A0A077Z6S0_TRITR Loading...

Tetraspannin domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z6S0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 310 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	51.6	Low	60.3	Low	242 Å²	242	163.5 Å²	163.5	100%	1.192	75%	0.749	S	S	*	*				0	74.2	0	-78	172.1	156.6	0	0	109.6
2	N	60	Low	60.5	Low	137 Å²	137	163.3 Å²	163.3	73%	0.733	75%	0.745	S	S	*	*			trans	-106.7	99.8	172.9	-76.3	-9.1	0	0	0	107.1	W4	N2-W4 VanDerWaalsContact C-N 3.25Å; N2-W4 VanDerWaalsContact O-CD1 3.28Å; N2-W4 PolarHBondContact O-N 3.45Å
3	R	68.3	Low	60.7	Low	242 Å²	242	160.9 Å²	160.9	91%	0.913	74%	0.736	S	S	*	*			trans	-70.4	88.6	175.4	-173.6	-179.1	-86.6	-173.2	-5	106.9	R5	R3-R5 VanDerWaalsContact C-N 3.33Å; R3-R5 PolarHBondContact O-N 3.01Å
4	W	59.7	Low	61	Low	231 Å²	231	151.9 Å²	151.9	88%	0.875	71%	0.708	S	S	*	*			trans	-55.7	98.7	168.8	-69.5	94.3	0	0	0	107.8	N2 R6	N2-W4 VanDerWaalsContact C-N 3.25Å; N2-W4 VanDerWaalsContact O-CD1 3.28Å; N2-W4 PolarHBondContact O-N 3.45Å; W4-R6 PolarHBondContact O-N 2.89Å
5	R	58.7	Low	61.6	Low	190 Å²	190	148.1 Å²	148.1	72%	0.717	70%	0.695	S	S	*	*			trans	-67.8	122.1	170.6	-134.9	-176.1	-83.3	-148.8	-0.7	105.7	R3	R3-R5 VanDerWaalsContact C-N 3.33Å; R3-R5 PolarHBondContact O-N 3.01Å
6	R	63.5	Low	62.1	Low	193 Å²	193	144.8 Å²	144.8	73%	0.728	69%	0.687	S	S	*	*			trans	-61	133.3	-177.4	-64.7	-170.9	-152.4	-170.2	7.8	108.2	W4 H8 D9	W4-R6 PolarHBondContact O-N 2.89Å; R6-H8 PolarHBondContact O-N 2.69Å; R6-D9 PolarHBondContact O-N 2.73Å; R6-D9 VanDerWaalsContact O-N 3.14Å
7	P	64.3	Low	62.7	Low	99 Å²	99	142.5 Å²	142.5	64%	0.643	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.7	-19.1	-177.5	19.4	-30.2	0	0	0	113.9	D9	P7-D9 VanDerWaalsContact C-N 3.31Å; P7-D9 PolarHBondContact O-N 3.1Å
8	H	57.6	Low	62.9	Low	146 Å²	146	141.6 Å²	141.6	68%	0.676	67%	0.671	S	S	*	*	H	α-helix	trans	-66.4	-25.8	176.9	-69.8	-73	0	0	0	114.4	R6	R6-H8 PolarHBondContact O-N 2.69Å
9	D	60	Low	63.1	Low	99 Å²	99	140.3 Å²	140.3	53%	0.529	67%	0.667	S	S	.	*	H	α-helix	trans	-76.2	-26.8	-177.7	-63.1	-24.8	0	0	0	112.4	R6 P7	R6-D9 PolarHBondContact O-N 2.73Å; R6-D9 VanDerWaalsContact O-N 3.14Å; P7-D9 VanDerWaalsContact C-N 3.31Å; P7-D9 PolarHBondContact O-N 3.1Å
10	L	59.5	Low	63.1	Low	118 Å²	118	141.6 Å²	141.6	62%	0.618	67%	0.666	S	S	*	*	H	α-helix	trans	-73.9	-30.5	-179.3	-73.8	167.1	0	0	0	112.7
11	V	60.6	Low	63.3	Low	101 Å²	101	141 Å²	141	61%	0.612	66%	0.661	S	S	*	*	H	α-helix	trans	-71	-41	-179.6	-178.6	0	0	0	0	110.8	Q13	V11-Q13 PolarHBondContact O-N 3Å
12	F	61.8	Low	63.8	Low	161 Å²	161	134 Å²	134	71%	0.706	62%	0.622	S	S	*	*	H	α-helix	trans	-69	-32.4	-179.6	-100.4	-84.3	0	0	0	113.6	D15 V16	F12-D15 PolarHBondContact O-N 2.86Å; F12-V16 PolarHBondContact O-N 3.29Å
13	Q	63.2	Low	64	Low	133 Å²	133	135.2 Å²	135.2	62%	0.621	62%	0.62	S	S	*	*	H	α-helix	trans	-71	-33.1	-175.8	-159.5	167.5	1.3	0	0	112.5	V11 E17	V11-Q13 PolarHBondContact O-N 3Å; Q13-E17 PolarHBondContact O-N 3.48Å
14	G	64.8	Low	63.4	Low	34 Å²	34	127.2 Å²	127.2	35%	0.351	60%	0.599	S	S	.	*	H	α-helix	trans	-66.5	-39.3	176.2	0	0	0	0	0	113.4	H18	G14-H18 PolarHBondContact O-CD2 3.46Å; G14-H18 VanDerWaalsContact O-CD2 3.31Å; G14-H18 PolarHBondContact O-N 3.12Å
15	D	70.2	Confident	63.5	Low	96 Å²	96	123.8 Å²	123.8	51%	0.513	59%	0.586	S	S	.	*	H	α-helix	trans	-68.6	-41.2	-178.2	-76.9	-20.9	0	0	0	112.2	F12 E17 H18 I19	F12-D15 PolarHBondContact O-N 2.86Å; D15-E17 PolarHBondContact O-N 3.32Å; D15-H18 PolarHBondContact O-N 3.44Å; D15-I19 WeakPolarHBondContact O-CD1 3.28Å; D15-I19 VanDerWaalsContact O-CG1 3.22Å; D15-I19 WeakPolarHBondContact O-CG1 3.06Å; D15-I19 PolarHBondContact O-N 3.11Å
16	V	70.2	Confident	64	Low	94 Å²	94	116.2 Å²	116.2	57%	0.57	56%	0.561	S	S	*	*	H	α-helix	trans	-65.7	-41.5	179.9	179.4	0	0	0	0	111.4	F12 H18 I19 Y20	F12-V16 PolarHBondContact O-N 3.29Å; V16-H18 VanDerWaalsContact C-N 3.34Å; V16-H18 PolarHBondContact O-N 2.74Å; V16-I19 PolarHBondContact O-N 3.37Å; V16-Y20 WeakPolarHBondContact O-CB 3.35Å; V16-Y20 PolarHBondContact O-N 3.42Å
17	E	71.1	Confident	64.7	Low	107 Å²	107	110 Å²	110	50%	0.5	55%	0.548	S	S	.	.	H	α-helix	trans	-66.5	-38	179.1	-157.8	-174.6	151.5	0	0	111.7	Q13 D15 K21	Q13-E17 PolarHBondContact O-N 3.48Å; D15-E17 PolarHBondContact O-N 3.32Å; E17-K21 HydrophobicContact CG-CD 4.49Å; E17-K21 WeakPolarHBondContact O-CB 3.45Å; E17-K21 PolarHBondContact O-N 3.38Å; E17-K21 WeakPolarHBondContact OE1-CE 3.4Å; E17-K21 IonicContact OE1-NZ 3.59Å; E17-K21 PolarHBondContact OE1-NZ 2.92Å
18	H	66.2	Low	65.6	Low	126 Å²	126	108.4 Å²	108.4	58%	0.583	54%	0.536	S	S	*	.	H	α-helix	trans	-66.6	-40.6	174	-89.5	-66.3	0	0	0	112.9	G14 D15 V16 R22	G14-H18 PolarHBondContact O-CD2 3.46Å; G14-H18 VanDerWaalsContact O-CD2 3.31Å; G14-H18 PolarHBondContact O-N 3.12Å; D15-H18 PolarHBondContact O-N 3.44Å; V16-H18 VanDerWaalsContact C-N 3.34Å; V16-H18 PolarHBondContact O-N 2.74Å; H18-R22 WeakPolarHBondContact O-CB 3.44Å; H18-R22 PolarHBondContact O-N 3Å
19	I	67.6	Low	66.8	Low	116 Å²	116	101.9 Å²	101.9	60%	0.595	51%	0.506	S	S	*	.	H	α-helix	trans	-65.1	-44.2	176.5	-68.8	164.6	0	0	0	110.5	D15 V16 R22 K23	D15-I19 WeakPolarHBondContact O-CD1 3.28Å; D15-I19 VanDerWaalsContact O-CG1 3.22Å; D15-I19 WeakPolarHBondContact O-CG1 3.06Å; D15-I19 PolarHBondContact O-N 3.11Å; V16-I19 PolarHBondContact O-N 3.37Å; I19-R22 PolarHBondContact O-N 2.95Å; I19-K23 PolarHBondContact O-N 3.39Å
20	Y	63	Low	68.1	Low	166 Å²	166	101.1 Å²	101.1	65%	0.651	50%	0.495	S	S	*	.	H	α-helix	trans	-65.9	-49.1	179.9	-171.1	-99.1	0	0	0	112	V16 R22 K23 V24	V16-Y20 WeakPolarHBondContact O-CB 3.35Å; V16-Y20 PolarHBondContact O-N 3.42Å; Y20-R22 PolarHBondContact O-N 3.02Å; Y20-K23 PolarHBondContact O-N 3.03Å; Y20-V24 HydrophobicContact CD1-CG2 4.09Å; Y20-V24 HydrophobicContact CE1-CG2 3.72Å; Y20-V24 HydrophobicContact CE2-CG2 4.24Å; Y20-V24 WeakPolarHBondContact O-CG2 3.1Å; Y20-V24 PolarHBondContact O-N 3.24Å
21	K	66.4	Low	69.6	Low	129 Å²	129	100.8 Å²	100.8	56%	0.561	49%	0.493	S	S	*	.	H	α-helix	trans	-57.9	-35.7	175.1	-82.5	175	172.4	159.5	0	112.2	E17 R25	E17-K21 HydrophobicContact CG-CD 4.49Å; E17-K21 WeakPolarHBondContact O-CB 3.45Å; E17-K21 PolarHBondContact O-N 3.38Å; E17-K21 WeakPolarHBondContact OE1-CE 3.4Å; E17-K21 IonicContact OE1-NZ 3.59Å; E17-K21 PolarHBondContact OE1-NZ 2.92Å; K21-R25 WeakPolarHBondContact O-CB 3.42Å; K21-R25 PolarHBondContact O-N 3.45Å
22	R	62.3	Low	71	Confident	96 Å²	96	103.4 Å²	103.4	36%	0.362	49%	0.492	S	S	.	.	H	α-helix	trans	-72.7	-39.1	178.2	-162.3	-177.9	-72.9	178.5	-2.4	112.4	H18 I19 Y20 S26 N274	H18-R22 WeakPolarHBondContact O-CB 3.44Å; H18-R22 PolarHBondContact O-N 3Å; I19-R22 PolarHBondContact O-N 2.95Å; Y20-R22 PolarHBondContact O-N 3.02Å; R22-S26 PolarHBondContact O-N 2.92Å; R22-N274 PolarHBondContact NH1-ND2 2.94Å
23	K	64.2	Low	72.3	Confident	162 Å²	162	96.1 Å²	96.1	70%	0.704	46%	0.461	S	S	*	.	H	α-helix	trans	-69.5	-43.4	178.7	-164.2	172.3	-175.7	179.4	0	112.1	I19 Y20 R25 S26	I19-K23 PolarHBondContact O-N 3.39Å; Y20-K23 PolarHBondContact O-N 3.03Å; K23-R25 PolarHBondContact O-N 2.92Å; K23-S26 PolarHBondContact O-N 3.44Å; K23-S26 PolarHBondContact O-OG 2.93Å
24	V	57	Low	73.6	Confident	75 Å²	75	93.3 Å²	93.3	46%	0.455	45%	0.445	S	S	.	.	H	α-helix	trans	-63.4	-41.6	179	175.4	0	0	0	0	111.5	Y20 S26 S27	Y20-V24 HydrophobicContact CD1-CG2 4.09Å; Y20-V24 HydrophobicContact CE1-CG2 3.72Å; Y20-V24 HydrophobicContact CE2-CG2 4.24Å; Y20-V24 WeakPolarHBondContact O-CG2 3.1Å; Y20-V24 PolarHBondContact O-N 3.24Å; V24-S26 VanDerWaalsContact C-N 3.31Å; V24-S26 PolarHBondContact O-N 3.08Å; V24-S27 PolarHBondContact O-N 3.43Å; V24-S27 VanDerWaalsContact O-N 3.15Å
25	R	61.4	Low	74.9	Confident	159 Å²	159	93.4 Å²	93.4	60%	0.6	45%	0.446	S	S	*	.	H	α-helix	trans	-66.2	-30	-178.5	-156.1	175	-154.2	150.4	6.9	113.7	K21 K23 S27 T28	K21-R25 WeakPolarHBondContact O-CB 3.42Å; K21-R25 PolarHBondContact O-N 3.45Å; K23-R25 PolarHBondContact O-N 2.92Å; R25-S27 PolarHBondContact O-N 3.25Å; R25-T28 PolarHBondContact O-N 3.42Å
26	S	69	Low	75.9	Confident	30 Å²	30	90 Å²	90	21%	0.21	43%	0.426	C	S	.	.	H	α-helix	trans	-67.2	-13.3	175.2	78.5	0	0	0	0	114.1	R22 K23 V24 Y29	R22-S26 PolarHBondContact O-N 2.92Å; K23-S26 PolarHBondContact O-N 3.44Å; K23-S26 PolarHBondContact O-OG 2.93Å; V24-S26 VanDerWaalsContact C-N 3.31Å; V24-S26 PolarHBondContact O-N 3.08Å; S26-Y29 WeakPolarHBondContact O-CD1 3.38Å; S26-Y29 WeakPolarHBondContact O-CE1 3.43Å
27	S	77.9	Confident	77	Confident	63 Å²	63	85.7 Å²	85.7	44%	0.441	40%	0.4	S	S	.	.	H	α-helix	trans	-85.2	-30.4	176.2	-161.9	0	0	0	0	112.2	V24 R25 Y29 R30 I31	V24-S27 PolarHBondContact O-N 3.43Å; V24-S27 VanDerWaalsContact O-N 3.15Å; R25-S27 PolarHBondContact O-N 3.25Å; S27-Y29 PolarHBondContact O-N 3.37Å; S27-R30 PolarHBondContact O-N 3.35Å; S27-I31 WeakPolarHBondContact O-CG1 3.34Å; S27-I31 PolarHBondContact O-N 2.97Å
28	T	83.8	Confident	78	Confident	66 Å²	66	86.6 Å²	86.6	41%	0.405	41%	0.407	S	S	.	.	H	α-helix	trans	-65.9	-42.5	-170.6	-47.2	0	0	0	0	112.8	R25 R30 I31 W32	R25-T28 PolarHBondContact O-N 3.42Å; T28-R30 VanDerWaalsContact C-N 3.29Å; T28-R30 PolarHBondContact O-N 3.38Å; T28-I31 PolarHBondContact O-N 3.42Å; T28-W32 PolarHBondContact O-N 2.86Å; T28-W32 VanDerWaalsContact O-N 3.14Å
29	Y	82.7	Confident	79.2	Confident	9 Å²	9	85 Å²	85	4%	0.035	40%	0.402	C	S	.	.	H	α-helix	trans	-63.6	-35.4	179.6	80.6	-90.3	0	0	0	112.3	S26 S27 W32 L33 D96 E260 L264	S26-Y29 WeakPolarHBondContact O-CD1 3.38Å; S26-Y29 WeakPolarHBondContact O-CE1 3.43Å; S27-Y29 PolarHBondContact O-N 3.37Å; Y29-W32 PolarHBondContact O-N 3.05Å; Y29-L33 HydrophobicContact CD2-CD1 3.86Å; Y29-L33 HydrophobicContact CE2-CD1 4.41Å; Y29-L33 WeakPolarHBondContact O-CG 3.47Å; Y29-L33 PolarHBondContact O-N 3.27Å; Y29-D96 PolarHBondContact OH-OD1 3.39Å; Y29-E260 WeakPolarHBondContact CB-OE2 3.41Å; Y29-L264 HydrophobicContact CD1-CD2 3.94Å; Y29-L264 HydrophobicContact CD2-CD1 3.79Å; Y29-L264 HydrophobicContact CD2-CD2 4.49Å; Y29-L264 HydrophobicContact CE1-CD2 3.57Å; Y29-L264 HydrophobicContact CE2-CD1 3.67Å; Y29-L264 HydrophobicContact CE2-CD2 4.19Å; Y29-L264 HydrophobicContact CE2-CG 4.48Å; Y29-L264 HydrophobicContact CG-CD1 4.3Å; Y29-L264 HydrophobicContact CG-CD2 4.39Å
30	R	88.1	Confident	80.3	Confident	82 Å²	82	79.8 Å²	79.8	31%	0.309	38%	0.376	S	S	.	.	H	α-helix	trans	-64.2	-44.4	177.9	-62.3	-176.4	179.3	-163.6	-4.6	110.3	S27 T28 W32 L33 Y34 V93 D96	S27-R30 PolarHBondContact O-N 3.35Å; T28-R30 VanDerWaalsContact C-N 3.29Å; T28-R30 PolarHBondContact O-N 3.38Å; R30-W32 VanDerWaalsContact C-N 3.29Å; R30-W32 PolarHBondContact O-N 3.48Å; R30-L33 PolarHBondContact O-N 3.48Å; R30-Y34 HydrophobicContact CB-CD2 4.23Å; R30-Y34 HydrophobicContact CB-CE2 4.12Å; R30-Y34 WeakPolarHBondContact O-CB 3.46Å; R30-Y34 WeakPolarHBondContact O-CD2 3.48Å; R30-Y34 PolarHBondContact O-N 3.49Å; R30-V93 HydrophobicContact CB-CG1 4.25Å; R30-V93 HydrophobicContact CG-CG1 4.14Å; R30-D96 IonicContact NH2-OD1 2.7Å; R30-D96 PolarHBondContact NH2-OD1 3.16Å; R30-D96 IonicContact NH2-OD2 3.47Å; R30-D96 PolarHBondContact NH2-OD2 3.05Å
31	I	90.2	Very high	81.7	Confident	112 Å²	112	75.8 Å²	75.8	57%	0.574	37%	0.365	S	S	*	.	H	α-helix	trans	-58.9	-43.3	176.5	-62.7	166.9	0	0	0	110.3	S27 T28 G35	S27-I31 WeakPolarHBondContact O-CG1 3.34Å; S27-I31 PolarHBondContact O-N 2.97Å; T28-I31 PolarHBondContact O-N 3.42Å; I31-G35 PolarHBondContact O-N 2.94Å
32	W	89.6	Confident	82.9	Confident	156 Å²	156	72.9 Å²	72.9	59%	0.591	36%	0.359	S	S	*	.	H	α-helix	trans	-65	-44.1	176.8	-77.6	111.6	0	0	0	113.3	T28 Y29 R30 G35 Y36	T28-W32 PolarHBondContact O-N 2.86Å; T28-W32 VanDerWaalsContact O-N 3.14Å; Y29-W32 PolarHBondContact O-N 3.05Å; R30-W32 VanDerWaalsContact C-N 3.29Å; R30-W32 PolarHBondContact O-N 3.48Å; W32-G35 PolarHBondContact O-N 3.37Å; W32-Y36 WeakPolarHBondContact O-CB 3.37Å; W32-Y36 PolarHBondContact O-N 2.93Å
33	L	88.5	Confident	84.3	Confident	8 Å²	8	71.4 Å²	71.4	4%	0.042	36%	0.361	C	S	.	.	H	α-helix	trans	-69.3	-41.2	-179.9	-68.6	174.4	0	0	0	112.5	Y29 R30 Y36 C37 V93 L101 L257	Y29-L33 HydrophobicContact CD2-CD1 3.86Å; Y29-L33 HydrophobicContact CE2-CD1 4.41Å; Y29-L33 WeakPolarHBondContact O-CG 3.47Å; Y29-L33 PolarHBondContact O-N 3.27Å; R30-L33 PolarHBondContact O-N 3.48Å; L33-Y36 PolarHBondContact O-N 3.28Å; L33-C37 PolarHBondContact O-N 3.1Å; L33-C37 PolarHBondContact O-SG 3.39Å; L33-V93 HydrophobicContact CB-CG2 3.79Å; L33-V93 HydrophobicContact CD1-CG2 3.58Å; L33-V93 HydrophobicContact CG-CG2 4.31Å; L33-L101 HydrophobicContact CD1-CD1 4.09Å; L33-L101 HydrophobicContact CD1-CD2 4.41Å; L33-L257 HydrophobicContact CD1-CD1 4.48Å; L33-L257 HydrophobicContact CD2-CD1 3.39Å
34	Y	91.5	Very high	85.6	Confident	73 Å²	73	64.1 Å²	64.1	29%	0.286	33%	0.329	S	S	.	.	H	α-helix	trans	-64.3	-43.5	171.8	-71.8	-54.9	0	0	0	110.9	R30 Y36 C37 I38 I90 V93	R30-Y34 HydrophobicContact CB-CD2 4.23Å; R30-Y34 HydrophobicContact CB-CE2 4.12Å; R30-Y34 WeakPolarHBondContact O-CB 3.46Å; R30-Y34 WeakPolarHBondContact O-CD2 3.48Å; R30-Y34 PolarHBondContact O-N 3.49Å; Y34-Y36 VanDerWaalsContact C-N 3.3Å; Y34-Y36 PolarHBondContact O-N 3.47Å; Y34-C37 PolarHBondContact O-N 3.27Å; Y34-I38 VanDerWaalsContact O-CB 3.3Å; Y34-I38 WeakPolarHBondContact O-CB 3.39Å; Y34-I38 WeakPolarHBondContact O-CG1 3.48Å; Y34-I38 PolarHBondContact O-N 3.14Å; Y34-I90 HydrophobicContact CE1-CG2 4.4Å; Y34-V93 HydrophobicContact CD2-CG1 4.24Å; Y34-V93 HydrophobicContact CE1-CB 4.25Å; Y34-V93 HydrophobicContact CE1-CG1 3.96Å; Y34-V93 HydrophobicContact CE2-CG1 3.55Å; Y34-V93 WeakPolarHBondContact OH-CG1 3.48Å
35	G	92.2	Very high	87.3	Confident	36 Å²	36	65.1 Å²	65.1	37%	0.371	33%	0.331	S	S	.	.	H	α-helix	trans	-58.4	-41.5	174.8	0	0	0	0	0	112.4	I31 W32 L39	I31-G35 PolarHBondContact O-N 2.94Å; W32-G35 PolarHBondContact O-N 3.37Å; G35-L39 WeakPolarHBondContact O-CB 3.46Å; G35-L39 PolarHBondContact O-N 3.46Å
36	Y	91.8	Very high	88.7	Confident	25 Å²	25	60.3 Å²	60.3	10%	0.098	33%	0.325	C	S	.	.	H	α-helix	trans	-61.5	-48.4	174.6	178.3	-100.3	0	0	0	112	W32 L33 Y34 L39 L40 L86 F104 Y249 G253	W32-Y36 WeakPolarHBondContact O-CB 3.37Å; W32-Y36 PolarHBondContact O-N 2.93Å; L33-Y36 PolarHBondContact O-N 3.28Å; Y34-Y36 VanDerWaalsContact C-N 3.3Å; Y34-Y36 PolarHBondContact O-N 3.47Å; Y36-L39 PolarHBondContact O-N 2.87Å; Y36-L40 HydrophobicContact CE1-CD2 4.02Å; Y36-L40 WeakPolarHBondContact O-CB 3.34Å; Y36-L40 PolarHBondContact O-N 2.86Å; Y36-L86 HydrophobicContact CE1-CD2 4.42Å; Y36-F104 HydrophobicContact CE1-CZ 4.39Å; Y36-Y249 WeakPolarHBondContact CA-OH 3.48Å; Y36-Y249 HydrophobicContact CD2-CD1 4.48Å; Y36-Y249 AromaticContact CD2-CE1 3.5Å; Y36-Y249 HydrophobicContact CD2-CE1 3.5Å; Y36-Y249 AromaticContact CD2-CZ 3.56Å; Y36-Y249 VanDerWaalsContact CD2-OH 3.27Å; Y36-Y249 WeakPolarHBondContact CD2-OH 3.3Å; Y36-Y249 AromaticContact CE2-CD1 3.83Å; Y36-Y249 HydrophobicContact CE2-CD1 3.83Å; Y36-Y249 AromaticContact CE2-CE1 3.21Å; Y36-Y249 HydrophobicContact CE2-CE1 3.21Å; Y36-Y249 AromaticContact CE2-CZ 3.75Å; Y36-Y249 PolarHBondContact O-OH 3.44Å; Y36-G253 VanDerWaalsContact CE2-CA 3.48Å
37	C	91.9	Very high	89.6	Confident	4 Å²	4	60 Å²	60	3%	0.027	32%	0.323	C	S	.	.	H	α-helix	trans	-65.3	-43.7	179	-63.1	0	0	0	0	112.1	L33 Y34 L39 L40 L41 L86 I90	L33-C37 PolarHBondContact O-N 3.1Å; L33-C37 PolarHBondContact O-SG 3.39Å; Y34-C37 PolarHBondContact O-N 3.27Å; C37-L39 VanDerWaalsContact C-N 3.28Å; C37-L39 PolarHBondContact O-N 3.02Å; C37-L40 PolarHBondContact O-N 3.35Å; C37-L41 VanDerWaalsContact O-CB 3.3Å; C37-L41 WeakPolarHBondContact O-CB 3.36Å; C37-L41 PolarHBondContact O-N 3.25Å; C37-L86 HydrophobicContact CB-CD2 4.32Å; C37-I90 HydrophobicContact CB-CD1 4.16Å; C37-I90 HydrophobicContact CB-CG1 3.93Å
38	I	92.1	Very high	90.2	Very high	125 Å²	125	59 Å²	59	64%	0.641	32%	0.315	S	S	*	.	H	α-helix	trans	-63.6	-34.2	179.5	-72	168.1	0	0	0	111.1	Y34 P42	Y34-I38 VanDerWaalsContact O-CB 3.3Å; Y34-I38 WeakPolarHBondContact O-CB 3.39Å; Y34-I38 WeakPolarHBondContact O-CG1 3.48Å; Y34-I38 PolarHBondContact O-N 3.14Å; I38-P42 WeakPolarHBondContact O-CD 3.46Å; I38-P42 VanDerWaalsContact O-CG 3.31Å; I38-P42 WeakPolarHBondContact O-CG 3.36Å
39	L	92.1	Very high	90.5	Very high	94 Å²	94	59.1 Å²	59.1	49%	0.492	32%	0.315	S	S	.	.	H	α-helix	trans	-82	-38.3	176.6	-161.6	88.1	0	0	0	112.4	G35 Y36 C37 P42 V43 Y249	G35-L39 WeakPolarHBondContact O-CB 3.46Å; G35-L39 PolarHBondContact O-N 3.46Å; Y36-L39 PolarHBondContact O-N 2.87Å; C37-L39 VanDerWaalsContact C-N 3.28Å; C37-L39 PolarHBondContact O-N 3.02Å; L39-P42 VanDerWaalsContact O-CD 3.32Å; L39-P42 WeakPolarHBondContact O-CD 3.21Å; L39-P42 WeakPolarHBondContact O-CG 3.36Å; L39-V43 WeakPolarHBondContact O-CG2 3.48Å; L39-Y249 WeakPolarHBondContact CB-OH 3.2Å; L39-Y249 HydrophobicContact CD2-CD2 4.04Å; L39-Y249 HydrophobicContact CD2-CE1 4.35Å; L39-Y249 HydrophobicContact CD2-CE2 3.21Å; L39-Y249 WeakPolarHBondContact CD2-OH 3.14Å; L39-Y249 HydrophobicContact CG-CE2 4.47Å
40	L	91.6	Very high	90.7	Very high	6 Å²	6	60.5 Å²	60.5	3%	0.031	33%	0.329	C	S	.	.	H	α-helix	trans	-70	-37.8	-178.4	-165.5	68.6	0	0	0	112.4	Y36 C37 V43 L44 L86 L246 Y249 R250	Y36-L40 HydrophobicContact CE1-CD2 4.02Å; Y36-L40 WeakPolarHBondContact O-CB 3.34Å; Y36-L40 PolarHBondContact O-N 2.86Å; C37-L40 PolarHBondContact O-N 3.35Å; L40-V43 PolarHBondContact O-N 3.31Å; L40-L44 WeakPolarHBondContact O-CB 3.33Å; L40-L44 PolarHBondContact O-N 3.37Å; L40-L86 HydrophobicContact CB-CD1 4.15Å; L40-L86 HydrophobicContact CB-CD2 4.21Å; L40-L86 HydrophobicContact CD2-CD1 3.93Å; L40-L86 HydrophobicContact CD2-CD2 3.64Å; L40-L86 HydrophobicContact CD2-CG 4Å; L40-L86 HydrophobicContact CG-CD1 4.1Å; L40-L86 HydrophobicContact CG-CD2 4.4Å; L40-L246 HydrophobicContact CD1-CD1 3.72Å; L40-Y249 HydrophobicContact CB-CE1 4.01Å; L40-Y249 HydrophobicContact CD1-CD1 3.49Å; L40-Y249 VanDerWaalsContact CD1-CD1 3.49Å; L40-Y249 HydrophobicContact CD1-CE1 3.69Å; L40-Y249 HydrophobicContact CG-CE1 4.42Å; L40-R250 HydrophobicContact CD1-CG 4.3Å
41	L	92.2	Very high	90.7	Very high	81 Å²	81	58 Å²	58	42%	0.424	32%	0.321	S	S	.	.	H	α-helix	trans	-57.3	-52	-177.8	-172.7	70.6	0	0	0	113.8	C37 V43 L44 I45 L86	C37-L41 VanDerWaalsContact O-CB 3.3Å; C37-L41 WeakPolarHBondContact O-CB 3.36Å; C37-L41 PolarHBondContact O-N 3.25Å; L41-V43 VanDerWaalsContact C-N 3.31Å; L41-V43 PolarHBondContact O-N 3.01Å; L41-L44 WeakPolarHBondContact O-CB 3.45Å; L41-L44 PolarHBondContact O-N 2.95Å; L41-I45 HydrophobicContact CD1-CD1 4.47Å; L41-I45 HydrophobicContact CG-CD1 4.1Å; L41-I45 WeakPolarHBondContact O-CG1 3.26Å; L41-I45 PolarHBondContact O-N 3.46Å; L41-L86 HydrophobicContact CB-CD1 4.44Å; L41-L86 HydrophobicContact CD1-CD1 4.31Å
42	P	91.8	Very high	90.7	Very high	69 Å²	69	58.5 Å²	58.5	45%	0.448	32%	0.316	S	S	.	.	H	α-helix	trans	-66.1	-33.1	177.4	26.1	-34.9	0	0	0	112.2	I38 L39 L44 I45 A46	I38-P42 WeakPolarHBondContact O-CD 3.46Å; I38-P42 VanDerWaalsContact O-CG 3.31Å; I38-P42 WeakPolarHBondContact O-CG 3.36Å; L39-P42 VanDerWaalsContact O-CD 3.32Å; L39-P42 WeakPolarHBondContact O-CD 3.21Å; L39-P42 WeakPolarHBondContact O-CG 3.36Å; P42-L44 VanDerWaalsContact C-N 3.35Å; P42-I45 PolarHBondContact O-N 3.17Å; P42-A46 WeakPolarHBondContact O-CB 3.33Å; P42-A46 PolarHBondContact O-N 3.01Å
43	V	90.5	Very high	90.6	Very high	64 Å²	64	57.2 Å²	57.2	39%	0.388	32%	0.315	S	S	.	.	H	α-helix	trans	-64.1	-42.6	174.4	176	0	0	0	0	110.5	L39 L40 L41 A46 S47 L246	L39-V43 WeakPolarHBondContact O-CG2 3.48Å; L40-V43 PolarHBondContact O-N 3.31Å; L41-V43 VanDerWaalsContact C-N 3.31Å; L41-V43 PolarHBondContact O-N 3.01Å; V43-A46 PolarHBondContact O-N 2.98Å; V43-S47 WeakPolarHBondContact O-CB 3.22Å; V43-S47 PolarHBondContact O-N 2.76Å; V43-S47 PolarHBondContact O-OG 2.89Å; V43-L246 HydrophobicContact CG1-CD1 3.88Å
44	L	91.9	Very high	90.4	Very high	9 Å²	9	57.6 Å²	57.6	5%	0.047	32%	0.317	C	S	.	.	H	α-helix	trans	-62.9	-47.4	176.5	-176.4	62.8	0	0	0	111.6	L40 L41 P42 S47 T48 A79 Q82 A83 L86	L40-L44 WeakPolarHBondContact O-CB 3.33Å; L40-L44 PolarHBondContact O-N 3.37Å; L41-L44 WeakPolarHBondContact O-CB 3.45Å; L41-L44 PolarHBondContact O-N 2.95Å; P42-L44 VanDerWaalsContact C-N 3.35Å; L44-S47 PolarHBondContact O-N 3.5Å; L44-S47 PolarHBondContact O-OG 2.76Å; L44-T48 PolarHBondContact O-N 3.46Å; L44-T48 PolarHBondContact O-OG1 3.46Å; L44-A79 HydrophobicContact CD1-CB 3.95Å; L44-Q82 HydrophobicContact CD1-CB 4.27Å; L44-Q82 HydrophobicContact CD2-CB 4.06Å; L44-A83 HydrophobicContact CD2-CB 4.05Å; L44-L86 HydrophobicContact CD2-CD1 4.34Å
45	I	92.5	Very high	90.1	Very high	96 Å²	96	56 Å²	56	49%	0.492	31%	0.313	S	S	.	.	H	α-helix	trans	-61.5	-49.2	176.7	-66.2	166.9	0	0	0	110.1	L41 P42 S47 T48 V49	L41-I45 HydrophobicContact CD1-CD1 4.47Å; L41-I45 HydrophobicContact CG-CD1 4.1Å; L41-I45 WeakPolarHBondContact O-CG1 3.26Å; L41-I45 PolarHBondContact O-N 3.46Å; P42-I45 PolarHBondContact O-N 3.17Å; I45-S47 VanDerWaalsContact C-N 3.32Å; I45-S47 PolarHBondContact O-N 3.31Å; I45-T48 PolarHBondContact O-N 3.38Å; I45-V49 HydrophobicContact CG2-CG2 4.26Å; I45-V49 WeakPolarHBondContact O-CB 3.31Å; I45-V49 VanDerWaalsContact O-CG2 3.29Å; I45-V49 WeakPolarHBondContact O-CG2 3.48Å; I45-V49 PolarHBondContact O-N 2.89Å
46	A	90.5	Very high	89.8	Confident	58 Å²	58	58.8 Å²	58.8	48%	0.479	32%	0.316	S	S	.	.	H	α-helix	trans	-60.5	-41.1	179.7	0	0	0	0	0	111.9	P42 V43 V49 A50	P42-A46 WeakPolarHBondContact O-CB 3.33Å; P42-A46 PolarHBondContact O-N 3.01Å; V43-A46 PolarHBondContact O-N 2.98Å; A46-V49 PolarHBondContact O-N 3.12Å; A46-A50 WeakPolarHBondContact O-CB 3.36Å; A46-A50 PolarHBondContact O-N 3.49Å
47	S	87.7	Confident	89.5	Confident	24 Å²	24	59.9 Å²	59.9	17%	0.168	32%	0.324	C	S	.	.	H	α-helix	trans	-65.2	-41.1	175.9	69.8	0	0	0	0	112.3	V43 L44 I45 A50 I51	V43-S47 WeakPolarHBondContact O-CB 3.22Å; V43-S47 PolarHBondContact O-N 2.76Å; V43-S47 PolarHBondContact O-OG 2.89Å; L44-S47 PolarHBondContact O-N 3.5Å; L44-S47 PolarHBondContact O-OG 2.76Å; I45-S47 VanDerWaalsContact C-N 3.32Å; I45-S47 PolarHBondContact O-N 3.31Å; S47-A50 PolarHBondContact O-N 2.87Å; S47-I51 WeakPolarHBondContact O-CD1 3.49Å; S47-I51 VanDerWaalsContact O-CG1 3.24Å; S47-I51 WeakPolarHBondContact O-CG1 3.24Å; S47-I51 PolarHBondContact O-N 2.97Å
48	T	90.2	Very high	88.9	Confident	43 Å²	43	63.7 Å²	63.7	26%	0.264	34%	0.344	S	S	.	.	H	α-helix	trans	-65.5	-43.4	177.5	-53.6	0	0	0	0	111.1	L44 I45 I51 Y52 Y76	L44-T48 PolarHBondContact O-N 3.46Å; L44-T48 PolarHBondContact O-OG1 3.46Å; I45-T48 PolarHBondContact O-N 3.38Å; T48-I51 PolarHBondContact O-N 3.44Å; T48-Y52 PolarHBondContact O-N 2.94Å; T48-Y76 HydrophobicContact CG2-CD1 4.38Å; T48-Y76 HydrophobicContact CG2-CE1 4.21Å
49	V	90.8	Very high	88.4	Confident	68 Å²	68	59.4 Å²	59.4	41%	0.412	32%	0.32	S	S	.	.	H	α-helix	trans	-65.4	-41	175.5	171.3	0	0	0	0	110.9	I45 A46 Y52 F53	I45-V49 HydrophobicContact CG2-CG2 4.26Å; I45-V49 WeakPolarHBondContact O-CB 3.31Å; I45-V49 VanDerWaalsContact O-CG2 3.29Å; I45-V49 WeakPolarHBondContact O-CG2 3.48Å; I45-V49 PolarHBondContact O-N 2.89Å; A46-V49 PolarHBondContact O-N 3.12Å; V49-Y52 WeakPolarHBondContact O-CB 3.47Å; V49-Y52 PolarHBondContact O-N 3.33Å; V49-F53 HydrophobicContact CG1-CD2 3.55Å; V49-F53 HydrophobicContact CG1-CE2 3.45Å; V49-F53 VanDerWaalsContact CG1-CE2 3.45Å; V49-F53 VanDerWaalsContact O-CD2 3.25Å; V49-F53 WeakPolarHBondContact O-CD2 3.35Å; V49-F53 PolarHBondContact O-N 3.19Å
50	A	88	Confident	88	Confident	38 Å²	38	55.1 Å²	55.1	31%	0.314	30%	0.297	S	S	.	.	H	α-helix	trans	-63.3	-42.1	176.2	0	0	0	0	0	111.9	A46 S47 F53 F54	A46-A50 WeakPolarHBondContact O-CB 3.36Å; A46-A50 PolarHBondContact O-N 3.49Å; S47-A50 PolarHBondContact O-N 2.87Å; A50-F53 PolarHBondContact O-N 2.92Å; A50-F54 VanDerWaalsContact O-CB 3.24Å; A50-F54 WeakPolarHBondContact O-CB 3.36Å; A50-F54 PolarHBondContact O-N 3.35Å
