A0A061I5K5_CRIGR Loading...

small monomeric GTPase

AlphaFold DB , UniProt , Accession A0A061I5K5, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Rasl11a, Length 242 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	44.7	Very low	41.8	Very low	248 Å²	248	158.1 Å²	158.1	100%	1.222	84%	0.836	S	S	*	*				0	118.8	0	-75.5	175	164.4	0	0	107.9
2	R	40.3	Very low	41.2	Very low	246 Å²	246	158.8 Å²	158.8	93%	0.928	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-87.2	145.3	177.9	-71	178.7	-178	172.5	0.3	109.2
3	P	41.9	Very low	41.4	Very low	117 Å²	117	152.6 Å²	152.6	76%	0.76	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-72.9	153.7	174.7	30.5	-32.2	0	0	0	111.1
4	P	42.5	Very low	41.2	Very low	117 Å²	117	150.4 Å²	150.4	76%	0.76	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-73.1	141	177.5	29.8	-31	0	0	0	110.9
5	T	42.8	Very low	41.2	Very low	134 Å²	134	150.3 Å²	150.3	82%	0.822	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-63	124.3	173.9	43	0	0	0	0	111.3	S7	T5-S7 PolarHBondContact O-N 2.9Å
6	M	37.3	Very low	41.1	Very low	186 Å²	186	147.6 Å²	147.6	92%	0.916	81%	0.81	S	S	*	*			trans	-66.5	90.4	170.2	-75.9	-82.3	112.8	0	0	110.4
7	S	47.5	Very low	41.2	Very low	109 Å²	109	149.8 Å²	149.8	76%	0.762	81%	0.813	S	S	*	*			trans	-93	85.8	161.4	173.7	0	0	0	0	107.7	T5	T5-S7 PolarHBondContact O-N 2.9Å
8	G	40.6	Very low	41	Very low	49 Å²	49	146.2 Å²	146.2	51%	0.505	80%	0.801	S	S	.	*			trans	-123	86.7	172.5	0	0	0	0	0	108.4	F10	G8-F10 PolarHBondContact O-N 3.19Å
9	H	43	Very low	41.1	Very low	178 Å²	178	144.3 Å²	144.3	82%	0.824	80%	0.799	S	S	*	*			trans	-62.5	88.6	160.5	-87.3	-93.3	0	0	0	107.6	L11	H9-L11 PolarHBondContact O-N 2.97Å
10	F	38.4	Very low	41.1	Very low	197 Å²	197	139.7 Å²	139.7	86%	0.864	78%	0.778	S	S	*	*			trans	-69.4	86.6	161.7	-78.3	-87.5	0	0	0	106.7	G8 L12	G8-F10 PolarHBondContact O-N 3.19Å; F10-L12 VanDerWaalsContact C-N 3.31Å; F10-L12 PolarHBondContact O-N 2.74Å
11	L	40.5	Very low	41	Very low	158 Å²	158	139.6 Å²	139.6	83%	0.827	78%	0.775	S	S	*	*			trans	-56.6	104	157.9	-78.6	162.8	0	0	0	105.9	H9 A13	H9-L11 PolarHBondContact O-N 2.97Å; L11-A13 VanDerWaalsContact C-N 3.29Å; L11-A13 PolarHBondContact O-N 2.88Å
12	L	34.9	Very low	40.9	Very low	167 Å²	167	137 Å²	137	87%	0.874	75%	0.753	S	S	*	*			trans	-55.6	101.2	162.5	-73.9	164.1	0	0	0	105.8	F10	F10-L12 VanDerWaalsContact C-N 3.31Å; F10-L12 PolarHBondContact O-N 2.74Å
13	A	43.6	Very low	41.6	Very low	78 Å²	78	132.6 Å²	132.6	65%	0.645	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-55.1	134.8	164.1	0	0	0	0	0	106.3	L11 I15	L11-A13 VanDerWaalsContact C-N 3.29Å; L11-A13 PolarHBondContact O-N 2.88Å; A13-I15 PolarHBondContact O-N 2.94Å
14	P	38.3	Very low	42.1	Very low	121 Å²	121	134.2 Å²	134.2	79%	0.786	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-52.6	124.8	172.3	-15	24.6	0	0	0	107.1	P16	P14-P16 VanDerWaalsContact O-N 3.15Å
15	I	42.1	Very low	42.8	Very low	150 Å²	150	131 Å²	131	77%	0.769	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-51.1	125.5	166.2	-60.9	167.4	0	0	0	104.4	A13 E17	A13-I15 PolarHBondContact O-N 2.94Å; I15-E17 PolarHBondContact O-N 2.84Å
16	P	39	Very low	44.3	Very low	106 Å²	106	129.7 Å²	129.7	69%	0.688	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-56.5	117.4	174.5	22.4	-28.5	0	0	0	105.3	P14 S18	P14-P16 VanDerWaalsContact O-N 3.15Å; P16-S18 PolarHBondContact O-N 2.97Å
17	E	43.1	Very low	46.6	Very low	185 Å²	185	123.8 Å²	123.8	86%	0.864	68%	0.683	S	S	*	*			trans	-64.5	77.9	163.8	-73.4	-169.5	172.7	0	0	105.8	I15 S19	I15-E17 PolarHBondContact O-N 2.84Å; E17-S19 PolarHBondContact O-N 3.02Å
18	S	37.2	Very low	48.8	Very low	86 Å²	86	118.6 Å²	118.6	60%	0.601	65%	0.647	S	S	*	*			trans	-63.3	92.4	156.3	62.2	0	0	0	0	104	P16 S20	P16-S18 PolarHBondContact O-N 2.97Å; S18-S20 PolarHBondContact O-N 3Å; S18-S20 PolarHBondContact O-OG 3.14Å
19	S	44	Very low	51.5	Low	110 Å²	110	119.2 Å²	119.2	77%	0.769	64%	0.636	S	S	*	*			trans	-64.4	57.8	149.1	21.5	0	0	0	0	107.5	E17 D21	E17-S19 PolarHBondContact O-N 3.02Å; S19-D21 PolarHBondContact O-N 3.1Å
20	S	40.8	Very low	54.1	Low	52 Å²	52	110.7 Å²	110.7	36%	0.364	60%	0.596	S	S	.	*			trans	-66	92	144.5	50.7	0	0	0	0	103.4	S18 Y22	S18-S20 PolarHBondContact O-N 3Å; S18-S20 PolarHBondContact O-OG 3.14Å; S20-Y22 WeakPolarHBondContact O-CD2 3.46Å; S20-Y22 PolarHBondContact O-N 3.29Å
21	D	39.6	Very low	56.9	Low	137 Å²	137	101.3 Å²	101.3	73%	0.733	56%	0.555	S	S	*	*			trans	-43.4	95.5	136.8	-75.3	-32.5	0	0	0	104.2	S19 L23	S19-D21 PolarHBondContact O-N 3.1Å; D21-L23 PolarHBondContact O-N 2.95Å
22	Y	42.1	Very low	59.6	Low	194 Å²	194	93.8 Å²	93.8	76%	0.761	52%	0.516	S	S	*	.			trans	-58.6	98.7	164.9	-73.2	-84.5	0	0	0	102	S20 L24	S20-Y22 WeakPolarHBondContact O-CD2 3.46Å; S20-Y22 PolarHBondContact O-N 3.29Å; Y22-L24 PolarHBondContact O-N 3.33Å
23	L	53.5	Low	62.5	Low	154 Å²	154	85.9 Å²	85.9	81%	0.806	47%	0.474	S	S	*	.			trans	-60.5	87.1	175.8	-70.5	169.9	0	0	0	104.3	D21 P25	D21-L23 PolarHBondContact O-N 2.95Å; L23-P25 VanDerWaalsContact O-N 3.11Å
24	L	52.5	Low	64.9	Low	151 Å²	151	82.6 Å²	82.6	79%	0.791	45%	0.448	S	S	*	.	P	Polyproline II helix	trans	-50.2	124.9	171.3	-73.6	169.5	0	0	0	104.6	Y22 K26	Y22-L24 PolarHBondContact O-N 3.33Å; L24-K26 PolarHBondContact O-N 2.9Å
25	P	58.4	Low	67.5	Low	49 Å²	49	77.8 Å²	77.8	32%	0.318	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-48.4	120.9	-179.7	-26	31.7	0	0	0	107.6	L23 D27 S76	L23-P25 VanDerWaalsContact O-N 3.11Å; P25-D27 PolarHBondContact O-N 3.03Å; P25-D27 VanDerWaalsContact O-N 3.12Å; P25-S76 WeakPolarHBondContact O-CB 3.41Å
26	K	72.8	Confident	69.8	Low	107 Å²	107	71.9 Å²	71.9	47%	0.465	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-57	124.6	-174.4	-170.3	172.6	173	-137.5	0	107.8	L24 I28 H200	L24-K26 PolarHBondContact O-N 2.9Å; K26-I28 PolarHBondContact O-N 2.93Å; K26-H200 VanDerWaalsContact CD-ND1 3.35Å; K26-H200 WeakPolarHBondContact CD-ND1 3.29Å; K26-H200 WeakPolarHBondContact CE-ND1 3.18Å; K26-H200 PolarHBondContact NZ-CD2 3.03Å; K26-H200 PolarHBondContact NZ-CE1 3.4Å; K26-H200 VanDerWaalsContact NZ-CE1 3.28Å; K26-H200 PolarHBondContact NZ-ND1 3.15Å; K26-H200 PolarHBondContact NZ-NE2 2.65Å
27	D	87.3	Confident	72.3	Confident	61 Å²	61	78.1 Å²	78.1	33%	0.326	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-61	120.1	-177.3	-70.3	-37.3	0	0	0	109.8	P25 S76 Q78	P25-D27 PolarHBondContact O-N 3.03Å; P25-D27 VanDerWaalsContact O-N 3.12Å; D27-S76 CarbonylContact C-O 3.45Å; D27-S76 WeakPolarHBondContact CA-O 3.41Å; D27-S76 WeakPolarHBondContact OD1-CB 3.34Å; D27-S76 PolarHBondContact OD1-OG 3.09Å; D27-Q78 PolarHBondContact OD2-NE2 3.35Å
28	I	93.8	Very high	74.8	Confident	1 Å²	1	69.3 Å²	69.3	1%	0.005	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	124.8	166.1	-66.8	179.9	0	0	0	107.4	K26 L30 L75 S76 L77 Q78 C193 V196 S197	K26-I28 PolarHBondContact O-N 2.93Å; I28-L30 HydrophobicContact CG2-CD2 3.69Å; I28-L30 HydrophobicContact CG2-CG 4Å; I28-L75 HydrophobicContact CD1-CB 4.25Å; I28-L75 HydrophobicContact CD1-CD1 3.71Å; I28-L75 HydrophobicContact CD1-CD2 4.42Å; I28-L75 HydrophobicContact CD1-CG 4.34Å; I28-S76 PolarHBondContact N-O 3.42Å; I28-L77 HydrophobicContact CB-CD1 3.99Å; I28-L77 HydrophobicContact CG2-CD1 3.71Å; I28-Q78 PolarHBondContact O-N 3.2Å; I28-C193 HydrophobicContact CD1-CB 4.27Å; I28-V196 HydrophobicContact CG1-CG1 4.47Å; I28-V196 HydrophobicContact CG2-CB 4.18Å; I28-V196 HydrophobicContact CG2-CG1 4.03Å; I28-S197 VanDerWaalsContact CD1-OG 3.26Å; I28-S197 WeakPolarHBondContact CD1-OG 3.36Å
29	K	95.8	Very high	77.6	Confident	61 Å²	61	66 Å²	66	27%	0.265	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	112.7	-176.5	-63.7	171.3	-179.3	177.2	0	110.5	Q78 W105 E107 G108	K29-Q78 WeakPolarHBondContact CA-O 3.41Å; K29-Q78 HydrophobicContact CG-CB 4.47Å; K29-W105 HydrophobicContact CB-CD2 4.3Å; K29-W105 HydrophobicContact CB-CE3 4.28Å; K29-W105 HydrophobicContact CB-CH2 3.8Å; K29-W105 HydrophobicContact CB-CZ2 3.83Å; K29-W105 HydrophobicContact CB-CZ3 4.03Å; K29-W105 HydrophobicContact CD-CD2 4.21Å; K29-W105 HydrophobicContact CD-CG 4.46Å; K29-W105 HydrophobicContact CD-CZ2 4.02Å; K29-W105 WeakPolarHBondContact CD-O 3.23Å; K29-W105 HydrophobicContact CG-CH2 4.13Å; K29-W105 HydrophobicContact CG-CZ2 3.65Å; K29-E107 HydrophobicContact CB-CG 4.34Å; K29-E107 PolarHBondContact O-N 3.05Å; K29-G108 PolarHBondContact O-N 3Å
30	L	97.5	Very high	80	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	143.3	-179.9	-53.3	-173.5	0	0	0	110.9	I28 L77 Q78 I79 Q80 W105 G108 F189 L192 V196	I28-L30 HydrophobicContact CG2-CD2 3.69Å; I28-L30 HydrophobicContact CG2-CG 4Å; L30-L77 HydrophobicContact CD1-CD1 3.66Å; L30-L77 HydrophobicContact CG-CD1 3.73Å; L30-Q78 PolarHBondContact N-O 3.06Å; L30-I79 CarbonylContact O-C 3.59Å; L30-I79 WeakPolarHBondContact O-CA 3.29Å; L30-Q80 PolarHBondContact O-N 3.37Å; L30-W105 WeakPolarHBondContact O-CZ3 3.17Å; L30-G108 WeakPolarHBondContact CA-O 3.39Å; L30-F189 HydrophobicContact CD1-CD1 4.22Å; L30-L192 HydrophobicContact CD1-CD2 3.95Å; L30-L192 HydrophobicContact CD1-CG 4.21Å; L30-L192 HydrophobicContact CD2-CD2 3.86Å; L30-L192 HydrophobicContact CD2-CG 3.81Å; L30-L192 HydrophobicContact CG-CD2 4.34Å; L30-V196 HydrophobicContact CD2-CG2 4.02Å
31	A	97.1	Very high	82.6	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	136.3	168.9	0	0	0	0	0	110.9	L33 C102 A106 G108 F109 L110	A31-L33 HydrophobicContact CB-CD2 4.24Å; A31-L33 HydrophobicContact CB-CG 4.44Å; A31-C102 VanDerWaalsContact CB-SG 3.59Å; A31-A106 HydrophobicContact CB-CB 3.61Å; A31-G108 PolarHBondContact N-O 2.85Å; A31-F109 HydrophobicContact CB-CD1 3.93Å; A31-F109 HydrophobicContact CB-CE1 4.08Å; A31-F109 WeakPolarHBondContact O-CA 3.49Å; A31-L110 PolarHBondContact O-N 3.37Å
32	V	97.3	Very high	85.2	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	110.5	173.5	-171.1	0	0	0	0	108.5	K40 M43 I44 I79 Q80 T82 L110 V112 F189	V32-K40 HydrophobicContact CG1-CB 3.81Å; V32-K40 HydrophobicContact CG1-CD 4.16Å; V32-K40 HydrophobicContact CG1-CG 3.98Å; V32-M43 HydrophobicContact CG1-CE 4.09Å; V32-I44 HydrophobicContact CB-CD1 4Å; V32-I44 HydrophobicContact CB-CG1 4.44Å; V32-I44 HydrophobicContact CG2-CD1 3.73Å; V32-I44 HydrophobicContact CG2-CG1 3.81Å; V32-I79 HydrophobicContact CG2-CG2 3.77Å; V32-Q80 PolarHBondContact N-O 3.45Å; V32-T82 PolarHBondContact O-OG1 3.36Å; V32-L110 HydrophobicContact CG1-CB 4.21Å; V32-L110 HydrophobicContact CG2-CB 4.36Å; V32-L110 HydrophobicContact CG2-CD1 4.12Å; V32-V112 HydrophobicContact CG1-CG2 3.63Å; V32-F189 HydrophobicContact CG2-CE1 4.2Å; V32-F189 HydrophobicContact CG2-CZ 4.35Å
33	L	95.9	Very high	87.8	Confident	1 Å²	1	44 Å²	44	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	156	-174.3	-49.8	179.1	0	0	0	110.6	A31 T82 L99 V103 F109 L110 L111 V112 L127 I131	A31-L33 HydrophobicContact CB-CD2 4.24Å; A31-L33 HydrophobicContact CB-CG 4.44Å; L33-T82 HydrophobicContact CD2-CG2 3.42Å; L33-T82 VanDerWaalsContact CD2-CG2 3.42Å; L33-L99 HydrophobicContact CD1-CD1 4.21Å; L33-L99 HydrophobicContact CD2-CD1 3.93Å; L33-V103 HydrophobicContact CD1-CG2 4.41Å; L33-F109 HydrophobicContact CD1-CD1 4.15Å; L33-L110 PolarHBondContact N-O 3.46Å; L33-L111 HydrophobicContact CB-CD2 3.87Å; L33-L111 HydrophobicContact CD1-CD2 4.09Å; L33-L111 HydrophobicContact CG-CD2 4.45Å; L33-V112 PolarHBondContact O-N 3.24Å; L33-L127 HydrophobicContact CB-CD1 4.27Å; L33-L127 HydrophobicContact CB-CD2 4.33Å; L33-I131 HydrophobicContact CD1-CD1 4.04Å; L33-I131 HydrophobicContact CD1-CG1 4.26Å
34	G	94.9	Very high	89.8	Confident	8 Å²	8	36.7 Å²	36.7	8%	0.082	19%	0.19	C	C	.	.			trans	150.6	170.4	-179.9	0	0	0	0	0	112.3	K40 V112	G34-K40 PolarHBondContact O-NZ 3.29Å; G34-V112 WeakPolarHBondContact CA-O 3.38Å
35	A	92.8	Very high	91.8	Very high	21 Å²	21	30.3 Å²	30.3	17%	0.174	16%	0.157	C	C	.	.	S	Bend	trans	-61.5	173.7	-179.6	0	0	0	0	0	113.6	V38 K40	A35-V38 HydrophobicContact CB-CG1 3.93Å; A35-V38 WeakPolarHBondContact O-CG2 3.49Å; A35-K40 PolarHBondContact O-NZ 3.05Å
36	G	90.4	Very high	93.6	Very high	26 Å²	26	29.7 Å²	29.7	27%	0.268	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	143.2	171	0	0	0	0	0	111.7	V38 G84	G36-V38 PolarHBondContact O-N 3.5Å; G36-G84 WeakPolarHBondContact CA-O 3.32Å
37	R	91.6	Very high	94.7	Very high	236 Å²	236	25.4 Å²	25.4	89%	0.891	13%	0.129	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.1	14.5	166	-52.6	172.3	69.3	-163.5	2.5	116.6	G39 K148	R37-G39 PolarHBondContact O-N 3.32Å; R37-K148 WeakPolarHBondContact O-CE 3.32Å; R37-K148 PolarHBondContact O-NZ 2.97Å
38	V	95.4	Very high	94.9	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.119	C	C	.	.	S	Bend	trans	-74.4	-11.6	173.9	-56.9	0	0	0	0	113.6	A35 G36 K40 V112 N147	A35-V38 HydrophobicContact CB-CG1 3.93Å; A35-V38 WeakPolarHBondContact O-CG2 3.49Å; G36-V38 PolarHBondContact O-N 3.5Å; V38-K40 HydrophobicContact CG2-CD 4.2Å; V38-K40 HydrophobicContact CG2-CG 3.53Å; V38-V112 HydrophobicContact CB-CG1 4.42Å; V38-V112 HydrophobicContact CG2-CB 4.14Å; V38-V112 HydrophobicContact CG2-CG1 3.97Å; V38-N147 PolarHBondContact O-ND2 3.4Å
39	G	94.9	Very high	94.8	Very high	18 Å²	18	26.4 Å²	26.4	19%	0.186	14%	0.137	C	C	.	.	S	Bend	trans	101.7	19.1	177	0	0	0	0	0	115.9	R37 A42 M43	R37-G39 PolarHBondContact O-N 3.32Å; G39-A42 PolarHBondContact O-N 3.04Å; G39-M43 WeakPolarHBondContact O-CB 3.35Å; G39-M43 PolarHBondContact O-N 3.49Å
40	K	95.5	Very high	94.7	Very high	7 Å²	7	30 Å²	30	3%	0.03	15%	0.153	C	C	.	.	H	α-helix	trans	-54.3	-56	179.3	-54.3	-169.7	-60.8	-80.3	0	113.1	V32 G34 A35 V38 A42 M43 I44 T82 V112	V32-K40 HydrophobicContact CG1-CB 3.81Å; V32-K40 HydrophobicContact CG1-CD 4.16Å; V32-K40 HydrophobicContact CG1-CG 3.98Å; G34-K40 PolarHBondContact O-NZ 3.29Å; A35-K40 PolarHBondContact O-NZ 3.05Å; V38-K40 HydrophobicContact CG2-CD 4.2Å; V38-K40 HydrophobicContact CG2-CG 3.53Å; K40-A42 VanDerWaalsContact C-N 3.31Å; K40-A42 PolarHBondContact O-N 3.41Å; K40-M43 WeakPolarHBondContact O-CB 3.49Å; K40-M43 PolarHBondContact O-N 3.41Å; K40-M43 VanDerWaalsContact O-N 3.16Å; K40-I44 WeakPolarHBondContact O-CG1 3.23Å; K40-I44 PolarHBondContact O-N 3.12Å; K40-T82 WeakPolarHBondContact CE-O 3.47Å; K40-T82 PolarHBondContact NZ-O 3.22Å; K40-V112 HydrophobicContact CG-CB 4.26Å
41	S	94.4	Very high	94.4	Very high	16 Å²	16	39 Å²	39	11%	0.112	19%	0.186	C	C	.	.	H	α-helix	trans	-60.7	-41.6	179.1	-49.8	0	0	0	0	111.8	M43 I44 V45 N59 D81	S41-M43 VanDerWaalsContact C-N 3.34Å; S41-M43 PolarHBondContact O-N 3.06Å; S41-I44 PolarHBondContact O-N 3.19Å; S41-V45 WeakPolarHBondContact O-CB 3.4Å; S41-V45 VanDerWaalsContact O-CG2 3.31Å; S41-V45 WeakPolarHBondContact O-CG2 3.49Å; S41-V45 PolarHBondContact O-N 3.48Å; S41-N59 PolarHBondContact OG-ND2 3.49Å; S41-D81 WeakPolarHBondContact CA-OD2 3.35Å; S41-D81 VanDerWaalsContact CB-OD2 3.22Å; S41-D81 WeakPolarHBondContact CB-OD2 3.39Å; S41-D81 VanDerWaalsContact OG-CG 3.3Å; S41-D81 PolarHBondContact OG-OD1 2.92Å; S41-D81 PolarHBondContact OG-OD2 3.33Å
42	A	95.3	Very high	94.2	Very high	8 Å²	8	43 Å²	43	7%	0.066	20%	0.204	C	C	.	.	H	α-helix	trans	-60.7	-43.8	175.5	0	0	0	0	0	111.7	G39 K40 V45 R46 F52 Y56 T178	G39-A42 PolarHBondContact O-N 3.04Å; K40-A42 VanDerWaalsContact C-N 3.31Å; K40-A42 PolarHBondContact O-N 3.41Å; A42-V45 PolarHBondContact O-N 3.43Å; A42-R46 WeakPolarHBondContact O-CB 3.26Å; A42-R46 PolarHBondContact O-N 2.78Å; A42-F52 HydrophobicContact CB-CE2 4.14Å; A42-Y56 HydrophobicContact CB-CD2 3.92Å; A42-Y56 HydrophobicContact CB-CE2 3.4Å; A42-Y56 VanDerWaalsContact CB-CE2 3.4Å; A42-T178 HydrophobicContact CB-CG2 4.04Å
43	M	96.8	Very high	93.7	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-65.2	-43.8	-179.8	-160.3	-178.4	77.1	0	0	111.5	V32 G39 K40 S41 R46 F47 L110 V112 V145 I176 T178 V185 F189	V32-M43 HydrophobicContact CG1-CE 4.09Å; G39-M43 WeakPolarHBondContact O-CB 3.35Å; G39-M43 PolarHBondContact O-N 3.49Å; K40-M43 WeakPolarHBondContact O-CB 3.49Å; K40-M43 PolarHBondContact O-N 3.41Å; K40-M43 VanDerWaalsContact O-N 3.16Å; S41-M43 VanDerWaalsContact C-N 3.34Å; S41-M43 PolarHBondContact O-N 3.06Å; M43-R46 PolarHBondContact O-N 3.38Å; M43-F47 WeakPolarHBondContact O-CB 3.41Å; M43-F47 PolarHBondContact O-N 3.19Å; M43-L110 HydrophobicContact CE-CB 4.48Å; M43-L110 HydrophobicContact CE-CD1 3.39Å; M43-V112 HydrophobicContact CE-CG2 3.83Å; M43-V112 HydrophobicContact SD-CG2 4.31Å; M43-V145 HydrophobicContact SD-CG1 4.16Å; M43-I176 HydrophobicContact CG-CD1 4.36Å; M43-I176 HydrophobicContact SD-CD1 3.87Å; M43-T178 HydrophobicContact CB-CG2 4.17Å; M43-V185 HydrophobicContact CG-CG1 3.9Å; M43-V185 HydrophobicContact CG-CG2 4.36Å; M43-F189 HydrophobicContact CE-CE2 3.83Å; M43-F189 HydrophobicContact CE-CZ 3.69Å; M43-F189 HydrophobicContact CG-CE2 4Å
