C4Q310_SCHMA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession C4Q310, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 219 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	39.5	Very low	37.9	Very low	102 Å²	102	72.5 Å²	72.5	50%	0.502	41%	0.41	S	S	.	.				0	115.5	0	-172.5	172.9	-178.6	0	0	107.5	L3 T49 G181 M184	M1-L3 PolarHBondContact O-N 3.38Å; M1-T49 PolarHBondContact N-OG1 3.3Å; M1-G181 WeakPolarHBondContact CE-O 3.42Å; M1-M184 HydrophobicContact CE-CB 4.48Å; M1-M184 WeakPolarHBondContact CE-O 3.33Å
2	A	37	Very low	37.3	Very low	73 Å²	73	70.9 Å²	70.9	60%	0.603	41%	0.407	S	S	*	.			trans	-82.3	105.3	172.9	0	0	0	0	0	107.4	R4	A2-R4 PolarHBondContact O-N 3.4Å
3	L	41.9	Very low	37.2	Very low	30 Å²	30	78.3 Å²	78.3	16%	0.157	44%	0.442	C	S	.	.			trans	-53.5	133.2	172.7	-66.3	170.2	0	0	0	108.8	M1 L65 M195	M1-L3 PolarHBondContact O-N 3.38Å; L3-L65 HydrophobicContact CD1-CD1 3.76Å; L3-L65 HydrophobicContact CD1-CD2 3.39Å; L3-L65 HydrophobicContact CD1-CG 4.16Å; L3-M195 HydrophobicContact CD2-CE 3.62Å; L3-M195 HydrophobicContact CD2-SD 3.92Å
4	R	36.5	Very low	37.1	Very low	95 Å²	95	77.4 Å²	77.4	36%	0.358	43%	0.434	S	S	.	.			trans	-54.3	158.3	-172.8	-88.9	-168.7	177.8	-170.1	13.6	111.5	A2 S6 F7 R8 P186 D192	A2-R4 PolarHBondContact O-N 3.4Å; R4-S6 VanDerWaalsContact CB-OG 3.31Å; R4-S6 WeakPolarHBondContact CB-OG 3.28Å; R4-S6 PolarHBondContact O-N 2.93Å; R4-F7 PolarHBondContact O-N 3.3Å; R4-F7 VanDerWaalsContact O-N 3.09Å; R4-R8 PolarHBondContact O-N 3.06Å; R4-P186 PolarHBondContact NH2-O 3.47Å; R4-P186 VanDerWaalsContact NH2-O 3.15Å; R4-D192 VanDerWaalsContact CZ-CG 3.49Å; R4-D192 IonicContact CZ-OD1 2.79Å; R4-D192 IonicContact CZ-OD2 3.36Å; R4-D192 IonicContact NE-OD1 3.33Å; R4-D192 PolarHBondContact NE-OD1 3.38Å; R4-D192 IonicContact NH1-OD1 2.77Å; R4-D192 PolarHBondContact NH1-OD1 2.9Å; R4-D192 IonicContact NH1-OD2 2.81Å; R4-D192 PolarHBondContact NH1-OD2 3.39Å; R4-D192 IonicContact NH2-OD1 3.06Å; R4-D192 PolarHBondContact NH2-OD1 3.47Å; R4-D192 IonicContact NH2-OD2 3.25Å; R4-D192 PolarHBondContact NH2-OD2 3.33Å
5	P	38.6	Very low	37.4	Very low	71 Å²	71	85.8 Å²	85.8	46%	0.461	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-9.8	164	-21.8	32	0	0	0	116.3	R8 L9	P5-R8 VanDerWaalsContact CA-CB 3.5Å; P5-R8 HydrophobicContact CB-CB 4.15Å; P5-R8 HydrophobicContact CB-CG 4.33Å; P5-R8 CarbonylContact O-C 3.15Å; P5-R8 VanDerWaalsContact O-CA 3.28Å; P5-R8 WeakPolarHBondContact O-CA 3.23Å; P5-R8 WeakPolarHBondContact O-CB 3.47Å; P5-R8 PolarHBondContact O-N 3.36Å; P5-R8 VanDerWaalsContact O-N 3.08Å; P5-L9 HydrophobicContact CB-CD1 4.47Å; P5-L9 WeakPolarHBondContact O-CA 3.26Å; P5-L9 WeakPolarHBondContact O-CB 3.36Å; P5-L9 WeakPolarHBondContact O-CD1 3.33Å; P5-L9 PolarHBondContact O-N 3.36Å
6	S	38.5	Very low	37	Very low	48 Å²	48	90.6 Å²	90.6	34%	0.336	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-38.4	170.6	42	0	0	0	0	112.3	R4 R8 L9 A10	R4-S6 VanDerWaalsContact CB-OG 3.31Å; R4-S6 WeakPolarHBondContact CB-OG 3.28Å; R4-S6 PolarHBondContact O-N 2.93Å; S6-R8 VanDerWaalsContact C-N 3.29Å; S6-L9 PolarHBondContact O-N 3.05Å; S6-A10 PolarHBondContact O-N 3.35Å
7	F	37.9	Very low	36.7	Very low	30 Å²	30	92.7 Å²	92.7	13%	0.132	49%	0.492	C	S	.	.	H	α-helix	trans	-65.5	-36.1	162.3	-111.9	-98.8	0	0	0	110.7	R4 L9 M195 M198 A199	R4-F7 PolarHBondContact O-N 3.3Å; R4-F7 VanDerWaalsContact O-N 3.09Å; F7-L9 PolarHBondContact O-N 3.34Å; F7-M195 HydrophobicContact CD2-CE 3.14Å; F7-M195 HydrophobicContact CE2-CE 3.32Å; F7-M195 HydrophobicContact CG-CE 4.14Å; F7-M195 HydrophobicContact CZ-CE 4.43Å; F7-M198 HydrophobicContact CE2-CB 4.19Å; F7-M198 HydrophobicContact CZ-CB 4.33Å; F7-A199 HydrophobicContact CE2-CB 3.9Å; F7-A199 HydrophobicContact CZ-CB 4.22Å
8	R	41.3	Very low	36.4	Very low	113 Å²	113	92.6 Å²	92.6	43%	0.426	50%	0.497	S	S	.	.	H	α-helix	trans	-69.7	-13.3	173.4	-46.1	173	-175.3	-163.6	-10.8	114.4	R4 P5 S6 S12	R4-R8 PolarHBondContact O-N 3.06Å; P5-R8 VanDerWaalsContact CA-CB 3.5Å; P5-R8 HydrophobicContact CB-CB 4.15Å; P5-R8 HydrophobicContact CB-CG 4.33Å; P5-R8 CarbonylContact O-C 3.15Å; P5-R8 VanDerWaalsContact O-CA 3.28Å; P5-R8 WeakPolarHBondContact O-CA 3.23Å; P5-R8 WeakPolarHBondContact O-CB 3.47Å; P5-R8 PolarHBondContact O-N 3.36Å; P5-R8 VanDerWaalsContact O-N 3.08Å; S6-R8 VanDerWaalsContact C-N 3.29Å; R8-S12 PolarHBondContact O-N 2.69Å; R8-S12 PolarHBondContact O-OG 3.01Å
9	L	33.5	Very low	36.6	Very low	126 Å²	126	99.5 Å²	99.5	66%	0.66	52%	0.516	S	S	*	.	H	α-helix	trans	-98.1	-27.5	-175.2	-107.7	129.9	0	0	0	111.2	P5 S6 F7 S11 S12	P5-L9 HydrophobicContact CB-CD1 4.47Å; P5-L9 WeakPolarHBondContact O-CA 3.26Å; P5-L9 WeakPolarHBondContact O-CB 3.36Å; P5-L9 WeakPolarHBondContact O-CD1 3.33Å; P5-L9 PolarHBondContact O-N 3.36Å; S6-L9 PolarHBondContact O-N 3.05Å; F7-L9 PolarHBondContact O-N 3.34Å; L9-S11 PolarHBondContact O-N 3.1Å; L9-S12 WeakPolarHBondContact CA-OG 3.29Å
10	A	34.7	Very low	36.4	Very low	85 Å²	85	103 Å²	103	70%	0.702	53%	0.527	S	S	*	.	H	α-helix	trans	-65.2	-29.2	165.4	0	0	0	0	0	112.2	S6	S6-A10 PolarHBondContact O-N 3.35Å
11	S	37.5	Very low	36.4	Very low	24 Å²	24	104 Å²	104	17%	0.168	54%	0.543	C	S	.	.	S	Bend	trans	-104.3	6.5	177.3	71.5	0	0	0	0	115.5	L9 I13 L14	L9-S11 PolarHBondContact O-N 3.1Å; S11-I13 PolarHBondContact O-N 2.86Å; S11-L14 PolarHBondContact O-N 3.05Å; S11-L14 VanDerWaalsContact O-N 3.15Å
12	S	31.3	Very low	36.4	Very low	54 Å²	54	102.8 Å²	102.8	38%	0.378	55%	0.545	S	S	.	.	G	3₁₀ helix	trans	-62	-14.4	-173.2	-82.9	0	0	0	0	116.2	R8 L9 L14	R8-S12 PolarHBondContact O-N 2.69Å; R8-S12 PolarHBondContact O-OG 3.01Å; L9-S12 WeakPolarHBondContact CA-OG 3.29Å; S12-L14 VanDerWaalsContact C-N 3.3Å; S12-L14 PolarHBondContact O-N 3.34Å
13	I	35	Very low	37	Very low	167 Å²	167	103.3 Å²	103.3	86%	0.856	54%	0.544	S	S	*	.	G	3₁₀ helix	trans	-78.8	-13.6	179.3	-65.9	178.2	0	0	0	112.2	S11	S11-I13 PolarHBondContact O-N 2.86Å
14	L	36.5	Very low	37.9	Very low	65 Å²	65	105.1 Å²	105.1	34%	0.34	56%	0.556	S	S	.	*	G	3₁₀ helix	trans	-99.4	4.4	-167.4	-83	148.4	0	0	0	116.8	S11 S12 L16 L17 E75	S11-L14 PolarHBondContact O-N 3.05Å; S11-L14 VanDerWaalsContact O-N 3.15Å; S12-L14 VanDerWaalsContact C-N 3.3Å; S12-L14 PolarHBondContact O-N 3.34Å; L14-L16 PolarHBondContact O-N 2.83Å; L14-L17 HydrophobicContact CD2-CD1 3.84Å; L14-E75 WeakPolarHBondContact CD1-OE1 3.27Å; L14-E75 VanDerWaalsContact CD2-OE1 3.22Å; L14-E75 WeakPolarHBondContact CD2-OE1 3.37Å
15	R	40.9	Very low	39.3	Very low	204 Å²	204	103 Å²	103	77%	0.77	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.8	-7.1	-179.9	-74.1	-170.5	-172.1	176.3	7.1	115.9
16	L	30.9	Very low	41.3	Very low	163 Å²	163	101.1 Å²	101.1	85%	0.853	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.8	0.9	-172.2	-71.3	172.1	0	0	0	115.2	L14	L14-L16 PolarHBondContact O-N 2.83Å
17	L	31.9	Very low	43.4	Very low	126 Å²	126	100.2 Å²	100.2	66%	0.66	54%	0.539	S	S	*	.	S	Bend	trans	-84.1	125.3	167.8	-66.7	-179.4	0	0	0	108.5	L14 R19	L14-L17 HydrophobicContact CD2-CD1 3.84Å; L17-R19 PolarHBondContact O-N 2.94Å; L17-R19 VanDerWaalsContact O-N 3.15Å
18	P	32.8	Very low	46	Very low	91 Å²	91	100.4 Å²	100.4	59%	0.591	54%	0.543	S	S	*	.			trans	-48.4	128.5	169.3	-21.3	30.3	0	0	0	107.4	F20	P18-F20 HydrophobicContact CB-CD2 4.42Å; P18-F20 HydrophobicContact CB-CE2 4.36Å; P18-F20 WeakPolarHBondContact O-CD2 3.39Å; P18-F20 PolarHBondContact O-N 3.07Å
19	R	39	Very low	48.3	Very low	224 Å²	224	99.2 Å²	99.2	85%	0.845	56%	0.557	S	S	*	*			trans	-60.5	80.8	167.4	-72.5	-176.9	179.2	-163.8	-5	106.8	L17 S21	L17-R19 PolarHBondContact O-N 2.94Å; L17-R19 VanDerWaalsContact O-N 3.15Å; R19-S21 PolarHBondContact O-N 3.18Å
20	F	33.3	Very low	51	Low	169 Å²	169	96.5 Å²	96.5	74%	0.741	56%	0.56	S	S	*	*			trans	-52.8	129.1	161.3	-82.5	-84.8	0	0	0	104.3	P18 S22	P18-F20 HydrophobicContact CB-CD2 4.42Å; P18-F20 HydrophobicContact CB-CE2 4.36Å; P18-F20 WeakPolarHBondContact O-CD2 3.39Å; P18-F20 PolarHBondContact O-N 3.07Å; F20-S22 PolarHBondContact O-N 2.86Å
21	S	35.9	Very low	53.8	Low	124 Å²	124	92.8 Å²	92.8	87%	0.867	53%	0.529	S	S	*	.			trans	-57.2	84.5	163.2	-176.7	0	0	0	0	105.6	R19 S23	R19-S21 PolarHBondContact O-N 3.18Å; S21-S23 VanDerWaalsContact C-N 3.31Å; S21-S23 PolarHBondContact O-N 3.24Å
22	S	41	Very low	56.6	Low	76 Å²	76	92 Å²	92	53%	0.531	52%	0.523	S	S	.	.			trans	-69.6	101.5	177.5	45	0	0	0	0	103.1	F20 V24	F20-S22 PolarHBondContact O-N 2.86Å; S22-V24 PolarHBondContact O-N 3.32Å
23	S	49.3	Very low	59.7	Low	85 Å²	85	89.6 Å²	89.6	59%	0.594	51%	0.506	S	S	*	.			trans	-51.5	104.9	156.6	52.5	0	0	0	0	105.3	S21 S25	S21-S23 VanDerWaalsContact C-N 3.31Å; S21-S23 PolarHBondContact O-N 3.24Å; S23-S25 PolarHBondContact O-N 2.82Å
24	V	59.2	Low	62.5	Low	68 Å²	68	82.8 Å²	82.8	41%	0.412	47%	0.471	S	S	.	.			trans	-54.2	112.2	172	176.9	0	0	0	0	103.9	S22 L37 I70	S22-V24 PolarHBondContact O-N 3.32Å; V24-L37 HydrophobicContact CG1-CD1 4.09Å; V24-L37 HydrophobicContact CG1-CD2 4.44Å; V24-I70 HydrophobicContact CG2-CG2 4.19Å
25	S	66.4	Low	65.4	Low	49 Å²	49	83.4 Å²	83.4	34%	0.343	47%	0.469	S	S	.	.			trans	-54.7	142.6	-177.8	-15.6	0	0	0	0	107.1	S23 K33	S23-S25 PolarHBondContact O-N 2.82Å; S25-K33 VanDerWaalsContact CB-NZ 3.28Å; S25-K33 WeakPolarHBondContact O-CE 3.44Å; S25-K33 PolarHBondContact O-NZ 3.37Å; S25-K33 PolarHBondContact OG-NZ 3.01Å
26	P	80.2	Confident	68	Low	32 Å²	32	73.7 Å²	73.7	21%	0.208	43%	0.432	C	S	.	.			trans	-51.4	151.9	-173.6	15.9	-28.2	0	0	0	112.4	E140 Q141 E144	P26-E140 VanDerWaalsContact CD-OE2 3.28Å; P26-E140 WeakPolarHBondContact CD-OE2 3.43Å; P26-E140 VanDerWaalsContact CG-C 3.44Å; P26-E140 HydrophobicContact CG-CB 3.55Å; P26-Q141 HydrophobicContact CB-CB 4.35Å; P26-Q141 HydrophobicContact CG-CB 4.17Å; P26-E144 HydrophobicContact CG-CG 4.47Å
27	A	84.1	Confident	71.1	Confident	30 Å²	30	67.2 Å²	67.2	25%	0.248	40%	0.398	C	S	.	.			trans	-118.1	135.1	171.5	0	0	0	0	0	108.4	K33 D34 L37	A27-K33 HydrophobicContact CB-CB 4.3Å; A27-K33 HydrophobicContact CB-CD 4.26Å; A27-K33 HydrophobicContact CB-CG 4.01Å; A27-D34 HydrophobicContact CB-CB 4.03Å; A27-L37 HydrophobicContact CB-CD1 4.02Å
28	V	91	Very high	74	Confident	34 Å²	34	65.6 Å²	65.6	21%	0.206	39%	0.386	C	S	.	.			trans	-78	129	171.5	-177.6	0	0	0	0	108	G30 G31 D34 E144 E145 E148	V28-G30 PolarHBondContact O-N 3.47Å; V28-G31 WeakPolarHBondContact O-CA 3.48Å; V28-G31 PolarHBondContact O-N 2.85Å; V28-D34 VanDerWaalsContact O-CB 3.24Å; V28-D34 WeakPolarHBondContact O-CB 3.06Å; V28-E144 HydrophobicContact CG2-CB 4.12Å; V28-E145 HydrophobicContact CG2-CG 3.93Å; V28-E148 HydrophobicContact CB-CG 3.91Å; V28-E148 HydrophobicContact CG1-CG 4.44Å; V28-E148 HydrophobicContact CG2-CB 4.39Å; V28-E148 HydrophobicContact CG2-CG 3.86Å
29	A	90.1	Very high	77	Confident	87 Å²	87	61.7 Å²	61.7	72%	0.719	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	129.4	179.7	0	0	0	0	0	111.6	G31	A29-G31 PolarHBondContact O-N 3.28Å
30	G	90.1	Very high	79.6	Confident	70 Å²	70	51 Å²	51	72%	0.722	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.3	-3.3	-176.5	0	0	0	0	0	115	V28 D34	V28-G30 PolarHBondContact O-N 3.47Å; G30-D34 PolarHBondContact N-OD2 3.44Å
31	G	94.3	Very high	82.4	Confident	6 Å²	6	44.9 Å²	44.9	6%	0.062	30%	0.296	C	S	.	.	S	Bend	trans	-71.6	169.7	172.2	0	0	0	0	0	112.8	V28 A29 K33 D34 R35 E148	V28-G31 WeakPolarHBondContact O-CA 3.48Å; V28-G31 PolarHBondContact O-N 2.85Å; A29-G31 PolarHBondContact O-N 3.28Å; G31-K33 VanDerWaalsContact C-N 3.31Å; G31-K33 PolarHBondContact O-N 2.98Å; G31-D34 PolarHBondContact O-N 3.24Å; G31-R35 PolarHBondContact O-N 3.21Å; G31-E148 WeakPolarHBondContact CA-OE1 3.41Å
32	I	95.6	Very high	85	Confident	7 Å²	7	44 Å²	44	4%	0.036	28%	0.282	C	S	.	.	H	α-helix	trans	-66.8	-33.9	-177.3	-169.9	62.5	0	0	0	112.3	R35 M36 E148 F167 Y209 I212 M216	I32-R35 PolarHBondContact O-N 2.9Å; I32-M36 PolarHBondContact O-N 3.31Å; I32-E148 PolarHBondContact N-OE1 2.98Å; I32-F167 HydrophobicContact CD1-CD1 4.16Å; I32-F167 HydrophobicContact CD1-CD2 4.09Å; I32-F167 HydrophobicContact CD1-CE1 4.02Å; I32-F167 HydrophobicContact CD1-CE2 3.92Å; I32-F167 HydrophobicContact CD1-CG 4.2Å; I32-F167 HydrophobicContact CD1-CZ 3.88Å; I32-Y209 HydrophobicContact CG1-CD2 4.1Å; I32-Y209 HydrophobicContact CG1-CE2 4.32Å; I32-Y209 HydrophobicContact CG2-CE2 4.43Å; I32-I212 HydrophobicContact CB-CG2 4.31Å; I32-I212 HydrophobicContact CD1-CD1 4.21Å; I32-I212 HydrophobicContact CG1-CD1 4.21Å; I32-I212 HydrophobicContact CG1-CG2 4.07Å; I32-I212 HydrophobicContact CG2-CG2 3.94Å; I32-M216 HydrophobicContact CG2-CE 4.32Å; I32-M216 HydrophobicContact CG2-SD 3.56Å; I32-M216 VanDerWaalsContact CG2-SD 3.56Å
33	K	95.5	Very high	87.3	Confident	5 Å²	5	41.1 Å²	41.1	2%	0.022	26%	0.26	C	S	.	.	H	α-helix	trans	-66.7	-45.5	174.8	-176.9	172.2	-169.9	-175.8	0	111.5	S25 A27 G31 R35 M36 L37 Y209	S25-K33 VanDerWaalsContact CB-NZ 3.28Å; S25-K33 WeakPolarHBondContact O-CE 3.44Å; S25-K33 PolarHBondContact O-NZ 3.37Å; S25-K33 PolarHBondContact OG-NZ 3.01Å; A27-K33 HydrophobicContact CB-CB 4.3Å; A27-K33 HydrophobicContact CB-CD 4.26Å; A27-K33 HydrophobicContact CB-CG 4.01Å; G31-K33 VanDerWaalsContact C-N 3.31Å; G31-K33 PolarHBondContact O-N 2.98Å; K33-R35 VanDerWaalsContact C-N 3.3Å; K33-R35 PolarHBondContact O-N 2.92Å; K33-M36 PolarHBondContact O-N 2.61Å; K33-L37 HydrophobicContact CG-CD1 4.16Å; K33-L37 HydrophobicContact CG-CG 4.47Å; K33-L37 WeakPolarHBondContact O-CG 3.34Å; K33-L37 PolarHBondContact O-N 2.63Å; K33-Y209 HydrophobicContact CB-CE2 4.49Å; K33-Y209 WeakPolarHBondContact CB-OH 3.27Å; K33-Y209 WeakPolarHBondContact CG-OH 3.4Å
34	D	95.7	Very high	89	Confident	24 Å²	24	45.8 Å²	45.8	13%	0.128	27%	0.265	C	S	.	.	H	α-helix	trans	-60	-42	175	178.3	61.8	0	0	0	111	A27 V28 G30 G31 L37 K38	A27-D34 HydrophobicContact CB-CB 4.03Å; V28-D34 VanDerWaalsContact O-CB 3.24Å; V28-D34 WeakPolarHBondContact O-CB 3.06Å; G30-D34 PolarHBondContact N-OD2 3.44Å; G31-D34 PolarHBondContact O-N 3.24Å; D34-L37 PolarHBondContact O-N 2.83Å; D34-K38 WeakPolarHBondContact O-CB 3.37Å; D34-K38 WeakPolarHBondContact O-CG 3.43Å; D34-K38 PolarHBondContact O-N 3.38Å; D34-K38 VanDerWaalsContact OD1-CE 3.24Å; D34-K38 WeakPolarHBondContact OD1-CE 3.43Å; D34-K38 IonicContact OD1-NZ 3.19Å; D34-K38 PolarHBondContact OD1-NZ 3.07Å; D34-K38 WeakPolarHBondContact OD2-CE 3.44Å; D34-K38 IonicContact OD2-NZ 3.23Å; D34-K38 PolarHBondContact OD2-NZ 2.68Å
35	R	96.2	Very high	90.3	Very high	77 Å²	77	43.8 Å²	43.8	29%	0.291	25%	0.252	S	S	.	.	H	α-helix	trans	-60.7	-46.4	174.7	-175	179	179.4	-177.7	2.2	112.6	G31 I32 K33 K38 F39 F167 D168 E171	G31-R35 PolarHBondContact O-N 3.21Å; I32-R35 PolarHBondContact O-N 2.9Å; K33-R35 VanDerWaalsContact C-N 3.3Å; K33-R35 PolarHBondContact O-N 2.92Å; R35-K38 PolarHBondContact O-N 3.27Å; R35-F39 WeakPolarHBondContact O-CB 3.23Å; R35-F39 PolarHBondContact O-N 3.37Å; R35-F167 HydrophobicContact CG-CE1 4.08Å; R35-D168 IonicContact CZ-OD1 2.62Å; R35-D168 IonicContact NH1-OD1 3.12Å; R35-D168 PolarHBondContact NH1-OD1 3.32Å; R35-D168 IonicContact NH2-OD1 2.89Å; R35-D168 PolarHBondContact NH2-OD1 3.02Å; R35-E171 IonicContact CZ-OE2 3.89Å; R35-E171 IonicContact NE-OE2 2.66Å; R35-E171 PolarHBondContact NE-OE2 3.03Å; R35-E171 IonicContact NH2-OE2 2.71Å; R35-E171 PolarHBondContact NH2-OE2 3.23Å
36	M	95.9	Very high	91.2	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-63.1	-44.1	177.1	-177.6	63.5	102.4	0	0	111.6	I32 K33 F39 I40 I73 F167 W202 M205 Y209	I32-M36 PolarHBondContact O-N 3.31Å; K33-M36 PolarHBondContact O-N 2.61Å; M36-F39 WeakPolarHBondContact O-CB 3.42Å; M36-F39 PolarHBondContact O-N 3Å; M36-I40 PolarHBondContact O-N 3.16Å; M36-I73 HydrophobicContact CE-CD1 3.48Å; M36-I73 VanDerWaalsContact CE-CD1 3.48Å; M36-I73 HydrophobicContact CG-CD1 3.66Å; M36-I73 HydrophobicContact CG-CG1 3.73Å; M36-I73 HydrophobicContact CG-CG2 4.05Å; M36-I73 HydrophobicContact SD-CD1 3.77Å; M36-I73 HydrophobicContact SD-CG1 4.31Å; M36-F167 HydrophobicContact CE-CE2 3.98Å; M36-F167 HydrophobicContact CE-CZ 4.42Å; M36-F167 HydrophobicContact SD-CZ 4.43Å; M36-W202 HydrophobicContact SD-CH2 4.11Å; M36-W202 HydrophobicContact SD-CZ3 4.03Å; M36-M205 HydrophobicContact CE-CE 4.23Å; M36-M205 HydrophobicContact CE-CG 3.9Å; M36-M205 HydrophobicContact CE-SD 4.48Å; M36-M205 HydrophobicContact SD-CE 3.84Å; M36-M205 HydrophobicContact SD-SD 4.44Å; M36-Y209 HydrophobicContact CB-CD2 3.96Å; M36-Y209 HydrophobicContact CB-CE2 3.78Å; M36-Y209 HydrophobicContact CE-CD1 4.39Å; M36-Y209 HydrophobicContact CE-CD2 3.98Å; M36-Y209 HydrophobicContact CE-CG 3.71Å; M36-Y209 HydrophobicContact CG-CD2 4.19Å; M36-Y209 HydrophobicContact CG-CE2 4.22Å