51	I	86.9	Confident	87.5	Confident	30 Å²	30	57.9 Å²	57.9	15%	0.154	31%	0.31	C	S	.	.	H	α-helix	trans	-61.6	-45.4	173.6	-69	162.7	0	0	0	110.3	S47 T48 F54 L55 W72 L75	S47-I51 WeakPolarHBondContact O-CD1 3.49Å; S47-I51 VanDerWaalsContact O-CG1 3.24Å; S47-I51 WeakPolarHBondContact O-CG1 3.24Å; S47-I51 PolarHBondContact O-N 2.97Å; T48-I51 PolarHBondContact O-N 3.44Å; I51-F54 WeakPolarHBondContact O-CB 3.42Å; I51-F54 PolarHBondContact O-N 3.19Å; I51-L55 HydrophobicContact CG2-CD1 4.21Å; I51-L55 WeakPolarHBondContact O-CG 3.38Å; I51-L55 PolarHBondContact O-N 3.36Å; I51-W72 HydrophobicContact CG2-CE3 4.23Å; I51-W72 HydrophobicContact CG2-CZ3 4.19Å; I51-L75 HydrophobicContact CD1-CB 4.44Å; I51-L75 HydrophobicContact CD1-CD1 4.34Å
52	Y	89.5	Confident	86.9	Confident	121 Å²	121	54.3 Å²	54.3	48%	0.475	29%	0.291	S	S	.	.	H	α-helix	trans	-58.1	-50.6	176.3	173.9	-97.2	0	0	0	111.8	T48 V49 F54 L55 Q56	T48-Y52 PolarHBondContact O-N 2.94Å; V49-Y52 WeakPolarHBondContact O-CB 3.47Å; V49-Y52 PolarHBondContact O-N 3.33Å; Y52-F54 VanDerWaalsContact C-N 3.31Å; Y52-F54 PolarHBondContact O-N 3.05Å; Y52-L55 PolarHBondContact O-N 3.37Å; Y52-Q56 HydrophobicContact CD1-CG 4.45Å; Y52-Q56 HydrophobicContact CE1-CG 4.05Å; Y52-Q56 HydrophobicContact CE2-CG 4.33Å; Y52-Q56 WeakPolarHBondContact O-CG 3.38Å; Y52-Q56 PolarHBondContact O-N 3.48Å; Y52-Q56 VanDerWaalsContact O-N 3.13Å
53	F	87.6	Confident	86.3	Confident	129 Å²	129	51.3 Å²	51.3	57%	0.566	27%	0.271	S	S	*	.	H	α-helix	trans	-63	-38.6	177	-81.8	-66.3	0	0	0	112	V49 A50 L55 Q56 L57	V49-F53 HydrophobicContact CG1-CD2 3.55Å; V49-F53 HydrophobicContact CG1-CE2 3.45Å; V49-F53 VanDerWaalsContact CG1-CE2 3.45Å; V49-F53 VanDerWaalsContact O-CD2 3.25Å; V49-F53 WeakPolarHBondContact O-CD2 3.35Å; V49-F53 PolarHBondContact O-N 3.19Å; A50-F53 PolarHBondContact O-N 2.92Å; F53-L55 VanDerWaalsContact C-N 3.32Å; F53-L55 PolarHBondContact O-N 3.43Å; F53-Q56 CarbonylContact O-C 3.51Å; F53-Q56 WeakPolarHBondContact O-CA 3.22Å; F53-Q56 WeakPolarHBondContact O-CB 2.8Å; F53-Q56 PolarHBondContact O-N 3.49Å; F53-L57 WeakPolarHBondContact O-CD1 3.48Å; F53-L57 PolarHBondContact O-N 2.95Å
54	F	85.6	Confident	85.3	Confident	17 Å²	17	50.3 Å²	50.3	8%	0.075	27%	0.266	C	S	.	.	H	α-helix	trans	-57.7	-45.1	176.8	-178.9	-104.8	0	0	0	111.8	A50 I51 Y52 Q56 L57 M60 W72 Y238	A50-F54 VanDerWaalsContact O-CB 3.24Å; A50-F54 WeakPolarHBondContact O-CB 3.36Å; A50-F54 PolarHBondContact O-N 3.35Å; I51-F54 WeakPolarHBondContact O-CB 3.42Å; I51-F54 PolarHBondContact O-N 3.19Å; Y52-F54 VanDerWaalsContact C-N 3.31Å; Y52-F54 PolarHBondContact O-N 3.05Å; F54-Q56 PolarHBondContact O-N 3.5Å; F54-L57 HydrophobicContact CD2-CD1 4.39Å; F54-L57 WeakPolarHBondContact O-CD1 3.49Å; F54-L57 PolarHBondContact O-N 3.42Å; F54-M60 HydrophobicContact CD1-CE 4.17Å; F54-M60 HydrophobicContact CE1-CE 3.37Å; F54-M60 HydrophobicContact CE1-CG 4.32Å; F54-M60 HydrophobicContact CE1-SD 3.89Å; F54-M60 HydrophobicContact CE2-CG 4.48Å; F54-M60 HydrophobicContact CE2-SD 4.33Å; F54-M60 HydrophobicContact CZ-CE 3.76Å; F54-M60 HydrophobicContact CZ-CG 4.22Å; F54-M60 HydrophobicContact CZ-SD 3.64Å; F54-M60 WeakPolarHBondContact O-CG 3.42Å; F54-W72 HydrophobicContact CD1-CH2 4.18Å; F54-W72 HydrophobicContact CE1-CH2 4.09Å; F54-Y238 HydrophobicContact CD2-CD1 4.49Å; F54-Y238 AromaticContact CD2-CD2 3.97Å; F54-Y238 HydrophobicContact CD2-CD2 3.97Å; F54-Y238 AromaticContact CD2-CG 3.84Å; F54-Y238 HydrophobicContact CD2-CG 3.84Å; F54-Y238 HydrophobicContact CE2-CD2 4.1Å; F54-Y238 HydrophobicContact CE2-CG 4.28Å
55	L	84.9	Confident	84.5	Confident	40 Å²	40	51.3 Å²	51.3	21%	0.209	27%	0.27	C	S	.	.	H	α-helix	trans	-66	-25.3	174.8	-68.9	174.3	0	0	0	113.4	I51 Y52 F53 W72 Y76	I51-L55 HydrophobicContact CG2-CD1 4.21Å; I51-L55 WeakPolarHBondContact O-CG 3.38Å; I51-L55 PolarHBondContact O-N 3.36Å; Y52-L55 PolarHBondContact O-N 3.37Å; F53-L55 VanDerWaalsContact C-N 3.32Å; F53-L55 PolarHBondContact O-N 3.43Å; L55-W72 HydrophobicContact CD1-CD2 4.24Å; L55-W72 HydrophobicContact CD1-CE3 4.03Å; L55-W72 HydrophobicContact CD1-CZ3 4.44Å; L55-W72 HydrophobicContact CD2-CD2 3.8Å; L55-W72 HydrophobicContact CD2-CE3 3.89Å; L55-W72 HydrophobicContact CD2-CH2 3.61Å; L55-W72 HydrophobicContact CD2-CZ2 3.5Å; L55-W72 VanDerWaalsContact CD2-CZ2 3.5Å; L55-W72 HydrophobicContact CD2-CZ3 3.8Å; L55-W72 HydrophobicContact CG-CE3 4.28Å; L55-W72 HydrophobicContact CG-CH2 4.44Å; L55-W72 HydrophobicContact CG-CZ3 4.23Å; L55-Y76 HydrophobicContact CD1-CE2 4.4Å
56	Q	86.2	Confident	83.7	Confident	93 Å²	93	50.6 Å²	50.6	44%	0.435	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-4.9	176.5	-66.1	-65	-18.3	0	0	113.7	Y52 F53 F54 D58	Y52-Q56 HydrophobicContact CD1-CG 4.45Å; Y52-Q56 HydrophobicContact CE1-CG 4.05Å; Y52-Q56 HydrophobicContact CE2-CG 4.33Å; Y52-Q56 WeakPolarHBondContact O-CG 3.38Å; Y52-Q56 PolarHBondContact O-N 3.48Å; Y52-Q56 VanDerWaalsContact O-N 3.13Å; F53-Q56 CarbonylContact O-C 3.51Å; F53-Q56 WeakPolarHBondContact O-CA 3.22Å; F53-Q56 WeakPolarHBondContact O-CB 2.8Å; F53-Q56 PolarHBondContact O-N 3.49Å; F54-Q56 PolarHBondContact O-N 3.5Å; Q56-D58 PolarHBondContact O-N 3.34Å
57	L	84.6	Confident	82.9	Confident	49 Å²	49	54.8 Å²	54.8	26%	0.257	28%	0.276	S	S	.	.	S	Bend	trans	-61.4	131.6	172.9	-89.8	92.9	0	0	0	109.8	F53 F54 W59 M60 Q61 W230	F53-L57 WeakPolarHBondContact O-CD1 3.48Å; F53-L57 PolarHBondContact O-N 2.95Å; F54-L57 HydrophobicContact CD2-CD1 4.39Å; F54-L57 WeakPolarHBondContact O-CD1 3.49Å; F54-L57 PolarHBondContact O-N 3.42Å; L57-W59 PolarHBondContact O-N 2.97Å; L57-M60 HydrophobicContact CB-CB 4.47Å; L57-M60 HydrophobicContact CB-CG 4.18Å; L57-M60 WeakPolarHBondContact O-CB 3.09Å; L57-M60 PolarHBondContact O-N 2.94Å; L57-Q61 PolarHBondContact O-N 3.16Å; L57-W230 HydrophobicContact CD2-CH2 4.03Å; L57-W230 HydrophobicContact CD2-CZ2 4.05Å
58	D	80.3	Confident	82.4	Confident	83 Å²	83	58.8 Å²	58.8	44%	0.444	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.7	-33.1	179.5	-73.1	-40.8	0	0	0	113.2	Q56 Q61 R167	Q56-D58 PolarHBondContact O-N 3.34Å; D58-Q61 PolarHBondContact O-N 3.35Å; D58-R167 HydrophobicContact CB-CG 4.41Å; D58-R167 IonicContact OD1-NE 2.96Å
59	W	81.4	Confident	82.1	Confident	36 Å²	36	58.9 Å²	58.9	14%	0.136	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-32.6	-176.6	-54.8	20.6	0	0	0	111.5	L57 Q61 V62 F63 I171 Q174 L175 L227 W230	L57-W59 PolarHBondContact O-N 2.97Å; W59-Q61 VanDerWaalsContact C-N 3.27Å; W59-Q61 PolarHBondContact O-N 3.43Å; W59-V62 PolarHBondContact O-N 3.26Å; W59-F63 WeakPolarHBondContact O-CD2 3.38Å; W59-I171 HydrophobicContact CG-CG1 4.39Å; W59-Q174 HydrophobicContact CZ2-CB 4.49Å; W59-Q174 VanDerWaalsContact NE1-OE1 3.12Å; W59-L175 HydrophobicContact CH2-CD2 4.24Å; W59-L175 HydrophobicContact CZ3-CD1 4.46Å; W59-L175 HydrophobicContact CZ3-CD2 4.09Å; W59-L175 HydrophobicContact CZ3-CG 4.4Å; W59-L227 HydrophobicContact CE3-CD1 4.15Å; W59-W230 HydrophobicContact CB-CH2 3.64Å; W59-W230 HydrophobicContact CB-CZ2 4.39Å; W59-W230 HydrophobicContact CB-CZ3 3.82Å; W59-W230 HydrophobicContact CD2-CD2 4.27Å; W59-W230 AromaticContact CD2-CE2 3.86Å; W59-W230 HydrophobicContact CD2-CE3 4.34Å; W59-W230 AromaticContact CD2-CH2 3.7Å; W59-W230 HydrophobicContact CD2-CH2 3.7Å; W59-W230 AromaticContact CD2-CZ2 3.56Å; W59-W230 HydrophobicContact CD2-CZ2 3.56Å; W59-W230 HydrophobicContact CD2-CZ3 4.09Å; W59-W230 AromaticContact CE3-CD2 3.19Å; W59-W230 HydrophobicContact CE3-CD2 3.19Å; W59-W230 AromaticContact CE3-CE2 3.14Å; W59-W230 AromaticContact CE3-CE3 3.35Å; W59-W230 HydrophobicContact CE3-CE3 3.35Å; W59-W230 AromaticContact CE3-CG 3.85Å; W59-W230 HydrophobicContact CE3-CG 3.85Å; W59-W230 AromaticContact CE3-CH2 3.52Å; W59-W230 HydrophobicContact CE3-CH2 3.52Å; W59-W230 AromaticContact CE3-CZ2 3.32Å; W59-W230 HydrophobicContact CE3-CZ2 3.32Å; W59-W230 AromaticContact CE3-CZ3 3.53Å; W59-W230 HydrophobicContact CE3-CZ3 3.53Å; W59-W230 AromaticContact CE3-NE1 3.71Å; W59-W230 AromaticContact CG-CH2 3.88Å; W59-W230 HydrophobicContact CG-CH2 3.88Å; W59-W230 HydrophobicContact CG-CZ2 4.14Å; W59-W230 HydrophobicContact CG-CZ3 4.32Å; W59-W230 AromaticContact CH2-CD1 3.57Å; W59-W230 HydrophobicContact CH2-CD2 4.09Å; W59-W230 AromaticContact CH2-CE2 3.61Å; W59-W230 HydrophobicContact CH2-CG 4.07Å; W59-W230 HydrophobicContact CH2-CZ2 4.16Å; W59-W230 AromaticContact CH2-NE1 3.22Å; W59-W230 HydrophobicContact CZ2-CZ2 4.33Å; W59-W230 HydrophobicContact CZ3-CB 4.1Å; W59-W230 AromaticContact CZ3-CD1 3.23Å; W59-W230 AromaticContact CZ3-CD2 3.13Å; W59-W230 HydrophobicContact CZ3-CD2 3.13Å; W59-W230 AromaticContact CZ3-CE2 3.06Å; W59-W230 AromaticContact CZ3-CE3 3.8Å; W59-W230 HydrophobicContact CZ3-CE3 3.8Å; W59-W230 AromaticContact CZ3-CG 3.25Å; W59-W230 HydrophobicContact CZ3-CG 3.25Å; W59-W230 HydrophobicContact CZ3-CH2 4.32Å; W59-W230 AromaticContact CZ3-CZ2 3.71Å; W59-W230 HydrophobicContact CZ3-CZ2 3.71Å; W59-W230 HydrophobicContact CZ3-CZ3 4.35Å; W59-W230 AromaticContact CZ3-NE1 3.08Å
60	M	82.5	Confident	82.1	Confident	4 Å²	4	62 Å²	62	2%	0.02	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-68.5	-30.6	176.4	-72	-62	-65.9	0	0	111.2	F54 L57 V62 F63 F65 W72	F54-M60 HydrophobicContact CD1-CE 4.17Å; F54-M60 HydrophobicContact CE1-CE 3.37Å; F54-M60 HydrophobicContact CE1-CG 4.32Å; F54-M60 HydrophobicContact CE1-SD 3.89Å; F54-M60 HydrophobicContact CE2-CG 4.48Å; F54-M60 HydrophobicContact CE2-SD 4.33Å; F54-M60 HydrophobicContact CZ-CE 3.76Å; F54-M60 HydrophobicContact CZ-CG 4.22Å; F54-M60 HydrophobicContact CZ-SD 3.64Å; F54-M60 WeakPolarHBondContact O-CG 3.42Å; L57-M60 HydrophobicContact CB-CB 4.47Å; L57-M60 HydrophobicContact CB-CG 4.18Å; L57-M60 WeakPolarHBondContact O-CB 3.09Å; L57-M60 PolarHBondContact O-N 2.94Å; M60-V62 PolarHBondContact O-N 3.43Å; M60-F63 PolarHBondContact O-N 3.4Å; M60-F65 HydrophobicContact CE-CD2 3.57Å; M60-F65 HydrophobicContact CE-CE2 3.18Å; M60-F65 HydrophobicContact CE-CZ 3.95Å; M60-F65 HydrophobicContact SD-CE2 4.09Å; M60-W72 HydrophobicContact CE-CZ2 4.49Å
61	Q	81.6	Confident	82.1	Confident	64 Å²	64	60.8 Å²	60.8	30%	0.299	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-75.6	-6.1	177.8	-57.7	-170.7	12.7	0	0	114.2	L57 D58 W59 R167	L57-Q61 PolarHBondContact O-N 3.16Å; D58-Q61 PolarHBondContact O-N 3.35Å; W59-Q61 VanDerWaalsContact C-N 3.27Å; W59-Q61 PolarHBondContact O-N 3.43Å; Q61-R167 VanDerWaalsContact CB-NH1 3.27Å
62	V	79	Confident	82.2	Confident	5 Å²	5	60.2 Å²	60.2	3%	0.03	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-79.6	-29.9	170.2	175.8	0	0	0	0	110.8	W59 M60 R167 W168 I171	W59-V62 PolarHBondContact O-N 3.26Å; M60-V62 PolarHBondContact O-N 3.43Å; V62-R167 HydrophobicContact CG2-CB 3.98Å; V62-W168 HydrophobicContact CG1-CE3 4.05Å; V62-W168 HydrophobicContact CG1-CZ3 4.31Å; V62-I171 HydrophobicContact CB-CD1 4.17Å; V62-I171 HydrophobicContact CG1-CD1 4.33Å; V62-I171 HydrophobicContact CG2-CD1 3.63Å
63	F	79.9	Confident	82.3	Confident	6 Å²	6	58.4 Å²	58.4	3%	0.026	28%	0.283	C	S	.	.	S	Bend	trans	-77.5	148	171.2	-65.8	-82.6	0	0	0	109.9	W59 M60 F65 F129 I137 L227 M231	W59-F63 WeakPolarHBondContact O-CD2 3.38Å; M60-F63 PolarHBondContact O-N 3.4Å; F63-F65 HydrophobicContact CB-CD2 3.52Å; F63-F65 HydrophobicContact CB-CE2 3.29Å; F63-F65 HydrophobicContact CB-CG 4.39Å; F63-F65 HydrophobicContact CB-CZ 4.01Å; F63-F65 HydrophobicContact CD2-CE2 4.17Å; F63-F65 AromaticContact CG-CE2 3.84Å; F63-F65 HydrophobicContact CG-CE2 3.84Å; F63-F65 HydrophobicContact CG-CZ 4.39Å; F63-F65 PolarHBondContact O-N 2.93Å; F63-F129 HydrophobicContact CB-CZ 4.31Å; F63-F129 AromaticContact CD1-CE1 3.99Å; F63-F129 HydrophobicContact CD1-CE1 3.99Å; F63-F129 AromaticContact CD1-CZ 3.73Å; F63-F129 HydrophobicContact CD1-CZ 3.73Å; F63-F129 HydrophobicContact CE1-CE1 4.29Å; F63-F129 HydrophobicContact CE1-CZ 4.44Å; F63-F129 HydrophobicContact CG-CZ 4.29Å; F63-I137 HydrophobicContact CD1-CD1 4.35Å; F63-I137 HydrophobicContact CE1-CD1 3.72Å; F63-I137 HydrophobicContact CE1-CG1 4.41Å; F63-I137 HydrophobicContact CZ-CD1 4.25Å; F63-L227 HydrophobicContact CE2-CD1 4.39Å; F63-L227 HydrophobicContact CE2-CD2 4.22Å; F63-L227 HydrophobicContact CE2-CG 4.28Å; F63-L227 HydrophobicContact CZ-CD2 3.81Å; F63-L227 HydrophobicContact CZ-CG 3.95Å; F63-M231 HydrophobicContact CD2-SD 4.3Å; F63-M231 HydrophobicContact CE1-CE 4.45Å; F63-M231 HydrophobicContact CE1-SD 4Å; F63-M231 HydrophobicContact CE2-SD 3.74Å; F63-M231 HydrophobicContact CZ-CE 4.3Å; F63-M231 HydrophobicContact CZ-SD 3.57Å; F63-M231 VanDerWaalsContact CZ-SD 3.57Å
64	P	69.3	Low	82.6	Confident	43 Å²	43	54.5 Å²	54.5	28%	0.279	26%	0.264	S	S	.	.			trans	-81.6	43.6	-176.4	42.7	-44.3	0	0	0	111.2	D66 F136	P64-D66 VanDerWaalsContact C-N 3.27Å; P64-D66 PolarHBondContact O-N 3.34Å; P64-F136 HydrophobicContact CB-CD1 4.16Å; P64-F136 HydrophobicContact CB-CE1 3.2Å; P64-F136 HydrophobicContact CB-CE2 3.96Å; P64-F136 HydrophobicContact CB-CZ 3.08Å; P64-F136 VanDerWaalsContact CD-CD1 3.48Å; P64-F136 HydrophobicContact CG-CD1 3.45Å; P64-F136 VanDerWaalsContact CG-CD1 3.45Å; P64-F136 HydrophobicContact CG-CD2 4.15Å; P64-F136 HydrophobicContact CG-CE1 3Å; P64-F136 HydrophobicContact CG-CE2 3.74Å; P64-F136 HydrophobicContact CG-CG 4.04Å; P64-F136 HydrophobicContact CG-CZ 3.19Å
65	F	75.7	Confident	82.9	Confident	31 Å²	31	54.9 Å²	54.9	14%	0.136	27%	0.267	C	S	.	.			trans	-66	101	174.9	-65.1	-60.5	0	0	0	106.7	M60 F63 H67 W72 W125 W126 F129	M60-F65 HydrophobicContact CE-CD2 3.57Å; M60-F65 HydrophobicContact CE-CE2 3.18Å; M60-F65 HydrophobicContact CE-CZ 3.95Å; M60-F65 HydrophobicContact SD-CE2 4.09Å; F63-F65 HydrophobicContact CB-CD2 3.52Å; F63-F65 HydrophobicContact CB-CE2 3.29Å; F63-F65 HydrophobicContact CB-CG 4.39Å; F63-F65 HydrophobicContact CB-CZ 4.01Å; F63-F65 HydrophobicContact CD2-CE2 4.17Å; F63-F65 AromaticContact CG-CE2 3.84Å; F63-F65 HydrophobicContact CG-CE2 3.84Å; F63-F65 HydrophobicContact CG-CZ 4.39Å; F63-F65 PolarHBondContact O-N 2.93Å; F65-H67 PolarHBondContact O-N 2.95Å; F65-W72 HydrophobicContact CD1-CZ2 4.44Å; F65-W72 HydrophobicContact CG-CZ2 4.49Å; F65-W125 AromaticContact CE1-CH2 3.92Å; F65-W125 HydrophobicContact CE1-CH2 3.92Å; F65-W126 HydrophobicContact CZ-CZ3 4.47Å; F65-F129 HydrophobicContact CD1-CZ 4.46Å; F65-F129 HydrophobicContact CE1-CD2 4.42Å; F65-F129 AromaticContact CE1-CE1 3.94Å; F65-F129 HydrophobicContact CE1-CE1 3.94Å; F65-F129 AromaticContact CE1-CE2 3.74Å; F65-F129 HydrophobicContact CE1-CE2 3.74Å; F65-F129 AromaticContact CE1-CZ 3.46Å; F65-F129 HydrophobicContact CE1-CZ 3.46Å; F65-F129 VanDerWaalsContact CE1-CZ 3.46Å; F65-F129 HydrophobicContact CE2-CZ 4.24Å; F65-F129 HydrophobicContact CZ-CD1 4.42Å; F65-F129 AromaticContact CZ-CE1 3.54Å; F65-F129 HydrophobicContact CZ-CE1 3.54Å; F65-F129 HydrophobicContact CZ-CE2 4.11Å; F65-F129 AromaticContact CZ-CZ 3.34Å; F65-F129 HydrophobicContact CZ-CZ 3.34Å
66	D	76.4	Confident	83.2	Confident	80 Å²	80	57 Å²	57	43%	0.428	27%	0.273	S	S	.	.			trans	-65.7	131	167.3	-157	-8	0	0	0	106	P64 L68 E69	P64-D66 VanDerWaalsContact C-N 3.27Å; P64-D66 PolarHBondContact O-N 3.34Å; D66-L68 PolarHBondContact O-N 3.11Å; D66-E69 HydrophobicContact CB-CG 4.17Å; D66-E69 WeakPolarHBondContact O-CB 3.3Å; D66-E69 WeakPolarHBondContact O-CG 3.48Å; D66-E69 PolarHBondContact O-N 3.44Å
67	H	73.9	Confident	83.6	Confident	147 Å²	147	55 Å²	55	68%	0.681	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-18.4	173.1	57.4	-65.9	0	0	0	112.3	F65	F65-H67 PolarHBondContact O-N 2.95Å
68	L	75.7	Confident	84	Confident	108 Å²	108	53.4 Å²	53.4	57%	0.565	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	6.6	175.2	-66.5	168.2	0	0	0	114.6	D66 F70 I73	D66-L68 PolarHBondContact O-N 3.11Å; L68-F70 PolarHBondContact O-N 3.2Å; L68-I73 HydrophobicContact CD2-CD1 4.44Å; L68-I73 VanDerWaalsContact O-CD1 3.24Å; L68-I73 WeakPolarHBondContact O-CD1 3.23Å
69	E	85.1	Confident	84.7	Confident	45 Å²	45	50.1 Å²	50.1	21%	0.21	25%	0.249	C	C	.	.	S	Bend	trans	-62.2	139.2	172.2	-74.6	-174.2	-167.7	0	0	110.8	D66 H71 W72 I73	D66-E69 HydrophobicContact CB-CG 4.17Å; D66-E69 WeakPolarHBondContact O-CB 3.3Å; D66-E69 WeakPolarHBondContact O-CG 3.48Å; D66-E69 PolarHBondContact O-N 3.44Å; E69-H71 PolarHBondContact O-N 3.48Å; E69-W72 PolarHBondContact O-N 2.96Å; E69-I73 PolarHBondContact O-N 3.47Å
70	F	90.1	Very high	85.3	Confident	132 Å²	132	51.1 Å²	51.1	58%	0.579	27%	0.265	S	S	*	.	H	α-helix	trans	-50.7	-34.1	-176.4	177.8	-100.3	0	0	0	113.4	L68 Y74	L68-F70 PolarHBondContact O-N 3.2Å; F70-Y74 WeakPolarHBondContact O-CB 3.48Å; F70-Y74 PolarHBondContact O-N 3.08Å
71	H	88.6	Confident	86	Confident	13 Å²	13	54.1 Å²	54.1	6%	0.06	28%	0.284	C	S	.	.	H	α-helix	trans	-62.3	-46.7	179.5	-67.2	86	0	0	0	112.8	E69 Y74 L75 F118 F121 W125	E69-H71 PolarHBondContact O-N 3.48Å; H71-Y74 PolarHBondContact O-N 2.75Å; H71-L75 WeakPolarHBondContact O-CG 3.39Å; H71-L75 PolarHBondContact O-N 3.18Å; H71-L75 VanDerWaalsContact O-N 3.11Å; H71-F118 HydrophobicContact CB-CZ 4.42Å; H71-F118 AromaticContact CD2-CE2 3.88Å; H71-F121 AromaticContact CE1-CE1 3.91Å; H71-F121 AromaticContact NE2-CD1 3.78Å; H71-F121 AromaticContact NE2-CE1 3.42Å; H71-F121 WeakPolarHBondContact NE2-CE1 3.37Å; H71-W125 AromaticContact CD2-CD2 3.95Å; H71-W125 AromaticContact CD2-CE3 3.83Å; H71-W125 AromaticContact CE1-CD1 3.27Å; H71-W125 AromaticContact CE1-CD2 3.11Å; H71-W125 AromaticContact CE1-CE2 3.18Å; H71-W125 AromaticContact CE1-CE3 3.77Å; H71-W125 AromaticContact CE1-CG 3.16Å; H71-W125 AromaticContact CE1-CZ2 3.86Å; H71-W125 AromaticContact CE1-NE1 3.27Å; H71-W125 PolarHBondContact CE1-NE1 3.19Å; H71-W125 VanDerWaalsContact CE1-NE1 3.27Å; H71-W125 AromaticContact ND1-CD2 3.61Å; H71-W125 AromaticContact ND1-CE2 3.38Å; H71-W125 AromaticContact ND1-CE3 3.99Å; H71-W125 AromaticContact ND1-CH2 3.92Å; H71-W125 AromaticContact ND1-CZ2 3.56Å; H71-W125 AromaticContact ND1-NE1 3.78Å; H71-W125 AromaticContact NE2-CD1 3.83Å; H71-W125 AromaticContact NE2-CD2 3.32Å; H71-W125 VanDerWaalsContact NE2-CD2 3.32Å; H71-W125 AromaticContact NE2-CE2 3.9Å; H71-W125 AromaticContact NE2-CE3 3.66Å; H71-W125 AromaticContact NE2-CG 3.27Å; H71-W125 VanDerWaalsContact NE2-CG 3.27Å
72	W	88.8	Confident	86.6	Confident	18 Å²	18	51.7 Å²	51.7	7%	0.068	27%	0.272	C	S	.	.	H	α-helix	trans	-72.2	-42.2	-178.6	-54.4	119.2	0	0	0	110.9	I51 F54 L55 M60 F65 E69 Y74 L75 Y76	I51-W72 HydrophobicContact CG2-CE3 4.23Å; I51-W72 HydrophobicContact CG2-CZ3 4.19Å; F54-W72 HydrophobicContact CD1-CH2 4.18Å; F54-W72 HydrophobicContact CE1-CH2 4.09Å; L55-W72 HydrophobicContact CD1-CD2 4.24Å; L55-W72 HydrophobicContact CD1-CE3 4.03Å; L55-W72 HydrophobicContact CD1-CZ3 4.44Å; L55-W72 HydrophobicContact CD2-CD2 3.8Å; L55-W72 HydrophobicContact CD2-CE3 3.89Å; L55-W72 HydrophobicContact CD2-CH2 3.61Å; L55-W72 HydrophobicContact CD2-CZ2 3.5Å; L55-W72 VanDerWaalsContact CD2-CZ2 3.5Å; L55-W72 HydrophobicContact CD2-CZ3 3.8Å; L55-W72 HydrophobicContact CG-CE3 4.28Å; L55-W72 HydrophobicContact CG-CH2 4.44Å; L55-W72 HydrophobicContact CG-CZ3 4.23Å; M60-W72 HydrophobicContact CE-CZ2 4.49Å; F65-W72 HydrophobicContact CD1-CZ2 4.44Å; F65-W72 HydrophobicContact CG-CZ2 4.49Å; E69-W72 PolarHBondContact O-N 2.96Å; W72-Y74 VanDerWaalsContact C-N 3.28Å; W72-Y74 PolarHBondContact O-N 3.27Å; W72-L75 HydrophobicContact CE3-CD1 3.92Å; W72-L75 HydrophobicContact CZ3-CD1 4.04Å; W72-L75 PolarHBondContact O-N 2.89Å; W72-Y76 HydrophobicContact CB-CE2 4.43Å; W72-Y76 WeakPolarHBondContact O-CD2 3.41Å; W72-Y76 PolarHBondContact O-N 2.87Å
73	I	91.7	Very high	87.4	Confident	84 Å²	84	53 Å²	53	43%	0.431	28%	0.284	S	S	.	.	H	α-helix	trans	-56.8	-45.5	174.9	-63.2	175.7	0	0	0	110.2	L68 E69 Y76 A77	L68-I73 HydrophobicContact CD2-CD1 4.44Å; L68-I73 VanDerWaalsContact O-CD1 3.24Å; L68-I73 WeakPolarHBondContact O-CD1 3.23Å; E69-I73 PolarHBondContact O-N 3.47Å; I73-Y76 PolarHBondContact O-N 3.15Å; I73-A77 WeakPolarHBondContact O-CB 3.49Å; I73-A77 PolarHBondContact O-N 3.11Å
74	Y	93.4	Very high	88.1	Confident	47 Å²	47	57.4 Å²	57.4	18%	0.184	31%	0.311	C	S	.	.	H	α-helix	trans	-60.4	-47.5	177.2	179.7	-85.6	0	0	0	111.9	F70 H71 W72 Y76 A77 S78 S114 D115 F118	F70-Y74 WeakPolarHBondContact O-CB 3.48Å; F70-Y74 PolarHBondContact O-N 3.08Å; H71-Y74 PolarHBondContact O-N 2.75Å; W72-Y74 VanDerWaalsContact C-N 3.28Å; W72-Y74 PolarHBondContact O-N 3.27Å; Y74-Y76 PolarHBondContact O-N 2.93Å; Y74-A77 PolarHBondContact O-N 3.36Å; Y74-S78 VanDerWaalsContact O-CB 3.26Å; Y74-S78 WeakPolarHBondContact O-CB 3.49Å; Y74-S78 PolarHBondContact O-N 3.39Å; Y74-S114 WeakPolarHBondContact OH-CB 3.39Å; Y74-S114 PolarHBondContact OH-O 3.3Å; Y74-D115 WeakPolarHBondContact CE1-OD1 3.33Å; Y74-D115 WeakPolarHBondContact OH-CA 3.27Å; Y74-D115 PolarHBondContact OH-N 3.5Å; Y74-D115 PolarHBondContact OH-OD1 3.06Å; Y74-F118 HydrophobicContact CD1-CB 4.07Å; Y74-F118 AromaticContact CD1-CD1 3.55Å; Y74-F118 HydrophobicContact CD1-CD1 3.55Å; Y74-F118 AromaticContact CD1-CD2 3.3Å; Y74-F118 HydrophobicContact CD1-CD2 3.3Å; Y74-F118 AromaticContact CD1-CE1 3.72Å; Y74-F118 HydrophobicContact CD1-CE1 3.72Å; Y74-F118 AromaticContact CD1-CE2 3.47Å; Y74-F118 HydrophobicContact CD1-CE2 3.47Å; Y74-F118 VanDerWaalsContact CD1-CE2 3.47Å; Y74-F118 AromaticContact CD1-CG 3.33Å; Y74-F118 HydrophobicContact CD1-CG 3.33Å; Y74-F118 AromaticContact CD1-CZ 3.67Å; Y74-F118 HydrophobicContact CD1-CZ 3.67Å; Y74-F118 HydrophobicContact CD2-CD2 4.11Å; Y74-F118 HydrophobicContact CE1-CB 3.49Å; Y74-F118 VanDerWaalsContact CE1-CB 3.49Å; Y74-F118 AromaticContact CE1-CD1 3.5Å; Y74-F118 HydrophobicContact CE1-CD1 3.5Å; Y74-F118 AromaticContact CE1-CD2 3.68Å; Y74-F118 HydrophobicContact CE1-CD2 3.68Å; Y74-F118 HydrophobicContact CE1-CE1 4.12Å; Y74-F118 HydrophobicContact CE1-CE2 4.27Å; Y74-F118 AromaticContact CE1-CG 3.24Å; Y74-F118 HydrophobicContact CE1-CG 3.24Å; Y74-F118 HydrophobicContact CE1-CZ 4.46Å; Y74-F118 HydrophobicContact CE2-CB 4.3Å; Y74-F118 HydrophobicContact CE2-CD2 4.39Å; Y74-F118 HydrophobicContact CE2-CG 4.47Å; Y74-F118 AromaticContact CG-CD2 3.57Å; Y74-F118 HydrophobicContact CG-CD2 3.57Å; Y74-F118 AromaticContact CG-CE2 3.68Å; Y74-F118 HydrophobicContact CG-CE2 3.68Å; Y74-F118 HydrophobicContact CG-CG 4.06Å; Y74-F118 HydrophobicContact CG-CZ 4.25Å; Y74-F118 AromaticContact CZ-CG 3.87Å
75	L	91.4	Very high	89.4	Confident	25 Å²	25	55.9 Å²	55.9	13%	0.131	30%	0.3	C	S	.	.	H	α-helix	trans	-60.6	-45.4	-179.6	-74	172.8	0	0	0	112	I51 H71 W72 A79 F118 L239	I51-L75 HydrophobicContact CD1-CB 4.44Å; I51-L75 HydrophobicContact CD1-CD1 4.34Å; H71-L75 WeakPolarHBondContact O-CG 3.39Å; H71-L75 PolarHBondContact O-N 3.18Å; H71-L75 VanDerWaalsContact O-N 3.11Å; W72-L75 HydrophobicContact CE3-CD1 3.92Å; W72-L75 HydrophobicContact CZ3-CD1 4.04Å; W72-L75 PolarHBondContact O-N 2.89Å; L75-A79 WeakPolarHBondContact O-CB 3.38Å; L75-A79 PolarHBondContact O-N 3.26Å; L75-F118 HydrophobicContact CD2-CE1 3.72Å; L75-F118 HydrophobicContact CD2-CZ 4.32Å; L75-F118 HydrophobicContact CG-CE1 4.04Å; L75-F118 HydrophobicContact CG-CZ 4.13Å; L75-L239 HydrophobicContact CD1-CD1 4.39Å
76	Y	91.7	Very high	90.2	Very high	85 Å²	85	54.6 Å²	54.6	33%	0.333	30%	0.295	S	S	.	.	H	α-helix	trans	-67.1	-42.5	176.8	-72.9	-62	0	0	0	112.5	T48 L55 W72 I73 Y74 A79 A80	T48-Y76 HydrophobicContact CG2-CD1 4.38Å; T48-Y76 HydrophobicContact CG2-CE1 4.21Å; L55-Y76 HydrophobicContact CD1-CE2 4.4Å; W72-Y76 HydrophobicContact CB-CE2 4.43Å; W72-Y76 WeakPolarHBondContact O-CD2 3.41Å; W72-Y76 PolarHBondContact O-N 2.87Å; I73-Y76 PolarHBondContact O-N 3.15Å; Y74-Y76 PolarHBondContact O-N 2.93Å; Y76-A79 PolarHBondContact O-N 3.43Å; Y76-A80 WeakPolarHBondContact O-CB 3.49Å; Y76-A80 PolarHBondContact O-N 3.21Å