44	I	95.9	Very high	92.8	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-63	-49.5	175.9	-63.3	166.4	0	0	0	110.7	V32 K40 S41 R46 F47 L48 Y64 I79 D81 F189	V32-I44 HydrophobicContact CB-CD1 4Å; V32-I44 HydrophobicContact CB-CG1 4.44Å; V32-I44 HydrophobicContact CG2-CD1 3.73Å; V32-I44 HydrophobicContact CG2-CG1 3.81Å; K40-I44 WeakPolarHBondContact O-CG1 3.23Å; K40-I44 PolarHBondContact O-N 3.12Å; S41-I44 PolarHBondContact O-N 3.19Å; I44-R46 VanDerWaalsContact C-N 3.33Å; I44-R46 PolarHBondContact O-N 2.68Å; I44-F47 WeakPolarHBondContact O-CB 3.35Å; I44-F47 PolarHBondContact O-N 3.26Å; I44-L48 HydrophobicContact CG2-CD1 3.77Å; I44-L48 HydrophobicContact CG2-CG 4.38Å; I44-L48 VanDerWaalsContact O-CG 3.25Å; I44-L48 WeakPolarHBondContact O-CG 3.23Å; I44-L48 PolarHBondContact O-N 3.02Å; I44-Y64 HydrophobicContact CG2-CD1 4.49Å; I44-Y64 HydrophobicContact CG2-CD2 3.74Å; I44-Y64 HydrophobicContact CG2-CE2 3.99Å; I44-Y64 HydrophobicContact CG2-CG 4Å; I44-I79 HydrophobicContact CD1-CG2 3.89Å; I44-I79 HydrophobicContact CG1-CG2 3.96Å; I44-I79 HydrophobicContact CG2-CB 4.46Å; I44-I79 HydrophobicContact CG2-CD1 4.2Å; I44-I79 HydrophobicContact CG2-CG2 4.24Å; I44-D81 HydrophobicContact CD1-CB 3.53Å; I44-F189 HydrophobicContact CG1-CZ 4.02Å
45	V	94.1	Very high	92	Very high	16 Å²	16	56.4 Å²	56.4	10%	0.097	29%	0.286	C	S	.	.	H	α-helix	trans	-66.8	-37.7	-179.4	172.1	0	0	0	0	111	S41 A42 L48 T49 I53 Y56 Y64	S41-V45 WeakPolarHBondContact O-CB 3.4Å; S41-V45 VanDerWaalsContact O-CG2 3.31Å; S41-V45 WeakPolarHBondContact O-CG2 3.49Å; S41-V45 PolarHBondContact O-N 3.48Å; A42-V45 PolarHBondContact O-N 3.43Å; V45-L48 PolarHBondContact O-N 3.32Å; V45-T49 HydrophobicContact CG1-CG2 4.03Å; V45-T49 WeakPolarHBondContact O-CB 3.46Å; V45-T49 WeakPolarHBondContact O-CG2 3.41Å; V45-T49 PolarHBondContact O-N 3.14Å; V45-T49 PolarHBondContact O-OG1 3.03Å; V45-I53 HydrophobicContact CG1-CD1 4.25Å; V45-Y56 HydrophobicContact CB-CE1 4.42Å; V45-Y56 WeakPolarHBondContact CB-OH 3.34Å; V45-Y56 WeakPolarHBondContact CG1-OH 3.35Å; V45-Y56 HydrophobicContact CG2-CE1 4.11Å; V45-Y64 HydrophobicContact CG2-CE1 4.3Å
46	R	95.7	Very high	91.1	Very high	37 Å²	37	59.2 Å²	59.2	14%	0.14	29%	0.292	C	S	.	.	H	α-helix	trans	-59.9	-48.1	174.2	-179.3	59.7	160.6	-178.3	-11.3	110.8	A42 M43 I44 K50 R51 T178 Y182 V185	A42-R46 WeakPolarHBondContact O-CB 3.26Å; A42-R46 PolarHBondContact O-N 2.78Å; M43-R46 PolarHBondContact O-N 3.38Å; I44-R46 VanDerWaalsContact C-N 3.33Å; I44-R46 PolarHBondContact O-N 2.68Å; R46-K50 PolarHBondContact NH1-O 2.93Å; R46-K50 WeakPolarHBondContact O-CA 3.43Å; R46-K50 PolarHBondContact O-N 2.83Å; R46-R51 WeakPolarHBondContact CA-O 3.39Å; R46-T178 HydrophobicContact CB-CG2 4Å; R46-T178 HydrophobicContact CG-CG2 4.28Å; R46-Y182 HydrophobicContact CG-CD2 4.14Å; R46-Y182 VanDerWaalsContact O-CE2 3.28Å; R46-Y182 WeakPolarHBondContact O-CE2 3.29Å; R46-V185 HydrophobicContact CB-CG1 4.43Å; R46-V185 HydrophobicContact CG-CB 4.46Å; R46-V185 HydrophobicContact CG-CG1 4.28Å; R46-V185 HydrophobicContact CG-CG2 4.25Å
47	F	95.5	Very high	90.4	Very high	16 Å²	16	66 Å²	66	7%	0.07	32%	0.317	C	S	.	.	H	α-helix	trans	-57.2	-51.8	174.8	172.3	-114.4	0	0	0	112.1	M43 I44 V68 L77 I79 V185 F189	M43-F47 WeakPolarHBondContact O-CB 3.41Å; M43-F47 PolarHBondContact O-N 3.19Å; I44-F47 WeakPolarHBondContact O-CB 3.35Å; I44-F47 PolarHBondContact O-N 3.26Å; F47-V68 HydrophobicContact CE1-CG1 4.27Å; F47-V68 HydrophobicContact CZ-CG1 4.22Å; F47-L77 HydrophobicContact CE1-CD2 3.58Å; F47-L77 HydrophobicContact CZ-CD2 4.14Å; F47-I79 HydrophobicContact CD1-CD1 4.02Å; F47-I79 HydrophobicContact CE1-CD1 4.17Å; F47-V185 HydrophobicContact CB-CG1 3.94Å; F47-F189 HydrophobicContact CB-CD2 3.51Å; F47-F189 HydrophobicContact CB-CE2 3.59Å; F47-F189 HydrophobicContact CB-CG 4.26Å; F47-F189 HydrophobicContact CB-CZ 4.41Å; F47-F189 HydrophobicContact CD1-CB 4.14Å; F47-F189 HydrophobicContact CD1-CD1 4.17Å; F47-F189 AromaticContact CD1-CD2 3.96Å; F47-F189 HydrophobicContact CD1-CD2 3.96Å; F47-F189 HydrophobicContact CD1-CE2 4.39Å; F47-F189 AromaticContact CD1-CG 3.84Å; F47-F189 HydrophobicContact CD1-CG 3.84Å; F47-F189 HydrophobicContact CD2-CB 3.67Å; F47-F189 AromaticContact CD2-CD2 3.74Å; F47-F189 HydrophobicContact CD2-CD2 3.74Å; F47-F189 AromaticContact CD2-CG 3.92Å; F47-F189 HydrophobicContact CD2-CG 3.92Å; F47-F189 HydrophobicContact CE1-CB 4.02Å; F47-F189 HydrophobicContact CE1-CD1 4.41Å; F47-F189 HydrophobicContact CE1-CG 4.15Å; F47-F189 HydrophobicContact CE2-CB 3.52Å; F47-F189 HydrophobicContact CE2-CD2 4.47Å; F47-F189 HydrophobicContact CE2-CG 4.21Å; F47-F189 HydrophobicContact CG-CB 3.98Å; F47-F189 HydrophobicContact CG-CD1 4.46Å; F47-F189 AromaticContact CG-CD2 3.44Å; F47-F189 HydrophobicContact CG-CD2 3.44Å; F47-F189 VanDerWaalsContact CG-CD2 3.44Å; F47-F189 AromaticContact CG-CE2 3.98Å; F47-F189 HydrophobicContact CG-CE2 3.98Å; F47-F189 AromaticContact CG-CG 3.72Å; F47-F189 HydrophobicContact CG-CG 3.72Å; F47-F189 HydrophobicContact CZ-CB 3.71Å; F47-F189 HydrophobicContact CZ-CG 4.32Å
48	L	93.1	Very high	89.6	Confident	21 Å²	21	60.3 Å²	60.3	11%	0.11	31%	0.31	C	S	.	.	H	α-helix	trans	-70.5	-41.6	-175	-64	173.5	0	0	0	112.2	I44 V45 Y64 R66 I79	I44-L48 HydrophobicContact CG2-CD1 3.77Å; I44-L48 HydrophobicContact CG2-CG 4.38Å; I44-L48 VanDerWaalsContact O-CG 3.25Å; I44-L48 WeakPolarHBondContact O-CG 3.23Å; I44-L48 PolarHBondContact O-N 3.02Å; V45-L48 PolarHBondContact O-N 3.32Å; L48-Y64 HydrophobicContact CD1-CD1 3.75Å; L48-Y64 HydrophobicContact CD1-CG 3.92Å; L48-R66 HydrophobicContact CD2-CB 3.96Å; L48-R66 HydrophobicContact CD2-CG 4.44Å; L48-R66 VanDerWaalsContact O-CZ 3.25Å; L48-R66 PolarHBondContact O-NH1 3.38Å; L48-I79 HydrophobicContact CD2-CD1 4.25Å
49	T	91.9	Very high	88.4	Confident	62 Å²	62	62.1 Å²	62.1	38%	0.38	32%	0.32	S	S	.	.	H	α-helix	trans	-104.9	-9.3	-168.6	69.8	0	0	0	0	114.2	V45 R51	V45-T49 HydrophobicContact CG1-CG2 4.03Å; V45-T49 WeakPolarHBondContact O-CB 3.46Å; V45-T49 WeakPolarHBondContact O-CG2 3.41Å; V45-T49 PolarHBondContact O-N 3.14Å; V45-T49 PolarHBondContact O-OG1 3.03Å; T49-R51 PolarHBondContact O-N 3.35Å; T49-R51 VanDerWaalsContact O-N 3.1Å; T49-R51 PolarHBondContact OG1-N 2.96Å; T49-R51 PolarHBondContact OG1-O 3.17Å
50	K	93.6	Very high	87.4	Confident	137 Å²	137	67.9 Å²	67.9	60%	0.596	35%	0.352	S	S	*	.	S	Bend	trans	60.3	5.6	-168.3	-45.5	-164.1	173.5	-171	0	114.2	R46 Y182	R46-K50 PolarHBondContact NH1-O 2.93Å; R46-K50 WeakPolarHBondContact O-CA 3.43Å; R46-K50 PolarHBondContact O-N 2.83Å; K50-Y182 HydrophobicContact CB-CD2 4.31Å; K50-Y182 HydrophobicContact CB-CE2 4.03Å; K50-Y182 HydrophobicContact CD-CE1 4.1Å; K50-Y182 WeakPolarHBondContact CE-OH 3.4Å; K50-Y182 HydrophobicContact CG-CE1 4.22Å; K50-Y182 HydrophobicContact CG-CE2 3.81Å
51	R	91.3	Very high	86.4	Confident	188 Å²	188	68.8 Å²	68.8	71%	0.709	36%	0.364	S	S	*	.			trans	-108.7	142.5	179.9	-63.5	-175.2	-178.8	-151.2	-0.2	110.3	R46 T49	R46-R51 WeakPolarHBondContact CA-O 3.39Å; T49-R51 PolarHBondContact O-N 3.35Å; T49-R51 VanDerWaalsContact O-N 3.1Å; T49-R51 PolarHBondContact OG1-N 2.96Å; T49-R51 PolarHBondContact OG1-O 3.17Å
52	F	91.4	Very high	86.1	Confident	86 Å²	86	73.3 Å²	73.3	38%	0.377	38%	0.381	S	S	.	.			trans	-97.5	130.2	168.1	179.3	-106.2	0	0	0	108.7	A42 T178	A42-F52 HydrophobicContact CB-CE2 4.14Å; F52-T178 HydrophobicContact CD2-CG2 4.14Å; F52-T178 HydrophobicContact CE2-CG2 4.23Å
53	I	86.6	Confident	85.9	Confident	83 Å²	83	76.9 Å²	76.9	43%	0.426	40%	0.399	S	S	.	.			trans	-116.1	119.3	173.3	-54	173.7	0	0	0	105	V45 Y56	V45-I53 HydrophobicContact CG1-CD1 4.25Å; I53-Y56 HydrophobicContact CB-CE1 4.33Å; I53-Y56 HydrophobicContact CB-CE2 4.11Å; I53-Y56 WeakPolarHBondContact CB-OH 3.15Å; I53-Y56 VanDerWaalsContact O-CD2 3.32Å; I53-Y56 WeakPolarHBondContact O-CD2 3.45Å; I53-Y56 WeakPolarHBondContact O-CE2 3.5Å
54	G	77.8	Confident	85.7	Confident	52 Å²	52	78.7 Å²	78.7	54%	0.536	41%	0.406	S	S	.	.	S	Bend	trans	-73.1	-31.8	-174.8	0	0	0	0	0	113.3
55	D	78.4	Confident	85.6	Confident	155 Å²	155	82.5 Å²	82.5	83%	0.829	43%	0.432	S	S	*	.			trans	-102.1	104.5	-172.1	-57.7	-43.9	0	0	0	110.3
56	Y	74.5	Confident	85.4	Confident	80 Å²	80	87.8 Å²	87.8	31%	0.314	45%	0.451	S	S	.	.			trans	-117.8	130.8	172.7	-71.9	-77.1	0	0	0	110.6	A42 V45 I53	A42-Y56 HydrophobicContact CB-CD2 3.92Å; A42-Y56 HydrophobicContact CB-CE2 3.4Å; A42-Y56 VanDerWaalsContact CB-CE2 3.4Å; V45-Y56 HydrophobicContact CB-CE1 4.42Å; V45-Y56 WeakPolarHBondContact CB-OH 3.34Å; V45-Y56 WeakPolarHBondContact CG1-OH 3.35Å; V45-Y56 HydrophobicContact CG2-CE1 4.11Å; I53-Y56 HydrophobicContact CB-CE1 4.33Å; I53-Y56 HydrophobicContact CB-CE2 4.11Å; I53-Y56 WeakPolarHBondContact CB-OH 3.15Å; I53-Y56 VanDerWaalsContact O-CD2 3.32Å; I53-Y56 WeakPolarHBondContact O-CD2 3.45Å; I53-Y56 WeakPolarHBondContact O-CE2 3.5Å
57	E	75.4	Confident	85.1	Confident	168 Å²	168	90.4 Å²	90.4	79%	0.785	47%	0.467	S	S	*	.	P	Polyproline II helix	trans	-62.8	150	164.4	-68.8	-59.3	134.5	0	0	110.8	N59	E57-N59 PolarHBondContact O-N 3.3Å
58	P	74.3	Confident	84.7	Confident	116 Å²	116	90.5 Å²	90.5	75%	0.753	47%	0.469	S	S	*	.	P	Polyproline II helix	trans	-52.1	123.8	171.5	-24.7	34.1	0	0	0	111.1
59	N	70.9	Confident	84.4	Confident	38 Å²	38	96.9 Å²	96.9	20%	0.203	49%	0.492	C	S	.	.	P	Polyproline II helix	trans	-76.3	139.9	-179.3	84.3	62.3	0	0	0	111	S41 E57 G61 D81 T82 P83	S41-N59 PolarHBondContact OG-ND2 3.49Å; E57-N59 PolarHBondContact O-N 3.3Å; N59-G61 VanDerWaalsContact C-N 3.31Å; N59-G61 PolarHBondContact OD1-N 3.24Å; N59-G61 VanDerWaalsContact OD1-N 3.11Å; N59-D81 PolarHBondContact ND2-OD1 3.33Å; N59-D81 PolarHBondContact ND2-OD2 3.02Å; N59-T82 PolarHBondContact ND2-O 3.33Å; N59-T82 VanDerWaalsContact OD1-C 3.22Å; N59-T82 PolarHBondContact OD1-O 3.45Å; N59-P83 WeakPolarHBondContact OD1-CA 3.44Å
60	T	72.1	Confident	83.8	Confident	139 Å²	139	94.3 Å²	94.3	85%	0.853	48%	0.477	S	S	*	.	S	Bend	trans	-95.1	13.6	173	51.8	0	0	0	0	112.5
61	G	76.4	Confident	83.1	Confident	27 Å²	27	94.3 Å²	94.3	28%	0.278	48%	0.479	S	S	.	.			trans	92.7	124.8	-171.2	0	0	0	0	0	111.5	N59 D81	N59-G61 VanDerWaalsContact C-N 3.31Å; N59-G61 PolarHBondContact OD1-N 3.24Å; N59-G61 VanDerWaalsContact OD1-N 3.11Å; G61-D81 VanDerWaalsContact CA-O 3.29Å; G61-D81 WeakPolarHBondContact CA-O 3.48Å
62	K	86.1	Confident	82.4	Confident	111 Å²	111	88.4 Å²	88.4	48%	0.483	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	134.2	-178.6	-174.7	164.7	167.9	-170.5	0	111.2	Y64 Q80 D81	K62-Y64 HydrophobicContact CB-CD2 4.49Å; K62-Y64 HydrophobicContact CB-CE2 3.87Å; K62-Y64 HydrophobicContact CD-CE1 3.99Å; K62-Y64 HydrophobicContact CD-CE2 3.94Å; K62-Y64 WeakPolarHBondContact CD-OH 3.47Å; K62-Y64 VanDerWaalsContact CE-CE1 3.46Å; K62-Y64 HydrophobicContact CG-CD2 4.17Å; K62-Y64 HydrophobicContact CG-CE1 4.38Å; K62-Y64 HydrophobicContact CG-CE2 3.71Å; K62-Q80 PolarHBondContact O-NE2 3.01Å; K62-D81 HydrophobicContact CB-CB 4.41Å; K62-D81 PolarHBondContact N-O 3.12Å; K62-D81 WeakPolarHBondContact O-CB 3.43Å; K62-D81 PolarHBondContact O-N 3.14Å
63	L	91.5	Very high	81.9	Confident	83 Å²	83	89.7 Å²	89.7	44%	0.435	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	123.5	172.1	-175.1	62.9	0	0	0	109	Q78 Q80 W105	L63-Q78 HydrophobicContact CD1-CB 4.24Å; L63-Q80 HydrophobicContact CD1-CB 4.5Å; L63-W105 HydrophobicContact CD1-CH2 3.71Å; L63-W105 HydrophobicContact CD1-CZ2 3.8Å
64	Y	93.3	Very high	81.9	Confident	37 Å²	37	90 Å²	90	15%	0.145	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	130.2	173.8	-63.7	-94.7	0	0	0	109.1	I44 V45 L48 K62 Q78 I79 D81	I44-Y64 HydrophobicContact CG2-CD1 4.49Å; I44-Y64 HydrophobicContact CG2-CD2 3.74Å; I44-Y64 HydrophobicContact CG2-CE2 3.99Å; I44-Y64 HydrophobicContact CG2-CG 4Å; V45-Y64 HydrophobicContact CG2-CE1 4.3Å; L48-Y64 HydrophobicContact CD1-CD1 3.75Å; L48-Y64 HydrophobicContact CD1-CG 3.92Å; K62-Y64 HydrophobicContact CB-CD2 4.49Å; K62-Y64 HydrophobicContact CB-CE2 3.87Å; K62-Y64 HydrophobicContact CD-CE1 3.99Å; K62-Y64 HydrophobicContact CD-CE2 3.94Å; K62-Y64 WeakPolarHBondContact CD-OH 3.47Å; K62-Y64 VanDerWaalsContact CE-CE1 3.46Å; K62-Y64 HydrophobicContact CG-CD2 4.17Å; K62-Y64 HydrophobicContact CG-CE1 4.38Å; K62-Y64 HydrophobicContact CG-CE2 3.71Å; Y64-Q78 CarbonylContact O-C 3.57Å; Y64-Q78 VanDerWaalsContact O-CA 3.29Å; Y64-Q78 WeakPolarHBondContact O-CA 3.45Å; Y64-I79 PolarHBondContact N-O 3.08Å; Y64-I79 PolarHBondContact O-N 3.11Å; Y64-D81 HydrophobicContact CD2-CB 4.31Å; Y64-D81 HydrophobicContact CE2-CB 3.79Å
65	S	93.3	Very high	82.4	Confident	80 Å²	80	88.7 Å²	88.7	56%	0.559	47%	0.468	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.2	126.6	176.3	-58.2	0	0	0	0	109.9	L77	S65-L77 CarbonylContact C-O 3.55Å; S65-L77 WeakPolarHBondContact CA-O 3.44Å
66	R	89.9	Confident	83.1	Confident	128 Å²	128	82.3 Å²	82.3	48%	0.483	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	145.9	179.9	-168.5	160.5	-175	171.5	-9.4	112.5	L48 L77	L48-R66 HydrophobicContact CD2-CB 3.96Å; L48-R66 HydrophobicContact CD2-CG 4.44Å; L48-R66 VanDerWaalsContact O-CZ 3.25Å; L48-R66 PolarHBondContact O-NH1 3.38Å; R66-L77 PolarHBondContact N-O 3Å; R66-L77 WeakPolarHBondContact O-CB 3.09Å; R66-L77 PolarHBondContact O-N 2.72Å
67	L	90.3	Very high	84	Confident	92 Å²	92	78.6 Å²	78.6	48%	0.482	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	124.9	166.1	-64.1	174.4	0	0	0	109.6	Q74 L75	L67-Q74 HydrophobicContact CB-CG 4.41Å; L67-L75 WeakPolarHBondContact CA-O 3.28Å
68	V	87.6	Confident	85	Confident	18 Å²	18	72 Å²	72	11%	0.109	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	156.4	178.4	-60.8	0	0	0	0	110.2	F47 V70 Q74 L75 L77	F47-V68 HydrophobicContact CE1-CG1 4.27Å; F47-V68 HydrophobicContact CZ-CG1 4.22Å; V68-V70 HydrophobicContact CG2-CG2 4.16Å; V68-Q74 WeakPolarHBondContact O-CA 3.29Å; V68-L75 HydrophobicContact CG2-CB 4.35Å; V68-L75 PolarHBondContact N-O 3.3Å; V68-L75 PolarHBondContact O-N 3.43Å; V68-L77 HydrophobicContact CG1-CB 4.28Å; V68-L77 HydrophobicContact CG1-CD2 3.97Å; V68-L77 HydrophobicContact CG2-CB 3.82Å; V68-L77 HydrophobicContact CG2-CD2 4Å
69	Y	85.4	Confident	86.1	Confident	154 Å²	154	66.6 Å²	66.6	60%	0.604	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104	125.7	172.3	-71.1	-88.7	0	0	0	109.1	D73 Q74	Y69-D73 WeakPolarHBondContact CA-O 3.42Å; Y69-Q74 HydrophobicContact CD1-CB 4.12Å; Y69-Q74 HydrophobicContact CE1-CB 3.78Å; Y69-Q74 HydrophobicContact CE1-CG 4.09Å
70	V	80.7	Confident	87.3	Confident	8 Å²	8	66.9 Å²	66.9	5%	0.048	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	120.5	175.6	-178.2	0	0	0	0	107.2	V68 G72 D73 L75 C193 K194	V68-V70 HydrophobicContact CG2-CG2 4.16Å; V70-G72 PolarHBondContact O-N 2.76Å; V70-G72 VanDerWaalsContact O-N 3.11Å; V70-D73 PolarHBondContact N-O 2.67Å; V70-D73 PolarHBondContact O-N 2.64Å; V70-L75 HydrophobicContact CB-CD1 3.7Å; V70-L75 HydrophobicContact CG2-CD1 3.86Å; V70-C193 HydrophobicContact CG1-CB 4.44Å; V70-C193 HydrophobicContact CG2-CB 3.95Å; V70-K194 HydrophobicContact CG1-CB 4.48Å
71	E	77.4	Confident	88.2	Confident	137 Å²	137	60.3 Å²	60.3	64%	0.64	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	28.9	-177.5	-57.4	-166.6	131.2	0	0	114.9	D73 K194	E71-D73 VanDerWaalsContact C-N 3.34Å; E71-K194 VanDerWaalsContact OE1-CE 3.23Å; E71-K194 WeakPolarHBondContact OE1-CE 3.32Å; E71-K194 IonicContact OE1-NZ 2.64Å; E71-K194 PolarHBondContact OE1-NZ 3.01Å; E71-K194 VanDerWaalsContact OE2-CE 3.23Å; E71-K194 WeakPolarHBondContact OE2-CE 3.31Å; E71-K194 IonicContact OE2-NZ 3.58Å
72	G	77.9	Confident	88.7	Confident	65 Å²	65	59.7 Å²	59.7	67%	0.67	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.8	-13.1	-179.3	0	0	0	0	0	114.4	V70	V70-G72 PolarHBondContact O-N 2.76Å; V70-G72 VanDerWaalsContact O-N 3.11Å
73	D	80.9	Confident	88.5	Confident	113 Å²	113	57.8 Å²	57.8	60%	0.604	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.9	137	176.7	-71.4	-28.1	0	0	0	111.5	Y69 V70 E71	Y69-D73 WeakPolarHBondContact CA-O 3.42Å; V70-D73 PolarHBondContact N-O 2.67Å; V70-D73 PolarHBondContact O-N 2.64Å; E71-D73 VanDerWaalsContact C-N 3.34Å
74	Q	86.6	Confident	87.1	Confident	88 Å²	88	55.3 Å²	55.3	41%	0.411	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	121	174.7	-167	175.9	25.6	0	0	110.2	L67 V68 Y69	L67-Q74 HydrophobicContact CB-CG 4.41Å; V68-Q74 WeakPolarHBondContact O-CA 3.29Å; Y69-Q74 HydrophobicContact CD1-CB 4.12Å; Y69-Q74 HydrophobicContact CE1-CB 3.78Å; Y69-Q74 HydrophobicContact CE1-CG 4.09Å