37	L	94.8	Very high	91.3	Very high	27 Å²	27	45.2 Å²	45.2	14%	0.141	25%	0.249	C	C	.	.	H	α-helix	trans	-62.7	-46.4	177.3	-70.1	174.6	0	0	0	111.1	V24 A27 K33 D34 F39 I40 T41 I70	V24-L37 HydrophobicContact CG1-CD1 4.09Å; V24-L37 HydrophobicContact CG1-CD2 4.44Å; A27-L37 HydrophobicContact CB-CD1 4.02Å; K33-L37 HydrophobicContact CG-CD1 4.16Å; K33-L37 HydrophobicContact CG-CG 4.47Å; K33-L37 WeakPolarHBondContact O-CG 3.34Å; K33-L37 PolarHBondContact O-N 2.63Å; D34-L37 PolarHBondContact O-N 2.83Å; L37-F39 VanDerWaalsContact C-N 3.33Å; L37-F39 PolarHBondContact O-N 3.1Å; L37-I40 CarbonylContact O-C 3.52Å; L37-I40 WeakPolarHBondContact O-CA 3.38Å; L37-I40 WeakPolarHBondContact O-CB 3.31Å; L37-I40 PolarHBondContact O-N 2.85Å; L37-T41 WeakPolarHBondContact O-CG2 3.34Å; L37-T41 PolarHBondContact O-N 3.45Å; L37-T41 PolarHBondContact O-OG1 2.81Å; L37-I70 HydrophobicContact CD2-CG1 4.16Å; L37-I70 HydrophobicContact CD2-CG2 4.38Å
38	K	94.4	Very high	90.6	Very high	92 Å²	92	47.1 Å²	47.1	40%	0.4	26%	0.255	S	S	.	.	H	α-helix	trans	-62.4	-37.2	176.6	-75.7	174.6	175	162.2	0	113.1	D34 R35 I40 T41 D42	D34-K38 WeakPolarHBondContact O-CB 3.37Å; D34-K38 WeakPolarHBondContact O-CG 3.43Å; D34-K38 PolarHBondContact O-N 3.38Å; D34-K38 VanDerWaalsContact OD1-CE 3.24Å; D34-K38 WeakPolarHBondContact OD1-CE 3.43Å; D34-K38 IonicContact OD1-NZ 3.19Å; D34-K38 PolarHBondContact OD1-NZ 3.07Å; D34-K38 WeakPolarHBondContact OD2-CE 3.44Å; D34-K38 IonicContact OD2-NZ 3.23Å; D34-K38 PolarHBondContact OD2-NZ 2.68Å; R35-K38 PolarHBondContact O-N 3.27Å; K38-I40 PolarHBondContact O-N 3.34Å; K38-T41 WeakPolarHBondContact CA-OG1 3.33Å; K38-T41 PolarHBondContact O-N 2.8Å; K38-D42 VanDerWaalsContact O-CB 3.27Å; K38-D42 WeakPolarHBondContact O-CB 3.47Å; K38-D42 PolarHBondContact O-N 2.87Å
39	F	94.9	Very high	89.1	Confident	9 Å²	9	50.8 Å²	50.8	4%	0.039	28%	0.278	C	S	.	.	H	α-helix	trans	-56.8	-33	171.8	173.7	-92.3	0	0	0	111.8	R35 M36 L37 N43 E171 L174 L178 W202 M205	R35-F39 WeakPolarHBondContact O-CB 3.23Å; R35-F39 PolarHBondContact O-N 3.37Å; M36-F39 WeakPolarHBondContact O-CB 3.42Å; M36-F39 PolarHBondContact O-N 3Å; L37-F39 VanDerWaalsContact C-N 3.33Å; L37-F39 PolarHBondContact O-N 3.1Å; F39-N43 WeakPolarHBondContact O-CB 3.45Å; F39-E171 HydrophobicContact CD2-CG 3.64Å; F39-E171 HydrophobicContact CE2-CG 3.98Å; F39-L174 HydrophobicContact CE1-CD2 3.59Å; F39-L174 HydrophobicContact CE1-CG 4.38Å; F39-L174 HydrophobicContact CZ-CB 4.1Å; F39-L174 HydrophobicContact CZ-CD2 3.43Å; F39-L174 VanDerWaalsContact CZ-CD2 3.43Å; F39-L174 HydrophobicContact CZ-CG 3.76Å; F39-L178 HydrophobicContact CZ-CD1 3.94Å; F39-W202 HydrophobicContact CD1-CZ3 4.18Å; F39-W202 HydrophobicContact CE1-CE3 4.45Å; F39-W202 HydrophobicContact CE1-CZ3 4.04Å; F39-M205 HydrophobicContact CD1-CE 4.25Å; F39-M205 HydrophobicContact CD2-CE 4.46Å; F39-M205 HydrophobicContact CE1-SD 4.44Å; F39-M205 HydrophobicContact CG-CE 4.15Å
40	I	93.5	Very high	87.3	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-84.5	-51.1	177.1	-57.4	164	0	0	0	110.9	M36 L37 K38 L46 Q66 L69 I70 I73 W202	M36-I40 PolarHBondContact O-N 3.16Å; L37-I40 CarbonylContact O-C 3.52Å; L37-I40 WeakPolarHBondContact O-CA 3.38Å; L37-I40 WeakPolarHBondContact O-CB 3.31Å; L37-I40 PolarHBondContact O-N 2.85Å; K38-I40 PolarHBondContact O-N 3.34Å; I40-L46 HydrophobicContact CG2-CD1 4.27Å; I40-Q66 HydrophobicContact CG2-CB 3.81Å; I40-Q66 HydrophobicContact CG2-CG 3.93Å; I40-Q66 PolarHBondContact O-NE2 3.33Å; I40-L69 HydrophobicContact CD1-CB 3.99Å; I40-L69 HydrophobicContact CG1-CB 4.23Å; I40-L69 HydrophobicContact CG2-CB 4.01Å; I40-L69 HydrophobicContact CG2-CD1 4.28Å; I40-I70 HydrophobicContact CB-CG1 4.44Å; I40-I70 HydrophobicContact CD1-CG1 3.88Å; I40-I70 HydrophobicContact CG2-CD1 4.36Å; I40-I70 HydrophobicContact CG2-CG1 4.05Å; I40-I73 HydrophobicContact CD1-CG1 3.84Å; I40-W202 HydrophobicContact CD1-CH2 3.89Å; I40-W202 HydrophobicContact CG1-CH2 4.08Å
41	T	91.6	Very high	85.2	Confident	40 Å²	40	54.7 Å²	54.7	25%	0.245	28%	0.284	C	S	.	.	H	α-helix	trans	-75.4	-32.4	-169.3	60.2	0	0	0	0	113.4	L37 K38 F47 L62 Q66 I70	L37-T41 WeakPolarHBondContact O-CG2 3.34Å; L37-T41 PolarHBondContact O-N 3.45Å; L37-T41 PolarHBondContact O-OG1 2.81Å; K38-T41 WeakPolarHBondContact CA-OG1 3.33Å; K38-T41 PolarHBondContact O-N 2.8Å; T41-F47 WeakPolarHBondContact O-CE1 3.48Å; T41-L62 HydrophobicContact CG2-CD1 4.45Å; T41-L62 HydrophobicContact CG2-CD2 3.79Å; T41-Q66 PolarHBondContact O-NE2 2.89Å; T41-I70 HydrophobicContact CG2-CD1 4.13Å
42	D	90.7	Very high	83.1	Confident	107 Å²	107	56.7 Å²	56.7	57%	0.572	31%	0.305	S	S	*	.	S	Bend	trans	-102.7	-8	-172	-55.3	-2.7	0	0	0	111.4	K38 R44	K38-D42 VanDerWaalsContact O-CB 3.27Å; K38-D42 WeakPolarHBondContact O-CB 3.47Å; K38-D42 PolarHBondContact O-N 2.87Å; D42-R44 PolarHBondContact O-N 2.93Å
43	N	89.4	Confident	80.9	Confident	14 Å²	14	62.7 Å²	62.7	8%	0.075	34%	0.337	C	S	.	.			trans	-77.1	102.1	-179.9	-169.4	-19.5	0	0	0	111	F39 N45 L46 N175	F39-N43 WeakPolarHBondContact O-CB 3.45Å; N43-N45 PolarHBondContact O-N 3.34Å; N43-N45 VanDerWaalsContact OD1-CB 3.23Å; N43-N45 WeakPolarHBondContact OD1-CB 3.44Å; N43-N45 PolarHBondContact OD1-N 3.09Å; N43-L46 HydrophobicContact CB-CD1 4.13Å; N43-L46 HydrophobicContact CB-CG 4.34Å; N43-L46 PolarHBondContact O-N 3.29Å; N43-N175 PolarHBondContact ND2-OD1 2.94Å
44	R	86.3	Confident	79	Confident	183 Å²	183	70.5 Å²	70.5	69%	0.691	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.9	-19.6	174.7	69.8	-179.1	-175.3	-179.6	-0.8	114.2	D42 L46 F47 K182	D42-R44 PolarHBondContact O-N 2.93Å; R44-L46 VanDerWaalsContact C-N 3.33Å; R44-F47 HydrophobicContact CB-CD2 4.32Å; R44-F47 HydrophobicContact CB-CE2 4.25Å; R44-K182 PolarHBondContact O-NZ 3.02Å
45	N	86.3	Confident	77.3	Confident	27 Å²	27	76.4 Å²	76.4	14%	0.144	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-15.9	178.2	-57.7	-29.6	0	0	0	114.2	N43 L178 K182	N43-N45 PolarHBondContact O-N 3.34Å; N43-N45 VanDerWaalsContact OD1-CB 3.23Å; N43-N45 WeakPolarHBondContact OD1-CB 3.44Å; N43-N45 PolarHBondContact OD1-N 3.09Å; N45-L178 HydrophobicContact CB-CB 3.73Å; N45-K182 HydrophobicContact CB-CD 4.4Å; N45-K182 WeakPolarHBondContact OD1-CD 3.44Å; N45-K182 WeakPolarHBondContact OD1-CE 3.49Å; N45-K182 PolarHBondContact OD1-NZ 2.92Å
46	L	85.3	Confident	75.4	Confident	9 Å²	9	77.8 Å²	77.8	5%	0.047	43%	0.426	C	S	.	.	S	Bend	trans	-98.1	-6.1	177.2	-61.4	174	0	0	0	113.6	I40 N43 R44 S63 L65 Q66 L69 L178	I40-L46 HydrophobicContact CG2-CD1 4.27Å; N43-L46 HydrophobicContact CB-CD1 4.13Å; N43-L46 HydrophobicContact CB-CG 4.34Å; N43-L46 PolarHBondContact O-N 3.29Å; R44-L46 VanDerWaalsContact C-N 3.33Å; L46-S63 PolarHBondContact O-OG 2.86Å; L46-L65 HydrophobicContact CD2-CD2 3.76Å; L46-Q66 HydrophobicContact CB-CG 3.93Å; L46-L69 HydrophobicContact CD1-CD1 3.86Å; L46-L69 HydrophobicContact CD2-CD1 4Å; L46-L178 HydrophobicContact CD2-CD1 4.06Å; L46-L178 HydrophobicContact CD2-CD2 3.72Å; L46-L178 HydrophobicContact CG-CD1 4.31Å
47	F	80.7	Confident	73.1	Confident	102 Å²	102	83 Å²	83	45%	0.447	46%	0.46	S	S	.	.	S	Bend	trans	-67.8	137.7	176.2	-63.2	-11.2	0	0	0	110.3	T41 R44 T49	T41-F47 WeakPolarHBondContact O-CE1 3.48Å; R44-F47 HydrophobicContact CB-CD2 4.32Å; R44-F47 HydrophobicContact CB-CE2 4.25Å; F47-T49 PolarHBondContact O-N 3.46Å
48	D	70.5	Confident	71.1	Confident	70 Å²	70	88.1 Å²	88.1	37%	0.374	49%	0.492	S	S	.	.			trans	-62.5	130.6	170.4	-75	-38.1	0	0	0	108.9	V50 S63	D48-V50 HydrophobicContact CB-CG2 3.5Å; D48-V50 PolarHBondContact O-N 3.31Å; D48-S63 VanDerWaalsContact OD2-CB 3.3Å; D48-S63 WeakPolarHBondContact OD2-CB 3.42Å
49	T	58.9	Low	68.9	Low	111 Å²	111	90 Å²	90	68%	0.681	50%	0.502	S	S	*	.			trans	-74.5	59.6	163.1	59.3	0	0	0	0	108.7	M1 F47 S51	M1-T49 PolarHBondContact N-OG1 3.3Å; F47-T49 PolarHBondContact O-N 3.46Å; T49-S51 PolarHBondContact O-N 2.93Å
50	V	53.1	Low	67.2	Low	109 Å²	109	95.4 Å²	95.4	66%	0.661	54%	0.542	S	S	*	.			trans	-78	109.1	169	-167.4	0	0	0	0	106.3	D48 G52	D48-V50 HydrophobicContact CB-CG2 3.5Å; D48-V50 PolarHBondContact O-N 3.31Å; V50-G52 PolarHBondContact O-N 3.31Å
51	S	46.4	Very low	66.2	Low	130 Å²	130	102.7 Å²	102.7	91%	0.909	57%	0.573	S	S	*	*			trans	-66.9	72.6	158.2	-173.8	0	0	0	0	107.3	T49	T49-S51 PolarHBondContact O-N 2.93Å
52	G	48.6	Very low	65.8	Low	48 Å²	48	103.8 Å²	103.8	50%	0.495	58%	0.577	S	S	.	*			trans	-75.5	137	-177	0	0	0	0	0	110.5	V50 L54	V50-G52 PolarHBondContact O-N 3.31Å; G52-L54 PolarHBondContact O-N 3.26Å
53	D	49.5	Very low	65.5	Low	133 Å²	133	99.1 Å²	99.1	71%	0.711	55%	0.553	S	S	*	*			trans	-49.2	127.4	173.5	-135.3	-21.9	0	0	0	110	N55 V56	D53-N55 PolarHBondContact O-N 3.08Å; D53-V56 PolarHBondContact O-N 3.47Å
54	L	56.9	Low	65.2	Low	169 Å²	169	103.7 Å²	103.7	89%	0.885	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.4	-4.9	-170.3	-71.9	167.8	0	0	0	114.9	G52	G52-L54 PolarHBondContact O-N 3.26Å
55	N	60.5	Low	65.2	Low	147 Å²	147	95.6 Å²	95.6	79%	0.786	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.5	3	-170.8	-66.4	-42	0	0	0	114.8	D53	D53-N55 PolarHBondContact O-N 3.08Å
56	V	55	Low	65.4	Low	106 Å²	106	94.5 Å²	94.5	64%	0.642	53%	0.534	S	S	*	.	S	Bend	trans	-99	120.2	169.1	-175.2	0	0	0	0	108.1	D53 V58	D53-V56 PolarHBondContact O-N 3.47Å; V56-V58 PolarHBondContact O-N 3.41Å
57	P	47.6	Very low	65.6	Low	111 Å²	111	98.2 Å²	98.2	72%	0.721	55%	0.551	S	S	*	*			trans	-54.8	116.5	167.6	-21	31.9	0	0	0	107.7	E59	P57-E59 PolarHBondContact O-N 3.23Å
58	V	52.7	Low	66.1	Low	134 Å²	134	95.7 Å²	95.7	81%	0.812	54%	0.542	S	S	*	.			trans	-67.3	88.4	170.6	-178.9	0	0	0	0	105.5	V56 S60	V56-V58 PolarHBondContact O-N 3.41Å; V58-S60 PolarHBondContact O-N 3.21Å; V58-S60 VanDerWaalsContact O-N 3.16Å
59	E	49.3	Very low	67.2	Low	131 Å²	131	92.8 Å²	92.8	61%	0.612	53%	0.526	S	S	*	.			trans	-51.7	124	154.3	-72.5	-177.1	165.2	0	0	104.7	P57 K61	P57-E59 PolarHBondContact O-N 3.23Å; E59-K61 HydrophobicContact CB-CD 4.43Å; E59-K61 HydrophobicContact CB-CG 4.24Å; E59-K61 PolarHBondContact O-N 2.9Å; E59-K61 WeakPolarHBondContact OE2-CE 3.38Å; E59-K61 IonicContact OE2-NZ 3.79Å; E59-K61 PolarHBondContact OE2-NZ 3.48Å
60	S	58.6	Low	68.9	Low	123 Å²	123	88.3 Å²	88.3	86%	0.86	50%	0.498	S	S	*	.			trans	-63.9	71.2	-176.7	59.5	0	0	0	0	110.1	V58	V58-S60 PolarHBondContact O-N 3.21Å; V58-S60 VanDerWaalsContact O-N 3.16Å
61	K	73	Confident	70.8	Confident	152 Å²	152	85 Å²	85	66%	0.661	48%	0.482	S	S	*	.	P	Polyproline II helix	trans	-89.4	128.7	177.8	-72.7	178.6	179.6	160.8	0	106.1	E59	E59-K61 HydrophobicContact CB-CD 4.43Å; E59-K61 HydrophobicContact CB-CG 4.24Å; E59-K61 PolarHBondContact O-N 2.9Å; E59-K61 WeakPolarHBondContact OE2-CE 3.38Å; E59-K61 IonicContact OE2-NZ 3.79Å; E59-K61 PolarHBondContact OE2-NZ 3.48Å
62	L	83.1	Confident	73.1	Confident	64 Å²	64	79.8 Å²	79.8	34%	0.335	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-53.4	145.6	168.7	-65.4	172.9	0	0	0	108.8	T41 Q66 E67 I70	T41-L62 HydrophobicContact CG2-CD1 4.45Å; T41-L62 HydrophobicContact CG2-CD2 3.79Å; L62-Q66 HydrophobicContact CB-CB 3.97Å; L62-Q66 HydrophobicContact CD2-CB 4.27Å; L62-E67 HydrophobicContact CB-CG 4.03Å; L62-I70 HydrophobicContact CD1-CD1 3.51Å
63	S	84.4	Confident	75.3	Confident	8 Å²	8	77.6 Å²	77.6	6%	0.056	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-61.3	155.1	169.2	71.6	0	0	0	0	109.4	L46 D48 L65 Q66 E67	L46-S63 PolarHBondContact O-OG 2.86Å; D48-S63 VanDerWaalsContact OD2-CB 3.3Å; D48-S63 WeakPolarHBondContact OD2-CB 3.42Å; S63-L65 PolarHBondContact O-N 2.86Å; S63-L65 VanDerWaalsContact O-N 3.12Å; S63-Q66 WeakPolarHBondContact O-CB 3.16Å; S63-Q66 PolarHBondContact O-N 3.08Å; S63-Q66 VanDerWaalsContact OG-CG 3.3Å; S63-Q66 WeakPolarHBondContact OG-CG 3.36Å; S63-Q66 PolarHBondContact OG-N 3.17Å; S63-Q66 VanDerWaalsContact OG-N 3.12Å; S63-Q66 PolarHBondContact OG-OE1 3.2Å; S63-E67 PolarHBondContact O-N 3.06Å
64	W	83.5	Confident	77.3	Confident	110 Å²	110	73.6 Å²	73.6	42%	0.417	40%	0.403	S	S	.	.	H	α-helix	trans	-54.8	-32.9	174.3	70.6	-84.2	0	0	0	111.7	E67 D68	W64-E67 PolarHBondContact O-N 2.81Å; W64-D68 WeakPolarHBondContact O-CB 3.37Å; W64-D68 PolarHBondContact O-N 3.28Å
65	L	86.1	Confident	79	Confident	13 Å²	13	70.6 Å²	70.6	7%	0.068	38%	0.384	C	S	.	.	H	α-helix	trans	-67.8	-44.3	176.9	177.1	66.7	0	0	0	110.6	L3 L46 S63 E67 D68 L69	L3-L65 HydrophobicContact CD1-CD1 3.76Å; L3-L65 HydrophobicContact CD1-CD2 3.39Å; L3-L65 HydrophobicContact CD1-CG 4.16Å; L46-L65 HydrophobicContact CD2-CD2 3.76Å; S63-L65 PolarHBondContact O-N 2.86Å; S63-L65 VanDerWaalsContact O-N 3.12Å; L65-E67 VanDerWaalsContact C-N 3.31Å; L65-E67 PolarHBondContact O-N 3.3Å; L65-D68 PolarHBondContact O-N 2.82Å; L65-L69 HydrophobicContact CD1-CD1 4.37Å; L65-L69 HydrophobicContact CD1-CG 4.33Å; L65-L69 HydrophobicContact CG-CD1 4.11Å; L65-L69 HydrophobicContact CG-CG 4.46Å; L65-L69 VanDerWaalsContact O-CG 3.23Å; L65-L69 WeakPolarHBondContact O-CG 3.31Å; L65-L69 PolarHBondContact O-N 2.86Å
66	Q	90.1	Very high	80.6	Confident	5 Å²	5	65.7 Å²	65.7	2%	0.023	36%	0.36	C	S	.	.	H	α-helix	trans	-62.1	-41.1	175.5	-71.7	173.8	-57.7	0	0	111.3	I40 T41 L46 L62 S63 L69 I70	I40-Q66 HydrophobicContact CG2-CB 3.81Å; I40-Q66 HydrophobicContact CG2-CG 3.93Å; I40-Q66 PolarHBondContact O-NE2 3.33Å; T41-Q66 PolarHBondContact O-NE2 2.89Å; L46-Q66 HydrophobicContact CB-CG 3.93Å; L62-Q66 HydrophobicContact CB-CB 3.97Å; L62-Q66 HydrophobicContact CD2-CB 4.27Å; S63-Q66 WeakPolarHBondContact O-CB 3.16Å; S63-Q66 PolarHBondContact O-N 3.08Å; S63-Q66 VanDerWaalsContact OG-CG 3.3Å; S63-Q66 WeakPolarHBondContact OG-CG 3.36Å; S63-Q66 PolarHBondContact OG-N 3.17Å; S63-Q66 VanDerWaalsContact OG-N 3.12Å; S63-Q66 PolarHBondContact OG-OE1 3.2Å; Q66-L69 PolarHBondContact O-N 3.46Å; Q66-I70 WeakPolarHBondContact O-CB 3.36Å; Q66-I70 WeakPolarHBondContact O-CD1 3.49Å; Q66-I70 VanDerWaalsContact O-CG1 3.26Å; Q66-I70 WeakPolarHBondContact O-CG1 3.31Å; Q66-I70 PolarHBondContact O-N 3.23Å
67	E	89.3	Confident	82.4	Confident	87 Å²	87	62.5 Å²	62.5	41%	0.407	34%	0.338	S	S	.	.	H	α-helix	trans	-60.8	-44.6	173.7	-67.2	-177.6	167.8	0	0	112.1	L62 S63 W64 L65 I70 A71	L62-E67 HydrophobicContact CB-CG 4.03Å; S63-E67 PolarHBondContact O-N 3.06Å; W64-E67 PolarHBondContact O-N 2.81Å; L65-E67 VanDerWaalsContact C-N 3.31Å; L65-E67 PolarHBondContact O-N 3.3Å; E67-I70 PolarHBondContact O-N 3.13Å; E67-A71 PolarHBondContact O-N 3.49Å
68	D	91.3	Very high	84.4	Confident	49 Å²	49	58.5 Å²	58.5	26%	0.262	31%	0.312	S	S	.	.	H	α-helix	trans	-62.1	-46.6	178.5	-159.3	54.3	0	0	0	111	W64 L65 I70 A71 E72	W64-D68 WeakPolarHBondContact O-CB 3.37Å; W64-D68 PolarHBondContact O-N 3.28Å; L65-D68 PolarHBondContact O-N 2.82Å; D68-I70 VanDerWaalsContact C-N 3.35Å; D68-I70 PolarHBondContact O-N 3.02Å; D68-A71 WeakPolarHBondContact O-CB 3.48Å; D68-A71 PolarHBondContact O-N 2.95Å; D68-E72 WeakPolarHBondContact O-CG 3.43Å; D68-E72 PolarHBondContact O-N 3.06Å
69	L	93.7	Very high	86	Confident	8 Å²	8	56 Å²	56	4%	0.042	29%	0.294	C	S	.	.	H	α-helix	trans	-62.6	-39.8	176.6	-64.9	172.3	0	0	0	111.9	I40 L46 L65 Q66 E72 I73 W202	I40-L69 HydrophobicContact CD1-CB 3.99Å; I40-L69 HydrophobicContact CG1-CB 4.23Å; I40-L69 HydrophobicContact CG2-CB 4.01Å; I40-L69 HydrophobicContact CG2-CD1 4.28Å; L46-L69 HydrophobicContact CD1-CD1 3.86Å; L46-L69 HydrophobicContact CD2-CD1 4Å; L65-L69 HydrophobicContact CD1-CD1 4.37Å; L65-L69 HydrophobicContact CD1-CG 4.33Å; L65-L69 HydrophobicContact CG-CD1 4.11Å; L65-L69 HydrophobicContact CG-CG 4.46Å; L65-L69 VanDerWaalsContact O-CG 3.23Å; L65-L69 WeakPolarHBondContact O-CG 3.31Å; L65-L69 PolarHBondContact O-N 2.86Å; Q66-L69 PolarHBondContact O-N 3.46Å; L69-E72 PolarHBondContact O-N 2.88Å; L69-I73 WeakPolarHBondContact O-CG1 3.35Å; L69-I73 PolarHBondContact O-N 3.24Å; L69-W202 HydrophobicContact CB-CH2 4.24Å; L69-W202 HydrophobicContact CB-CZ2 3.88Å; L69-W202 HydrophobicContact CD2-CD2 4.05Å; L69-W202 VanDerWaalsContact CD2-CE2 3.42Å; L69-W202 HydrophobicContact CD2-CG 4.45Å; L69-W202 HydrophobicContact CD2-CH2 4.32Å; L69-W202 HydrophobicContact CD2-CZ2 3.59Å; L69-W202 HydrophobicContact CG-CZ2 4.27Å