77	A	94.3	Very high	91.1	Very high	50 Å²	50	56.3 Å²	56.3	41%	0.413	30%	0.304	S	S	.	.	H	α-helix	trans	-64.4	-43.3	177.1	0	0	0	0	0	111.5	I73 Y74 A79 A80 V81	I73-A77 WeakPolarHBondContact O-CB 3.49Å; I73-A77 PolarHBondContact O-N 3.11Å; Y74-A77 PolarHBondContact O-N 3.36Å; A77-A79 PolarHBondContact O-N 3.03Å; A77-A80 PolarHBondContact O-N 2.96Å; A77-V81 WeakPolarHBondContact O-CB 3.32Å; A77-V81 VanDerWaalsContact O-CG2 3.28Å; A77-V81 WeakPolarHBondContact O-CG2 3.48Å; A77-V81 PolarHBondContact O-N 2.97Å
78	S	94.3	Very high	92	Very high	15 Å²	15	51.4 Å²	51.4	11%	0.105	28%	0.282	C	S	.	.	H	α-helix	trans	-60.9	-45.2	175.5	-175.3	0	0	0	0	110.4	Y74 A80 V81 Q82 D115	Y74-S78 VanDerWaalsContact O-CB 3.26Å; Y74-S78 WeakPolarHBondContact O-CB 3.49Å; Y74-S78 PolarHBondContact O-N 3.39Å; S78-A80 PolarHBondContact O-N 2.7Å; S78-V81 PolarHBondContact O-N 3.45Å; S78-Q82 WeakPolarHBondContact O-CB 3.45Å; S78-Q82 WeakPolarHBondContact O-CG 3.42Å; S78-Q82 PolarHBondContact O-N 2.81Å; S78-Q82 PolarHBondContact OG-NE2 2.88Å; S78-D115 PolarHBondContact OG-OD1 3.21Å; S78-D115 PolarHBondContact OG-OD2 2.96Å
79	A	93.2	Very high	92.8	Very high	14 Å²	14	46.3 Å²	46.3	12%	0.116	26%	0.256	C	S	.	.	H	α-helix	trans	-61.5	-42.6	176.3	0	0	0	0	0	112.8	L44 L75 Y76 A77 Q82 A83	L44-A79 HydrophobicContact CD1-CB 3.95Å; L75-A79 WeakPolarHBondContact O-CB 3.38Å; L75-A79 PolarHBondContact O-N 3.26Å; Y76-A79 PolarHBondContact O-N 3.43Å; A77-A79 PolarHBondContact O-N 3.03Å; A79-Q82 PolarHBondContact O-N 2.87Å; A79-A83 PolarHBondContact O-N 3.42Å
80	A	95.4	Very high	93.2	Very high	57 Å²	57	47.5 Å²	47.5	47%	0.471	26%	0.262	S	S	.	.	H	α-helix	trans	-64.3	-45.5	176.7	0	0	0	0	0	112.2	Y76 A77 S78 Q82 A83 V84	Y76-A80 WeakPolarHBondContact O-CB 3.49Å; Y76-A80 PolarHBondContact O-N 3.21Å; A77-A80 PolarHBondContact O-N 2.96Å; S78-A80 PolarHBondContact O-N 2.7Å; A80-Q82 VanDerWaalsContact C-N 3.31Å; A80-Q82 PolarHBondContact O-N 2.85Å; A80-A83 WeakPolarHBondContact O-CB 3.12Å; A80-A83 PolarHBondContact O-N 3.48Å; A80-V84 WeakPolarHBondContact O-CG2 3.39Å; A80-V84 PolarHBondContact O-N 3.3Å
81	V	96.2	Very high	93.4	Very high	68 Å²	68	47 Å²	47	41%	0.412	26%	0.257	S	S	.	.	H	α-helix	trans	-61.6	-41.2	176	170.8	0	0	0	0	110.6	A77 S78 A83 V84 I85 T111	A77-V81 WeakPolarHBondContact O-CB 3.32Å; A77-V81 VanDerWaalsContact O-CG2 3.28Å; A77-V81 WeakPolarHBondContact O-CG2 3.48Å; A77-V81 PolarHBondContact O-N 2.97Å; S78-V81 PolarHBondContact O-N 3.45Å; V81-A83 PolarHBondContact O-N 3.44Å; V81-V84 PolarHBondContact O-N 3.44Å; V81-I85 HydrophobicContact CG1-CD1 3.74Å; V81-I85 HydrophobicContact CG1-CG1 4.35Å; V81-I85 WeakPolarHBondContact O-CB 3.41Å; V81-I85 VanDerWaalsContact O-CG1 3.27Å; V81-I85 WeakPolarHBondContact O-CG1 3.26Å; V81-I85 PolarHBondContact O-N 2.93Å; V81-T111 HydrophobicContact CG1-CG2 3.77Å
82	Q	94.9	Very high	93.4	Very high	12 Å²	12	46.5 Å²	46.5	6%	0.056	26%	0.256	C	S	.	.	H	α-helix	trans	-62.8	-39.9	175.7	-73	173.2	36.6	0	0	112.2	L44 S78 A79 A80 I85 L86 D115	L44-Q82 HydrophobicContact CD1-CB 4.27Å; L44-Q82 HydrophobicContact CD2-CB 4.06Å; S78-Q82 WeakPolarHBondContact O-CB 3.45Å; S78-Q82 WeakPolarHBondContact O-CG 3.42Å; S78-Q82 PolarHBondContact O-N 2.81Å; S78-Q82 PolarHBondContact OG-NE2 2.88Å; A79-Q82 PolarHBondContact O-N 2.87Å; A80-Q82 VanDerWaalsContact C-N 3.31Å; A80-Q82 PolarHBondContact O-N 2.85Å; Q82-I85 PolarHBondContact O-N 3.49Å; Q82-L86 WeakPolarHBondContact O-CG 3.37Å; Q82-L86 PolarHBondContact O-N 3.36Å; Q82-D115 PolarHBondContact NE2-OD2 2.9Å
83	A	94.8	Very high	93.5	Very high	34 Å²	34	45.9 Å²	45.9	28%	0.281	26%	0.255	S	S	.	.	H	α-helix	trans	-61.9	-43.7	174.6	0	0	0	0	0	111.7	L44 A79 A80 V81 L86 L87	L44-A83 HydrophobicContact CD2-CB 4.05Å; A79-A83 PolarHBondContact O-N 3.42Å; A80-A83 WeakPolarHBondContact O-CB 3.12Å; A80-A83 PolarHBondContact O-N 3.48Å; V81-A83 PolarHBondContact O-N 3.44Å; A83-L86 PolarHBondContact O-N 3.2Å; A83-L87 WeakPolarHBondContact O-CG 3.44Å; A83-L87 PolarHBondContact O-N 3.26Å
84	V	95.6	Very high	93.4	Very high	97 Å²	97	48.8 Å²	48.8	59%	0.588	26%	0.264	S	S	*	.	H	α-helix	trans	-62.8	-43.5	175.7	173.9	0	0	0	0	111.4	A80 V81 L86 L87 L88	A80-V84 WeakPolarHBondContact O-CG2 3.39Å; A80-V84 PolarHBondContact O-N 3.3Å; V81-V84 PolarHBondContact O-N 3.44Å; V84-L86 VanDerWaalsContact C-N 3.32Å; V84-L86 PolarHBondContact O-N 3.22Å; V84-L87 PolarHBondContact O-N 3.3Å; V84-L88 WeakPolarHBondContact O-CB 3.27Å; V84-L88 PolarHBondContact O-N 3.13Å
85	I	95.5	Very high	93.2	Very high	12 Å²	12	50.5 Å²	50.5	6%	0.062	28%	0.275	C	S	.	.	H	α-helix	trans	-60.2	-41.9	176.4	-76.2	172.7	0	0	0	110.9	V81 Q82 L88 C89 F104 L107 S108 T111	V81-I85 HydrophobicContact CG1-CD1 3.74Å; V81-I85 HydrophobicContact CG1-CG1 4.35Å; V81-I85 WeakPolarHBondContact O-CB 3.41Å; V81-I85 VanDerWaalsContact O-CG1 3.27Å; V81-I85 WeakPolarHBondContact O-CG1 3.26Å; V81-I85 PolarHBondContact O-N 2.93Å; Q82-I85 PolarHBondContact O-N 3.49Å; I85-L88 WeakPolarHBondContact O-CB 3.48Å; I85-L88 PolarHBondContact O-N 3.04Å; I85-C89 PolarHBondContact O-N 2.88Å; I85-F104 HydrophobicContact CG2-CD2 3.52Å; I85-F104 HydrophobicContact CG2-CE2 3.44Å; I85-F104 VanDerWaalsContact CG2-CE2 3.44Å; I85-F104 VanDerWaalsContact O-CD2 3.23Å; I85-F104 WeakPolarHBondContact O-CD2 3.41Å; I85-F104 WeakPolarHBondContact O-CE2 3.44Å; I85-L107 HydrophobicContact CD1-CB 3.88Å; I85-L107 HydrophobicContact CG1-CB 4.08Å; I85-L107 HydrophobicContact CG1-CD1 4.48Å; I85-S108 VanDerWaalsContact CG2-OG 3.27Å; I85-S108 WeakPolarHBondContact CG2-OG 3.29Å; I85-T111 HydrophobicContact CD1-CG2 3.61Å
86	L	94.3	Very high	92.9	Very high	4 Å²	4	53.1 Å²	53.1	2%	0.021	29%	0.289	C	S	.	.	H	α-helix	trans	-64.3	-42.7	174.8	-79.1	179.1	0	0	0	112.8	Y36 C37 L40 L41 L44 Q82 A83 V84 L88 C89 I90	Y36-L86 HydrophobicContact CE1-CD2 4.42Å; C37-L86 HydrophobicContact CB-CD2 4.32Å; L40-L86 HydrophobicContact CB-CD1 4.15Å; L40-L86 HydrophobicContact CB-CD2 4.21Å; L40-L86 HydrophobicContact CD2-CD1 3.93Å; L40-L86 HydrophobicContact CD2-CD2 3.64Å; L40-L86 HydrophobicContact CD2-CG 4Å; L40-L86 HydrophobicContact CG-CD1 4.1Å; L40-L86 HydrophobicContact CG-CD2 4.4Å; L41-L86 HydrophobicContact CB-CD1 4.44Å; L41-L86 HydrophobicContact CD1-CD1 4.31Å; L44-L86 HydrophobicContact CD2-CD1 4.34Å; Q82-L86 WeakPolarHBondContact O-CG 3.37Å; Q82-L86 PolarHBondContact O-N 3.36Å; A83-L86 PolarHBondContact O-N 3.2Å; V84-L86 VanDerWaalsContact C-N 3.32Å; V84-L86 PolarHBondContact O-N 3.22Å; L86-L88 VanDerWaalsContact C-N 3.31Å; L86-L88 PolarHBondContact O-N 3.33Å; L86-C89 VanDerWaalsContact O-CB 3.31Å; L86-C89 WeakPolarHBondContact O-CB 3.13Å; L86-C89 PolarHBondContact O-N 3.16Å; L86-C89 VanDerWaalsContact O-N 3.16Å; L86-I90 WeakPolarHBondContact O-CG1 3.28Å; L86-I90 PolarHBondContact O-N 2.83Å
87	L	93.9	Very high	92.7	Very high	116 Å²	116	57.1 Å²	57.1	61%	0.607	30%	0.304	S	S	*	.	H	α-helix	trans	-62.2	-40.8	174.9	-69.5	174.8	0	0	0	111.5	A83 V84 C89 I90 Y91	A83-L87 WeakPolarHBondContact O-CG 3.44Å; A83-L87 PolarHBondContact O-N 3.26Å; V84-L87 PolarHBondContact O-N 3.3Å; L87-C89 VanDerWaalsContact C-N 3.28Å; L87-C89 PolarHBondContact O-N 3.42Å; L87-I90 PolarHBondContact O-N 2.9Å; L87-Y91 WeakPolarHBondContact O-CB 3.45Å; L87-Y91 PolarHBondContact O-N 3.47Å
88	L	93.6	Very high	92.4	Very high	44 Å²	44	57.3 Å²	57.3	23%	0.23	30%	0.297	C	S	.	.	H	α-helix	trans	-61.7	-37.4	174.6	-169.4	70.5	0	0	0	111.5	V84 I85 L86 G92 L100 I103 F104 L107	V84-L88 WeakPolarHBondContact O-CB 3.27Å; V84-L88 PolarHBondContact O-N 3.13Å; I85-L88 WeakPolarHBondContact O-CB 3.48Å; I85-L88 PolarHBondContact O-N 3.04Å; L86-L88 VanDerWaalsContact C-N 3.31Å; L86-L88 PolarHBondContact O-N 3.33Å; L88-G92 PolarHBondContact O-N 2.81Å; L88-L100 HydrophobicContact CD1-CD2 3.98Å; L88-I103 HydrophobicContact CD2-CG2 3.95Å; L88-F104 HydrophobicContact CD2-CB 4.37Å; L88-L107 HydrophobicContact CD2-CD1 4.2Å
89	C	92.4	Very high	92.3	Very high	1 Å²	1	62.7 Å²	62.7	1%	0.007	32%	0.324	C	S	.	.	H	α-helix	trans	-63	-53.5	173.8	-173.2	0	0	0	0	111.5	I85 L86 L87 Y91 G92 V93 F104	I85-C89 PolarHBondContact O-N 2.88Å; L86-C89 VanDerWaalsContact O-CB 3.31Å; L86-C89 WeakPolarHBondContact O-CB 3.13Å; L86-C89 PolarHBondContact O-N 3.16Å; L86-C89 VanDerWaalsContact O-N 3.16Å; L87-C89 VanDerWaalsContact C-N 3.28Å; L87-C89 PolarHBondContact O-N 3.42Å; C89-Y91 VanDerWaalsContact C-N 3.27Å; C89-Y91 PolarHBondContact O-N 2.97Å; C89-G92 PolarHBondContact O-N 3.45Å; C89-G92 VanDerWaalsContact O-N 3.13Å; C89-V93 VanDerWaalsContact O-CG2 3.3Å; C89-V93 WeakPolarHBondContact O-CG2 3.4Å; C89-V93 PolarHBondContact O-N 3.49Å; C89-F104 HydrophobicContact CB-CD1 4.07Å; C89-F104 HydrophobicContact CB-CD2 3.65Å; C89-F104 HydrophobicContact CB-CE1 3.85Å; C89-F104 HydrophobicContact CB-CE2 3.48Å; C89-F104 VanDerWaalsContact CB-CE2 3.48Å; C89-F104 HydrophobicContact CB-CG 3.97Å; C89-F104 HydrophobicContact CB-CZ 3.59Å; C89-F104 WeakPolarHBondContact SG-CE1 3.19Å; C89-F104 VanDerWaalsContact SG-CZ 3.57Å
90	I	93.1	Very high	92.2	Very high	69 Å²	69	63.7 Å²	63.7	35%	0.354	33%	0.327	S	S	.	.	H	α-helix	trans	-56.5	-45.9	179.9	-66.5	168.8	0	0	0	110.2	Y34 C37 L86 L87 V93 F94	Y34-I90 HydrophobicContact CE1-CG2 4.4Å; C37-I90 HydrophobicContact CB-CD1 4.16Å; C37-I90 HydrophobicContact CB-CG1 3.93Å; L86-I90 WeakPolarHBondContact O-CG1 3.28Å; L86-I90 PolarHBondContact O-N 2.83Å; L87-I90 PolarHBondContact O-N 2.9Å; I90-V93 PolarHBondContact O-N 2.91Å; I90-F94 WeakPolarHBondContact O-CB 3.46Å; I90-F94 PolarHBondContact O-N 2.99Å
91	Y	93.6	Very high	92	Very high	121 Å²	121	61.3 Å²	61.3	48%	0.475	31%	0.307	S	S	.	.	H	α-helix	trans	-64.7	-42.3	177.3	-177.6	-103.8	0	0	0	112.7	L87 C89 V93 F94 M95 L100	L87-Y91 WeakPolarHBondContact O-CB 3.45Å; L87-Y91 PolarHBondContact O-N 3.47Å; C89-Y91 VanDerWaalsContact C-N 3.27Å; C89-Y91 PolarHBondContact O-N 2.97Å; Y91-V93 PolarHBondContact O-N 3.32Å; Y91-F94 PolarHBondContact O-N 3.25Å; Y91-M95 HydrophobicContact CD1-CG 4.47Å; Y91-M95 HydrophobicContact CD2-CG 4.32Å; Y91-M95 HydrophobicContact CE1-CG 4.01Å; Y91-M95 HydrophobicContact CE2-CE 3.79Å; Y91-M95 HydrophobicContact CE2-CG 3.86Å; Y91-M95 WeakPolarHBondContact O-CB 3.27Å; Y91-M95 PolarHBondContact O-N 3.45Å; Y91-M95 VanDerWaalsContact OH-CE 3.26Å; Y91-M95 WeakPolarHBondContact OH-CE 3.41Å; Y91-L100 HydrophobicContact CD1-CD1 3.71Å; Y91-L100 HydrophobicContact CE1-CD1 3.71Å
92	G	90.2	Very high	91.8	Very high	4 Å²	4	61.9 Å²	61.9	4%	0.041	31%	0.305	C	S	.	.	H	α-helix	trans	-63.1	-39.8	177.4	0	0	0	0	0	112.9	L88 C89 D96 R97	L88-G92 PolarHBondContact O-N 2.81Å; C89-G92 PolarHBondContact O-N 3.45Å; C89-G92 VanDerWaalsContact O-N 3.13Å; G92-D96 PolarHBondContact O-N 2.97Å; G92-D96 VanDerWaalsContact O-N 3.08Å; G92-R97 PolarHBondContact O-N 3.18Å
93	V	89.6	Confident	91.8	Very high	5 Å²	5	64.8 Å²	64.8	3%	0.03	32%	0.32	C	S	.	.	H	α-helix	trans	-68.2	-40.5	174.3	179	0	0	0	0	111	R30 L33 Y34 C89 I90 Y91 D96	R30-V93 HydrophobicContact CB-CG1 4.25Å; R30-V93 HydrophobicContact CG-CG1 4.14Å; L33-V93 HydrophobicContact CB-CG2 3.79Å; L33-V93 HydrophobicContact CD1-CG2 3.58Å; L33-V93 HydrophobicContact CG-CG2 4.31Å; Y34-V93 HydrophobicContact CD2-CG1 4.24Å; Y34-V93 HydrophobicContact CE1-CB 4.25Å; Y34-V93 HydrophobicContact CE1-CG1 3.96Å; Y34-V93 HydrophobicContact CE2-CG1 3.55Å; Y34-V93 WeakPolarHBondContact OH-CG1 3.48Å; C89-V93 VanDerWaalsContact O-CG2 3.3Å; C89-V93 WeakPolarHBondContact O-CG2 3.4Å; C89-V93 PolarHBondContact O-N 3.49Å; I90-V93 PolarHBondContact O-N 2.91Å; Y91-V93 PolarHBondContact O-N 3.32Å; V93-D96 PolarHBondContact O-N 2.94Å
94	F	90.4	Very high	91.8	Very high	144 Å²	144	63.3 Å²	63.3	63%	0.632	31%	0.307	S	S	*	.	H	α-helix	trans	-63.6	-43.3	177.6	-178.5	-99.9	0	0	0	112.3	I90 Y91	I90-F94 WeakPolarHBondContact O-CB 3.46Å; I90-F94 PolarHBondContact O-N 2.99Å; Y91-F94 PolarHBondContact O-N 3.25Å
95	M	89.8	Confident	91.7	Very high	84 Å²	84	61.1 Å²	61.1	41%	0.414	29%	0.288	S	S	.	.	H	α-helix	trans	-84.2	-7.6	-178.3	-70.2	-61.6	-153.2	0	0	114.6	Y91 R97	Y91-M95 HydrophobicContact CD1-CG 4.47Å; Y91-M95 HydrophobicContact CD2-CG 4.32Å; Y91-M95 HydrophobicContact CE1-CG 4.01Å; Y91-M95 HydrophobicContact CE2-CE 3.79Å; Y91-M95 HydrophobicContact CE2-CG 3.86Å; Y91-M95 WeakPolarHBondContact O-CB 3.27Å; Y91-M95 PolarHBondContact O-N 3.45Å; Y91-M95 VanDerWaalsContact OH-CE 3.26Å; Y91-M95 WeakPolarHBondContact OH-CE 3.41Å; M95-R97 HydrophobicContact CB-CG 3.87Å; M95-R97 PolarHBondContact O-N 3.36Å
96	D	84.4	Confident	91.8	Very high	80 Å²	80	63.6 Å²	63.6	43%	0.428	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.4	34.1	-177.2	-148	22.4	0	0	0	113.7	Y29 R30 G92 V93	Y29-D96 PolarHBondContact OH-OD1 3.39Å; R30-D96 IonicContact NH2-OD1 2.7Å; R30-D96 PolarHBondContact NH2-OD1 3.16Å; R30-D96 IonicContact NH2-OD2 3.47Å; R30-D96 PolarHBondContact NH2-OD2 3.05Å; G92-D96 PolarHBondContact O-N 2.97Å; G92-D96 VanDerWaalsContact O-N 3.08Å; V93-D96 PolarHBondContact O-N 2.94Å
97	R	88.1	Confident	91.9	Very high	169 Å²	169	66.7 Å²	66.7	64%	0.638	32%	0.32	S	S	*	.			trans	-95.6	108.2	-179	-63.2	-66.9	-172.3	171.1	2.1	110.4	G92 M95 L99 L100 L101	G92-R97 PolarHBondContact O-N 3.18Å; M95-R97 HydrophobicContact CB-CG 3.87Å; M95-R97 PolarHBondContact O-N 3.36Å; R97-L99 PolarHBondContact O-N 2.96Å; R97-L100 HydrophobicContact CB-CB 4.32Å; R97-L100 HydrophobicContact CB-CD1 3.99Å; R97-L100 HydrophobicContact CB-CG 4.15Å; R97-L100 HydrophobicContact CG-CD1 4.36Å; R97-L100 PolarHBondContact O-N 3.23Å; R97-L100 VanDerWaalsContact O-N 3.11Å; R97-L101 PolarHBondContact O-N 3.49Å
98	I	87.9	Confident	91.9	Very high	54 Å²	54	61.5 Å²	61.5	28%	0.277	29%	0.293	S	S	.	.	H	α-helix	trans	-53.7	-39.3	178.5	-40.9	172.9	0	0	0	112.1	L100 L101 H102 I268	I98-L100 VanDerWaalsContact C-N 3.34Å; I98-L100 PolarHBondContact O-N 3.37Å; I98-L101 PolarHBondContact O-N 3.25Å; I98-L101 VanDerWaalsContact O-N 3.16Å; I98-H102 PolarHBondContact O-CD2 3.4Å; I98-H102 PolarHBondContact O-N 3.34Å; I98-I268 HydrophobicContact CD1-CB 4.42Å; I98-I268 HydrophobicContact CD1-CD1 3.23Å; I98-I268 HydrophobicContact CD1-CG1 4.37Å; I98-I268 HydrophobicContact CD1-CG2 4.29Å; I98-I268 HydrophobicContact CG1-CD1 3.58Å
99	L	91.5	Very high	92.1	Very high	127 Å²	127	62.2 Å²	62.2	67%	0.665	30%	0.297	S	S	*	.	H	α-helix	trans	-58.8	-44.6	-179.4	-176	73.7	0	0	0	111.7	R97 L101 H102 I103	R97-L99 PolarHBondContact O-N 2.96Å; L99-L101 VanDerWaalsContact C-N 3.29Å; L99-L101 PolarHBondContact O-N 2.97Å; L99-H102 PolarHBondContact O-N 2.85Å; L99-I103 HydrophobicContact CG-CD1 4.09Å; L99-I103 WeakPolarHBondContact O-CG1 3.49Å; L99-I103 PolarHBondContact O-N 3.31Å
100	L	91.7	Very high	92.3	Very high	35 Å²	35	66.5 Å²	66.5	18%	0.183	32%	0.319	C	S	.	.	H	α-helix	trans	-63.9	-38.2	178.1	-72.6	175.4	0	0	0	111.3	L88 Y91 R97 I98 I103 F104	L88-L100 HydrophobicContact CD1-CD2 3.98Å; Y91-L100 HydrophobicContact CD1-CD1 3.71Å; Y91-L100 HydrophobicContact CE1-CD1 3.71Å; R97-L100 HydrophobicContact CB-CB 4.32Å; R97-L100 HydrophobicContact CB-CD1 3.99Å; R97-L100 HydrophobicContact CB-CG 4.15Å; R97-L100 HydrophobicContact CG-CD1 4.36Å; R97-L100 PolarHBondContact O-N 3.23Å; R97-L100 VanDerWaalsContact O-N 3.11Å; I98-L100 VanDerWaalsContact C-N 3.34Å; I98-L100 PolarHBondContact O-N 3.37Å; L100-I103 PolarHBondContact O-N 3.01Å; L100-F104 VanDerWaalsContact O-CB 3.31Å; L100-F104 WeakPolarHBondContact O-CB 3.31Å; L100-F104 PolarHBondContact O-N 2.72Å
101	L	90.4	Very high	92.5	Very high	8 Å²	8	64.1 Å²	64.1	4%	0.042	31%	0.308	C	S	.	.	H	α-helix	trans	-67.8	-35.9	177.7	-161.9	64.3	0	0	0	112	L33 R97 I98 L99 F104 W105 L257 I261 L264	L33-L101 HydrophobicContact CD1-CD1 4.09Å; L33-L101 HydrophobicContact CD1-CD2 4.41Å; R97-L101 PolarHBondContact O-N 3.49Å; I98-L101 PolarHBondContact O-N 3.25Å; I98-L101 VanDerWaalsContact O-N 3.16Å; L99-L101 VanDerWaalsContact C-N 3.29Å; L99-L101 PolarHBondContact O-N 2.97Å; L101-F104 HydrophobicContact CD1-CD1 4.04Å; L101-W105 WeakPolarHBondContact O-CB 3.47Å; L101-W105 PolarHBondContact O-N 3.05Å; L101-L257 HydrophobicContact CD1-CD1 3.74Å; L101-L257 HydrophobicContact CD2-CD1 4.48Å; L101-L257 HydrophobicContact CG-CD1 4.1Å; L101-I261 HydrophobicContact CD2-CD1 4.33Å; L101-I261 HydrophobicContact CD2-CG1 3.53Å; L101-I261 HydrophobicContact CG-CD1 3.95Å; L101-I261 HydrophobicContact CG-CG1 3.71Å; L101-L264 HydrophobicContact CD2-CD1 3.97Å
102	H	92.5	Very high	92.6	Very high	79 Å²	79	59.2 Å²	59.2	37%	0.366	29%	0.29	S	S	.	.	H	α-helix	trans	-67.2	-42.4	171.7	-86.1	-64.6	0	0	0	112.8	I98 L99 W105 T106 I261	I98-H102 PolarHBondContact O-CD2 3.4Å; I98-H102 PolarHBondContact O-N 3.34Å; L99-H102 PolarHBondContact O-N 2.85Å; H102-W105 PolarHBondContact O-N 3.42Å; H102-T106 WeakPolarHBondContact O-CB 3.45Å; H102-T106 PolarHBondContact O-N 3.11Å; H102-T106 PolarHBondContact O-OG1 3.24Å; H102-I261 WeakPolarHBondContact CE1-CG2 3.36Å
103	I	95.1	Very high	92.9	Very high	73 Å²	73	63.9 Å²	63.9	37%	0.374	31%	0.313	S	S	.	.	H	α-helix	trans	-61.5	-49.1	175.2	-67.9	166.3	0	0	0	109.5	L88 L99 L100 W105 T106 L107	L88-I103 HydrophobicContact CD2-CG2 3.95Å; L99-I103 HydrophobicContact CG-CD1 4.09Å; L99-I103 WeakPolarHBondContact O-CG1 3.49Å; L99-I103 PolarHBondContact O-N 3.31Å; L100-I103 PolarHBondContact O-N 3.01Å; I103-W105 PolarHBondContact O-N 2.79Å; I103-T106 PolarHBondContact O-N 3.44Å; I103-L107 HydrophobicContact CG2-CD1 3.8Å; I103-L107 HydrophobicContact CG2-CG 4.26Å; I103-L107 WeakPolarHBondContact O-CB 3.39Å; I103-L107 WeakPolarHBondContact O-CG 3.45Å; I103-L107 PolarHBondContact O-N 3.35Å
104	F	93.9	Very high	93.2	Very high	3 Å²	3	66.2 Å²	66.2	1%	0.013	33%	0.329	C	S	.	.	H	α-helix	trans	-55.5	-48.6	175.6	163.1	-111.4	0	0	0	112.5	Y36 I85 L88 C89 L100 L101 T106 L107 S108 L257	Y36-F104 HydrophobicContact CE1-CZ 4.39Å; I85-F104 HydrophobicContact CG2-CD2 3.52Å; I85-F104 HydrophobicContact CG2-CE2 3.44Å; I85-F104 VanDerWaalsContact CG2-CE2 3.44Å; I85-F104 VanDerWaalsContact O-CD2 3.23Å; I85-F104 WeakPolarHBondContact O-CD2 3.41Å; I85-F104 WeakPolarHBondContact O-CE2 3.44Å; L88-F104 HydrophobicContact CD2-CB 4.37Å; C89-F104 HydrophobicContact CB-CD1 4.07Å; C89-F104 HydrophobicContact CB-CD2 3.65Å; C89-F104 HydrophobicContact CB-CE1 3.85Å; C89-F104 HydrophobicContact CB-CE2 3.48Å; C89-F104 VanDerWaalsContact CB-CE2 3.48Å; C89-F104 HydrophobicContact CB-CG 3.97Å; C89-F104 HydrophobicContact CB-CZ 3.59Å; C89-F104 WeakPolarHBondContact SG-CE1 3.19Å; C89-F104 VanDerWaalsContact SG-CZ 3.57Å; L100-F104 VanDerWaalsContact O-CB 3.31Å; L100-F104 WeakPolarHBondContact O-CB 3.31Å; L100-F104 PolarHBondContact O-N 2.72Å; L101-F104 HydrophobicContact CD1-CD1 4.04Å; F104-T106 VanDerWaalsContact C-N 3.32Å; F104-T106 PolarHBondContact O-N 3.45Å; F104-L107 PolarHBondContact O-N 3.15Å; F104-S108 VanDerWaalsContact CE2-OG 3.26Å; F104-S108 WeakPolarHBondContact CE2-OG 3.44Å; F104-S108 VanDerWaalsContact O-CB 3.22Å; F104-S108 WeakPolarHBondContact O-CB 3.03Å; F104-S108 PolarHBondContact O-N 3.18Å; F104-S108 PolarHBondContact O-OG 3.1Å; F104-L257 HydrophobicContact CD1-CD1 4.21Å; F104-L257 HydrophobicContact CD1-CD2 3.57Å; F104-L257 HydrophobicContact CE1-CD1 3.93Å; F104-L257 HydrophobicContact CE1-CD2 3.18Å; F104-L257 HydrophobicContact CE1-CG 4.2Å; F104-L257 HydrophobicContact CZ-CD2 4.09Å
105	W	94.8	Very high	93.4	Very high	51 Å²	51	60.2 Å²	60.2	19%	0.193	30%	0.304	C	S	.	.	H	α-helix	trans	-60.3	-43.2	178	-179	90.3	0	0	0	111.6	L101 H102 I103 S108 L109 L254 L257 K258 I261	L101-W105 WeakPolarHBondContact O-CB 3.47Å; L101-W105 PolarHBondContact O-N 3.05Å; H102-W105 PolarHBondContact O-N 3.42Å; I103-W105 PolarHBondContact O-N 2.79Å; W105-S108 PolarHBondContact O-N 2.84Å; W105-L109 HydrophobicContact CH2-CD2 3.75Å; W105-L109 HydrophobicContact CZ2-CD2 4.36Å; W105-L109 HydrophobicContact CZ3-CD2 4.02Å; W105-L109 WeakPolarHBondContact O-CB 3.45Å; W105-L109 PolarHBondContact O-N 2.94Å; W105-L254 HydrophobicContact CG-CD2 4.48Å; W105-L254 PolarHBondContact NE1-O 3.47Å; W105-L257 HydrophobicContact CB-CD2 3.91Å; W105-L257 HydrophobicContact CB-CG 4.47Å; W105-L257 HydrophobicContact CG-CD2 4.14Å; W105-K258 HydrophobicContact CZ2-CD 3.91Å; W105-K258 HydrophobicContact CZ2-CG 4.36Å; W105-I261 HydrophobicContact CB-CD1 3.72Å; W105-I261 HydrophobicContact CG-CD1 3.97Å
106	T	96.1	Very high	93.7	Very high	65 Å²	65	61.1 Å²	61.1	40%	0.399	31%	0.31	S	S	.	.	H	α-helix	trans	-67	-45.8	-179.5	-53.2	0	0	0	0	111.6	H102 I103 F104 S108 L109 I110	H102-T106 WeakPolarHBondContact O-CB 3.45Å; H102-T106 PolarHBondContact O-N 3.11Å; H102-T106 PolarHBondContact O-OG1 3.24Å; I103-T106 PolarHBondContact O-N 3.44Å; F104-T106 VanDerWaalsContact C-N 3.32Å; F104-T106 PolarHBondContact O-N 3.45Å; T106-S108 VanDerWaalsContact C-N 3.35Å; T106-L109 WeakPolarHBondContact O-CB 3.35Å; T106-L109 PolarHBondContact O-N 3.14Å; T106-I110 HydrophobicContact CG2-CD1 4.14Å; T106-I110 WeakPolarHBondContact O-CG1 3.38Å; T106-I110 PolarHBondContact O-N 2.91Å
107	L	96.8	Very high	94.2	Very high	69 Å²	69	60.2 Å²	60.2	36%	0.361	31%	0.313	S	S	.	.	H	α-helix	trans	-64.2	-40	176	-69.5	176	0	0	0	111.9	I85 L88 I103 F104 L109 I110 T111	I85-L107 HydrophobicContact CD1-CB 3.88Å; I85-L107 HydrophobicContact CG1-CB 4.08Å; I85-L107 HydrophobicContact CG1-CD1 4.48Å; L88-L107 HydrophobicContact CD2-CD1 4.2Å; I103-L107 HydrophobicContact CG2-CD1 3.8Å; I103-L107 HydrophobicContact CG2-CG 4.26Å; I103-L107 WeakPolarHBondContact O-CB 3.39Å; I103-L107 WeakPolarHBondContact O-CG 3.45Å; I103-L107 PolarHBondContact O-N 3.35Å; F104-L107 PolarHBondContact O-N 3.15Å; L107-L109 VanDerWaalsContact C-N 3.29Å; L107-L109 PolarHBondContact O-N 3.36Å; L107-I110 PolarHBondContact O-N 3.27Å; L107-T111 WeakPolarHBondContact O-CB 3.38Å; L107-T111 WeakPolarHBondContact O-CG2 3.48Å; L107-T111 PolarHBondContact O-N 3.2Å; L107-T111 PolarHBondContact O-OG1 2.87Å
108	S	95.2	Very high	94.5	Very high	6 Å²	6	53 Å²	53	4%	0.042	29%	0.287	C	S	.	.	H	α-helix	trans	-63.2	-36.2	175.7	-64.8	0	0	0	0	112	I85 F104 W105 T106 T111 L112	I85-S108 VanDerWaalsContact CG2-OG 3.27Å; I85-S108 WeakPolarHBondContact CG2-OG 3.29Å; F104-S108 VanDerWaalsContact CE2-OG 3.26Å; F104-S108 WeakPolarHBondContact CE2-OG 3.44Å; F104-S108 VanDerWaalsContact O-CB 3.22Å; F104-S108 WeakPolarHBondContact O-CB 3.03Å; F104-S108 PolarHBondContact O-N 3.18Å; F104-S108 PolarHBondContact O-OG 3.1Å; W105-S108 PolarHBondContact O-N 2.84Å; T106-S108 VanDerWaalsContact C-N 3.35Å; S108-T111 WeakPolarHBondContact CA-OG1 3.41Å; S108-T111 PolarHBondContact O-OG1 3.38Å; S108-T111 VanDerWaalsContact O-OG1 3.05Å; S108-L112 WeakPolarHBondContact O-CB 3.47Å; S108-L112 PolarHBondContact O-N 3.28Å; S108-L112 VanDerWaalsContact O-N 3.1Å
109	L	96.4	Very high	94.7	Very high	60 Å²	60	51.8 Å²	51.8	31%	0.314	29%	0.285	S	S	.	.	H	α-helix	trans	-69.3	-46.9	174.8	-176.2	69.3	0	0	0	111.8	W105 T106 L107 T111 L112 I113 L254	W105-L109 HydrophobicContact CH2-CD2 3.75Å; W105-L109 HydrophobicContact CZ2-CD2 4.36Å; W105-L109 HydrophobicContact CZ3-CD2 4.02Å; W105-L109 WeakPolarHBondContact O-CB 3.45Å; W105-L109 PolarHBondContact O-N 2.94Å; T106-L109 WeakPolarHBondContact O-CB 3.35Å; T106-L109 PolarHBondContact O-N 3.14Å; L107-L109 VanDerWaalsContact C-N 3.29Å; L107-L109 PolarHBondContact O-N 3.36Å; L109-T111 PolarHBondContact O-N 3.44Å; L109-L112 PolarHBondContact O-N 2.87Å; L109-I113 HydrophobicContact CG-CD1 4.24Å; L109-I113 WeakPolarHBondContact O-CG1 3.22Å; L109-I113 PolarHBondContact O-N 3.29Å; L109-L254 HydrophobicContact CD1-CD1 4.29Å