75	L	87.9	Confident	85.4	Confident	26 Å²	26	55.4 Å²	55.4	14%	0.136	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	141.9	-175.6	-58.5	166.7	0	0	0	110.1	I28 L67 V68 V70	I28-L75 HydrophobicContact CD1-CB 4.25Å; I28-L75 HydrophobicContact CD1-CD1 3.71Å; I28-L75 HydrophobicContact CD1-CD2 4.42Å; I28-L75 HydrophobicContact CD1-CG 4.34Å; L67-L75 WeakPolarHBondContact CA-O 3.28Å; V68-L75 HydrophobicContact CG2-CB 4.35Å; V68-L75 PolarHBondContact N-O 3.3Å; V68-L75 PolarHBondContact O-N 3.43Å; V70-L75 HydrophobicContact CB-CD1 3.7Å; V70-L75 HydrophobicContact CG2-CD1 3.86Å
76	S	92.3	Very high	83.4	Confident	21 Å²	21	56.9 Å²	56.9	15%	0.147	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	116.2	168.9	-176.7	0	0	0	0	108.4	P25 D27 I28	P25-S76 WeakPolarHBondContact O-CB 3.41Å; D27-S76 CarbonylContact C-O 3.45Å; D27-S76 WeakPolarHBondContact CA-O 3.41Å; D27-S76 WeakPolarHBondContact OD1-CB 3.34Å; D27-S76 PolarHBondContact OD1-OG 3.09Å; I28-S76 PolarHBondContact N-O 3.42Å
77	L	94.6	Very high	81.1	Confident	1 Å²	1	58.9 Å²	58.9	1%	0.005	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	127.4	-177	-179.9	63.5	0	0	0	110.3	I28 L30 F47 S65 R66 V68 I79	I28-L77 HydrophobicContact CB-CD1 3.99Å; I28-L77 HydrophobicContact CG2-CD1 3.71Å; L30-L77 HydrophobicContact CD1-CD1 3.66Å; L30-L77 HydrophobicContact CG-CD1 3.73Å; F47-L77 HydrophobicContact CE1-CD2 3.58Å; F47-L77 HydrophobicContact CZ-CD2 4.14Å; S65-L77 CarbonylContact C-O 3.55Å; S65-L77 WeakPolarHBondContact CA-O 3.44Å; R66-L77 PolarHBondContact N-O 3Å; R66-L77 WeakPolarHBondContact O-CB 3.09Å; R66-L77 PolarHBondContact O-N 2.72Å; V68-L77 HydrophobicContact CG1-CB 4.28Å; V68-L77 HydrophobicContact CG1-CD2 3.97Å; V68-L77 HydrophobicContact CG2-CB 3.82Å; V68-L77 HydrophobicContact CG2-CD2 4Å; L77-I79 HydrophobicContact CD1-CG1 4.28Å; L77-I79 HydrophobicContact CD2-CD1 3.82Å; L77-I79 HydrophobicContact CD2-CG1 4Å; L77-I79 HydrophobicContact CG-CD1 4.21Å; L77-I79 HydrophobicContact CG-CG1 3.83Å
78	Q	96.4	Very high	78.9	Confident	31 Å²	31	58 Å²	58	15%	0.145	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	124.6	171.7	-64.2	-177.1	9.7	0	0	109.2	D27 I28 K29 L30 L63 Y64 W105	D27-Q78 PolarHBondContact OD2-NE2 3.35Å; I28-Q78 PolarHBondContact O-N 3.2Å; K29-Q78 WeakPolarHBondContact CA-O 3.41Å; K29-Q78 HydrophobicContact CG-CB 4.47Å; L30-Q78 PolarHBondContact N-O 3.06Å; L63-Q78 HydrophobicContact CD1-CB 4.24Å; Y64-Q78 CarbonylContact O-C 3.57Å; Y64-Q78 VanDerWaalsContact O-CA 3.29Å; Y64-Q78 WeakPolarHBondContact O-CA 3.45Å; Q78-W105 HydrophobicContact CB-CH2 3.89Å; Q78-W105 HydrophobicContact CB-CZ2 3.77Å
79	I	96.6	Very high	76.7	Confident	1 Å²	1	65 Å²	65	1%	0.005	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	117.8	-179.4	-47.4	175.8	0	0	0	109.1	L30 V32 I44 F47 L48 Y64 L77 F189	L30-I79 CarbonylContact O-C 3.59Å; L30-I79 WeakPolarHBondContact O-CA 3.29Å; V32-I79 HydrophobicContact CG2-CG2 3.77Å; I44-I79 HydrophobicContact CD1-CG2 3.89Å; I44-I79 HydrophobicContact CG1-CG2 3.96Å; I44-I79 HydrophobicContact CG2-CB 4.46Å; I44-I79 HydrophobicContact CG2-CD1 4.2Å; I44-I79 HydrophobicContact CG2-CG2 4.24Å; F47-I79 HydrophobicContact CD1-CD1 4.02Å; F47-I79 HydrophobicContact CE1-CD1 4.17Å; L48-I79 HydrophobicContact CD2-CD1 4.25Å; Y64-I79 PolarHBondContact N-O 3.08Å; Y64-I79 PolarHBondContact O-N 3.11Å; L77-I79 HydrophobicContact CD1-CG1 4.28Å; L77-I79 HydrophobicContact CD2-CD1 3.82Å; L77-I79 HydrophobicContact CD2-CG1 4Å; L77-I79 HydrophobicContact CG-CD1 4.21Å; L77-I79 HydrophobicContact CG-CG1 3.83Å; I79-F189 HydrophobicContact CD1-CD1 4.24Å; I79-F189 HydrophobicContact CD1-CE1 3.97Å; I79-F189 HydrophobicContact CG2-CE1 4.39Å
80	Q	95.4	Very high	74.6	Confident	44 Å²	44	64.1 Å²	64.1	21%	0.206	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	110.8	171.4	-176.1	63.8	52.8	0	0	109.7	L30 V32 K62 L63 T82 W105	L30-Q80 PolarHBondContact O-N 3.37Å; V32-Q80 PolarHBondContact N-O 3.45Å; K62-Q80 PolarHBondContact O-NE2 3.01Å; L63-Q80 HydrophobicContact CD1-CB 4.5Å; Q80-T82 HydrophobicContact CG-CG2 4.09Å; Q80-W105 HydrophobicContact CB-CE3 4.22Å; Q80-W105 HydrophobicContact CB-CH2 4.12Å; Q80-W105 HydrophobicContact CB-CZ3 3.54Å
81	D	91.4	Very high	72.9	Confident	1 Å²	1	68.3 Å²	68.3	1%	0.005	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	120.1	165.4	-171.9	7.2	0	0	0	108.2	S41 I44 N59 G61 K62 Y64	S41-D81 WeakPolarHBondContact CA-OD2 3.35Å; S41-D81 VanDerWaalsContact CB-OD2 3.22Å; S41-D81 WeakPolarHBondContact CB-OD2 3.39Å; S41-D81 VanDerWaalsContact OG-CG 3.3Å; S41-D81 PolarHBondContact OG-OD1 2.92Å; S41-D81 PolarHBondContact OG-OD2 3.33Å; I44-D81 HydrophobicContact CD1-CB 3.53Å; N59-D81 PolarHBondContact ND2-OD1 3.33Å; N59-D81 PolarHBondContact ND2-OD2 3.02Å; G61-D81 VanDerWaalsContact CA-O 3.29Å; G61-D81 WeakPolarHBondContact CA-O 3.48Å; K62-D81 HydrophobicContact CB-CB 4.41Å; K62-D81 PolarHBondContact N-O 3.12Å; K62-D81 WeakPolarHBondContact O-CB 3.43Å; K62-D81 PolarHBondContact O-N 3.14Å; Y64-D81 HydrophobicContact CD2-CB 4.31Å; Y64-D81 HydrophobicContact CE2-CB 3.79Å
82	T	87.2	Confident	71.6	Confident	15 Å²	15	67.2 Å²	67.2	9%	0.092	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-99.2	145	-180	68.9	0	0	0	0	111.3	V32 L33 K40 N59 Q80 G84	V32-T82 PolarHBondContact O-OG1 3.36Å; L33-T82 HydrophobicContact CD2-CG2 3.42Å; L33-T82 VanDerWaalsContact CD2-CG2 3.42Å; K40-T82 WeakPolarHBondContact CE-O 3.47Å; K40-T82 PolarHBondContact NZ-O 3.22Å; N59-T82 PolarHBondContact ND2-O 3.33Å; N59-T82 VanDerWaalsContact OD1-C 3.22Å; N59-T82 PolarHBondContact OD1-O 3.45Å; Q80-T82 HydrophobicContact CG-CG2 4.09Å; T82-G84 PolarHBondContact O-N 2.94Å
83	P	81.8	Confident	70.4	Confident	71 Å²	71	67.9 Å²	67.9	46%	0.461	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-52	134.9	169	-25	34.1	0	0	0	110.3	N59	N59-P83 WeakPolarHBondContact OD1-CA 3.44Å
84	G	63.3	Low	69.1	Low	30 Å²	30	68.6 Å²	68.6	31%	0.309	38%	0.383	S	S	.	.	S	Bend	trans	-88.2	110	172.3	0	0	0	0	0	109.6	G36 T82	G36-G84 WeakPolarHBondContact CA-O 3.32Å; T82-G84 PolarHBondContact O-N 2.94Å
85	G	57.3	Low	67.6	Low	39 Å²	39	67.5 Å²	67.5	40%	0.402	38%	0.383	S	S	.	.			trans	154.5	75.5	-175.4	0	0	0	0	0	111.1	Q87	G85-Q87 PolarHBondContact O-N 2.84Å
86	I	51.3	Low	66.3	Low	111 Å²	111	69.6 Å²	69.6	57%	0.569	40%	0.397	S	S	*	.			trans	-89	56.2	154.3	-48	178.2	0	0	0	106	L99 L127	I86-L99 HydrophobicContact CD1-CD2 3.83Å; I86-L127 HydrophobicContact CD1-CD2 3.45Å; I86-L127 VanDerWaalsContact CD1-CD2 3.45Å; I86-L127 HydrophobicContact CD1-CG 4.26Å
87	Q	41.8	Very low	65.1	Low	170 Å²	170	72.7 Å²	72.7	79%	0.794	41%	0.411	S	S	*	.			trans	-89.7	109.8	167.5	-75.9	-167.5	-4.8	0	0	106.9	G85 Q89	G85-Q87 PolarHBondContact O-N 2.84Å; Q87-Q89 PolarHBondContact O-N 2.98Å; Q87-Q89 VanDerWaalsContact O-N 3.09Å
88	A	44.1	Very low	64.1	Low	74 Å²	74	76.1 Å²	76.1	61%	0.612	44%	0.436	S	S	*	.			trans	-58.3	104.6	168.8	0	0	0	0	0	108.7	L92	A88-L92 HydrophobicContact CB-CD2 4.4Å
89	Q	40.2	Very low	63.4	Low	164 Å²	164	76.1 Å²	76.1	77%	0.766	44%	0.436	S	S	*	.	S	Bend	trans	-152.3	-40.6	143.7	-141.9	160	2.4	0	0	114.7	Q87	Q87-Q89 PolarHBondContact O-N 2.98Å; Q87-Q89 VanDerWaalsContact O-N 3.09Å
90	D	41.2	Very low	62.8	Low	137 Å²	137	77.6 Å²	77.6	73%	0.733	45%	0.447	S	S	*	.	S	Bend	trans	-116.5	-16.2	-163.2	-63.6	-36.9	0	0	0	117.6
91	N	46.3	Very low	62.4	Low	95 Å²	95	81.9 Å²	81.9	51%	0.508	47%	0.465	S	S	.	.			trans	-152.5	64.4	178.3	-74.9	-64.1	0	0	0	113	S93 T95	N91-S93 VanDerWaalsContact C-N 3.3Å; N91-S93 PolarHBondContact O-N 2.67Å; N91-T95 PolarHBondContact O-N 3.47Å; N91-T95 PolarHBondContact O-OG1 3.14Å
92	L	49.6	Very low	62.3	Low	115 Å²	115	82.5 Å²	82.5	60%	0.602	47%	0.469	S	S	*	.	H	α-helix	trans	-56.2	-36.4	-177.8	-82.8	153.9	0	0	0	113.7	A88 V96	A88-L92 HydrophobicContact CB-CD2 4.4Å; L92-V96 VanDerWaalsContact O-CB 3.29Å; L92-V96 WeakPolarHBondContact O-CB 3.35Å; L92-V96 WeakPolarHBondContact O-CG2 3.13Å; L92-V96 PolarHBondContact O-N 3.48Å
93	S	52.8	Low	62.5	Low	78 Å²	78	81.9 Å²	81.9	55%	0.545	47%	0.465	S	S	.	.	H	α-helix	trans	-69.6	-51.6	-177.4	58.7	0	0	0	0	112.7	N91 T95 V96 D97	N91-S93 VanDerWaalsContact C-N 3.3Å; N91-S93 PolarHBondContact O-N 2.67Å; S93-T95 VanDerWaalsContact C-N 3.33Å; S93-T95 PolarHBondContact O-N 3.47Å; S93-V96 PolarHBondContact O-N 3.24Å; S93-D97 WeakPolarHBondContact O-CB 3.49Å; S93-D97 PolarHBondContact O-N 3.43Å
94	Q	53.8	Low	63	Low	128 Å²	128	84.7 Å²	84.7	60%	0.598	47%	0.473	S	S	*	.	H	α-helix	trans	-68.5	-32.8	-175.4	-60.3	-174.8	15.1	0	0	112.8	S98	Q94-S98 WeakPolarHBondContact O-CB 3.46Å; Q94-S98 PolarHBondContact O-N 3.37Å; Q94-S98 VanDerWaalsContact O-N 3.07Å; Q94-S98 PolarHBondContact O-OG 3.26Å
95	T	54.4	Low	64.4	Low	66 Å²	66	86.6 Å²	86.6	41%	0.405	47%	0.47	S	S	.	.	H	α-helix	trans	-75.4	-41.3	-179.1	-49.3	0	0	0	0	111.3	N91 S93 D97 S98 L99	N91-T95 PolarHBondContact O-N 3.47Å; N91-T95 PolarHBondContact O-OG1 3.14Å; S93-T95 VanDerWaalsContact C-N 3.33Å; S93-T95 PolarHBondContact O-N 3.47Å; T95-D97 VanDerWaalsContact C-N 3.34Å; T95-S98 PolarHBondContact O-N 2.84Å; T95-L99 PolarHBondContact O-N 3.36Å; T95-L99 VanDerWaalsContact O-N 3.09Å
96	V	60.2	Low	66.3	Low	69 Å²	69	84.8 Å²	84.8	42%	0.418	45%	0.452	S	S	.	.	H	α-helix	trans	-66.4	-38.6	174.2	173.5	0	0	0	0	110.8	L92 S93 S98 S100	L92-V96 VanDerWaalsContact O-CB 3.29Å; L92-V96 WeakPolarHBondContact O-CB 3.35Å; L92-V96 WeakPolarHBondContact O-CG2 3.13Å; L92-V96 PolarHBondContact O-N 3.48Å; S93-V96 PolarHBondContact O-N 3.24Å; V96-S98 VanDerWaalsContact C-N 3.34Å; V96-S98 PolarHBondContact O-N 3.02Å; V96-S100 VanDerWaalsContact O-CB 3.29Å; V96-S100 WeakPolarHBondContact O-CB 3.43Å; V96-S100 PolarHBondContact O-N 3.02Å; V96-S100 PolarHBondContact O-OG 3.38Å
97	D	68.3	Low	68.4	Low	86 Å²	86	82.1 Å²	82.1	46%	0.46	44%	0.437	S	S	.	.	H	α-helix	trans	-63.2	-40.3	175.4	-76.1	-15.2	0	0	0	112.2	S93 T95 S100 K101	S93-D97 WeakPolarHBondContact O-CB 3.49Å; S93-D97 PolarHBondContact O-N 3.43Å; T95-D97 VanDerWaalsContact C-N 3.34Å; D97-S100 PolarHBondContact O-N 3.15Å; D97-K101 WeakPolarHBondContact O-CB 3.29Å; D97-K101 WeakPolarHBondContact O-CG 3.29Å; D97-K101 PolarHBondContact O-N 2.82Å
98	S	73.4	Confident	71	Confident	74 Å²	74	74 Å²	74	52%	0.517	40%	0.399	S	S	.	.	H	α-helix	trans	-69	-43.1	-179.5	-60.1	0	0	0	0	111.9	Q94 T95 V96 C102	Q94-S98 WeakPolarHBondContact O-CB 3.46Å; Q94-S98 PolarHBondContact O-N 3.37Å; Q94-S98 VanDerWaalsContact O-N 3.07Å; Q94-S98 PolarHBondContact O-OG 3.26Å; T95-S98 PolarHBondContact O-N 2.84Å; V96-S98 VanDerWaalsContact C-N 3.34Å; V96-S98 PolarHBondContact O-N 3.02Å; S98-C102 WeakPolarHBondContact O-CB 3.39Å; S98-C102 PolarHBondContact O-N 3.3Å
99	L	82.1	Confident	73.6	Confident	30 Å²	30	70.5 Å²	70.5	16%	0.157	37%	0.37	C	S	.	.	H	α-helix	trans	-63.6	-43.9	173.5	-179.3	62.9	0	0	0	111.3	L33 I86 T95 K101 C102 V103 L127 Q130	L33-L99 HydrophobicContact CD1-CD1 4.21Å; L33-L99 HydrophobicContact CD2-CD1 3.93Å; I86-L99 HydrophobicContact CD1-CD2 3.83Å; T95-L99 PolarHBondContact O-N 3.36Å; T95-L99 VanDerWaalsContact O-N 3.09Å; L99-K101 PolarHBondContact O-N 3.35Å; L99-C102 WeakPolarHBondContact O-CB 3.3Å; L99-C102 PolarHBondContact O-N 3.49Å; L99-V103 HydrophobicContact CD1-CG2 4.19Å; L99-V103 HydrophobicContact CG-CG2 4.37Å; L99-V103 VanDerWaalsContact O-CG2 3.29Å; L99-V103 WeakPolarHBondContact O-CG2 3.48Å; L99-V103 PolarHBondContact O-N 2.86Å; L99-L127 HydrophobicContact CD1-CD2 4.36Å; L99-L127 HydrophobicContact CD2-CD2 4.1Å; L99-Q130 HydrophobicContact CD2-CG 4.36Å
100	S	83.3	Confident	76.4	Confident	33 Å²	33	62.7 Å²	62.7	23%	0.231	33%	0.333	C	S	.	.	H	α-helix	trans	-61.5	-44.1	179.3	-59.1	0	0	0	0	111.7	V96 D97 V103 Q104	V96-S100 VanDerWaalsContact O-CB 3.29Å; V96-S100 WeakPolarHBondContact O-CB 3.43Å; V96-S100 PolarHBondContact O-N 3.02Å; V96-S100 PolarHBondContact O-OG 3.38Å; D97-S100 PolarHBondContact O-N 3.15Å; S100-V103 PolarHBondContact O-N 3.25Å; S100-Q104 WeakPolarHBondContact O-CB 3.48Å; S100-Q104 VanDerWaalsContact O-CG 3.26Å; S100-Q104 WeakPolarHBondContact O-CG 3.3Å; S100-Q104 PolarHBondContact O-N 3.37Å
101	K	86.3	Confident	79.1	Confident	133 Å²	133	56.2 Å²	56.2	58%	0.578	30%	0.299	S	S	*	.	H	α-helix	trans	-61.9	-42.2	174.4	-73	168.6	-174.7	172.3	0	112.1	D97 L99 Q104 W105	D97-K101 WeakPolarHBondContact O-CB 3.29Å; D97-K101 WeakPolarHBondContact O-CG 3.29Å; D97-K101 PolarHBondContact O-N 2.82Å; L99-K101 PolarHBondContact O-N 3.35Å; K101-Q104 PolarHBondContact O-N 3.36Å; K101-W105 WeakPolarHBondContact O-CB 3.28Å; K101-W105 PolarHBondContact O-N 2.98Å
102	C	89.6	Confident	81.6	Confident	14 Å²	14	51.7 Å²	51.7	10%	0.095	27%	0.274	C	S	.	.	H	α-helix	trans	-61.1	-46.9	175.9	176.5	0	0	0	0	111.4	A31 S98 L99 Q104 W105 A106	A31-C102 VanDerWaalsContact CB-SG 3.59Å; S98-C102 WeakPolarHBondContact O-CB 3.39Å; S98-C102 PolarHBondContact O-N 3.3Å; L99-C102 WeakPolarHBondContact O-CB 3.3Å; L99-C102 PolarHBondContact O-N 3.49Å; C102-Q104 PolarHBondContact O-N 2.91Å; C102-W105 PolarHBondContact O-N 3.13Å; C102-A106 WeakPolarHBondContact O-CB 3.49Å; C102-A106 PolarHBondContact O-N 2.9Å
103	V	91.7	Very high	83.9	Confident	2 Å²	2	46.2 Å²	46.2	1%	0.012	25%	0.246	C	C	.	.	H	α-helix	trans	-64.2	-39.5	178	174	0	0	0	0	111.6	L33 L99 S100 W105 F109 I131 V134 H135	L33-V103 HydrophobicContact CD1-CG2 4.41Å; L99-V103 HydrophobicContact CD1-CG2 4.19Å; L99-V103 HydrophobicContact CG-CG2 4.37Å; L99-V103 VanDerWaalsContact O-CG2 3.29Å; L99-V103 WeakPolarHBondContact O-CG2 3.48Å; L99-V103 PolarHBondContact O-N 2.86Å; S100-V103 PolarHBondContact O-N 3.25Å; V103-W105 VanDerWaalsContact C-N 3.33Å; V103-W105 PolarHBondContact O-N 2.93Å; V103-F109 HydrophobicContact CB-CE1 4.37Å; V103-F109 HydrophobicContact CG1-CE1 4.28Å; V103-F109 HydrophobicContact CG1-CZ 4.13Å; V103-F109 HydrophobicContact CG2-CE1 4.26Å; V103-I131 HydrophobicContact CG1-CB 4.46Å; V103-I131 HydrophobicContact CG1-CG1 4.34Å; V103-I131 HydrophobicContact CG2-CG1 4.25Å; V103-V134 HydrophobicContact CB-CG2 4.4Å; V103-V134 HydrophobicContact CG1-CB 3.6Å; V103-V134 HydrophobicContact CG1-CG1 4Å; V103-V134 HydrophobicContact CG1-CG2 3.72Å; V103-H135 PolarHBondContact O-NE2 3.48Å
104	Q	92.1	Very high	86.1	Confident	131 Å²	131	42.5 Å²	42.5	61%	0.612	22%	0.22	S	C	*	.	H	α-helix	trans	-65.7	-34.4	175.3	-75.6	173.2	-28	0	0	113	S100 K101 C102 V134	S100-Q104 WeakPolarHBondContact O-CB 3.48Å; S100-Q104 VanDerWaalsContact O-CG 3.26Å; S100-Q104 WeakPolarHBondContact O-CG 3.3Å; S100-Q104 PolarHBondContact O-N 3.37Å; K101-Q104 PolarHBondContact O-N 3.36Å; C102-Q104 PolarHBondContact O-N 2.91Å; Q104-V134 HydrophobicContact CB-CG1 4.34Å; Q104-V134 HydrophobicContact CG-CG1 3.58Å; Q104-V134 HydrophobicContact CG-CG2 4.45Å
105	W	93.5	Very high	88.2	Confident	69 Å²	69	36.4 Å²	36.4	26%	0.261	19%	0.191	S	C	.	.	H	α-helix	trans	-78.6	-36.9	-178.4	168.4	90.8	0	0	0	113.1	K29 L30 L63 Q78 Q80 K101 C102 V103	K29-W105 HydrophobicContact CB-CD2 4.3Å; K29-W105 HydrophobicContact CB-CE3 4.28Å; K29-W105 HydrophobicContact CB-CH2 3.8Å; K29-W105 HydrophobicContact CB-CZ2 3.83Å; K29-W105 HydrophobicContact CB-CZ3 4.03Å; K29-W105 HydrophobicContact CD-CD2 4.21Å; K29-W105 HydrophobicContact CD-CG 4.46Å; K29-W105 HydrophobicContact CD-CZ2 4.02Å; K29-W105 WeakPolarHBondContact CD-O 3.23Å; K29-W105 HydrophobicContact CG-CH2 4.13Å; K29-W105 HydrophobicContact CG-CZ2 3.65Å; L30-W105 WeakPolarHBondContact O-CZ3 3.17Å; L63-W105 HydrophobicContact CD1-CH2 3.71Å; L63-W105 HydrophobicContact CD1-CZ2 3.8Å; Q78-W105 HydrophobicContact CB-CH2 3.89Å; Q78-W105 HydrophobicContact CB-CZ2 3.77Å; Q80-W105 HydrophobicContact CB-CE3 4.22Å; Q80-W105 HydrophobicContact CB-CH2 4.12Å; Q80-W105 HydrophobicContact CB-CZ3 3.54Å; K101-W105 WeakPolarHBondContact O-CB 3.28Å; K101-W105 PolarHBondContact O-N 2.98Å; C102-W105 PolarHBondContact O-N 3.13Å; V103-W105 VanDerWaalsContact C-N 3.33Å; V103-W105 PolarHBondContact O-N 2.93Å
106	A	95.7	Very high	90.3	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.008	18%	0.179	C	C	.	.			trans	-79.5	149.1	-175.2	0	0	0	0	0	112.9	A31 C102 F109 H135	A31-A106 HydrophobicContact CB-CB 3.61Å; C102-A106 WeakPolarHBondContact O-CB 3.49Å; C102-A106 PolarHBondContact O-N 2.9Å; A106-F109 HydrophobicContact CB-CD1 4.35Å; A106-F109 HydrophobicContact CB-CE1 3.6Å; A106-F109 HydrophobicContact CB-CZ 3.72Å; A106-H135 PolarHBondContact O-NE2 3.35Å
107	E	95.5	Very high	92.1	Very high	56 Å²	56	33.6 Å²	33.6	26%	0.262	17%	0.173	S	C	.	.	S	Bend	trans	-109.4	-18.8	179.2	-61.2	178.2	128	0	0	112.2	K29 P141 V196 H200	K29-E107 HydrophobicContact CB-CG 4.34Å; K29-E107 PolarHBondContact O-N 3.05Å; E107-P141 WeakPolarHBondContact O-CD 3.48Å; E107-V196 HydrophobicContact CB-CG1 3.81Å; E107-H200 IonicContact OE1-CD2 2.85Å; E107-H200 IonicContact OE1-CE1 3.21Å; E107-H200 IonicContact OE1-NE2 3Å; E107-H200 PolarHBondContact OE1-NE2 3.07Å; E107-H200 IonicContact OE2-CE1 3.92Å; E107-H200 PolarHBondContact OE2-CE1 3.37Å; E107-H200 IonicContact OE2-NE2 4Å; E107-H200 PolarHBondContact OE2-NE2 3.34Å