70	I	93.4	Very high	87.6	Confident	17 Å²	17	52.6 Å²	52.6	9%	0.087	28%	0.282	C	S	.	.	H	α-helix	trans	-65.4	-38.8	175.8	-72.7	164.5	0	0	0	111.5	V24 L37 I40 T41 L62 Q66 E67 D68 E72 I73 S74	V24-I70 HydrophobicContact CG2-CG2 4.19Å; L37-I70 HydrophobicContact CD2-CG1 4.16Å; L37-I70 HydrophobicContact CD2-CG2 4.38Å; I40-I70 HydrophobicContact CB-CG1 4.44Å; I40-I70 HydrophobicContact CD1-CG1 3.88Å; I40-I70 HydrophobicContact CG2-CD1 4.36Å; I40-I70 HydrophobicContact CG2-CG1 4.05Å; T41-I70 HydrophobicContact CG2-CD1 4.13Å; L62-I70 HydrophobicContact CD1-CD1 3.51Å; Q66-I70 WeakPolarHBondContact O-CB 3.36Å; Q66-I70 WeakPolarHBondContact O-CD1 3.49Å; Q66-I70 VanDerWaalsContact O-CG1 3.26Å; Q66-I70 WeakPolarHBondContact O-CG1 3.31Å; Q66-I70 PolarHBondContact O-N 3.23Å; E67-I70 PolarHBondContact O-N 3.13Å; D68-I70 VanDerWaalsContact C-N 3.35Å; D68-I70 PolarHBondContact O-N 3.02Å; I70-E72 VanDerWaalsContact C-N 3.35Å; I70-I73 PolarHBondContact O-N 3.02Å; I70-S74 PolarHBondContact O-N 2.88Å; I70-S74 PolarHBondContact O-OG 2.88Å
71	A	93.2	Very high	88.3	Confident	41 Å²	41	50.6 Å²	50.6	34%	0.339	27%	0.268	S	S	.	.	H	α-helix	trans	-61.3	-45.9	174.1	0	0	0	0	0	110.5	E67 D68 I73 S74 E75	E67-A71 PolarHBondContact O-N 3.49Å; D68-A71 WeakPolarHBondContact O-CB 3.48Å; D68-A71 PolarHBondContact O-N 2.95Å; A71-I73 VanDerWaalsContact C-N 3.31Å; A71-I73 PolarHBondContact O-N 3.05Å; A71-S74 WeakPolarHBondContact O-CB 3.31Å; A71-S74 PolarHBondContact O-N 3.4Å; A71-E75 WeakPolarHBondContact O-CG 3.44Å; A71-E75 PolarHBondContact O-N 2.82Å
72	E	94.7	Very high	87.8	Confident	20 Å²	20	53.3 Å²	53.3	9%	0.093	27%	0.274	C	S	.	.	H	α-helix	trans	-61.3	-35.3	176.3	-69.6	-172.1	-169.5	0	0	113.4	D68 L69 I70 S74 E75 W202 K206	D68-E72 WeakPolarHBondContact O-CG 3.43Å; D68-E72 PolarHBondContact O-N 3.06Å; L69-E72 PolarHBondContact O-N 2.88Å; I70-E72 VanDerWaalsContact C-N 3.35Å; E72-S74 VanDerWaalsContact C-N 3.35Å; E72-E75 PolarHBondContact O-N 3.18Å; E72-W202 PolarHBondContact OE2-NE1 3.31Å; E72-K206 HydrophobicContact CB-CD 4.03Å; E72-K206 WeakPolarHBondContact OE2-CE 3.3Å; E72-K206 IonicContact OE2-NZ 3.11Å; E72-K206 PolarHBondContact OE2-NZ 3.23Å
73	I	94.5	Very high	86.9	Confident	2 Å²	2	51.9 Å²	51.9	1%	0.01	28%	0.275	C	S	.	.	H	α-helix	trans	-66.4	-39.4	172.9	-65.5	-50	0	0	0	111.4	M36 I40 L69 I70 A71 E75 V76 E77 W202 K206 Y209	M36-I73 HydrophobicContact CE-CD1 3.48Å; M36-I73 VanDerWaalsContact CE-CD1 3.48Å; M36-I73 HydrophobicContact CG-CD1 3.66Å; M36-I73 HydrophobicContact CG-CG1 3.73Å; M36-I73 HydrophobicContact CG-CG2 4.05Å; M36-I73 HydrophobicContact SD-CD1 3.77Å; M36-I73 HydrophobicContact SD-CG1 4.31Å; I40-I73 HydrophobicContact CD1-CG1 3.84Å; L69-I73 WeakPolarHBondContact O-CG1 3.35Å; L69-I73 PolarHBondContact O-N 3.24Å; I70-I73 PolarHBondContact O-N 3.02Å; A71-I73 VanDerWaalsContact C-N 3.31Å; A71-I73 PolarHBondContact O-N 3.05Å; I73-E75 VanDerWaalsContact C-N 3.28Å; I73-E75 PolarHBondContact O-N 3.02Å; I73-V76 VanDerWaalsContact O-CG2 3.24Å; I73-V76 WeakPolarHBondContact O-CG2 3.47Å; I73-V76 PolarHBondContact O-N 3.31Å; I73-E77 PolarHBondContact O-N 3.4Å; I73-W202 HydrophobicContact CD1-CH2 3.59Å; I73-W202 HydrophobicContact CD1-CZ2 3.74Å; I73-W202 HydrophobicContact CG1-CH2 3.92Å; I73-W202 HydrophobicContact CG1-CZ2 4.09Å; I73-K206 HydrophobicContact CD1-CD 4.12Å; I73-K206 HydrophobicContact CD1-CG 3.74Å; I73-Y209 HydrophobicContact CG2-CD1 4.33Å; I73-Y209 HydrophobicContact CG2-CE1 3.65Å
74	S	92	Very high	86.3	Confident	48 Å²	48	59.6 Å²	59.6	34%	0.336	31%	0.31	S	S	.	.	H	α-helix	trans	-66.7	-32.4	179.5	-56.5	0	0	0	0	111.9	I70 A71 E72 V76 E77	I70-S74 PolarHBondContact O-N 2.88Å; I70-S74 PolarHBondContact O-OG 2.88Å; A71-S74 WeakPolarHBondContact O-CB 3.31Å; A71-S74 PolarHBondContact O-N 3.4Å; E72-S74 VanDerWaalsContact C-N 3.35Å; S74-V76 VanDerWaalsContact C-N 3.32Å; S74-V76 PolarHBondContact O-N 2.91Å; S74-E77 PolarHBondContact O-N 2.83Å
75	E	93	Very high	86.2	Confident	106 Å²	106	56.2 Å²	56.2	50%	0.495	30%	0.3	S	S	.	.	H	α-helix	trans	-68.6	-28.2	177.2	-72.8	175.7	-176	0	0	113.8	L14 A71 E72 I73	L14-E75 WeakPolarHBondContact CD1-OE1 3.27Å; L14-E75 VanDerWaalsContact CD2-OE1 3.22Å; L14-E75 WeakPolarHBondContact CD2-OE1 3.37Å; A71-E75 WeakPolarHBondContact O-CG 3.44Å; A71-E75 PolarHBondContact O-N 2.82Å; E72-E75 PolarHBondContact O-N 3.18Å; I73-E75 VanDerWaalsContact C-N 3.28Å; I73-E75 PolarHBondContact O-N 3.02Å
76	V	94.4	Very high	85.9	Confident	45 Å²	45	60 Å²	60	27%	0.273	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	1.5	-179.8	-57.8	0	0	0	0	113.4	I73 S74 K206 Y209 A210	I73-V76 VanDerWaalsContact O-CG2 3.24Å; I73-V76 WeakPolarHBondContact O-CG2 3.47Å; I73-V76 PolarHBondContact O-N 3.31Å; S74-V76 VanDerWaalsContact C-N 3.32Å; S74-V76 PolarHBondContact O-N 2.91Å; V76-K206 HydrophobicContact CG2-CB 4.5Å; V76-Y209 HydrophobicContact CG2-CD1 3.99Å; V76-Y209 HydrophobicContact CG2-CE1 4.36Å; V76-A210 HydrophobicContact CB-CB 4.1Å; V76-A210 HydrophobicContact CG2-CB 4.39Å
77	E	92.5	Very high	85.7	Confident	39 Å²	39	65.3 Å²	65.3	18%	0.182	35%	0.353	C	S	.	.	S	Bend	trans	-63.7	135.4	171.6	-77.3	-73.8	162.3	0	0	110.3	I73 S74 R147 Y209 R213	I73-E77 PolarHBondContact O-N 3.4Å; S74-E77 PolarHBondContact O-N 2.83Å; E77-R147 IonicContact OE2-NH1 2.63Å; E77-Y209 PolarHBondContact OE1-OH 3.08Å; E77-R213 IonicContact OE1-CZ 3.63Å; E77-R213 IonicContact OE1-NE 3.9Å; E77-R213 PolarHBondContact OE1-NE 2.77Å; E77-R213 IonicContact OE1-NH2 2.73Å; E77-R213 IonicContact OE2-CZ 2.8Å; E77-R213 IonicContact OE2-NE 3.59Å; E77-R213 PolarHBondContact OE2-NE 3.33Å; E77-R213 VanDerWaalsContact OE2-NE 3.11Å; E77-R213 IonicContact OE2-NH2 3.13Å; E77-R213 PolarHBondContact OE2-NH2 3.29Å; E77-R213 VanDerWaalsContact OE2-NH2 3.14Å
78	P	90.3	Very high	85.9	Confident	27 Å²	27	61.9 Å²	61.9	18%	0.175	34%	0.339	C	S	.	.			trans	-67	143.2	177.8	29.9	-36.2	0	0	0	110.9	T80 R213 L217	P78-T80 PolarHBondContact O-N 2.97Å; P78-T80 VanDerWaalsContact O-N 3.14Å; P78-R213 HydrophobicContact CG-CB 4.13Å; P78-L217 HydrophobicContact CB-CD1 4.16Å; P78-L217 HydrophobicContact CB-CD2 3.99Å; P78-L217 HydrophobicContact CB-CG 4.19Å; P78-L217 HydrophobicContact CG-CD2 3.89Å; P78-L217 HydrophobicContact CG-CG 4.19Å
79	D	85.4	Confident	86.1	Confident	82 Å²	82	62.8 Å²	62.8	44%	0.439	35%	0.346	S	S	.	.			trans	-64.4	112.5	173.3	-178.2	5.4	0	0	0	110.5	S81 R82	D79-S81 VanDerWaalsContact C-N 3.34Å; D79-S81 VanDerWaalsContact CG-OG 3.28Å; D79-S81 VanDerWaalsContact OD1-CB 3.27Å; D79-S81 WeakPolarHBondContact OD1-CB 3.5Å; D79-S81 PolarHBondContact OD1-N 3.23Å; D79-S81 PolarHBondContact OD1-OG 3.35Å; D79-S81 PolarHBondContact OD2-OG 3.26Å; D79-R82 WeakPolarHBondContact OD2-CD 3.46Å; D79-R82 VanDerWaalsContact OD2-CG 3.27Å; D79-R82 WeakPolarHBondContact OD2-CG 3.4Å; D79-R82 IonicContact OD2-NE 3.77Å; D79-R82 PolarHBondContact OD2-NE 2.89Å
80	T	83.4	Confident	86.2	Confident	59 Å²	59	67.9 Å²	67.9	36%	0.362	37%	0.368	S	S	.	.	S	Bend	trans	-82.9	-11.9	179.2	57.3	0	0	0	0	112.8	P78 Y143 L217	P78-T80 PolarHBondContact O-N 2.97Å; P78-T80 VanDerWaalsContact O-N 3.14Å; T80-Y143 HydrophobicContact CG2-CE1 3.72Å; T80-L217 HydrophobicContact CG2-CD2 4.1Å
81	S	72.6	Confident	86.3	Confident	80 Å²	80	74.6 Å²	74.6	56%	0.559	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-18.9	-178	74.2	0	0	0	0	113.8	D79	D79-S81 VanDerWaalsContact C-N 3.34Å; D79-S81 VanDerWaalsContact CG-OG 3.28Å; D79-S81 VanDerWaalsContact OD1-CB 3.27Å; D79-S81 WeakPolarHBondContact OD1-CB 3.5Å; D79-S81 PolarHBondContact OD1-N 3.23Å; D79-S81 PolarHBondContact OD1-OG 3.35Å; D79-S81 PolarHBondContact OD2-OG 3.26Å
82	R	63.7	Low	86.3	Confident	209 Å²	209	78.3 Å²	78.3	79%	0.789	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112	20.8	-174.8	-64.8	-177.7	-175.4	-162	0	114.2	D79	D79-R82 WeakPolarHBondContact OD2-CD 3.46Å; D79-R82 VanDerWaalsContact OD2-CG 3.27Å; D79-R82 WeakPolarHBondContact OD2-CG 3.4Å; D79-R82 IonicContact OD2-NE 3.77Å; D79-R82 PolarHBondContact OD2-NE 2.89Å
83	G	64.2	Low	86.4	Confident	34 Å²	34	78.1 Å²	78.1	35%	0.351	41%	0.414	S	S	.	.			trans	-54.9	147.5	175.3	0	0	0	0	0	112.2	I85	G83-I85 PolarHBondContact O-N 2.96Å
84	E	70.8	Confident	86.4	Confident	170 Å²	170	78.8 Å²	78.8	79%	0.794	42%	0.417	S	S	*	.			trans	-59.6	127.6	169.8	-170.5	174.1	-176.6	0	0	108.3	K86	E84-K86 PolarHBondContact O-N 3.49Å
85	I	81.8	Confident	86.5	Confident	40 Å²	40	78.1 Å²	78.1	21%	0.205	41%	0.41	C	S	.	.			trans	-81.3	115.8	-179.1	-63.5	164	0	0	0	108	G83 C107 H108 H133 F135	G83-I85 PolarHBondContact O-N 2.96Å; I85-C107 HydrophobicContact CD1-CB 4.33Å; I85-H108 HydrophobicContact CD1-CB 4.49Å; I85-H133 HydrophobicContact CG2-CB 3.87Å; I85-H133 WeakPolarHBondContact CG2-ND1 3.46Å; I85-F135 HydrophobicContact CD1-CE1 4.35Å; I85-F135 HydrophobicContact CD1-CZ 4.03Å; I85-F135 HydrophobicContact CG1-CE1 4.23Å; I85-F135 HydrophobicContact CG1-CZ 4.27Å; I85-F135 HydrophobicContact CG2-CE1 4.09Å; I85-F135 HydrophobicContact CG2-CZ 3.74Å
86	K	80.3	Confident	86.5	Confident	93 Å²	93	74 Å²	74	40%	0.404	39%	0.392	S	S	.	.			trans	-81.1	156.7	175.3	-90.7	-176.6	178	175.8	0	114.5	E84 S88 N94 H133 D219	E84-K86 PolarHBondContact O-N 3.49Å; K86-S88 PolarHBondContact O-N 3.33Å; K86-S88 PolarHBondContact O-OG 3.1Å; K86-N94 PolarHBondContact N-OD1 3Å; K86-N94 PolarHBondContact O-ND2 3.44Å; K86-H133 PolarHBondContact O-CD2 3.49Å; K86-D219 VanDerWaalsContact CB-OXT 3.29Å; K86-D219 WeakPolarHBondContact CB-OXT 3.46Å; K86-D219 HydrophobicContact CD-CB 3.37Å; K86-D219 VanDerWaalsContact CD-OXT 3.26Å; K86-D219 WeakPolarHBondContact CD-OXT 3.49Å; K86-D219 HydrophobicContact CG-CB 4.22Å; K86-D219 WeakPolarHBondContact CG-OXT 3.49Å; K86-D219 IonicContact NZ-OD1 3.34Å; K86-D219 IonicContact NZ-OD2 3.3Å; K86-D219 PolarHBondContact NZ-OD2 2.98Å
87	S	85.9	Confident	86.5	Confident	115 Å²	115	73.5 Å²	73.5	80%	0.804	39%	0.392	S	S	*	.			trans	-55.4	123.6	157.6	-167.4	0	0	0	0	109.1
88	S	92.5	Very high	86.4	Confident	16 Å²	16	72.6 Å²	72.6	11%	0.112	39%	0.39	C	S	.	.			trans	-140.9	161.3	-167	43	0	0	0	0	109.7	K86 N92 N94 W134	K86-S88 PolarHBondContact O-N 3.33Å; K86-S88 PolarHBondContact O-OG 3.1Å; S88-N92 WeakPolarHBondContact CB-O 3.22Å; S88-N94 WeakPolarHBondContact CB-ND2 3.36Å; S88-N94 PolarHBondContact OG-ND2 3.44Å; S88-W134 PolarHBondContact OG-N 3.34Å; S88-W134 PolarHBondContact OG-O 3.19Å
89	T	95.1	Very high	86.5	Confident	68 Å²	68	75.2 Å²	75.2	42%	0.417	41%	0.409	S	S	.	.			trans	-121.7	172	176.3	60	0	0	0	0	109.4	E91 N92 P93 W134	T89-E91 PolarHBondContact O-N 2.98Å; T89-N92 PolarHBondContact N-O 2.77Å; T89-N92 VanDerWaalsContact N-O 3.1Å; T89-N92 CarbonylContact O-C 3.47Å; T89-N92 PolarHBondContact O-N 3.33Å; T89-N92 PolarHBondContact OG1-N 3.48Å; T89-P93 WeakPolarHBondContact O-CA 3.27Å; T89-P93 VanDerWaalsContact O-N 3.11Å; T89-W134 VanDerWaalsContact C-CD1 3.42Å; T89-W134 VanDerWaalsContact C-CG 3.43Å; T89-W134 VanDerWaalsContact O-CB 3.23Å; T89-W134 WeakPolarHBondContact O-CB 3.44Å
90	K	96.2	Very high	86.9	Confident	114 Å²	114	76 Å²	76	50%	0.496	41%	0.414	S	S	.	.	S	Bend	trans	-62.5	-34.4	175.6	-175.6	-179.4	178.9	-173.4	0	111.2	P126 W134	K90-P126 HydrophobicContact CG-CB 4.19Å; K90-W134 HydrophobicContact CB-CD2 3.88Å; K90-W134 HydrophobicContact CB-CE3 3.91Å; K90-W134 HydrophobicContact CB-CH2 3.84Å; K90-W134 HydrophobicContact CB-CZ2 3.79Å; K90-W134 HydrophobicContact CB-CZ3 3.9Å; K90-W134 HydrophobicContact CD-CH2 3.86Å; K90-W134 HydrophobicContact CD-CZ2 4.46Å; K90-W134 HydrophobicContact CD-CZ3 4.06Å; K90-W134 HydrophobicContact CG-CD2 4.46Å; K90-W134 HydrophobicContact CG-CE3 3.98Å; K90-W134 HydrophobicContact CG-CH2 3.84Å; K90-W134 HydrophobicContact CG-CZ2 4.32Å; K90-W134 HydrophobicContact CG-CZ3 3.66Å
91	E	96	Very high	87.5	Confident	158 Å²	158	78.4 Å²	78.4	74%	0.738	43%	0.428	S	S	*	.	S	Bend	trans	-80.5	-29.9	-178.9	-62	67.1	-143.7	0	0	112.1	T89 P93	T89-E91 PolarHBondContact O-N 2.98Å; E91-P93 VanDerWaalsContact C-CD 3.48Å
92	N	94.1	Very high	88.6	Confident	120 Å²	120	82.2 Å²	82.2	64%	0.642	43%	0.43	S	S	*	.	S	Bend	trans	-125.9	73.2	173.7	-172	47	0	0	0	110.8	S88 T89	S88-N92 WeakPolarHBondContact CB-O 3.22Å; T89-N92 PolarHBondContact N-O 2.77Å; T89-N92 VanDerWaalsContact N-O 3.1Å; T89-N92 CarbonylContact O-C 3.47Å; T89-N92 PolarHBondContact O-N 3.33Å; T89-N92 PolarHBondContact OG1-N 3.48Å
93	P	95.6	Very high	90.1	Very high	16 Å²	16	73.1 Å²	73.1	10%	0.104	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-80.6	159.1	-178.7	33.2	-35.2	0	0	0	111.9	T89 E91 L95 W134 L136	T89-P93 WeakPolarHBondContact O-CA 3.27Å; T89-P93 VanDerWaalsContact O-N 3.11Å; E91-P93 VanDerWaalsContact C-CD 3.48Å; P93-L95 HydrophobicContact CG-CD2 4.32Å; P93-L95 PolarHBondContact O-N 2.8Å; P93-W134 HydrophobicContact CB-CB 3.91Å; P93-L136 HydrophobicContact CB-CB 3.92Å; P93-L136 HydrophobicContact CG-CB 3.48Å; P93-L136 VanDerWaalsContact CG-CB 3.48Å; P93-L136 HydrophobicContact CG-CD2 3.94Å; P93-L136 HydrophobicContact CG-CG 4.34Å
94	N	94.1	Very high	91.5	Very high	16 Å²	16	76.2 Å²	76.2	9%	0.086	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	123.2	167.2	-63.4	-73.6	0	0	0	109.6	K86 S88 W134 F135 L136	K86-N94 PolarHBondContact N-OD1 3Å; K86-N94 PolarHBondContact O-ND2 3.44Å; S88-N94 WeakPolarHBondContact CB-ND2 3.36Å; S88-N94 PolarHBondContact OG-ND2 3.44Å; N94-W134 WeakPolarHBondContact CB-O 3.48Å; N94-W134 PolarHBondContact N-O 3.31Å; N94-W134 PolarHBondContact ND2-O 3.11Å; N94-F135 HydrophobicContact CB-CD1 3.74Å; N94-F135 HydrophobicContact CB-CE1 3.97Å; N94-F135 CarbonylContact O-C 3.57Å; N94-F135 VanDerWaalsContact O-CA 3.23Å; N94-F135 WeakPolarHBondContact O-CA 3.32Å; N94-L136 PolarHBondContact O-N 3.5Å
95	L	94.8	Very high	92.5	Very high	34 Å²	34	69.6 Å²	69.6	18%	0.178	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	138	-178.1	-57.7	-172.7	0	0	0	111.1	P93 L136 V138 Y143 E146 L218	P93-L95 HydrophobicContact CG-CD2 4.32Å; P93-L95 PolarHBondContact O-N 2.8Å; L95-L136 WeakPolarHBondContact CA-O 3.33Å; L95-L136 HydrophobicContact CD2-CB 3.89Å; L95-L136 HydrophobicContact CD2-CD2 3.97Å; L95-L136 HydrophobicContact CD2-CG 4.28Å; L95-V138 HydrophobicContact CB-CG2 4.28Å; L95-V138 HydrophobicContact CD2-CG1 4.17Å; L95-Y143 HydrophobicContact CB-CD2 3.95Å; L95-Y143 HydrophobicContact CB-CE2 4.15Å; L95-Y143 WeakPolarHBondContact O-CE2 3.25Å; L95-E146 HydrophobicContact CD1-CB 3.99Å; L95-E146 HydrophobicContact CD1-CG 3.61Å; L95-L218 HydrophobicContact CB-CD1 4.14Å; L95-L218 HydrophobicContact CD1-CD1 3.97Å; L95-L218 HydrophobicContact CG-CD1 4.37Å
96	V	93.4	Very high	92.9	Very high	20 Å²	20	72.6 Å²	72.6	12%	0.121	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	121.3	175.4	-179.5	0	0	0	0	107.8	Q105 L121 F135 L136 L137 V138	V96-Q105 HydrophobicContact CG2-CG 4.12Å; V96-Q105 VanDerWaalsContact CG2-OE1 3.28Å; V96-L121 HydrophobicContact CB-CD1 3.96Å; V96-L121 HydrophobicContact CG1-CD1 4.32Å; V96-L121 HydrophobicContact CG2-CD1 3.7Å; V96-F135 HydrophobicContact CG2-CD1 4.12Å; V96-L136 PolarHBondContact N-O 3.37Å; V96-L137 HydrophobicContact CB-CD1 4.31Å; V96-L137 HydrophobicContact CG1-CD1 4.09Å; V96-L137 WeakPolarHBondContact O-CA 3.42Å; V96-L137 WeakPolarHBondContact O-CD1 3.46Å; V96-V138 PolarHBondContact O-N 3.36Å
97	A	93	Very high	93.4	Very high	34 Å²	34	68.2 Å²	68.2	28%	0.281	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	132.5	177.7	0	0	0	0	0	111.1	Y143	A97-Y143 HydrophobicContact CB-CD1 4.02Å; A97-Y143 HydrophobicContact CB-CD2 3.88Å; A97-Y143 HydrophobicContact CB-CE2 4.5Å; A97-Y143 HydrophobicContact CB-CG 3.62Å
98	S	92.2	Very high	93.4	Very high	19 Å²	19	66.3 Å²	66.3	13%	0.133	35%	0.353	C	S	.	.			trans	-157.7	141.1	164.3	-165.6	0	0	0	0	111.6	N100 R123 V138	S98-N100 PolarHBondContact O-N 2.87Å; S98-N100 PolarHBondContact OG-N 3.27Å; S98-R123 PolarHBondContact O-NH2 2.98Å; S98-V138 PolarHBondContact N-O 2.97Å
99	S	91.5	Very high	93.1	Very high	83 Å²	83	66.8 Å²	66.8	58%	0.58	36%	0.356	S	S	*	.	S	Bend	trans	-64.1	-21.5	166.2	56.3	0	0	0	0	112.9	R123	S99-R123 VanDerWaalsContact C-NH2 3.28Å; S99-R123 PolarHBondContact O-NH2 3.08Å
100	N	94	Very high	92.5	Very high	99 Å²	99	65.1 Å²	65.1	53%	0.529	35%	0.347	S	S	.	.	S	Bend	trans	-77.7	156.5	178.6	-65.6	-48.4	0	0	0	112.9	S98 R102 R123	S98-N100 PolarHBondContact O-N 2.87Å; S98-N100 PolarHBondContact OG-N 3.27Å; N100-R102 VanDerWaalsContact C-N 3.26Å; N100-R102 VanDerWaalsContact CB-O 3.22Å; N100-R102 WeakPolarHBondContact CB-O 3.4Å; N100-R102 PolarHBondContact O-N 2.96Å; N100-R123 PolarHBondContact O-NH2 3.27Å; N100-R123 VanDerWaalsContact O-NH2 3.08Å
