N 3.43Å; I699-R702 PolarHBondContact O-N 3.19Å; R700-R702 VanDerWaalsContact C-N 3.33Å; R700-R702 PolarHBondContact O-N 2.95Å
703	R	61.8	Low	84.2	Confident	66 Å²	66	84.5 Å²	84.5	25%	0.249	33%	0.326	C	S	.	.			trans	-98.9	0	175.5	-65.5	-179.4	-172.8	165.3	13.8	111.2	Y88 T90 Q91 R700 R701	Y88-R703 WeakPolarHBondContact O-CA 3.48Å; T90-R703 PolarHBondContact N-O 2.7Å; T90-R703 PolarHBondContact OG1-O 2.85Å; Q91-R703 VanDerWaalsContact CD-OXT 3.26Å; Q91-R703 PolarHBondContact NE2-OXT 2.94Å; R700-R703 PolarHBondContact O-N 3.31Å; R701-R703 VanDerWaalsContact C-N 3.27Å

Retrieved 703 of 703 residues in 677.8 ms (Link to these results)

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