108	G	97.6	Very high	93.5	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	151.2	174.3	0	0	0	0	0	112	K29 L30 A31	K29-G108 PolarHBondContact O-N 3Å; L30-G108 WeakPolarHBondContact CA-O 3.39Å; A31-G108 PolarHBondContact N-O 2.85Å
109	F	98.1	Very high	94.6	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	135.4	-168	-59.4	-87.2	0	0	0	113.1	A31 L33 V103 A106 I131 H135 A140 P141 V142 I143	A31-F109 HydrophobicContact CB-CD1 3.93Å; A31-F109 HydrophobicContact CB-CE1 4.08Å; A31-F109 WeakPolarHBondContact O-CA 3.49Å; L33-F109 HydrophobicContact CD1-CD1 4.15Å; V103-F109 HydrophobicContact CB-CE1 4.37Å; V103-F109 HydrophobicContact CG1-CE1 4.28Å; V103-F109 HydrophobicContact CG1-CZ 4.13Å; V103-F109 HydrophobicContact CG2-CE1 4.26Å; A106-F109 HydrophobicContact CB-CD1 4.35Å; A106-F109 HydrophobicContact CB-CE1 3.6Å; A106-F109 HydrophobicContact CB-CZ 3.72Å; F109-I131 HydrophobicContact CB-CD1 3.72Å; F109-I131 HydrophobicContact CD1-CD1 3.7Å; F109-I131 HydrophobicContact CD1-CG1 3.89Å; F109-I131 HydrophobicContact CD2-CD1 4.24Å; F109-I131 HydrophobicContact CD2-CG1 4.47Å; F109-I131 HydrophobicContact CD2-CG2 3.75Å; F109-I131 HydrophobicContact CE1-CD1 4.41Å; F109-I131 HydrophobicContact CE1-CG1 4.1Å; F109-I131 HydrophobicContact CE2-CG2 3.73Å; F109-I131 HydrophobicContact CG-CD1 3.6Å; F109-I131 HydrophobicContact CG-CG1 4.1Å; F109-I131 HydrophobicContact CG-CG2 4.22Å; F109-I131 HydrophobicContact CZ-CG1 4.48Å; F109-I131 HydrophobicContact CZ-CG2 4.16Å; F109-H135 AromaticContact CE2-CD2 3.95Å; F109-H135 AromaticContact CZ-CD2 3.91Å; F109-H135 AromaticContact CZ-NE2 3.78Å; F109-A140 HydrophobicContact CD2-CB 4.16Å; F109-A140 HydrophobicContact CE2-CB 3.79Å; F109-P141 PolarHBondContact N-O 3.01Å; F109-V142 HydrophobicContact CB-CG1 4.29Å; F109-V142 HydrophobicContact CB-CG2 4.18Å; F109-V142 HydrophobicContact CD2-CG2 4.32Å; F109-V142 WeakPolarHBondContact O-CA 3.49Å; F109-I143 PolarHBondContact O-N 3.38Å
110	L	98.5	Very high	95.3	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	123.9	164	-60.3	-178.5	0	0	0	109	A31 V32 L33 M43 V112 I143 V145 V188 F189 L192	A31-L110 PolarHBondContact O-N 3.37Å; V32-L110 HydrophobicContact CG1-CB 4.21Å; V32-L110 HydrophobicContact CG2-CB 4.36Å; V32-L110 HydrophobicContact CG2-CD1 4.12Å; L33-L110 PolarHBondContact N-O 3.46Å; M43-L110 HydrophobicContact CE-CB 4.48Å; M43-L110 HydrophobicContact CE-CD1 3.39Å; L110-V112 HydrophobicContact CB-CG2 4.27Å; L110-I143 WeakPolarHBondContact CA-O 3.34Å; L110-I143 HydrophobicContact CD2-CB 3.74Å; L110-I143 HydrophobicContact CD2-CD1 4.09Å; L110-I143 HydrophobicContact CD2-CG1 4.3Å; L110-I143 HydrophobicContact CD2-CG2 4.4Å; L110-V145 HydrophobicContact CD2-CG2 4.46Å; L110-V188 HydrophobicContact CD1-CG1 3.95Å; L110-V188 HydrophobicContact CD2-CG1 3.6Å; L110-V188 HydrophobicContact CG-CG1 4.46Å; L110-F189 HydrophobicContact CD1-CD1 3.89Å; L110-F189 HydrophobicContact CD1-CE1 3.47Å; L110-F189 VanDerWaalsContact CD1-CE1 3.47Å; L110-F189 HydrophobicContact CD1-CE2 4.29Å; L110-F189 HydrophobicContact CD1-CG 4.45Å; L110-F189 HydrophobicContact CD1-CZ 3.69Å; L110-L192 HydrophobicContact CD1-CD2 4.47Å; L110-L192 HydrophobicContact CD2-CD2 3.53Å; L110-L192 HydrophobicContact CG-CD2 3.64Å
111	L	98.1	Very high	96.1	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	103	171.3	-62.4	-175.3	0	0	0	108.8	L33 V124 L127 Y128 I131 V142 I143 I144 V145	L33-L111 HydrophobicContact CB-CD2 3.87Å; L33-L111 HydrophobicContact CD1-CD2 4.09Å; L33-L111 HydrophobicContact CG-CD2 4.45Å; L111-V124 HydrophobicContact CB-CG1 4.09Å; L111-V124 HydrophobicContact CD1-CG1 3.85Å; L111-L127 HydrophobicContact CD2-CB 3.86Å; L111-L127 HydrophobicContact CD2-CD1 4.42Å; L111-Y128 HydrophobicContact CD1-CD2 4.11Å; L111-Y128 HydrophobicContact CD1-CG 4.48Å; L111-I131 HydrophobicContact CD1-CD1 4.44Å; L111-I131 HydrophobicContact CD2-CD1 3.82Å; L111-I131 HydrophobicContact CG-CD1 4.36Å; L111-V142 HydrophobicContact CD1-CG1 3.74Å; L111-V142 HydrophobicContact CG-CG1 3.79Å; L111-I143 PolarHBondContact N-O 2.95Å; L111-I144 WeakPolarHBondContact O-CA 3.32Å; L111-V145 PolarHBondContact O-N 2.66Å
112	V	98.4	Very high	96.6	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	128.6	-172.7	-170.3	0	0	0	0	110.3	V32 L33 G34 V38 K40 M43 L110 V145 N147	V32-V112 HydrophobicContact CG1-CG2 3.63Å; L33-V112 PolarHBondContact O-N 3.24Å; G34-V112 WeakPolarHBondContact CA-O 3.38Å; V38-V112 HydrophobicContact CB-CG1 4.42Å; V38-V112 HydrophobicContact CG2-CB 4.14Å; V38-V112 HydrophobicContact CG2-CG1 3.97Å; K40-V112 HydrophobicContact CG-CB 4.26Å; M43-V112 HydrophobicContact CE-CG2 3.83Å; M43-V112 HydrophobicContact SD-CG2 4.31Å; L110-V112 HydrophobicContact CB-CG2 4.27Å; V112-V145 WeakPolarHBondContact CA-O 3.44Å; V112-V145 HydrophobicContact CG1-CB 4.48Å; V112-V145 HydrophobicContact CG2-CB 4.27Å; V112-N147 HydrophobicContact CG1-CB 3.94Å
113	Y	98.5	Very high	96.8	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	168.1	167.2	72.8	-90.2	0	0	0	110.3	I115 Y121 V124 I144 V145 G146 N147 V157 F173	Y113-I115 HydrophobicContact CE2-CG2 4.25Å; Y113-Y121 HydrophobicContact CD1-CD2 4.32Å; Y113-Y121 HydrophobicContact CD2-CD2 4.27Å; Y113-Y121 HydrophobicContact CE1-CD2 4.1Å; Y113-Y121 HydrophobicContact CE2-CD2 4.08Å; Y113-Y121 HydrophobicContact CG-CD2 4.4Å; Y113-Y121 AromaticContact CZ-CD2 3.98Å; Y113-V124 HydrophobicContact CD1-CG2 3.92Å; Y113-V124 HydrophobicContact CG-CG2 4.35Å; Y113-I144 HydrophobicContact CD1-CG2 4.13Å; Y113-I144 HydrophobicContact CE1-CG2 3.86Å; Y113-V145 WeakPolarHBondContact CD1-O 3.35Å; Y113-V145 PolarHBondContact N-O 2.9Å; Y113-G146 VanDerWaalsContact CZ-CA 3.49Å; Y113-N147 WeakPolarHBondContact O-CB 3.08Å; Y113-N147 PolarHBondContact O-N 3.03Å; Y113-V157 HydrophobicContact CE2-CB 4.09Å; Y113-V157 HydrophobicContact CE2-CG1 3.82Å; Y113-V157 HydrophobicContact CE2-CG2 4.32Å; Y113-F173 AromaticContact CE1-CE2 3.93Å; Y113-F173 HydrophobicContact CE1-CE2 3.93Å; Y113-F173 AromaticContact CZ-CE2 4Å; Y113-F173 VanDerWaalsContact OH-CE2 3.27Å; Y113-F173 WeakPolarHBondContact OH-CE2 3.29Å; Y113-F173 WeakPolarHBondContact OH-CZ 3.41Å
114	S	98.4	Very high	97.1	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	129.8	175.7	-176.6	0	0	0	0	109.2	T116 D117 S120 K148	S114-T116 PolarHBondContact O-N 3.28Å; S114-T116 PolarHBondContact OG-OG1 2.98Å; S114-D117 PolarHBondContact O-N 2.72Å; S114-S120 PolarHBondContact N-OG 3.14Å; S114-S120 PolarHBondContact O-OG 2.82Å; S114-K148 WeakPolarHBondContact OG-CD 3.33Å; S114-K148 VanDerWaalsContact OG-CE 3.24Å; S114-K148 WeakPolarHBondContact OG-CE 3.29Å; S114-K148 PolarHBondContact OG-NZ 3.17Å
115	I	98.8	Very high	97.3	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-17.2	177.7	65.8	156.7	0	0	0	112.7	Y113 N147 K148 R155 Q156 V157 E175	Y113-I115 HydrophobicContact CE2-CG2 4.25Å; I115-N147 PolarHBondContact N-O 3.21Å; I115-K148 VanDerWaalsContact CD1-O 3.29Å; I115-K148 WeakPolarHBondContact CD1-O 3.5Å; I115-K148 VanDerWaalsContact CG1-O 3.26Å; I115-K148 WeakPolarHBondContact CG1-O 3.37Å; I115-R155 HydrophobicContact CD1-CB 4.4Å; I115-R155 HydrophobicContact CD1-CG 4.38Å; I115-Q156 PolarHBondContact O-N 3.32Å; I115-V157 PolarHBondContact O-N 2.77Å; I115-E175 HydrophobicContact CG2-CG 4Å
116	T	98.5	Very high	97.3	Very high	25 Å²	25	33.5 Å²	33.5	15%	0.153	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	5.9	178.5	73.1	0	0	0	0	114.1	S114 L151 A154 Q156	S114-T116 PolarHBondContact O-N 3.28Å; S114-T116 PolarHBondContact OG-OG1 2.98Å; T116-L151 HydrophobicContact CG2-CB 3.53Å; T116-L151 HydrophobicContact CG2-CD1 3.92Å; T116-L151 HydrophobicContact CG2-CG 4.37Å; T116-A154 VanDerWaalsContact CA-O 3.29Å; T116-A154 WeakPolarHBondContact CA-O 3.33Å; T116-A154 WeakPolarHBondContact CB-O 3.35Å; T116-A154 HydrophobicContact CG2-CB 3.87Å; T116-Q156 PolarHBondContact O-NE2 2.94Å; T116-Q156 VanDerWaalsContact O-NE2 3.07Å
117	D	98.1	Very high	97.3	Very high	52 Å²	52	33.7 Å²	33.7	28%	0.278	16%	0.161	S	C	.	.			trans	-144.7	100.4	-175.1	176.8	-4.6	0	0	0	109.6	S114 E119 S120 Y121	S114-D117 PolarHBondContact O-N 2.72Å; D117-E119 VanDerWaalsContact C-N 3.34Å; D117-E119 PolarHBondContact O-N 2.93Å; D117-E119 PolarHBondContact OD1-N 3.12Å; D117-E119 VanDerWaalsContact OD1-N 3.08Å; D117-S120 WeakPolarHBondContact O-CB 3.49Å; D117-S120 PolarHBondContact O-N 2.87Å; D117-S120 PolarHBondContact O-OG 2.57Å; D117-S120 PolarHBondContact OD1-N 3.1Å; D117-S120 VanDerWaalsContact OD1-N 3.11Å; D117-Y121 PolarHBondContact O-N 3.01Å
118	Y	97.9	Very high	97.3	Very high	91 Å²	91	32.6 Å²	32.6	36%	0.357	16%	0.155	S	C	.	.	H	α-helix	trans	-65.1	-33.6	-178.2	-171.9	-98.4	0	0	0	113.2	S120 Y121 Q122 V157	Y118-S120 VanDerWaalsContact C-N 3.28Å; Y118-S120 PolarHBondContact O-N 3.26Å; Y118-Y121 HydrophobicContact CD2-CD1 4.25Å; Y118-Y121 AromaticContact CE2-CD1 3.94Å; Y118-Y121 HydrophobicContact CE2-CD1 3.94Å; Y118-Y121 HydrophobicContact CE2-CE1 4.21Å; Y118-Y121 WeakPolarHBondContact O-CB 3.35Å; Y118-Y121 PolarHBondContact O-N 3.45Å; Y118-Y121 VanDerWaalsContact O-N 3.15Å; Y118-Q122 HydrophobicContact CD1-CG 3.99Å; Y118-Q122 VanDerWaalsContact CE1-CD 3.43Å; Y118-Q122 HydrophobicContact CE1-CG 3.69Å; Y118-Q122 WeakPolarHBondContact O-CG 3.27Å; Y118-Q122 PolarHBondContact O-N 3.42Å; Y118-V157 HydrophobicContact CD2-CG2 3.96Å
119	E	96.5	Very high	97.1	Very high	134 Å²	134	37.1 Å²	37.1	63%	0.626	18%	0.176	S	C	*	.	H	α-helix	trans	-64.6	-37.7	176.6	-66.3	-170.9	173.4	0	0	111	D117 Y121 Q122 S123	D117-E119 VanDerWaalsContact C-N 3.34Å; D117-E119 PolarHBondContact O-N 2.93Å; D117-E119 PolarHBondContact OD1-N 3.12Å; D117-E119 VanDerWaalsContact OD1-N 3.08Å; E119-Y121 VanDerWaalsContact C-N 3.27Å; E119-Y121 PolarHBondContact O-N 3.12Å; E119-Q122 PolarHBondContact O-N 2.96Å; E119-S123 PolarHBondContact O-N 3.5Å; E119-S123 VanDerWaalsContact O-N 3.12Å
120	S	97.1	Very high	96.8	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-60.7	-37.6	174.7	80.7	0	0	0	0	112.5	S114 D117 Y118 S123	S114-S120 PolarHBondContact N-OG 3.14Å; S114-S120 PolarHBondContact O-OG 2.82Å; D117-S120 WeakPolarHBondContact O-CB 3.49Å; D117-S120 PolarHBondContact O-N 2.87Å; D117-S120 PolarHBondContact O-OG 2.57Å; D117-S120 PolarHBondContact OD1-N 3.1Å; D117-S120 VanDerWaalsContact OD1-N 3.11Å; Y118-S120 VanDerWaalsContact C-N 3.28Å; Y118-S120 PolarHBondContact O-N 3.26Å; S120-S123 PolarHBondContact O-N 2.7Å; S120-S123 PolarHBondContact O-OG 2.77Å
121	Y	98.4	Very high	96.6	Very high	32 Å²	32	40 Å²	40	13%	0.125	19%	0.19	C	C	.	.	H	α-helix	trans	-66.8	-43.6	174.7	164.1	-101.8	0	0	0	111.8	Y113 D117 Y118 E119 S123 V124 V157 E161 L165	Y113-Y121 HydrophobicContact CD1-CD2 4.32Å; Y113-Y121 HydrophobicContact CD2-CD2 4.27Å; Y113-Y121 HydrophobicContact CE1-CD2 4.1Å; Y113-Y121 HydrophobicContact CE2-CD2 4.08Å; Y113-Y121 HydrophobicContact CG-CD2 4.4Å; Y113-Y121 AromaticContact CZ-CD2 3.98Å; D117-Y121 PolarHBondContact O-N 3.01Å; Y118-Y121 HydrophobicContact CD2-CD1 4.25Å; Y118-Y121 AromaticContact CE2-CD1 3.94Å; Y118-Y121 HydrophobicContact CE2-CD1 3.94Å; Y118-Y121 HydrophobicContact CE2-CE1 4.21Å; Y118-Y121 WeakPolarHBondContact O-CB 3.35Å; Y118-Y121 PolarHBondContact O-N 3.45Å; Y118-Y121 VanDerWaalsContact O-N 3.15Å; E119-Y121 VanDerWaalsContact C-N 3.27Å; E119-Y121 PolarHBondContact O-N 3.12Å; Y121-S123 PolarHBondContact O-N 3.5Å; Y121-S123 VanDerWaalsContact O-N 3.16Å; Y121-V124 WeakPolarHBondContact O-CB 3.27Å; Y121-V124 WeakPolarHBondContact O-CG2 3.48Å; Y121-V124 PolarHBondContact O-N 3.26Å; Y121-V124 VanDerWaalsContact O-N 3.07Å; Y121-V157 HydrophobicContact CD1-CG1 4.39Å; Y121-V157 HydrophobicContact CD1-CG2 4.5Å; Y121-V157 HydrophobicContact CD2-CG1 3.88Å; Y121-V157 HydrophobicContact CE2-CG1 4.25Å; Y121-V157 HydrophobicContact CG-CG1 3.96Å; Y121-V157 HydrophobicContact CG-CG2 4.1Å; Y121-E161 PolarHBondContact OH-O 2.93Å; Y121-L165 HydrophobicContact CD2-CD2 4.03Å; Y121-L165 HydrophobicContact CE2-CB 4.05Å; Y121-L165 HydrophobicContact CE2-CD2 3.42Å; Y121-L165 VanDerWaalsContact CE2-CD2 3.42Å; Y121-L165 HydrophobicContact CE2-CG 4.34Å
122	Q	97.1	Very high	96.4	Very high	108 Å²	108	42.3 Å²	42.3	51%	0.505	20%	0.198	S	C	.	.	H	α-helix	trans	-60	-28.4	176.6	-68.1	-177.1	-55.1	0	0	112.8	Y118 E119 V124 P126	Y118-Q122 HydrophobicContact CD1-CG 3.99Å; Y118-Q122 VanDerWaalsContact CE1-CD 3.43Å; Y118-Q122 HydrophobicContact CE1-CG 3.69Å; Y118-Q122 WeakPolarHBondContact O-CG 3.27Å; Y118-Q122 PolarHBondContact O-N 3.42Å; E119-Q122 PolarHBondContact O-N 2.96Å; Q122-V124 VanDerWaalsContact C-N 3.26Å; Q122-V124 PolarHBondContact O-N 3.37Å; Q122-P126 WeakPolarHBondContact O-CD 3.38Å
123	S	94.9	Very high	96.1	Very high	30 Å²	30	49 Å²	49	21%	0.21	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-17.1	178	81.5	0	0	0	0	114.6	E119 S120 Y121 R125 P126 L127	E119-S123 PolarHBondContact O-N 3.5Å; E119-S123 VanDerWaalsContact O-N 3.12Å; S120-S123 PolarHBondContact O-N 2.7Å; S120-S123 PolarHBondContact O-OG 2.77Å; Y121-S123 PolarHBondContact O-N 3.5Å; Y121-S123 VanDerWaalsContact O-N 3.16Å; S123-R125 PolarHBondContact O-N 3.04Å; S123-P126 WeakPolarHBondContact O-CD 3.36Å; S123-L127 VanDerWaalsContact O-CG 3.3Å; S123-L127 WeakPolarHBondContact O-CG 3.3Å; S123-L127 PolarHBondContact O-N 2.9Å
124	V	96.9	Very high	95.8	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.006	24%	0.242	C	C	.	.	H	α-helix	trans	-63.6	-44.4	-177	174.9	0	0	0	0	111.6	L111 Y113 Y121 Q122 L127 Y128 I144 L165	L111-V124 HydrophobicContact CB-CG1 4.09Å; L111-V124 HydrophobicContact CD1-CG1 3.85Å; Y113-V124 HydrophobicContact CD1-CG2 3.92Å; Y113-V124 HydrophobicContact CG-CG2 4.35Å; Y121-V124 WeakPolarHBondContact O-CB 3.27Å; Y121-V124 WeakPolarHBondContact O-CG2 3.48Å; Y121-V124 PolarHBondContact O-N 3.26Å; Y121-V124 VanDerWaalsContact O-N 3.07Å; Q122-V124 VanDerWaalsContact C-N 3.26Å; Q122-V124 PolarHBondContact O-N 3.37Å; V124-L127 PolarHBondContact O-N 3.23Å; V124-Y128 WeakPolarHBondContact O-CB 3.15Å; V124-Y128 PolarHBondContact O-N 2.93Å; V124-I144 HydrophobicContact CG1-CD1 4.07Å; V124-I144 HydrophobicContact CG1-CG1 4.3Å; V124-I144 HydrophobicContact CG1-CG2 4.18Å; V124-L165 HydrophobicContact CB-CD2 3.9Å; V124-L165 HydrophobicContact CG1-CD2 3.71Å
125	R	96.8	Very high	95.3	Very high	106 Å²	106	53.2 Å²	53.2	40%	0.4	25%	0.25	S	S	.	.	H	α-helix	trans	-65.9	-47.1	-176.9	-168.3	-178	-160.7	99.4	-3.7	112.6	S123 L127 Y128 Q129 E168 L169	S123-R125 PolarHBondContact O-N 3.04Å; R125-L127 VanDerWaalsContact C-N 3.34Å; R125-L127 PolarHBondContact O-N 2.76Å; R125-Y128 PolarHBondContact O-N 2.86Å; R125-Q129 WeakPolarHBondContact O-CG 3.38Å; R125-Q129 PolarHBondContact O-N 3.23Å; R125-E168 IonicContact CZ-OE2 3.5Å; R125-E168 IonicContact NH1-OE2 3.54Å; R125-E168 PolarHBondContact NH1-OE2 2.9Å; R125-E168 IonicContact NH2-OE2 2.89Å; R125-L169 HydrophobicContact CG-CD2 4.49Å
126	P	94.5	Very high	94.7	Very high	67 Å²	67	58.3 Å²	58.3	44%	0.435	28%	0.283	S	S	.	.	H	α-helix	trans	-56.7	-43.7	171.3	-26.5	34.1	0	0	0	113.4	Q122 S123 Q129 Q130	Q122-P126 WeakPolarHBondContact O-CD 3.38Å; S123-P126 WeakPolarHBondContact O-CD 3.36Å; P126-Q129 PolarHBondContact O-N 2.62Å; P126-Q130 WeakPolarHBondContact O-CG 3.42Å; P126-Q130 PolarHBondContact O-N 2.88Å; P126-Q130 VanDerWaalsContact O-N 3.11Å
127	L	94.3	Very high	94.1	Very high	6 Å²	6	61.4 Å²	61.4	3%	0.031	30%	0.299	C	S	.	.	H	α-helix	trans	-61.4	-46.3	178	-75.5	169.8	0	0	0	111.9	L33 I86 L99 L111 S123 V124 R125 Q129 Q130 I131	L33-L127 HydrophobicContact CB-CD1 4.27Å; L33-L127 HydrophobicContact CB-CD2 4.33Å; I86-L127 HydrophobicContact CD1-CD2 3.45Å; I86-L127 VanDerWaalsContact CD1-CD2 3.45Å; I86-L127 HydrophobicContact CD1-CG 4.26Å; L99-L127 HydrophobicContact CD1-CD2 4.36Å; L99-L127 HydrophobicContact CD2-CD2 4.1Å; L111-L127 HydrophobicContact CD2-CB 3.86Å; L111-L127 HydrophobicContact CD2-CD1 4.42Å; S123-L127 VanDerWaalsContact O-CG 3.3Å; S123-L127 WeakPolarHBondContact O-CG 3.3Å; S123-L127 PolarHBondContact O-N 2.9Å; V124-L127 PolarHBondContact O-N 3.23Å; R125-L127 VanDerWaalsContact C-N 3.34Å; R125-L127 PolarHBondContact O-N 2.76Å; L127-Q129 VanDerWaalsContact C-N 3.31Å; L127-Q129 PolarHBondContact O-N 3.36Å; L127-Q130 WeakPolarHBondContact O-CB 3.46Å; L127-Q130 PolarHBondContact O-N 3.01Å; L127-Q130 VanDerWaalsContact O-N 3.13Å; L127-I131 PolarHBondContact O-N 3.33Å; L127-I131 VanDerWaalsContact O-N 3.08Å