101	V	95.8	Very high	91.6	Very high	108 Å²	108	64.9 Å²	64.9	66%	0.655	36%	0.357	S	S	*	.	S	Bend	trans	-73.9	-18.3	173.2	-63.9	0	0	0	0	113.3	R123	V101-R123 WeakPolarHBondContact O-CB 3.48Å; V101-R123 PolarHBondContact O-N 2.89Å
102	R	96.4	Very high	90.9	Very high	160 Å²	160	64.9 Å²	64.9	60%	0.604	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.5	150.1	175.7	67.6	179.3	-176.6	179.5	-0.2	110.1	N100 L121 Y122	N100-R102 VanDerWaalsContact C-N 3.26Å; N100-R102 VanDerWaalsContact CB-O 3.22Å; N100-R102 WeakPolarHBondContact CB-O 3.4Å; N100-R102 PolarHBondContact O-N 2.96Å; R102-L121 WeakPolarHBondContact CA-O 3.22Å; R102-L121 WeakPolarHBondContact CB-O 3.2Å; R102-Y122 HydrophobicContact CB-CD1 4.36Å
103	A	94.7	Very high	90.1	Very high	19 Å²	19	61.9 Å²	61.9	16%	0.157	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	153.7	176.9	0	0	0	0	0	110.3	L121 L137	A103-L121 PolarHBondContact N-O 3.38Å; A103-L121 VanDerWaalsContact N-O 3.08Å; A103-L121 PolarHBondContact O-N 3.31Å; A103-L137 HydrophobicContact CB-CD1 3.78Å; A103-L137 HydrophobicContact CB-CD2 3.98Å
104	V	93.6	Very high	89.2	Confident	99 Å²	99	70.2 Å²	70.2	60%	0.6	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.3	117.9	171	-177.9	0	0	0	0	107.8	L119	V104-L119 WeakPolarHBondContact CA-O 3.27Å
105	Q	91.5	Very high	88.6	Confident	30 Å²	30	73.3 Å²	73.3	14%	0.14	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	136.1	173.3	-179.5	58.4	44.4	0	0	109.8	V96 S118 L119 L121 F135	V96-Q105 HydrophobicContact CG2-CG 4.12Å; V96-Q105 VanDerWaalsContact CG2-OE1 3.28Å; Q105-S118 WeakPolarHBondContact O-CA 3.32Å; Q105-L119 PolarHBondContact N-O 2.83Å; Q105-L119 PolarHBondContact O-N 2.6Å; Q105-L121 HydrophobicContact CB-CD1 3.65Å; Q105-L121 HydrophobicContact CB-CG 4.02Å; Q105-L121 HydrophobicContact CG-CD1 4.34Å; Q105-F135 HydrophobicContact CG-CD1 3.84Å; Q105-F135 HydrophobicContact CG-CE1 3.95Å; Q105-F135 HydrophobicContact CG-CG 4.27Å; Q105-F135 HydrophobicContact CG-CZ 4.47Å
106	Q	90.7	Very high	88.1	Confident	104 Å²	104	75.8 Å²	75.8	49%	0.486	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	129.6	170.7	-67.6	-179.9	-24.6	0	0	109.5	L116	Q106-L116 HydrophobicContact CB-CB 4.46Å; Q106-L116 HydrophobicContact CB-CD2 4.41Å
107	C	89.7	Confident	87.9	Confident	1 Å²	1	78.9 Å²	78.9	1%	0.007	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	122.6	175.8	-175.8	0	0	0	0	110.1	I85 C109 K117 C129 F135	I85-C107 HydrophobicContact CD1-CB 4.33Å; C107-C109 PolarHBondContact O-N 3.14Å; C107-K117 PolarHBondContact N-O 3.33Å; C107-K117 PolarHBondContact O-N 2.87Å; C107-C129 HydrophobicContact CB-CB 4.27Å; C107-F135 HydrophobicContact CB-CE2 4.06Å; C107-F135 HydrophobicContact CB-CZ 4Å
108	H	87	Confident	87.8	Confident	74 Å²	74	81.2 Å²	81.2	34%	0.343	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	101.4	167.7	-154.5	-90.5	0	0	0	108.2	I85 S110 D113 L116	I85-H108 HydrophobicContact CD1-CB 4.49Å; H108-S110 PolarHBondContact CE1-O 3Å; H108-S110 PolarHBondContact ND1-O 3.26Å; H108-D113 PolarHBondContact CE1-O 2.85Å; H108-D113 VanDerWaalsContact CE1-O 3.24Å; H108-D113 PolarHBondContact NE2-O 3.19Å; H108-L116 HydrophobicContact CB-CD2 4.22Å
109	C	86.4	Confident	87.8	Confident	26 Å²	26	82.2 Å²	82.2	18%	0.176	44%	0.435	C	S	.	.			trans	-77.9	-25.8	-169.4	-64.8	0	0	0	0	113.5	C107 F130 C131	C107-C109 PolarHBondContact O-N 3.14Å; C109-F130 HydrophobicContact CB-CE1 4.43Å; C109-F130 HydrophobicContact CB-CZ 3.82Å; C109-F130 WeakPolarHBondContact SG-CE1 3.42Å; C109-F130 WeakPolarHBondContact SG-CZ 3.41Å; C109-C131 HydrophobicContact CB-CB 3.54Å; C109-C131 VanDerWaalsContact SG-CB 3.53Å; C109-C131 PolarHBondContact SG-SG 2.93Å
110	S	82.3	Confident	88	Confident	34 Å²	34	81.6 Å²	81.6	24%	0.238	43%	0.427	C	S	.	.	S	Bend	trans	-145.9	136.1	176.2	168	0	0	0	0	108	H108 H112 D113	H108-S110 PolarHBondContact CE1-O 3Å; H108-S110 PolarHBondContact ND1-O 3.26Å; S110-H112 PolarHBondContact O-N 3.35Å; S110-H112 PolarHBondContact OG-N 2.82Å; S110-D113 VanDerWaalsContact CB-OD2 3.28Å; S110-D113 WeakPolarHBondContact CB-OD2 3.5Å; S110-D113 PolarHBondContact O-N 3.14Å
111	P	77.6	Confident	88.2	Confident	109 Å²	109	76.9 Å²	76.9	71%	0.708	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-18.2	178.1	25.7	-34.5	0	0	0	113.6
112	H	80.6	Confident	88.3	Confident	157 Å²	157	77.8 Å²	77.8	73%	0.727	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-11.1	178.5	-55.3	-59.2	0	0	0	113.6	S110	S110-H112 PolarHBondContact O-N 3.35Å; S110-H112 PolarHBondContact OG-N 2.82Å
113	D	76.2	Confident	88.3	Confident	57 Å²	57	74.1 Å²	74.1	31%	0.305	38%	0.381	S	S	.	.			trans	-89.9	120	-178	-79.8	-28.8	0	0	0	111.1	H108 S110 H115	H108-D113 PolarHBondContact CE1-O 2.85Å; H108-D113 VanDerWaalsContact CE1-O 3.24Å; H108-D113 PolarHBondContact NE2-O 3.19Å; S110-D113 VanDerWaalsContact CB-OD2 3.28Å; S110-D113 WeakPolarHBondContact CB-OD2 3.5Å; S110-D113 PolarHBondContact O-N 3.14Å; D113-H115 PolarHBondContact O-N 2.98Å; D113-H115 IonicContact OD1-CE1 2.83Å; D113-H115 PolarHBondContact OD1-CE1 3.42Å; D113-H115 IonicContact OD1-ND1 2.72Å; D113-H115 IonicContact OD2-CE1 3.88Å; D113-H115 PolarHBondContact OD2-CE1 3.21Å; D113-H115 VanDerWaalsContact OD2-CE1 3.3Å; D113-H115 IonicContact OD2-NE2 3.8Å
114	H	78.1	Confident	88.5	Confident	191 Å²	191	77.5 Å²	77.5	88%	0.884	40%	0.396	S	S	*	.			trans	-75.8	1.1	174	-62.2	-57.9	0	0	0	114.1
115	H	81.5	Confident	88.6	Confident	82 Å²	82	77.8 Å²	77.8	38%	0.38	39%	0.394	S	S	.	.			trans	-101.4	116.3	-176.2	62.7	-96.7	0	0	0	110.9	D113	D113-H115 PolarHBondContact O-N 2.98Å; D113-H115 IonicContact OD1-CE1 2.83Å; D113-H115 PolarHBondContact OD1-CE1 3.42Å; D113-H115 IonicContact OD1-ND1 2.72Å; D113-H115 IonicContact OD2-CE1 3.88Å; D113-H115 PolarHBondContact OD2-CE1 3.21Å; D113-H115 VanDerWaalsContact OD2-CE1 3.3Å; D113-H115 IonicContact OD2-NE2 3.8Å
116	L	84.3	Confident	88.9	Confident	85 Å²	85	78.3 Å²	78.3	45%	0.445	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	138.9	173.1	-68.8	168.5	0	0	0	110.2	Q106 H108	Q106-L116 HydrophobicContact CB-CB 4.46Å; Q106-L116 HydrophobicContact CB-CD2 4.41Å; H108-L116 HydrophobicContact CB-CD2 4.22Å
117	K	88.5	Confident	89.2	Confident	85 Å²	85	74.4 Å²	74.4	37%	0.37	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	116.8	-179.9	-65.8	-85.7	-158.7	-153.3	0	108.4	C107 F130	C107-K117 PolarHBondContact N-O 3.33Å; C107-K117 PolarHBondContact O-N 2.87Å; K117-F130 HydrophobicContact CB-CE1 3.78Å; K117-F130 HydrophobicContact CD-CD1 4.36Å; K117-F130 HydrophobicContact CD-CE1 3.46Å; K117-F130 VanDerWaalsContact CD-CE1 3.46Å; K117-F130 HydrophobicContact CD-CZ 3.93Å; K117-F130 VanDerWaalsContact CE-CE1 3.45Å; K117-F130 HydrophobicContact CG-CD1 4.49Å; K117-F130 HydrophobicContact CG-CE1 3.37Å; K117-F130 HydrophobicContact CG-CZ 3.83Å
118	S	91.1	Very high	89.5	Confident	83 Å²	83	81.6 Å²	81.6	58%	0.58	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.3	133.9	-177.9	-58.8	0	0	0	0	111	Q105	Q105-S118 WeakPolarHBondContact O-CA 3.32Å
119	L	92.6	Very high	89.9	Confident	41 Å²	41	78.5 Å²	78.5	22%	0.215	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	135	174.9	179.1	67.8	0	0	0	108.9	V104 Q105 L121 A127 F135	V104-L119 WeakPolarHBondContact CA-O 3.27Å; Q105-L119 PolarHBondContact N-O 2.83Å; Q105-L119 PolarHBondContact O-N 2.6Å; L119-L121 HydrophobicContact CD2-CD2 3.55Å; L119-L121 HydrophobicContact CG-CD2 3.89Å; L119-A127 HydrophobicContact CD2-CB 3.82Å; L119-A127 HydrophobicContact CG-CB 4.49Å; L119-F135 HydrophobicContact CD2-CD2 4.31Å
120	V	96.1	Very high	90.1	Very high	70 Å²	70	83.9 Å²	83.9	42%	0.424	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	118.9	170	-177.7	0	0	0	0	108.2	Y122	V120-Y122 HydrophobicContact CG1-CD2 4.48Å; V120-Y122 HydrophobicContact CG1-CE2 3.91Å
121	L	96.8	Very high	90.5	Very high	0 Å²	0	84.5 Å²	84.5	0%	0	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	143.8	173.7	-54.9	-178.9	0	0	0	110	V96 R102 A103 Q105 L119 A127 F135 L137	V96-L121 HydrophobicContact CB-CD1 3.96Å; V96-L121 HydrophobicContact CG1-CD1 4.32Å; V96-L121 HydrophobicContact CG2-CD1 3.7Å; R102-L121 WeakPolarHBondContact CA-O 3.22Å; R102-L121 WeakPolarHBondContact CB-O 3.2Å; A103-L121 PolarHBondContact N-O 3.38Å; A103-L121 VanDerWaalsContact N-O 3.08Å; A103-L121 PolarHBondContact O-N 3.31Å; Q105-L121 HydrophobicContact CB-CD1 3.65Å; Q105-L121 HydrophobicContact CB-CG 4.02Å; Q105-L121 HydrophobicContact CG-CD1 4.34Å; L119-L121 HydrophobicContact CD2-CD2 3.55Å; L119-L121 HydrophobicContact CG-CD2 3.89Å; L121-A127 HydrophobicContact CD2-CB 3.82Å; L121-F135 HydrophobicContact CD1-CB 3.85Å; L121-F135 HydrophobicContact CD2-CB 3.8Å; L121-F135 HydrophobicContact CG-CB 4.5Å; L121-L137 HydrophobicContact CB-CB 3.77Å; L121-L137 HydrophobicContact CB-CD2 4.32Å; L121-L137 HydrophobicContact CD1-CB 4.32Å
122	Y	98.1	Very high	91.2	Very high	127 Å²	127	80 Å²	80	50%	0.498	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	142.4	170.2	-67.3	-95.7	0	0	0	108.7	R102 V120 N124 L125	R102-Y122 HydrophobicContact CB-CD1 4.36Å; V120-Y122 HydrophobicContact CG1-CD2 4.48Å; V120-Y122 HydrophobicContact CG1-CE2 3.91Å; Y122-N124 PolarHBondContact O-N 2.93Å; Y122-L125 PolarHBondContact O-N 3.39Å; Y122-L125 VanDerWaalsContact O-N 3.1Å
123	R	97.5	Very high	91.8	Very high	82 Å²	82	74.3 Å²	74.3	31%	0.309	37%	0.37	S	S	.	.	B	Isolated β-bridge	trans	-54.7	132.1	-175.7	-178.4	173.6	-69.8	-161.4	1.9	110.8	S98 S99 N100 V101 L125 L137	S98-R123 PolarHBondContact O-NH2 2.98Å; S99-R123 VanDerWaalsContact C-NH2 3.28Å; S99-R123 PolarHBondContact O-NH2 3.08Å; N100-R123 PolarHBondContact O-NH2 3.27Å; N100-R123 VanDerWaalsContact O-NH2 3.08Å; V101-R123 WeakPolarHBondContact O-CB 3.48Å; V101-R123 PolarHBondContact O-N 2.89Å; R123-L125 PolarHBondContact O-N 2.9Å; R123-L125 VanDerWaalsContact O-N 3.16Å; R123-L137 WeakPolarHBondContact CA-O 3.26Å; R123-L137 HydrophobicContact CB-CD2 4.45Å
124	N	97.3	Very high	92.8	Very high	91 Å²	91	74 Å²	74	49%	0.487	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.7	16.5	179.3	-61.1	-39.5	0	0	0	115.5	Y122 L136 L137 R142	Y122-N124 PolarHBondContact O-N 2.93Å; N124-L136 VanDerWaalsContact C-CD1 3.45Å; N124-L137 PolarHBondContact N-O 3.3Å; N124-R142 PolarHBondContact OD1-NH1 3.44Å
125	L	97.7	Very high	93.6	Very high	105 Å²	105	65.1 Å²	65.1	55%	0.55	32%	0.324	S	S	.	.	B	Isolated β-bridge	trans	-112.7	107.2	173.8	-173.7	65.1	0	0	0	110.5	Y122 R123 A127	Y122-L125 PolarHBondContact O-N 3.39Å; Y122-L125 VanDerWaalsContact O-N 3.1Å; R123-L125 PolarHBondContact O-N 2.9Å; R123-L125 VanDerWaalsContact O-N 3.16Å; L125-A127 PolarHBondContact O-N 3.22Å
126	P	97.1	Very high	94.3	Very high	40 Å²	40	61.7 Å²	61.7	26%	0.26	31%	0.308	S	S	.	.			trans	-62	129.9	177	-21.4	30.9	0	0	0	111.3	K90 W134 F135 L136	K90-P126 HydrophobicContact CG-CB 4.19Å; P126-W134 HydrophobicContact CB-CE3 4.09Å; P126-W134 HydrophobicContact CB-CZ3 4.27Å; P126-F135 WeakPolarHBondContact CA-O 3.24Å; P126-L136 HydrophobicContact CB-CD1 4.46Å; P126-L136 HydrophobicContact CG-CD1 3.89Å
127	A	97	Very high	94.9	Very high	22 Å²	22	57.7 Å²	57.7	18%	0.182	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	140.7	179.2	0	0	0	0	0	110.5	L119 L121 L125 W134 F135	L119-A127 HydrophobicContact CD2-CB 3.82Å; L119-A127 HydrophobicContact CG-CB 4.49Å; L121-A127 HydrophobicContact CD2-CB 3.82Å; L125-A127 PolarHBondContact O-N 3.22Å; A127-W134 WeakPolarHBondContact O-CA 3.28Å; A127-F135 PolarHBondContact N-O 2.52Å; A127-F135 PolarHBondContact O-N 2.73Å
128	R	96	Very high	95.3	Very high	153 Å²	153	53.6 Å²	53.6	58%	0.577	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.3	128.1	-176.9	-163.3	-171.9	178.9	-170.4	-10.1	110.1	G132 H133 W134	R128-G132 PolarHBondContact NE-O 2.72Å; R128-H133 CarbonylContact C-O 3.1Å; R128-H133 WeakPolarHBondContact CA-O 3.32Å; R128-W134 HydrophobicContact CB-CD2 3.77Å; R128-W134 HydrophobicContact CB-CE3 3.82Å; R128-W134 HydrophobicContact CB-CG 4.47Å; R128-W134 HydrophobicContact CB-CH2 3.86Å; R128-W134 HydrophobicContact CB-CZ2 3.82Å; R128-W134 HydrophobicContact CB-CZ3 3.86Å; R128-W134 HydrophobicContact CG-CD2 3.88Å; R128-W134 HydrophobicContact CG-CE3 4.44Å; R128-W134 HydrophobicContact CG-CG 4.22Å; R128-W134 HydrophobicContact CG-CH2 4.45Å; R128-W134 HydrophobicContact CG-CZ2 3.89Å
129	C	94.3	Very high	95.5	Very high	8 Å²	8	52.1 Å²	52.1	5%	0.054	26%	0.255	C	S	.	.			trans	-71.5	152.5	165.1	-170.2	0	0	0	0	110.1	C107 C131 G132 H133 F135	C107-C129 HydrophobicContact CB-CB 4.27Å; C129-C131 PolarHBondContact O-N 2.65Å; C129-C131 VanDerWaalsContact SG-SG 3.62Å; C129-G132 PolarHBondContact O-N 3.23Å; C129-H133 PolarHBondContact N-O 3.14Å; C129-F135 HydrophobicContact CB-CE2 4.09Å
130	F	90.6	Very high	95.5	Very high	140 Å²	140	52.5 Å²	52.5	61%	0.614	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-26.3	179.8	73.5	-79.9	0	0	0	113.3	C109 K117 G132	C109-F130 HydrophobicContact CB-CE1 4.43Å; C109-F130 HydrophobicContact CB-CZ 3.82Å; C109-F130 WeakPolarHBondContact SG-CE1 3.42Å; C109-F130 WeakPolarHBondContact SG-CZ 3.41Å; K117-F130 HydrophobicContact CB-CE1 3.78Å; K117-F130 HydrophobicContact CD-CD1 4.36Å; K117-F130 HydrophobicContact CD-CE1 3.46Å; K117-F130 VanDerWaalsContact CD-CE1 3.46Å; K117-F130 HydrophobicContact CD-CZ 3.93Å; K117-F130 VanDerWaalsContact CE-CE1 3.45Å; K117-F130 HydrophobicContact CG-CD1 4.49Å; K117-F130 HydrophobicContact CG-CE1 3.37Å; K117-F130 HydrophobicContact CG-CZ 3.83Å; F130-G132 PolarHBondContact O-N 3.41Å
131	C	91.3	Very high	95.4	Very high	47 Å²	47	52.6 Å²	52.6	32%	0.318	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-14	177.2	65.3	0	0	0	0	114.1	C109 C129 H133	C109-C131 HydrophobicContact CB-CB 3.54Å; C109-C131 VanDerWaalsContact SG-CB 3.53Å; C109-C131 PolarHBondContact SG-SG 2.93Å; C129-C131 PolarHBondContact O-N 2.65Å; C129-C131 VanDerWaalsContact SG-SG 3.62Å; C131-H133 PolarHBondContact SG-ND1 3.23Å
132	G	93.4	Very high	95.3	Very high	15 Å²	15	56.4 Å²	56.4	16%	0.155	27%	0.266	C	S	.	.	S	Bend	trans	117.2	-25.6	178.6	0	0	0	0	0	114.7	R128 C129 F130 W134	R128-G132 PolarHBondContact NE-O 2.72Å; C129-G132 PolarHBondContact O-N 3.23Å; F130-G132 PolarHBondContact O-N 3.41Å; G132-W134 VanDerWaalsContact O-CD1 3.27Å
133	H	93.3	Very high	95.1	Very high	36 Å²	36	51 Å²	51	17%	0.167	24%	0.244	C	C	.	.			trans	-63.4	136	-178.7	-58.5	136.9	0	0	0	111.9	I85 K86 R128 C129 C131 F135	I85-H133 HydrophobicContact CG2-CB 3.87Å; I85-H133 WeakPolarHBondContact CG2-ND1 3.46Å; K86-H133 PolarHBondContact O-CD2 3.49Å; R128-H133 CarbonylContact C-O 3.1Å; R128-H133 WeakPolarHBondContact CA-O 3.32Å; C129-H133 PolarHBondContact N-O 3.14Å; C131-H133 PolarHBondContact SG-ND1 3.23Å; H133-F135 HydrophobicContact CB-CE2 3.73Å; H133-F135 HydrophobicContact CB-CZ 3.98Å
134	W	96	Very high	94.9	Very high	51 Å²	51	47.6 Å²	47.6	19%	0.193	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	142	175.5	-72.5	87	0	0	0	110.4	S88 T89 K90 P93 N94 P126 A127 R128 G132	S88-W134 PolarHBondContact OG-N 3.34Å; S88-W134 PolarHBondContact OG-O 3.19Å; T89-W134 VanDerWaalsContact C-CD1 3.42Å; T89-W134 VanDerWaalsContact C-CG 3.43Å; T89-W134 VanDerWaalsContact O-CB 3.23Å; T89-W134 WeakPolarHBondContact O-CB 3.44Å; K90-W134 HydrophobicContact CB-CD2 3.88Å; K90-W134 HydrophobicContact CB-CE3 3.91Å; K90-W134 HydrophobicContact CB-CH2 3.84Å; K90-W134 HydrophobicContact CB-CZ2 3.79Å; K90-W134 HydrophobicContact CB-CZ3 3.9Å; K90-W134 HydrophobicContact CD-CH2 3.86Å; K90-W134 HydrophobicContact CD-CZ2 4.46Å; K90-W134 HydrophobicContact CD-CZ3 4.06Å; K90-W134 HydrophobicContact CG-CD2 4.46Å; K90-W134 HydrophobicContact CG-CE3 3.98Å; K90-W134 HydrophobicContact CG-CH2 3.84Å; K90-W134 HydrophobicContact CG-CZ2 4.32Å; K90-W134 HydrophobicContact CG-CZ3 3.66Å; P93-W134 HydrophobicContact CB-CB 3.91Å; N94-W134 WeakPolarHBondContact CB-O 3.48Å; N94-W134 PolarHBondContact N-O 3.31Å; N94-W134 PolarHBondContact ND2-O 3.11Å; P126-W134 HydrophobicContact CB-CE3 4.09Å; P126-W134 HydrophobicContact CB-CZ3 4.27Å; A127-W134 WeakPolarHBondContact O-CA 3.28Å; R128-W134 HydrophobicContact CB-CD2 3.77Å; R128-W134 HydrophobicContact CB-CE3 3.82Å; R128-W134 HydrophobicContact CB-CG 4.47Å; R128-W134 HydrophobicContact CB-CH2 3.86Å; R128-W134 HydrophobicContact CB-CZ2 3.82Å; R128-W134 HydrophobicContact CB-CZ3 3.86Å; R128-W134 HydrophobicContact CG-CD2 3.88Å; R128-W134 HydrophobicContact CG-CE3 4.44Å; R128-W134 HydrophobicContact CG-CG 4.22Å; R128-W134 HydrophobicContact CG-CH2 4.45Å; R128-W134 HydrophobicContact CG-CZ2 3.89Å; G132-W134 VanDerWaalsContact O-CD1 3.27Å