110	I	97.8	Very high	94.8	Very high	90 Å²	90	48.6 Å²	48.6	46%	0.462	28%	0.277	S	S	.	.	H	α-helix	trans	-58.3	-50.3	178.1	-70.1	166.2	0	0	0	110.1	T106 L107 L112 I113 S114	T106-I110 HydrophobicContact CG2-CD1 4.14Å; T106-I110 WeakPolarHBondContact O-CG1 3.38Å; T106-I110 PolarHBondContact O-N 2.91Å; L107-I110 PolarHBondContact O-N 3.27Å; I110-L112 VanDerWaalsContact C-N 3.29Å; I110-L112 PolarHBondContact O-N 3.48Å; I110-I113 PolarHBondContact O-N 3.41Å; I110-I113 VanDerWaalsContact O-N 3.16Å; I110-S114 PolarHBondContact O-N 3.28Å; I110-S114 PolarHBondContact O-OG 3.35Å
111	T	95.7	Very high	94.9	Very high	19 Å²	19	51.8 Å²	51.8	12%	0.117	29%	0.289	C	S	.	.	H	α-helix	trans	-62.5	-35.3	179.2	48	0	0	0	0	112.4	V81 I85 L107 S108 L109 S114 D115 R250	V81-T111 HydrophobicContact CG1-CG2 3.77Å; I85-T111 HydrophobicContact CD1-CG2 3.61Å; L107-T111 WeakPolarHBondContact O-CB 3.38Å; L107-T111 WeakPolarHBondContact O-CG2 3.48Å; L107-T111 PolarHBondContact O-N 3.2Å; L107-T111 PolarHBondContact O-OG1 2.87Å; S108-T111 WeakPolarHBondContact CA-OG1 3.41Å; S108-T111 PolarHBondContact O-OG1 3.38Å; S108-T111 VanDerWaalsContact O-OG1 3.05Å; L109-T111 PolarHBondContact O-N 3.44Å; T111-S114 PolarHBondContact O-N 2.88Å; T111-D115 WeakPolarHBondContact O-CB 3.34Å; T111-D115 PolarHBondContact O-N 3.33Å; T111-D115 VanDerWaalsContact O-OD2 3.08Å; T111-R250 PolarHBondContact OG1-NH2 3Å
112	L	95.9	Very high	94.9	Very high	19 Å²	19	52.1 Å²	52.1	10%	0.099	29%	0.293	C	S	.	.	H	α-helix	trans	-63.5	-43.4	174.5	-174	151.5	0	0	0	111.9	S108 L109 I110 D115 L116 M247 R250 I251 L254	S108-L112 WeakPolarHBondContact O-CB 3.47Å; S108-L112 PolarHBondContact O-N 3.28Å; S108-L112 VanDerWaalsContact O-N 3.1Å; L109-L112 PolarHBondContact O-N 2.87Å; I110-L112 VanDerWaalsContact C-N 3.29Å; I110-L112 PolarHBondContact O-N 3.48Å; L112-D115 PolarHBondContact O-N 2.93Å; L112-L116 WeakPolarHBondContact O-CB 3.26Å; L112-L116 PolarHBondContact O-N 3.29Å; L112-M247 HydrophobicContact CD2-CE 4.05Å; L112-M247 HydrophobicContact CG-CE 3.95Å; L112-M247 HydrophobicContact CG-SD 4.4Å; L112-R250 HydrophobicContact CD1-CB 4.08Å; L112-I251 HydrophobicContact CD1-CG1 3.7Å; L112-L254 HydrophobicContact CB-CD1 4.25Å; L112-L254 HydrophobicContact CD1-CD1 3.54Å; L112-L254 HydrophobicContact CG-CD1 4.49Å
113	I	97.1	Very high	94.8	Very high	102 Å²	102	52.6 Å²	52.6	52%	0.523	30%	0.301	S	S	.	.	H	α-helix	trans	-64.3	-44	177.3	-66.2	167.6	0	0	0	110.2	L109 I110 D115 L116 A117	L109-I113 HydrophobicContact CG-CD1 4.24Å; L109-I113 WeakPolarHBondContact O-CG1 3.22Å; L109-I113 PolarHBondContact O-N 3.29Å; I110-I113 PolarHBondContact O-N 3.41Å; I110-I113 VanDerWaalsContact O-N 3.16Å; I113-D115 PolarHBondContact O-N 3.3Å; I113-L116 PolarHBondContact O-N 2.83Å; I113-A117 PolarHBondContact O-N 2.92Å
114	S	96.3	Very high	94.6	Very high	53 Å²	53	54.2 Å²	54.2	37%	0.371	31%	0.309	S	S	.	.	H	α-helix	trans	-59.4	-45.4	175.8	-60.6	0	0	0	0	111.9	Y74 I110 T111 L116 A117 F118	Y74-S114 WeakPolarHBondContact OH-CB 3.39Å; Y74-S114 PolarHBondContact OH-O 3.3Å; I110-S114 PolarHBondContact O-N 3.28Å; I110-S114 PolarHBondContact O-OG 3.35Å; T111-S114 PolarHBondContact O-N 2.88Å; S114-L116 VanDerWaalsContact C-N 3.34Å; S114-L116 PolarHBondContact O-N 3.5Å; S114-A117 PolarHBondContact O-N 3.33Å; S114-F118 WeakPolarHBondContact O-CB 3.37Å; S114-F118 PolarHBondContact O-N 3.32Å
115	D	95	Very high	94.5	Very high	18 Å²	18	56.9 Å²	56.9	10%	0.096	32%	0.319	C	S	.	.	H	α-helix	trans	-67.7	-34.3	179.7	-67.9	-31.3	0	0	0	112.2	Y74 S78 Q82 T111 L112 I113 F118 A119 M247 R250	Y74-D115 WeakPolarHBondContact CE1-OD1 3.33Å; Y74-D115 WeakPolarHBondContact OH-CA 3.27Å; Y74-D115 PolarHBondContact OH-N 3.5Å; Y74-D115 PolarHBondContact OH-OD1 3.06Å; S78-D115 PolarHBondContact OG-OD1 3.21Å; S78-D115 PolarHBondContact OG-OD2 2.96Å; Q82-D115 PolarHBondContact NE2-OD2 2.9Å; T111-D115 WeakPolarHBondContact O-CB 3.34Å; T111-D115 PolarHBondContact O-N 3.33Å; T111-D115 VanDerWaalsContact O-OD2 3.08Å; L112-D115 PolarHBondContact O-N 2.93Å; I113-D115 PolarHBondContact O-N 3.3Å; D115-F118 PolarHBondContact O-N 2.96Å; D115-A119 WeakPolarHBondContact O-CB 3.34Å; D115-A119 PolarHBondContact O-N 3.46Å; D115-M247 HydrophobicContact CB-SD 4.03Å; D115-R250 IonicContact OD2-CZ 3.71Å; D115-R250 IonicContact OD2-NH1 3.97Å; D115-R250 PolarHBondContact OD2-NH1 2.99Å; D115-R250 IonicContact OD2-NH2 2.64Å
116	L	94.8	Very high	94.2	Very high	104 Å²	104	55.5 Å²	55.5	55%	0.545	31%	0.314	S	S	.	.	H	α-helix	trans	-65.1	-45.2	172.5	-177.5	62.5	0	0	0	111.7	L112 I113 S114 F118 A119 A120 M247	L112-L116 WeakPolarHBondContact O-CB 3.26Å; L112-L116 PolarHBondContact O-N 3.29Å; I113-L116 PolarHBondContact O-N 2.83Å; S114-L116 VanDerWaalsContact C-N 3.34Å; S114-L116 PolarHBondContact O-N 3.5Å; L116-F118 VanDerWaalsContact C-N 3.35Å; L116-A119 PolarHBondContact O-N 3.49Å; L116-A120 PolarHBondContact O-N 3.34Å; L116-A120 VanDerWaalsContact O-N 3.07Å; L116-M247 HydrophobicContact CB-CE 3.8Å; L116-M247 HydrophobicContact CD1-CE 4.26Å
117	A	95.5	Very high	93.9	Very high	61 Å²	61	57.5 Å²	57.5	50%	0.504	32%	0.322	S	S	.	.	H	α-helix	trans	-63.3	-42.8	176.6	0	0	0	0	0	111.2	I113 S114 A120 F121	I113-A117 PolarHBondContact O-N 2.92Å; S114-A117 PolarHBondContact O-N 3.33Å; A117-A120 PolarHBondContact O-N 2.96Å; A117-F121 WeakPolarHBondContact O-CB 3.18Å; A117-F121 PolarHBondContact O-N 3.27Å
118	F	94.1	Very high	93.6	Very high	17 Å²	17	58.9 Å²	58.9	8%	0.075	33%	0.33	C	S	.	.	H	α-helix	trans	-62.6	-41	174.6	176.8	-99.5	0	0	0	112	H71 Y74 L75 S114 D115 L116 A120 F121 S122	H71-F118 HydrophobicContact CB-CZ 4.42Å; H71-F118 AromaticContact CD2-CE2 3.88Å; Y74-F118 HydrophobicContact CD1-CB 4.07Å; Y74-F118 AromaticContact CD1-CD1 3.55Å; Y74-F118 HydrophobicContact CD1-CD1 3.55Å; Y74-F118 AromaticContact CD1-CD2 3.3Å; Y74-F118 HydrophobicContact CD1-CD2 3.3Å; Y74-F118 AromaticContact CD1-CE1 3.72Å; Y74-F118 HydrophobicContact CD1-CE1 3.72Å; Y74-F118 AromaticContact CD1-CE2 3.47Å; Y74-F118 HydrophobicContact CD1-CE2 3.47Å; Y74-F118 VanDerWaalsContact CD1-CE2 3.47Å; Y74-F118 AromaticContact CD1-CG 3.33Å; Y74-F118 HydrophobicContact CD1-CG 3.33Å; Y74-F118 AromaticContact CD1-CZ 3.67Å; Y74-F118 HydrophobicContact CD1-CZ 3.67Å; Y74-F118 HydrophobicContact CD2-CD2 4.11Å; Y74-F118 HydrophobicContact CE1-CB 3.49Å; Y74-F118 VanDerWaalsContact CE1-CB 3.49Å; Y74-F118 AromaticContact CE1-CD1 3.5Å; Y74-F118 HydrophobicContact CE1-CD1 3.5Å; Y74-F118 AromaticContact CE1-CD2 3.68Å; Y74-F118 HydrophobicContact CE1-CD2 3.68Å; Y74-F118 HydrophobicContact CE1-CE1 4.12Å; Y74-F118 HydrophobicContact CE1-CE2 4.27Å; Y74-F118 AromaticContact CE1-CG 3.24Å; Y74-F118 HydrophobicContact CE1-CG 3.24Å; Y74-F118 HydrophobicContact CE1-CZ 4.46Å; Y74-F118 HydrophobicContact CE2-CB 4.3Å; Y74-F118 HydrophobicContact CE2-CD2 4.39Å; Y74-F118 HydrophobicContact CE2-CG 4.47Å; Y74-F118 AromaticContact CG-CD2 3.57Å; Y74-F118 HydrophobicContact CG-CD2 3.57Å; Y74-F118 AromaticContact CG-CE2 3.68Å; Y74-F118 HydrophobicContact CG-CE2 3.68Å; Y74-F118 HydrophobicContact CG-CG 4.06Å; Y74-F118 HydrophobicContact CG-CZ 4.25Å; Y74-F118 AromaticContact CZ-CG 3.87Å; L75-F118 HydrophobicContact CD2-CE1 3.72Å; L75-F118 HydrophobicContact CD2-CZ 4.32Å; L75-F118 HydrophobicContact CG-CE1 4.04Å; L75-F118 HydrophobicContact CG-CZ 4.13Å; S114-F118 WeakPolarHBondContact O-CB 3.37Å; S114-F118 PolarHBondContact O-N 3.32Å; D115-F118 PolarHBondContact O-N 2.96Å; L116-F118 VanDerWaalsContact C-N 3.35Å; F118-A120 VanDerWaalsContact C-N 3.35Å; F118-A120 PolarHBondContact O-N 2.89Å; F118-F121 PolarHBondContact O-N 2.99Å; F118-S122 WeakPolarHBondContact CE1-OG 3.41Å; F118-S122 VanDerWaalsContact CZ-OG 3.27Å; F118-S122 WeakPolarHBondContact CZ-OG 3.3Å; F118-S122 VanDerWaalsContact O-CB 3.25Å; F118-S122 WeakPolarHBondContact O-CB 3.24Å; F118-S122 PolarHBondContact O-N 3.41Å; F118-S122 PolarHBondContact O-OG 3.05Å
119	A	92.3	Very high	93.1	Very high	28 Å²	28	60 Å²	60	23%	0.231	33%	0.334	C	S	.	.	H	α-helix	trans	-61.1	-44	176.4	0	0	0	0	0	111.4	D115 L116 S122 V123 I243	D115-A119 WeakPolarHBondContact O-CB 3.34Å; D115-A119 PolarHBondContact O-N 3.46Å; L116-A119 PolarHBondContact O-N 3.49Å; A119-S122 PolarHBondContact O-N 3.33Å; A119-V123 WeakPolarHBondContact O-CG2 3.38Å; A119-V123 PolarHBondContact O-N 3.4Å; A119-I243 HydrophobicContact CB-CG2 4.47Å
120	A	92.8	Very high	92.7	Very high	61 Å²	61	58 Å²	58	50%	0.504	33%	0.325	S	S	.	.	H	α-helix	trans	-63.6	-45.3	175.3	0	0	0	0	0	112.1	L116 A117 F118 S122 V123 I124	L116-A120 PolarHBondContact O-N 3.34Å; L116-A120 VanDerWaalsContact O-N 3.07Å; A117-A120 PolarHBondContact O-N 2.96Å; F118-A120 VanDerWaalsContact C-N 3.35Å; F118-A120 PolarHBondContact O-N 2.89Å; A120-S122 PolarHBondContact O-N 3.49Å; A120-V123 PolarHBondContact O-N 3.37Å; A120-I124 PolarHBondContact O-N 2.87Å
121	F	93.7	Very high	92.1	Very high	101 Å²	101	58.5 Å²	58.5	44%	0.443	33%	0.332	S	S	.	.	H	α-helix	trans	-62.3	-41.6	176.7	179.1	-99.8	0	0	0	112.2	H71 A117 F118 V123 I124 W125	H71-F121 AromaticContact CE1-CE1 3.91Å; H71-F121 AromaticContact NE2-CD1 3.78Å; H71-F121 AromaticContact NE2-CE1 3.42Å; H71-F121 WeakPolarHBondContact NE2-CE1 3.37Å; A117-F121 WeakPolarHBondContact O-CB 3.18Å; A117-F121 PolarHBondContact O-N 3.27Å; F118-F121 PolarHBondContact O-N 2.99Å; F121-V123 VanDerWaalsContact C-N 3.28Å; F121-V123 PolarHBondContact O-N 3.44Å; F121-I124 PolarHBondContact O-N 3.24Å; F121-I124 VanDerWaalsContact O-N 3.13Å; F121-W125 HydrophobicContact CE1-CB 4.27Å; F121-W125 WeakPolarHBondContact O-CB 3.41Å; F121-W125 PolarHBondContact O-N 3.02Å
122	S	90.6	Very high	91.7	Very high	16 Å²	16	60.8 Å²	60.8	11%	0.112	35%	0.349	C	S	.	.	H	α-helix	trans	-62.4	-34.8	179.7	-63.9	0	0	0	0	112.2	F118 A119 A120 W126	F118-S122 WeakPolarHBondContact CE1-OG 3.41Å; F118-S122 VanDerWaalsContact CZ-OG 3.27Å; F118-S122 WeakPolarHBondContact CZ-OG 3.3Å; F118-S122 VanDerWaalsContact O-CB 3.25Å; F118-S122 WeakPolarHBondContact O-CB 3.24Å; F118-S122 PolarHBondContact O-N 3.41Å; F118-S122 PolarHBondContact O-OG 3.05Å; A119-S122 PolarHBondContact O-N 3.33Å; A120-S122 PolarHBondContact O-N 3.49Å; S122-W126 WeakPolarHBondContact O-CB 3.2Å; S122-W126 PolarHBondContact O-N 2.64Å
123	V	90.5	Very high	91	Very high	89 Å²	89	60 Å²	60	54%	0.539	35%	0.345	S	S	.	.	H	α-helix	trans	-64.4	-44.9	174.3	172.3	0	0	0	0	110.9	A119 A120 F121 N127	A119-V123 WeakPolarHBondContact O-CG2 3.38Å; A119-V123 PolarHBondContact O-N 3.4Å; A120-V123 PolarHBondContact O-N 3.37Å; F121-V123 VanDerWaalsContact C-N 3.28Å; F121-V123 PolarHBondContact O-N 3.44Å; V123-N127 PolarHBondContact O-N 3.47Å; V123-N127 VanDerWaalsContact O-N 3.14Å
124	I	92.1	Very high	90.1	Very high	106 Å²	106	56.9 Å²	56.9	54%	0.544	33%	0.332	S	S	.	.	H	α-helix	trans	-65.3	-49.3	178.5	-62.4	169.5	0	0	0	110.2	A120 F121 W126 N127 N128	A120-I124 PolarHBondContact O-N 2.87Å; F121-I124 PolarHBondContact O-N 3.24Å; F121-I124 VanDerWaalsContact O-N 3.13Å; I124-W126 VanDerWaalsContact C-N 3.31Å; I124-W126 PolarHBondContact O-N 3.27Å; I124-N127 PolarHBondContact O-N 3.39Å; I124-N128 PolarHBondContact O-N 3.27Å; I124-N128 VanDerWaalsContact O-N 3.13Å
125	W	90.6	Very high	89.5	Confident	59 Å²	59	57.6 Å²	57.6	22%	0.223	34%	0.337	C	S	.	.	H	α-helix	trans	-58.4	-44.5	178.5	173.9	81	0	0	0	111.6	F65 H71 F121 N127 N128 F129	F65-W125 AromaticContact CE1-CH2 3.92Å; F65-W125 HydrophobicContact CE1-CH2 3.92Å; H71-W125 AromaticContact CD2-CD2 3.95Å; H71-W125 AromaticContact CD2-CE3 3.83Å; H71-W125 AromaticContact CE1-CD1 3.27Å; H71-W125 AromaticContact CE1-CD2 3.11Å; H71-W125 AromaticContact CE1-CE2 3.18Å; H71-W125 AromaticContact CE1-CE3 3.77Å; H71-W125 AromaticContact CE1-CG 3.16Å; H71-W125 AromaticContact CE1-CZ2 3.86Å; H71-W125 AromaticContact CE1-NE1 3.27Å; H71-W125 PolarHBondContact CE1-NE1 3.19Å; H71-W125 VanDerWaalsContact CE1-NE1 3.27Å; H71-W125 AromaticContact ND1-CD2 3.61Å; H71-W125 AromaticContact ND1-CE2 3.38Å; H71-W125 AromaticContact ND1-CE3 3.99Å; H71-W125 AromaticContact ND1-CH2 3.92Å; H71-W125 AromaticContact ND1-CZ2 3.56Å; H71-W125 AromaticContact ND1-NE1 3.78Å; H71-W125 AromaticContact NE2-CD1 3.83Å; H71-W125 AromaticContact NE2-CD2 3.32Å; H71-W125 VanDerWaalsContact NE2-CD2 3.32Å; H71-W125 AromaticContact NE2-CE2 3.9Å; H71-W125 AromaticContact NE2-CE3 3.66Å; H71-W125 AromaticContact NE2-CG 3.27Å; H71-W125 VanDerWaalsContact NE2-CG 3.27Å; F121-W125 HydrophobicContact CE1-CB 4.27Å; F121-W125 WeakPolarHBondContact O-CB 3.41Å; F121-W125 PolarHBondContact O-N 3.02Å; W125-N127 VanDerWaalsContact C-N 3.33Å; W125-N127 PolarHBondContact O-N 2.77Å; W125-N128 PolarHBondContact O-N 2.89Å; W125-F129 HydrophobicContact CZ2-CD2 4.28Å; W125-F129 WeakPolarHBondContact O-CB 3.46Å; W125-F129 PolarHBondContact O-N 3.11Å
126	W	88.6	Confident	88.9	Confident	22 Å²	22	59.8 Å²	59.8	8%	0.083	35%	0.346	C	S	.	.	H	α-helix	trans	-60.8	-41.9	178.4	-175.5	-96.4	0	0	0	112.5	F65 S122 I124 N128 F129 V130 M231 N232 K235	F65-W126 HydrophobicContact CZ-CZ3 4.47Å; S122-W126 WeakPolarHBondContact O-CB 3.2Å; S122-W126 PolarHBondContact O-N 2.64Å; I124-W126 VanDerWaalsContact C-N 3.31Å; I124-W126 PolarHBondContact O-N 3.27Å; W126-N128 VanDerWaalsContact C-N 3.3Å; W126-N128 PolarHBondContact O-N 3.44Å; W126-F129 HydrophobicContact CE3-CD1 4.5Å; W126-F129 HydrophobicContact CZ3-CD1 4.45Å; W126-F129 WeakPolarHBondContact O-CB 3.44Å; W126-F129 PolarHBondContact O-N 3.19Å; W126-V130 HydrophobicContact CD2-CG2 4.42Å; W126-V130 HydrophobicContact CG-CG2 4.44Å; W126-V130 HydrophobicContact CZ2-CG2 4.39Å; W126-V130 WeakPolarHBondContact O-CG2 3.28Å; W126-V130 PolarHBondContact O-N 3.34Å; W126-M231 HydrophobicContact CH2-CE 3.8Å; W126-M231 HydrophobicContact CH2-CG 3.55Å; W126-M231 HydrophobicContact CH2-SD 3.49Å; W126-M231 WeakPolarHBondContact CH2-SD 3.42Å; W126-M231 HydrophobicContact CZ2-CB 4.44Å; W126-M231 HydrophobicContact CZ2-CE 3.46Å; W126-M231 VanDerWaalsContact CZ2-CE 3.46Å; W126-M231 HydrophobicContact CZ2-CG 3.56Å; W126-M231 HydrophobicContact CZ2-SD 3.72Å; W126-N232 PolarHBondContact NE1-OD1 2.69Å; W126-K235 HydrophobicContact CD2-CD 3.53Å; W126-K235 VanDerWaalsContact CE2-CD 3.4Å; W126-K235 HydrophobicContact CE3-CD 4.17Å; W126-K235 HydrophobicContact CG-CD 3.69Å; W126-K235 HydrophobicContact CH2-CD 4.44Å; W126-K235 HydrophobicContact CZ2-CB 4.13Å; W126-K235 HydrophobicContact CZ2-CD 3.86Å; W126-K235 HydrophobicContact CZ2-CG 4.41Å
127	N	89.9	Confident	88.1	Confident	107 Å²	107	55 Å²	55	57%	0.572	32%	0.321	S	S	*	.	H	α-helix	trans	-64.7	-38.2	179.4	-149.1	29.5	0	0	0	111.5	V123 I124 W125 T131	V123-N127 PolarHBondContact O-N 3.47Å; V123-N127 VanDerWaalsContact O-N 3.14Å; I124-N127 PolarHBondContact O-N 3.39Å; W125-N127 VanDerWaalsContact C-N 3.33Å; W125-N127 PolarHBondContact O-N 2.77Å; N127-T131 WeakPolarHBondContact O-CG2 3.28Å; N127-T131 PolarHBondContact O-N 2.89Å; N127-T131 PolarHBondContact O-OG1 2.78Å
128	N	90	Very high	87.4	Confident	99 Å²	99	54.8 Å²	54.8	53%	0.529	31%	0.311	S	S	.	.	H	α-helix	trans	-68.9	-37.5	173.3	-67.5	-14.2	0	0	0	112	I124 W125 W126 T131 S132	I124-N128 PolarHBondContact O-N 3.27Å; I124-N128 VanDerWaalsContact O-N 3.13Å; W125-N128 PolarHBondContact O-N 2.89Å; W126-N128 VanDerWaalsContact C-N 3.3Å; W126-N128 PolarHBondContact O-N 3.44Å; N128-T131 WeakPolarHBondContact CA-OG1 3.3Å; N128-T131 PolarHBondContact O-N 2.93Å; N128-T131 PolarHBondContact O-OG1 3.47Å; N128-S132 WeakPolarHBondContact O-CB 3.32Å; N128-S132 PolarHBondContact O-N 3.37Å
129	F	86.5	Confident	86.7	Confident	28 Å²	28	55.1 Å²	55.1	12%	0.123	32%	0.315	C	S	.	.	H	α-helix	trans	-64.2	-48.1	176.6	178	-96.9	0	0	0	111.5	F63 F65 W125 W126 T131 S132 S133 M231	F63-F129 HydrophobicContact CB-CZ 4.31Å; F63-F129 AromaticContact CD1-CE1 3.99Å; F63-F129 HydrophobicContact CD1-CE1 3.99Å; F63-F129 AromaticContact CD1-CZ 3.73Å; F63-F129 HydrophobicContact CD1-CZ 3.73Å; F63-F129 HydrophobicContact CE1-CE1 4.29Å; F63-F129 HydrophobicContact CE1-CZ 4.44Å; F63-F129 HydrophobicContact CG-CZ 4.29Å; F65-F129 HydrophobicContact CD1-CZ 4.46Å; F65-F129 HydrophobicContact CE1-CD2 4.42Å; F65-F129 AromaticContact CE1-CE1 3.94Å; F65-F129 HydrophobicContact CE1-CE1 3.94Å; F65-F129 AromaticContact CE1-CE2 3.74Å; F65-F129 HydrophobicContact CE1-CE2 3.74Å; F65-F129 AromaticContact CE1-CZ 3.46Å; F65-F129 HydrophobicContact CE1-CZ 3.46Å; F65-F129 VanDerWaalsContact CE1-CZ 3.46Å; F65-F129 HydrophobicContact CE2-CZ 4.24Å; F65-F129 HydrophobicContact CZ-CD1 4.42Å; F65-F129 AromaticContact CZ-CE1 3.54Å; F65-F129 HydrophobicContact CZ-CE1 3.54Å; F65-F129 HydrophobicContact CZ-CE2 4.11Å; F65-F129 AromaticContact CZ-CZ 3.34Å; F65-F129 HydrophobicContact CZ-CZ 3.34Å; W125-F129 HydrophobicContact CZ2-CD2 4.28Å; W125-F129 WeakPolarHBondContact O-CB 3.46Å; W125-F129 PolarHBondContact O-N 3.11Å; W126-F129 HydrophobicContact CE3-CD1 4.5Å; W126-F129 HydrophobicContact CZ3-CD1 4.45Å; W126-F129 WeakPolarHBondContact O-CB 3.44Å; W126-F129 PolarHBondContact O-N 3.19Å; F129-T131 VanDerWaalsContact C-N 3.27Å; F129-T131 PolarHBondContact O-N 3.46Å; F129-S132 CarbonylContact O-C 3.2Å; F129-S132 PolarHBondContact O-N 2.98Å; F129-S132 VanDerWaalsContact O-N 3.14Å; F129-S133 VanDerWaalsContact O-CB 3.31Å; F129-S133 WeakPolarHBondContact O-CB 3.33Å; F129-S133 PolarHBondContact O-N 3.22Å; F129-M231 HydrophobicContact CD1-CE 4.27Å; F129-M231 HydrophobicContact CE1-CE 4.06Å; F129-M231 HydrophobicContact CE1-SD 4.14Å
130	V	86.3	Confident	85.9	Confident	20 Å²	20	56 Å²	56	12%	0.121	32%	0.316	C	S	.	.	H	α-helix	trans	-59.3	-37.6	178.1	166.9	0	0	0	0	111.9	W126 S133 L228 M231	W126-V130 HydrophobicContact CD2-CG2 4.42Å; W126-V130 HydrophobicContact CG-CG2 4.44Å; W126-V130 HydrophobicContact CZ2-CG2 4.39Å; W126-V130 WeakPolarHBondContact O-CG2 3.28Å; W126-V130 PolarHBondContact O-N 3.34Å; V130-S133 PolarHBondContact O-OG 3.4Å; V130-L228 HydrophobicContact CB-CD2 4.35Å; V130-L228 HydrophobicContact CG1-CD1 4.18Å; V130-L228 HydrophobicContact CG1-CD2 3.88Å; V130-L228 HydrophobicContact CG2-CD2 4.31Å; V130-M231 HydrophobicContact CG2-CE 3.78Å
131	T	86.4	Confident	85	Confident	99 Å²	99	53.1 Å²	53.1	61%	0.607	29%	0.292	S	S	*	.	H	α-helix	trans	-74.6	-32.1	177.9	48.1	0	0	0	0	112.5	N127 N128 F129	N127-T131 WeakPolarHBondContact O-CG2 3.28Å; N127-T131 PolarHBondContact O-N 2.89Å; N127-T131 PolarHBondContact O-OG1 2.78Å; N128-T131 WeakPolarHBondContact CA-OG1 3.3Å; N128-T131 PolarHBondContact O-N 2.93Å; N128-T131 PolarHBondContact O-OG1 3.47Å; F129-T131 VanDerWaalsContact C-N 3.27Å; F129-T131 PolarHBondContact O-N 3.46Å
132	S	86.6	Confident	84.1	Confident	68 Å²	68	50.7 Å²	50.7	48%	0.476	28%	0.284	S	S	.	.	H	α-helix	trans	-87.2	-12.2	178.1	-172.6	0	0	0	0	114.4	N128 F129 S134 S135 F136	N128-S132 WeakPolarHBondContact O-CB 3.32Å; N128-S132 PolarHBondContact O-N 3.37Å; F129-S132 CarbonylContact O-C 3.2Å; F129-S132 PolarHBondContact O-N 2.98Å; F129-S132 VanDerWaalsContact O-N 3.14Å; S132-S134 PolarHBondContact O-N 3.44Å; S132-S135 PolarHBondContact O-OG 2.81Å; S132-F136 PolarHBondContact O-N 3.35Å
133	S	80.8	Confident	82.9	Confident	3 Å²	3	52.8 Å²	52.8	2%	0.021	29%	0.291	C	S	.	.	H	α-helix	trans	-72.1	-28.3	-169.2	62.3	0	0	0	0	113.8	F129 V130 F136 I137 L228	F129-S133 VanDerWaalsContact O-CB 3.31Å; F129-S133 WeakPolarHBondContact O-CB 3.33Å; F129-S133 PolarHBondContact O-N 3.22Å; V130-S133 PolarHBondContact O-OG 3.4Å; S133-F136 PolarHBondContact O-N 3.39Å; S133-I137 WeakPolarHBondContact O-CG1 3.27Å; S133-I137 PolarHBondContact O-N 2.83Å; S133-L228 WeakPolarHBondContact OG-CD2 3.42Å
134	S	79	Confident	81.4	Confident	35 Å²	35	50.6 Å²	50.6	25%	0.245	29%	0.286	C	S	.	.	H	α-helix	trans	-62	-52.7	179.9	57.2	0	0	0	0	111.5	S132 F136 I137 L138	S132-S134 PolarHBondContact O-N 3.44Å; S134-F136 PolarHBondContact O-N 2.99Å; S134-I137 PolarHBondContact O-N 2.89Å; S134-L138 WeakPolarHBondContact O-CB 3.22Å; S134-L138 PolarHBondContact O-N 3.25Å; S134-L138 VanDerWaalsContact O-N 3.07Å
135	S	83.3	Confident	79.8	Confident	69 Å²	69	53 Å²	53	48%	0.483	29%	0.289	S	S	.	.	H	α-helix	trans	-60	-34.6	175.9	50.6	0	0	0	0	111.8	S132 S139	S132-S135 PolarHBondContact O-OG 2.81Å; S135-S139 VanDerWaalsContact O-CB 3.23Å; S135-S139 WeakPolarHBondContact O-CB 3.25Å; S135-S139 PolarHBondContact O-N 3.4Å; S135-S139 PolarHBondContact O-OG 3Å
136	F	81.9	Confident	78	Confident	63 Å²	63	53 Å²	53	28%	0.276	29%	0.291	S	S	.	.	H	α-helix	trans	-68.8	-51.9	180	-175	-82.8	0	0	0	111.9	P64 S132 S133 S134 L138 S139 N140	P64-F136 HydrophobicContact CB-CD1 4.16Å; P64-F136 HydrophobicContact CB-CE1 3.2Å; P64-F136 HydrophobicContact CB-CE2 3.96Å; P64-F136 HydrophobicContact CB-CZ 3.08Å; P64-F136 VanDerWaalsContact CD-CD1 3.48Å; P64-F136 HydrophobicContact CG-CD1 3.45Å; P64-F136 VanDerWaalsContact CG-CD1 3.45Å; P64-F136 HydrophobicContact CG-CD2 4.15Å; P64-F136 HydrophobicContact CG-CE1 3Å; P64-F136 HydrophobicContact CG-CE2 3.74Å; P64-F136 HydrophobicContact CG-CG 4.04Å; P64-F136 HydrophobicContact CG-CZ 3.19Å; S132-F136 PolarHBondContact O-N 3.35Å; S133-F136 PolarHBondContact O-N 3.39Å; S134-F136 PolarHBondContact O-N 2.99Å; F136-L138 VanDerWaalsContact C-N 3.29Å; F136-L138 PolarHBondContact O-N 2.87Å; F136-S139 PolarHBondContact O-N 3.37Å; F136-S139 PolarHBondContact O-OG 2.93Å; F136-N140 HydrophobicContact CE1-CB 4.14Å; F136-N140 WeakPolarHBondContact CE1-ND2 3.15Å; F136-N140 VanDerWaalsContact CZ-CG 3.4Å; F136-N140 VanDerWaalsContact CZ-ND2 3.27Å; F136-N140 WeakPolarHBondContact CZ-ND2 3.19Å; F136-N140 WeakPolarHBondContact CZ-OD1 3.34Å; F136-N140 PolarHBondContact O-N 2.98Å
137	I	79.6	Confident	76.2	Confident	4 Å²	4	54.8 Å²	54.8	2%	0.021	31%	0.31	C	S	.	.	H	α-helix	trans	-57.2	-46.4	178.7	-71.2	162	0	0	0	110.1	F63 S133 S134 S139 N140 L141 W168 V180 I224 L227	F63-I137 HydrophobicContact CD1-CD1 4.35Å; F63-I137 HydrophobicContact CE1-CD1 3.72Å; F63-I137 HydrophobicContact CE1-CG1 4.41Å; F63-I137 HydrophobicContact CZ-CD1 4.25Å; S133-I137 WeakPolarHBondContact O-CG1 3.27Å; S133-I137 PolarHBondContact O-N 2.83Å; S134-I137 PolarHBondContact O-N 2.89Å; I137-S139 VanDerWaalsContact C-N 3.26Å; I137-S139 PolarHBondContact O-N 3.47Å; I137-N140 PolarHBondContact O-N 3Å; I137-L141 HydrophobicContact CG2-CD1 3.71Å; I137-L141 HydrophobicContact CG2-CG 4.4Å; I137-L141 WeakPolarHBondContact O-CG 3.34Å; I137-L141 PolarHBondContact O-N 3.4Å; I137-W168 HydrophobicContact CG2-CH2 3.99Å; I137-W168 HydrophobicContact CG2-CZ3 3.98Å; I137-V180 HydrophobicContact CG2-CG1 4.31Å; I137-V180 HydrophobicContact CG2-CG2 4.09Å; I137-I224 HydrophobicContact CD1-CD1 3.53Å; I137-L227 HydrophobicContact CD1-CD2 4.11Å
138	L	79.8	Confident	74.4	Confident	56 Å²	56	58.8 Å²	58.8	29%	0.293	33%	0.325	S	S	.	.	H	α-helix	trans	-56.1	-45.2	177.1	-162.1	70.1	0	0	0	111.1	S134 F136 N140 L141 D142 V180 I189	S134-L138 WeakPolarHBondContact O-CB 3.22Å; S134-L138 PolarHBondContact O-N 3.25Å; S134-L138 VanDerWaalsContact O-N 3.07Å; F136-L138 VanDerWaalsContact C-N 3.29Å; F136-L138 PolarHBondContact O-N 2.87Å; L138-N140 VanDerWaalsContact C-N 3.33Å; L138-N140 PolarHBondContact O-N 2.82Å; L138-L141 PolarHBondContact O-N 2.77Å; L138-D142 PolarHBondContact O-N 3.48Å; L138-D142 VanDerWaalsContact O-N 3.15Å; L138-V180 HydrophobicContact CD1-CB 3.92Å; L138-V180 HydrophobicContact CD1-CG1 4.26Å; L138-V180 HydrophobicContact CD1-CG2 3.82Å; L138-I189 HydrophobicContact CD1-CD1 3.25Å; L138-I189 HydrophobicContact CD2-CD1 3.97Å; L138-I189 HydrophobicContact CG-CD1 3.5Å; L138-I189 VanDerWaalsContact CG-CD1 3.5Å