128	Y	95.9	Very high	93.2	Very high	32 Å²	32	60.9 Å²	60.9	13%	0.125	31%	0.306	C	S	.	.	H	α-helix	trans	-57.6	-44	175.8	-177.4	-89.2	0	0	0	112	L111 V124 R125 Q130 I131 R132 V142 L169 S171	L111-Y128 HydrophobicContact CD1-CD2 4.11Å; L111-Y128 HydrophobicContact CD1-CG 4.48Å; V124-Y128 WeakPolarHBondContact O-CB 3.15Å; V124-Y128 PolarHBondContact O-N 2.93Å; R125-Y128 PolarHBondContact O-N 2.86Å; Y128-Q130 VanDerWaalsContact C-N 3.29Å; Y128-Q130 PolarHBondContact O-N 2.82Å; Y128-I131 WeakPolarHBondContact O-CB 3.23Å; Y128-I131 PolarHBondContact O-N 3.2Å; Y128-I131 VanDerWaalsContact O-N 3.14Å; Y128-R132 HydrophobicContact CD1-CG 3.95Å; Y128-R132 HydrophobicContact CE1-CG 3.42Å; Y128-R132 VanDerWaalsContact CE1-CG 3.42Å; Y128-R132 VanDerWaalsContact CZ-NE 3.31Å; Y128-R132 PolarHBondContact O-N 3Å; Y128-R132 PolarHBondContact OH-NE 3.1Å; Y128-R132 PolarHBondContact OH-NH2 2.79Å; Y128-V142 HydrophobicContact CD2-CB 4.47Å; Y128-V142 HydrophobicContact CD2-CG1 4.07Å; Y128-V142 HydrophobicContact CD2-CG2 4.45Å; Y128-V142 HydrophobicContact CE2-CB 4.25Å; Y128-V142 HydrophobicContact CE2-CG1 4.33Å; Y128-V142 HydrophobicContact CE2-CG2 4.19Å; Y128-L169 HydrophobicContact CD1-CB 4.43Å; Y128-L169 HydrophobicContact CD1-CD1 4.2Å; Y128-L169 HydrophobicContact CD1-CD2 3.86Å; Y128-L169 HydrophobicContact CD1-CG 4.38Å; Y128-L169 HydrophobicContact CD2-CB 4.18Å; Y128-L169 HydrophobicContact CD2-CD1 4Å; Y128-L169 HydrophobicContact CE1-CB 4.21Å; Y128-L169 HydrophobicContact CE1-CD2 4.07Å; Y128-L169 HydrophobicContact CE2-CB 3.95Å; Y128-L169 HydrophobicContact CG-CB 4.42Å; Y128-L169 HydrophobicContact CG-CD1 3.78Å; Y128-L169 HydrophobicContact CG-CD2 4.3Å; Y128-L169 HydrophobicContact CG-CG 4.39Å; Y128-L169 VanDerWaalsContact CZ-O 3.23Å; Y128-L169 PolarHBondContact OH-O 3.44Å; Y128-S171 WeakPolarHBondContact CE2-OG 3.41Å
129	Q	93.9	Very high	92.5	Very high	95 Å²	95	61.9 Å²	61.9	44%	0.444	31%	0.312	S	S	.	.	H	α-helix	trans	-61.3	-37.7	177.1	-71.3	170.5	-7.6	0	0	112	R125 P126 L127 R132 K133	R125-Q129 WeakPolarHBondContact O-CG 3.38Å; R125-Q129 PolarHBondContact O-N 3.23Å; P126-Q129 PolarHBondContact O-N 2.62Å; L127-Q129 VanDerWaalsContact C-N 3.31Å; L127-Q129 PolarHBondContact O-N 3.36Å; Q129-R132 PolarHBondContact O-N 3.34Å; Q129-K133 VanDerWaalsContact O-CG 3.31Å; Q129-K133 WeakPolarHBondContact O-CG 3.42Å; Q129-K133 PolarHBondContact O-N 3.23Å
130	Q	91.7	Very high	92.3	Very high	61 Å²	61	55.8 Å²	55.8	29%	0.285	29%	0.285	S	S	.	.	H	α-helix	trans	-65.1	-40.1	174.5	-62.7	-59.8	-27.4	0	0	111.8	L99 P126 L127 Y128 R132 K133 V134	L99-Q130 HydrophobicContact CD2-CG 4.36Å; P126-Q130 WeakPolarHBondContact O-CG 3.42Å; P126-Q130 PolarHBondContact O-N 2.88Å; P126-Q130 VanDerWaalsContact O-N 3.11Å; L127-Q130 WeakPolarHBondContact O-CB 3.46Å; L127-Q130 PolarHBondContact O-N 3.01Å; L127-Q130 VanDerWaalsContact O-N 3.13Å; Y128-Q130 VanDerWaalsContact C-N 3.29Å; Y128-Q130 PolarHBondContact O-N 2.82Å; Q130-R132 PolarHBondContact O-N 3.28Å; Q130-K133 VanDerWaalsContact NE2-NZ 3.2Å; Q130-K133 PolarHBondContact O-N 3.37Å; Q130-V134 PolarHBondContact O-N 2.87Å
131	I	94.1	Very high	92.3	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-58.2	-49.4	173.2	-64.8	165.1	0	0	0	110.4	L33 V103 F109 L111 L127 Y128 K133 V134 H135 V142	L33-I131 HydrophobicContact CD1-CD1 4.04Å; L33-I131 HydrophobicContact CD1-CG1 4.26Å; V103-I131 HydrophobicContact CG1-CB 4.46Å; V103-I131 HydrophobicContact CG1-CG1 4.34Å; V103-I131 HydrophobicContact CG2-CG1 4.25Å; F109-I131 HydrophobicContact CB-CD1 3.72Å; F109-I131 HydrophobicContact CD1-CD1 3.7Å; F109-I131 HydrophobicContact CD1-CG1 3.89Å; F109-I131 HydrophobicContact CD2-CD1 4.24Å; F109-I131 HydrophobicContact CD2-CG1 4.47Å; F109-I131 HydrophobicContact CD2-CG2 3.75Å; F109-I131 HydrophobicContact CE1-CD1 4.41Å; F109-I131 HydrophobicContact CE1-CG1 4.1Å; F109-I131 HydrophobicContact CE2-CG2 3.73Å; F109-I131 HydrophobicContact CG-CD1 3.6Å; F109-I131 HydrophobicContact CG-CG1 4.1Å; F109-I131 HydrophobicContact CG-CG2 4.22Å; F109-I131 HydrophobicContact CZ-CG1 4.48Å; F109-I131 HydrophobicContact CZ-CG2 4.16Å; L111-I131 HydrophobicContact CD1-CD1 4.44Å; L111-I131 HydrophobicContact CD2-CD1 3.82Å; L111-I131 HydrophobicContact CG-CD1 4.36Å; L127-I131 PolarHBondContact O-N 3.33Å; L127-I131 VanDerWaalsContact O-N 3.08Å; Y128-I131 WeakPolarHBondContact O-CB 3.23Å; Y128-I131 PolarHBondContact O-N 3.2Å; Y128-I131 VanDerWaalsContact O-N 3.14Å; I131-K133 VanDerWaalsContact C-N 3.33Å; I131-K133 PolarHBondContact O-N 3.34Å; I131-V134 PolarHBondContact O-N 3.34Å; I131-V134 VanDerWaalsContact O-N 3.15Å; I131-H135 PolarHBondContact O-N 3.08Å; I131-V142 HydrophobicContact CD1-CG1 4.49Å; I131-V142 HydrophobicContact CD1-CG2 4.38Å; I131-V142 HydrophobicContact CG2-CG2 4.2Å
132	R	94.6	Very high	92.3	Very high	48 Å²	48	55.6 Å²	55.6	18%	0.181	29%	0.287	C	S	.	.	H	α-helix	trans	-71.1	-23.2	-177.3	-65.5	-58.3	178.8	-144.7	-0.8	114.5	Y128 Q129 Q130 V134 H135 P136 A140	Y128-R132 HydrophobicContact CD1-CG 3.95Å; Y128-R132 HydrophobicContact CE1-CG 3.42Å; Y128-R132 VanDerWaalsContact CE1-CG 3.42Å; Y128-R132 VanDerWaalsContact CZ-NE 3.31Å; Y128-R132 PolarHBondContact O-N 3Å; Y128-R132 PolarHBondContact OH-NE 3.1Å; Y128-R132 PolarHBondContact OH-NH2 2.79Å; Q129-R132 PolarHBondContact O-N 3.34Å; Q130-R132 PolarHBondContact O-N 3.28Å; R132-V134 VanDerWaalsContact C-N 3.3Å; R132-H135 CarbonylContact O-C 3.52Å; R132-P136 VanDerWaalsContact O-CA 3.23Å; R132-P136 WeakPolarHBondContact O-CA 3.28Å; R132-A140 PolarHBondContact NH1-O 2.96Å; R132-A140 PolarHBondContact NH2-O 3.31Å
133	K	91.8	Very high	92.4	Very high	140 Å²	140	50.6 Å²	50.6	61%	0.609	26%	0.264	S	S	*	.	H	α-helix	trans	-63.6	-37.1	169.5	-76.3	171.7	-174.2	175.3	0	112.1	Q129 Q130 I131	Q129-K133 VanDerWaalsContact O-CG 3.31Å; Q129-K133 WeakPolarHBondContact O-CG 3.42Å; Q129-K133 PolarHBondContact O-N 3.23Å; Q130-K133 VanDerWaalsContact NE2-NZ 3.2Å; Q130-K133 PolarHBondContact O-N 3.37Å; I131-K133 VanDerWaalsContact C-N 3.33Å; I131-K133 PolarHBondContact O-N 3.34Å
134	V	90.8	Very high	92.6	Very high	50 Å²	50	49.2 Å²	49.2	30%	0.303	25%	0.254	S	S	.	.	H	α-helix	trans	-89.2	-36	-178.7	178.8	0	0	0	0	112	V103 Q104 Q130 I131 R132 P136	V103-V134 HydrophobicContact CB-CG2 4.4Å; V103-V134 HydrophobicContact CG1-CB 3.6Å; V103-V134 HydrophobicContact CG1-CG1 4Å; V103-V134 HydrophobicContact CG1-CG2 3.72Å; Q104-V134 HydrophobicContact CB-CG1 4.34Å; Q104-V134 HydrophobicContact CG-CG1 3.58Å; Q104-V134 HydrophobicContact CG-CG2 4.45Å; Q130-V134 PolarHBondContact O-N 2.87Å; I131-V134 PolarHBondContact O-N 3.34Å; I131-V134 VanDerWaalsContact O-N 3.15Å; R132-V134 VanDerWaalsContact C-N 3.3Å; V134-P136 WeakPolarHBondContact O-CD 3.4Å
135	H	89.6	Confident	92.7	Very high	39 Å²	39	49.1 Å²	49.1	18%	0.181	25%	0.253	C	S	.	.			trans	-115.7	69.9	179.1	-62.1	-82.8	0	0	0	110.7	V103 A106 F109 I131 R132 D137 G138 A140	V103-H135 PolarHBondContact O-NE2 3.48Å; A106-H135 PolarHBondContact O-NE2 3.35Å; F109-H135 AromaticContact CE2-CD2 3.95Å; F109-H135 AromaticContact CZ-CD2 3.91Å; F109-H135 AromaticContact CZ-NE2 3.78Å; I131-H135 PolarHBondContact O-N 3.08Å; R132-H135 CarbonylContact O-C 3.52Å; H135-D137 VanDerWaalsContact C-N 3.3Å; H135-D137 PolarHBondContact O-N 2.88Å; H135-G138 PolarHBondContact O-N 2.94Å; H135-A140 HydrophobicContact CB-CB 4.05Å
136	P	86.4	Confident	92.8	Very high	107 Å²	107	44.1 Å²	44.1	70%	0.695	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-19.5	-171	30	-37.3	0	0	0	113.8	R132 V134 G138	R132-P136 VanDerWaalsContact O-CA 3.23Å; R132-P136 WeakPolarHBondContact O-CA 3.28Å; V134-P136 WeakPolarHBondContact O-CD 3.4Å; P136-G138 PolarHBondContact O-N 3.25Å
137	D	84.8	Confident	93	Very high	91 Å²	91	41 Å²	41	49%	0.487	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-1.1	178.8	69.7	-13.9	0	0	0	113.3	H135 K139	H135-D137 VanDerWaalsContact C-N 3.3Å; H135-D137 PolarHBondContact O-N 2.88Å; D137-K139 HydrophobicContact CB-CG 4.36Å; D137-K139 PolarHBondContact O-N 3.34Å; D137-K139 VanDerWaalsContact O-N 3.1Å; D137-K139 PolarHBondContact OD1-N 3.2Å; D137-K139 VanDerWaalsContact OD2-CD 3.29Å; D137-K139 WeakPolarHBondContact OD2-CD 3.4Å; D137-K139 WeakPolarHBondContact OD2-CE 3.46Å; D137-K139 VanDerWaalsContact OD2-CG 3.3Å; D137-K139 WeakPolarHBondContact OD2-CG 3.45Å; D137-K139 IonicContact OD2-NZ 3.56Å; D137-K139 PolarHBondContact OD2-NZ 2.67Å
138	G	78.6	Confident	93.1	Very high	40 Å²	40	43.3 Å²	43.3	41%	0.412	22%	0.224	S	C	.	.	S	Bend	trans	70.7	1.3	176.8	0	0	0	0	0	114.2	H135 P136 A140	H135-G138 PolarHBondContact O-N 2.94Å; P136-G138 PolarHBondContact O-N 3.25Å; G138-A140 PolarHBondContact O-N 3.04Å
139	K	83.9	Confident	93.2	Very high	113 Å²	113	42.6 Å²	42.6	49%	0.491	23%	0.226	S	C	.	.			trans	-71	-34.8	-171.8	-69.5	-165	-164.3	106.8	0	112.9	D137 P141 L199	D137-K139 HydrophobicContact CB-CG 4.36Å; D137-K139 PolarHBondContact O-N 3.34Å; D137-K139 VanDerWaalsContact O-N 3.1Å; D137-K139 PolarHBondContact OD1-N 3.2Å; D137-K139 VanDerWaalsContact OD2-CD 3.29Å; D137-K139 WeakPolarHBondContact OD2-CD 3.4Å; D137-K139 WeakPolarHBondContact OD2-CE 3.46Å; D137-K139 VanDerWaalsContact OD2-CG 3.3Å; D137-K139 WeakPolarHBondContact OD2-CG 3.45Å; D137-K139 IonicContact OD2-NZ 3.56Å; D137-K139 PolarHBondContact OD2-NZ 2.67Å; K139-P141 VanDerWaalsContact O-CD 3.29Å; K139-P141 WeakPolarHBondContact O-CD 3.48Å; K139-L199 HydrophobicContact CB-CD2 4.24Å; K139-L199 WeakPolarHBondContact O-CD1 3.44Å
140	A	93.3	Very high	93.4	Very high	6 Å²	6	40.2 Å²	40.2	5%	0.05	22%	0.216	C	C	.	.	S	Bend	trans	-64.3	119	179.6	0	0	0	0	0	110.4	F109 R132 H135 G138	F109-A140 HydrophobicContact CD2-CB 4.16Å; F109-A140 HydrophobicContact CE2-CB 3.79Å; R132-A140 PolarHBondContact NH1-O 2.96Å; R132-A140 PolarHBondContact NH2-O 3.31Å; H135-A140 HydrophobicContact CB-CB 4.05Å; G138-A140 PolarHBondContact O-N 3.04Å
141	P	96.9	Very high	93.7	Very high	20 Å²	20	39.8 Å²	39.8	13%	0.13	22%	0.216	C	C	.	.			trans	-68.6	139.8	-179.3	27.4	-35.4	0	0	0	110.6	E107 F109 K139 L192 E195 V196	E107-P141 WeakPolarHBondContact O-CD 3.48Å; F109-P141 PolarHBondContact N-O 3.01Å; K139-P141 VanDerWaalsContact O-CD 3.29Å; K139-P141 WeakPolarHBondContact O-CD 3.48Å; P141-L192 HydrophobicContact CB-CD1 3.82Å; P141-L192 HydrophobicContact CG-CD1 3.64Å; P141-E195 HydrophobicContact CB-CB 3.77Å; P141-E195 HydrophobicContact CB-CG 4.48Å; P141-E195 HydrophobicContact CG-CB 3.84Å; P141-V196 HydrophobicContact CG-CG2 3.66Å
142	V	98.1	Very high	93.8	Very high	8 Å²	8	45.2 Å²	45.2	5%	0.048	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	128.4	177.4	-173.2	0	0	0	0	108.3	F109 L111 Y128 I131 S171	F109-V142 HydrophobicContact CB-CG1 4.29Å; F109-V142 HydrophobicContact CB-CG2 4.18Å; F109-V142 HydrophobicContact CD2-CG2 4.32Å; F109-V142 WeakPolarHBondContact O-CA 3.49Å; L111-V142 HydrophobicContact CD1-CG1 3.74Å; L111-V142 HydrophobicContact CG-CG1 3.79Å; Y128-V142 HydrophobicContact CD2-CB 4.47Å; Y128-V142 HydrophobicContact CD2-CG1 4.07Å; Y128-V142 HydrophobicContact CD2-CG2 4.45Å; Y128-V142 HydrophobicContact CE2-CB 4.25Å; Y128-V142 HydrophobicContact CE2-CG1 4.33Å; Y128-V142 HydrophobicContact CE2-CG2 4.19Å; I131-V142 HydrophobicContact CD1-CG1 4.49Å; I131-V142 HydrophobicContact CD1-CG2 4.38Å; I131-V142 HydrophobicContact CG2-CG2 4.2Å; V142-S171 WeakPolarHBondContact O-CB 3.29Å
143	I	98.6	Very high	93.9	Very high	3 Å²	3	50.9 Å²	50.9	2%	0.015	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	132.1	172.3	-53.3	174.3	0	0	0	108.1	F109 L110 L111 V145 V172 L174 L192	F109-I143 PolarHBondContact O-N 3.38Å; L110-I143 WeakPolarHBondContact CA-O 3.34Å; L110-I143 HydrophobicContact CD2-CB 3.74Å; L110-I143 HydrophobicContact CD2-CD1 4.09Å; L110-I143 HydrophobicContact CD2-CG1 4.3Å; L110-I143 HydrophobicContact CD2-CG2 4.4Å; L111-I143 PolarHBondContact N-O 2.95Å; I143-V145 HydrophobicContact CG2-CG2 4.18Å; I143-V172 HydrophobicContact CG1-CB 4.46Å; I143-V172 HydrophobicContact CG2-CB 4.4Å; I143-L174 HydrophobicContact CG2-CD1 3.58Å; I143-L192 HydrophobicContact CD1-CB 3.77Å; I143-L192 HydrophobicContact CD1-CD1 4.28Å; I143-L192 HydrophobicContact CD1-CG 4.49Å; I143-L192 HydrophobicContact CG1-CD1 4.39Å
144	I	98.8	Very high	94.2	Very high	0 Å²	0	46 Å²	46	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	129.9	173.2	-55.2	179.4	0	0	0	108.1	L111 Y113 V124 L165 A166 L169 V172 F173 L174	L111-I144 WeakPolarHBondContact O-CA 3.32Å; Y113-I144 HydrophobicContact CD1-CG2 4.13Å; Y113-I144 HydrophobicContact CE1-CG2 3.86Å; V124-I144 HydrophobicContact CG1-CD1 4.07Å; V124-I144 HydrophobicContact CG1-CG1 4.3Å; V124-I144 HydrophobicContact CG1-CG2 4.18Å; I144-L165 HydrophobicContact CD1-CD2 4.45Å; I144-L165 HydrophobicContact CD1-CG 4.23Å; I144-A166 HydrophobicContact CD1-CB 3.91Å; I144-L169 HydrophobicContact CD1-CD1 4.01Å; I144-V172 PolarHBondContact N-O 2.9Å; I144-F173 HydrophobicContact CB-CD2 4.22Å; I144-F173 HydrophobicContact CG2-CD2 4.04Å; I144-F173 HydrophobicContact CG2-CE2 4.49Å; I144-F173 WeakPolarHBondContact O-CA 3.44Å; I144-F173 WeakPolarHBondContact O-CD2 3.43Å; I144-L174 PolarHBondContact O-N 3.11Å
145	V	98.8	Very high	94.6	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	115.6	-177.3	-175.9	0	0	0	0	109.8	M43 L110 L111 V112 Y113 I143 N147 L174 I176 V188	M43-V145 HydrophobicContact SD-CG1 4.16Å; L110-V145 HydrophobicContact CD2-CG2 4.46Å; L111-V145 PolarHBondContact O-N 2.66Å; V112-V145 WeakPolarHBondContact CA-O 3.44Å; V112-V145 HydrophobicContact CG1-CB 4.48Å; V112-V145 HydrophobicContact CG2-CB 4.27Å; Y113-V145 WeakPolarHBondContact CD1-O 3.35Å; Y113-V145 PolarHBondContact N-O 2.9Å; I143-V145 HydrophobicContact CG2-CG2 4.18Å; V145-N147 PolarHBondContact O-N 2.82Å; V145-L174 CarbonylContact C-O 3.49Å; V145-L174 VanDerWaalsContact CA-O 3.3Å; V145-L174 WeakPolarHBondContact CA-O 3.44Å; V145-I176 HydrophobicContact CG1-CD1 3.65Å; V145-I176 HydrophobicContact CG1-CG1 3.69Å; V145-V188 HydrophobicContact CG2-CG1 3.94Å
146	G	98.7	Very high	95	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	100.4	166.8	0	0	0	0	0	109.3	Y113 L174 E175 I176	Y113-G146 VanDerWaalsContact CZ-CA 3.49Å; G146-L174 PolarHBondContact N-O 3.43Å; G146-E175 CarbonylContact O-C 3.58Å; G146-E175 VanDerWaalsContact O-CA 3.27Å; G146-E175 WeakPolarHBondContact O-CA 3.49Å; G146-E175 WeakPolarHBondContact O-CG 3.29Å; G146-I176 PolarHBondContact O-N 2.91Å
147	N	98.6	Very high	95.6	Very high	3 Å²	3	44.1 Å²	44.1	2%	0.016	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	166.5	-176.2	-166.8	27.4	0	0	0	112	V38 V112 Y113 I115 V145 I176 T178	V38-N147 PolarHBondContact O-ND2 3.4Å; V112-N147 HydrophobicContact CG1-CB 3.94Å; Y113-N147 WeakPolarHBondContact O-CB 3.08Å; Y113-N147 PolarHBondContact O-N 3.03Å; I115-N147 PolarHBondContact N-O 3.21Å; V145-N147 PolarHBondContact O-N 2.82Å; N147-I176 CarbonylContact C-O 3.51Å; N147-I176 WeakPolarHBondContact CA-O 3.26Å; N147-T178 VanDerWaalsContact CG-OG1 3.31Å; N147-T178 PolarHBondContact ND2-OG1 3.14Å; N147-T178 WeakPolarHBondContact OD1-CB 3.22Å; N147-T178 PolarHBondContact OD1-N 3.38Å; N147-T178 VanDerWaalsContact OD1-N 3.17Å; N147-T178 PolarHBondContact OD1-OG1 2.97Å
148	K	97.9	Very high	96.3	Very high	54 Å²	54	44 Å²	44	24%	0.235	23%	0.232	C	C	.	.			trans	67.6	36.3	-177.9	-44	-168.8	-162.4	167.6	0	113.3	R37 S114 I115 D150 L151 I176	R37-K148 WeakPolarHBondContact O-CE 3.32Å; R37-K148 PolarHBondContact O-NZ 2.97Å; S114-K148 WeakPolarHBondContact OG-CD 3.33Å; S114-K148 VanDerWaalsContact OG-CE 3.24Å; S114-K148 WeakPolarHBondContact OG-CE 3.29Å; S114-K148 PolarHBondContact OG-NZ 3.17Å; I115-K148 VanDerWaalsContact CD1-O 3.29Å; I115-K148 WeakPolarHBondContact CD1-O 3.5Å; I115-K148 VanDerWaalsContact CG1-O 3.26Å; I115-K148 WeakPolarHBondContact CG1-O 3.37Å; K148-D150 VanDerWaalsContact C-OD1 3.24Å; K148-D150 VanDerWaalsContact CA-OD1 3.29Å; K148-D150 WeakPolarHBondContact CA-OD1 3.25Å; K148-D150 PolarHBondContact O-N 3.43Å; K148-L151 HydrophobicContact CB-CD1 4.05Å; K148-L151 HydrophobicContact CB-CG 4.27Å; K148-L151 HydrophobicContact CD-CD1 3.97Å; K148-L151 PolarHBondContact O-N 2.86Å; K148-I176 PolarHBondContact N-O 2.96Å; K148-I176 VanDerWaalsContact N-O 3.1Å
149	G	98	Very high	97.2	Very high	16 Å²	16	45.1 Å²	45.1	17%	0.165	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-22.1	176.2	0	0	0	0	0	114.5	L151 L152 I176	G149-L151 VanDerWaalsContact C-N 3.28Å; G149-L151 PolarHBondContact O-N 3.22Å; G149-L152 WeakPolarHBondContact O-CD2 3.43Å; G149-I176 PolarHBondContact N-O 3.36Å