135	F	95.5	Very high	94.9	Very high	4 Å²	4	46.8 Å²	46.8	2%	0.018	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	148.1	178.3	-60.9	-87.3	0	0	0	110.4	I85 N94 V96 Q105 C107 L119 L121 P126 A127 C129 H133	I85-F135 HydrophobicContact CD1-CE1 4.35Å; I85-F135 HydrophobicContact CD1-CZ 4.03Å; I85-F135 HydrophobicContact CG1-CE1 4.23Å; I85-F135 HydrophobicContact CG1-CZ 4.27Å; I85-F135 HydrophobicContact CG2-CE1 4.09Å; I85-F135 HydrophobicContact CG2-CZ 3.74Å; N94-F135 HydrophobicContact CB-CD1 3.74Å; N94-F135 HydrophobicContact CB-CE1 3.97Å; N94-F135 CarbonylContact O-C 3.57Å; N94-F135 VanDerWaalsContact O-CA 3.23Å; N94-F135 WeakPolarHBondContact O-CA 3.32Å; V96-F135 HydrophobicContact CG2-CD1 4.12Å; Q105-F135 HydrophobicContact CG-CD1 3.84Å; Q105-F135 HydrophobicContact CG-CE1 3.95Å; Q105-F135 HydrophobicContact CG-CG 4.27Å; Q105-F135 HydrophobicContact CG-CZ 4.47Å; C107-F135 HydrophobicContact CB-CE2 4.06Å; C107-F135 HydrophobicContact CB-CZ 4Å; L119-F135 HydrophobicContact CD2-CD2 4.31Å; L121-F135 HydrophobicContact CD1-CB 3.85Å; L121-F135 HydrophobicContact CD2-CB 3.8Å; L121-F135 HydrophobicContact CG-CB 4.5Å; P126-F135 WeakPolarHBondContact CA-O 3.24Å; A127-F135 PolarHBondContact N-O 2.52Å; A127-F135 PolarHBondContact O-N 2.73Å; C129-F135 HydrophobicContact CB-CE2 4.09Å; H133-F135 HydrophobicContact CB-CE2 3.73Å; H133-F135 HydrophobicContact CB-CZ 3.98Å
136	L	96.5	Very high	94.7	Very high	11 Å²	11	44.5 Å²	44.5	6%	0.058	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	118.1	174.8	-178.8	63.1	0	0	0	109.9	P93 N94 L95 V96 N124 P126 V138	P93-L136 HydrophobicContact CB-CB 3.92Å; P93-L136 HydrophobicContact CG-CB 3.48Å; P93-L136 VanDerWaalsContact CG-CB 3.48Å; P93-L136 HydrophobicContact CG-CD2 3.94Å; P93-L136 HydrophobicContact CG-CG 4.34Å; N94-L136 PolarHBondContact O-N 3.5Å; L95-L136 WeakPolarHBondContact CA-O 3.33Å; L95-L136 HydrophobicContact CD2-CB 3.89Å; L95-L136 HydrophobicContact CD2-CD2 3.97Å; L95-L136 HydrophobicContact CD2-CG 4.28Å; V96-L136 PolarHBondContact N-O 3.37Å; N124-L136 VanDerWaalsContact C-CD1 3.45Å; P126-L136 HydrophobicContact CB-CD1 4.46Å; P126-L136 HydrophobicContact CG-CD1 3.89Å; L136-V138 HydrophobicContact CD2-CG1 4.15Å; L136-V138 HydrophobicContact CG-CG1 3.98Å; L136-V138 PolarHBondContact O-N 2.88Å
137	L	96.8	Very high	94.6	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	123.9	172.8	-177.4	63.5	0	0	0	110	V96 A103 L121 R123 N124	V96-L137 HydrophobicContact CB-CD1 4.31Å; V96-L137 HydrophobicContact CG1-CD1 4.09Å; V96-L137 WeakPolarHBondContact O-CA 3.42Å; V96-L137 WeakPolarHBondContact O-CD1 3.46Å; A103-L137 HydrophobicContact CB-CD1 3.78Å; A103-L137 HydrophobicContact CB-CD2 3.98Å; L121-L137 HydrophobicContact CB-CB 3.77Å; L121-L137 HydrophobicContact CB-CD2 4.32Å; L121-L137 HydrophobicContact CD1-CB 4.32Å; R123-L137 WeakPolarHBondContact CA-O 3.26Å; R123-L137 HydrophobicContact CB-CD2 4.45Å; N124-L137 PolarHBondContact N-O 3.3Å
138	V	96.1	Very high	94.6	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	161.3	178.4	-60.5	0	0	0	0	110.2	L95 V96 S98 L136 R142 Y143	L95-V138 HydrophobicContact CB-CG2 4.28Å; L95-V138 HydrophobicContact CD2-CG1 4.17Å; V96-V138 PolarHBondContact O-N 3.36Å; S98-V138 PolarHBondContact N-O 2.97Å; L136-V138 HydrophobicContact CD2-CG1 4.15Å; L136-V138 HydrophobicContact CG-CG1 3.98Å; L136-V138 PolarHBondContact O-N 2.88Å; V138-R142 HydrophobicContact CB-CB 4.21Å; V138-R142 HydrophobicContact CB-CG 4.11Å; V138-R142 HydrophobicContact CG1-CG 4.26Å; V138-R142 HydrophobicContact CG2-CG 4.48Å; V138-Y143 HydrophobicContact CG2-CD2 4.34Å
139	D	94.8	Very high	94.6	Very high	51 Å²	51	39.7 Å²	39.7	27%	0.273	19%	0.187	S	C	.	.			trans	-70.4	162.9	167.7	57	67.3	0	0	0	111.6	Q141 R142 Y143	D139-Q141 VanDerWaalsContact C-N 3.25Å; D139-Q141 PolarHBondContact O-N 3.31Å; D139-Q141 WeakPolarHBondContact OD1-CB 3.22Å; D139-Q141 PolarHBondContact OD1-N 3.31Å; D139-R142 PolarHBondContact O-N 2.85Å; D139-R142 WeakPolarHBondContact OD1-CB 3.27Å; D139-R142 PolarHBondContact OD1-N 3.31Å; D139-Y143 PolarHBondContact O-N 2.9Å; D139-Y143 VanDerWaalsContact O-N 3.1Å
140	E	92.5	Very high	94.6	Very high	50 Å²	50	41.2 Å²	41.2	23%	0.234	19%	0.193	C	C	.	.	H	α-helix	trans	-62	-33.9	-176.9	-62.7	176.1	-170.8	0	0	112.4	P26 Y143 E144	P26-E140 VanDerWaalsContact CD-OE2 3.28Å; P26-E140 WeakPolarHBondContact CD-OE2 3.43Å; P26-E140 VanDerWaalsContact CG-C 3.44Å; P26-E140 HydrophobicContact CG-CB 3.55Å; E140-Y143 PolarHBondContact O-N 3.47Å; E140-E144 WeakPolarHBondContact O-CG 3.45Å; E140-E144 PolarHBondContact O-N 3.45Å
141	Q	94	Very high	94.9	Very high	71 Å²	71	35.1 Å²	35.1	33%	0.332	17%	0.166	S	C	.	.	H	α-helix	trans	-64.2	-51.2	179.9	175.1	62.4	36.8	0	0	110.3	P26 D139 Y143 E144 E145	P26-Q141 HydrophobicContact CB-CB 4.35Å; P26-Q141 HydrophobicContact CG-CB 4.17Å; D139-Q141 VanDerWaalsContact C-N 3.25Å; D139-Q141 PolarHBondContact O-N 3.31Å; D139-Q141 WeakPolarHBondContact OD1-CB 3.22Å; D139-Q141 PolarHBondContact OD1-N 3.31Å; Q141-Y143 VanDerWaalsContact C-N 3.27Å; Q141-Y143 PolarHBondContact O-N 3.08Å; Q141-E144 PolarHBondContact O-N 3.34Å; Q141-E145 WeakPolarHBondContact CG-OE1 3.39Å; Q141-E145 PolarHBondContact NE2-OE1 3.44Å; Q141-E145 WeakPolarHBondContact O-CG 3.32Å; Q141-E145 PolarHBondContact O-N 3.34Å
142	R	94.9	Very high	95.2	Very high	81 Å²	81	36.7 Å²	36.7	31%	0.306	17%	0.171	S	C	.	.	H	α-helix	trans	-60.1	-38	176.1	177.8	172	174.3	-161.6	-0.3	112	N124 V138 D139 E145 E146	N124-R142 PolarHBondContact OD1-NH1 3.44Å; V138-R142 HydrophobicContact CB-CB 4.21Å; V138-R142 HydrophobicContact CB-CG 4.11Å; V138-R142 HydrophobicContact CG1-CG 4.26Å; V138-R142 HydrophobicContact CG2-CG 4.48Å; D139-R142 PolarHBondContact O-N 2.85Å; D139-R142 WeakPolarHBondContact OD1-CB 3.27Å; D139-R142 PolarHBondContact OD1-N 3.31Å; R142-E145 PolarHBondContact O-N 2.97Å; R142-E146 WeakPolarHBondContact O-CG 3.32Å; R142-E146 PolarHBondContact O-N 3.44Å
143	Y	94.4	Very high	95.3	Very high	12 Å²	12	44.2 Å²	44.2	5%	0.047	20%	0.2	C	C	.	.	H	α-helix	trans	-63.3	-46	176.8	-172	-96.4	0	0	0	111.8	T80 L95 A97 V138 D139 E140 Q141 E145 E146 R147 L218	T80-Y143 HydrophobicContact CG2-CE1 3.72Å; L95-Y143 HydrophobicContact CB-CD2 3.95Å; L95-Y143 HydrophobicContact CB-CE2 4.15Å; L95-Y143 WeakPolarHBondContact O-CE2 3.25Å; A97-Y143 HydrophobicContact CB-CD1 4.02Å; A97-Y143 HydrophobicContact CB-CD2 3.88Å; A97-Y143 HydrophobicContact CB-CE2 4.5Å; A97-Y143 HydrophobicContact CB-CG 3.62Å; V138-Y143 HydrophobicContact CG2-CD2 4.34Å; D139-Y143 PolarHBondContact O-N 2.9Å; D139-Y143 VanDerWaalsContact O-N 3.1Å; E140-Y143 PolarHBondContact O-N 3.47Å; Q141-Y143 VanDerWaalsContact C-N 3.27Å; Q141-Y143 PolarHBondContact O-N 3.08Å; Y143-E145 PolarHBondContact O-N 2.83Å; Y143-E146 PolarHBondContact O-N 2.86Å; Y143-R147 HydrophobicContact CD1-CG 4.23Å; Y143-R147 HydrophobicContact CE1-CG 4.04Å; Y143-R147 WeakPolarHBondContact O-CG 3.45Å; Y143-R147 PolarHBondContact O-N 2.62Å; Y143-R147 VanDerWaalsContact O-N 3.08Å; Y143-L218 HydrophobicContact CD2-CD1 4Å; Y143-L218 HydrophobicContact CE2-CD1 3.73Å; Y143-L218 HydrophobicContact CE2-CG 4.39Å
144	E	94.3	Very high	95.5	Very high	12 Å²	12	43.8 Å²	43.8	6%	0.056	20%	0.198	C	C	.	.	H	α-helix	trans	-65.5	-36.2	177.8	-73.6	-64.3	142.9	0	0	112.8	P26 V28 E140 Q141 E146 R147 E148 R213	P26-E144 HydrophobicContact CG-CG 4.47Å; V28-E144 HydrophobicContact CG2-CB 4.12Å; E140-E144 WeakPolarHBondContact O-CG 3.45Å; E140-E144 PolarHBondContact O-N 3.45Å; Q141-E144 PolarHBondContact O-N 3.34Å; E144-E146 VanDerWaalsContact C-N 3.31Å; E144-E146 PolarHBondContact O-N 3.37Å; E144-R147 WeakPolarHBondContact O-CB 3.4Å; E144-R147 PolarHBondContact O-N 2.89Å; E144-R147 IonicContact OE1-CZ 3.68Å; E144-R147 IonicContact OE1-NH1 2.68Å; E144-R147 PolarHBondContact OE1-NH1 3.31Å; E144-R147 IonicContact OE2-NH1 3.31Å; E144-E148 WeakPolarHBondContact O-CG 3.36Å; E144-E148 PolarHBondContact O-N 3.26Å; E144-R213 VanDerWaalsContact CD-NH2 3.32Å; E144-R213 IonicContact OE1-NH2 2.65Å; E144-R213 PolarHBondContact OE1-NH2 3.47Å; E144-R213 IonicContact OE2-CZ 3.72Å; E144-R213 IonicContact OE2-NH1 3.41Å; E144-R213 PolarHBondContact OE2-NH1 2.99Å; E144-R213 IonicContact OE2-NH2 3.42Å; E144-R213 PolarHBondContact OE2-NH2 2.89Å
145	E	95.8	Very high	95.6	Very high	74 Å²	74	44.4 Å²	44.4	35%	0.346	20%	0.202	S	C	.	.	H	α-helix	trans	-59.2	-41	172.1	-73.4	169.7	-171.5	0	0	112.5	V28 Q141 R142 Y143 E148 K149	V28-E145 HydrophobicContact CG2-CG 3.93Å; Q141-E145 WeakPolarHBondContact CG-OE1 3.39Å; Q141-E145 PolarHBondContact NE2-OE1 3.44Å; Q141-E145 WeakPolarHBondContact O-CG 3.32Å; Q141-E145 PolarHBondContact O-N 3.34Å; R142-E145 PolarHBondContact O-N 2.97Å; Y143-E145 PolarHBondContact O-N 2.83Å; E145-E148 PolarHBondContact O-N 2.72Å; E145-K149 VanDerWaalsContact O-CG 3.31Å; E145-K149 WeakPolarHBondContact O-CG 3.42Å; E145-K149 PolarHBondContact O-N 3.33Å
146	E	95	Very high	95.6	Very high	56 Å²	56	50.3 Å²	50.3	26%	0.262	23%	0.234	S	C	.	.	H	α-helix	trans	-70.2	-36.9	177.4	-68	-62.7	148	0	0	112.1	L95 R142 Y143 E144 E148 K149 K150 L218	L95-E146 HydrophobicContact CD1-CB 3.99Å; L95-E146 HydrophobicContact CD1-CG 3.61Å; R142-E146 WeakPolarHBondContact O-CG 3.32Å; R142-E146 PolarHBondContact O-N 3.44Å; Y143-E146 PolarHBondContact O-N 2.86Å; E144-E146 VanDerWaalsContact C-N 3.31Å; E144-E146 PolarHBondContact O-N 3.37Å; E146-E148 VanDerWaalsContact C-N 3.32Å; E146-E148 PolarHBondContact O-N 2.75Å; E146-K149 PolarHBondContact O-N 2.92Å; E146-K149 IonicContact OE1-NZ 3.99Å; E146-K149 PolarHBondContact OE1-NZ 3.45Å; E146-K150 PolarHBondContact O-N 2.9Å; E146-L218 HydrophobicContact CB-CD1 3.82Å; E146-L218 HydrophobicContact CB-CD2 4.22Å
147	R	95	Very high	95.7	Very high	1 Å²	1	55.7 Å²	55.7	0%	0.004	26%	0.257	C	S	.	.	H	α-helix	trans	-60.6	-42.3	172	-69.3	-177.2	68.2	-172.8	2.4	111.8	E77 Y143 E144 K150 W151 R213 M216 L218	E77-R147 IonicContact OE2-NH1 2.63Å; Y143-R147 HydrophobicContact CD1-CG 4.23Å; Y143-R147 HydrophobicContact CE1-CG 4.04Å; Y143-R147 WeakPolarHBondContact O-CG 3.45Å; Y143-R147 PolarHBondContact O-N 2.62Å; Y143-R147 VanDerWaalsContact O-N 3.08Å; E144-R147 WeakPolarHBondContact O-CB 3.4Å; E144-R147 PolarHBondContact O-N 2.89Å; E144-R147 IonicContact OE1-CZ 3.68Å; E144-R147 IonicContact OE1-NH1 2.68Å; E144-R147 PolarHBondContact OE1-NH1 3.31Å; E144-R147 IonicContact OE2-NH1 3.31Å; R147-K150 WeakPolarHBondContact O-CB 3.29Å; R147-K150 PolarHBondContact O-N 3.44Å; R147-W151 PolarHBondContact O-N 3.39Å; R147-R213 PolarHBondContact NH2-O 2.9Å; R147-M216 HydrophobicContact CB-CB 4.34Å; R147-M216 HydrophobicContact CB-CE 4.17Å; R147-M216 WeakPolarHBondContact CB-O 3.11Å; R147-M216 VanDerWaalsContact CG-O 3.31Å; R147-M216 WeakPolarHBondContact CG-O 3.3Å; R147-M216 PolarHBondContact NE-O 2.94Å; R147-L218 HydrophobicContact CG-CD2 4.19Å; R147-L218 HydrophobicContact CG-CG 3.91Å
148	E	95.9	Very high	95.7	Very high	12 Å²	12	61.2 Å²	61.2	6%	0.056	29%	0.293	C	S	.	.	H	α-helix	trans	-70.2	-35.9	177	-72.6	-71.9	174.9	0	0	112.3	V28 G31 I32 E144 E145 E146 K150 W151 N152 M216	V28-E148 HydrophobicContact CB-CG 3.91Å; V28-E148 HydrophobicContact CG1-CG 4.44Å; V28-E148 HydrophobicContact CG2-CB 4.39Å; V28-E148 HydrophobicContact CG2-CG 3.86Å; G31-E148 WeakPolarHBondContact CA-OE1 3.41Å; I32-E148 PolarHBondContact N-OE1 2.98Å; E144-E148 WeakPolarHBondContact O-CG 3.36Å; E144-E148 PolarHBondContact O-N 3.26Å; E145-E148 PolarHBondContact O-N 2.72Å; E146-E148 VanDerWaalsContact C-N 3.32Å; E146-E148 PolarHBondContact O-N 2.75Å; E148-K150 VanDerWaalsContact C-N 3.32Å; E148-K150 PolarHBondContact O-N 2.92Å; E148-W151 PolarHBondContact O-N 3.48Å; E148-N152 WeakPolarHBondContact O-CB 3.37Å; E148-N152 PolarHBondContact O-N 3.43Å; E148-N152 PolarHBondContact O-ND2 3.48Å; E148-M216 HydrophobicContact CG-CE 3.86Å; E148-M216 VanDerWaalsContact OE1-CE 3.26Å; E148-M216 WeakPolarHBondContact OE1-CE 3.49Å
149	K	96.1	Very high	95.6	Very high	101 Å²	101	68 Å²	68	44%	0.439	32%	0.324	S	S	.	.	H	α-helix	trans	-60.6	-41.8	169.8	-73.7	172.1	-166.3	171.8	0	111.5	E145 E146 K153	E145-K149 VanDerWaalsContact O-CG 3.31Å; E145-K149 WeakPolarHBondContact O-CG 3.42Å; E145-K149 PolarHBondContact O-N 3.33Å; E146-K149 PolarHBondContact O-N 2.92Å; E146-K149 IonicContact OE1-NZ 3.99Å; E146-K149 PolarHBondContact OE1-NZ 3.45Å; K149-K153 WeakPolarHBondContact O-CG 3.39Å
150	K	95.2	Very high	95.8	Very high	40 Å²	40	65.9 Å²	65.9	17%	0.174	31%	0.313	C	S	.	.	H	α-helix	trans	-61.7	-50.4	173.2	179.3	-179.7	176	177.7	0	110.4	E146 R147 E148 N152 K153 I154 N215 L217 L218 D219	E146-K150 PolarHBondContact O-N 2.9Å; R147-K150 WeakPolarHBondContact O-CB 3.29Å; R147-K150 PolarHBondContact O-N 3.44Å; E148-K150 VanDerWaalsContact C-N 3.32Å; E148-K150 PolarHBondContact O-N 2.92Å; K150-N152 VanDerWaalsContact C-N 3.32Å; K150-N152 PolarHBondContact O-N 2.94Å; K150-K153 WeakPolarHBondContact O-CB 3.24Å; K150-K153 PolarHBondContact O-N 2.71Å; K150-I154 HydrophobicContact CG-CD1 4.36Å; K150-I154 PolarHBondContact O-N 3.32Å; K150-N215 WeakPolarHBondContact CE-O 3.48Å; K150-L217 WeakPolarHBondContact CD-O 3.31Å; K150-L217 WeakPolarHBondContact CE-O 3.34Å; K150-L217 PolarHBondContact NZ-O 3.18Å; K150-L218 HydrophobicContact CB-CD2 4.29Å; K150-L218 HydrophobicContact CD-CD2 4.4Å; K150-D219 IonicContact NZ-OD1 2.69Å; K150-D219 PolarHBondContact NZ-OD1 2.92Å; K150-D219 IonicContact NZ-OD2 3.33Å; K150-D219 PolarHBondContact NZ-OD2 3.35Å
151	W	96.8	Very high	96	Very high	12 Å²	12	65.5 Å²	65.5	5%	0.045	32%	0.319	C	S	.	.	H	α-helix	trans	-53.5	-48.7	179.9	-174.6	-127.3	0	0	0	112.3	R147 E148 K153 I154 K155 N160 L164 I212 N215 M216	R147-W151 PolarHBondContact O-N 3.39Å; E148-W151 PolarHBondContact O-N 3.48Å; W151-K153 PolarHBondContact O-N 3.03Å; W151-K153 VanDerWaalsContact O-N 3.09Å; W151-I154 HydrophobicContact CE3-CD1 4.04Å; W151-I154 HydrophobicContact CE3-CG1 3.85Å; W151-I154 HydrophobicContact CZ3-CD1 4.38Å; W151-I154 HydrophobicContact CZ3-CG1 4.28Å; W151-I154 PolarHBondContact O-N 3.03Å; W151-K155 HydrophobicContact CD2-CB 4.07Å; W151-K155 HydrophobicContact CH2-CB 4.35Å; W151-K155 HydrophobicContact CZ2-CB 3.85Å; W151-K155 WeakPolarHBondContact O-CB 3.41Å; W151-K155 PolarHBondContact O-N 3.32Å; W151-N160 HydrophobicContact CH2-CB 3.64Å; W151-N160 HydrophobicContact CZ3-CB 3.89Å; W151-L164 HydrophobicContact CZ2-CD1 3.85Å; W151-L164 HydrophobicContact CZ2-CD2 3.91Å; W151-L164 HydrophobicContact CZ2-CG 3.78Å; W151-I212 HydrophobicContact CD2-CG2 4.2Å; W151-I212 HydrophobicContact CE3-CG2 4.23Å; W151-I212 HydrophobicContact CH2-CB 4.29Å; W151-I212 HydrophobicContact CH2-CG1 4.09Å; W151-I212 HydrophobicContact CH2-CG2 3.61Å; W151-I212 HydrophobicContact CZ2-CG1 4.34Å; W151-I212 HydrophobicContact CZ2-CG2 3.53Å; W151-I212 HydrophobicContact CZ3-CG2 3.95Å; W151-N215 HydrophobicContact CZ3-CB 4.25Å; W151-M216 HydrophobicContact CB-CE 3.87Å; W151-M216 HydrophobicContact CB-CG 3.79Å; W151-M216 HydrophobicContact CB-SD 4.19Å; W151-M216 HydrophobicContact CD2-CG 3.88Å; W151-M216 HydrophobicContact CD2-SD 4.27Å; W151-M216 HydrophobicContact CE3-CG 3.69Å; W151-M216 HydrophobicContact CG-CE 4.24Å; W151-M216 HydrophobicContact CG-CG 3.92Å; W151-M216 HydrophobicContact CG-SD 4.05Å
152	N	96.7	Very high	96.2	Very high	81 Å²	81	66.9 Å²	66.9	43%	0.433	33%	0.328	S	S	.	.	H	α-helix	trans	-60.3	-23.5	179.8	-78.2	-54.8	0	0	0	114	E148 K150 K155	E148-N152 WeakPolarHBondContact O-CB 3.37Å; E148-N152 PolarHBondContact O-N 3.43Å; E148-N152 PolarHBondContact O-ND2 3.48Å; K150-N152 VanDerWaalsContact C-N 3.32Å; K150-N152 PolarHBondContact O-N 2.94Å; N152-K155 PolarHBondContact OD1-NZ 3.39Å
153	K	96.8	Very high	96.4	Very high	173 Å²	173	64.1 Å²	64.1	75%	0.752	32%	0.319	S	S	*	.	H	α-helix	trans	-84.1	-22	174.7	-64.9	171.6	-174.9	176.3	0	113.5	K149 K150 W151	K149-K153 WeakPolarHBondContact O-CG 3.39Å; K150-K153 WeakPolarHBondContact O-CB 3.24Å; K150-K153 PolarHBondContact O-N 2.71Å; W151-K153 PolarHBondContact O-N 3.03Å; W151-K153 VanDerWaalsContact O-N 3.09Å