139	S	80.1	Confident	72.4	Confident	24 Å²	24	59.1 Å²	59.1	17%	0.168	34%	0.335	C	S	.	.	H	α-helix	trans	-72.5	-21.8	-178	83.4	0	0	0	0	115.1	S135 F136 I137 R145	S135-S139 VanDerWaalsContact O-CB 3.23Å; S135-S139 WeakPolarHBondContact O-CB 3.25Å; S135-S139 PolarHBondContact O-N 3.4Å; S135-S139 PolarHBondContact O-OG 3Å; F136-S139 PolarHBondContact O-N 3.37Å; F136-S139 PolarHBondContact O-OG 2.93Å; I137-S139 VanDerWaalsContact C-N 3.26Å; I137-S139 PolarHBondContact O-N 3.47Å; S139-R145 PolarHBondContact OG-NH1 3.36Å
140	N	75.8	Confident	70.5	Confident	46 Å²	46	60.2 Å²	60.2	25%	0.246	35%	0.347	C	S	.	.	H	α-helix	trans	-85.3	-28.4	175.2	-98	20.7	0	0	0	112.9	F136 I137 L138	F136-N140 HydrophobicContact CE1-CB 4.14Å; F136-N140 WeakPolarHBondContact CE1-ND2 3.15Å; F136-N140 VanDerWaalsContact CZ-CG 3.4Å; F136-N140 VanDerWaalsContact CZ-ND2 3.27Å; F136-N140 WeakPolarHBondContact CZ-ND2 3.19Å; F136-N140 WeakPolarHBondContact CZ-OD1 3.34Å; F136-N140 PolarHBondContact O-N 2.98Å; I137-N140 PolarHBondContact O-N 3Å; L138-N140 VanDerWaalsContact C-N 3.33Å; L138-N140 PolarHBondContact O-N 2.82Å
141	L	73.5	Confident	68.6	Low	2 Å²	2	70.5 Å²	70.5	1%	0.01	38%	0.383	C	S	.	.	H	α-helix	trans	-81	-22.5	176.7	-70.3	173.5	0	0	0	112.2	I137 L138 K143 W168 V180 Y191 R192	I137-L141 HydrophobicContact CG2-CD1 3.71Å; I137-L141 HydrophobicContact CG2-CG 4.4Å; I137-L141 WeakPolarHBondContact O-CG 3.34Å; I137-L141 PolarHBondContact O-N 3.4Å; L138-L141 PolarHBondContact O-N 2.77Å; L141-K143 PolarHBondContact O-N 2.84Å; L141-W168 HydrophobicContact CD1-CD2 4.01Å; L141-W168 HydrophobicContact CD1-CE3 4.2Å; L141-W168 HydrophobicContact CD1-CH2 3.95Å; L141-W168 HydrophobicContact CD1-CZ2 3.74Å; L141-W168 HydrophobicContact CD1-CZ3 4.17Å; L141-W168 HydrophobicContact CD2-CD2 4.36Å; L141-W168 HydrophobicContact CD2-CG 4.36Å; L141-V180 HydrophobicContact CD1-CG2 3.7Å; L141-Y191 HydrophobicContact CB-CD1 3.77Å; L141-Y191 HydrophobicContact CB-CE1 3.69Å; L141-Y191 HydrophobicContact CD1-CD1 4.45Å; L141-Y191 HydrophobicContact CD1-CE1 3.91Å; L141-Y191 HydrophobicContact CG-CD1 4.49Å; L141-Y191 HydrophobicContact CG-CE1 4.33Å; L141-Y191 WeakPolarHBondContact O-CA 3.42Å; L141-R192 PolarHBondContact O-N 3.03Å
142	D	74.9	Confident	66.8	Low	49 Å²	49	68.3 Å²	68.3	26%	0.262	37%	0.367	S	S	.	.	B	Isolated β-bridge	trans	-64.9	114.7	174.8	-179.3	25.3	0	0	0	112.3	L138 G144 I189	L138-D142 PolarHBondContact O-N 3.48Å; L138-D142 VanDerWaalsContact O-N 3.15Å; D142-G144 VanDerWaalsContact C-N 3.27Å; D142-G144 PolarHBondContact O-N 3.34Å; D142-G144 PolarHBondContact OD1-N 3.43Å; D142-I189 HydrophobicContact CB-CG2 3.8Å
143	K	64.4	Low	65.1	Low	61 Å²	61	70.3 Å²	70.3	27%	0.265	37%	0.373	S	S	.	.	S	Bend	trans	-66.3	-30.1	174.5	-167.7	-173.6	-176.1	-175.9	0	111.1	L141 R145 H146 A147 I190	L141-K143 PolarHBondContact O-N 2.84Å; K143-R145 VanDerWaalsContact C-N 3.29Å; K143-R145 PolarHBondContact O-N 3.41Å; K143-H146 PolarHBondContact O-N 3.36Å; K143-A147 PolarHBondContact O-N 3.13Å; K143-I190 WeakPolarHBondContact CA-O 3.32Å; K143-I190 HydrophobicContact CB-CB 4.07Å; K143-I190 HydrophobicContact CB-CG2 3.74Å; K143-I190 WeakPolarHBondContact CB-O 3.46Å; K143-I190 HydrophobicContact CD-CG2 3.45Å; K143-I190 VanDerWaalsContact CD-CG2 3.45Å; K143-I190 HydrophobicContact CG-CG2 4.2Å; K143-I190 PolarHBondContact N-O 2.85Å
144	G	59.1	Low	64	Low	43 Å²	43	79.5 Å²	79.5	44%	0.443	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-41	-176.9	0	0	0	0	0	112.6	D142 H146	D142-G144 VanDerWaalsContact C-N 3.27Å; D142-G144 PolarHBondContact O-N 3.34Å; D142-G144 PolarHBondContact OD1-N 3.43Å; G144-H146 VanDerWaalsContact C-N 3.27Å; G144-H146 PolarHBondContact O-N 3.32Å
145	R	58.2	Low	62.9	Low	157 Å²	157	85.4 Å²	85.4	59%	0.592	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-23.7	175.9	-174.9	177	-94.2	177.3	-4	114.1	S139 K143	S139-R145 PolarHBondContact OG-NH1 3.36Å; K143-R145 VanDerWaalsContact C-N 3.29Å; K143-R145 PolarHBondContact O-N 3.41Å
146	H	52.3	Low	61.6	Low	59 Å²	59	84.7 Å²	84.7	27%	0.273	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	-10.8	-178.1	-69.3	-64.7	0	0	0	114.4	K143 G144 E148 S149 S150	K143-H146 PolarHBondContact O-N 3.36Å; G144-H146 VanDerWaalsContact C-N 3.27Å; G144-H146 PolarHBondContact O-N 3.32Å; H146-E148 PolarHBondContact O-N 3.48Å; H146-S149 PolarHBondContact O-N 3.07Å; H146-S150 PolarHBondContact O-N 2.85Å
147	A	51.9	Low	60.4	Low	59 Å²	59	86.5 Å²	86.5	49%	0.488	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-29.9	178.7	0	0	0	0	0	112.8	K143 S149 S150	K143-A147 PolarHBondContact O-N 3.13Å; A147-S149 VanDerWaalsContact C-N 3.33Å; A147-S149 PolarHBondContact O-N 3.23Å; A147-S150 CarbonylContact O-C 3.56Å
148	E	52.4	Low	59.5	Low	190 Å²	190	88 Å²	88	89%	0.888	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-31.9	175.1	-155.2	79.6	-151.1	0	0	112.3	H146	H146-E148 PolarHBondContact O-N 3.48Å
149	S	48.6	Very low	58.9	Low	106 Å²	106	90 Å²	90	74%	0.741	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-16.5	-175.9	169.2	0	0	0	0	113.6	H146 A147	H146-S149 PolarHBondContact O-N 3.07Å; A147-S149 VanDerWaalsContact C-N 3.33Å; A147-S149 PolarHBondContact O-N 3.23Å
150	S	44.8	Very low	58.2	Low	52 Å²	52	93.5 Å²	93.5	36%	0.364	51%	0.505	S	S	.	.			trans	-157.3	116.7	173.2	47.1	0	0	0	0	107.6	H146 A147 I152	H146-S150 PolarHBondContact O-N 2.85Å; A147-S150 CarbonylContact O-C 3.56Å; S150-I152 PolarHBondContact O-N 3.32Å; S150-I152 WeakPolarHBondContact OG-CG1 3.42Å
151	R	46.4	Very low	57.9	Low	236 Å²	236	91.9 Å²	91.9	89%	0.891	50%	0.498	S	S	*	.			trans	-51.7	87.7	142	-84.6	175.5	151.8	144	-6.1	105.9	D153	R151-D153 PolarHBondContact O-N 3.42Å
152	I	49.5	Very low	58	Low	53 Å²	53	94.3 Å²	94.3	27%	0.272	51%	0.512	S	S	.	.			trans	-65.4	94.7	166.8	-62	174	0	0	0	102.4	S150 E154	S150-I152 PolarHBondContact O-N 3.32Å; S150-I152 WeakPolarHBondContact OG-CG1 3.42Å; I152-E154 PolarHBondContact O-N 3.48Å; I152-E154 VanDerWaalsContact O-N 3.16Å
153	D	51.7	Low	58.3	Low	110 Å²	110	95.8 Å²	95.8	59%	0.588	52%	0.52	S	S	*	.			trans	-48.6	125.7	160.8	-69.6	-33.7	0	0	0	104.7	R151 N155 S156	R151-D153 PolarHBondContact O-N 3.42Å; D153-N155 PolarHBondContact O-N 3.18Å; D153-S156 PolarHBondContact N-OG 2.93Å; D153-S156 PolarHBondContact O-N 3.27Å; D153-S156 PolarHBondContact O-OG 2.75Å
154	E	56	Low	59	Low	196 Å²	196	94.3 Å²	94.3	92%	0.916	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	-21.1	174.9	-81.7	177.5	144.2	0	0	111.9	I152	I152-E154 PolarHBondContact O-N 3.48Å; I152-E154 VanDerWaalsContact O-N 3.16Å
155	N	57	Low	60.1	Low	159 Å²	159	92.6 Å²	92.6	85%	0.85	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-13.6	176.6	-65.5	-14.3	0	0	0	114.8	D153 S157	D153-N155 PolarHBondContact O-N 3.18Å; N155-S157 PolarHBondContact O-N 3.37Å
156	S	54.7	Low	61.4	Low	54 Å²	54	92.7 Å²	92.7	38%	0.378	50%	0.5	S	S	.	.	S	Bend	trans	-80.1	100.1	175.1	65.9	0	0	0	0	108.9	D153 C158	D153-S156 PolarHBondContact N-OG 2.93Å; D153-S156 PolarHBondContact O-N 3.27Å; D153-S156 PolarHBondContact O-OG 2.75Å; S156-C158 VanDerWaalsContact C-N 3.28Å; S156-C158 PolarHBondContact O-N 3.35Å
157	S	58.6	Low	63.1	Low	101 Å²	101	92.9 Å²	92.9	71%	0.706	50%	0.498	S	S	*	.			trans	-60.5	91.8	170.1	58.7	0	0	0	0	109	N155 T159	N155-S157 PolarHBondContact O-N 3.37Å; S157-T159 PolarHBondContact O-N 2.98Å
158	C	60.4	Low	64.8	Low	34 Å²	34	90.2 Å²	90.2	23%	0.23	48%	0.476	C	S	.	.			trans	-67.6	98.1	173.7	170.2	0	0	0	0	109	S156 T160 C161 T162	S156-C158 VanDerWaalsContact C-N 3.28Å; S156-C158 PolarHBondContact O-N 3.35Å; C158-T160 VanDerWaalsContact C-N 3.28Å; C158-T160 PolarHBondContact O-N 3.05Å; C158-T160 PolarHBondContact SG-OG1 3.39Å; C158-C161 HydrophobicContact CB-CB 3.62Å; C158-C161 WeakPolarHBondContact CB-SG 3.5Å; C158-C161 VanDerWaalsContact O-CB 3.27Å; C158-C161 WeakPolarHBondContact O-CB 3.4Å; C158-C161 PolarHBondContact O-N 2.85Å; C158-C161 WeakPolarHBondContact SG-CB 3.4Å; C158-C161 PolarHBondContact SG-N 3.42Å; C158-C161 CovalentContact SG-SG 2.03Å; C158-C161 PolarHBondContact SG-SG 2.98Å; C158-T162 PolarHBondContact O-N 2.92Å; C158-T162 VanDerWaalsContact O-N 3.13Å
159	T	65.9	Low	66.5	Low	99 Å²	99	83.3 Å²	83.3	61%	0.607	45%	0.449	S	S	*	.	H	α-helix	trans	-59.7	-36.9	-177.7	-35.7	0	0	0	0	112.3	S157 C161 T162 D163	S157-T159 PolarHBondContact O-N 2.98Å; T159-C161 VanDerWaalsContact C-N 3.32Å; T159-C161 PolarHBondContact O-N 2.83Å; T159-T162 PolarHBondContact O-N 3.19Å; T159-T162 PolarHBondContact O-OG1 2.77Å; T159-D163 PolarHBondContact O-N 3.23Å
160	T	66.7	Low	68.5	Low	97 Å²	97	81 Å²	81	60%	0.595	43%	0.427	S	S	*	.	H	α-helix	trans	-70.8	-29.7	176.6	51.6	0	0	0	0	112.5	C158 H164	C158-T160 VanDerWaalsContact C-N 3.28Å; C158-T160 PolarHBondContact O-N 3.05Å; C158-T160 PolarHBondContact SG-OG1 3.39Å; T160-H164 PolarHBondContact O-N 3.01Å
161	C	68.7	Low	70.7	Confident	13 Å²	13	78.5 Å²	78.5	9%	0.088	41%	0.41	C	S	.	.	H	α-helix	trans	-66.5	-41.2	173.4	-55.8	0	0	0	0	110.2	C158 T159 D163 H164 C165 R192	C158-C161 HydrophobicContact CB-CB 3.62Å; C158-C161 WeakPolarHBondContact CB-SG 3.5Å; C158-C161 VanDerWaalsContact O-CB 3.27Å; C158-C161 WeakPolarHBondContact O-CB 3.4Å; C158-C161 PolarHBondContact O-N 2.85Å; C158-C161 WeakPolarHBondContact SG-CB 3.4Å; C158-C161 PolarHBondContact SG-N 3.42Å; C158-C161 CovalentContact SG-SG 2.03Å; C158-C161 PolarHBondContact SG-SG 2.98Å; T159-C161 VanDerWaalsContact C-N 3.32Å; T159-C161 PolarHBondContact O-N 2.83Å; C161-D163 VanDerWaalsContact C-N 3.28Å; C161-D163 PolarHBondContact O-N 2.96Å; C161-H164 PolarHBondContact O-N 3.38Å; C161-C165 VanDerWaalsContact O-CB 3.3Å; C161-C165 WeakPolarHBondContact O-CB 3.11Å; C161-C165 PolarHBondContact O-N 3.26Å; C161-C165 PolarHBondContact O-SG 2.84Å; C161-R192 HydrophobicContact CB-CG 4.34Å; C161-R192 PolarHBondContact SG-NE 3.14Å; C161-R192 PolarHBondContact SG-NH2 3.45Å
162	T	75.2	Confident	72.9	Confident	53 Å²	53	67.4 Å²	67.4	33%	0.325	37%	0.368	S	S	.	.	H	α-helix	trans	-62.2	-37.1	180	62.2	0	0	0	0	112.1	C158 T159 K166 F196	C158-T162 PolarHBondContact O-N 2.92Å; C158-T162 VanDerWaalsContact O-N 3.13Å; T159-T162 PolarHBondContact O-N 3.19Å; T159-T162 PolarHBondContact O-OG1 2.77Å; T162-K166 WeakPolarHBondContact O-CB 3.43Å; T162-K166 PolarHBondContact O-N 3.26Å; T162-F196 HydrophobicContact CG2-CZ 3.91Å
163	D	81.4	Confident	74.9	Confident	79 Å²	79	68.7 Å²	68.7	42%	0.422	38%	0.379	S	S	.	.	H	α-helix	trans	-69.2	-46.2	179.1	-71.2	-19.6	0	0	0	112.5	T159 C161 C165 K166 R167	T159-D163 PolarHBondContact O-N 3.23Å; C161-D163 VanDerWaalsContact C-N 3.28Å; C161-D163 PolarHBondContact O-N 2.96Å; D163-C165 VanDerWaalsContact C-N 3.32Å; D163-C165 PolarHBondContact O-N 2.87Å; D163-K166 PolarHBondContact O-N 3.46Å; D163-R167 WeakPolarHBondContact O-CG 3.32Å; D163-R167 PolarHBondContact O-N 2.97Å
164	H	79.2	Confident	76.9	Confident	30 Å²	30	67.9 Å²	67.9	14%	0.139	37%	0.372	C	S	.	.	H	α-helix	trans	-63.1	-41.6	177.7	-166.5	75.1	0	0	0	111.3	T160 C161 R167 W168	T160-H164 PolarHBondContact O-N 3.01Å; C161-H164 PolarHBondContact O-N 3.38Å; H164-R167 PolarHBondContact O-N 2.85Å; H164-W168 PolarHBondContact O-N 3.45Å
165	C	82.3	Confident	78.7	Confident	7 Å²	7	60.2 Å²	60.2	5%	0.047	34%	0.337	C	S	.	.	H	α-helix	trans	-68.5	-38.4	178	-65.8	0	0	0	0	113.2	C161 D163 R167 W168 S169 C193 F196	C161-C165 VanDerWaalsContact O-CB 3.3Å; C161-C165 WeakPolarHBondContact O-CB 3.11Å; C161-C165 PolarHBondContact O-N 3.26Å; C161-C165 PolarHBondContact O-SG 2.84Å; D163-C165 VanDerWaalsContact C-N 3.32Å; D163-C165 PolarHBondContact O-N 2.87Å; C165-R167 VanDerWaalsContact C-N 3.31Å; C165-R167 PolarHBondContact O-N 3.43Å; C165-W168 PolarHBondContact O-N 2.81Å; C165-S169 WeakPolarHBondContact O-CB 3.48Å; C165-S169 PolarHBondContact O-N 3.13Å; C165-C193 WeakPolarHBondContact CA-SG 3.38Å; C165-C193 HydrophobicContact CB-CB 3.67Å; C165-C193 WeakPolarHBondContact CB-SG 3.4Å; C165-C193 WeakPolarHBondContact SG-CA 3.34Å; C165-C193 WeakPolarHBondContact SG-CB 3.31Å; C165-C193 CovalentContact SG-SG 2.03Å; C165-C193 PolarHBondContact SG-SG 2.88Å; C165-F196 HydrophobicContact CB-CD2 3.99Å; C165-F196 HydrophobicContact CB-CE2 3.58Å
166	K	85.8	Confident	80.5	Confident	160 Å²	160	58.9 Å²	58.9	70%	0.696	33%	0.325	S	S	*	.	H	α-helix	trans	-61.5	-41.3	173.6	-176.3	178.5	179.8	-177.1	0	111.2	T162 D163 N170	T162-K166 WeakPolarHBondContact O-CB 3.43Å; T162-K166 PolarHBondContact O-N 3.26Å; D163-K166 PolarHBondContact O-N 3.46Å; K166-N170 WeakPolarHBondContact O-CB 3.14Å; K166-N170 PolarHBondContact O-N 3.22Å
167	R	87.1	Confident	82.4	Confident	63 Å²	63	56.3 Å²	56.3	24%	0.238	31%	0.307	C	S	.	.	H	α-helix	trans	-67.6	-47	176.7	-70.2	174.2	-169.8	163.7	1.9	112.4	D58 Q61 V62 D163 H164 C165 S169 N170 I171	D58-R167 HydrophobicContact CB-CG 4.41Å; D58-R167 IonicContact OD1-NE 2.96Å; Q61-R167 VanDerWaalsContact CB-NH1 3.27Å; V62-R167 HydrophobicContact CG2-CB 3.98Å; D163-R167 WeakPolarHBondContact O-CG 3.32Å; D163-R167 PolarHBondContact O-N 2.97Å; H164-R167 PolarHBondContact O-N 2.85Å; C165-R167 VanDerWaalsContact C-N 3.31Å; C165-R167 PolarHBondContact O-N 3.43Å; R167-S169 VanDerWaalsContact C-N 3.32Å; R167-S169 PolarHBondContact O-N 3.43Å; R167-N170 WeakPolarHBondContact O-CB 3.35Å; R167-N170 PolarHBondContact O-N 3.23Å; R167-N170 VanDerWaalsContact O-N 3.15Å; R167-I171 WeakPolarHBondContact O-CG1 3.31Å; R167-I171 PolarHBondContact O-N 2.82Å
168	W	87.8	Confident	83.9	Confident	3 Å²	3	51.5 Å²	51.5	1%	0.011	27%	0.274	C	S	.	.	H	α-helix	trans	-58.6	-46.5	175.8	-174.9	-109	0	0	0	111.3	V62 I137 L141 H164 C165 N170 I171 Q172 V180 C223	V62-W168 HydrophobicContact CG1-CE3 4.05Å; V62-W168 HydrophobicContact CG1-CZ3 4.31Å; I137-W168 HydrophobicContact CG2-CH2 3.99Å; I137-W168 HydrophobicContact CG2-CZ3 3.98Å; L141-W168 HydrophobicContact CD1-CD2 4.01Å; L141-W168 HydrophobicContact CD1-CE3 4.2Å; L141-W168 HydrophobicContact CD1-CH2 3.95Å; L141-W168 HydrophobicContact CD1-CZ2 3.74Å; L141-W168 HydrophobicContact CD1-CZ3 4.17Å; L141-W168 HydrophobicContact CD2-CD2 4.36Å; L141-W168 HydrophobicContact CD2-CG 4.36Å; H164-W168 PolarHBondContact O-N 3.45Å; C165-W168 PolarHBondContact O-N 2.81Å; W168-N170 VanDerWaalsContact C-N 3.3Å; W168-N170 PolarHBondContact O-N 3.41Å; W168-I171 HydrophobicContact CE3-CD1 4.44Å; W168-I171 WeakPolarHBondContact O-CB 3.33Å; W168-I171 PolarHBondContact O-N 3.19Å; W168-I171 VanDerWaalsContact O-N 3.09Å; W168-Q172 VanDerWaalsContact CD1-OE1 3.24Å; W168-Q172 WeakPolarHBondContact O-CG 3.44Å; W168-Q172 PolarHBondContact O-N 2.88Å; W168-V180 HydrophobicContact CH2-CG2 4.15Å; W168-V180 HydrophobicContact CZ2-CG2 4.01Å; W168-C223 HydrophobicContact CH2-CB 3.98Å; W168-C223 HydrophobicContact CZ2-CB 4.22Å
169	S	88.3	Confident	85.3	Confident	45 Å²	45	49.9 Å²	49.9	32%	0.315	26%	0.263	S	S	.	.	H	α-helix	trans	-57.6	-41.6	174.9	-174.7	0	0	0	0	112.2	C165 R167 I171 Q172 T173 S205	C165-S169 WeakPolarHBondContact O-CB 3.48Å; C165-S169 PolarHBondContact O-N 3.13Å; R167-S169 VanDerWaalsContact C-N 3.32Å; R167-S169 PolarHBondContact O-N 3.43Å; S169-I171 PolarHBondContact O-N 2.87Å; S169-Q172 PolarHBondContact O-N 3.39Å; S169-T173 PolarHBondContact O-N 2.99Å; S169-T173 PolarHBondContact O-OG1 3.42Å; S169-T173 VanDerWaalsContact O-OG1 3.1Å; S169-S205 WeakPolarHBondContact O-CB 3.45Å; S169-S205 WeakPolarHBondContact OG-CB 3.37Å; S169-S205 PolarHBondContact OG-OG 3.28Å
170	N	91.1	Very high	86.4	Confident	56 Å²	56	45.2 Å²	45.2	30%	0.299	23%	0.234	S	C	.	.	H	α-helix	trans	-63.6	-41	175.1	-166.3	24.3	0	0	0	112.4	K166 R167 W168 T173 Q174	K166-N170 WeakPolarHBondContact O-CB 3.14Å; K166-N170 PolarHBondContact O-N 3.22Å; R167-N170 WeakPolarHBondContact O-CB 3.35Å; R167-N170 PolarHBondContact O-N 3.23Å; R167-N170 VanDerWaalsContact O-N 3.15Å; W168-N170 VanDerWaalsContact C-N 3.3Å; W168-N170 PolarHBondContact O-N 3.41Å; N170-T173 PolarHBondContact O-N 3.28Å; N170-Q174 PolarHBondContact ND2-NE2 3.33Å; N170-Q174 WeakPolarHBondContact O-CB 3.32Å; N170-Q174 VanDerWaalsContact O-CG 3.26Å; N170-Q174 WeakPolarHBondContact O-CG 2.88Å; N170-Q174 PolarHBondContact O-N 3.14Å; N170-Q174 PolarHBondContact OD1-NE2 2.8Å
171	I	91.5	Very high	87.4	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.005	23%	0.232	C	C	.	.	H	α-helix	trans	-60.8	-45.8	175.4	-69.1	172.2	0	0	0	110.5	W59 V62 R167 W168 S169 T173 Q174 L175 L227	W59-I171 HydrophobicContact CG-CG1 4.39Å; V62-I171 HydrophobicContact CB-CD1 4.17Å; V62-I171 HydrophobicContact CG1-CD1 4.33Å; V62-I171 HydrophobicContact CG2-CD1 3.63Å; R167-I171 WeakPolarHBondContact O-CG1 3.31Å; R167-I171 PolarHBondContact O-N 2.82Å; W168-I171 HydrophobicContact CE3-CD1 4.44Å; W168-I171 WeakPolarHBondContact O-CB 3.33Å; W168-I171 PolarHBondContact O-N 3.19Å; W168-I171 VanDerWaalsContact O-N 3.09Å; S169-I171 PolarHBondContact O-N 2.87Å; I171-T173 PolarHBondContact O-N 2.89Å; I171-Q174 PolarHBondContact O-N 3.47Å; I171-L175 HydrophobicContact CG2-CD1 3.74Å; I171-L175 HydrophobicContact CG2-CG 4.37Å; I171-L175 WeakPolarHBondContact O-CB 3.4Å; I171-L175 PolarHBondContact O-N 3.25Å; I171-L227 HydrophobicContact CD1-CD1 4.4Å; I171-L227 HydrophobicContact CG2-CD1 4.25Å
172	Q	91.8	Very high	88.3	Confident	2 Å²	2	48.2 Å²	48.2	1%	0.009	24%	0.244	C	C	.	.	H	α-helix	trans	-58.4	-47.3	178.4	-68.6	-169.4	-95.6	0	0	111.9	W168 S169 Q176 C177 Y186 S205	W168-Q172 VanDerWaalsContact CD1-OE1 3.24Å; W168-Q172 WeakPolarHBondContact O-CG 3.44Å; W168-Q172 PolarHBondContact O-N 2.88Å; S169-Q172 PolarHBondContact O-N 3.39Å; Q172-Q176 WeakPolarHBondContact O-CA 3.29Å; Q172-Q176 PolarHBondContact O-N 2.87Å; Q172-C177 WeakPolarHBondContact CB-O 3.42Å; Q172-C177 PolarHBondContact O-N 3.44Å; Q172-C177 VanDerWaalsContact O-N 3.08Å; Q172-Y186 PolarHBondContact OE1-OH 2.91Å; Q172-Y186 VanDerWaalsContact OE1-OH 3.13Å; Q172-S205 CarbonylContact C-O 3.58Å
173	T	91.9	Very high	88.8	Confident	80 Å²	80	46.5 Å²	46.5	49%	0.491	24%	0.236	S	C	.	.	H	α-helix	trans	-63.6	-44.4	177.8	-56.9	0	0	0	0	112.1	S169 N170 I171 S205	S169-T173 PolarHBondContact O-N 2.99Å; S169-T173 PolarHBondContact O-OG1 3.42Å; S169-T173 VanDerWaalsContact O-OG1 3.1Å; N170-T173 PolarHBondContact O-N 3.28Å; I171-T173 PolarHBondContact O-N 2.89Å; T173-S205 WeakPolarHBondContact OG1-CB 3.46Å
174	Q	93.2	Very high	88.9	Confident	93 Å²	93	49.7 Å²	49.7	44%	0.435	25%	0.248	S	C	.	.	H	α-helix	trans	-74	-36.6	-175.1	-72.3	179	-9	0	0	113.1	W59 N170 I171	W59-Q174 HydrophobicContact CZ2-CB 4.49Å; W59-Q174 VanDerWaalsContact NE1-OE1 3.12Å; N170-Q174 PolarHBondContact ND2-NE2 3.33Å; N170-Q174 WeakPolarHBondContact O-CB 3.32Å; N170-Q174 VanDerWaalsContact O-CG 3.26Å; N170-Q174 WeakPolarHBondContact O-CG 2.88Å; N170-Q174 PolarHBondContact O-N 3.14Å; N170-Q174 PolarHBondContact OD1-NE2 2.8Å; I171-Q174 PolarHBondContact O-N 3.47Å
175	L	93.6	Very high	89	Confident	36 Å²	36	49.3 Å²	49.3	19%	0.188	25%	0.247	C	C	.	.	H	α-helix	trans	-93	0.8	178.6	-63.5	-178.9	0	0	0	113.2	W59 I171 C177 P226 L227	W59-L175 HydrophobicContact CH2-CD2 4.24Å; W59-L175 HydrophobicContact CZ3-CD1 4.46Å; W59-L175 HydrophobicContact CZ3-CD2 4.09Å; W59-L175 HydrophobicContact CZ3-CG 4.4Å; I171-L175 HydrophobicContact CG2-CD1 3.74Å; I171-L175 HydrophobicContact CG2-CG 4.37Å; I171-L175 WeakPolarHBondContact O-CB 3.4Å; I171-L175 PolarHBondContact O-N 3.25Å; L175-C177 VanDerWaalsContact C-N 3.32Å; L175-C177 HydrophobicContact CB-CB 4.44Å; L175-C177 VanDerWaalsContact CB-SG 3.58Å; L175-C177 PolarHBondContact O-N 3.33Å; L175-P226 HydrophobicContact CB-CB 4.33Å; L175-P226 HydrophobicContact CB-CG 4.34Å; L175-P226 HydrophobicContact CD1-CB 4.19Å; L175-P226 HydrophobicContact CD1-CG 4.31Å; L175-P226 HydrophobicContact CD2-CB 4.36Å; L175-L227 HydrophobicContact CD1-CB 3.93Å; L175-L227 HydrophobicContact CD1-CD1 4.23Å
176	Q	94.7	Very high	88.8	Confident	130 Å²	130	50.6 Å²	50.6	61%	0.607	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	52.5	-179.6	-63.4	-176.1	-11.9	0	0	111.7	Q172 H219	Q172-Q176 WeakPolarHBondContact O-CA 3.29Å; Q172-Q176 PolarHBondContact O-N 2.87Å; Q176-H219 VanDerWaalsContact C-CD2 3.48Å; Q176-H219 VanDerWaalsContact O-CB 3.3Å; Q176-H219 WeakPolarHBondContact O-CB 3.23Å; Q176-H219 PolarHBondContact O-ND1 2.89Å
177	C	94.5	Very high	88.3	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.254	C	S	.	.			trans	-134.9	157.6	-171.8	62.5	0	0	0	0	111.7	Q172 L175 S221 C223 P226	Q172-C177 WeakPolarHBondContact CB-O 3.42Å; Q172-C177 PolarHBondContact O-N 3.44Å; Q172-C177 VanDerWaalsContact O-N 3.08Å; L175-C177 VanDerWaalsContact C-N 3.32Å; L175-C177 HydrophobicContact CB-CB 4.44Å; L175-C177 VanDerWaalsContact CB-SG 3.58Å; L175-C177 PolarHBondContact O-N 3.33Å; C177-S221 CarbonylContact C-O 3.45Å; C177-S221 WeakPolarHBondContact CA-O 3.31Å; C177-S221 VanDerWaalsContact CB-O 3.25Å; C177-S221 WeakPolarHBondContact CB-O 3.24Å; C177-C223 HydrophobicContact CB-CB 3.92Å; C177-C223 WeakPolarHBondContact CB-SG 3.46Å; C177-C223 WeakPolarHBondContact SG-CA 3.39Å; C177-C223 WeakPolarHBondContact SG-CB 3.01Å; C177-C223 CovalentContact SG-SG 2.02Å; C177-C223 PolarHBondContact SG-SG 3.32Å; C177-P226 HydrophobicContact CB-CG 4.39Å
178	C	91.4	Very high	87.5	Confident	0 Å²	0	51 Å²	51	0%	0	28%	0.277	C	S	.	.			trans	-132.2	129.3	179.7	-169.7	0	0	0	0	112.7	T182 A183 C206 H219 S221 G222	C178-T182 CarbonylContact O-C 3.53Å; C178-A183 HydrophobicContact CB-CB 4.08Å; C178-A183 PolarHBondContact O-N 2.99Å; C178-A183 VanDerWaalsContact SG-CB 3.59Å; C178-C206 HydrophobicContact CB-CB 3.85Å; C178-C206 WeakPolarHBondContact CB-SG 3.47Å; C178-C206 WeakPolarHBondContact SG-CB 3.48Å; C178-C206 CovalentContact SG-SG 2Å; C178-C206 PolarHBondContact SG-SG 3.24Å; C178-H219 HydrophobicContact CB-CB 4.1Å; C178-H219 WeakPolarHBondContact CB-O 3.37Å; C178-S221 PolarHBondContact N-O 2.82Å; C178-G222 WeakPolarHBondContact O-CA 3.26Å
179	G	88.7	Confident	86.5	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.284	C	S	.	.	S	Bend	trans	67.7	-168.3	-176.2	0	0	0	0	0	112.6	T182 C223	G179-T182 WeakPolarHBondContact CA-O 3.17Å; G179-C223 VanDerWaalsContact O-CB 3.27Å; G179-C223 WeakPolarHBondContact O-CB 3.46Å; G179-C223 PolarHBondContact O-N 3.33Å; G179-C223 PolarHBondContact O-SG 2.98Å
180	V	89	Confident	85.5	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.006	29%	0.291	C	S	.	.	S	Bend	trans	-83.5	-58	-178.4	179.7	0	0	0	0	108.9	I137 L138 L141 W168 D185 G222 C223 I224	I137-V180 HydrophobicContact CG2-CG1 4.31Å; I137-V180 HydrophobicContact CG2-CG2 4.09Å; L138-V180 HydrophobicContact CD1-CB 3.92Å; L138-V180 HydrophobicContact CD1-CG1 4.26Å; L138-V180 HydrophobicContact CD1-CG2 3.82Å; L141-V180 HydrophobicContact CD1-CG2 3.7Å; W168-V180 HydrophobicContact CH2-CG2 4.15Å; W168-V180 HydrophobicContact CZ2-CG2 4.01Å; V180-D185 WeakPolarHBondContact CA-OD2 3.38Å; V180-D185 WeakPolarHBondContact CB-OD2 3.46Å; V180-D185 PolarHBondContact N-OD2 2.96Å; V180-G222 CarbonylContact O-C 3.52Å; V180-G222 WeakPolarHBondContact O-CA 3.15Å; V180-C223 PolarHBondContact O-N 2.89Å; V180-I224 HydrophobicContact CG1-CB 4.14Å; V180-I224 VanDerWaalsContact O-CB 3.31Å; V180-I224 WeakPolarHBondContact O-CB 2.95Å; V180-I224 VanDerWaalsContact O-CG2 3.23Å; V180-I224 WeakPolarHBondContact O-CG2 3.27Å; V180-I224 PolarHBondContact O-N 3Å
181	E	89.1	Confident	84.4	Confident	119 Å²	119	51.9 Å²	51.9	56%	0.556	28%	0.277	S	S	*	.	S	Bend	trans	-103.7	-39.5	174.9	-61.1	-167.3	170.5	0	0	111.7	D185 G222 I224	E181-D185 PolarHBondContact N-OD2 3.34Å; E181-G222 VanDerWaalsContact C-CA 3.42Å; E181-G222 WeakPolarHBondContact O-CA 3.35Å; E181-G222 PolarHBondContact O-N 3.42Å; E181-I224 HydrophobicContact CG-CG2 4.28Å
