A0A077Z4R3_TRITR Loading...

Protein BTG1

AlphaFold DB , UniProt , Accession A0A077Z4R3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 332 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	35.8	Very low	34.4	Very low	245 Å²	245	151.8 Å²	151.8	100%	1.207	85%	0.851	S	S	*	*				0	97.4	0	-74.7	175.8	171.3	0	0	106.4
2	S	39.3	Very low	34.3	Very low	115 Å²	115	149.8 Å²	149.8	80%	0.804	84%	0.844	S	S	*	*			trans	-139	139.3	-166.8	0.5	0	0	0	0	108.9
3	Y	30	Very low	34.3	Very low	222 Å²	222	150.1 Å²	150.1	87%	0.871	84%	0.84	S	S	*	*			trans	-56.5	144.7	-172.7	-69.8	-95.3	0	0	0	115.2
4	S	38.3	Very low	34.4	Very low	121 Å²	121	146.8 Å²	146.8	85%	0.846	83%	0.832	S	S	*	*			trans	-136	110.1	152.4	-58.7	0	0	0	0	109.2
5	R	34	Very low	34.3	Very low	234 Å²	234	149.5 Å²	149.5	88%	0.883	84%	0.835	S	S	*	*			trans	-74.2	133.5	165.8	-64.4	178.2	-171.5	-153.2	0.9	108.4
6	L	39.2	Very low	34.1	Very low	179 Å²	179	152.4 Å²	152.4	94%	0.937	84%	0.836	S	S	*	*			trans	-134.4	130.7	152.6	-73.3	176.2	0	0	0	108.6
7	S	31.5	Very low	34.1	Very low	105 Å²	105	148.8 Å²	148.8	73%	0.734	82%	0.824	S	S	*	*			trans	-110	142.7	-174	-170.8	0	0	0	0	109.2
8	S	30	Very low	34.2	Very low	98 Å²	98	149.9 Å²	149.9	69%	0.685	83%	0.829	S	S	*	*			trans	67.1	139.1	159.5	-55.7	0	0	0	0	117.8
9	P	33.7	Very low	34.3	Very low	126 Å²	126	151.3 Å²	151.3	82%	0.818	83%	0.825	S	S	*	*				-135.3	138.9	80.7	31.4	-14.5	0	0	0	114.9
10	S	29.2	Very low	34.3	Very low	107 Å²	107	152.5 Å²	152.5	75%	0.748	83%	0.825	S	S	*	*			trans	-52.9	132.3	163.1	-51.6	0	0	0	0	112
11	S	37.2	Very low	34.3	Very low	118 Å²	118	154.4 Å²	154.4	83%	0.825	83%	0.829	S	S	*	*			trans	-116	119.3	156.6	-90.3	0	0	0	0	109.1	I13	S11-I13 PolarHBondContact O-N 2.94Å
12	V	33.8	Very low	34.3	Very low	127 Å²	127	150 Å²	150	77%	0.77	81%	0.81	S	S	*	*			trans	-65.4	112.1	-176.1	176.8	0	0	0	0	109.4
13	I	34	Very low	34.2	Very low	154 Å²	154	151.9 Å²	151.9	79%	0.79	81%	0.806	S	S	*	*			trans	-94.4	103	161	-69.2	173.8	0	0	0	106	S11 Q15	S11-I13 PolarHBondContact O-N 2.94Å; I13-Q15 PolarHBondContact O-N 2.97Å
14	S	35.3	Very low	34.7	Very low	104 Å²	104	146.3 Å²	146.3	73%	0.727	80%	0.8	S	S	*	*			trans	-57.8	99.6	172.6	-76.7	0	0	0	0	110.1	K16	S14-K16 PolarHBondContact O-N 3.14Å
15	Q	34.2	Very low	35	Very low	187 Å²	187	142.6 Å²	142.6	87%	0.874	78%	0.776	S	S	*	*			trans	-67.7	107.8	160.5	-67.9	179.9	-55.1	0	0	107	I13 S17	I13-Q15 PolarHBondContact O-N 2.97Å; Q15-S17 PolarHBondContact O-N 3.47Å