154	I	97.1	Very high	96.6	Very high	26 Å²	26	65.4 Å²	65.4	13%	0.133	33%	0.327	C	S	.	.	H	α-helix	trans	-115.2	-14.1	-171.9	68.7	173.1	0	0	0	113.9	K150 W151 D156 K157 N160 N215	K150-I154 HydrophobicContact CG-CD1 4.36Å; K150-I154 PolarHBondContact O-N 3.32Å; W151-I154 HydrophobicContact CE3-CD1 4.04Å; W151-I154 HydrophobicContact CE3-CG1 3.85Å; W151-I154 HydrophobicContact CZ3-CD1 4.38Å; W151-I154 HydrophobicContact CZ3-CG1 4.28Å; W151-I154 PolarHBondContact O-N 3.03Å; I154-D156 PolarHBondContact O-N 3.25Å; I154-K157 HydrophobicContact CB-CD 4.29Å; I154-K157 WeakPolarHBondContact O-CB 3.14Å; I154-K157 WeakPolarHBondContact O-CG 3.24Å; I154-K157 PolarHBondContact O-N 3.5Å; I154-N160 PolarHBondContact O-ND2 3.2Å; I154-N215 HydrophobicContact CD1-CB 4.42Å; I154-N215 VanDerWaalsContact CD1-O 3.31Å; I154-N215 WeakPolarHBondContact CD1-O 3.42Å
155	K	96.9	Very high	96.7	Very high	65 Å²	65	71 Å²	71	28%	0.283	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-28.4	-172.9	66	-179.4	-179.4	-170.9	0	114.2	W151 N152 K157 N160 A161 L164	W151-K155 HydrophobicContact CD2-CB 4.07Å; W151-K155 HydrophobicContact CH2-CB 4.35Å; W151-K155 HydrophobicContact CZ2-CB 3.85Å; W151-K155 WeakPolarHBondContact O-CB 3.41Å; W151-K155 PolarHBondContact O-N 3.32Å; N152-K155 PolarHBondContact OD1-NZ 3.39Å; K155-K157 VanDerWaalsContact C-N 3.32Å; K155-N160 CarbonylContact O-C 3.58Å; K155-N160 WeakPolarHBondContact O-CB 3.45Å; K155-A161 PolarHBondContact O-N 2.93Å; K155-L164 HydrophobicContact CB-CD1 4.05Å
156	D	96.6	Very high	96.9	Very high	128 Å²	128	73.2 Å²	73.2	68%	0.684	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-4.7	-178.8	-55	-46.5	0	0	0	113.2	I154	I154-D156 PolarHBondContact O-N 3.25Å
157	K	97.7	Very high	97	Very high	123 Å²	123	70.6 Å²	70.6	54%	0.535	34%	0.344	S	S	.	.	S	Bend	trans	-64.2	144.4	171.7	-66.5	-178.9	179.5	-178.3	0	109.5	I154 K155 E159 N160 A161	I154-K157 HydrophobicContact CB-CD 4.29Å; I154-K157 WeakPolarHBondContact O-CB 3.14Å; I154-K157 WeakPolarHBondContact O-CG 3.24Å; I154-K157 PolarHBondContact O-N 3.5Å; K155-K157 VanDerWaalsContact C-N 3.32Å; K157-E159 VanDerWaalsContact C-N 3.32Å; K157-E159 PolarHBondContact O-N 3.05Å; K157-E159 VanDerWaalsContact O-N 3.13Å; K157-N160 PolarHBondContact O-N 3.48Å; K157-A161 PolarHBondContact O-N 3.5Å
158	P	96.7	Very high	97.2	Very high	117 Å²	117	73.1 Å²	73.1	76%	0.76	36%	0.358	S	S	*	.	H	α-helix	trans	-50.4	-44.7	-172.7	-30	34.7	0	0	0	115.1	N160 A161 D162	P158-N160 PolarHBondContact O-N 3.43Å; P158-A161 PolarHBondContact O-N 2.89Å; P158-D162 PolarHBondContact O-N 2.97Å
159	E	95.4	Very high	97.3	Very high	141 Å²	141	76.1 Å²	76.1	66%	0.659	37%	0.373	S	S	*	.	H	α-helix	trans	-61.5	-42.8	177.8	-175.9	-175.7	172.3	0	0	112.5	K157 L163	K157-E159 VanDerWaalsContact C-N 3.32Å; K157-E159 PolarHBondContact O-N 3.05Å; K157-E159 VanDerWaalsContact O-N 3.13Å; E159-L163 WeakPolarHBondContact O-CG 3.27Å; E159-L163 PolarHBondContact O-N 3.28Å
160	N	97.8	Very high	97.4	Very high	8 Å²	8	71.4 Å²	71.4	4%	0.043	35%	0.353	C	S	.	.	H	α-helix	trans	-76.2	-35.2	-179.5	-69.9	-34.6	0	0	0	112.4	W151 I154 K155 K157 P158 D162 L163 L164 N215	W151-N160 HydrophobicContact CH2-CB 3.64Å; W151-N160 HydrophobicContact CZ3-CB 3.89Å; I154-N160 PolarHBondContact O-ND2 3.2Å; K155-N160 CarbonylContact O-C 3.58Å; K155-N160 WeakPolarHBondContact O-CB 3.45Å; K157-N160 PolarHBondContact O-N 3.48Å; P158-N160 PolarHBondContact O-N 3.43Å; N160-D162 VanDerWaalsContact C-N 3.32Å; N160-L163 PolarHBondContact O-N 2.95Å; N160-L164 PolarHBondContact O-N 2.96Å; N160-N215 PolarHBondContact OD1-ND2 2.97Å
161	A	97.7	Very high	97.5	Very high	42 Å²	42	71.2 Å²	71.2	35%	0.347	35%	0.353	S	S	.	.	H	α-helix	trans	-64.9	-38	175.1	0	0	0	0	0	111.3	K155 K157 P158 L164 K165	K155-A161 PolarHBondContact O-N 2.93Å; K157-A161 PolarHBondContact O-N 3.5Å; P158-A161 PolarHBondContact O-N 2.89Å; A161-L164 PolarHBondContact O-N 3.31Å; A161-K165 WeakPolarHBondContact O-CB 3.26Å; A161-K165 PolarHBondContact O-N 3.45Å
162	D	98.1	Very high	97.5	Very high	99 Å²	99	77.4 Å²	77.4	53%	0.529	38%	0.38	S	S	.	.	H	α-helix	trans	-65	-43.6	173.9	-171.3	65	0	0	0	112	P158 N160 L164 K165 R166	P158-D162 PolarHBondContact O-N 2.97Å; N160-D162 VanDerWaalsContact C-N 3.32Å; D162-L164 PolarHBondContact O-N 3.41Å; D162-K165 PolarHBondContact O-N 3.23Å; D162-R166 WeakPolarHBondContact O-CB 3.49Å; D162-R166 PolarHBondContact O-N 3.45Å
163	L	98.3	Very high	97.6	Very high	23 Å²	23	76.7 Å²	76.7	12%	0.12	37%	0.374	C	S	.	.	H	α-helix	trans	-57.9	-46.1	173.7	-71.2	172.4	0	0	0	112	E159 N160 R166 F167 V208 N211 I212	E159-L163 WeakPolarHBondContact O-CG 3.27Å; E159-L163 PolarHBondContact O-N 3.28Å; N160-L163 PolarHBondContact O-N 2.95Å; L163-R166 PolarHBondContact O-N 2.64Å; L163-F167 WeakPolarHBondContact O-CB 3.46Å; L163-F167 PolarHBondContact O-N 3.48Å; L163-V208 HydrophobicContact CB-CG1 4.39Å; L163-V208 HydrophobicContact CD2-CG1 4.24Å; L163-V208 VanDerWaalsContact O-CG1 3.22Å; L163-V208 WeakPolarHBondContact O-CG1 3.48Å; L163-N211 HydrophobicContact CD1-CB 4.16Å; L163-N211 HydrophobicContact CD2-CB 4.03Å; L163-I212 HydrophobicContact CB-CD1 4.18Å; L163-I212 HydrophobicContact CB-CG1 3.78Å; L163-I212 HydrophobicContact CD1-CG1 4.13Å
164	L	97.9	Very high	97.6	Very high	39 Å²	39	68.8 Å²	68.8	20%	0.204	34%	0.34	C	S	.	.	H	α-helix	trans	-62.4	-44.7	176.9	-78	173.8	0	0	0	112.2	W151 K155 N160 A161 D162 R166 F167 D168 I212	W151-L164 HydrophobicContact CZ2-CD1 3.85Å; W151-L164 HydrophobicContact CZ2-CD2 3.91Å; W151-L164 HydrophobicContact CZ2-CG 3.78Å; K155-L164 HydrophobicContact CB-CD1 4.05Å; N160-L164 PolarHBondContact O-N 2.96Å; A161-L164 PolarHBondContact O-N 3.31Å; D162-L164 PolarHBondContact O-N 3.41Å; L164-R166 VanDerWaalsContact C-N 3.3Å; L164-R166 PolarHBondContact O-N 3.35Å; L164-F167 WeakPolarHBondContact O-CB 3.46Å; L164-F167 PolarHBondContact O-N 2.81Å; L164-D168 VanDerWaalsContact O-CG 3.28Å; L164-D168 PolarHBondContact O-N 2.8Å; L164-I212 HydrophobicContact CD2-CD1 4.19Å
165	K	98.2	Very high	97.5	Very high	131 Å²	131	70.1 Å²	70.1	57%	0.57	35%	0.347	S	S	*	.	H	α-helix	trans	-60.3	-42	176.4	-176.6	-177.4	177.3	-173.7	0	111.4	A161 D162 D168 I169	A161-K165 WeakPolarHBondContact O-CB 3.26Å; A161-K165 PolarHBondContact O-N 3.45Å; D162-K165 PolarHBondContact O-N 3.23Å; K165-D168 PolarHBondContact O-N 2.87Å; K165-I169 HydrophobicContact CG-CD1 4.2Å; K165-I169 WeakPolarHBondContact O-CG1 3.48Å; K165-I169 PolarHBondContact O-N 2.97Å; K165-I169 VanDerWaalsContact O-N 3.08Å
166	R	98.3	Very high	97.4	Very high	120 Å²	120	71.5 Å²	71.5	45%	0.453	36%	0.357	S	S	.	.	H	α-helix	trans	-67.4	-39.3	177.3	-167.9	166.6	-179.1	163.6	-1.8	111.8	D162 L163 L164 D168 I169 L170 E204 V208	D162-R166 WeakPolarHBondContact O-CB 3.49Å; D162-R166 PolarHBondContact O-N 3.45Å; L163-R166 PolarHBondContact O-N 2.64Å; L164-R166 VanDerWaalsContact C-N 3.3Å; L164-R166 PolarHBondContact O-N 3.35Å; R166-D168 VanDerWaalsContact C-N 3.35Å; R166-D168 PolarHBondContact O-N 3.43Å; R166-I169 PolarHBondContact O-N 3.39Å; R166-L170 HydrophobicContact CG-CD1 3.97Å; R166-L170 HydrophobicContact CG-CG 4.43Å; R166-L170 WeakPolarHBondContact O-CB 3.35Å; R166-L170 VanDerWaalsContact O-CG 3.32Å; R166-L170 WeakPolarHBondContact O-CG 3.28Å; R166-L170 PolarHBondContact O-N 3.02Å; R166-E204 IonicContact CZ-OE2 2.72Å; R166-E204 IonicContact NE-OE2 3.62Å; R166-E204 IonicContact NH2-OE2 3.14Å; R166-E204 PolarHBondContact NH2-OE2 3.29Å; R166-V208 HydrophobicContact CB-CG2 4.36Å; R166-V208 HydrophobicContact CG-CG2 3.98Å
167	F	98.3	Very high	97.3	Very high	0 Å²	0	66.6 Å²	66.6	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-58	-47.1	172.6	-169.5	-81.1	0	0	0	111.2	I32 R35 M36 L163 L164 I169 L170 E171 M205 V208 Y209 I212	I32-F167 HydrophobicContact CD1-CD1 4.16Å; I32-F167 HydrophobicContact CD1-CD2 4.09Å; I32-F167 HydrophobicContact CD1-CE1 4.02Å; I32-F167 HydrophobicContact CD1-CE2 3.92Å; I32-F167 HydrophobicContact CD1-CG 4.2Å; I32-F167 HydrophobicContact CD1-CZ 3.88Å; R35-F167 HydrophobicContact CG-CE1 4.08Å; M36-F167 HydrophobicContact CE-CE2 3.98Å; M36-F167 HydrophobicContact CE-CZ 4.42Å; M36-F167 HydrophobicContact SD-CZ 4.43Å; L163-F167 WeakPolarHBondContact O-CB 3.46Å; L163-F167 PolarHBondContact O-N 3.48Å; L164-F167 WeakPolarHBondContact O-CB 3.46Å; L164-F167 PolarHBondContact O-N 2.81Å; F167-I169 VanDerWaalsContact C-N 3.32Å; F167-I169 PolarHBondContact O-N 3.34Å; F167-L170 PolarHBondContact O-N 2.98Å; F167-E171 WeakPolarHBondContact O-CB 3.43Å; F167-E171 PolarHBondContact O-N 3.41Å; F167-M205 HydrophobicContact CD2-CG 4.47Å; F167-M205 HydrophobicContact CE1-CE 3.73Å; F167-M205 HydrophobicContact CE2-CE 3.87Å; F167-M205 HydrophobicContact CE2-CG 4.21Å; F167-M205 HydrophobicContact CZ-CE 3.38Å; F167-V208 HydrophobicContact CB-CG1 3.9Å; F167-V208 HydrophobicContact CD2-CG1 4.27Å; F167-Y209 HydrophobicContact CE2-CD2 4.28Å; F167-I212 HydrophobicContact CB-CD1 4.45Å; F167-I212 HydrophobicContact CD2-CD1 4.44Å
168	D	98	Very high	97	Very high	55 Å²	55	61.9 Å²	61.9	29%	0.294	31%	0.311	S	S	.	.	H	α-helix	trans	-60.8	-38.8	178.2	-67.2	-13.4	0	0	0	112.9	R35 L164 K165 R166 K172	R35-D168 IonicContact CZ-OD1 2.62Å; R35-D168 IonicContact NH1-OD1 3.12Å; R35-D168 PolarHBondContact NH1-OD1 3.32Å; R35-D168 IonicContact NH2-OD1 2.89Å; R35-D168 PolarHBondContact NH2-OD1 3.02Å; L164-D168 VanDerWaalsContact O-CG 3.28Å; L164-D168 PolarHBondContact O-N 2.8Å; K165-D168 PolarHBondContact O-N 2.87Å; R166-D168 VanDerWaalsContact C-N 3.35Å; R166-D168 PolarHBondContact O-N 3.43Å; D168-K172 WeakPolarHBondContact O-CD 3.29Å; D168-K172 VanDerWaalsContact O-CG 3.29Å; D168-K172 WeakPolarHBondContact O-CG 3.39Å; D168-K172 PolarHBondContact O-N 3.08Å
169	I	98.6	Very high	96.8	Very high	74 Å²	74	58.8 Å²	58.8	38%	0.379	30%	0.295	S	S	.	.	H	α-helix	trans	-66.9	-50.2	177.2	-70	165.3	0	0	0	110	K165 R166 F167 E171 K172 E173	K165-I169 HydrophobicContact CG-CD1 4.2Å; K165-I169 WeakPolarHBondContact O-CG1 3.48Å; K165-I169 PolarHBondContact O-N 2.97Å; K165-I169 VanDerWaalsContact O-N 3.08Å; R166-I169 PolarHBondContact O-N 3.39Å; F167-I169 VanDerWaalsContact C-N 3.32Å; F167-I169 PolarHBondContact O-N 3.34Å; I169-E171 PolarHBondContact O-N 3.32Å; I169-K172 PolarHBondContact O-N 3.19Å; I169-E173 HydrophobicContact CG2-CG 4.29Å; I169-E173 WeakPolarHBondContact O-CG 3.46Å; I169-E173 PolarHBondContact O-N 2.94Å
170	L	98.4	Very high	96.6	Very high	3 Å²	3	56.7 Å²	56.7	2%	0.016	29%	0.285	C	S	.	.	H	α-helix	trans	-63.2	-40	-178.3	-71.5	167.2	0	0	0	112.3	R166 F167 K172 E173 L174 K201 E204 M205 V208	R166-L170 HydrophobicContact CG-CD1 3.97Å; R166-L170 HydrophobicContact CG-CG 4.43Å; R166-L170 WeakPolarHBondContact O-CB 3.35Å; R166-L170 VanDerWaalsContact O-CG 3.32Å; R166-L170 WeakPolarHBondContact O-CG 3.28Å; R166-L170 PolarHBondContact O-N 3.02Å; F167-L170 PolarHBondContact O-N 2.98Å; L170-K172 VanDerWaalsContact C-N 3.31Å; L170-K172 PolarHBondContact O-N 2.65Å; L170-E173 PolarHBondContact O-N 3.49Å; L170-L174 VanDerWaalsContact O-CB 3.28Å; L170-L174 WeakPolarHBondContact O-CB 3.43Å; L170-L174 PolarHBondContact O-N 2.66Å; L170-K201 HydrophobicContact CD2-CD 3.83Å; L170-E204 HydrophobicContact CD1-CB 3.86Å; L170-E204 HydrophobicContact CD2-CB 3.85Å; L170-M205 HydrophobicContact CB-CB 4.18Å; L170-M205 HydrophobicContact CB-CG 4.34Å; L170-M205 HydrophobicContact CD1-CB 4.34Å; L170-V208 HydrophobicContact CD1-CG2 3.92Å
171	E	97.2	Very high	96.2	Very high	35 Å²	35	56.7 Å²	56.7	16%	0.164	29%	0.287	C	S	.	.	H	α-helix	trans	-60.9	-41	175.4	-174.3	177.4	-171.3	0	0	111.7	R35 F39 F167 I169 N175 M205	R35-E171 IonicContact CZ-OE2 3.89Å; R35-E171 IonicContact NE-OE2 2.66Å; R35-E171 PolarHBondContact NE-OE2 3.03Å; R35-E171 IonicContact NH2-OE2 2.71Å; R35-E171 PolarHBondContact NH2-OE2 3.23Å; F39-E171 HydrophobicContact CD2-CG 3.64Å; F39-E171 HydrophobicContact CE2-CG 3.98Å; F167-E171 WeakPolarHBondContact O-CB 3.43Å; F167-E171 PolarHBondContact O-N 3.41Å; I169-E171 PolarHBondContact O-N 3.32Å; E171-N175 WeakPolarHBondContact O-CB 3.22Å; E171-N175 PolarHBondContact O-N 3.31Å; E171-N175 VanDerWaalsContact O-N 3.08Å; E171-N175 PolarHBondContact O-ND2 3.47Å; E171-M205 HydrophobicContact CB-CE 3.98Å; E171-M205 HydrophobicContact CG-CE 4.2Å
172	K	97.7	Very high	95.5	Very high	142 Å²	142	59.3 Å²	59.3	62%	0.617	29%	0.291	S	S	*	.	H	α-helix	trans	-67.7	-47.9	176.3	-72.2	170.5	-174.1	172.7	0	111.7	D168 I169 L170 L174 N175 I176	D168-K172 WeakPolarHBondContact O-CD 3.29Å; D168-K172 VanDerWaalsContact O-CG 3.29Å; D168-K172 WeakPolarHBondContact O-CG 3.39Å; D168-K172 PolarHBondContact O-N 3.08Å; I169-K172 PolarHBondContact O-N 3.19Å; L170-K172 VanDerWaalsContact C-N 3.31Å; L170-K172 PolarHBondContact O-N 2.65Å; K172-L174 PolarHBondContact O-N 3.25Å; K172-N175 PolarHBondContact O-N 2.95Å; K172-I176 WeakPolarHBondContact O-CG1 3.11Å; K172-I176 PolarHBondContact O-N 2.88Å
173	E	97.4	Very high	94.9	Very high	67 Å²	67	59.6 Å²	59.6	31%	0.313	30%	0.3	S	S	.	.	H	α-helix	trans	-59	-46.8	178.7	-73	179.7	170.3	0	0	111.1	I169 L170 N175 I176 L177 K201	I169-E173 HydrophobicContact CG2-CG 4.29Å; I169-E173 WeakPolarHBondContact O-CG 3.46Å; I169-E173 PolarHBondContact O-N 2.94Å; L170-E173 PolarHBondContact O-N 3.49Å; E173-N175 VanDerWaalsContact C-N 3.34Å; E173-N175 PolarHBondContact O-N 2.7Å; E173-I176 PolarHBondContact O-N 3.37Å; E173-L177 WeakPolarHBondContact O-CG 3.25Å; E173-L177 PolarHBondContact O-N 2.85Å; E173-K201 IonicContact OE1-NZ 2.69Å; E173-K201 VanDerWaalsContact OE2-CD 3.29Å; E173-K201 WeakPolarHBondContact OE2-CD 3.47Å; E173-K201 WeakPolarHBondContact OE2-CE 3.29Å; E173-K201 IonicContact OE2-NZ 3.31Å; E173-K201 PolarHBondContact OE2-NZ 3.12Å
174	L	96.5	Very high	94.3	Very high	7 Å²	7	60 Å²	60	4%	0.037	30%	0.302	C	S	.	.	H	α-helix	trans	-65.9	-37.5	179.6	-168.2	59.9	0	0	0	111.7	F39 L170 K172 I176 L177 L178 M198 K201 W202 M205	F39-L174 HydrophobicContact CE1-CD2 3.59Å; F39-L174 HydrophobicContact CE1-CG 4.38Å; F39-L174 HydrophobicContact CZ-CB 4.1Å; F39-L174 HydrophobicContact CZ-CD2 3.43Å; F39-L174 VanDerWaalsContact CZ-CD2 3.43Å; F39-L174 HydrophobicContact CZ-CG 3.76Å; L170-L174 VanDerWaalsContact O-CB 3.28Å; L170-L174 WeakPolarHBondContact O-CB 3.43Å; L170-L174 PolarHBondContact O-N 2.66Å; K172-L174 PolarHBondContact O-N 3.25Å; L174-I176 PolarHBondContact O-N 2.88Å; L174-L177 PolarHBondContact O-N 2.92Å; L174-L178 HydrophobicContact CD1-CG 4.48Å; L174-L178 HydrophobicContact CG-CD1 4.07Å; L174-L178 HydrophobicContact CG-CG 4.36Å; L174-L178 VanDerWaalsContact O-CB 3.26Å; L174-L178 WeakPolarHBondContact O-CB 3.33Å; L174-L178 WeakPolarHBondContact O-CG 3.46Å; L174-L178 PolarHBondContact O-N 2.94Å; L174-M198 HydrophobicContact CD1-CB 4.29Å; L174-M198 HydrophobicContact CD1-CG 4.48Å; L174-K201 HydrophobicContact CD1-CB 4.3Å; L174-W202 HydrophobicContact CD2-CB 4.33Å; L174-W202 HydrophobicContact CD2-CE3 3.7Å; L174-W202 HydrophobicContact CD2-CZ3 4.46Å; L174-M205 HydrophobicContact CD2-SD 4.16Å
175	N	94.8	Very high	93.8	Very high	53 Å²	53	61.7 Å²	61.7	28%	0.283	31%	0.314	S	S	.	.	H	α-helix	trans	-62.5	-39.5	173.2	-86.5	-45.7	0	0	0	113.3	N43 E171 K172 E173 A179	N43-N175 PolarHBondContact ND2-OD1 2.94Å; E171-N175 WeakPolarHBondContact O-CB 3.22Å; E171-N175 PolarHBondContact O-N 3.31Å; E171-N175 VanDerWaalsContact O-N 3.08Å; E171-N175 PolarHBondContact O-ND2 3.47Å; K172-N175 PolarHBondContact O-N 2.95Å; E173-N175 VanDerWaalsContact C-N 3.34Å; E173-N175 PolarHBondContact O-N 2.7Å; N175-A179 WeakPolarHBondContact O-CB 3.13Å; N175-A179 PolarHBondContact O-N 2.97Å
176	I	95.2	Very high	93.1	Very high	95 Å²	95	58.5 Å²	58.5	49%	0.487	31%	0.307	S	S	.	.	H	α-helix	trans	-63.6	-51.9	175.4	-68.8	164.4	0	0	0	109.6	K172 E173 L174 L178 A179 E180	K172-I176 WeakPolarHBondContact O-CG1 3.11Å; K172-I176 PolarHBondContact O-N 2.88Å; E173-I176 PolarHBondContact O-N 3.37Å; L174-I176 PolarHBondContact O-N 2.88Å; I176-L178 PolarHBondContact O-N 3.07Å; I176-A179 PolarHBondContact O-N 3.17Å; I176-A179 VanDerWaalsContact O-N 3.12Å; I176-E180 HydrophobicContact CG2-CG 4.47Å; I176-E180 WeakPolarHBondContact CG2-OE1 3.45Å; I176-E180 WeakPolarHBondContact O-CG 3.44Å; I176-E180 PolarHBondContact O-N 3.23Å