182	T	87.1	Confident	83.3	Confident	54 Å²	54	54.8 Å²	54.8	33%	0.331	29%	0.288	S	S	.	.			trans	-149.6	168.8	-179.8	69.3	0	0	0	0	112.3	C178 G179 E184 D185	C178-T182 CarbonylContact O-C 3.53Å; G179-T182 WeakPolarHBondContact CA-O 3.17Å; T182-E184 PolarHBondContact O-N 3.32Å; T182-E184 PolarHBondContact OG1-N 3.39Å; T182-D185 PolarHBondContact N-OD1 2.88Å; T182-D185 PolarHBondContact N-OD2 3.48Å; T182-D185 WeakPolarHBondContact O-CB 3.39Å; T182-D185 PolarHBondContact O-N 3.3Å; T182-D185 PolarHBondContact OG1-OD1 3.27Å
183	A	86.5	Confident	82.2	Confident	18 Å²	18	55.1 Å²	55.1	15%	0.149	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-25.6	172.8	0	0	0	0	0	113.2	C178 D185 Y186 L202 A218	C178-A183 HydrophobicContact CB-CB 4.08Å; C178-A183 PolarHBondContact O-N 2.99Å; C178-A183 VanDerWaalsContact SG-CB 3.59Å; A183-D185 PolarHBondContact O-N 3.42Å; A183-Y186 PolarHBondContact O-N 3.02Å; A183-L202 HydrophobicContact CB-CD1 4.13Å; A183-A218 HydrophobicContact CB-CB 4.23Å
184	E	83.5	Confident	80.9	Confident	146 Å²	146	55 Å²	55	68%	0.682	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-17.5	179.7	-61.9	176.6	-174.7	0	0	112.4	T182 Y186 D187 A188	T182-E184 PolarHBondContact O-N 3.32Å; T182-E184 PolarHBondContact OG1-N 3.39Å; E184-Y186 PolarHBondContact O-N 2.8Å; E184-Y186 VanDerWaalsContact O-N 3.09Å; E184-D187 WeakPolarHBondContact O-CB 3.41Å; E184-D187 PolarHBondContact O-N 3.47Å; E184-A188 PolarHBondContact O-N 3.13Å
185	D	80.2	Confident	79.2	Confident	21 Å²	21	55.4 Å²	55.4	11%	0.112	30%	0.296	C	S	.	.	H	α-helix	trans	-55.2	-31.8	175.6	-54.5	-5.8	0	0	0	111.1	V180 E181 T182 A183 D187 A188 I189 Y191	V180-D185 WeakPolarHBondContact CA-OD2 3.38Å; V180-D185 WeakPolarHBondContact CB-OD2 3.46Å; V180-D185 PolarHBondContact N-OD2 2.96Å; E181-D185 PolarHBondContact N-OD2 3.34Å; T182-D185 PolarHBondContact N-OD1 2.88Å; T182-D185 PolarHBondContact N-OD2 3.48Å; T182-D185 WeakPolarHBondContact O-CB 3.39Å; T182-D185 PolarHBondContact O-N 3.3Å; T182-D185 PolarHBondContact OG1-OD1 3.27Å; A183-D185 PolarHBondContact O-N 3.42Å; D185-D187 VanDerWaalsContact C-N 3.26Å; D185-D187 PolarHBondContact O-N 3.01Å; D185-A188 PolarHBondContact O-N 3.24Å; D185-I189 WeakPolarHBondContact O-CB 3.24Å; D185-I189 PolarHBondContact O-N 3.4Å; D185-Y191 HydrophobicContact CB-CE2 4.41Å; D185-Y191 WeakPolarHBondContact CB-OH 3.35Å; D185-Y191 WeakPolarHBondContact O-CE2 3.44Å
186	Y	78.5	Confident	77.5	Confident	34 Å²	34	59.6 Å²	59.6	13%	0.133	31%	0.313	C	S	.	.	H	α-helix	trans	-63.2	-25.2	175.5	-80.1	-83.7	0	0	0	114.4	Q172 A183 E184 Y191 L202 P203	Q172-Y186 PolarHBondContact OE1-OH 2.91Å; Q172-Y186 VanDerWaalsContact OE1-OH 3.13Å; A183-Y186 PolarHBondContact O-N 3.02Å; E184-Y186 PolarHBondContact O-N 2.8Å; E184-Y186 VanDerWaalsContact O-N 3.09Å; Y186-Y191 VanDerWaalsContact CA-CE2 3.46Å; Y186-Y191 AromaticContact CD1-CD2 3.28Å; Y186-Y191 HydrophobicContact CD1-CD2 3.28Å; Y186-Y191 AromaticContact CD1-CE2 3.69Å; Y186-Y191 HydrophobicContact CD1-CE2 3.69Å; Y186-Y191 AromaticContact CD1-CG 3.84Å; Y186-Y191 HydrophobicContact CD1-CG 3.84Å; Y186-Y191 HydrophobicContact CD2-CE2 4.28Å; Y186-Y191 HydrophobicContact CE1-CD1 4.16Å; Y186-Y191 AromaticContact CE1-CD2 3.6Å; Y186-Y191 HydrophobicContact CE1-CD2 3.6Å; Y186-Y191 HydrophobicContact CE1-CE2 4.06Å; Y186-Y191 AromaticContact CE1-CG 3.67Å; Y186-Y191 HydrophobicContact CE1-CG 3.67Å; Y186-Y191 AromaticContact CG-CD2 3.88Å; Y186-Y191 HydrophobicContact CG-CD2 3.88Å; Y186-Y191 AromaticContact CG-CE2 3.8Å; Y186-Y191 HydrophobicContact CG-CE2 3.8Å; Y186-L202 HydrophobicContact CD2-CD2 3.6Å; Y186-L202 HydrophobicContact CE2-CD2 4.34Å; Y186-L202 HydrophobicContact CG-CD2 3.77Å; Y186-P203 HydrophobicContact CE1-CG 4.19Å; Y186-P203 HydrophobicContact CE2-CG 4.34Å; Y186-P203 WeakPolarHBondContact OH-CG 3.02Å
187	D	75.1	Confident	75.9	Confident	144 Å²	144	54.4 Å²	54.4	77%	0.77	29%	0.29	S	S	*	.	H	α-helix	trans	-83.8	-34.6	176.1	-63.4	-28.5	0	0	0	111.1	E184 D185	E184-D187 WeakPolarHBondContact O-CB 3.41Å; E184-D187 PolarHBondContact O-N 3.47Å; D185-D187 VanDerWaalsContact C-N 3.26Å; D185-D187 PolarHBondContact O-N 3.01Å
188	A	70.9	Confident	74.2	Confident	87 Å²	87	60.5 Å²	60.5	72%	0.719	32%	0.322	S	S	*	.	H	α-helix	trans	-81.6	-28.7	-178	0	0	0	0	0	113.3	E184 D185	E184-A188 PolarHBondContact O-N 3.13Å; D185-A188 PolarHBondContact O-N 3.24Å
189	I	66.6	Low	72.4	Confident	31 Å²	31	65.7 Å²	65.7	16%	0.159	36%	0.358	C	S	.	.	S	Bend	trans	-125	129.5	-171.1	-59	175.5	0	0	0	109.9	L138 D142 D185 Y191	L138-I189 HydrophobicContact CD1-CD1 3.25Å; L138-I189 HydrophobicContact CD2-CD1 3.97Å; L138-I189 HydrophobicContact CG-CD1 3.5Å; L138-I189 VanDerWaalsContact CG-CD1 3.5Å; D142-I189 HydrophobicContact CB-CG2 3.8Å; D185-I189 WeakPolarHBondContact O-CB 3.24Å; D185-I189 PolarHBondContact O-N 3.4Å; I189-Y191 HydrophobicContact CB-CD2 4.4Å; I189-Y191 HydrophobicContact CB-CE2 3.94Å; I189-Y191 HydrophobicContact CG2-CD2 4.48Å; I189-Y191 HydrophobicContact CG2-CE2 4.29Å; I189-Y191 WeakPolarHBondContact O-CD2 3.2Å; I189-Y191 PolarHBondContact O-N 2.93Å
190	I	67.1	Low	71.3	Confident	90 Å²	90	71.6 Å²	71.6	46%	0.462	40%	0.395	S	S	.	.			trans	-72.7	103.4	171.5	-53.9	-179.7	0	0	0	107.1	K143 Q194	K143-I190 WeakPolarHBondContact CA-O 3.32Å; K143-I190 HydrophobicContact CB-CB 4.07Å; K143-I190 HydrophobicContact CB-CG2 3.74Å; K143-I190 WeakPolarHBondContact CB-O 3.46Å; K143-I190 HydrophobicContact CD-CG2 3.45Å; K143-I190 VanDerWaalsContact CD-CG2 3.45Å; K143-I190 HydrophobicContact CG-CG2 4.2Å; K143-I190 PolarHBondContact N-O 2.85Å; I190-Q194 VanDerWaalsContact CG2-OE1 3.27Å
191	Y	67.7	Low	70.6	Confident	3 Å²	3	74.2 Å²	74.2	1%	0.012	41%	0.411	C	S	.	.	B	Isolated β-bridge	trans	-73.4	140.9	179.7	-79.2	-92.7	0	0	0	111.7	L141 D185 Y186 I189 C193 Q194	L141-Y191 HydrophobicContact CB-CD1 3.77Å; L141-Y191 HydrophobicContact CB-CE1 3.69Å; L141-Y191 HydrophobicContact CD1-CD1 4.45Å; L141-Y191 HydrophobicContact CD1-CE1 3.91Å; L141-Y191 HydrophobicContact CG-CD1 4.49Å; L141-Y191 HydrophobicContact CG-CE1 4.33Å; L141-Y191 WeakPolarHBondContact O-CA 3.42Å; D185-Y191 HydrophobicContact CB-CE2 4.41Å; D185-Y191 WeakPolarHBondContact CB-OH 3.35Å; D185-Y191 WeakPolarHBondContact O-CE2 3.44Å; Y186-Y191 VanDerWaalsContact CA-CE2 3.46Å; Y186-Y191 AromaticContact CD1-CD2 3.28Å; Y186-Y191 HydrophobicContact CD1-CD2 3.28Å; Y186-Y191 AromaticContact CD1-CE2 3.69Å; Y186-Y191 HydrophobicContact CD1-CE2 3.69Å; Y186-Y191 AromaticContact CD1-CG 3.84Å; Y186-Y191 HydrophobicContact CD1-CG 3.84Å; Y186-Y191 HydrophobicContact CD2-CE2 4.28Å; Y186-Y191 HydrophobicContact CE1-CD1 4.16Å; Y186-Y191 AromaticContact CE1-CD2 3.6Å; Y186-Y191 HydrophobicContact CE1-CD2 3.6Å; Y186-Y191 HydrophobicContact CE1-CE2 4.06Å; Y186-Y191 AromaticContact CE1-CG 3.67Å; Y186-Y191 HydrophobicContact CE1-CG 3.67Å; Y186-Y191 AromaticContact CG-CD2 3.88Å; Y186-Y191 HydrophobicContact CG-CD2 3.88Å; Y186-Y191 AromaticContact CG-CE2 3.8Å; Y186-Y191 HydrophobicContact CG-CE2 3.8Å; I189-Y191 HydrophobicContact CB-CD2 4.4Å; I189-Y191 HydrophobicContact CB-CE2 3.94Å; I189-Y191 HydrophobicContact CG2-CD2 4.48Å; I189-Y191 HydrophobicContact CG2-CE2 4.29Å; I189-Y191 WeakPolarHBondContact O-CD2 3.2Å; I189-Y191 PolarHBondContact O-N 2.93Å; Y191-C193 PolarHBondContact O-N 3.44Å; Y191-Q194 WeakPolarHBondContact O-CB 3.25Å; Y191-Q194 PolarHBondContact O-N 3.39Å
192	R	67.5	Low	70.3	Confident	61 Å²	61	69.5 Å²	69.5	23%	0.23	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-25.4	168.1	-169.1	173.5	-176.7	170.5	-1.1	112.5	L141 C161 P195	L141-R192 PolarHBondContact O-N 3.03Å; C161-R192 HydrophobicContact CB-CG 4.34Å; C161-R192 PolarHBondContact SG-NE 3.14Å; C161-R192 PolarHBondContact SG-NH2 3.45Å; R192-P195 VanDerWaalsContact O-CD 3.31Å; R192-P195 WeakPolarHBondContact O-CD 3.38Å
193	C	68.6	Low	70.2	Confident	10 Å²	10	67.6 Å²	67.6	7%	0.068	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	6	-179.4	-52.4	0	0	0	0	114.7	C165 Y191 P195 F196	C165-C193 WeakPolarHBondContact CA-SG 3.38Å; C165-C193 HydrophobicContact CB-CB 3.67Å; C165-C193 WeakPolarHBondContact CB-SG 3.4Å; C165-C193 WeakPolarHBondContact SG-CA 3.34Å; C165-C193 WeakPolarHBondContact SG-CB 3.31Å; C165-C193 CovalentContact SG-SG 2.03Å; C165-C193 PolarHBondContact SG-SG 2.88Å; Y191-C193 PolarHBondContact O-N 3.44Å; C193-P195 VanDerWaalsContact C-N 3.29Å; C193-F196 HydrophobicContact CB-CD2 4.36Å; C193-F196 WeakPolarHBondContact O-CD2 3.26Å; C193-F196 PolarHBondContact O-N 3.32Å; C193-F196 VanDerWaalsContact O-N 3.14Å
194	Q	64.5	Low	70.2	Confident	77 Å²	77	71.8 Å²	71.8	36%	0.36	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-57.6	-28	175.8	-163.5	-179	13.8	0	0	115.1	I190 Y191 F196 V197	I190-Q194 VanDerWaalsContact CG2-OE1 3.27Å; Y191-Q194 WeakPolarHBondContact O-CB 3.25Å; Y191-Q194 PolarHBondContact O-N 3.39Å; Q194-F196 PolarHBondContact O-N 2.84Å; Q194-V197 CarbonylContact O-C 3.57Å; Q194-V197 WeakPolarHBondContact O-CA 3.23Å; Q194-V197 WeakPolarHBondContact O-CB 3.49Å; Q194-V197 PolarHBondContact O-N 3.16Å
195	P	59.4	Low	70.4	Confident	102 Å²	102	65.1 Å²	65.1	66%	0.662	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-58.1	-15.3	174.5	-24.6	34.4	0	0	0	114.5	R192 C193 V197	R192-P195 VanDerWaalsContact O-CD 3.31Å; R192-P195 WeakPolarHBondContact O-CD 3.38Å; C193-P195 VanDerWaalsContact C-N 3.29Å; P195-V197 VanDerWaalsContact C-N 3.35Å
196	F	57.8	Low	70.9	Confident	124 Å²	124	64.1 Å²	64.1	54%	0.544	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-92.6	6.3	175.5	-58.5	-74.6	0	0	0	113.4	T162 C165 C193 Q194	T162-F196 HydrophobicContact CG2-CZ 3.91Å; C165-F196 HydrophobicContact CB-CD2 3.99Å; C165-F196 HydrophobicContact CB-CE2 3.58Å; C193-F196 HydrophobicContact CB-CD2 4.36Å; C193-F196 WeakPolarHBondContact O-CD2 3.26Å; C193-F196 PolarHBondContact O-N 3.32Å; C193-F196 VanDerWaalsContact O-N 3.14Å; Q194-F196 PolarHBondContact O-N 2.84Å
197	V	59.7	Low	71.4	Confident	21 Å²	21	63 Å²	63	13%	0.127	36%	0.358	C	S	.	.	S	Bend	trans	-140.4	121.7	-164.2	-172.1	0	0	0	0	109.5	Q194 P195 T201 P203	Q194-V197 CarbonylContact O-C 3.57Å; Q194-V197 WeakPolarHBondContact O-CA 3.23Å; Q194-V197 WeakPolarHBondContact O-CB 3.49Å; Q194-V197 PolarHBondContact O-N 3.16Å; P195-V197 VanDerWaalsContact C-N 3.35Å; V197-T201 WeakPolarHBondContact CG1-O 3.39Å; V197-P203 HydrophobicContact CG2-CB 3.96Å; V197-P203 HydrophobicContact CG2-CG 4.44Å
198	N	58.6	Low	71.8	Confident	127 Å²	127	61.1 Å²	61.1	68%	0.679	35%	0.352	S	S	*	.			trans	-73.6	139.9	165.8	-78	-14.3	0	0	0	108.1	T200 T201	N198-T200 PolarHBondContact O-N 2.72Å; N198-T201 WeakPolarHBondContact CB-OG1 3.16Å; N198-T201 PolarHBondContact N-OG1 3.35Å; N198-T201 PolarHBondContact O-N 3.19Å; N198-T201 VanDerWaalsContact O-O 3.13Å; N198-T201 PolarHBondContact O-OG1 3.2Å
199	S	55	Low	72.2	Confident	109 Å²	109	66 Å²	66	76%	0.762	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-12.7	-171.6	54.6	0	0	0	0	116.8
200	T	64	Low	72.6	Confident	125 Å²	125	71.9 Å²	71.9	77%	0.767	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.2	-1.7	176.5	52.9	0	0	0	0	114	N198	N198-T200 PolarHBondContact O-N 2.72Å
201	T	75.3	Confident	72.8	Confident	56 Å²	56	76.3 Å²	76.3	34%	0.344	40%	0.397	S	S	.	.	S	Bend	trans	-125.1	150.4	-171.6	52.9	0	0	0	0	109.7	V197 N198 C213	V197-T201 WeakPolarHBondContact CG1-O 3.39Å; N198-T201 WeakPolarHBondContact CB-OG1 3.16Å; N198-T201 PolarHBondContact N-OG1 3.35Å; N198-T201 PolarHBondContact O-N 3.19Å; N198-T201 VanDerWaalsContact O-O 3.13Å; N198-T201 PolarHBondContact O-OG1 3.2Å; T201-C213 WeakPolarHBondContact CA-O 3.38Å
202	L	83.4	Confident	73.3	Confident	19 Å²	19	83.7 Å²	83.7	10%	0.099	43%	0.432	C	S	.	.			trans	-91.3	160.1	170.1	-74.3	163.7	0	0	0	108.8	A183 Y186 C206 C213 A218	A183-L202 HydrophobicContact CB-CD1 4.13Å; Y186-L202 HydrophobicContact CD2-CD2 3.6Å; Y186-L202 HydrophobicContact CE2-CD2 4.34Å; Y186-L202 HydrophobicContact CG-CD2 3.77Å; L202-C206 HydrophobicContact CB-CB 4.21Å; L202-C213 HydrophobicContact CB-CB 4.4Å; L202-C213 WeakPolarHBondContact CB-SG 3.34Å; L202-C213 PolarHBondContact N-O 3.17Å; L202-C213 WeakPolarHBondContact O-CB 3.27Å; L202-A218 HydrophobicContact CD1-CB 3.69Å
203	P	84.1	Confident	74	Confident	14 Å²	14	81.1 Å²	81.1	9%	0.091	42%	0.423	C	S	.	.			trans	-62	146.2	176.2	25.3	-33.3	0	0	0	110.7	Y186 V197 S205 C206 C213	Y186-P203 HydrophobicContact CE1-CG 4.19Å; Y186-P203 HydrophobicContact CE2-CG 4.34Å; Y186-P203 WeakPolarHBondContact OH-CG 3.02Å; V197-P203 HydrophobicContact CG2-CB 3.96Å; V197-P203 HydrophobicContact CG2-CG 4.44Å; P203-S205 PolarHBondContact O-N 3.17Å; P203-C206 HydrophobicContact CG-CB 4.03Å; P203-C206 WeakPolarHBondContact O-CB 3.45Å; P203-C206 PolarHBondContact O-N 2.84Å; P203-C213 PolarHBondContact O-SG 3.06Å
204	I	86	Confident	74.7	Confident	106 Å²	106	83.7 Å²	83.7	54%	0.544	44%	0.436	S	S	.	.	G	3₁₀ helix	trans	-54.1	-34.4	-177	-67.1	167.3	0	0	0	112.5	C206 C207 E210	I204-C206 PolarHBondContact O-N 3.48Å; I204-C207 PolarHBondContact O-N 2.81Å; I204-E210 HydrophobicContact CG2-CB 4.21Å; I204-E210 HydrophobicContact CG2-CG 3.94Å
205	S	89.1	Confident	75.5	Confident	6 Å²	6	83.6 Å²	83.6	4%	0.042	45%	0.449	C	S	.	.	G	3₁₀ helix	trans	-65.9	-15.9	177	50.9	0	0	0	0	115.3	S169 Q172 T173 P203 C207	S169-S205 WeakPolarHBondContact O-CB 3.45Å; S169-S205 WeakPolarHBondContact OG-CB 3.37Å; S169-S205 PolarHBondContact OG-OG 3.28Å; Q172-S205 CarbonylContact C-O 3.58Å; T173-S205 WeakPolarHBondContact OG1-CB 3.46Å; P203-S205 PolarHBondContact O-N 3.17Å; S205-C207 VanDerWaalsContact C-N 3.32Å
206	C	89.4	Confident	76.8	Confident	0 Å²	0	85.8 Å²	85.8	0%	0	46%	0.455	C	S	.	.	G	3₁₀ helix	trans	-79.9	-15.1	173	167.1	0	0	0	0	112.3	C178 L202 P203 I204 A218 H219	C178-C206 HydrophobicContact CB-CB 3.85Å; C178-C206 WeakPolarHBondContact CB-SG 3.47Å; C178-C206 WeakPolarHBondContact SG-CB 3.48Å; C178-C206 CovalentContact SG-SG 2Å; C178-C206 PolarHBondContact SG-SG 3.24Å; L202-C206 HydrophobicContact CB-CB 4.21Å; P203-C206 HydrophobicContact CG-CB 4.03Å; P203-C206 WeakPolarHBondContact O-CB 3.45Å; P203-C206 PolarHBondContact O-N 2.84Å; I204-C206 PolarHBondContact O-N 3.48Å; C206-A218 CarbonylContact O-C 3.4Å; C206-A218 WeakPolarHBondContact O-CA 3.24Å; C206-A218 WeakPolarHBondContact SG-CB 3.44Å; C206-H219 VanDerWaalsContact C-CD2 3.46Å; C206-H219 PolarHBondContact O-CD2 3.37Å; C206-H219 PolarHBondContact O-N 3.2Å
207	C	88.6	Confident	78.2	Confident	12 Å²	12	82.2 Å²	82.2	8%	0.081	44%	0.443	C	S	.	.	B	Isolated β-bridge	trans	-117.4	149.6	-172.8	-71.9	0	0	0	0	112.9	I204 S205 R209 C213 V217	I204-C207 PolarHBondContact O-N 2.81Å; S205-C207 VanDerWaalsContact C-N 3.32Å; C207-R209 VanDerWaalsContact C-N 3.27Å; C207-R209 PolarHBondContact O-N 3.02Å; C207-C213 HydrophobicContact CB-CB 3.7Å; C207-C213 WeakPolarHBondContact CB-SG 3.24Å; C207-C213 WeakPolarHBondContact SG-CA 3.37Å; C207-C213 WeakPolarHBondContact SG-CB 3.38Å; C207-C213 CovalentContact SG-SG 2.02Å; C207-C213 PolarHBondContact SG-SG 2.84Å; C207-V217 HydrophobicContact CB-CG1 4.38Å
208	T	84.2	Confident	79.6	Confident	104 Å²	104	81.7 Å²	81.7	64%	0.638	44%	0.441	S	S	*	.	S	Bend	trans	-72.4	-19.8	173.2	36	0	0	0	0	113.4
209	R	80.4	Confident	81.2	Confident	189 Å²	189	76.9 Å²	76.9	71%	0.713	41%	0.414	S	S	*	.	S	Bend	trans	-126.6	134.8	-179.7	-63.8	-176.3	-175.9	174.5	1.7	110.5	C207 Q211 V217	C207-R209 VanDerWaalsContact C-N 3.27Å; C207-R209 PolarHBondContact O-N 3.02Å; R209-Q211 PolarHBondContact O-N 3.27Å; R209-V217 HydrophobicContact CB-CG1 4.35Å
210	E	73.7	Confident	82.8	Confident	155 Å²	155	83.5 Å²	83.5	72%	0.724	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-27.5	-173.4	-63.2	-179.4	164.2	0	0	114.4	I204 Q212	I204-E210 HydrophobicContact CG2-CB 4.21Å; I204-E210 HydrophobicContact CG2-CG 3.94Å; E210-Q212 PolarHBondContact O-N 3.27Å
211	Q	72.1	Confident	84.2	Confident	183 Å²	183	80.5 Å²	80.5	86%	0.855	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-20	-160.9	-69.9	177.6	-13.3	0	0	115.2	R209	R209-Q211 PolarHBondContact O-N 3.27Å
212	Q	77.3	Confident	85	Confident	158 Å²	158	78.2 Å²	78.2	74%	0.738	40%	0.395	S	S	*	.			trans	-160.5	92.8	179.2	-94.8	142.6	18.2	0	0	109.8	E210 N214	E210-Q212 PolarHBondContact O-N 3.27Å; Q212-N214 PolarHBondContact O-N 2.98Å
213	C	82.2	Confident	85.4	Confident	7 Å²	7	77.3 Å²	77.3	5%	0.047	39%	0.39	C	S	.	.			trans	-90.4	105.7	180	-168.2	0	0	0	0	111.1	T201 L202 P203 C207	T201-C213 WeakPolarHBondContact CA-O 3.38Å; L202-C213 HydrophobicContact CB-CB 4.4Å; L202-C213 WeakPolarHBondContact CB-SG 3.34Å; L202-C213 PolarHBondContact N-O 3.17Å; L202-C213 WeakPolarHBondContact O-CB 3.27Å; P203-C213 PolarHBondContact O-SG 3.06Å; C207-C213 HydrophobicContact CB-CB 3.7Å; C207-C213 WeakPolarHBondContact CB-SG 3.24Å; C207-C213 WeakPolarHBondContact SG-CA 3.37Å; C207-C213 WeakPolarHBondContact SG-CB 3.38Å; C207-C213 CovalentContact SG-SG 2.02Å; C207-C213 PolarHBondContact SG-SG 2.84Å
214	N	84.6	Confident	85.7	Confident	63 Å²	63	77.3 Å²	77.3	34%	0.337	39%	0.389	S	S	.	.			trans	-127.8	170.7	175.5	65.9	14.3	0	0	0	110.2	Q212 N216 V217 A218	Q212-N214 PolarHBondContact O-N 2.98Å; N214-N216 PolarHBondContact O-N 3.2Å; N214-N216 WeakPolarHBondContact OD1-CB 3.31Å; N214-N216 PolarHBondContact OD1-N 3.07Å; N214-N216 VanDerWaalsContact OD1-N 3.13Å; N214-V217 PolarHBondContact O-N 3.22Å; N214-V217 VanDerWaalsContact O-N 3.08Å; N214-V217 WeakPolarHBondContact OD1-CG2 3.46Å; N214-V217 PolarHBondContact OD1-N 3.31Å; N214-A218 WeakPolarHBondContact O-CB 3.43Å; N214-A218 PolarHBondContact O-N 3.41Å
215	A	81.5	Confident	85.9	Confident	76 Å²	76	82.1 Å²	82.1	63%	0.628	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-23.6	179.6	0	0	0	0	0	114.1
216	N	85	Confident	86.1	Confident	147 Å²	147	83.4 Å²	83.4	79%	0.786	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-29.3	179.7	-63.1	-31.8	0	0	0	113.5	N214	N214-N216 PolarHBondContact O-N 3.2Å; N214-N216 WeakPolarHBondContact OD1-CB 3.31Å; N214-N216 PolarHBondContact OD1-N 3.07Å; N214-N216 VanDerWaalsContact OD1-N 3.13Å
217	V	87.9	Confident	86.2	Confident	49 Å²	49	83.4 Å²	83.4	30%	0.297	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-11.2	-178.7	-176.3	0	0	0	0	111.7	C207 R209 N214	C207-V217 HydrophobicContact CB-CG1 4.38Å; R209-V217 HydrophobicContact CB-CG1 4.35Å; N214-V217 PolarHBondContact O-N 3.22Å; N214-V217 VanDerWaalsContact O-N 3.08Å; N214-V217 WeakPolarHBondContact OD1-CG2 3.46Å; N214-V217 PolarHBondContact OD1-N 3.31Å
218	A	89.8	Confident	86.2	Confident	11 Å²	11	84.2 Å²	84.2	9%	0.091	41%	0.412	C	S	.	.	B	Isolated β-bridge	trans	-60.8	152	175.2	0	0	0	0	0	112.9	A183 L202 C206 N214 R220	A183-A218 HydrophobicContact CB-CB 4.23Å; L202-A218 HydrophobicContact CD1-CB 3.69Å; C206-A218 CarbonylContact O-C 3.4Å; C206-A218 WeakPolarHBondContact O-CA 3.24Å; C206-A218 WeakPolarHBondContact SG-CB 3.44Å; N214-A218 WeakPolarHBondContact O-CB 3.43Å; N214-A218 PolarHBondContact O-N 3.41Å; A218-R220 PolarHBondContact O-N 3.35Å
219	H	91.2	Very high	86.5	Confident	25 Å²	25	84.9 Å²	84.9	12%	0.116	41%	0.408	C	S	.	.			trans	-59.9	127.6	166.5	-67	-65.9	0	0	0	110.1	Q176 C178 C206 S221	Q176-H219 VanDerWaalsContact C-CD2 3.48Å; Q176-H219 VanDerWaalsContact O-CB 3.3Å; Q176-H219 WeakPolarHBondContact O-CB 3.23Å; Q176-H219 PolarHBondContact O-ND1 2.89Å; C178-H219 HydrophobicContact CB-CB 4.1Å; C178-H219 WeakPolarHBondContact CB-O 3.37Å; C206-H219 VanDerWaalsContact C-CD2 3.46Å; C206-H219 PolarHBondContact O-CD2 3.37Å; C206-H219 PolarHBondContact O-N 3.2Å; H219-S221 VanDerWaalsContact C-N 3.31Å; H219-S221 PolarHBondContact O-N 3.42Å
220	R	89.3	Confident	87	Confident	248 Å²	248	77.3 Å²	77.3	94%	0.936	38%	0.379	S	S	*	.	S	Bend	trans	-73.6	-21.2	-176.7	-66.9	-172.8	178.2	-173.8	-1.6	113.9	A218	A218-R220 PolarHBondContact O-N 3.35Å
221	S	92.1	Very high	87.6	Confident	62 Å²	62	70 Å²	70	43%	0.434	35%	0.345	S	S	.	.	S	Bend	trans	-95.4	134.5	-178.3	47.4	0	0	0	0	111.5	C177 C178 H219	C177-S221 CarbonylContact C-O 3.45Å; C177-S221 WeakPolarHBondContact CA-O 3.31Å; C177-S221 VanDerWaalsContact CB-O 3.25Å; C177-S221 WeakPolarHBondContact CB-O 3.24Å; C178-S221 PolarHBondContact N-O 2.82Å; H219-S221 VanDerWaalsContact C-N 3.31Å; H219-S221 PolarHBondContact O-N 3.42Å
222	G	92.2	Very high	88.4	Confident	9 Å²	9	63.9 Å²	63.9	9%	0.093	32%	0.318	C	S	.	.			trans	-64	157.4	165.9	0	0	0	0	0	113.5	C178 V180 E181 P226	C178-G222 WeakPolarHBondContact O-CA 3.26Å; V180-G222 CarbonylContact O-C 3.52Å; V180-G222 WeakPolarHBondContact O-CA 3.15Å; E181-G222 VanDerWaalsContact C-CA 3.42Å; E181-G222 WeakPolarHBondContact O-CA 3.35Å; E181-G222 PolarHBondContact O-N 3.42Å; G222-P226 VanDerWaalsContact O-CD 3.24Å; G222-P226 WeakPolarHBondContact O-CD 3.49Å
223	C	92.7	Very high	89	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	31%	0.308	C	S	.	.	S	Bend	trans	-77.8	-20.3	-178.1	-64.8	0	0	0	0	114.3	W168 C177 G179 V180 R225 P226 L227	W168-C223 HydrophobicContact CH2-CB 3.98Å; W168-C223 HydrophobicContact CZ2-CB 4.22Å; C177-C223 HydrophobicContact CB-CB 3.92Å; C177-C223 WeakPolarHBondContact CB-SG 3.46Å; C177-C223 WeakPolarHBondContact SG-CA 3.39Å; C177-C223 WeakPolarHBondContact SG-CB 3.01Å; C177-C223 CovalentContact SG-SG 2.02Å; C177-C223 PolarHBondContact SG-SG 3.32Å; G179-C223 VanDerWaalsContact O-CB 3.27Å; G179-C223 WeakPolarHBondContact O-CB 3.46Å; G179-C223 PolarHBondContact O-N 3.33Å; G179-C223 PolarHBondContact O-SG 2.98Å; V180-C223 PolarHBondContact O-N 2.89Å; C223-R225 PolarHBondContact O-N 3.38Å; C223-P226 VanDerWaalsContact O-CD 3.31Å; C223-P226 WeakPolarHBondContact O-CD 3.31Å; C223-P226 WeakPolarHBondContact O-CG 3.47Å; C223-L227 WeakPolarHBondContact O-CB 3.3Å; C223-L227 PolarHBondContact O-N 3.32Å
224	I	90.5	Very high	89.2	Confident	14 Å²	14	64.6 Å²	64.6	7%	0.072	32%	0.32	C	S	.	.	H	α-helix	trans	-62.9	-46.1	-171	-169.9	59.7	0	0	0	113.1	I137 V180 E181 L227 L228	I137-I224 HydrophobicContact CD1-CD1 3.53Å; V180-I224 HydrophobicContact CG1-CB 4.14Å; V180-I224 VanDerWaalsContact O-CB 3.31Å; V180-I224 WeakPolarHBondContact O-CB 2.95Å; V180-I224 VanDerWaalsContact O-CG2 3.23Å; V180-I224 WeakPolarHBondContact O-CG2 3.27Å; V180-I224 PolarHBondContact O-N 3Å; E181-I224 HydrophobicContact CG-CG2 4.28Å; I224-L227 PolarHBondContact O-N 3Å; I224-L228 HydrophobicContact CD1-CD1 4.19Å; I224-L228 HydrophobicContact CD1-CG 4.17Å; I224-L228 HydrophobicContact CG1-CD1 4.01Å; I224-L228 HydrophobicContact CG1-CG 4.39Å; I224-L228 VanDerWaalsContact O-CB 3.31Å; I224-L228 WeakPolarHBondContact O-CB 3.35Å; I224-L228 VanDerWaalsContact O-CG 3.24Å; I224-L228 WeakPolarHBondContact O-CG 3.23Å; I224-L228 PolarHBondContact O-N 3.43Å
225	R	91	Very high	89.2	Confident	207 Å²	207	62.7 Å²	62.7	78%	0.781	31%	0.308	S	S	*	.	H	α-helix	trans	-64.4	-54.4	-179.5	-69.1	-174.4	179.4	-174.4	1.5	112.6	C223 L227 L228 Q229	C223-R225 PolarHBondContact O-N 3.38Å; R225-L227 VanDerWaalsContact C-N 3.27Å; R225-L227 PolarHBondContact O-N 3.5Å; R225-L228 PolarHBondContact O-N 2.98Å; R225-Q229 WeakPolarHBondContact O-CB 3.07Å; R225-Q229 PolarHBondContact O-N 3.19Å
226	P	92.8	Very high	89.4	Confident	32 Å²	32	62.8 Å²	62.8	21%	0.208	30%	0.298	C	S	.	.	H	α-helix	trans	-64.4	-33.1	178	25.1	-33.8	0	0	0	112	L175 C177 G222 C223 Q229 W230	L175-P226 HydrophobicContact CB-CB 4.33Å; L175-P226 HydrophobicContact CB-CG 4.34Å; L175-P226 HydrophobicContact CD1-CB 4.19Å; L175-P226 HydrophobicContact CD1-CG 4.31Å; L175-P226 HydrophobicContact CD2-CB 4.36Å; C177-P226 HydrophobicContact CB-CG 4.39Å; G222-P226 VanDerWaalsContact O-CD 3.24Å; G222-P226 WeakPolarHBondContact O-CD 3.49Å; C223-P226 VanDerWaalsContact O-CD 3.31Å; C223-P226 WeakPolarHBondContact O-CD 3.31Å; C223-P226 WeakPolarHBondContact O-CG 3.47Å; P226-Q229 PolarHBondContact O-N 3.25Å; P226-W230 VanDerWaalsContact O-CB 3.31Å; P226-W230 WeakPolarHBondContact O-CB 3.33Å; P226-W230 PolarHBondContact O-N 3.09Å