16	K	30.6	Very low	35.4	Very low	196 Å²	196	142.3 Å²	142.3	85%	0.852	78%	0.775	S	S	*	*			trans	-57.2	120.1	165.5	-85.2	179.5	172.1	-179.5	0	107	S14 D18	S14-K16 PolarHBondContact O-N 3.14Å; K16-D18 PolarHBondContact O-N 3.14Å
17	S	33.8	Very low	35.9	Very low	92 Å²	92	138.2 Å²	138.2	64%	0.643	76%	0.758	S	S	*	*			trans	-55.9	123.6	179.6	50	0	0	0	0	111.7	Q15 K19	Q15-S17 PolarHBondContact O-N 3.47Å; S17-K19 PolarHBondContact O-N 2.96Å
18	D	35.7	Very low	37.3	Very low	168 Å²	168	134.2 Å²	134.2	90%	0.898	73%	0.729	S	S	*	*			trans	-67.2	49.6	166	-63.1	-52.5	0	0	0	112.2	K16	K16-D18 PolarHBondContact O-N 3.14Å
19	K	35.5	Very low	39.6	Very low	176 Å²	176	133.9 Å²	133.9	77%	0.765	72%	0.719	S	S	*	*			trans	-97.4	2.8	179.8	-97.5	-167.9	175.4	-174.8	0	114.6	S17	S17-K19 PolarHBondContact O-N 2.96Å
20	E	35.5	Very low	42.4	Very low	175 Å²	175	128.3 Å²	128.3	82%	0.818	68%	0.682	S	S	*	*	S	Bend	trans	-105.2	-3.3	-175.9	-76.8	-178.7	137.9	0	0	115.7
21	Q	33.7	Very low	45.3	Very low	193 Å²	193	125 Å²	125	90%	0.902	66%	0.655	S	S	*	*	S	Bend	trans	-103.4	3.6	-175.7	-85.8	-168.2	11.8	0	0	118
22	N	37	Very low	47.9	Very low	152 Å²	152	121.5 Å²	121.5	81%	0.813	63%	0.633	S	S	*	*			trans	-120.6	33.7	173.7	-152.4	10.3	0	0	0	114.4	S24	N22-S24 VanDerWaalsContact C-N 3.31Å
23	Q	35.1	Very low	50.8	Low	156 Å²	156	116 Å²	116	73%	0.729	60%	0.599	S	S	*	*			trans	-97.2	27.4	164.4	-66	-176	47.3	0	0	111.5	A25	Q23-A25 VanDerWaalsContact C-N 3.28Å; Q23-A25 PolarHBondContact O-N 2.87Å
24	S	42.1	Very low	53.8	Low	105 Å²	105	108.7 Å²	108.7	73%	0.734	56%	0.562	S	S	*	*	S	Bend	trans	-53.6	106.9	155.8	-179.6	0	0	0	0	105.6	N22 R26	N22-S24 VanDerWaalsContact C-N 3.31Å; S24-R26 PolarHBondContact O-N 3.08Å
25	A	43.5	Very low	56.7	Low	43 Å²	43	104.8 Å²	104.8	36%	0.355	53%	0.534	S	S	.	.			trans	-52.7	129.9	-159.3	0	0	0	0	0	109.5	Q23 T27	Q23-A25 VanDerWaalsContact C-N 3.28Å; Q23-A25 PolarHBondContact O-N 2.87Å; A25-T27 PolarHBondContact O-N 3.19Å; A25-T27 PolarHBondContact O-OG1 2.7Å
26	R	42.8	Very low	59.6	Low	228 Å²	228	96.9 Å²	96.9	86%	0.86	50%	0.501	S	S	*	.			trans	-63.1	78.3	169.9	-74.6	177.9	161.9	169.7	-5.7	108.6	S24	S24-R26 PolarHBondContact O-N 3.08Å