150	D	97.6	Very high	97.9	Very high	45 Å²	45	45.5 Å²	45.5	24%	0.241	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-25.7	174	52.8	-62.4	0	0	0	113.6	K148 L152 S177 S179 E180	K148-D150 VanDerWaalsContact C-OD1 3.24Å; K148-D150 VanDerWaalsContact CA-OD1 3.29Å; K148-D150 WeakPolarHBondContact CA-OD1 3.25Å; K148-D150 PolarHBondContact O-N 3.43Å; D150-L152 VanDerWaalsContact C-N 3.3Å; D150-L152 PolarHBondContact O-N 2.84Å; D150-L152 VanDerWaalsContact O-N 3.11Å; D150-S177 VanDerWaalsContact OD1-CB 3.28Å; D150-S177 WeakPolarHBondContact OD1-CB 3.42Å; D150-S177 PolarHBondContact OD1-OG 3.4Å; D150-S179 PolarHBondContact OD1-OG 3.1Å; D150-S179 PolarHBondContact OD2-OG 2.94Å; D150-E180 HydrophobicContact CB-CG 3.8Å; D150-E180 WeakPolarHBondContact CB-OE2 3.31Å
151	L	97.1	Very high	98.1	Very high	53 Å²	53	47.1 Å²	47.1	28%	0.277	24%	0.24	S	C	.	.			trans	-91.9	50.9	-174.1	-57.5	-177.1	0	0	0	112.7	T116 K148 G149 H153 A154 R155	T116-L151 HydrophobicContact CG2-CB 3.53Å; T116-L151 HydrophobicContact CG2-CD1 3.92Å; T116-L151 HydrophobicContact CG2-CG 4.37Å; K148-L151 HydrophobicContact CB-CD1 4.05Å; K148-L151 HydrophobicContact CB-CG 4.27Å; K148-L151 HydrophobicContact CD-CD1 3.97Å; K148-L151 PolarHBondContact O-N 2.86Å; G149-L151 VanDerWaalsContact C-N 3.28Å; G149-L151 PolarHBondContact O-N 3.22Å; L151-H153 PolarHBondContact O-N 2.92Å; L151-A154 HydrophobicContact CB-CB 4.5Å; L151-A154 CarbonylContact O-C 3.47Å; L151-A154 PolarHBondContact O-N 2.82Å; L151-R155 PolarHBondContact O-N 2.83Å
152	L	97.1	Very high	98.2	Very high	113 Å²	113	46.2 Å²	46.2	59%	0.592	23%	0.234	S	C	*	.	G	3₁₀ helix	trans	-57.5	-35	-177.7	-63.1	180	0	0	0	113.5	G149 D150 A154 R155	G149-L152 WeakPolarHBondContact O-CD2 3.43Å; D150-L152 VanDerWaalsContact C-N 3.3Å; D150-L152 PolarHBondContact O-N 2.84Å; D150-L152 VanDerWaalsContact O-N 3.11Å; L152-A154 PolarHBondContact O-N 3Å; L152-R155 VanDerWaalsContact O-CB 3.27Å; L152-R155 WeakPolarHBondContact O-CB 3.39Å; L152-R155 PolarHBondContact O-N 2.95Å
153	H	97.8	Very high	98.2	Very high	167 Å²	167	50.1 Å²	50.1	77%	0.773	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-66.5	-21.7	178.5	63.4	-86.2	0	0	0	113.4	L151	L151-H153 PolarHBondContact O-N 2.92Å
154	A	97.9	Very high	98.2	Very high	38 Å²	38	55 Å²	55	31%	0.314	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-108.2	12.2	178.6	0	0	0	0	0	112.2	T116 L151 L152 Q156	T116-A154 VanDerWaalsContact CA-O 3.29Å; T116-A154 WeakPolarHBondContact CA-O 3.33Å; T116-A154 WeakPolarHBondContact CB-O 3.35Å; T116-A154 HydrophobicContact CG2-CB 3.87Å; L151-A154 HydrophobicContact CB-CB 4.5Å; L151-A154 CarbonylContact O-C 3.47Å; L151-A154 PolarHBondContact O-N 2.82Å; L152-A154 PolarHBondContact O-N 3Å; A154-Q156 PolarHBondContact O-N 3.17Å
155	R	98.6	Very high	98.2	Very high	48 Å²	48	55.4 Å²	55.4	18%	0.181	28%	0.279	C	S	.	.			trans	-62	128.9	-177	-178.8	179.8	-71.7	-97	8.4	111.1	I115 L151 L152 V157 T159 E175	I115-R155 HydrophobicContact CD1-CB 4.4Å; I115-R155 HydrophobicContact CD1-CG 4.38Å; L151-R155 PolarHBondContact O-N 2.83Å; L152-R155 VanDerWaalsContact O-CB 3.27Å; L152-R155 WeakPolarHBondContact O-CB 3.39Å; L152-R155 PolarHBondContact O-N 2.95Å; R155-V157 WeakPolarHBondContact CD-O 3.16Å; R155-V157 WeakPolarHBondContact CG-O 3.49Å; R155-V157 PolarHBondContact NH1-O 3.09Å; R155-T159 PolarHBondContact NH1-OG1 3.42Å; R155-E175 IonicContact CZ-OE1 2.7Å; R155-E175 IonicContact CZ-OE2 2.66Å; R155-E175 IonicContact NH1-OE1 3.68Å; R155-E175 IonicContact NH1-OE2 3.68Å; R155-E175 PolarHBondContact NH1-OE2 3.41Å; R155-E175 IonicContact NH2-OE1 3.68Å; R155-E175 PolarHBondContact NH2-OE1 3.35Å; R155-E175 IonicContact NH2-OE2 2.75Å
156	Q	98.6	Very high	98.1	Very high	109 Å²	109	55.4 Å²	55.4	51%	0.509	28%	0.279	S	S	.	.			trans	-115.3	-23.5	171.8	-60.6	-177.1	9.1	0	0	112.4	I115 T116 A154	I115-Q156 PolarHBondContact O-N 3.32Å; T116-Q156 PolarHBondContact O-NE2 2.94Å; T116-Q156 VanDerWaalsContact O-NE2 3.07Å; A154-Q156 PolarHBondContact O-N 3.17Å
157	V	98.6	Very high	98.1	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	31%	0.308	C	S	.	.	S	Bend	trans	-115.2	122.2	179.2	-173.1	0	0	0	0	109.2	Y113 I115 Y118 Y121 R155 E161	Y113-V157 HydrophobicContact CE2-CB 4.09Å; Y113-V157 HydrophobicContact CE2-CG1 3.82Å; Y113-V157 HydrophobicContact CE2-CG2 4.32Å; I115-V157 PolarHBondContact O-N 2.77Å; Y118-V157 HydrophobicContact CD2-CG2 3.96Å; Y121-V157 HydrophobicContact CD1-CG1 4.39Å; Y121-V157 HydrophobicContact CD1-CG2 4.5Å; Y121-V157 HydrophobicContact CD2-CG1 3.88Å; Y121-V157 HydrophobicContact CE2-CG1 4.25Å; Y121-V157 HydrophobicContact CG-CG1 3.96Å; Y121-V157 HydrophobicContact CG-CG2 4.1Å; R155-V157 WeakPolarHBondContact CD-O 3.16Å; R155-V157 WeakPolarHBondContact CG-O 3.49Å; R155-V157 PolarHBondContact NH1-O 3.09Å; V157-E161 HydrophobicContact CG1-CB 4.15Å
158	Q	98.4	Very high	98	Very high	89 Å²	89	65.4 Å²	65.4	42%	0.416	33%	0.33	S	S	.	.			trans	-76.5	147.4	177.3	-57.3	-60.3	-28.4	0	0	110.8	H160 E161 G162	Q158-H160 VanDerWaalsContact CB-CE1 3.41Å; Q158-H160 WeakPolarHBondContact CB-CE1 3.34Å; Q158-H160 VanDerWaalsContact CB-ND1 3.31Å; Q158-H160 WeakPolarHBondContact CB-ND1 3.41Å; Q158-H160 PolarHBondContact O-N 2.78Å; Q158-H160 VanDerWaalsContact O-N 3.16Å; Q158-E161 HydrophobicContact CB-CG 4.18Å; Q158-E161 WeakPolarHBondContact CB-OE2 3.22Å; Q158-E161 PolarHBondContact N-OE2 3.43Å; Q158-E161 WeakPolarHBondContact O-CB 3.41Å; Q158-E161 PolarHBondContact O-N 3.46Å; Q158-G162 PolarHBondContact O-N 3.22Å
159	T	98	Very high	98	Very high	62 Å²	62	63.6 Å²	63.6	38%	0.38	32%	0.323	S	S	.	.	H	α-helix	trans	-56.2	-36.1	-180	-50.8	0	0	0	0	112.5	R155 E161 G162 L163 F173 E175	R155-T159 PolarHBondContact NH1-OG1 3.42Å; T159-E161 VanDerWaalsContact C-N 3.31Å; T159-E161 PolarHBondContact O-N 3.45Å; T159-G162 PolarHBondContact O-N 2.98Å; T159-L163 PolarHBondContact O-N 2.8Å; T159-L163 VanDerWaalsContact O-N 3.08Å; T159-F173 HydrophobicContact CG2-CE1 4.08Å; T159-E175 WeakPolarHBondContact CA-OE2 3.31Å; T159-E175 WeakPolarHBondContact CB-OE2 3.43Å; T159-E175 WeakPolarHBondContact CG2-OE2 3.31Å; T159-E175 PolarHBondContact OG1-OE2 2.8Å
160	H	98.3	Very high	97.9	Very high	121 Å²	121	66.1 Å²	66.1	56%	0.56	35%	0.348	S	S	*	.	H	α-helix	trans	-67	-29.4	178.7	76.3	-91	0	0	0	113.1	Q158 L163 Q164	Q158-H160 VanDerWaalsContact CB-CE1 3.41Å; Q158-H160 WeakPolarHBondContact CB-CE1 3.34Å; Q158-H160 VanDerWaalsContact CB-ND1 3.31Å; Q158-H160 WeakPolarHBondContact CB-ND1 3.41Å; Q158-H160 PolarHBondContact O-N 2.78Å; Q158-H160 VanDerWaalsContact O-N 3.16Å; H160-L163 PolarHBondContact O-N 3.47Å; H160-Q164 VanDerWaalsContact O-CB 3.31Å; H160-Q164 WeakPolarHBondContact O-CB 3.38Å; H160-Q164 PolarHBondContact O-N 2.68Å
161	E	98.4	Very high	97.8	Very high	41 Å²	41	64.7 Å²	64.7	19%	0.192	34%	0.342	C	S	.	.	H	α-helix	trans	-68.1	-43.5	176	-63.1	177.2	92.6	0	0	110.4	Y121 V157 Q158 T159 L163 Q164 L165	Y121-E161 PolarHBondContact OH-O 2.93Å; V157-E161 HydrophobicContact CG1-CB 4.15Å; Q158-E161 HydrophobicContact CB-CG 4.18Å; Q158-E161 WeakPolarHBondContact CB-OE2 3.22Å; Q158-E161 PolarHBondContact N-OE2 3.43Å; Q158-E161 WeakPolarHBondContact O-CB 3.41Å; Q158-E161 PolarHBondContact O-N 3.46Å; T159-E161 VanDerWaalsContact C-N 3.31Å; T159-E161 PolarHBondContact O-N 3.45Å; E161-L163 PolarHBondContact O-N 2.83Å; E161-Q164 PolarHBondContact O-N 2.89Å; E161-L165 WeakPolarHBondContact O-CB 3.42Å; E161-L165 PolarHBondContact O-N 2.94Å
162	G	98.1	Very high	97.8	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-60	-43.7	173.5	0	0	0	0	0	112.8	Q158 T159 L165 A166	Q158-G162 PolarHBondContact O-N 3.22Å; T159-G162 PolarHBondContact O-N 2.98Å; G162-L165 PolarHBondContact O-N 3Å; G162-A166 WeakPolarHBondContact O-CB 3.29Å; G162-A166 PolarHBondContact O-N 3.41Å
163	L	98.3	Very high	97.9	Very high	90 Å²	90	61.5 Å²	61.5	47%	0.471	33%	0.327	S	S	.	.	H	α-helix	trans	-64.8	-44.4	176.6	-175.4	64.6	0	0	0	111.9	T159 H160 E161 A166 N167 F173	T159-L163 PolarHBondContact O-N 2.8Å; T159-L163 VanDerWaalsContact O-N 3.08Å; H160-L163 PolarHBondContact O-N 3.47Å; E161-L163 PolarHBondContact O-N 2.83Å; L163-A166 PolarHBondContact O-N 2.83Å; L163-N167 VanDerWaalsContact O-CG 3.29Å; L163-N167 PolarHBondContact O-N 2.99Å; L163-N167 PolarHBondContact O-ND2 3.42Å; L163-F173 HydrophobicContact CB-CD1 4.17Å; L163-F173 HydrophobicContact CD1-CD1 4.47Å
164	Q	98.6	Very high	97.9	Very high	105 Å²	105	56.1 Å²	56.1	49%	0.491	30%	0.303	S	S	.	.	H	α-helix	trans	-60.2	-48	176.4	-178.5	-177.9	-20.7	0	0	110.9	H160 E161 A166 N167 E168	H160-Q164 VanDerWaalsContact O-CB 3.31Å; H160-Q164 WeakPolarHBondContact O-CB 3.38Å; H160-Q164 PolarHBondContact O-N 2.68Å; E161-Q164 PolarHBondContact O-N 2.89Å; Q164-A166 VanDerWaalsContact C-N 3.3Å; Q164-A166 PolarHBondContact O-N 2.81Å; Q164-N167 PolarHBondContact O-N 2.99Å; Q164-E168 PolarHBondContact NE2-OE1 2.67Å; Q164-E168 WeakPolarHBondContact O-CG 3.33Å; Q164-E168 PolarHBondContact O-N 3.36Å
165	L	98.4	Very high	97.9	Very high	9 Å²	9	56.9 Å²	56.9	5%	0.047	30%	0.3	C	S	.	.	H	α-helix	trans	-58	-44	178	179.8	63	0	0	0	111.6	Y121 V124 I144 E161 G162 E168 L169	Y121-L165 HydrophobicContact CD2-CD2 4.03Å; Y121-L165 HydrophobicContact CE2-CB 4.05Å; Y121-L165 HydrophobicContact CE2-CD2 3.42Å; Y121-L165 VanDerWaalsContact CE2-CD2 3.42Å; Y121-L165 HydrophobicContact CE2-CG 4.34Å; V124-L165 HydrophobicContact CB-CD2 3.9Å; V124-L165 HydrophobicContact CG1-CD2 3.71Å; I144-L165 HydrophobicContact CD1-CD2 4.45Å; I144-L165 HydrophobicContact CD1-CG 4.23Å; E161-L165 WeakPolarHBondContact O-CB 3.42Å; E161-L165 PolarHBondContact O-N 2.94Å; G162-L165 PolarHBondContact O-N 3Å; L165-E168 PolarHBondContact O-N 3.25Å; L165-L169 HydrophobicContact CD1-CD1 3.88Å; L165-L169 HydrophobicContact CD1-CG 4.13Å; L165-L169 HydrophobicContact CG-CD1 4.08Å; L165-L169 VanDerWaalsContact O-CG 3.29Å; L165-L169 WeakPolarHBondContact O-CG 3.42Å; L165-L169 PolarHBondContact O-N 2.89Å
166	A	98.1	Very high	97.9	Very high	1 Å²	1	54.8 Å²	54.8	1%	0.008	29%	0.292	C	S	.	.	H	α-helix	trans	-65.9	-39.3	179.3	0	0	0	0	0	112.9	I144 G162 L163 Q164 L169 G170 S171 F173	I144-A166 HydrophobicContact CD1-CB 3.91Å; G162-A166 WeakPolarHBondContact O-CB 3.29Å; G162-A166 PolarHBondContact O-N 3.41Å; L163-A166 PolarHBondContact O-N 2.83Å; Q164-A166 VanDerWaalsContact C-N 3.3Å; Q164-A166 PolarHBondContact O-N 2.81Å; A166-L169 CarbonylContact O-C 3.59Å; A166-L169 PolarHBondContact O-N 3.16Å; A166-G170 PolarHBondContact O-N 3.46Å; A166-S171 WeakPolarHBondContact CB-O 3.26Å; A166-S171 PolarHBondContact O-N 2.75Å; A166-F173 HydrophobicContact CB-CB 3.54Å; A166-F173 HydrophobicContact CB-CG 4.46Å
167	N	98	Very high	97.9	Very high	114 Å²	114	50 Å²	50	61%	0.61	27%	0.271	S	S	*	.	H	α-helix	trans	-61.2	-44.7	173.1	-71.1	-27.4	0	0	0	111.6	L163 Q164 L169 G170	L163-N167 VanDerWaalsContact O-CG 3.29Å; L163-N167 PolarHBondContact O-N 2.99Å; L163-N167 PolarHBondContact O-ND2 3.42Å; Q164-N167 PolarHBondContact O-N 2.99Å; N167-L169 VanDerWaalsContact C-N 3.27Å; N167-L169 PolarHBondContact O-N 3.03Å; N167-G170 PolarHBondContact O-N 3.22Å
168	E	97.5	Very high	97.9	Very high	99 Å²	99	50.1 Å²	50.1	46%	0.463	27%	0.272	S	S	.	.	H	α-helix	trans	-61.2	-35.8	176.4	-72.1	177.3	-162	0	0	112.7	R125 Q164 L165	R125-E168 IonicContact CZ-OE2 3.5Å; R125-E168 IonicContact NH1-OE2 3.54Å; R125-E168 PolarHBondContact NH1-OE2 2.9Å; R125-E168 IonicContact NH2-OE2 2.89Å; Q164-E168 PolarHBondContact NE2-OE1 2.67Å; Q164-E168 WeakPolarHBondContact O-CG 3.33Å; Q164-E168 PolarHBondContact O-N 3.36Å; L165-E168 PolarHBondContact O-N 3.25Å
169	L	96.5	Very high	97.8	Very high	16 Å²	16	47.6 Å²	47.6	8%	0.084	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	2.5	-179.3	-58.2	-175.4	0	0	0	113.3	R125 Y128 I144 L165 A166 N167 S171	R125-L169 HydrophobicContact CG-CD2 4.49Å; Y128-L169 HydrophobicContact CD1-CB 4.43Å; Y128-L169 HydrophobicContact CD1-CD1 4.2Å; Y128-L169 HydrophobicContact CD1-CD2 3.86Å; Y128-L169 HydrophobicContact CD1-CG 4.38Å; Y128-L169 HydrophobicContact CD2-CB 4.18Å; Y128-L169 HydrophobicContact CD2-CD1 4Å; Y128-L169 HydrophobicContact CE1-CB 4.21Å; Y128-L169 HydrophobicContact CE1-CD2 4.07Å; Y128-L169 HydrophobicContact CE2-CB 3.95Å; Y128-L169 HydrophobicContact CG-CB 4.42Å; Y128-L169 HydrophobicContact CG-CD1 3.78Å; Y128-L169 HydrophobicContact CG-CD2 4.3Å; Y128-L169 HydrophobicContact CG-CG 4.39Å; Y128-L169 VanDerWaalsContact CZ-O 3.23Å; Y128-L169 PolarHBondContact OH-O 3.44Å; I144-L169 HydrophobicContact CD1-CD1 4.01Å; L165-L169 HydrophobicContact CD1-CD1 3.88Å; L165-L169 HydrophobicContact CD1-CG 4.13Å; L165-L169 HydrophobicContact CG-CD1 4.08Å; L165-L169 VanDerWaalsContact O-CG 3.29Å; L165-L169 WeakPolarHBondContact O-CG 3.42Å; L165-L169 PolarHBondContact O-N 2.89Å; A166-L169 CarbonylContact O-C 3.59Å; A166-L169 PolarHBondContact O-N 3.16Å; N167-L169 VanDerWaalsContact C-N 3.27Å; N167-L169 PolarHBondContact O-N 3.03Å; L169-S171 VanDerWaalsContact C-N 3.28Å; L169-S171 PolarHBondContact O-N 3.28Å; L169-S171 PolarHBondContact O-OG 3.46Å
170	G	95.8	Very high	97.7	Very high	68 Å²	68	51.5 Å²	51.5	70%	0.701	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	43.1	-176.3	0	0	0	0	0	112.7	A166 N167	A166-G170 PolarHBondContact O-N 3.46Å; N167-G170 PolarHBondContact O-N 3.22Å
171	S	96.6	Very high	97.5	Very high	16 Å²	16	48.5 Å²	48.5	11%	0.112	27%	0.266	C	S	.	.			trans	-124.4	162.4	-175.2	-62	0	0	0	0	110.8	Y128 V142 A166 L169	Y128-S171 WeakPolarHBondContact CE2-OG 3.41Å; V142-S171 WeakPolarHBondContact O-CB 3.29Å; A166-S171 WeakPolarHBondContact CB-O 3.26Å; A166-S171 PolarHBondContact O-N 2.75Å; L169-S171 VanDerWaalsContact C-N 3.28Å; L169-S171 PolarHBondContact O-N 3.28Å; L169-S171 PolarHBondContact O-OG 3.46Å
172	V	96.9	Very high	97.4	Very high	66 Å²	66	48.2 Å²	48.2	40%	0.4	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	141.4	174.6	-178.4	0	0	0	0	109.3	I143 I144 L174	I143-V172 HydrophobicContact CG1-CB 4.46Å; I143-V172 HydrophobicContact CG2-CB 4.4Å; I144-V172 PolarHBondContact N-O 2.9Å; V172-L174 HydrophobicContact CG1-CD1 3.77Å
173	F	98.4	Very high	97.3	Very high	33 Å²	33	53.5 Å²	53.5	15%	0.145	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	134.6	174.3	178.5	-119.3	0	0	0	111.4	Y113 I144 T159 L163 A166 E175	Y113-F173 AromaticContact CE1-CE2 3.93Å; Y113-F173 HydrophobicContact CE1-CE2 3.93Å; Y113-F173 AromaticContact CZ-CE2 4Å; Y113-F173 VanDerWaalsContact OH-CE2 3.27Å; Y113-F173 WeakPolarHBondContact OH-CE2 3.29Å; Y113-F173 WeakPolarHBondContact OH-CZ 3.41Å; I144-F173 HydrophobicContact CB-CD2 4.22Å; I144-F173 HydrophobicContact CG2-CD2 4.04Å; I144-F173 HydrophobicContact CG2-CE2 4.49Å; I144-F173 WeakPolarHBondContact O-CA 3.44Å; I144-F173 WeakPolarHBondContact O-CD2 3.43Å; T159-F173 HydrophobicContact CG2-CE1 4.08Å; L163-F173 HydrophobicContact CB-CD1 4.17Å; L163-F173 HydrophobicContact CD1-CD1 4.47Å; A166-F173 HydrophobicContact CB-CB 3.54Å; A166-F173 HydrophobicContact CB-CG 4.46Å; F173-E175 HydrophobicContact CE1-CB 4.16Å; F173-E175 HydrophobicContact CZ-CB 3.89Å; F173-E175 HydrophobicContact CZ-CG 4.45Å
174	L	98.3	Very high	97.3	Very high	53 Å²	53	51.8 Å²	51.8	28%	0.277	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	134.4	165.4	-64.7	98.1	0	0	0	109.6	I143 I144 V145 G146 V172 I176 V188	I143-L174 HydrophobicContact CG2-CD1 3.58Å; I144-L174 PolarHBondContact O-N 3.11Å; V145-L174 CarbonylContact C-O 3.49Å; V145-L174 VanDerWaalsContact CA-O 3.3Å; V145-L174 WeakPolarHBondContact CA-O 3.44Å; G146-L174 PolarHBondContact N-O 3.43Å; V172-L174 HydrophobicContact CG1-CD1 3.77Å; L174-I176 HydrophobicContact CB-CG2 4.07Å; L174-V188 HydrophobicContact CB-CG2 4.21Å; L174-V188 HydrophobicContact CD1-CG2 4.19Å; L174-V188 HydrophobicContact CD2-CG2 4Å; L174-V188 HydrophobicContact CG-CG2 4.35Å
175	E	98.4	Very high	97.2	Very high	54 Å²	54	46.8 Å²	46.8	25%	0.252	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	124.8	166.7	-161.9	-175.3	107	0	0	108.2	I115 G146 R155 T159 F173	I115-E175 HydrophobicContact CG2-CG 4Å; G146-E175 CarbonylContact O-C 3.58Å; G146-E175 VanDerWaalsContact O-CA 3.27Å; G146-E175 WeakPolarHBondContact O-CA 3.49Å; G146-E175 WeakPolarHBondContact O-CG 3.29Å; R155-E175 IonicContact CZ-OE1 2.7Å; R155-E175 IonicContact CZ-OE2 2.66Å; R155-E175 IonicContact NH1-OE1 3.68Å; R155-E175 IonicContact NH1-OE2 3.68Å; R155-E175 PolarHBondContact NH1-OE2 3.41Å; R155-E175 IonicContact NH2-OE1 3.68Å; R155-E175 PolarHBondContact NH2-OE1 3.35Å; R155-E175 IonicContact NH2-OE2 2.75Å; T159-E175 WeakPolarHBondContact CA-OE2 3.31Å; T159-E175 WeakPolarHBondContact CB-OE2 3.43Å; T159-E175 WeakPolarHBondContact CG2-OE2 3.31Å; T159-E175 PolarHBondContact OG1-OE2 2.8Å; F173-E175 HydrophobicContact CE1-CB 4.16Å; F173-E175 HydrophobicContact CZ-CB 3.89Å; F173-E175 HydrophobicContact CZ-CG 4.45Å