227	L	91	Very high	89.3	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-65.4	-46.2	176	-177.9	63.4	0	0	0	111.6	W59 F63 I137 I171 L175 C223 I224 R225 W230 M231	W59-L227 HydrophobicContact CE3-CD1 4.15Å; F63-L227 HydrophobicContact CE2-CD1 4.39Å; F63-L227 HydrophobicContact CE2-CD2 4.22Å; F63-L227 HydrophobicContact CE2-CG 4.28Å; F63-L227 HydrophobicContact CZ-CD2 3.81Å; F63-L227 HydrophobicContact CZ-CG 3.95Å; I137-L227 HydrophobicContact CD1-CD2 4.11Å; I171-L227 HydrophobicContact CD1-CD1 4.4Å; I171-L227 HydrophobicContact CG2-CD1 4.25Å; L175-L227 HydrophobicContact CD1-CB 3.93Å; L175-L227 HydrophobicContact CD1-CD1 4.23Å; C223-L227 WeakPolarHBondContact O-CB 3.3Å; C223-L227 PolarHBondContact O-N 3.32Å; I224-L227 PolarHBondContact O-N 3Å; R225-L227 VanDerWaalsContact C-N 3.27Å; R225-L227 PolarHBondContact O-N 3.5Å; L227-W230 PolarHBondContact O-N 3.33Å; L227-M231 VanDerWaalsContact O-CB 3.31Å; L227-M231 WeakPolarHBondContact O-CB 3.47Å; L227-M231 PolarHBondContact O-N 2.86Å
228	L	89.1	Confident	89	Confident	29 Å²	29	62.1 Å²	62.1	15%	0.152	29%	0.289	C	S	.	.	H	α-helix	trans	-63.2	-41.3	175.6	-77.5	177.9	0	0	0	112.1	V130 S133 I224 R225 M231 N232	V130-L228 HydrophobicContact CB-CD2 4.35Å; V130-L228 HydrophobicContact CG1-CD1 4.18Å; V130-L228 HydrophobicContact CG1-CD2 3.88Å; V130-L228 HydrophobicContact CG2-CD2 4.31Å; S133-L228 WeakPolarHBondContact OG-CD2 3.42Å; I224-L228 HydrophobicContact CD1-CD1 4.19Å; I224-L228 HydrophobicContact CD1-CG 4.17Å; I224-L228 HydrophobicContact CG1-CD1 4.01Å; I224-L228 HydrophobicContact CG1-CG 4.39Å; I224-L228 VanDerWaalsContact O-CB 3.31Å; I224-L228 WeakPolarHBondContact O-CB 3.35Å; I224-L228 VanDerWaalsContact O-CG 3.24Å; I224-L228 WeakPolarHBondContact O-CG 3.23Å; I224-L228 PolarHBondContact O-N 3.43Å; R225-L228 PolarHBondContact O-N 2.98Å; L228-M231 HydrophobicContact CD2-CE 3.54Å; L228-M231 PolarHBondContact O-N 2.72Å; L228-N232 WeakPolarHBondContact O-CB 3.31Å; L228-N232 PolarHBondContact O-N 3.43Å
229	Q	90.5	Very high	88.6	Confident	119 Å²	119	63.4 Å²	63.4	56%	0.556	30%	0.295	S	S	*	.	H	α-helix	trans	-62.7	-46.2	176	-177.2	176.7	-4.3	0	0	111.3	R225 P226 M231 N232 Q233	R225-Q229 WeakPolarHBondContact O-CB 3.07Å; R225-Q229 PolarHBondContact O-N 3.19Å; P226-Q229 PolarHBondContact O-N 3.25Å; Q229-M231 VanDerWaalsContact C-N 3.32Å; Q229-M231 PolarHBondContact O-N 3.26Å; Q229-N232 PolarHBondContact O-N 3.2Å; Q229-Q233 WeakPolarHBondContact O-CG 3.43Å; Q229-Q233 PolarHBondContact O-N 3.4Å
230	W	90	Very high	88.3	Confident	29 Å²	29	65.1 Å²	65.1	11%	0.11	30%	0.304	C	S	.	.	H	α-helix	trans	-59.2	-45.5	174.6	174.7	94.3	0	0	0	111.4	L57 W59 P226 L227 N232 Q233 K234	L57-W230 HydrophobicContact CD2-CH2 4.03Å; L57-W230 HydrophobicContact CD2-CZ2 4.05Å; W59-W230 HydrophobicContact CB-CH2 3.64Å; W59-W230 HydrophobicContact CB-CZ2 4.39Å; W59-W230 HydrophobicContact CB-CZ3 3.82Å; W59-W230 HydrophobicContact CD2-CD2 4.27Å; W59-W230 AromaticContact CD2-CE2 3.86Å; W59-W230 HydrophobicContact CD2-CE3 4.34Å; W59-W230 AromaticContact CD2-CH2 3.7Å; W59-W230 HydrophobicContact CD2-CH2 3.7Å; W59-W230 AromaticContact CD2-CZ2 3.56Å; W59-W230 HydrophobicContact CD2-CZ2 3.56Å; W59-W230 HydrophobicContact CD2-CZ3 4.09Å; W59-W230 AromaticContact CE3-CD2 3.19Å; W59-W230 HydrophobicContact CE3-CD2 3.19Å; W59-W230 AromaticContact CE3-CE2 3.14Å; W59-W230 AromaticContact CE3-CE3 3.35Å; W59-W230 HydrophobicContact CE3-CE3 3.35Å; W59-W230 AromaticContact CE3-CG 3.85Å; W59-W230 HydrophobicContact CE3-CG 3.85Å; W59-W230 AromaticContact CE3-CH2 3.52Å; W59-W230 HydrophobicContact CE3-CH2 3.52Å; W59-W230 AromaticContact CE3-CZ2 3.32Å; W59-W230 HydrophobicContact CE3-CZ2 3.32Å; W59-W230 AromaticContact CE3-CZ3 3.53Å; W59-W230 HydrophobicContact CE3-CZ3 3.53Å; W59-W230 AromaticContact CE3-NE1 3.71Å; W59-W230 AromaticContact CG-CH2 3.88Å; W59-W230 HydrophobicContact CG-CH2 3.88Å; W59-W230 HydrophobicContact CG-CZ2 4.14Å; W59-W230 HydrophobicContact CG-CZ3 4.32Å; W59-W230 AromaticContact CH2-CD1 3.57Å; W59-W230 HydrophobicContact CH2-CD2 4.09Å; W59-W230 AromaticContact CH2-CE2 3.61Å; W59-W230 HydrophobicContact CH2-CG 4.07Å; W59-W230 HydrophobicContact CH2-CZ2 4.16Å; W59-W230 AromaticContact CH2-NE1 3.22Å; W59-W230 HydrophobicContact CZ2-CZ2 4.33Å; W59-W230 HydrophobicContact CZ3-CB 4.1Å; W59-W230 AromaticContact CZ3-CD1 3.23Å; W59-W230 AromaticContact CZ3-CD2 3.13Å; W59-W230 HydrophobicContact CZ3-CD2 3.13Å; W59-W230 AromaticContact CZ3-CE2 3.06Å; W59-W230 AromaticContact CZ3-CE3 3.8Å; W59-W230 HydrophobicContact CZ3-CE3 3.8Å; W59-W230 AromaticContact CZ3-CG 3.25Å; W59-W230 HydrophobicContact CZ3-CG 3.25Å; W59-W230 HydrophobicContact CZ3-CH2 4.32Å; W59-W230 AromaticContact CZ3-CZ2 3.71Å; W59-W230 HydrophobicContact CZ3-CZ2 3.71Å; W59-W230 HydrophobicContact CZ3-CZ3 4.35Å; W59-W230 AromaticContact CZ3-NE1 3.08Å; P226-W230 VanDerWaalsContact O-CB 3.31Å; P226-W230 WeakPolarHBondContact O-CB 3.33Å; P226-W230 PolarHBondContact O-N 3.09Å; L227-W230 PolarHBondContact O-N 3.33Å; W230-N232 VanDerWaalsContact C-N 3.34Å; W230-N232 PolarHBondContact O-N 3.32Å; W230-Q233 PolarHBondContact O-N 3.43Å; W230-K234 HydrophobicContact CD2-CG 3.82Å; W230-K234 HydrophobicContact CE3-CG 4.29Å; W230-K234 HydrophobicContact CG-CG 4.32Å; W230-K234 HydrophobicContact CH2-CG 4.19Å; W230-K234 HydrophobicContact CZ2-CD 4.18Å; W230-K234 HydrophobicContact CZ2-CG 3.73Å; W230-K234 HydrophobicContact CZ3-CG 4.45Å; W230-K234 WeakPolarHBondContact O-CB 3.43Å; W230-K234 VanDerWaalsContact O-CG 3.24Å; W230-K234 WeakPolarHBondContact O-CG 3.31Å; W230-K234 PolarHBondContact O-N 3.33Å
231	M	87.3	Confident	88.2	Confident	1 Å²	1	57.7 Å²	57.7	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-62.7	-42.5	-178.8	-165	-176.5	54.3	0	0	111.2	F63 W126 F129 V130 L227 L228 Q229 K234 K235	F63-M231 HydrophobicContact CD2-SD 4.3Å; F63-M231 HydrophobicContact CE1-CE 4.45Å; F63-M231 HydrophobicContact CE1-SD 4Å; F63-M231 HydrophobicContact CE2-SD 3.74Å; F63-M231 HydrophobicContact CZ-CE 4.3Å; F63-M231 HydrophobicContact CZ-SD 3.57Å; F63-M231 VanDerWaalsContact CZ-SD 3.57Å; W126-M231 HydrophobicContact CH2-CE 3.8Å; W126-M231 HydrophobicContact CH2-CG 3.55Å; W126-M231 HydrophobicContact CH2-SD 3.49Å; W126-M231 WeakPolarHBondContact CH2-SD 3.42Å; W126-M231 HydrophobicContact CZ2-CB 4.44Å; W126-M231 HydrophobicContact CZ2-CE 3.46Å; W126-M231 VanDerWaalsContact CZ2-CE 3.46Å; W126-M231 HydrophobicContact CZ2-CG 3.56Å; W126-M231 HydrophobicContact CZ2-SD 3.72Å; F129-M231 HydrophobicContact CD1-CE 4.27Å; F129-M231 HydrophobicContact CE1-CE 4.06Å; F129-M231 HydrophobicContact CE1-SD 4.14Å; V130-M231 HydrophobicContact CG2-CE 3.78Å; L227-M231 VanDerWaalsContact O-CB 3.31Å; L227-M231 WeakPolarHBondContact O-CB 3.47Å; L227-M231 PolarHBondContact O-N 2.86Å; L228-M231 HydrophobicContact CD2-CE 3.54Å; L228-M231 PolarHBondContact O-N 2.72Å; Q229-M231 VanDerWaalsContact C-N 3.32Å; Q229-M231 PolarHBondContact O-N 3.26Å; M231-K234 PolarHBondContact O-N 3.22Å; M231-K235 WeakPolarHBondContact O-CB 3.36Å; M231-K235 PolarHBondContact O-N 3Å
232	N	88.3	Confident	87.8	Confident	56 Å²	56	56.9 Å²	56.9	30%	0.299	28%	0.276	S	S	.	.	H	α-helix	trans	-62	-46	174.2	-79.5	-23.1	0	0	0	112.2	W126 L228 Q229 W230 K234 K235 D236	W126-N232 PolarHBondContact NE1-OD1 2.69Å; L228-N232 WeakPolarHBondContact O-CB 3.31Å; L228-N232 PolarHBondContact O-N 3.43Å; Q229-N232 PolarHBondContact O-N 3.2Å; W230-N232 VanDerWaalsContact C-N 3.34Å; W230-N232 PolarHBondContact O-N 3.32Å; N232-K234 VanDerWaalsContact C-N 3.3Å; N232-K234 PolarHBondContact O-N 3.02Å; N232-K235 PolarHBondContact O-N 2.92Å; N232-D236 PolarHBondContact O-N 3.38Å
233	Q	89.1	Confident	87.6	Confident	112 Å²	112	58.8 Å²	58.8	52%	0.523	28%	0.284	S	S	.	.	H	α-helix	trans	-60.4	-40.4	176.9	-73.1	174.7	-5.1	0	0	112.1	Q229 W230	Q229-Q233 WeakPolarHBondContact O-CG 3.43Å; Q229-Q233 PolarHBondContact O-N 3.4Å; W230-Q233 PolarHBondContact O-N 3.43Å
234	K	86.7	Confident	87.4	Confident	68 Å²	68	62.2 Å²	62.2	30%	0.296	31%	0.307	S	S	.	.	H	α-helix	trans	-73.1	-40.3	179.8	-66.1	-73	170.9	-174	0	111.7	W230 M231 N232 D236 V237 Y238	W230-K234 HydrophobicContact CD2-CG 3.82Å; W230-K234 HydrophobicContact CE3-CG 4.29Å; W230-K234 HydrophobicContact CG-CG 4.32Å; W230-K234 HydrophobicContact CH2-CG 4.19Å; W230-K234 HydrophobicContact CZ2-CD 4.18Å; W230-K234 HydrophobicContact CZ2-CG 3.73Å; W230-K234 HydrophobicContact CZ3-CG 4.45Å; W230-K234 WeakPolarHBondContact O-CB 3.43Å; W230-K234 VanDerWaalsContact O-CG 3.24Å; W230-K234 WeakPolarHBondContact O-CG 3.31Å; W230-K234 PolarHBondContact O-N 3.33Å; M231-K234 PolarHBondContact O-N 3.22Å; N232-K234 VanDerWaalsContact C-N 3.3Å; N232-K234 PolarHBondContact O-N 3.02Å; K234-D236 VanDerWaalsContact C-N 3.28Å; K234-D236 PolarHBondContact O-N 3.38Å; K234-V237 PolarHBondContact O-N 2.86Å; K234-Y238 HydrophobicContact CB-CD2 4.13Å; K234-Y238 HydrophobicContact CB-CE2 4.46Å; K234-Y238 HydrophobicContact CD-CD2 4.23Å; K234-Y238 HydrophobicContact CD-CE2 3.71Å; K234-Y238 VanDerWaalsContact O-CD2 3.26Å; K234-Y238 WeakPolarHBondContact O-CD2 3Å; K234-Y238 PolarHBondContact O-N 2.86Å
235	K	84.5	Confident	87.3	Confident	22 Å²	22	66.8 Å²	66.8	10%	0.096	33%	0.331	C	S	.	.	H	α-helix	trans	-55.2	-45.7	175.1	179.5	-168.2	72.7	83	0	111.6	W126 M231 N232 V237 Y238 L239 N240	W126-K235 HydrophobicContact CD2-CD 3.53Å; W126-K235 VanDerWaalsContact CE2-CD 3.4Å; W126-K235 HydrophobicContact CE3-CD 4.17Å; W126-K235 HydrophobicContact CG-CD 3.69Å; W126-K235 HydrophobicContact CH2-CD 4.44Å; W126-K235 HydrophobicContact CZ2-CB 4.13Å; W126-K235 HydrophobicContact CZ2-CD 3.86Å; W126-K235 HydrophobicContact CZ2-CG 4.41Å; M231-K235 WeakPolarHBondContact O-CB 3.36Å; M231-K235 PolarHBondContact O-N 3Å; N232-K235 PolarHBondContact O-N 2.92Å; K235-V237 PolarHBondContact O-N 3.37Å; K235-Y238 PolarHBondContact O-N 3.38Å; K235-L239 HydrophobicContact CG-CB 4.05Å; K235-L239 HydrophobicContact CG-CD2 3.98Å; K235-L239 WeakPolarHBondContact O-CA 3.31Å; K235-L239 VanDerWaalsContact O-CB 3.26Å; K235-L239 WeakPolarHBondContact O-CB 3.39Å; K235-L239 PolarHBondContact O-N 3.17Å; K235-N240 PolarHBondContact NZ-ND2 3.07Å; K235-N240 VanDerWaalsContact NZ-ND2 3.2Å; K235-N240 PolarHBondContact NZ-OD1 3.38Å; K235-N240 VanDerWaalsContact NZ-OD1 3.16Å; K235-N240 PolarHBondContact O-N 2.91Å
236	D	85.4	Confident	87.3	Confident	78 Å²	78	58 Å²	58	42%	0.417	30%	0.299	S	S	.	.	I	π-helix	trans	-62.4	-35.1	-177.1	-67.8	-18.2	0	0	0	111.9	N232 K234 N240 L241	N232-D236 PolarHBondContact O-N 3.38Å; K234-D236 VanDerWaalsContact C-N 3.28Å; K234-D236 PolarHBondContact O-N 3.38Å; D236-N240 PolarHBondContact OD1-ND2 2.91Å; D236-L241 PolarHBondContact O-N 3.05Å; D236-L241 VanDerWaalsContact O-N 3.17Å
237	V	84.2	Confident	87.3	Confident	83 Å²	83	57.5 Å²	57.5	50%	0.503	29%	0.294	S	S	.	.	I	π-helix	trans	-79.3	-46.9	178	178.2	0	0	0	0	112.7	K234 K235 P242	K234-V237 PolarHBondContact O-N 2.86Å; K235-V237 PolarHBondContact O-N 3.37Å; V237-P242 WeakPolarHBondContact O-CD 3.16Å
238	Y	81.6	Confident	87.4	Confident	100 Å²	100	60.6 Å²	60.6	39%	0.392	32%	0.315	S	S	.	.	I	π-helix	trans	-87.9	-29	-171.9	-72.5	-74.9	0	0	0	113.8	F54 K234 K235 P242	F54-Y238 HydrophobicContact CD2-CD1 4.49Å; F54-Y238 AromaticContact CD2-CD2 3.97Å; F54-Y238 HydrophobicContact CD2-CD2 3.97Å; F54-Y238 AromaticContact CD2-CG 3.84Å; F54-Y238 HydrophobicContact CD2-CG 3.84Å; F54-Y238 HydrophobicContact CE2-CD2 4.1Å; F54-Y238 HydrophobicContact CE2-CG 4.28Å; K234-Y238 HydrophobicContact CB-CD2 4.13Å; K234-Y238 HydrophobicContact CB-CE2 4.46Å; K234-Y238 HydrophobicContact CD-CD2 4.23Å; K234-Y238 HydrophobicContact CD-CE2 3.71Å; K234-Y238 VanDerWaalsContact O-CD2 3.26Å; K234-Y238 WeakPolarHBondContact O-CD2 3Å; K234-Y238 PolarHBondContact O-N 2.86Å; K235-Y238 PolarHBondContact O-N 3.38Å; Y238-P242 WeakPolarHBondContact O-CG 3.47Å
239	L	80.7	Confident	87.5	Confident	38 Å²	38	62 Å²	62	20%	0.199	32%	0.319	C	S	.	.	I	π-helix	trans	-106.1	-59.7	-175.9	-169.2	68.8	0	0	0	111.1	L75 K235 L241 I243	L75-L239 HydrophobicContact CD1-CD1 4.39Å; K235-L239 HydrophobicContact CG-CB 4.05Å; K235-L239 HydrophobicContact CG-CD2 3.98Å; K235-L239 WeakPolarHBondContact O-CA 3.31Å; K235-L239 VanDerWaalsContact O-CB 3.26Å; K235-L239 WeakPolarHBondContact O-CB 3.39Å; K235-L239 PolarHBondContact O-N 3.17Å; L239-L241 PolarHBondContact O-N 3.35Å; L239-I243 HydrophobicContact CD1-CD1 3.78Å; L239-I243 HydrophobicContact CG-CD1 3.83Å; L239-I243 WeakPolarHBondContact O-CB 2.99Å; L239-I243 WeakPolarHBondContact O-CD1 3.42Å; L239-I243 WeakPolarHBondContact O-CG1 3.43Å; L239-I243 PolarHBondContact O-N 2.91Å
240	N	85.5	Confident	87.7	Confident	60 Å²	60	56.8 Å²	56.8	32%	0.321	29%	0.294	S	S	.	.	I	π-helix	trans	-68.4	-41.8	-170.7	-56.1	-4	0	0	0	112	K235 D236 C244	K235-N240 PolarHBondContact NZ-ND2 3.07Å; K235-N240 VanDerWaalsContact NZ-ND2 3.2Å; K235-N240 PolarHBondContact NZ-OD1 3.38Å; K235-N240 VanDerWaalsContact NZ-OD1 3.16Å; K235-N240 PolarHBondContact O-N 2.91Å; D236-N240 PolarHBondContact OD1-ND2 2.91Å; N240-C244 VanDerWaalsContact O-CB 3.23Å; N240-C244 WeakPolarHBondContact O-CB 3.2Å; N240-C244 PolarHBondContact O-N 3.15Å
241	L	86.3	Confident	88	Confident	93 Å²	93	59.1 Å²	59.1	49%	0.487	31%	0.308	S	S	.	.	H	α-helix	trans	-65	-51.7	-176.2	174.7	70.2	0	0	0	112.4	D236 L239 I243 C244 L245	D236-L241 PolarHBondContact O-N 3.05Å; D236-L241 VanDerWaalsContact O-N 3.17Å; L239-L241 PolarHBondContact O-N 3.35Å; L241-I243 VanDerWaalsContact C-N 3.34Å; L241-I243 PolarHBondContact O-N 3.34Å; L241-C244 PolarHBondContact O-N 3.3Å; L241-L245 HydrophobicContact CD1-CD1 4.07Å; L241-L245 HydrophobicContact CD1-CG 4.21Å; L241-L245 HydrophobicContact CG-CD1 4.17Å; L241-L245 WeakPolarHBondContact O-CG 3.27Å; L241-L245 PolarHBondContact O-N 3.47Å
242	P	84	Confident	88.2	Confident	45 Å²	45	63.7 Å²	63.7	29%	0.292	33%	0.332	S	S	.	.	H	α-helix	trans	-60.8	-40.4	175.7	-27.2	37.6	0	0	0	113.1	V237 Y238 L245 L246	V237-P242 WeakPolarHBondContact O-CD 3.16Å; Y238-P242 WeakPolarHBondContact O-CG 3.47Å; P242-L245 PolarHBondContact O-N 2.93Å; P242-L246 WeakPolarHBondContact O-CB 3.43Å; P242-L246 PolarHBondContact O-N 3.47Å
243	I	87.4	Confident	88.4	Confident	49 Å²	49	61.4 Å²	61.4	25%	0.251	32%	0.321	S	S	.	.	H	α-helix	trans	-61.2	-46.8	176.6	-68.9	171.4	0	0	0	110.3	A119 L239 L241 L246 M247	A119-I243 HydrophobicContact CB-CG2 4.47Å; L239-I243 HydrophobicContact CD1-CD1 3.78Å; L239-I243 HydrophobicContact CG-CD1 3.83Å; L239-I243 WeakPolarHBondContact O-CB 2.99Å; L239-I243 WeakPolarHBondContact O-CD1 3.42Å; L239-I243 WeakPolarHBondContact O-CG1 3.43Å; L239-I243 PolarHBondContact O-N 2.91Å; L241-I243 VanDerWaalsContact C-N 3.34Å; L241-I243 PolarHBondContact O-N 3.34Å; I243-L246 PolarHBondContact O-N 2.99Å; I243-M247 HydrophobicContact CG2-CG 4.18Å; I243-M247 VanDerWaalsContact O-CB 3.28Å; I243-M247 WeakPolarHBondContact O-CB 3.44Å; I243-M247 WeakPolarHBondContact O-CG 3.38Å; I243-M247 PolarHBondContact O-N 2.73Å
244	C	89.5	Confident	88.6	Confident	71 Å²	71	56.8 Å²	56.8	48%	0.48	30%	0.3	S	S	.	.	H	α-helix	trans	-61	-47.8	179.3	-174.8	0	0	0	0	111.8	N240 L241 M247 C248	N240-C244 VanDerWaalsContact O-CB 3.23Å; N240-C244 WeakPolarHBondContact O-CB 3.2Å; N240-C244 PolarHBondContact O-N 3.15Å; L241-C244 PolarHBondContact O-N 3.3Å; C244-M247 PolarHBondContact O-N 3.28Å; C244-C248 WeakPolarHBondContact O-CB 2.95Å; C244-C248 PolarHBondContact O-N 2.03Å; C244-C248 PolarHBondContact O-SG 3.41Å; C244-C248 VanDerWaalsContact O-SG 3.33Å
245	L	89.1	Confident	89	Confident	110 Å²	110	58.8 Å²	58.8	58%	0.576	31%	0.313	S	S	*	.	H	α-helix	trans	-62.7	-44.5	178	-68.4	175.7	0	0	0	111.9	L241 P242 C248 Y249	L241-L245 HydrophobicContact CD1-CD1 4.07Å; L241-L245 HydrophobicContact CD1-CG 4.21Å; L241-L245 HydrophobicContact CG-CD1 4.17Å; L241-L245 WeakPolarHBondContact O-CG 3.27Å; L241-L245 PolarHBondContact O-N 3.47Å; P242-L245 PolarHBondContact O-N 2.93Å; L245-C248 PolarHBondContact O-N 3Å; L245-Y249 WeakPolarHBondContact O-CB 2.96Å; L245-Y249 PolarHBondContact O-N 3.36Å
246	L	90.3	Very high	89.2	Confident	23 Å²	23	61.7 Å²	61.7	12%	0.12	33%	0.329	C	S	.	.	H	α-helix	trans	-62	-44	177.2	-173.3	71.4	0	0	0	111.1	L40 V43 P242 I243 Y249 R250	L40-L246 HydrophobicContact CD1-CD1 3.72Å; V43-L246 HydrophobicContact CG1-CD1 3.88Å; P242-L246 WeakPolarHBondContact O-CB 3.43Å; P242-L246 PolarHBondContact O-N 3.47Å; I243-L246 PolarHBondContact O-N 2.99Å; L246-Y249 PolarHBondContact O-N 3.1Å; L246-R250 WeakPolarHBondContact O-CB 3.16Å; L246-R250 VanDerWaalsContact O-CG 3.22Å; L246-R250 WeakPolarHBondContact O-CG 3.44Å; L246-R250 PolarHBondContact O-N 3.03Å
247	M	92.4	Very high	89.4	Confident	22 Å²	22	58.3 Å²	58.3	11%	0.108	31%	0.311	C	S	.	.	H	α-helix	trans	-63.5	-49.3	178.2	-74.1	-64.4	-75.7	0	0	111.6	L112 D115 L116 I243 C244 Y249 R250 I251	L112-M247 HydrophobicContact CD2-CE 4.05Å; L112-M247 HydrophobicContact CG-CE 3.95Å; L112-M247 HydrophobicContact CG-SD 4.4Å; D115-M247 HydrophobicContact CB-SD 4.03Å; L116-M247 HydrophobicContact CB-CE 3.8Å; L116-M247 HydrophobicContact CD1-CE 4.26Å; I243-M247 HydrophobicContact CG2-CG 4.18Å; I243-M247 VanDerWaalsContact O-CB 3.28Å; I243-M247 WeakPolarHBondContact O-CB 3.44Å; I243-M247 WeakPolarHBondContact O-CG 3.38Å; I243-M247 PolarHBondContact O-N 2.73Å; C244-M247 PolarHBondContact O-N 3.28Å; M247-Y249 VanDerWaalsContact C-N 3.31Å; M247-Y249 PolarHBondContact O-N 2.92Å; M247-R250 PolarHBondContact O-N 3.32Å; M247-I251 VanDerWaalsContact O-CG1 3.28Å; M247-I251 WeakPolarHBondContact O-CG1 3.43Å; M247-I251 PolarHBondContact O-N 3.16Å
248	C	93.7	Very high	89.8	Confident	64 Å²	64	58.6 Å²	58.6	43%	0.432	31%	0.305	S	S	.	.	H	α-helix	trans	-55.8	-47.3	175.9	-74.1	0	0	0	0	111.6	C244 L245 R250 I251 I252	C244-C248 WeakPolarHBondContact O-CB 2.95Å; C244-C248 PolarHBondContact O-N 2.03Å; C244-C248 PolarHBondContact O-SG 3.41Å; C244-C248 VanDerWaalsContact O-SG 3.33Å; L245-C248 PolarHBondContact O-N 3Å; C248-R250 VanDerWaalsContact C-N 3.33Å; C248-R250 PolarHBondContact O-N 3.44Å; C248-I251 PolarHBondContact O-N 2.94Å; C248-I252 VanDerWaalsContact O-CG1 3.32Å; C248-I252 WeakPolarHBondContact O-CG1 3.28Å; C248-I252 PolarHBondContact O-N 3.05Å
249	Y	92	Very high	90.2	Very high	60 Å²	60	56.6 Å²	56.6	24%	0.235	31%	0.306	C	S	.	.	H	α-helix	trans	-63.5	-38.7	179.4	-175	-98.8	0	0	0	112.5	Y36 L39 L40 L245 L246 M247 I252 G253	Y36-Y249 WeakPolarHBondContact CA-OH 3.48Å; Y36-Y249 HydrophobicContact CD2-CD1 4.48Å; Y36-Y249 AromaticContact CD2-CE1 3.5Å; Y36-Y249 HydrophobicContact CD2-CE1 3.5Å; Y36-Y249 AromaticContact CD2-CZ 3.56Å; Y36-Y249 VanDerWaalsContact CD2-OH 3.27Å; Y36-Y249 WeakPolarHBondContact CD2-OH 3.3Å; Y36-Y249 AromaticContact CE2-CD1 3.83Å; Y36-Y249 HydrophobicContact CE2-CD1 3.83Å; Y36-Y249 AromaticContact CE2-CE1 3.21Å; Y36-Y249 HydrophobicContact CE2-CE1 3.21Å; Y36-Y249 AromaticContact CE2-CZ 3.75Å; Y36-Y249 PolarHBondContact O-OH 3.44Å; L39-Y249 WeakPolarHBondContact CB-OH 3.2Å; L39-Y249 HydrophobicContact CD2-CD2 4.04Å; L39-Y249 HydrophobicContact CD2-CE1 4.35Å; L39-Y249 HydrophobicContact CD2-CE2 3.21Å; L39-Y249 WeakPolarHBondContact CD2-OH 3.14Å; L39-Y249 HydrophobicContact CG-CE2 4.47Å; L40-Y249 HydrophobicContact CB-CE1 4.01Å; L40-Y249 HydrophobicContact CD1-CD1 3.49Å; L40-Y249 VanDerWaalsContact CD1-CD1 3.49Å; L40-Y249 HydrophobicContact CD1-CE1 3.69Å; L40-Y249 HydrophobicContact CG-CE1 4.42Å; L245-Y249 WeakPolarHBondContact O-CB 2.96Å; L245-Y249 PolarHBondContact O-N 3.36Å; L246-Y249 PolarHBondContact O-N 3.1Å; M247-Y249 VanDerWaalsContact C-N 3.31Å; M247-Y249 PolarHBondContact O-N 2.92Å; Y249-I252 PolarHBondContact O-N 2.79Å; Y249-G253 PolarHBondContact O-N 3.36Å
250	R	93.7	Very high	90.5	Very high	8 Å²	8	56.4 Å²	56.4	3%	0.03	30%	0.304	C	S	.	.	H	α-helix	trans	-69.5	-39	176.3	-73.6	177.1	68.7	-176.3	-2.5	113.2	L40 T111 L112 D115 L246 M247 C248 G253 L254	L40-R250 HydrophobicContact CD1-CG 4.3Å; T111-R250 PolarHBondContact OG1-NH2 3Å; L112-R250 HydrophobicContact CD1-CB 4.08Å; D115-R250 IonicContact OD2-CZ 3.71Å; D115-R250 IonicContact OD2-NH1 3.97Å; D115-R250 PolarHBondContact OD2-NH1 2.99Å; D115-R250 IonicContact OD2-NH2 2.64Å; L246-R250 WeakPolarHBondContact O-CB 3.16Å; L246-R250 VanDerWaalsContact O-CG 3.22Å; L246-R250 WeakPolarHBondContact O-CG 3.44Å; L246-R250 PolarHBondContact O-N 3.03Å; M247-R250 PolarHBondContact O-N 3.32Å; C248-R250 VanDerWaalsContact C-N 3.33Å; C248-R250 PolarHBondContact O-N 3.44Å; R250-G253 PolarHBondContact O-N 3.37Å; R250-L254 WeakPolarHBondContact O-CB 3.39Å; R250-L254 WeakPolarHBondContact O-CG 3.06Å; R250-L254 PolarHBondContact O-N 3.36Å
251	I	95.3	Very high	90.6	Very high	79 Å²	79	54 Å²	54	41%	0.405	29%	0.291	S	S	.	.	H	α-helix	trans	-60	-49.3	174.1	-67.2	169.4	0	0	0	109.6	L112 M247 C248 G253 L254 I255	L112-I251 HydrophobicContact CD1-CG1 3.7Å; M247-I251 VanDerWaalsContact O-CG1 3.28Å; M247-I251 WeakPolarHBondContact O-CG1 3.43Å; M247-I251 PolarHBondContact O-N 3.16Å; C248-I251 PolarHBondContact O-N 2.94Å; I251-G253 PolarHBondContact O-N 3.13Å; I251-L254 PolarHBondContact O-N 2.71Å; I251-I255 HydrophobicContact CG2-CD1 3.84Å; I251-I255 VanDerWaalsContact O-CG1 3.29Å; I251-I255 WeakPolarHBondContact O-CG1 3.29Å; I251-I255 PolarHBondContact O-N 2.83Å
252	I	93.4	Very high	90.7	Very high	97 Å²	97	57.3 Å²	57.3	50%	0.497	30%	0.297	S	S	.	.	H	α-helix	trans	-59.8	-48	177.8	-65.9	166	0	0	0	110.4	C248 Y249 L254 I255 L256	C248-I252 VanDerWaalsContact O-CG1 3.32Å; C248-I252 WeakPolarHBondContact O-CG1 3.28Å; C248-I252 PolarHBondContact O-N 3.05Å; Y249-I252 PolarHBondContact O-N 2.79Å; I252-L254 PolarHBondContact O-N 3.3Å; I252-I255 PolarHBondContact O-N 2.79Å; I252-L256 HydrophobicContact CG2-CD1 3.94Å; I252-L256 HydrophobicContact CG2-CG 4.4Å; I252-L256 WeakPolarHBondContact O-CG 3.1Å; I252-L256 PolarHBondContact O-N 3.34Å
253	G	91.8	Very high	90.8	Very high	8 Å²	8	57.9 Å²	57.9	8%	0.082	30%	0.296	C	S	.	.	H	α-helix	trans	-56.9	-45.2	177.4	0	0	0	0	0	113.5	Y36 Y249 R250 I251 L256 L257	Y36-G253 VanDerWaalsContact CE2-CA 3.48Å; Y249-G253 PolarHBondContact O-N 3.36Å; R250-G253 PolarHBondContact O-N 3.37Å; I251-G253 PolarHBondContact O-N 3.13Å; G253-L256 PolarHBondContact O-N 3.39Å; G253-L257 WeakPolarHBondContact O-CB 3.42Å; G253-L257 PolarHBondContact O-N 2.94Å
254	L	94	Very high	90.6	Very high	15 Å²	15	56.4 Å²	56.4	8%	0.079	29%	0.288	C	S	.	.	H	α-helix	trans	-65.5	-37.6	177.8	-82.1	175.3	0	0	0	113.1	W105 L109 L112 R250 I251 I252 L257 K258	W105-L254 HydrophobicContact CG-CD2 4.48Å; W105-L254 PolarHBondContact NE1-O 3.47Å; L109-L254 HydrophobicContact CD1-CD1 4.29Å; L112-L254 HydrophobicContact CB-CD1 4.25Å; L112-L254 HydrophobicContact CD1-CD1 3.54Å; L112-L254 HydrophobicContact CG-CD1 4.49Å; R250-L254 WeakPolarHBondContact O-CB 3.39Å; R250-L254 WeakPolarHBondContact O-CG 3.06Å; R250-L254 PolarHBondContact O-N 3.36Å; I251-L254 PolarHBondContact O-N 2.71Å; I252-L254 PolarHBondContact O-N 3.3Å; L254-L257 HydrophobicContact CD2-CD2 4.38Å; L254-K258 VanDerWaalsContact O-CB 3.32Å; L254-K258 WeakPolarHBondContact O-CB 3.18Å; L254-K258 PolarHBondContact O-N 3.42Å
255	I	93.4	Very high	90.5	Very high	110 Å²	110	54.1 Å²	54.1	56%	0.564	27%	0.273	S	S	*	.	H	α-helix	trans	-64.9	-50.1	176.3	-69.1	167	0	0	0	109.8	I251 I252 K258 S259	I251-I255 HydrophobicContact CG2-CD1 3.84Å; I251-I255 VanDerWaalsContact O-CG1 3.29Å; I251-I255 WeakPolarHBondContact O-CG1 3.29Å; I251-I255 PolarHBondContact O-N 2.83Å; I252-I255 PolarHBondContact O-N 2.79Å; I255-K258 WeakPolarHBondContact O-CB 3.25Å; I255-K258 PolarHBondContact O-N 3.48Å; I255-S259 PolarHBondContact O-N 3.19Å; I255-S259 VanDerWaalsContact O-N 3.11Å; I255-S259 PolarHBondContact O-OG 2.9Å