177	L	94.6	Very high	92.7	Very high	25 Å²	25	62.2 Å²	62.2	13%	0.131	33%	0.326	C	S	.	.	H	α-helix	trans	-57.8	-48.3	179	-65.4	170.2	0	0	0	111.1	E173 L174 A179 E180 G181 M194 N197 M198 K201	E173-L177 WeakPolarHBondContact O-CG 3.25Å; E173-L177 PolarHBondContact O-N 2.85Å; L174-L177 PolarHBondContact O-N 2.92Å; L177-A179 VanDerWaalsContact C-N 3.28Å; L177-A179 PolarHBondContact O-N 3.4Å; L177-E180 PolarHBondContact O-N 2.86Å; L177-G181 PolarHBondContact O-N 2.8Å; L177-M194 HydrophobicContact CB-SD 4.02Å; L177-M194 HydrophobicContact CD2-CE 4.09Å; L177-M194 HydrophobicContact CD2-SD 3.41Å; L177-M194 WeakPolarHBondContact CD2-SD 3.37Å; L177-M194 HydrophobicContact CG-SD 4.31Å; L177-N197 HydrophobicContact CD1-CB 4.28Å; L177-N197 HydrophobicContact CD2-CB 4.37Å; L177-M198 HydrophobicContact CB-CE 4.15Å; L177-M198 HydrophobicContact CB-CG 3.67Å; L177-M198 HydrophobicContact CD1-CG 4.26Å; L177-M198 WeakPolarHBondContact O-CE 3.39Å; L177-K201 HydrophobicContact CD1-CB 4.36Å; L177-K201 HydrophobicContact CD1-CG 3.88Å
178	L	92.4	Very high	92.4	Very high	24 Å²	24	63.8 Å²	63.8	13%	0.126	34%	0.337	C	S	.	.	H	α-helix	trans	-59.9	-36	178	-74.7	171.6	0	0	0	112.7	F39 N45 L46 L174 I176 K182 M198	F39-L178 HydrophobicContact CZ-CD1 3.94Å; N45-L178 HydrophobicContact CB-CB 3.73Å; L46-L178 HydrophobicContact CD2-CD1 4.06Å; L46-L178 HydrophobicContact CD2-CD2 3.72Å; L46-L178 HydrophobicContact CG-CD1 4.31Å; L174-L178 HydrophobicContact CD1-CG 4.48Å; L174-L178 HydrophobicContact CG-CD1 4.07Å; L174-L178 HydrophobicContact CG-CG 4.36Å; L174-L178 VanDerWaalsContact O-CB 3.26Å; L174-L178 WeakPolarHBondContact O-CB 3.33Å; L174-L178 WeakPolarHBondContact O-CG 3.46Å; L174-L178 PolarHBondContact O-N 2.94Å; I176-L178 PolarHBondContact O-N 3.07Å; L178-K182 PolarHBondContact O-N 3.12Å; L178-M198 HydrophobicContact CD2-SD 4Å
179	A	91.7	Very high	92.1	Very high	51 Å²	51	67.1 Å²	67.1	42%	0.421	36%	0.361	S	S	.	.	H	α-helix	trans	-71.4	-42.7	176.5	0	0	0	0	0	112.2	N175 I176 L177	N175-A179 WeakPolarHBondContact O-CB 3.13Å; N175-A179 PolarHBondContact O-N 2.97Å; I176-A179 PolarHBondContact O-N 3.17Å; I176-A179 VanDerWaalsContact O-N 3.12Å; L177-A179 VanDerWaalsContact C-N 3.28Å; L177-A179 PolarHBondContact O-N 3.4Å
180	E	91.2	Very high	91.8	Very high	98 Å²	98	65.5 Å²	65.5	46%	0.458	36%	0.363	S	S	.	.	H	α-helix	trans	-65.4	-44.7	176.7	-70.7	176.1	-176.1	0	0	111.2	I176 L177 K182 S183 M194	I176-E180 HydrophobicContact CG2-CG 4.47Å; I176-E180 WeakPolarHBondContact CG2-OE1 3.45Å; I176-E180 WeakPolarHBondContact O-CG 3.44Å; I176-E180 PolarHBondContact O-N 3.23Å; L177-E180 PolarHBondContact O-N 2.86Å; E180-K182 PolarHBondContact O-N 3.42Å; E180-S183 PolarHBondContact O-N 2.96Å; E180-S183 VanDerWaalsContact O-N 3.08Å; E180-S183 PolarHBondContact O-OG 3.21Å; E180-M194 HydrophobicContact CB-CE 3.92Å; E180-M194 WeakPolarHBondContact OE2-CE 3.26Å
181	G	89	Confident	91.5	Very high	7 Å²	7	65.8 Å²	65.8	7%	0.072	37%	0.366	C	S	.	.	H	α-helix	trans	-60.6	-26.8	-179.3	0	0	0	0	0	114	M1 L177 S183 M184	M1-G181 WeakPolarHBondContact CE-O 3.42Å; L177-G181 PolarHBondContact O-N 2.8Å; G181-S183 PolarHBondContact O-N 3.49Å; G181-M184 WeakPolarHBondContact O-CB 3.36Å; G181-M184 PolarHBondContact O-N 3.03Å
182	K	84.8	Confident	91.2	Very high	98 Å²	98	67.3 Å²	67.3	43%	0.426	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-31.2	174.7	-91.6	-174.9	157.5	165.5	0	114.1	R44 N45 L178 E180 M184	R44-K182 PolarHBondContact O-NZ 3.02Å; N45-K182 HydrophobicContact CB-CD 4.4Å; N45-K182 WeakPolarHBondContact OD1-CD 3.44Å; N45-K182 WeakPolarHBondContact OD1-CE 3.49Å; N45-K182 PolarHBondContact OD1-NZ 2.92Å; L178-K182 PolarHBondContact O-N 3.12Å; E180-K182 PolarHBondContact O-N 3.42Å; K182-M184 VanDerWaalsContact C-N 3.29Å
183	S	83.9	Confident	91	Very high	104 Å²	104	67 Å²	67	73%	0.727	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-9.5	179	71.9	0	0	0	0	113	E180 G181	E180-S183 PolarHBondContact O-N 2.96Å; E180-S183 VanDerWaalsContact O-N 3.08Å; E180-S183 PolarHBondContact O-OG 3.21Å; G181-S183 PolarHBondContact O-N 3.49Å
184	M	86.7	Confident	90.8	Very high	33 Å²	33	65 Å²	65	16%	0.163	37%	0.367	C	S	.	.			trans	-93.6	152	-174.1	-58.6	-174.1	83.7	0	0	111.7	M1 G181 K182 P189 A191 M194	M1-M184 HydrophobicContact CE-CB 4.48Å; M1-M184 WeakPolarHBondContact CE-O 3.33Å; G181-M184 WeakPolarHBondContact O-CB 3.36Å; G181-M184 PolarHBondContact O-N 3.03Å; K182-M184 VanDerWaalsContact C-N 3.29Å; M184-P189 VanDerWaalsContact CE-O 3.3Å; M184-P189 WeakPolarHBondContact CE-O 2.93Å; M184-A191 VanDerWaalsContact CE-CA 3.48Å; M184-A191 HydrophobicContact CE-CB 4.02Å; M184-M194 HydrophobicContact CE-CB 4.41Å; M184-M194 HydrophobicContact SD-CB 3.91Å; M184-M194 HydrophobicContact SD-CE 4.31Å; M184-M194 HydrophobicContact SD-CG 3.76Å
185	T	87	Confident	90.5	Very high	74 Å²	74	65.5 Å²	65.5	45%	0.454	37%	0.369	S	S	.	.			trans	-111.2	163.9	166.3	71.1	0	0	0	0	109	K187 S188 A191	T185-K187 PolarHBondContact O-N 2.92Å; T185-K187 PolarHBondContact OG1-N 3.27Å; T185-S188 PolarHBondContact N-OG 3.44Å; T185-S188 WeakPolarHBondContact O-CB 3.23Å; T185-S188 PolarHBondContact O-N 2.94Å; T185-S188 PolarHBondContact O-OG 3.4Å; T185-S188 PolarHBondContact OG1-N 3.48Å; T185-S188 PolarHBondContact OG1-OG 3.5Å; T185-A191 WeakPolarHBondContact O-CB 3.45Å
186	P	83.3	Confident	90.4	Very high	64 Å²	64	67.8 Å²	67.8	42%	0.416	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-12.2	174	-26.1	35.6	0	0	0	115.4	R4	R4-P186 PolarHBondContact NH2-O 3.47Å; R4-P186 VanDerWaalsContact NH2-O 3.15Å
187	K	89.6	Confident	90.4	Very high	197 Å²	197	66.1 Å²	66.1	86%	0.857	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.1	-5.4	177	-61.9	-175.7	179.4	-178.2	0	113.1	T185	T185-K187 PolarHBondContact O-N 2.92Å; T185-K187 PolarHBondContact OG1-N 3.27Å
188	S	91.9	Very high	90.5	Very high	33 Å²	33	65.3 Å²	65.3	23%	0.231	37%	0.37	C	S	.	.	S	Bend	trans	-64.9	140.9	178.5	-65.6	0	0	0	0	110	T185 G190 A191	T185-S188 PolarHBondContact N-OG 3.44Å; T185-S188 WeakPolarHBondContact O-CB 3.23Å; T185-S188 PolarHBondContact O-N 2.94Å; T185-S188 PolarHBondContact O-OG 3.4Å; T185-S188 PolarHBondContact OG1-N 3.48Å; T185-S188 PolarHBondContact OG1-OG 3.5Å; S188-G190 PolarHBondContact O-N 3.46Å; S188-A191 WeakPolarHBondContact O-CB 3.45Å; S188-A191 PolarHBondContact O-N 3.34Å; S188-A191 VanDerWaalsContact O-N 3.12Å
189	P	93.4	Very high	90.5	Very high	125 Å²	125	65.7 Å²	65.7	81%	0.812	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	135.4	171.9	-24.7	34.3	0	0	0	111	M184 A191	M184-P189 VanDerWaalsContact CE-O 3.3Å; M184-P189 WeakPolarHBondContact CE-O 2.93Å; P189-A191 PolarHBondContact O-N 3.15Å
190	G	91.8	Very high	90.8	Very high	41 Å²	41	67.3 Å²	67.3	42%	0.423	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.4	4.5	-179.1	0	0	0	0	0	115.6	S188 D192 E193 M194	S188-G190 PolarHBondContact O-N 3.46Å; G190-D192 VanDerWaalsContact C-N 3.28Å; G190-D192 PolarHBondContact O-N 3.25Å; G190-E193 PolarHBondContact O-N 2.96Å; G190-M194 WeakPolarHBondContact O-CB 3.45Å; G190-M194 PolarHBondContact O-N 3.3Å
191	A	91.6	Very high	91.1	Very high	9 Å²	9	65 Å²	65	7%	0.074	37%	0.366	C	S	.	.	H	α-helix	trans	-59	-38.5	-179.2	0	0	0	0	0	113	M184 T185 S188 P189 M195	M184-A191 VanDerWaalsContact CE-CA 3.48Å; M184-A191 HydrophobicContact CE-CB 4.02Å; T185-A191 WeakPolarHBondContact O-CB 3.45Å; S188-A191 WeakPolarHBondContact O-CB 3.45Å; S188-A191 PolarHBondContact O-N 3.34Å; S188-A191 VanDerWaalsContact O-N 3.12Å; P189-A191 PolarHBondContact O-N 3.15Å; A191-M195 VanDerWaalsContact O-CG 3.27Å; A191-M195 WeakPolarHBondContact O-CG 3.37Å; A191-M195 PolarHBondContact O-N 3.47Å
192	D	92	Very high	91.5	Very high	67 Å²	67	65.2 Å²	65.2	36%	0.358	36%	0.364	S	S	.	.	H	α-helix	trans	-69.5	-44.2	-179.5	-70.5	-14.5	0	0	0	111.6	R4 G190 M194 M195 D196	R4-D192 VanDerWaalsContact CZ-CG 3.49Å; R4-D192 IonicContact CZ-OD1 2.79Å; R4-D192 IonicContact CZ-OD2 3.36Å; R4-D192 IonicContact NE-OD1 3.33Å; R4-D192 PolarHBondContact NE-OD1 3.38Å; R4-D192 IonicContact NH1-OD1 2.77Å; R4-D192 PolarHBondContact NH1-OD1 2.9Å; R4-D192 IonicContact NH1-OD2 2.81Å; R4-D192 PolarHBondContact NH1-OD2 3.39Å; R4-D192 IonicContact NH2-OD1 3.06Å; R4-D192 PolarHBondContact NH2-OD1 3.47Å; R4-D192 IonicContact NH2-OD2 3.25Å; R4-D192 PolarHBondContact NH2-OD2 3.33Å; G190-D192 VanDerWaalsContact C-N 3.28Å; G190-D192 PolarHBondContact O-N 3.25Å; D192-M194 VanDerWaalsContact C-N 3.34Å; D192-M194 PolarHBondContact O-N 3.25Å; D192-M195 PolarHBondContact O-N 3.15Å; D192-D196 PolarHBondContact O-N 3.5Å
193	E	93.4	Very high	92.1	Very high	134 Å²	134	66.1 Å²	66.1	63%	0.626	37%	0.368	S	S	*	.	H	α-helix	trans	-60.8	-42.1	174.6	-176.5	-179.4	178.7	0	0	112	G190 M195 D196 N197	G190-E193 PolarHBondContact O-N 2.96Å; E193-M195 PolarHBondContact O-N 3.01Å; E193-D196 PolarHBondContact O-N 2.91Å; E193-N197 WeakPolarHBondContact O-CB 3.34Å; E193-N197 PolarHBondContact O-N 2.99Å; E193-N197 PolarHBondContact O-ND2 2.88Å
194	M	92.5	Very high	92.8	Very high	26 Å²	26	62.9 Å²	62.9	13%	0.128	34%	0.341	C	S	.	.	H	α-helix	trans	-59.1	-46.2	174.6	177	60.2	70.2	0	0	111.6	L177 E180 M184 G190 D192 N197 M198	L177-M194 HydrophobicContact CB-SD 4.02Å; L177-M194 HydrophobicContact CD2-CE 4.09Å; L177-M194 HydrophobicContact CD2-SD 3.41Å; L177-M194 WeakPolarHBondContact CD2-SD 3.37Å; L177-M194 HydrophobicContact CG-SD 4.31Å; E180-M194 HydrophobicContact CB-CE 3.92Å; E180-M194 WeakPolarHBondContact OE2-CE 3.26Å; M184-M194 HydrophobicContact CE-CB 4.41Å; M184-M194 HydrophobicContact SD-CB 3.91Å; M184-M194 HydrophobicContact SD-CE 4.31Å; M184-M194 HydrophobicContact SD-CG 3.76Å; G190-M194 WeakPolarHBondContact O-CB 3.45Å; G190-M194 PolarHBondContact O-N 3.3Å; D192-M194 VanDerWaalsContact C-N 3.34Å; D192-M194 PolarHBondContact O-N 3.25Å; M194-N197 PolarHBondContact O-N 2.98Å; M194-M198 HydrophobicContact CG-CE 3.66Å; M194-M198 WeakPolarHBondContact O-CG 3.16Å; M194-M198 PolarHBondContact O-N 2.89Å; M194-M198 HydrophobicContact SD-CE 3.76Å
195	M	90.2	Very high	93.3	Very high	17 Å²	17	61.3 Å²	61.3	8%	0.084	33%	0.334	C	S	.	.	H	α-helix	trans	-65.4	-41.5	179.1	-71.8	-51.9	-48.4	0	0	112.2	L3 F7 A191 D192 E193 N197 M198 A199	L3-M195 HydrophobicContact CD2-CE 3.62Å; L3-M195 HydrophobicContact CD2-SD 3.92Å; F7-M195 HydrophobicContact CD2-CE 3.14Å; F7-M195 HydrophobicContact CE2-CE 3.32Å; F7-M195 HydrophobicContact CG-CE 4.14Å; F7-M195 HydrophobicContact CZ-CE 4.43Å; A191-M195 VanDerWaalsContact O-CG 3.27Å; A191-M195 WeakPolarHBondContact O-CG 3.37Å; A191-M195 PolarHBondContact O-N 3.47Å; D192-M195 PolarHBondContact O-N 3.15Å; E193-M195 PolarHBondContact O-N 3.01Å; M195-N197 VanDerWaalsContact C-N 3.34Å; M195-M198 HydrophobicContact CE-SD 4.49Å; M195-M198 PolarHBondContact O-N 2.87Å; M195-M198 HydrophobicContact SD-SD 4.33Å; M195-A199 PolarHBondContact O-N 3Å
196	D	93.4	Very high	93.8	Very high	101 Å²	101	59.4 Å²	59.4	54%	0.54	32%	0.319	S	S	.	.	H	α-helix	trans	-64.8	-40.4	176.7	-71	-15.9	0	0	0	111	D192 E193 A199 L200	D192-D196 PolarHBondContact O-N 3.5Å; E193-D196 PolarHBondContact O-N 2.91Å; D196-A199 PolarHBondContact O-N 3.12Å; D196-L200 WeakPolarHBondContact O-CB 3.34Å; D196-L200 PolarHBondContact O-N 2.99Å
197	N	95	Very high	94.5	Very high	60 Å²	60	61.1 Å²	61.1	32%	0.321	32%	0.321	S	S	.	.	H	α-helix	trans	-62.7	-44.2	174.1	-74.9	-25.6	0	0	0	111.9	L177 E193 M194 M195 A199 L200 K201	L177-N197 HydrophobicContact CD1-CB 4.28Å; L177-N197 HydrophobicContact CD2-CB 4.37Å; E193-N197 WeakPolarHBondContact O-CB 3.34Å; E193-N197 PolarHBondContact O-N 2.99Å; E193-N197 PolarHBondContact O-ND2 2.88Å; M194-N197 PolarHBondContact O-N 2.98Å; M195-N197 VanDerWaalsContact C-N 3.34Å; N197-A199 PolarHBondContact O-N 3.28Å; N197-L200 PolarHBondContact O-N 3.16Å; N197-K201 WeakPolarHBondContact O-CB 3.23Å; N197-K201 VanDerWaalsContact O-CG 3.25Å; N197-K201 WeakPolarHBondContact O-CG 3.41Å; N197-K201 PolarHBondContact O-N 2.61Å
198	M	94.9	Very high	94.9	Very high	9 Å²	9	52.1 Å²	52.1	4%	0.044	28%	0.283	C	S	.	.	H	α-helix	trans	-59	-46.5	174.4	-72.3	-175.2	-160.3	0	0	111.8	F7 L174 L177 L178 M194 M195 L200 K201 W202	F7-M198 HydrophobicContact CE2-CB 4.19Å; F7-M198 HydrophobicContact CZ-CB 4.33Å; L174-M198 HydrophobicContact CD1-CB 4.29Å; L174-M198 HydrophobicContact CD1-CG 4.48Å; L177-M198 HydrophobicContact CB-CE 4.15Å; L177-M198 HydrophobicContact CB-CG 3.67Å; L177-M198 HydrophobicContact CD1-CG 4.26Å; L177-M198 WeakPolarHBondContact O-CE 3.39Å; L178-M198 HydrophobicContact CD2-SD 4Å; M194-M198 HydrophobicContact CG-CE 3.66Å; M194-M198 WeakPolarHBondContact O-CG 3.16Å; M194-M198 PolarHBondContact O-N 2.89Å; M194-M198 HydrophobicContact SD-CE 3.76Å; M195-M198 HydrophobicContact CE-SD 4.49Å; M195-M198 PolarHBondContact O-N 2.87Å; M195-M198 HydrophobicContact SD-SD 4.33Å; M198-L200 PolarHBondContact O-N 2.74Å; M198-K201 PolarHBondContact O-N 3.39Å; M198-W202 VanDerWaalsContact O-CB 3.29Å; M198-W202 WeakPolarHBondContact O-CB 3.42Å; M198-W202 PolarHBondContact O-N 2.95Å
199	A	94.3	Very high	95.2	Very high	31 Å²	31	50.5 Å²	50.5	26%	0.256	27%	0.272	S	S	.	.	H	α-helix	trans	-63.3	-41.8	179.7	0	0	0	0	0	111.8	F7 M195 D196 N197 K203	F7-A199 HydrophobicContact CE2-CB 3.9Å; F7-A199 HydrophobicContact CZ-CB 4.22Å; M195-A199 PolarHBondContact O-N 3Å; D196-A199 PolarHBondContact O-N 3.12Å; N197-A199 PolarHBondContact O-N 3.28Å; A199-K203 WeakPolarHBondContact O-CB 3.34Å; A199-K203 PolarHBondContact O-N 3.44Å
200	L	96.6	Very high	95.4	Very high	86 Å²	86	45.6 Å²	45.6	45%	0.45	24%	0.242	S	C	.	.	H	α-helix	trans	-62.1	-48.9	176.2	-179.3	63.4	0	0	0	111.4	D196 N197 M198 W202 K203 E204	D196-L200 WeakPolarHBondContact O-CB 3.34Å; D196-L200 PolarHBondContact O-N 2.99Å; N197-L200 PolarHBondContact O-N 3.16Å; M198-L200 PolarHBondContact O-N 2.74Å; L200-W202 PolarHBondContact O-N 3.24Å; L200-K203 WeakPolarHBondContact O-CB 3.4Å; L200-K203 PolarHBondContact O-N 2.83Å; L200-E204 PolarHBondContact O-N 3.05Å
201	K	97.7	Very high	95.7	Very high	50 Å²	50	47.4 Å²	47.4	22%	0.217	24%	0.242	C	C	.	.	H	α-helix	trans	-66	-38.3	179.6	-64.8	-58.3	-179.5	168.7	0	112.7	L170 E173 L174 L177 N197 M198 E204 M205	L170-K201 HydrophobicContact CD2-CD 3.83Å; E173-K201 IonicContact OE1-NZ 2.69Å; E173-K201 VanDerWaalsContact OE2-CD 3.29Å; E173-K201 WeakPolarHBondContact OE2-CD 3.47Å; E173-K201 WeakPolarHBondContact OE2-CE 3.29Å; E173-K201 IonicContact OE2-NZ 3.31Å; E173-K201 PolarHBondContact OE2-NZ 3.12Å; L174-K201 HydrophobicContact CD1-CB 4.3Å; L177-K201 HydrophobicContact CD1-CB 4.36Å; L177-K201 HydrophobicContact CD1-CG 3.88Å; N197-K201 WeakPolarHBondContact O-CB 3.23Å; N197-K201 VanDerWaalsContact O-CG 3.25Å; N197-K201 WeakPolarHBondContact O-CG 3.41Å; N197-K201 PolarHBondContact O-N 2.61Å; M198-K201 PolarHBondContact O-N 3.39Å; K201-E204 PolarHBondContact O-N 3.2Å; K201-M205 WeakPolarHBondContact O-CB 3.41Å; K201-M205 PolarHBondContact O-N 3.34Å
202	W	97.2	Very high	96	Very high	11 Å²	11	47 Å²	47	4%	0.042	24%	0.238	C	C	.	.	H	α-helix	trans	-61.4	-45.9	172.4	176.4	-117.7	0	0	0	111.8	M36 F39 I40 L69 E72 I73 L174 M198 L200 E204 M205 K206	M36-W202 HydrophobicContact SD-CH2 4.11Å; M36-W202 HydrophobicContact SD-CZ3 4.03Å; F39-W202 HydrophobicContact CD1-CZ3 4.18Å; F39-W202 HydrophobicContact CE1-CE3 4.45Å; F39-W202 HydrophobicContact CE1-CZ3 4.04Å; I40-W202 HydrophobicContact CD1-CH2 3.89Å; I40-W202 HydrophobicContact CG1-CH2 4.08Å; L69-W202 HydrophobicContact CB-CH2 4.24Å; L69-W202 HydrophobicContact CB-CZ2 3.88Å; L69-W202 HydrophobicContact CD2-CD2 4.05Å; L69-W202 VanDerWaalsContact CD2-CE2 3.42Å; L69-W202 HydrophobicContact CD2-CG 4.45Å; L69-W202 HydrophobicContact CD2-CH2 4.32Å; L69-W202 HydrophobicContact CD2-CZ2 3.59Å; L69-W202 HydrophobicContact CG-CZ2 4.27Å; E72-W202 PolarHBondContact OE2-NE1 3.31Å; I73-W202 HydrophobicContact CD1-CH2 3.59Å; I73-W202 HydrophobicContact CD1-CZ2 3.74Å; I73-W202 HydrophobicContact CG1-CH2 3.92Å; I73-W202 HydrophobicContact CG1-CZ2 4.09Å; L174-W202 HydrophobicContact CD2-CB 4.33Å; L174-W202 HydrophobicContact CD2-CE3 3.7Å; L174-W202 HydrophobicContact CD2-CZ3 4.46Å; M198-W202 VanDerWaalsContact O-CB 3.29Å; M198-W202 WeakPolarHBondContact O-CB 3.42Å; M198-W202 PolarHBondContact O-N 2.95Å; L200-W202 PolarHBondContact O-N 3.24Å; W202-E204 PolarHBondContact O-N 2.97Å; W202-M205 HydrophobicContact CE3-SD 4.43Å; W202-M205 HydrophobicContact CZ3-SD 4.39Å; W202-M205 PolarHBondContact O-N 3.09Å; W202-K206 HydrophobicContact CD2-CG 4.25Å; W202-K206 HydrophobicContact CZ2-CD 3.93Å; W202-K206 HydrophobicContact CZ2-CG 4Å; W202-K206 WeakPolarHBondContact O-CG 3.44Å; W202-K206 PolarHBondContact O-N 2.63Å