176	I	98.4	Very high	97.1	Very high	4 Å²	4	46.7 Å²	46.7	2%	0.021	26%	0.256	C	S	.	.			trans	-136.9	162.2	-172.1	73.7	174.5	0	0	0	111.7	M43 V145 G146 N147 K148 G149 L174 D184 V185 V188	M43-I176 HydrophobicContact CG-CD1 4.36Å; M43-I176 HydrophobicContact SD-CD1 3.87Å; V145-I176 HydrophobicContact CG1-CD1 3.65Å; V145-I176 HydrophobicContact CG1-CG1 3.69Å; G146-I176 PolarHBondContact O-N 2.91Å; N147-I176 CarbonylContact C-O 3.51Å; N147-I176 WeakPolarHBondContact CA-O 3.26Å; K148-I176 PolarHBondContact N-O 2.96Å; K148-I176 VanDerWaalsContact N-O 3.1Å; G149-I176 PolarHBondContact N-O 3.36Å; L174-I176 HydrophobicContact CB-CG2 4.07Å; I176-D184 HydrophobicContact CB-CB 4.09Å; I176-D184 HydrophobicContact CG2-CB 3.8Å; I176-V185 HydrophobicContact CD1-CG2 3.93Å; I176-V188 HydrophobicContact CD1-CG2 4.48Å; I176-V188 HydrophobicContact CG2-CG2 4.3Å
177	S	98.1	Very high	97	Very high	9 Å²	9	50.7 Å²	50.7	6%	0.063	28%	0.277	C	S	.	.			trans	-113.3	109.2	162.1	176.4	0	0	0	0	110.3	D150 S179 E180 N181	D150-S177 VanDerWaalsContact OD1-CB 3.28Å; D150-S177 WeakPolarHBondContact OD1-CB 3.42Å; D150-S177 PolarHBondContact OD1-OG 3.4Å; S177-S179 PolarHBondContact O-N 3.4Å; S177-S179 PolarHBondContact OG-OG 3.48Å; S177-E180 PolarHBondContact O-N 3.38Å; S177-E180 WeakPolarHBondContact OG-CB 3.47Å; S177-E180 PolarHBondContact OG-N 2.95Å; S177-E180 VanDerWaalsContact OG-N 3.09Å; S177-N181 PolarHBondContact O-N 3.28Å
178	T	97.6	Very high	97	Very high	3 Å²	3	45.3 Å²	45.3	2%	0.018	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-34.2	174.8	-63.1	0	0	0	0	112.4	A42 M43 R46 F52 N147 V185	A42-T178 HydrophobicContact CB-CG2 4.04Å; M43-T178 HydrophobicContact CB-CG2 4.17Å; R46-T178 HydrophobicContact CB-CG2 4Å; R46-T178 HydrophobicContact CG-CG2 4.28Å; F52-T178 HydrophobicContact CD2-CG2 4.14Å; F52-T178 HydrophobicContact CE2-CG2 4.23Å; N147-T178 VanDerWaalsContact CG-OG1 3.31Å; N147-T178 PolarHBondContact ND2-OG1 3.14Å; N147-T178 WeakPolarHBondContact OD1-CB 3.22Å; N147-T178 PolarHBondContact OD1-N 3.38Å; N147-T178 VanDerWaalsContact OD1-N 3.17Å; N147-T178 PolarHBondContact OD1-OG1 2.97Å; T178-V185 HydrophobicContact CG2-CG2 4.47Å
179	S	96.4	Very high	97	Very high	36 Å²	36	40.6 Å²	40.6	25%	0.252	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-45.6	179.8	31.5	0	0	0	0	111.8	D150 S177	D150-S179 PolarHBondContact OD1-OG 3.1Å; D150-S179 PolarHBondContact OD2-OG 2.94Å; S177-S179 PolarHBondContact O-N 3.4Å; S177-S179 PolarHBondContact OG-OG 3.48Å
180	E	95.9	Very high	96.9	Very high	143 Å²	143	43.1 Å²	43.1	67%	0.668	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-43.3	-169.7	-61.8	-168.1	153.1	0	0	113.5	D150 S177	D150-E180 HydrophobicContact CB-CG 3.8Å; D150-E180 WeakPolarHBondContact CB-OE2 3.31Å; S177-E180 PolarHBondContact O-N 3.38Å; S177-E180 WeakPolarHBondContact OG-CB 3.47Å; S177-E180 PolarHBondContact OG-N 2.95Å; S177-E180 VanDerWaalsContact OG-N 3.09Å
181	N	94.6	Very high	96.9	Very high	58 Å²	58	43.1 Å²	43.1	31%	0.31	22%	0.22	S	C	.	.			trans	-117.6	106.5	-170.3	-163.7	-11.5	0	0	0	112.6	S177 E183 D184 V185	S177-N181 PolarHBondContact O-N 3.28Å; N181-E183 PolarHBondContact OD1-N 2.62Å; N181-D184 HydrophobicContact CB-CB 4.3Å; N181-D184 WeakPolarHBondContact CB-OD2 2.79Å; N181-D184 VanDerWaalsContact CG-CG 3.46Å; N181-D184 VanDerWaalsContact CG-OD2 3.3Å; N181-D184 PolarHBondContact ND2-OD1 2.84Å; N181-D184 PolarHBondContact ND2-OD2 2.83Å; N181-V185 WeakPolarHBondContact O-CG2 3.42Å
182	Y	96.3	Very high	96.9	Very high	36 Å²	36	42.4 Å²	42.4	14%	0.141	21%	0.214	C	C	.	.	H	α-helix	trans	-69.5	-36.1	175.1	170.6	-103.8	0	0	0	112.6	R46 K50 V185 C186	R46-Y182 HydrophobicContact CG-CD2 4.14Å; R46-Y182 VanDerWaalsContact O-CE2 3.28Å; R46-Y182 WeakPolarHBondContact O-CE2 3.29Å; K50-Y182 HydrophobicContact CB-CD2 4.31Å; K50-Y182 HydrophobicContact CB-CE2 4.03Å; K50-Y182 HydrophobicContact CD-CE1 4.1Å; K50-Y182 WeakPolarHBondContact CE-OH 3.4Å; K50-Y182 HydrophobicContact CG-CE1 4.22Å; K50-Y182 HydrophobicContact CG-CE2 3.81Å; Y182-V185 WeakPolarHBondContact O-CB 3.48Å; Y182-V185 PolarHBondContact O-N 3.08Å; Y182-C186 HydrophobicContact CE1-CB 4.21Å; Y182-C186 PolarHBondContact O-N 3.15Å
183	E	96.9	Very high	96.8	Very high	111 Å²	111	39.2 Å²	39.2	52%	0.519	20%	0.195	S	C	.	.	H	α-helix	trans	-66.5	-43.3	-174	-60.7	-57	148.9	0	0	110.4	N181 V185 C186 D187	N181-E183 PolarHBondContact OD1-N 2.62Å; E183-V185 VanDerWaalsContact C-N 3.3Å; E183-V185 PolarHBondContact O-N 3.06Å; E183-C186 CarbonylContact O-C 3.57Å; E183-C186 WeakPolarHBondContact O-CA 3.41Å; E183-C186 VanDerWaalsContact O-CB 3.28Å; E183-C186 WeakPolarHBondContact O-CB 3.42Å; E183-C186 PolarHBondContact O-N 3.5Å; E183-D187 PolarHBondContact O-N 3.17Å
184	D	97.3	Very high	96.5	Very high	53 Å²	53	40.7 Å²	40.7	28%	0.283	20%	0.202	S	C	.	.	H	α-helix	trans	-58.5	-41.6	174.8	-63.3	-14.4	0	0	0	112.1	I176 N181 C186 D187 V188	I176-D184 HydrophobicContact CB-CB 4.09Å; I176-D184 HydrophobicContact CG2-CB 3.8Å; N181-D184 HydrophobicContact CB-CB 4.3Å; N181-D184 WeakPolarHBondContact CB-OD2 2.79Å; N181-D184 VanDerWaalsContact CG-CG 3.46Å; N181-D184 VanDerWaalsContact CG-OD2 3.3Å; N181-D184 PolarHBondContact ND2-OD1 2.84Å; N181-D184 PolarHBondContact ND2-OD2 2.83Å; D184-C186 VanDerWaalsContact C-N 3.32Å; D184-D187 PolarHBondContact O-N 2.81Å; D184-V188 VanDerWaalsContact O-CG2 3.29Å; D184-V188 WeakPolarHBondContact O-CG2 3.32Å; D184-V188 PolarHBondContact O-N 2.95Å; D184-V188 VanDerWaalsContact O-N 3.12Å
185	V	97.6	Very high	96.3	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-62.7	-43.5	174.8	175.3	0	0	0	0	110.1	M43 R46 F47 I176 T178 N181 Y182 E183 V188 F189	M43-V185 HydrophobicContact CG-CG1 3.9Å; M43-V185 HydrophobicContact CG-CG2 4.36Å; R46-V185 HydrophobicContact CB-CG1 4.43Å; R46-V185 HydrophobicContact CG-CB 4.46Å; R46-V185 HydrophobicContact CG-CG1 4.28Å; R46-V185 HydrophobicContact CG-CG2 4.25Å; F47-V185 HydrophobicContact CB-CG1 3.94Å; I176-V185 HydrophobicContact CD1-CG2 3.93Å; T178-V185 HydrophobicContact CG2-CG2 4.47Å; N181-V185 WeakPolarHBondContact O-CG2 3.42Å; Y182-V185 WeakPolarHBondContact O-CB 3.48Å; Y182-V185 PolarHBondContact O-N 3.08Å; E183-V185 VanDerWaalsContact C-N 3.3Å; E183-V185 PolarHBondContact O-N 3.06Å; V185-V188 PolarHBondContact O-N 3.03Å; V185-F189 HydrophobicContact CG1-CD2 4.11Å; V185-F189 HydrophobicContact CG1-CE2 4.05Å; V185-F189 VanDerWaalsContact O-CD2 3.3Å; V185-F189 WeakPolarHBondContact O-CD2 3.27Å; V185-F189 PolarHBondContact O-N 3.49Å
186	C	95.7	Very high	96.1	Very high	7 Å²	7	38.4 Å²	38.4	5%	0.047	19%	0.189	C	C	.	.	H	α-helix	trans	-61	-47.3	178.7	-150.8	0	0	0	0	111.4	Y182 E183 D184 V188 F189 Q190	Y182-C186 HydrophobicContact CE1-CB 4.21Å; Y182-C186 PolarHBondContact O-N 3.15Å; E183-C186 CarbonylContact O-C 3.57Å; E183-C186 WeakPolarHBondContact O-CA 3.41Å; E183-C186 VanDerWaalsContact O-CB 3.28Å; E183-C186 WeakPolarHBondContact O-CB 3.42Å; E183-C186 PolarHBondContact O-N 3.5Å; D184-C186 VanDerWaalsContact C-N 3.32Å; C186-V188 VanDerWaalsContact C-N 3.35Å; C186-V188 PolarHBondContact O-N 3.03Å; C186-F189 PolarHBondContact O-N 3.46Å; C186-Q190 WeakPolarHBondContact O-CB 3.29Å; C186-Q190 WeakPolarHBondContact O-CG 3.4Å; C186-Q190 PolarHBondContact O-N 3.34Å; C186-Q190 PolarHBondContact SG-NE2 2.88Å
187	D	95.6	Very high	95.7	Very high	86 Å²	86	39.7 Å²	39.7	46%	0.46	20%	0.199	S	C	.	.	H	α-helix	trans	-60.8	-42	-178.8	-73.9	-14.2	0	0	0	111.8	E183 D184 F189 Q190 H191	E183-D187 PolarHBondContact O-N 3.17Å; D184-D187 PolarHBondContact O-N 2.81Å; D187-F189 PolarHBondContact O-N 2.86Å; D187-Q190 PolarHBondContact O-N 2.85Å; D187-H191 WeakPolarHBondContact O-CB 3.17Å; D187-H191 PolarHBondContact O-N 3.3Å
188	V	97.8	Very high	95.3	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-57	-50.8	175.5	169.8	0	0	0	0	111.4	L110 V145 L174 I176 D184 V185 C186 L192	L110-V188 HydrophobicContact CD1-CG1 3.95Å; L110-V188 HydrophobicContact CD2-CG1 3.6Å; L110-V188 HydrophobicContact CG-CG1 4.46Å; V145-V188 HydrophobicContact CG2-CG1 3.94Å; L174-V188 HydrophobicContact CB-CG2 4.21Å; L174-V188 HydrophobicContact CD1-CG2 4.19Å; L174-V188 HydrophobicContact CD2-CG2 4Å; L174-V188 HydrophobicContact CG-CG2 4.35Å; I176-V188 HydrophobicContact CD1-CG2 4.48Å; I176-V188 HydrophobicContact CG2-CG2 4.3Å; D184-V188 VanDerWaalsContact O-CG2 3.29Å; D184-V188 WeakPolarHBondContact O-CG2 3.32Å; D184-V188 PolarHBondContact O-N 2.95Å; D184-V188 VanDerWaalsContact O-N 3.12Å; V185-V188 PolarHBondContact O-N 3.03Å; C186-V188 VanDerWaalsContact C-N 3.35Å; C186-V188 PolarHBondContact O-N 3.03Å; V188-L192 PolarHBondContact O-N 3.48Å; V188-L192 VanDerWaalsContact O-N 3.14Å
189	F	97.1	Very high	94.9	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-71.3	-41	-178.4	-78.8	-79.1	0	0	0	112.2	L30 V32 M43 I44 F47 I79 L110 V185 C186 D187 L192 C193	L30-F189 HydrophobicContact CD1-CD1 4.22Å; V32-F189 HydrophobicContact CG2-CE1 4.2Å; V32-F189 HydrophobicContact CG2-CZ 4.35Å; M43-F189 HydrophobicContact CE-CE2 3.83Å; M43-F189 HydrophobicContact CE-CZ 3.69Å; M43-F189 HydrophobicContact CG-CE2 4Å; I44-F189 HydrophobicContact CG1-CZ 4.02Å; F47-F189 HydrophobicContact CB-CD2 3.51Å; F47-F189 HydrophobicContact CB-CE2 3.59Å; F47-F189 HydrophobicContact CB-CG 4.26Å; F47-F189 HydrophobicContact CB-CZ 4.41Å; F47-F189 HydrophobicContact CD1-CB 4.14Å; F47-F189 HydrophobicContact CD1-CD1 4.17Å; F47-F189 AromaticContact CD1-CD2 3.96Å; F47-F189 HydrophobicContact CD1-CD2 3.96Å; F47-F189 HydrophobicContact CD1-CE2 4.39Å; F47-F189 AromaticContact CD1-CG 3.84Å; F47-F189 HydrophobicContact CD1-CG 3.84Å; F47-F189 HydrophobicContact CD2-CB 3.67Å; F47-F189 AromaticContact CD2-CD2 3.74Å; F47-F189 HydrophobicContact CD2-CD2 3.74Å; F47-F189 AromaticContact CD2-CG 3.92Å; F47-F189 HydrophobicContact CD2-CG 3.92Å; F47-F189 HydrophobicContact CE1-CB 4.02Å; F47-F189 HydrophobicContact CE1-CD1 4.41Å; F47-F189 HydrophobicContact CE1-CG 4.15Å; F47-F189 HydrophobicContact CE2-CB 3.52Å; F47-F189 HydrophobicContact CE2-CD2 4.47Å; F47-F189 HydrophobicContact CE2-CG 4.21Å; F47-F189 HydrophobicContact CG-CB 3.98Å; F47-F189 HydrophobicContact CG-CD1 4.46Å; F47-F189 AromaticContact CG-CD2 3.44Å; F47-F189 HydrophobicContact CG-CD2 3.44Å; F47-F189 VanDerWaalsContact CG-CD2 3.44Å; F47-F189 AromaticContact CG-CE2 3.98Å; F47-F189 HydrophobicContact CG-CE2 3.98Å; F47-F189 AromaticContact CG-CG 3.72Å; F47-F189 HydrophobicContact CG-CG 3.72Å; F47-F189 HydrophobicContact CZ-CB 3.71Å; F47-F189 HydrophobicContact CZ-CG 4.32Å; I79-F189 HydrophobicContact CD1-CD1 4.24Å; I79-F189 HydrophobicContact CD1-CE1 3.97Å; I79-F189 HydrophobicContact CG2-CE1 4.39Å; L110-F189 HydrophobicContact CD1-CD1 3.89Å; L110-F189 HydrophobicContact CD1-CE1 3.47Å; L110-F189 VanDerWaalsContact CD1-CE1 3.47Å; L110-F189 HydrophobicContact CD1-CE2 4.29Å; L110-F189 HydrophobicContact CD1-CG 4.45Å; L110-F189 HydrophobicContact CD1-CZ 3.69Å; V185-F189 HydrophobicContact CG1-CD2 4.11Å; V185-F189 HydrophobicContact CG1-CE2 4.05Å; V185-F189 VanDerWaalsContact O-CD2 3.3Å; V185-F189 WeakPolarHBondContact O-CD2 3.27Å; V185-F189 PolarHBondContact O-N 3.49Å; C186-F189 PolarHBondContact O-N 3.46Å; D187-F189 PolarHBondContact O-N 2.86Å; F189-L192 PolarHBondContact O-N 3.16Å; F189-C193 WeakPolarHBondContact O-CB 3.37Å; F189-C193 PolarHBondContact O-N 3.43Å; F189-C193 PolarHBondContact O-SG 2.87Å
190	Q	94.9	Very high	94.4	Very high	69 Å²	69	45.3 Å²	45.3	32%	0.322	22%	0.22	S	C	.	.	H	α-helix	trans	-63	-43.6	177.3	-73.9	-170.4	41.1	0	0	111.5	C186 D187 L192 C193 K194	C186-Q190 WeakPolarHBondContact O-CB 3.29Å; C186-Q190 WeakPolarHBondContact O-CG 3.4Å; C186-Q190 PolarHBondContact O-N 3.34Å; C186-Q190 PolarHBondContact SG-NE2 2.88Å; D187-Q190 PolarHBondContact O-N 2.85Å; Q190-L192 VanDerWaalsContact C-N 3.35Å; Q190-L192 PolarHBondContact O-N 3.4Å; Q190-C193 PolarHBondContact O-N 2.56Å; Q190-K194 WeakPolarHBondContact O-CB 3.17Å; Q190-K194 PolarHBondContact O-N 3.01Å
191	H	95.6	Very high	93.7	Very high	69 Å²	69	42.4 Å²	42.4	32%	0.319	22%	0.215	S	C	.	.	H	α-helix	trans	-59.5	-46.9	176.2	-176.3	58.3	0	0	0	111.1	D187 K194 E195	D187-H191 WeakPolarHBondContact O-CB 3.17Å; D187-H191 PolarHBondContact O-N 3.3Å; H191-K194 WeakPolarHBondContact O-CB 3.34Å; H191-K194 PolarHBondContact O-N 3.48Å; H191-E195 IonicContact CE1-OE1 3.92Å; H191-E195 WeakPolarHBondContact O-CG 3.34Å; H191-E195 PolarHBondContact O-N 3.39Å
192	L	96.9	Very high	92.8	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-63.3	-44.9	178.1	-173.6	55.9	0	0	0	112.5	L30 L110 P141 I143 V188 F189 Q190 K194 E195 V196	L30-L192 HydrophobicContact CD1-CD2 3.95Å; L30-L192 HydrophobicContact CD1-CG 4.21Å; L30-L192 HydrophobicContact CD2-CD2 3.86Å; L30-L192 HydrophobicContact CD2-CG 3.81Å; L30-L192 HydrophobicContact CG-CD2 4.34Å; L110-L192 HydrophobicContact CD1-CD2 4.47Å; L110-L192 HydrophobicContact CD2-CD2 3.53Å; L110-L192 HydrophobicContact CG-CD2 3.64Å; P141-L192 HydrophobicContact CB-CD1 3.82Å; P141-L192 HydrophobicContact CG-CD1 3.64Å; I143-L192 HydrophobicContact CD1-CB 3.77Å; I143-L192 HydrophobicContact CD1-CD1 4.28Å; I143-L192 HydrophobicContact CD1-CG 4.49Å; I143-L192 HydrophobicContact CG1-CD1 4.39Å; V188-L192 PolarHBondContact O-N 3.48Å; V188-L192 VanDerWaalsContact O-N 3.14Å; F189-L192 PolarHBondContact O-N 3.16Å; Q190-L192 VanDerWaalsContact C-N 3.35Å; Q190-L192 PolarHBondContact O-N 3.4Å; L192-K194 VanDerWaalsContact C-N 3.27Å; L192-K194 PolarHBondContact O-N 3.29Å; L192-E195 PolarHBondContact O-N 2.99Å; L192-V196 WeakPolarHBondContact O-CG2 3.3Å; L192-V196 PolarHBondContact O-N 2.99Å
193	C	95.2	Very high	91.3	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-56.4	-43.7	175	-73.4	0	0	0	0	111.3	I28 V70 F189 Q190 V196 S197	I28-C193 HydrophobicContact CD1-CB 4.27Å; V70-C193 HydrophobicContact CG1-CB 4.44Å; V70-C193 HydrophobicContact CG2-CB 3.95Å; F189-C193 WeakPolarHBondContact O-CB 3.37Å; F189-C193 PolarHBondContact O-N 3.43Å; F189-C193 PolarHBondContact O-SG 2.87Å; Q190-C193 PolarHBondContact O-N 2.56Å; C193-V196 PolarHBondContact O-N 3.3Å; C193-S197 WeakPolarHBondContact O-CB 3.21Å; C193-S197 PolarHBondContact O-N 3Å; C193-S197 PolarHBondContact O-OG 3.22Å; C193-S197 VanDerWaalsContact O-OG 3.06Å
194	K	93	Very high	89.4	Confident	64 Å²	64	41.9 Å²	41.9	28%	0.278	23%	0.23	S	C	.	.	H	α-helix	trans	-61.9	-45.3	178.5	-179.6	177.2	-178.1	171.3	0	112	V70 E71 Q190 H191 L192 V196 S197 K198	V70-K194 HydrophobicContact CG1-CB 4.48Å; E71-K194 VanDerWaalsContact OE1-CE 3.23Å; E71-K194 WeakPolarHBondContact OE1-CE 3.32Å; E71-K194 IonicContact OE1-NZ 2.64Å; E71-K194 PolarHBondContact OE1-NZ 3.01Å; E71-K194 VanDerWaalsContact OE2-CE 3.23Å; E71-K194 WeakPolarHBondContact OE2-CE 3.31Å; E71-K194 IonicContact OE2-NZ 3.58Å; Q190-K194 WeakPolarHBondContact O-CB 3.17Å; Q190-K194 PolarHBondContact O-N 3.01Å; H191-K194 WeakPolarHBondContact O-CB 3.34Å; H191-K194 PolarHBondContact O-N 3.48Å; L192-K194 VanDerWaalsContact C-N 3.27Å; L192-K194 PolarHBondContact O-N 3.29Å; K194-V196 PolarHBondContact O-N 3.04Å; K194-S197 PolarHBondContact O-N 2.85Å; K194-K198 WeakPolarHBondContact O-CG 3.4Å; K194-K198 PolarHBondContact O-N 3.23Å
195	E	93.8	Very high	87.1	Confident	58 Å²	58	45.7 Å²	45.7	27%	0.271	25%	0.246	S	C	.	.	H	α-helix	trans	-62.5	-41.4	177.6	-67.6	-53.4	115.2	0	0	112	P141 H191 L192 K198 L199	P141-E195 HydrophobicContact CB-CB 3.77Å; P141-E195 HydrophobicContact CB-CG 4.48Å; P141-E195 HydrophobicContact CG-CB 3.84Å; H191-E195 IonicContact CE1-OE1 3.92Å; H191-E195 WeakPolarHBondContact O-CG 3.34Å; H191-E195 PolarHBondContact O-N 3.39Å; L192-E195 PolarHBondContact O-N 2.99Å; E195-K198 PolarHBondContact O-N 3.5Å; E195-K198 IonicContact OE1-NZ 2.67Å; E195-K198 PolarHBondContact OE1-NZ 2.92Å; E195-K198 IonicContact OE2-NZ 3.52Å; E195-L199 WeakPolarHBondContact O-CG 3.43Å; E195-L199 PolarHBondContact O-N 2.75Å
196	V	93.7	Very high	84.7	Confident	0 Å²	0	55 Å²	55	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-65.7	-43.7	175.6	177.8	0	0	0	0	111.6	I28 L30 E107 P141 L192 C193 K194 K198 L199 H200	I28-V196 HydrophobicContact CG1-CG1 4.47Å; I28-V196 HydrophobicContact CG2-CB 4.18Å; I28-V196 HydrophobicContact CG2-CG1 4.03Å; L30-V196 HydrophobicContact CD2-CG2 4.02Å; E107-V196 HydrophobicContact CB-CG1 3.81Å; P141-V196 HydrophobicContact CG-CG2 3.66Å; L192-V196 WeakPolarHBondContact O-CG2 3.3Å; L192-V196 PolarHBondContact O-N 2.99Å; C193-V196 PolarHBondContact O-N 3.3Å; K194-V196 PolarHBondContact O-N 3.04Å; V196-K198 VanDerWaalsContact C-N 3.32Å; V196-K198 PolarHBondContact O-N 3.32Å; V196-L199 WeakPolarHBondContact O-CB 2.9Å; V196-L199 PolarHBondContact O-N 3.01Å; V196-L199 VanDerWaalsContact O-N 3.15Å; V196-H200 PolarHBondContact O-CD2 3.37Å; V196-H200 PolarHBondContact O-N 3.22Å; V196-H200 VanDerWaalsContact O-N 3.14Å