27	T	50.6	Low	62.8	Low	93 Å²	93	87.5 Å²	87.5	57%	0.571	46%	0.46	S	S	*	.			trans	-53.7	126.6	159.6	-11.2	0	0	0	0	104.7	A25 L29 E31	A25-T27 PolarHBondContact O-N 3.19Å; A25-T27 PolarHBondContact O-OG1 2.7Å; T27-L29 PolarHBondContact O-N 3.14Å; T27-E31 HydrophobicContact CG2-CB 4.02Å; T27-E31 HydrophobicContact CG2-CG 4.02Å; T27-E31 WeakPolarHBondContact CG2-OE2 3.43Å
28	P	61.1	Low	65.9	Low	20 Å²	20	83.2 Å²	83.2	13%	0.13	43%	0.43	C	S	.	.			trans	-48	140.9	172.5	-16.2	25.2	0	0	0	108.9	M30 E31 W230	P28-M30 HydrophobicContact CB-CG 4.29Å; P28-M30 PolarHBondContact O-N 3.39Å; P28-E31 HydrophobicContact CB-CB 4.19Å; P28-E31 WeakPolarHBondContact CD-OE2 3.38Å; P28-E31 HydrophobicContact CG-CB 3.95Å; P28-E31 PolarHBondContact O-N 3.12Å; P28-W230 HydrophobicContact CB-CZ2 3.66Å; P28-W230 HydrophobicContact CG-CZ2 3.49Å; P28-W230 VanDerWaalsContact CG-CZ2 3.49Å
29	L	77.2	Confident	68.7	Low	92 Å²	92	78.2 Å²	78.2	48%	0.482	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	2.6	179.3	-75.1	168.3	0	0	0	115.1	T27 W74 V148	T27-L29 PolarHBondContact O-N 3.14Å; L29-W74 PolarHBondContact O-NE1 2.78Å; L29-V148 HydrophobicContact CD2-CB 4.34Å; L29-V148 HydrophobicContact CD2-CG1 3.96Å
30	M	91.6	Very high	71.6	Confident	8 Å²	8	70 Å²	70	4%	0.039	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132.8	-2.8	-177.1	70.5	-177	120.2	0	0	113.5	P28 A32 E33 V34 L67 F71 W74 W230	P28-M30 HydrophobicContact CB-CG 4.29Å; P28-M30 PolarHBondContact O-N 3.39Å; M30-A32 VanDerWaalsContact C-N 3.31Å; M30-A32 PolarHBondContact O-N 3Å; M30-E33 VanDerWaalsContact C-OE2 3.25Å; M30-E33 VanDerWaalsContact CA-OE2 3.3Å; M30-E33 WeakPolarHBondContact CA-OE2 3.35Å; M30-E33 PolarHBondContact O-N 3.11Å; M30-V34 HydrophobicContact CB-CG2 4.49Å; M30-V34 HydrophobicContact CG-CG2 4.3Å; M30-V34 WeakPolarHBondContact O-CB 3.41Å; M30-V34 VanDerWaalsContact O-CG2 3.31Å; M30-V34 WeakPolarHBondContact O-CG2 3.31Å; M30-V34 PolarHBondContact O-N 2.84Å; M30-L67 HydrophobicContact CG-CD2 3.67Å; M30-L67 HydrophobicContact SD-CD2 4.06Å; M30-F71 HydrophobicContact CE-CB 4.22Å; M30-F71 HydrophobicContact CE-CD2 4.11Å; M30-W74 HydrophobicContact CB-CD2 3.55Å; M30-W74 HydrophobicContact CB-CE3 3.9Å; M30-W74 HydrophobicContact CB-CG 4.14Å; M30-W74 HydrophobicContact CB-CH2 3.77Å; M30-W74 HydrophobicContact CB-CZ2 3.37Å; M30-W74 HydrophobicContact CB-CZ3 4Å; M30-W230 HydrophobicContact CE-CH2 4.07Å; M30-W230 HydrophobicContact CE-CZ3 4.46Å