256	L	90.2	Very high	90.4	Very high	83 Å²	83	52 Å²	52	44%	0.435	27%	0.268	S	S	.	.	H	α-helix	trans	-61.6	-46.1	178.4	-68.5	175.8	0	0	0	111.4	I252 G253 K258 S259 E260	I252-L256 HydrophobicContact CG2-CD1 3.94Å; I252-L256 HydrophobicContact CG2-CG 4.4Å; I252-L256 WeakPolarHBondContact O-CG 3.1Å; I252-L256 PolarHBondContact O-N 3.34Å; G253-L256 PolarHBondContact O-N 3.39Å; L256-K258 VanDerWaalsContact C-N 3.29Å; L256-K258 PolarHBondContact O-N 3.44Å; L256-S259 WeakPolarHBondContact CA-OG 3.04Å; L256-S259 PolarHBondContact O-N 2.74Å; L256-S259 PolarHBondContact O-OG 3.17Å; L256-E260 WeakPolarHBondContact O-CG 3.24Å; L256-E260 PolarHBondContact O-N 2.86Å
257	L	88.8	Confident	90.2	Very high	7 Å²	7	52.2 Å²	52.2	4%	0.037	27%	0.268	C	S	.	.	H	α-helix	trans	-58.7	-41.2	176.6	175.6	66.7	0	0	0	111.8	L33 L101 F104 W105 G253 L254 E260 I261	L33-L257 HydrophobicContact CD1-CD1 4.48Å; L33-L257 HydrophobicContact CD2-CD1 3.39Å; L101-L257 HydrophobicContact CD1-CD1 3.74Å; L101-L257 HydrophobicContact CD2-CD1 4.48Å; L101-L257 HydrophobicContact CG-CD1 4.1Å; F104-L257 HydrophobicContact CD1-CD1 4.21Å; F104-L257 HydrophobicContact CD1-CD2 3.57Å; F104-L257 HydrophobicContact CE1-CD1 3.93Å; F104-L257 HydrophobicContact CE1-CD2 3.18Å; F104-L257 HydrophobicContact CE1-CG 4.2Å; F104-L257 HydrophobicContact CZ-CD2 4.09Å; W105-L257 HydrophobicContact CB-CD2 3.91Å; W105-L257 HydrophobicContact CB-CG 4.47Å; W105-L257 HydrophobicContact CG-CD2 4.14Å; G253-L257 WeakPolarHBondContact O-CB 3.42Å; G253-L257 PolarHBondContact O-N 2.94Å; L254-L257 HydrophobicContact CD2-CD2 4.38Å; L257-E260 PolarHBondContact O-N 3.02Å; L257-I261 HydrophobicContact CD1-CD1 3.93Å; L257-I261 HydrophobicContact CD1-CG1 4.18Å; L257-I261 HydrophobicContact CG-CD1 3.79Å; L257-I261 HydrophobicContact CG-CG1 4.42Å; L257-I261 WeakPolarHBondContact O-CB 3.36Å; L257-I261 VanDerWaalsContact O-CG1 3.24Å; L257-I261 WeakPolarHBondContact O-CG1 3.35Å; L257-I261 PolarHBondContact O-N 2.93Å
258	K	92.2	Very high	89.8	Confident	88 Å²	88	53.6 Å²	53.6	38%	0.383	28%	0.275	S	S	.	.	H	α-helix	trans	-63.9	-41.6	177.4	-171.5	176.4	-174.4	172.5	0	112	W105 L254 I255 L256 E260 R262	W105-K258 HydrophobicContact CZ2-CD 3.91Å; W105-K258 HydrophobicContact CZ2-CG 4.36Å; L254-K258 VanDerWaalsContact O-CB 3.32Å; L254-K258 WeakPolarHBondContact O-CB 3.18Å; L254-K258 PolarHBondContact O-N 3.42Å; I255-K258 WeakPolarHBondContact O-CB 3.25Å; I255-K258 PolarHBondContact O-N 3.48Å; L256-K258 VanDerWaalsContact C-N 3.29Å; L256-K258 PolarHBondContact O-N 3.44Å; K258-E260 VanDerWaalsContact C-N 3.34Å; K258-R262 WeakPolarHBondContact O-CG 3.49Å; K258-R262 PolarHBondContact O-N 2.91Å
259	S	90.4	Very high	89.5	Confident	59 Å²	59	58.4 Å²	58.4	41%	0.413	28%	0.284	S	S	.	.	H	α-helix	trans	-63.6	-41.6	175.6	46.2	0	0	0	0	111.6	I255 L256 R262 Q263	I255-S259 PolarHBondContact O-N 3.19Å; I255-S259 VanDerWaalsContact O-N 3.11Å; I255-S259 PolarHBondContact O-OG 2.9Å; L256-S259 WeakPolarHBondContact CA-OG 3.04Å; L256-S259 PolarHBondContact O-N 2.74Å; L256-S259 PolarHBondContact O-OG 3.17Å; S259-R262 PolarHBondContact O-N 2.99Å; S259-Q263 PolarHBondContact O-N 2.88Å; S259-Q263 VanDerWaalsContact O-N 3.11Å
260	E	87.5	Confident	89.4	Confident	33 Å²	33	57.1 Å²	57.1	15%	0.154	29%	0.286	C	S	.	.	H	α-helix	trans	-68.1	-43.4	179.8	-66.9	-58.2	155.9	0	0	112.4	Y29 L256 L257 K258 R262 Q263 L264	Y29-E260 WeakPolarHBondContact CB-OE2 3.41Å; L256-E260 WeakPolarHBondContact O-CG 3.24Å; L256-E260 PolarHBondContact O-N 2.86Å; L257-E260 PolarHBondContact O-N 3.02Å; K258-E260 VanDerWaalsContact C-N 3.34Å; E260-R262 VanDerWaalsContact C-N 3.3Å; E260-R262 PolarHBondContact O-N 3.04Å; E260-Q263 PolarHBondContact O-N 2.88Å; E260-Q263 VanDerWaalsContact O-N 3.15Å; E260-L264 WeakPolarHBondContact O-CG 3.41Å; E260-L264 PolarHBondContact O-N 3.47Å
261	I	86.5	Confident	89	Confident	9 Å²	9	61.9 Å²	61.9	5%	0.046	30%	0.304	C	S	.	.	H	α-helix	trans	-58.5	-43.1	175.5	-70.3	166.4	0	0	0	111.1	L101 H102 W105 L257 Q263 L264 S265	L101-I261 HydrophobicContact CD2-CD1 4.33Å; L101-I261 HydrophobicContact CD2-CG1 3.53Å; L101-I261 HydrophobicContact CG-CD1 3.95Å; L101-I261 HydrophobicContact CG-CG1 3.71Å; H102-I261 WeakPolarHBondContact CE1-CG2 3.36Å; W105-I261 HydrophobicContact CB-CD1 3.72Å; W105-I261 HydrophobicContact CG-CD1 3.97Å; L257-I261 HydrophobicContact CD1-CD1 3.93Å; L257-I261 HydrophobicContact CD1-CG1 4.18Å; L257-I261 HydrophobicContact CG-CD1 3.79Å; L257-I261 HydrophobicContact CG-CG1 4.42Å; L257-I261 WeakPolarHBondContact O-CB 3.36Å; L257-I261 VanDerWaalsContact O-CG1 3.24Å; L257-I261 WeakPolarHBondContact O-CG1 3.35Å; L257-I261 PolarHBondContact O-N 2.93Å; I261-Q263 VanDerWaalsContact C-N 3.31Å; I261-Q263 PolarHBondContact O-N 3.36Å; I261-L264 PolarHBondContact O-N 2.86Å; I261-S265 WeakPolarHBondContact O-CB 3.16Å; I261-S265 PolarHBondContact O-N 3.05Å
262	R	89.6	Confident	88.7	Confident	164 Å²	164	64 Å²	64	62%	0.619	31%	0.312	S	S	*	.	H	α-helix	trans	-62.1	-41.1	177.7	-76.9	176.5	174.2	-176.5	-3.4	111.5	K258 S259 E260 S265 S266	K258-R262 WeakPolarHBondContact O-CG 3.49Å; K258-R262 PolarHBondContact O-N 2.91Å; S259-R262 PolarHBondContact O-N 2.99Å; E260-R262 VanDerWaalsContact C-N 3.3Å; E260-R262 PolarHBondContact O-N 3.04Å; R262-S265 PolarHBondContact O-N 2.85Å; R262-S266 PolarHBondContact O-N 3.45Å; R262-S266 VanDerWaalsContact O-N 3.12Å
263	Q	86.1	Confident	88.6	Confident	56 Å²	56	62.1 Å²	62.1	26%	0.262	31%	0.308	S	S	.	.	H	α-helix	trans	-66.2	-46	177	-171.8	-176.6	-41.4	0	0	111.5	S259 E260 I261 S265 S266 E267	S259-Q263 PolarHBondContact O-N 2.88Å; S259-Q263 VanDerWaalsContact O-N 3.11Å; E260-Q263 PolarHBondContact O-N 2.88Å; E260-Q263 VanDerWaalsContact O-N 3.15Å; I261-Q263 VanDerWaalsContact C-N 3.31Å; I261-Q263 PolarHBondContact O-N 3.36Å; Q263-S265 VanDerWaalsContact C-N 3.29Å; Q263-S265 PolarHBondContact O-N 3.09Å; Q263-S266 PolarHBondContact O-N 2.96Å; Q263-S266 PolarHBondContact O-OG 3.35Å; Q263-E267 PolarHBondContact NE2-OE1 2.96Å; Q263-E267 WeakPolarHBondContact O-CG 3.15Å; Q263-E267 PolarHBondContact O-N 3.15Å
264	L	83.6	Confident	88.6	Confident	18 Å²	18	65 Å²	65	9%	0.094	32%	0.321	C	S	.	.	H	α-helix	trans	-59.7	-41.6	176.2	-74.3	172.1	0	0	0	112.2	Y29 L101 E260 I261 S266 E267 I268	Y29-L264 HydrophobicContact CD1-CD2 3.94Å; Y29-L264 HydrophobicContact CD2-CD1 3.79Å; Y29-L264 HydrophobicContact CD2-CD2 4.49Å; Y29-L264 HydrophobicContact CE1-CD2 3.57Å; Y29-L264 HydrophobicContact CE2-CD1 3.67Å; Y29-L264 HydrophobicContact CE2-CD2 4.19Å; Y29-L264 HydrophobicContact CE2-CG 4.48Å; Y29-L264 HydrophobicContact CG-CD1 4.3Å; Y29-L264 HydrophobicContact CG-CD2 4.39Å; L101-L264 HydrophobicContact CD2-CD1 3.97Å; E260-L264 WeakPolarHBondContact O-CG 3.41Å; E260-L264 PolarHBondContact O-N 3.47Å; I261-L264 PolarHBondContact O-N 2.86Å; L264-S266 VanDerWaalsContact C-N 3.33Å; L264-S266 PolarHBondContact O-N 3.5Å; L264-E267 PolarHBondContact O-N 2.96Å; L264-I268 WeakPolarHBondContact O-CG1 3.19Å; L264-I268 PolarHBondContact O-N 3.45Å
265	S	85.7	Confident	88.5	Confident	24 Å²	24	69.2 Å²	69.2	17%	0.168	34%	0.344	C	S	.	.	H	α-helix	trans	-63.9	-36.7	177.7	-173.4	0	0	0	0	112.7	I261 R262 Q263 R269	I261-S265 WeakPolarHBondContact O-CB 3.16Å; I261-S265 PolarHBondContact O-N 3.05Å; R262-S265 PolarHBondContact O-N 2.85Å; Q263-S265 VanDerWaalsContact C-N 3.29Å; Q263-S265 PolarHBondContact O-N 3.09Å; S265-R269 WeakPolarHBondContact O-CG 3.47Å; S265-R269 PolarHBondContact O-N 3.14Å; S265-R269 PolarHBondContact O-NE 2.87Å; S265-R269 PolarHBondContact OG-NE 3.47Å; S265-R269 PolarHBondContact OG-NH2 3.32Å
266	S	88.5	Confident	88.4	Confident	66 Å²	66	66.3 Å²	66.3	46%	0.462	34%	0.336	S	S	.	.	H	α-helix	trans	-74.6	-36.8	176.8	69.1	0	0	0	0	112	R262 Q263 L264 A270	R262-S266 PolarHBondContact O-N 3.45Å; R262-S266 VanDerWaalsContact O-N 3.12Å; Q263-S266 PolarHBondContact O-N 2.96Å; Q263-S266 PolarHBondContact O-OG 3.35Å; L264-S266 VanDerWaalsContact C-N 3.33Å; L264-S266 PolarHBondContact O-N 3.5Å; S266-A270 WeakPolarHBondContact O-CB 3.46Å; S266-A270 PolarHBondContact O-N 3.37Å
267	E	86.1	Confident	88.4	Confident	27 Å²	27	66.1 Å²	66.1	13%	0.126	34%	0.336	C	S	.	.	H	α-helix	trans	-64.5	-40.3	175.9	-74.7	-174.8	-160.5	0	0	112.4	Q263 L264 A270 R271	Q263-E267 PolarHBondContact NE2-OE1 2.96Å; Q263-E267 WeakPolarHBondContact O-CG 3.15Å; Q263-E267 PolarHBondContact O-N 3.15Å; L264-E267 PolarHBondContact O-N 2.96Å; E267-A270 PolarHBondContact O-N 2.9Å; E267-R271 WeakPolarHBondContact O-CG 3.26Å; E267-R271 PolarHBondContact O-N 3.37Å
268	I	83.4	Confident	88.5	Confident	50 Å²	50	68.8 Å²	68.8	26%	0.256	36%	0.355	S	S	.	.	H	α-helix	trans	-69.4	-45.5	179.5	-70.7	169.5	0	0	0	110.6	I98 L264 A270 R271 E272	I98-I268 HydrophobicContact CD1-CB 4.42Å; I98-I268 HydrophobicContact CD1-CD1 3.23Å; I98-I268 HydrophobicContact CD1-CG1 4.37Å; I98-I268 HydrophobicContact CD1-CG2 4.29Å; I98-I268 HydrophobicContact CG1-CD1 3.58Å; L264-I268 WeakPolarHBondContact O-CG1 3.19Å; L264-I268 PolarHBondContact O-N 3.45Å; I268-A270 VanDerWaalsContact C-N 3.26Å; I268-A270 PolarHBondContact O-N 3.49Å; I268-R271 WeakPolarHBondContact O-CB 3.35Å; I268-R271 PolarHBondContact O-N 2.03Å; I268-E272 WeakPolarHBondContact O-CG 3.3Å; I268-E272 PolarHBondContact O-N 3.36Å
269	R	88.2	Confident	88.3	Confident	165 Å²	165	69.7 Å²	69.7	62%	0.623	36%	0.363	S	S	*	.	H	α-helix	trans	-57.8	-39.3	172.7	-76.5	-175.5	-104.4	-175.8	-10.9	112.4	S265 R271 E272 S273	S265-R269 WeakPolarHBondContact O-CG 3.47Å; S265-R269 PolarHBondContact O-N 3.14Å; S265-R269 PolarHBondContact O-NE 2.87Å; S265-R269 PolarHBondContact OG-NE 3.47Å; S265-R269 PolarHBondContact OG-NH2 3.32Å; R269-R271 VanDerWaalsContact C-N 3.35Å; R269-E272 PolarHBondContact O-N 3.38Å; R269-S273 WeakPolarHBondContact O-CB 3.07Å; R269-S273 PolarHBondContact O-N 3.04Å; R269-S273 PolarHBondContact O-OG 3.35Å
270	A	88.3	Confident	88.3	Confident	33 Å²	33	72.4 Å²	72.4	27%	0.273	37%	0.373	S	S	.	.	H	α-helix	trans	-68.3	-31.1	175.7	0	0	0	0	0	112.9	S266 E267 I268 S273 N274	S266-A270 WeakPolarHBondContact O-CB 3.46Å; S266-A270 PolarHBondContact O-N 3.37Å; E267-A270 PolarHBondContact O-N 2.9Å; I268-A270 VanDerWaalsContact C-N 3.26Å; I268-A270 PolarHBondContact O-N 3.49Å; A270-S273 WeakPolarHBondContact CA-OG 2.95Å; A270-S273 PolarHBondContact O-OG 3.39Å; A270-S273 VanDerWaalsContact O-OG 3.05Å; A270-N274 VanDerWaalsContact O-CB 3.3Å; A270-N274 WeakPolarHBondContact O-CB 3.44Å; A270-N274 PolarHBondContact O-N 3.31Å; A270-N274 VanDerWaalsContact O-N 3.1Å; A270-N274 PolarHBondContact O-ND2 3.09Å
271	R	85.5	Confident	88.2	Confident	109 Å²	109	79.5 Å²	79.5	41%	0.411	40%	0.398	S	S	.	.	H	α-helix	trans	-71.9	-44.1	174	-71.9	175.2	-166.9	-165.3	6.3	111.1	E267 I268 R269 S273 N274 N275	E267-R271 WeakPolarHBondContact O-CG 3.26Å; E267-R271 PolarHBondContact O-N 3.37Å; I268-R271 WeakPolarHBondContact O-CB 3.35Å; I268-R271 PolarHBondContact O-N 2.03Å; R269-R271 VanDerWaalsContact C-N 3.35Å; R271-S273 PolarHBondContact O-N 2.88Å; R271-N274 PolarHBondContact O-N 2.02Å; R271-N275 WeakPolarHBondContact O-CB 3.33Å; R271-N275 PolarHBondContact O-N 2.87Å; R271-N275 PolarHBondContact O-OD1 3.29Å
272	E	89.9	Confident	88.1	Confident	123 Å²	123	81.7 Å²	81.7	58%	0.575	42%	0.418	S	S	*	.	H	α-helix	trans	-60.3	-45.3	176.1	-70.9	172.4	173.6	0	0	111.3	I268 R269 N274 N275 A276	I268-E272 WeakPolarHBondContact O-CG 3.3Å; I268-E272 PolarHBondContact O-N 3.36Å; R269-E272 PolarHBondContact O-N 3.38Å; E272-N274 PolarHBondContact O-N 3.08Å; E272-N275 PolarHBondContact O-N 3.04Å; E272-A276 WeakPolarHBondContact O-CB 2.76Å; E272-A276 PolarHBondContact O-N 3.46Å
273	S	91.3	Very high	88	Confident	57 Å²	57	80.1 Å²	80.1	40%	0.399	42%	0.415	S	S	.	.	H	α-helix	trans	-64.6	-40.1	176.6	71.1	0	0	0	0	112.5	R269 A270 R271 A276 N277	R269-S273 WeakPolarHBondContact O-CB 3.07Å; R269-S273 PolarHBondContact O-N 3.04Å; R269-S273 PolarHBondContact O-OG 3.35Å; A270-S273 WeakPolarHBondContact CA-OG 2.95Å; A270-S273 PolarHBondContact O-OG 3.39Å; A270-S273 VanDerWaalsContact O-OG 3.05Å; R271-S273 PolarHBondContact O-N 2.88Å; S273-A276 PolarHBondContact O-N 3.46Å; S273-N277 WeakPolarHBondContact O-CB 3.37Å; S273-N277 PolarHBondContact O-N 3.38Å; S273-N277 PolarHBondContact O-ND2 3.25Å
274	N	90.8	Very high	88	Confident	70 Å²	70	80.9 Å²	80.9	37%	0.374	43%	0.427	S	S	.	.	H	α-helix	trans	-68.3	-38.1	177.7	-75	-34.7	0	0	0	112.2	R22 A270 R271 E272 N277 S278	R22-N274 PolarHBondContact NH1-ND2 2.94Å; A270-N274 VanDerWaalsContact O-CB 3.3Å; A270-N274 WeakPolarHBondContact O-CB 3.44Å; A270-N274 PolarHBondContact O-N 3.31Å; A270-N274 VanDerWaalsContact O-N 3.1Å; A270-N274 PolarHBondContact O-ND2 3.09Å; R271-N274 PolarHBondContact O-N 2.02Å; E272-N274 PolarHBondContact O-N 3.08Å; N274-N277 PolarHBondContact O-N 3.33Å; N274-S278 WeakPolarHBondContact O-CB 3.01Å; N274-S278 PolarHBondContact O-N 3.13Å; N274-S278 PolarHBondContact O-OG 3.1Å
275	N	91.5	Very high	87.7	Confident	102 Å²	102	85.7 Å²	85.7	55%	0.545	45%	0.452	S	S	.	.	H	α-helix	trans	-68.1	-39.8	175.7	-70.8	-7.4	0	0	0	111.5	R271 E272 N277 S278 L279	R271-N275 WeakPolarHBondContact O-CB 3.33Å; R271-N275 PolarHBondContact O-N 2.87Å; R271-N275 PolarHBondContact O-OD1 3.29Å; E272-N275 PolarHBondContact O-N 3.04Å; N275-N277 VanDerWaalsContact C-N 3.34Å; N275-S278 WeakPolarHBondContact CA-OG 3.34Å; N275-S278 PolarHBondContact O-N 2.93Å; N275-S278 PolarHBondContact O-OG 3.4Å; N275-L279 WeakPolarHBondContact O-CG 3.37Å; N275-L279 PolarHBondContact O-N 3.07Å; N275-L279 VanDerWaalsContact O-N 3.08Å
276	A	91.6	Very high	87.1	Confident	49 Å²	49	91 Å²	91	41%	0.405	48%	0.478	S	S	.	.	H	α-helix	trans	-61.9	-43.4	172.7	0	0	0	0	0	111.3	E272 S273 L279 L280	E272-A276 WeakPolarHBondContact O-CB 2.76Å; E272-A276 PolarHBondContact O-N 3.46Å; S273-A276 PolarHBondContact O-N 3.46Å; A276-L279 PolarHBondContact O-N 3.33Å; A276-L280 WeakPolarHBondContact O-CG 3.18Å; A276-L280 PolarHBondContact O-N 2.85Å
277	N	91.4	Very high	85.7	Confident	80 Å²	80	96.5 Å²	96.5	43%	0.428	49%	0.49	S	S	.	.	H	α-helix	trans	-67.3	-36.4	177.6	-71.7	-19.9	0	0	0	113.2	S273 N274 N275 L280 R281	S273-N277 WeakPolarHBondContact O-CB 3.37Å; S273-N277 PolarHBondContact O-N 3.38Å; S273-N277 PolarHBondContact O-ND2 3.25Å; N274-N277 PolarHBondContact O-N 3.33Å; N275-N277 VanDerWaalsContact C-N 3.34Å; N277-L280 PolarHBondContact O-N 2.89Å; N277-R281 WeakPolarHBondContact O-CG 3.44Å; N277-R281 PolarHBondContact O-N 3.44Å
278	S	90.1	Very high	84.5	Confident	63 Å²	63	100.8 Å²	100.8	44%	0.441	52%	0.518	S	S	.	.	H	α-helix	trans	-69.1	-38	177.1	65.2	0	0	0	0	111.7	N274 N275 R281 A282	N274-S278 WeakPolarHBondContact O-CB 3.01Å; N274-S278 PolarHBondContact O-N 3.13Å; N274-S278 PolarHBondContact O-OG 3.1Å; N275-S278 WeakPolarHBondContact CA-OG 3.34Å; N275-S278 PolarHBondContact O-N 2.93Å; N275-S278 PolarHBondContact O-OG 3.4Å; S278-R281 PolarHBondContact O-N 3.35Å; S278-A282 WeakPolarHBondContact O-CB 3.48Å; S278-A282 PolarHBondContact O-N 2.83Å
279	L	89.4	Confident	83.4	Confident	107 Å²	107	103.6 Å²	103.6	56%	0.56	54%	0.54	S	S	*	.	H	α-helix	trans	-61.7	-46.9	171.1	-71.2	172	0	0	0	111.2	N275 A276 R281 A282 F283	N275-L279 WeakPolarHBondContact O-CG 3.37Å; N275-L279 PolarHBondContact O-N 3.07Å; N275-L279 VanDerWaalsContact O-N 3.08Å; A276-L279 PolarHBondContact O-N 3.33Å; L279-R281 VanDerWaalsContact C-N 3.33Å; L279-R281 PolarHBondContact O-N 3.2Å; L279-A282 PolarHBondContact O-N 2.94Å; L279-F283 WeakPolarHBondContact O-CD2 3.41Å; L279-F283 PolarHBondContact O-N 3.06Å
280	L	89.1	Confident	81.9	Confident	116 Å²	116	106.2 Å²	106.2	61%	0.607	56%	0.556	S	S	*	*	H	α-helix	trans	-58.9	-41.8	175.7	-73.9	171.1	0	0	0	112.6	A276 N277 F283 S284	A276-L280 WeakPolarHBondContact O-CG 3.18Å; A276-L280 PolarHBondContact O-N 2.85Å; N277-L280 PolarHBondContact O-N 2.89Å; L280-F283 PolarHBondContact O-N 2.95Å; L280-S284 PolarHBondContact O-N 3.05Å
281	R	86.2	Confident	80.2	Confident	182 Å²	182	108.2 Å²	108.2	69%	0.687	58%	0.58	S	S	*	*	H	α-helix	trans	-65.8	-42.3	176.1	-75.7	-177.6	-173	174.6	2.6	112.4	N277 S278 L279 F283 S284 I285	N277-R281 WeakPolarHBondContact O-CG 3.44Å; N277-R281 PolarHBondContact O-N 3.44Å; S278-R281 PolarHBondContact O-N 3.35Å; L279-R281 VanDerWaalsContact C-N 3.33Å; L279-R281 PolarHBondContact O-N 3.2Å; R281-F283 VanDerWaalsContact C-N 3.3Å; R281-F283 PolarHBondContact O-N 2.8Å; R281-S284 WeakPolarHBondContact CA-OG 3.43Å; R281-S284 PolarHBondContact O-N 3.23Å; R281-S284 VanDerWaalsContact O-N 3.11Å; R281-S284 PolarHBondContact O-OG 3.05Å; R281-I285 PolarHBondContact O-N 2Å
282	A	84.5	Confident	78.5	Confident	55 Å²	55	108.7 Å²	108.7	46%	0.455	60%	0.595	S	S	.	*	H	α-helix	trans	-57.6	-45.1	175.8	0	0	0	0	0	110.8	S278 L279 S284 I285	S278-A282 WeakPolarHBondContact O-CB 3.48Å; S278-A282 PolarHBondContact O-N 2.83Å; L279-A282 PolarHBondContact O-N 2.94Å; A282-S284 PolarHBondContact O-N 2.87Å; A282-I285 PolarHBondContact O-N 2.98Å
283	F	86.4	Confident	76.7	Confident	130 Å²	130	108.7 Å²	108.7	57%	0.57	61%	0.606	S	S	*	*	H	α-helix	trans	-62.3	-40.7	173.5	-74.8	-65.5	0	0	0	112.7	L279 L280 R281 I285 D286 Y287	L279-F283 WeakPolarHBondContact O-CD2 3.41Å; L279-F283 PolarHBondContact O-N 3.06Å; L280-F283 PolarHBondContact O-N 2.95Å; R281-F283 VanDerWaalsContact C-N 3.3Å; R281-F283 PolarHBondContact O-N 2.8Å; F283-I285 VanDerWaalsContact C-N 3.3Å; F283-I285 PolarHBondContact O-N 2.02Å; F283-D286 PolarHBondContact O-N 3.18Å; F283-Y287 VanDerWaalsContact O-CD2 3.28Å; F283-Y287 WeakPolarHBondContact O-CD2 3.38Å; F283-Y287 PolarHBondContact O-N 2.97Å
284	S	85.9	Confident	75	Confident	72 Å²	72	113.7 Å²	113.7	50%	0.503	63%	0.626	S	S	.	*	H	α-helix	trans	-65.2	-26.1	-177.9	69.8	0	0	0	0	115.1	L280 R281 A282	L280-S284 PolarHBondContact O-N 3.05Å; R281-S284 WeakPolarHBondContact CA-OG 3.43Å; R281-S284 PolarHBondContact O-N 3.23Å; R281-S284 VanDerWaalsContact O-N 3.11Å; R281-S284 PolarHBondContact O-OG 3.05Å; A282-S284 PolarHBondContact O-N 2.87Å
285	I	77	Confident	73.1	Confident	120 Å²	120	120.6 Å²	120.6	62%	0.615	65%	0.647	S	S	*	*	H	α-helix	trans	-75.3	-35.2	-179.4	-66.3	169.4	0	0	0	111	R281 A282 F283 Y287	R281-I285 PolarHBondContact O-N 2Å; A282-I285 PolarHBondContact O-N 2.98Å; F283-I285 VanDerWaalsContact C-N 3.3Å; F283-I285 PolarHBondContact O-N 2.02Å; I285-Y287 VanDerWaalsContact C-N 3.32Å
286	D	73.9	Confident	71.4	Confident	134 Å²	134	124.4 Å²	124.4	72%	0.717	66%	0.659	S	S	*	*	H	α-helix	trans	-74.1	-24.8	179.6	-69.6	-25.1	0	0	0	112.5	F283 T288	F283-D286 PolarHBondContact O-N 3.18Å; D286-T288 PolarHBondContact O-N 2.81Å
287	Y	59.8	Low	69.5	Low	183 Å²	183	130.6 Å²	130.6	72%	0.718	68%	0.679	S	S	*	*			trans	-92.7	63.7	169.1	-66.5	-84.3	0	0	0	110.7	F283 I285 P289	F283-Y287 VanDerWaalsContact O-CD2 3.28Å; F283-Y287 WeakPolarHBondContact O-CD2 3.38Å; F283-Y287 PolarHBondContact O-N 2.97Å; I285-Y287 VanDerWaalsContact C-N 3.32Å; Y287-P289 WeakPolarHBondContact O-CD 3.02Å
288	T	61.2	Low	67.6	Low	116 Å²	116	134.5 Å²	134.5	71%	0.712	70%	0.695	S	S	*	*			trans	-85.8	95.5	149.6	42.6	0	0	0	0	106.8	D286 F290	D286-T288 PolarHBondContact O-N 2.81Å; T288-F290 PolarHBondContact O-N 2.74Å
289	P	59.3	Low	65.9	Low	110 Å²	110	135.6 Å²	135.6	71%	0.714	71%	0.708	S	S	*	*			trans	-64.6	113.5	-178.5	27.9	-34.2	0	0	0	108.2	Y287 G291	Y287-P289 WeakPolarHBondContact O-CD 3.02Å; P289-G291 PolarHBondContact O-N 3.28Å
290	F	57.5	Low	64.1	Low	219 Å²	219	134.5 Å²	134.5	96%	0.961	71%	0.714	S	S	*	*			trans	20	101.8	151.4	-76.1	-88.6	0	0	0	117	T288	T288-F290 PolarHBondContact O-N 2.74Å
291	G	51.6	Low	62.7	Low	75 Å²	75	134.8 Å²	134.8	77%	0.773	72%	0.72	S	S	*	*			trans	158.4	94.1	159.6	0	0	0	0	0	110	P289	P289-G291 PolarHBondContact O-N 3.28Å
292	T	50.7	Low	60.9	Low	119 Å²	119	132.6 Å²	132.6	73%	0.73	72%	0.723	S	S	*	*			cis	-146.5	155.5	26	39.1	0	0	0	0	108.5	I294	T292-I294 PolarHBondContact O-N 2.99Å
293	P	51.1	Low	59.5	Low	124 Å²	124	135.7 Å²	135.7	81%	0.805	74%	0.741	S	S	*	*			trans	-56.7	111.2	172.2	25.2	-32.6	0	0	0	108.1	R295	P293-R295 PolarHBondContact O-N 3.08Å
294	I	55.7	Low	58.3	Low	162 Å²	162	135.5 Å²	135.5	83%	0.831	75%	0.752	S	S	*	*			trans	-66.9	89.6	162.6	-61.7	179.2	0	0	0	104.2	T292 K296	T292-I294 PolarHBondContact O-N 2.99Å; I294-K296 PolarHBondContact O-N 3.13Å; I294-K296 VanDerWaalsContact O-N 3.1Å
295	R	52	Low	56.7	Low	215 Å²	215	139.6 Å²	139.6	81%	0.811	77%	0.768	S	S	*	*			trans	-34.2	118.2	161.8	-169.5	179.8	-153.2	168.6	5.1	106.1	P293 Q297	P293-R295 PolarHBondContact O-N 3.08Å; R295-Q297 PolarHBondContact O-N 2.96Å
296	K	54.8	Low	55.5	Low	181 Å²	181	140.8 Å²	140.8	79%	0.787	78%	0.775	S	S	*	*			trans	-48.7	92.1	163.3	-72.1	175.6	174.8	178.9	0	107.2	I294 Q298	I294-K296 PolarHBondContact O-N 3.13Å; I294-K296 VanDerWaalsContact O-N 3.1Å; K296-Q298 PolarHBondContact O-N 3.03Å
297	Q	52.4	Low	54.7	Low	180 Å²	180	140.2 Å²	140.2	84%	0.841	78%	0.778	S	S	*	*			trans	-75.3	82	151.1	-87.5	-175.7	-23.2	0	0	104.3	R295 A299	R295-Q297 PolarHBondContact O-N 2.96Å; Q297-A299 PolarHBondContact O-N 3.45Å
298	Q	51.6	Low	54.8	Low	161 Å²	161	138 Å²	138	75%	0.752	78%	0.778	S	S	*	*			trans	-56.4	94.8	154.4	-156.8	121.8	-16.6	0	0	104.9	K296 A300	K296-Q298 PolarHBondContact O-N 3.03Å; Q298-A300 PolarHBondContact O-N 3.44Å
299	A	54	Low	54.4	Low	87 Å²	87	139.9 Å²	139.9	72%	0.719	78%	0.783	S	S	*	*			trans	-69.3	84.8	164.5	0	0	0	0	0	106.2	Q297 V301	Q297-A299 PolarHBondContact O-N 3.45Å; A299-V301 VanDerWaalsContact C-N 3.25Å; A299-V301 PolarHBondContact O-N 3.47Å; A299-V301 VanDerWaalsContact O-N 3.12Å
300	A	51.6	Low	54.4	Low	84 Å²	84	143.5 Å²	143.5	69%	0.694	81%	0.807	S	S	*	*			trans	-62.1	97.4	149.3	0	0	0	0	0	105.9	Q298	Q298-A300 PolarHBondContact O-N 3.44Å
301	V	58.6	Low	54.3	Low	121 Å²	121	139.8 Å²	139.8	73%	0.733	80%	0.799	S	S	*	*			trans	-132.6	85.4	159	-177.3	0	0	0	0	105.9	A299	A299-V301 VanDerWaalsContact C-N 3.25Å; A299-V301 PolarHBondContact O-N 3.47Å; A299-V301 VanDerWaalsContact O-N 3.12Å
302	D	48.7	Very low	54.4	Low	137 Å²	137	143.2 Å²	143.2	73%	0.733	80%	0.801	S	S	*	*			trans	43.3	109.3	134.1	-56.4	-24.2	0	0	0	117.9	P304	D302-P304 WeakPolarHBondContact O-CD 3.23Å
303	S	54.9	Low	54.6	Low	119 Å²	119	144.5 Å²	144.5	83%	0.832	80%	0.804	S	S	*	*			trans	-49.7	122.3	150.3	-53.5	0	0	0	0	111.5	L305	S303-L305 PolarHBondContact O-N 3.48Å
304	P	62.5	Low	54.8	Low	126 Å²	126	145.7 Å²	145.7	82%	0.818	80%	0.804	S	S	*	*			trans	-83.5	106.8	152.5	21.3	-8.7	0	0	0	108.7	D302	D302-P304 WeakPolarHBondContact O-CD 3.23Å
305	L	52	Low	54.8	Low	159 Å²	159	144.7 Å²	144.7	83%	0.832	80%	0.803	S	S	*	*			trans	11.2	124.2	144.5	-73	155	0	0	0	118.2	S303	S303-L305 PolarHBondContact O-N 3.48Å
306	L	51.2	Low	55	Low	144 Å²	144	140 Å²	140	75%	0.754	80%	0.802	S	S	*	*			trans	-33.9	141.2	149.4	-75.2	132.8	0	0	0	113.9	I308	L306-I308 HydrophobicContact CD2-CD1 4.31Å; L306-I308 HydrophobicContact CD2-CG1 3.96Å
307	P	57	Low	55	Low	122 Å²	122	137.1 Å²	137.1	79%	0.792	80%	0.803	S	S	*	*			trans	-106.2	110.9	136.5	29.9	-19.7	0	0	0	109.3
308	I	61.6	Low	55.2	Low	138 Å²	138	133.8 Å²	133.8	71%	0.708	80%	0.8	S	S	*	*			trans	-83.1	125.3	154.9	-66.1	166.3	0	0	0	105.6	L306	L306-I308 HydrophobicContact CD2-CD1 4.31Å; L306-I308 HydrophobicContact CD2-CG1 3.96Å
309	N	52.8	Low	55.5	Low	155 Å²	155	131.5 Å²	131.5	83%	0.829	80%	0.804	S	S	*	*			trans	-129.2	149.7	159.7	-115.9	-10.5	0	0	0	107.1
310	P	60.9	Low	55.6	Low	186 Å²	186	135.5 Å²	135.5	100%	1.208	81%	0.812	S	S	*	*				-76.1	0	-123.3	28	-37.1	0	0	0	116.2

Retrieved 310 of 310 residues in 513.3 ms (Link to these results)

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