197	S	90.4	Very high	82.3	Confident	31 Å²	31	64 Å²	64	22%	0.217	31%	0.314	C	S	.	.	H	α-helix	trans	-57.7	-41.9	176.5	-69.4	0	0	0	0	112.6	I28 C193 K194 L199 H200 S201	I28-S197 VanDerWaalsContact CD1-OG 3.26Å; I28-S197 WeakPolarHBondContact CD1-OG 3.36Å; C193-S197 WeakPolarHBondContact O-CB 3.21Å; C193-S197 PolarHBondContact O-N 3Å; C193-S197 PolarHBondContact O-OG 3.22Å; C193-S197 VanDerWaalsContact O-OG 3.06Å; K194-S197 PolarHBondContact O-N 2.85Å; S197-L199 VanDerWaalsContact C-N 3.31Å; S197-L199 PolarHBondContact O-N 3.4Å; S197-H200 WeakPolarHBondContact O-CB 3.24Å; S197-H200 PolarHBondContact O-N 3.21Å; S197-H200 VanDerWaalsContact O-N 3.14Å; S197-S201 PolarHBondContact O-N 3.22Å; S197-S201 VanDerWaalsContact O-N 3.08Å; S197-S201 PolarHBondContact O-OG 3.49Å
198	K	89.6	Confident	80	Confident	94 Å²	94	69.8 Å²	69.8	41%	0.409	33%	0.329	S	S	.	.	H	α-helix	trans	-58.7	-42.4	176.2	-72.9	169.7	-179.7	172.5	0	111.9	K194 E195 V196 H200 S201 L202	K194-K198 WeakPolarHBondContact O-CG 3.4Å; K194-K198 PolarHBondContact O-N 3.23Å; E195-K198 PolarHBondContact O-N 3.5Å; E195-K198 IonicContact OE1-NZ 2.67Å; E195-K198 PolarHBondContact OE1-NZ 2.92Å; E195-K198 IonicContact OE2-NZ 3.52Å; V196-K198 VanDerWaalsContact C-N 3.32Å; V196-K198 PolarHBondContact O-N 3.32Å; K198-H200 VanDerWaalsContact C-N 3.29Å; K198-H200 PolarHBondContact O-N 3.38Å; K198-S201 PolarHBondContact O-N 2.78Å; K198-L202 WeakPolarHBondContact O-CG 3.42Å; K198-L202 PolarHBondContact O-N 3.02Å; K198-L202 VanDerWaalsContact O-N 3.09Å
199	L	87.7	Confident	77.5	Confident	43 Å²	43	74 Å²	74	23%	0.225	36%	0.364	C	S	.	.	H	α-helix	trans	-64.7	-35.5	177.5	-64.2	169.4	0	0	0	112.2	K139 E195 V196 S197 S203	K139-L199 HydrophobicContact CB-CD2 4.24Å; K139-L199 WeakPolarHBondContact O-CD1 3.44Å; E195-L199 WeakPolarHBondContact O-CG 3.43Å; E195-L199 PolarHBondContact O-N 2.75Å; V196-L199 WeakPolarHBondContact O-CB 2.9Å; V196-L199 PolarHBondContact O-N 3.01Å; V196-L199 VanDerWaalsContact O-N 3.15Å; S197-L199 VanDerWaalsContact C-N 3.31Å; S197-L199 PolarHBondContact O-N 3.4Å; L199-S203 VanDerWaalsContact O-CB 3.29Å; L199-S203 WeakPolarHBondContact O-CB 3.21Å; L199-S203 PolarHBondContact O-N 3.16Å; L199-S203 PolarHBondContact O-OG 3.03Å
200	H	86	Confident	75	Confident	30 Å²	30	78 Å²	78	14%	0.139	39%	0.393	C	S	.	.	H	α-helix	trans	-65.6	-42.6	175.8	-73	-162.9	0	0	0	111.9	K26 E107 V196 S197 K198 S203 G204	K26-H200 VanDerWaalsContact CD-ND1 3.35Å; K26-H200 WeakPolarHBondContact CD-ND1 3.29Å; K26-H200 WeakPolarHBondContact CE-ND1 3.18Å; K26-H200 PolarHBondContact NZ-CD2 3.03Å; K26-H200 PolarHBondContact NZ-CE1 3.4Å; K26-H200 VanDerWaalsContact NZ-CE1 3.28Å; K26-H200 PolarHBondContact NZ-ND1 3.15Å; K26-H200 PolarHBondContact NZ-NE2 2.65Å; E107-H200 IonicContact OE1-CD2 2.85Å; E107-H200 IonicContact OE1-CE1 3.21Å; E107-H200 IonicContact OE1-NE2 3Å; E107-H200 PolarHBondContact OE1-NE2 3.07Å; E107-H200 IonicContact OE2-CE1 3.92Å; E107-H200 PolarHBondContact OE2-CE1 3.37Å; E107-H200 IonicContact OE2-NE2 4Å; E107-H200 PolarHBondContact OE2-NE2 3.34Å; V196-H200 PolarHBondContact O-CD2 3.37Å; V196-H200 PolarHBondContact O-N 3.22Å; V196-H200 VanDerWaalsContact O-N 3.14Å; S197-H200 WeakPolarHBondContact O-CB 3.24Å; S197-H200 PolarHBondContact O-N 3.21Å; S197-H200 VanDerWaalsContact O-N 3.14Å; K198-H200 VanDerWaalsContact C-N 3.29Å; K198-H200 PolarHBondContact O-N 3.38Å; H200-S203 PolarHBondContact O-N 3.44Å; H200-G204 PolarHBondContact O-N 3.11Å
201	S	81.8	Confident	73.1	Confident	81 Å²	81	81 Å²	81	57%	0.566	41%	0.41	S	S	*	.	H	α-helix	trans	-62.6	-47.5	176.9	-61.9	0	0	0	0	112.1	S197 K198 S203 G204 E205	S197-S201 PolarHBondContact O-N 3.22Å; S197-S201 VanDerWaalsContact O-N 3.08Å; S197-S201 PolarHBondContact O-OG 3.49Å; K198-S201 PolarHBondContact O-N 2.78Å; S201-S203 VanDerWaalsContact C-N 3.28Å; S201-S203 PolarHBondContact O-N 3.32Å; S201-G204 PolarHBondContact O-N 3.13Å; S201-G204 VanDerWaalsContact O-N 3.12Å; S201-E205 PolarHBondContact O-N 3.4Å
202	L	75.1	Confident	71.2	Confident	105 Å²	105	84.9 Å²	84.9	55%	0.55	43%	0.431	S	S	.	.	H	α-helix	trans	-62.9	-34	177	-66.5	171	0	0	0	112.6	K198	K198-L202 WeakPolarHBondContact O-CG 3.42Å; K198-L202 PolarHBondContact O-N 3.02Å; K198-L202 VanDerWaalsContact O-N 3.09Å
203	S	66	Low	68.7	Low	56 Å²	56	89.8 Å²	89.8	39%	0.392	46%	0.463	S	S	.	.	H	α-helix	trans	-75.4	-30.1	176.4	-58.5	0	0	0	0	112.5	L199 H200 S201 R207	L199-S203 VanDerWaalsContact O-CB 3.29Å; L199-S203 WeakPolarHBondContact O-CB 3.21Å; L199-S203 PolarHBondContact O-N 3.16Å; L199-S203 PolarHBondContact O-OG 3.03Å; H200-S203 PolarHBondContact O-N 3.44Å; S201-S203 VanDerWaalsContact C-N 3.28Å; S201-S203 PolarHBondContact O-N 3.32Å; S203-R207 PolarHBondContact O-N 2.96Å
204	G	56.7	Low	66.4	Low	34 Å²	34	100.8 Å²	100.8	35%	0.351	50%	0.504	S	S	.	.	H	α-helix	trans	-68.6	-37.7	176.1	0	0	0	0	0	113.1	H200 S201 R207 R208	H200-G204 PolarHBondContact O-N 3.11Å; S201-G204 PolarHBondContact O-N 3.13Å; S201-G204 VanDerWaalsContact O-N 3.12Å; G204-R207 PolarHBondContact O-N 3.29Å; G204-R208 PolarHBondContact O-N 3.39Å
205	E	49.9	Very low	64.1	Low	132 Å²	132	103.5 Å²	103.5	62%	0.617	53%	0.528	S	S	*	.	H	α-helix	trans	-65.4	-40	176	-73.2	-179.1	144.8	0	0	112.5	S201 R207 R208 A209	S201-E205 PolarHBondContact O-N 3.4Å; E205-R207 VanDerWaalsContact C-N 3.29Å; E205-R207 PolarHBondContact O-N 2.89Å; E205-R208 PolarHBondContact O-N 2.93Å; E205-R208 VanDerWaalsContact O-N 3.14Å; E205-A209 PolarHBondContact O-N 3.37Å
206	R	46.6	Very low	62.2	Low	197 Å²	197	112.3 Å²	112.3	74%	0.743	56%	0.559	S	S	*	*	H	α-helix	trans	-63.6	-32.2	175.1	-72.7	-173.9	-174.1	-172.6	1.3	113.1
207	R	44.8	Very low	60.3	Low	195 Å²	195	117.6 Å²	117.6	74%	0.736	60%	0.596	S	S	*	*	H	α-helix	trans	-77.9	-26.6	174.5	-68.8	-176	-174.8	161.1	2.2	112.9	S203 G204 E205 S210	S203-R207 PolarHBondContact O-N 2.96Å; G204-R207 PolarHBondContact O-N 3.29Å; E205-R207 VanDerWaalsContact C-N 3.29Å; E205-R207 PolarHBondContact O-N 2.89Å; R207-S210 PolarHBondContact O-OG 2.88Å
208	R	48.2	Very low	58.9	Low	207 Å²	207	120.7 Å²	120.7	78%	0.781	62%	0.616	S	S	*	*	H	α-helix	trans	-76.7	-25.9	172.1	-75.2	-175.9	171.5	-179.9	-0.8	113	G204 E205 S210 I211	G204-R208 PolarHBondContact O-N 3.39Å; E205-R208 PolarHBondContact O-N 2.93Å; E205-R208 VanDerWaalsContact O-N 3.14Å; R208-S210 VanDerWaalsContact C-N 3.31Å; R208-S210 PolarHBondContact O-N 2.84Å; R208-I211 WeakPolarHBondContact O-CG1 3.42Å
209	A	44	Very low	58.3	Low	89 Å²	89	120.3 Å²	120.3	74%	0.736	62%	0.618	S	S	*	*	S	Bend	trans	-75.1	-15.5	176.1	0	0	0	0	0	114	E205	E205-A209 PolarHBondContact O-N 3.37Å
210	S	46	Very low	57.2	Low	85 Å²	85	124.6 Å²	124.6	59%	0.594	64%	0.638	S	S	*	*			trans	-101.7	55.6	174	66.1	0	0	0	0	111.9	R207 R208 I212	R207-S210 PolarHBondContact O-OG 2.88Å; R208-S210 VanDerWaalsContact C-N 3.31Å; R208-S210 PolarHBondContact O-N 2.84Å; S210-I212 VanDerWaalsContact C-N 3.31Å; S210-I212 PolarHBondContact O-N 2.87Å
211	I	54.6	Low	56.5	Low	132 Å²	132	130.3 Å²	130.3	68%	0.677	67%	0.665	S	S	*	*			trans	-83.7	85.1	161.1	-58.9	166.5	0	0	0	106.4	R208 P213	R208-I211 WeakPolarHBondContact O-CG1 3.42Å; I211-P213 WeakPolarHBondContact O-CD 3.48Å
212	I	55.1	Low	56	Low	149 Å²	149	129.3 Å²	129.3	76%	0.764	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-62	118.8	148.2	-60.4	172.6	0	0	0	103.9	S210 R214	S210-I212 VanDerWaalsContact C-N 3.31Å; S210-I212 PolarHBondContact O-N 2.87Å; I212-R214 PolarHBondContact O-N 3.46Å
213	P	44.2	Very low	55.8	Low	103 Å²	103	128.7 Å²	128.7	67%	0.669	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-57.8	118.8	179.4	-17.5	28.6	0	0	0	107.6	I211	I211-P213 WeakPolarHBondContact O-CD 3.48Å
214	R	46.3	Very low	55.9	Low	231 Å²	231	132 Å²	132	87%	0.872	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-55.4	126.6	167.3	-80	-175.1	177.7	-175.4	0.2	106.6	I212 R216	I212-R214 PolarHBondContact O-N 3.46Å; R214-R216 PolarHBondContact O-N 3.45Å; R214-R216 VanDerWaalsContact O-N 3.12Å
215	P	46.5	Very low	56.8	Low	121 Å²	121	136.7 Å²	136.7	79%	0.786	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-56.3	125.4	177.1	21.2	-29.8	0	0	0	107.8	S217	P215-S217 PolarHBondContact O-N 2.91Å
216	R	53.3	Low	57.9	Low	243 Å²	243	138.7 Å²	138.7	92%	0.917	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-57.9	124.8	178.2	-72.1	-171.7	175.3	175.6	-0.8	108	R214	R214-R216 PolarHBondContact O-N 3.45Å; R214-R216 VanDerWaalsContact O-N 3.12Å
217	S	53.7	Low	59	Low	112 Å²	112	136 Å²	136	78%	0.783	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-50.9	124.1	173.2	-47.7	0	0	0	0	108.5	P215 N219	P215-S217 PolarHBondContact O-N 2.91Å; S217-N219 PolarHBondContact O-N 3.21Å
218	P	61.9	Low	60.3	Low	96 Å²	96	135.6 Å²	135.6	62%	0.623	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-61.3	141.4	-175.4	21.6	-30.7	0	0	0	110.2	M220	P218-M220 PolarHBondContact O-N 3.31Å; P218-M220 VanDerWaalsContact O-N 3.14Å
219	N	75.9	Confident	61.3	Low	86 Å²	86	131.9 Å²	131.9	46%	0.46	65%	0.651	S	S	.	*	P	Polyproline II helix	trans	-52	121.4	179.5	-178.8	-10.6	0	0	0	109.9	S217 Q221 D222 L223	S217-N219 PolarHBondContact O-N 3.21Å; N219-Q221 PolarHBondContact O-N 3.46Å; N219-Q221 VanDerWaalsContact O-N 3.1Å; N219-Q221 WeakPolarHBondContact OD1-CB 3.42Å; N219-Q221 PolarHBondContact OD1-N 2.95Å; N219-D222 HydrophobicContact CB-CB 4.37Å; N219-D222 PolarHBondContact O-N 3.34Å; N219-L223 PolarHBondContact O-N 2.72Å
220	M	63.9	Low	62.5	Low	132 Å²	132	130.8 Å²	130.8	65%	0.65	64%	0.642	S	S	*	*	H	α-helix	trans	-61.9	-22.4	-175.2	-171.6	151.1	49.2	0	0	112.3	P218 K224	P218-M220 PolarHBondContact O-N 3.31Å; P218-M220 VanDerWaalsContact O-N 3.14Å; M220-K224 WeakPolarHBondContact O-CB 3.47Å; M220-K224 VanDerWaalsContact O-CG 3.23Å; M220-K224 WeakPolarHBondContact O-CG 3.41Å; M220-K224 PolarHBondContact O-N 3.33Å
221	Q	71.9	Confident	63.4	Low	151 Å²	151	133 Å²	133	71%	0.706	65%	0.646	S	S	*	*	H	α-helix	trans	-72.3	-42.2	172.5	-61.4	-175.9	-2.8	0	0	112.2	N219 K224 R225	N219-Q221 PolarHBondContact O-N 3.46Å; N219-Q221 VanDerWaalsContact O-N 3.1Å; N219-Q221 WeakPolarHBondContact OD1-CB 3.42Å; N219-Q221 PolarHBondContact OD1-N 2.95Å; Q221-K224 PolarHBondContact O-N 3.07Å; Q221-R225 WeakPolarHBondContact O-CB 3.46Å; Q221-R225 PolarHBondContact O-N 3.26Å
222	D	71.6	Confident	63.8	Low	60 Å²	60	131.3 Å²	131.3	32%	0.321	65%	0.646	S	S	.	*	H	α-helix	trans	-67.8	-37.8	175.4	-79.3	-47.3	0	0	0	111.5	N219 R225 R226	N219-D222 HydrophobicContact CB-CB 4.37Å; N219-D222 PolarHBondContact O-N 3.34Å; D222-R225 PolarHBondContact O-N 3.11Å; D222-R225 IonicContact OD1-CZ 3.23Å; D222-R225 VanDerWaalsContact OD1-CZ 3.23Å; D222-R225 IonicContact OD1-NH1 2.74Å; D222-R225 PolarHBondContact OD1-NH1 3.11Å; D222-R225 IonicContact OD1-NH2 3.19Å; D222-R225 PolarHBondContact OD1-NH2 3.12Å; D222-R226 WeakPolarHBondContact O-CG 3.08Å; D222-R226 PolarHBondContact O-N 2.94Å
223	L	70.4	Confident	63.9	Low	92 Å²	92	129.1 Å²	129.1	48%	0.482	64%	0.644	S	S	.	*	H	α-helix	trans	-65.1	-45	175.8	-166.4	67.1	0	0	0	111.1	N219 R225 R226 F227	N219-L223 PolarHBondContact O-N 2.72Å; L223-R225 VanDerWaalsContact C-N 3.31Å; L223-R225 PolarHBondContact O-N 3.45Å; L223-R226 PolarHBondContact O-N 3.08Å; L223-F227 WeakPolarHBondContact O-CB 3.29Å; L223-F227 PolarHBondContact O-N 3.19Å
224	K	68.7	Low	64.6	Low	125 Å²	125	133.3 Å²	133.3	54%	0.543	65%	0.652	S	S	.	*	H	α-helix	trans	-63.3	-33.3	174	-77.4	178.4	179.1	-176	0	112.7	M220 Q221 R228	M220-K224 WeakPolarHBondContact O-CB 3.47Å; M220-K224 VanDerWaalsContact O-CG 3.23Å; M220-K224 WeakPolarHBondContact O-CG 3.41Å; M220-K224 PolarHBondContact O-N 3.33Å; Q221-K224 PolarHBondContact O-N 3.07Å; K224-R228 PolarHBondContact O-N 2.64Å
225	R	75.4	Confident	65	Low	133 Å²	133	128.9 Å²	128.9	50%	0.502	65%	0.65	S	S	.	*	H	α-helix	trans	-67.1	-48.4	174.6	-170.8	176	78.3	-128.4	-2.6	111	Q221 D222 L223 F227 R228 Q229	Q221-R225 WeakPolarHBondContact O-CB 3.46Å; Q221-R225 PolarHBondContact O-N 3.26Å; D222-R225 PolarHBondContact O-N 3.11Å; D222-R225 IonicContact OD1-CZ 3.23Å; D222-R225 VanDerWaalsContact OD1-CZ 3.23Å; D222-R225 IonicContact OD1-NH1 2.74Å; D222-R225 PolarHBondContact OD1-NH1 3.11Å; D222-R225 IonicContact OD1-NH2 3.19Å; D222-R225 PolarHBondContact OD1-NH2 3.12Å; L223-R225 VanDerWaalsContact C-N 3.31Å; L223-R225 PolarHBondContact O-N 3.45Å; R225-F227 PolarHBondContact O-N 3.41Å; R225-R228 PolarHBondContact O-N 3.23Å; R225-Q229 PolarHBondContact O-N 3.09Å
226	R	74.1	Confident	65.2	Low	173 Å²	173	133 Å²	133	65%	0.653	66%	0.656	S	S	*	*	H	α-helix	trans	-63.4	-40.7	179.1	-73.6	179.5	176.3	-170.1	-0.6	112.2	D222 L223 R228 Q229 A230	D222-R226 WeakPolarHBondContact O-CG 3.08Å; D222-R226 PolarHBondContact O-N 2.94Å; L223-R226 PolarHBondContact O-N 3.08Å; R226-R228 PolarHBondContact O-N 3.47Å; R226-Q229 PolarHBondContact O-N 2.99Å; R226-A230 PolarHBondContact O-N 3.35Å
227	F	69.5	Low	65.1	Low	142 Å²	142	125.8 Å²	125.8	62%	0.623	65%	0.648	S	S	*	*	H	α-helix	trans	-63.5	-41.7	176.6	-125.5	-88.2	0	0	0	112.3	L223 R225 A230 L231	L223-F227 WeakPolarHBondContact O-CB 3.29Å; L223-F227 PolarHBondContact O-N 3.19Å; R225-F227 PolarHBondContact O-N 3.41Å; F227-A230 PolarHBondContact O-N 3.07Å; F227-L231 HydrophobicContact CD1-CD1 4.13Å; F227-L231 WeakPolarHBondContact O-CG 3.39Å; F227-L231 PolarHBondContact O-N 3.48Å
228	R	70.8	Confident	64.8	Low	185 Å²	185	126.3 Å²	126.3	70%	0.698	65%	0.648	S	S	*	*	H	α-helix	trans	-65.6	-39.6	176	-84.8	-170.6	-82.7	-166.6	-2.9	112.9	K224 R225 R226 L231 S232	K224-R228 PolarHBondContact O-N 2.64Å; R225-R228 PolarHBondContact O-N 3.23Å; R226-R228 PolarHBondContact O-N 3.47Å; R228-L231 PolarHBondContact O-N 3.36Å; R228-S232 PolarHBondContact O-N 3.38Å
229	Q	70.5	Confident	64.3	Low	129 Å²	129	127.5 Å²	127.5	60%	0.603	66%	0.659	S	S	*	*	H	α-helix	trans	-64.5	-40.1	175.9	-81.8	179.5	-32.3	0	0	112.4	R225 R226 L231 S232	R225-Q229 PolarHBondContact O-N 3.09Å; R226-Q229 PolarHBondContact O-N 2.99Å; Q229-L231 VanDerWaalsContact C-N 3.32Å; Q229-L231 PolarHBondContact O-N 2.8Å; Q229-S232 PolarHBondContact O-N 3.09Å
230	A	68.3	Low	62.9	Low	67 Å²	67	128.2 Å²	128.2	55%	0.554	68%	0.677	S	S	*	*	H	α-helix	trans	-67.6	-29.5	178.5	0	0	0	0	0	113.6	R226 F227 S233	R226-A230 PolarHBondContact O-N 3.35Å; F227-A230 PolarHBondContact O-N 3.07Å; A230-S233 PolarHBondContact O-OG 3.32Å
231	L	65.9	Low	62.3	Low	131 Å²	131	130.6 Å²	130.6	69%	0.686	69%	0.692	S	S	*	*	H	α-helix	trans	-82.2	-19.8	176.8	-68.4	171	0	0	0	113	F227 R228 Q229	F227-L231 HydrophobicContact CD1-CD1 4.13Å; F227-L231 WeakPolarHBondContact O-CG 3.39Å; F227-L231 PolarHBondContact O-N 3.48Å; R228-L231 PolarHBondContact O-N 3.36Å; Q229-L231 VanDerWaalsContact C-N 3.32Å; Q229-L231 PolarHBondContact O-N 2.8Å
232	S	62.8	Low	61	Low	97 Å²	97	130.9 Å²	130.9	68%	0.678	74%	0.735	S	S	*	*	H	α-helix	trans	-84	-15.7	179.6	-170	0	0	0	0	113.8	R228 Q229 K234	R228-S232 PolarHBondContact O-N 3.38Å; Q229-S232 PolarHBondContact O-N 3.09Å; S232-K234 VanDerWaalsContact C-N 3.26Å; S232-K234 PolarHBondContact O-N 3.28Å
233	S	57.2	Low	60.4	Low	102 Å²	102	134.4 Å²	134.4	71%	0.713	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	11	-175.6	60.2	0	0	0	0	114.4	A230	A230-S233 PolarHBondContact O-OG 3.32Å
234	K	57.6	Low	59.9	Low	192 Å²	192	136.6 Å²	136.6	84%	0.835	77%	0.77	S	S	*	*			trans	-124.2	44.7	-176.1	-130.7	175.2	-172	179.9	0	113.5	S232	S232-K234 VanDerWaalsContact C-N 3.26Å; S232-K234 PolarHBondContact O-N 3.28Å
235	V	55.8	Low	59.4	Low	138 Å²	138	137.3 Å²	137.3	84%	0.836	78%	0.782	S	S	*	*			trans	-140	83.8	160.1	-171.7	0	0	0	0	109.4
236	K	49.6	Very low	58.5	Low	207 Å²	207	137.5 Å²	137.5	90%	0.9	80%	0.799	S	S	*	*			trans	-150.7	89.7	153.5	-133.7	178.3	-175.7	-177.3	0	107.5
237	A	51.3	Low	57.5	Low	91 Å²	91	135.3 Å²	135.3	75%	0.752	81%	0.808	S	S	*	*			trans	-66.8	143.1	170	0	0	0	0	0	109.2
238	P	48.8	Very low	56.7	Low	123 Å²	123	134.9 Å²	134.9	80%	0.799	82%	0.82	S	S	*	*			trans	-76.7	129.5	176.4	30.1	-30.1	0	0	0	110.2	A240	P238-A240 PolarHBondContact O-N 2.91Å
239	S	49.8	Very low	55.7	Low	122 Å²	122	131.3 Å²	131.3	85%	0.853	83%	0.829	S	S	*	*			trans	-72.3	108.8	160.6	51.1	0	0	0	0	108.7
240	A	47.3	Very low	54.6	Low	101 Å²	101	131.5 Å²	131.5	84%	0.835	85%	0.846	S	S	*	*			trans	-96.1	111	165.1	0	0	0	0	0	108.7	P238	P238-A240 PolarHBondContact O-N 2.91Å
241	L	51.3	Low	53.4	Low	182 Å²	182	136.8 Å²	136.8	95%	0.953	87%	0.871	S	S	*	*			trans	-100.3	131.5	156.9	-87.2	158	0	0	0	106.3
242	G	43.8	Very low	52.3	Low	156 Å²	156	137.4 Å²	137.4	100%	1.608	89%	0.888	S	S	*	*			trans	158.5	0	178.5	0	0	0	0	0	110.3

Retrieved 242 of 242 residues in 65.2 ms (Link to these results)

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