203	K	97.6	Very high	96.2	Very high	116 Å²	116	43.8 Å²	43.8	50%	0.504	22%	0.221	S	C	.	.	H	α-helix	trans	-57.5	-49.6	175.4	-177.9	-174.9	173.2	-172.4	0	111.7	A199 L200 M205 K206 E207	A199-K203 WeakPolarHBondContact O-CB 3.34Å; A199-K203 PolarHBondContact O-N 3.44Å; L200-K203 WeakPolarHBondContact O-CB 3.4Å; L200-K203 PolarHBondContact O-N 2.83Å; K203-M205 VanDerWaalsContact C-N 3.29Å; K203-M205 PolarHBondContact O-N 2.99Å; K203-K206 PolarHBondContact O-N 3.08Å; K203-E207 WeakPolarHBondContact CE-OE1 3.3Å; K203-E207 WeakPolarHBondContact O-CG 3.45Å; K203-E207 PolarHBondContact O-N 2.66Å
204	E	98.2	Very high	96.3	Very high	36 Å²	36	43.6 Å²	43.6	17%	0.168	22%	0.218	C	C	.	.	H	α-helix	trans	-59.5	-40.5	176.8	-72.6	-172.9	-136	0	0	112	R166 L170 L200 K201 W202 K206 E207 V208	R166-E204 IonicContact CZ-OE2 2.72Å; R166-E204 IonicContact NE-OE2 3.62Å; R166-E204 IonicContact NH2-OE2 3.14Å; R166-E204 PolarHBondContact NH2-OE2 3.29Å; L170-E204 HydrophobicContact CD1-CB 3.86Å; L170-E204 HydrophobicContact CD2-CB 3.85Å; L200-E204 PolarHBondContact O-N 3.05Å; K201-E204 PolarHBondContact O-N 3.2Å; W202-E204 PolarHBondContact O-N 2.97Å; E204-K206 PolarHBondContact O-N 3.44Å; E204-E207 PolarHBondContact O-N 3.31Å; E204-V208 WeakPolarHBondContact O-CG2 2.95Å; E204-V208 PolarHBondContact O-N 2.77Å
205	M	98.2	Very high	96.4	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-64.2	-41.6	179.4	-169.6	177.4	177.8	0	0	111.5	M36 F39 F167 L170 E171 L174 K201 W202 K203 V208 Y209	M36-M205 HydrophobicContact CE-CE 4.23Å; M36-M205 HydrophobicContact CE-CG 3.9Å; M36-M205 HydrophobicContact CE-SD 4.48Å; M36-M205 HydrophobicContact SD-CE 3.84Å; M36-M205 HydrophobicContact SD-SD 4.44Å; F39-M205 HydrophobicContact CD1-CE 4.25Å; F39-M205 HydrophobicContact CD2-CE 4.46Å; F39-M205 HydrophobicContact CE1-SD 4.44Å; F39-M205 HydrophobicContact CG-CE 4.15Å; F167-M205 HydrophobicContact CD2-CG 4.47Å; F167-M205 HydrophobicContact CE1-CE 3.73Å; F167-M205 HydrophobicContact CE2-CE 3.87Å; F167-M205 HydrophobicContact CE2-CG 4.21Å; F167-M205 HydrophobicContact CZ-CE 3.38Å; L170-M205 HydrophobicContact CB-CB 4.18Å; L170-M205 HydrophobicContact CB-CG 4.34Å; L170-M205 HydrophobicContact CD1-CB 4.34Å; E171-M205 HydrophobicContact CB-CE 3.98Å; E171-M205 HydrophobicContact CG-CE 4.2Å; L174-M205 HydrophobicContact CD2-SD 4.16Å; K201-M205 WeakPolarHBondContact O-CB 3.41Å; K201-M205 PolarHBondContact O-N 3.34Å; W202-M205 HydrophobicContact CE3-SD 4.43Å; W202-M205 HydrophobicContact CZ3-SD 4.39Å; W202-M205 PolarHBondContact O-N 3.09Å; K203-M205 VanDerWaalsContact C-N 3.29Å; K203-M205 PolarHBondContact O-N 2.99Å; M205-V208 PolarHBondContact O-N 3.33Å; M205-Y209 VanDerWaalsContact O-CB 3.25Å; M205-Y209 WeakPolarHBondContact O-CB 3.39Å; M205-Y209 PolarHBondContact O-N 3.32Å
206	K	97.5	Very high	96.6	Very high	35 Å²	35	43.6 Å²	43.6	15%	0.152	22%	0.219	C	C	.	.	H	α-helix	trans	-62.4	-40.2	173.4	-69.2	-166	-63.3	177.5	0	112.6	E72 I73 V76 W202 K203 E204 Y209 A210	E72-K206 HydrophobicContact CB-CD 4.03Å; E72-K206 WeakPolarHBondContact OE2-CE 3.3Å; E72-K206 IonicContact OE2-NZ 3.11Å; E72-K206 PolarHBondContact OE2-NZ 3.23Å; I73-K206 HydrophobicContact CD1-CD 4.12Å; I73-K206 HydrophobicContact CD1-CG 3.74Å; V76-K206 HydrophobicContact CG2-CB 4.5Å; W202-K206 HydrophobicContact CD2-CG 4.25Å; W202-K206 HydrophobicContact CZ2-CD 3.93Å; W202-K206 HydrophobicContact CZ2-CG 4Å; W202-K206 WeakPolarHBondContact O-CG 3.44Å; W202-K206 PolarHBondContact O-N 2.63Å; K203-K206 PolarHBondContact O-N 3.08Å; E204-K206 PolarHBondContact O-N 3.44Å; K206-Y209 WeakPolarHBondContact O-CB 3.2Å; K206-Y209 PolarHBondContact O-N 2.86Å; K206-A210 VanDerWaalsContact O-CB 3.32Å; K206-A210 WeakPolarHBondContact O-CB 3.28Å; K206-A210 PolarHBondContact O-N 3.18Å
207	E	98	Very high	96.5	Very high	99 Å²	99	40.4 Å²	40.4	46%	0.463	20%	0.202	S	C	.	.	H	α-helix	trans	-65.9	-45.5	178	-72.5	173.5	-177.2	0	0	111.6	K203 E204 Y209 A210 N211	K203-E207 WeakPolarHBondContact CE-OE1 3.3Å; K203-E207 WeakPolarHBondContact O-CG 3.45Å; K203-E207 PolarHBondContact O-N 2.66Å; E204-E207 PolarHBondContact O-N 3.31Å; E207-Y209 VanDerWaalsContact C-N 3.35Å; E207-A210 PolarHBondContact O-N 3.24Å; E207-N211 VanDerWaalsContact O-CG 3.27Å; E207-N211 PolarHBondContact O-N 3.35Å; E207-N211 PolarHBondContact O-ND2 3.3Å
208	V	98.3	Very high	96.3	Very high	8 Å²	8	39.1 Å²	39.1	5%	0.048	20%	0.195	C	C	.	.	H	α-helix	trans	-62.2	-44.3	175.1	174.1	0	0	0	0	110.8	L163 R166 F167 L170 E204 M205 N211 I212	L163-V208 HydrophobicContact CB-CG1 4.39Å; L163-V208 HydrophobicContact CD2-CG1 4.24Å; L163-V208 VanDerWaalsContact O-CG1 3.22Å; L163-V208 WeakPolarHBondContact O-CG1 3.48Å; R166-V208 HydrophobicContact CB-CG2 4.36Å; R166-V208 HydrophobicContact CG-CG2 3.98Å; F167-V208 HydrophobicContact CB-CG1 3.9Å; F167-V208 HydrophobicContact CD2-CG1 4.27Å; L170-V208 HydrophobicContact CD1-CG2 3.92Å; E204-V208 WeakPolarHBondContact O-CG2 2.95Å; E204-V208 PolarHBondContact O-N 2.77Å; M205-V208 PolarHBondContact O-N 3.33Å; V208-N211 PolarHBondContact O-N 2.69Å; V208-I212 HydrophobicContact CG1-CD1 4.12Å; V208-I212 WeakPolarHBondContact O-CG1 2.99Å; V208-I212 PolarHBondContact O-N 3.12Å
209	Y	98.2	Very high	95.3	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-55.2	-53.4	173.5	174.4	-99.8	0	0	0	111.7	I32 K33 M36 I73 V76 E77 F167 M205 K206 E207 N211 I212 R213	I32-Y209 HydrophobicContact CG1-CD2 4.1Å; I32-Y209 HydrophobicContact CG1-CE2 4.32Å; I32-Y209 HydrophobicContact CG2-CE2 4.43Å; K33-Y209 HydrophobicContact CB-CE2 4.49Å; K33-Y209 WeakPolarHBondContact CB-OH 3.27Å; K33-Y209 WeakPolarHBondContact CG-OH 3.4Å; M36-Y209 HydrophobicContact CB-CD2 3.96Å; M36-Y209 HydrophobicContact CB-CE2 3.78Å; M36-Y209 HydrophobicContact CE-CD1 4.39Å; M36-Y209 HydrophobicContact CE-CD2 3.98Å; M36-Y209 HydrophobicContact CE-CG 3.71Å; M36-Y209 HydrophobicContact CG-CD2 4.19Å; M36-Y209 HydrophobicContact CG-CE2 4.22Å; I73-Y209 HydrophobicContact CG2-CD1 4.33Å; I73-Y209 HydrophobicContact CG2-CE1 3.65Å; V76-Y209 HydrophobicContact CG2-CD1 3.99Å; V76-Y209 HydrophobicContact CG2-CE1 4.36Å; E77-Y209 PolarHBondContact OE1-OH 3.08Å; F167-Y209 HydrophobicContact CE2-CD2 4.28Å; M205-Y209 VanDerWaalsContact O-CB 3.25Å; M205-Y209 WeakPolarHBondContact O-CB 3.39Å; M205-Y209 PolarHBondContact O-N 3.32Å; K206-Y209 WeakPolarHBondContact O-CB 3.2Å; K206-Y209 PolarHBondContact O-N 2.86Å; E207-Y209 VanDerWaalsContact C-N 3.35Å; Y209-N211 VanDerWaalsContact C-N 3.28Å; Y209-N211 PolarHBondContact O-N 2.75Å; Y209-I212 WeakPolarHBondContact O-CB 3.21Å; Y209-I212 PolarHBondContact O-N 3.41Å; Y209-I212 VanDerWaalsContact O-N 3.14Å; Y209-R213 HydrophobicContact CD1-CG 4.02Å; Y209-R213 HydrophobicContact CD2-CG 4.17Å; Y209-R213 HydrophobicContact CE1-CG 3.6Å; Y209-R213 HydrophobicContact CE2-CG 3.77Å; Y209-R213 HydrophobicContact CG-CG 4.28Å; Y209-R213 VanDerWaalsContact CZ-CG 3.47Å; Y209-R213 VanDerWaalsContact O-CG 3.27Å; Y209-R213 WeakPolarHBondContact O-CG 3.47Å; Y209-R213 PolarHBondContact O-N 2.81Å
210	A	97.2	Very high	95.3	Very high	22 Å²	22	43.8 Å²	43.8	18%	0.182	22%	0.215	C	C	.	.	H	α-helix	trans	-58.5	-40.4	-179.6	0	0	0	0	0	112	V76 K206 E207 R213 K214	V76-A210 HydrophobicContact CB-CB 4.1Å; V76-A210 HydrophobicContact CG2-CB 4.39Å; K206-A210 VanDerWaalsContact O-CB 3.32Å; K206-A210 WeakPolarHBondContact O-CB 3.28Å; K206-A210 PolarHBondContact O-N 3.18Å; E207-A210 PolarHBondContact O-N 3.24Å; A210-R213 PolarHBondContact O-N 3.06Å; A210-K214 VanDerWaalsContact O-CB 3.32Å; A210-K214 WeakPolarHBondContact O-CB 3.39Å; A210-K214 PolarHBondContact O-N 3.02Å
211	N	97.5	Very high	95.3	Very high	78 Å²	78	41.6 Å²	41.6	42%	0.417	20%	0.202	S	C	.	.	H	α-helix	trans	-64.2	-44.4	176.1	-72.1	-29.6	0	0	0	112.3	L163 E207 V208 Y209 K214 N215	L163-N211 HydrophobicContact CD1-CB 4.16Å; L163-N211 HydrophobicContact CD2-CB 4.03Å; E207-N211 VanDerWaalsContact O-CG 3.27Å; E207-N211 PolarHBondContact O-N 3.35Å; E207-N211 PolarHBondContact O-ND2 3.3Å; V208-N211 PolarHBondContact O-N 2.69Å; Y209-N211 VanDerWaalsContact C-N 3.28Å; Y209-N211 PolarHBondContact O-N 2.75Å; N211-K214 PolarHBondContact O-N 3.33Å; N211-N215 PolarHBondContact O-N 3.16Å
212	I	97.7	Very high	95.1	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-58	-52.8	172.6	-67.6	168.1	0	0	0	109.4	I32 W151 L163 L164 F167 V208 Y209 K214 N215 M216	I32-I212 HydrophobicContact CB-CG2 4.31Å; I32-I212 HydrophobicContact CD1-CD1 4.21Å; I32-I212 HydrophobicContact CG1-CD1 4.21Å; I32-I212 HydrophobicContact CG1-CG2 4.07Å; I32-I212 HydrophobicContact CG2-CG2 3.94Å; W151-I212 HydrophobicContact CD2-CG2 4.2Å; W151-I212 HydrophobicContact CE3-CG2 4.23Å; W151-I212 HydrophobicContact CH2-CB 4.29Å; W151-I212 HydrophobicContact CH2-CG1 4.09Å; W151-I212 HydrophobicContact CH2-CG2 3.61Å; W151-I212 HydrophobicContact CZ2-CG1 4.34Å; W151-I212 HydrophobicContact CZ2-CG2 3.53Å; W151-I212 HydrophobicContact CZ3-CG2 3.95Å; L163-I212 HydrophobicContact CB-CD1 4.18Å; L163-I212 HydrophobicContact CB-CG1 3.78Å; L163-I212 HydrophobicContact CD1-CG1 4.13Å; L164-I212 HydrophobicContact CD2-CD1 4.19Å; F167-I212 HydrophobicContact CB-CD1 4.45Å; F167-I212 HydrophobicContact CD2-CD1 4.44Å; V208-I212 HydrophobicContact CG1-CD1 4.12Å; V208-I212 WeakPolarHBondContact O-CG1 2.99Å; V208-I212 PolarHBondContact O-N 3.12Å; Y209-I212 WeakPolarHBondContact O-CB 3.21Å; Y209-I212 PolarHBondContact O-N 3.41Å; Y209-I212 VanDerWaalsContact O-N 3.14Å; I212-K214 VanDerWaalsContact C-N 3.26Å; I212-K214 PolarHBondContact O-N 3.25Å; I212-N215 WeakPolarHBondContact O-CB 3.48Å; I212-N215 PolarHBondContact O-N 3.39Å; I212-M216 HydrophobicContact CG2-CG 4.41Å; I212-M216 HydrophobicContact CG2-SD 3.99Å; I212-M216 VanDerWaalsContact O-CG 3.27Å; I212-M216 WeakPolarHBondContact O-CG 3.2Å; I212-M216 PolarHBondContact O-N 3.31Å
213	R	96.4	Very high	95	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-58.9	-36.9	-178.9	-64.3	-62.2	-69	163.2	-9.2	112.3	E77 P78 E144 R147 Y209 A210 M216 L217	E77-R213 IonicContact OE1-CZ 3.63Å; E77-R213 IonicContact OE1-NE 3.9Å; E77-R213 PolarHBondContact OE1-NE 2.77Å; E77-R213 IonicContact OE1-NH2 2.73Å; E77-R213 IonicContact OE2-CZ 2.8Å; E77-R213 IonicContact OE2-NE 3.59Å; E77-R213 PolarHBondContact OE2-NE 3.33Å; E77-R213 VanDerWaalsContact OE2-NE 3.11Å; E77-R213 IonicContact OE2-NH2 3.13Å; E77-R213 PolarHBondContact OE2-NH2 3.29Å; E77-R213 VanDerWaalsContact OE2-NH2 3.14Å; P78-R213 HydrophobicContact CG-CB 4.13Å; E144-R213 VanDerWaalsContact CD-NH2 3.32Å; E144-R213 IonicContact OE1-NH2 2.65Å; E144-R213 PolarHBondContact OE1-NH2 3.47Å; E144-R213 IonicContact OE2-CZ 3.72Å; E144-R213 IonicContact OE2-NH1 3.41Å; E144-R213 PolarHBondContact OE2-NH1 2.99Å; E144-R213 IonicContact OE2-NH2 3.42Å; E144-R213 PolarHBondContact OE2-NH2 2.89Å; R147-R213 PolarHBondContact NH2-O 2.9Å; Y209-R213 HydrophobicContact CD1-CG 4.02Å; Y209-R213 HydrophobicContact CD2-CG 4.17Å; Y209-R213 HydrophobicContact CE1-CG 3.6Å; Y209-R213 HydrophobicContact CE2-CG 3.77Å; Y209-R213 HydrophobicContact CG-CG 4.28Å; Y209-R213 VanDerWaalsContact CZ-CG 3.47Å; Y209-R213 VanDerWaalsContact O-CG 3.27Å; Y209-R213 WeakPolarHBondContact O-CG 3.47Å; Y209-R213 PolarHBondContact O-N 2.81Å; A210-R213 PolarHBondContact O-N 3.06Å; R213-M216 CarbonylContact O-C 3.59Å; R213-M216 WeakPolarHBondContact O-CB 3.46Å; R213-M216 PolarHBondContact O-N 2.91Å; R213-L217 PolarHBondContact O-N 2.79Å
214	K	94.8	Very high	94.9	Very high	131 Å²	131	38.3 Å²	38.3	57%	0.57	19%	0.193	S	C	*	.	H	α-helix	trans	-63.5	-43.2	174.1	-173	-177.8	178.9	-176.9	0	111.8	A210 N211 I212 M216 L217	A210-K214 VanDerWaalsContact O-CB 3.32Å; A210-K214 WeakPolarHBondContact O-CB 3.39Å; A210-K214 PolarHBondContact O-N 3.02Å; N211-K214 PolarHBondContact O-N 3.33Å; I212-K214 VanDerWaalsContact C-N 3.26Å; I212-K214 PolarHBondContact O-N 3.25Å; K214-M216 PolarHBondContact O-N 3.35Å; K214-L217 HydrophobicContact CG-CD1 4.24Å; K214-L217 VanDerWaalsContact O-CB 3.31Å; K214-L217 WeakPolarHBondContact O-CB 3.42Å; K214-L217 WeakPolarHBondContact O-CG 3.33Å; K214-L217 PolarHBondContact O-N 3.34Å
215	N	95	Very high	94.6	Very high	42 Å²	42	38.5 Å²	38.5	23%	0.225	19%	0.194	C	C	.	.	H	α-helix	trans	-66.1	-21.7	175.8	-68.9	-5.2	0	0	0	112.4	K150 W151 I154 N160 N211 I212	K150-N215 WeakPolarHBondContact CE-O 3.48Å; W151-N215 HydrophobicContact CZ3-CB 4.25Å; I154-N215 HydrophobicContact CD1-CB 4.42Å; I154-N215 VanDerWaalsContact CD1-O 3.31Å; I154-N215 WeakPolarHBondContact CD1-O 3.42Å; N160-N215 PolarHBondContact OD1-ND2 2.97Å; N211-N215 PolarHBondContact O-N 3.16Å; I212-N215 WeakPolarHBondContact O-CB 3.48Å; I212-N215 PolarHBondContact O-N 3.39Å
216	M	94.6	Very high	94.4	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-3.5	172.7	-56.3	172.8	63.6	0	0	114.5	I32 R147 E148 W151 I212 R213 K214 L218	I32-M216 HydrophobicContact CG2-CE 4.32Å; I32-M216 HydrophobicContact CG2-SD 3.56Å; I32-M216 VanDerWaalsContact CG2-SD 3.56Å; R147-M216 HydrophobicContact CB-CB 4.34Å; R147-M216 HydrophobicContact CB-CE 4.17Å; R147-M216 WeakPolarHBondContact CB-O 3.11Å; R147-M216 VanDerWaalsContact CG-O 3.31Å; R147-M216 WeakPolarHBondContact CG-O 3.3Å; R147-M216 PolarHBondContact NE-O 2.94Å; E148-M216 HydrophobicContact CG-CE 3.86Å; E148-M216 VanDerWaalsContact OE1-CE 3.26Å; E148-M216 WeakPolarHBondContact OE1-CE 3.49Å; W151-M216 HydrophobicContact CB-CE 3.87Å; W151-M216 HydrophobicContact CB-CG 3.79Å; W151-M216 HydrophobicContact CB-SD 4.19Å; W151-M216 HydrophobicContact CD2-CG 3.88Å; W151-M216 HydrophobicContact CD2-SD 4.27Å; W151-M216 HydrophobicContact CE3-CG 3.69Å; W151-M216 HydrophobicContact CG-CE 4.24Å; W151-M216 HydrophobicContact CG-CG 3.92Å; W151-M216 HydrophobicContact CG-SD 4.05Å; I212-M216 HydrophobicContact CG2-CG 4.41Å; I212-M216 HydrophobicContact CG2-SD 3.99Å; I212-M216 VanDerWaalsContact O-CG 3.27Å; I212-M216 WeakPolarHBondContact O-CG 3.2Å; I212-M216 PolarHBondContact O-N 3.31Å; R213-M216 CarbonylContact O-C 3.59Å; R213-M216 WeakPolarHBondContact O-CB 3.46Å; R213-M216 PolarHBondContact O-N 2.91Å; K214-M216 PolarHBondContact O-N 3.35Å; M216-L218 PolarHBondContact O-N 3.15Å
217	L	92	Very high	94.1	Very high	35 Å²	35	41.7 Å²	41.7	18%	0.183	21%	0.213	C	C	.	.	S	Bend	trans	-53.5	132.8	174	-77.4	174.1	0	0	0	108.7	P78 T80 K150 R213 K214 D219	P78-L217 HydrophobicContact CB-CD1 4.16Å; P78-L217 HydrophobicContact CB-CD2 3.99Å; P78-L217 HydrophobicContact CB-CG 4.19Å; P78-L217 HydrophobicContact CG-CD2 3.89Å; P78-L217 HydrophobicContact CG-CG 4.19Å; T80-L217 HydrophobicContact CG2-CD2 4.1Å; K150-L217 WeakPolarHBondContact CD-O 3.31Å; K150-L217 WeakPolarHBondContact CE-O 3.34Å; K150-L217 PolarHBondContact NZ-O 3.18Å; R213-L217 PolarHBondContact O-N 2.79Å; K214-L217 HydrophobicContact CG-CD1 4.24Å; K214-L217 VanDerWaalsContact O-CB 3.31Å; K214-L217 WeakPolarHBondContact O-CB 3.42Å; K214-L217 WeakPolarHBondContact O-CG 3.33Å; K214-L217 PolarHBondContact O-N 3.34Å; L217-D219 PolarHBondContact O-N 2.82Å
218	L	89.8	Confident	93.8	Very high	33 Å²	33	36.9 Å²	36.9	17%	0.173	19%	0.192	C	C	.	.			trans	-66.4	137.5	170.1	-62.2	-177.6	0	0	0	107.5	L95 Y143 E146 R147 K150 M216	L95-L218 HydrophobicContact CB-CD1 4.14Å; L95-L218 HydrophobicContact CD1-CD1 3.97Å; L95-L218 HydrophobicContact CG-CD1 4.37Å; Y143-L218 HydrophobicContact CD2-CD1 4Å; Y143-L218 HydrophobicContact CE2-CD1 3.73Å; Y143-L218 HydrophobicContact CE2-CG 4.39Å; E146-L218 HydrophobicContact CB-CD1 3.82Å; E146-L218 HydrophobicContact CB-CD2 4.22Å; R147-L218 HydrophobicContact CG-CD2 4.19Å; R147-L218 HydrophobicContact CG-CG 3.91Å; K150-L218 HydrophobicContact CB-CD2 4.29Å; K150-L218 HydrophobicContact CD-CD2 4.4Å; M216-L218 PolarHBondContact O-N 3.15Å
219	D	74.3	Confident	93.4	Very high	94 Å²	94	39.5 Å²	39.5	50%	0.503	21%	0.205	S	C	.	.			trans	-85.8	0	175.6	-42.3	-55.9	0	0	0	111	K86 K150 L217	K86-D219 VanDerWaalsContact CB-OXT 3.29Å; K86-D219 WeakPolarHBondContact CB-OXT 3.46Å; K86-D219 HydrophobicContact CD-CB 3.37Å; K86-D219 VanDerWaalsContact CD-OXT 3.26Å; K86-D219 WeakPolarHBondContact CD-OXT 3.49Å; K86-D219 HydrophobicContact CG-CB 4.22Å; K86-D219 WeakPolarHBondContact CG-OXT 3.49Å; K86-D219 IonicContact NZ-OD1 3.34Å; K86-D219 IonicContact NZ-OD2 3.3Å; K86-D219 PolarHBondContact NZ-OD2 2.98Å; K150-D219 IonicContact NZ-OD1 2.69Å; K150-D219 PolarHBondContact NZ-OD1 2.92Å; K150-D219 IonicContact NZ-OD2 3.33Å; K150-D219 PolarHBondContact NZ-OD2 3.35Å; L217-D219 PolarHBondContact O-N 2.82Å

Retrieved 219 of 219 residues in 62 ms (Link to these results)

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