31	E	91.3	Very high	74.5	Confident	39 Å²	39	61.7 Å²	61.7	18%	0.182	33%	0.329	C	S	.	.	H	α-helix	trans	-67.5	-33.9	-170.3	171.3	168.3	-171.4	0	0	112.2	T27 P28 S35 K63 L67	T27-E31 HydrophobicContact CG2-CB 4.02Å; T27-E31 HydrophobicContact CG2-CG 4.02Å; T27-E31 WeakPolarHBondContact CG2-OE2 3.43Å; P28-E31 HydrophobicContact CB-CB 4.19Å; P28-E31 WeakPolarHBondContact CD-OE2 3.38Å; P28-E31 HydrophobicContact CG-CB 3.95Å; P28-E31 PolarHBondContact O-N 3.12Å; E31-S35 WeakPolarHBondContact O-CB 3.48Å; E31-S35 PolarHBondContact O-N 3.34Å; E31-S35 PolarHBondContact O-OG 3.02Å; E31-K63 WeakPolarHBondContact OE1-CE 3.38Å; E31-K63 IonicContact OE1-NZ 2.63Å; E31-K63 PolarHBondContact OE1-NZ 3.08Å; E31-L67 HydrophobicContact CB-CD2 4.45Å
32	A	92.5	Very high	77.4	Confident	44 Å²	44	52.5 Å²	52.5	36%	0.364	29%	0.286	S	S	.	.	H	α-helix	trans	-66.6	-46.3	179	0	0	0	0	0	110.8	M30 S35 A36 Y143	M30-A32 VanDerWaalsContact C-N 3.31Å; M30-A32 PolarHBondContact O-N 3Å; A32-S35 PolarHBondContact O-N 3.01Å; A32-A36 WeakPolarHBondContact O-CB 3.44Å; A32-A36 PolarHBondContact O-N 3.02Å; A32-Y143 VanDerWaalsContact CB-OH 3.29Å; A32-Y143 WeakPolarHBondContact CB-OH 3.48Å
33	E	94.8	Very high	80.1	Confident	12 Å²	12	47.6 Å²	47.6	6%	0.056	26%	0.26	C	S	.	.	H	α-helix	trans	-65.9	-46.5	178.2	-61	92.2	150	0	0	111.5	M30 S35 A36 A37 W74 V124 G127 V129 Y143	M30-E33 VanDerWaalsContact C-OE2 3.25Å; M30-E33 VanDerWaalsContact CA-OE2 3.3Å; M30-E33 WeakPolarHBondContact CA-OE2 3.35Å; M30-E33 PolarHBondContact O-N 3.11Å; E33-S35 VanDerWaalsContact C-N 3.31Å; E33-S35 PolarHBondContact O-N 2.89Å; E33-A36 PolarHBondContact O-N 2.7Å; E33-A37 WeakPolarHBondContact O-CB 3.25Å; E33-A37 PolarHBondContact O-N 2.97Å; E33-W74 HydrophobicContact CB-CH2 3.92Å; E33-W74 HydrophobicContact CB-CZ2 4.33Å; E33-W74 HydrophobicContact CG-CH2 4.15Å; E33-W74 HydrophobicContact CG-CZ2 4.18Å; E33-V124 HydrophobicContact CB-CG1 3.99Å; E33-G127 PolarHBondContact OE1-N 3.4Å; E33-V129 HydrophobicContact CB-CG2 3.85Å; E33-V129 HydrophobicContact CG-CG2 4.42Å; E33-V129 VanDerWaalsContact O-CG2 3.32Å; E33-V129 WeakPolarHBondContact O-CG2 3.18Å; E33-Y143 HydrophobicContact CG-CD1 4.21Å; E33-Y143 HydrophobicContact CG-CE1 3.87Å
34	V	96.4	Very high	82.7	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-61.7	-42.3	175.7	170.4	0	0	0	0	110.7	M30 A37 V38 K63 L66 L67 Y70 V124	M30-V34 HydrophobicContact CB-CG2 4.49Å; M30-V34 HydrophobicContact CG-CG2 4.3Å; M30-V34 WeakPolarHBondContact O-CB 3.41Å; M30-V34 VanDerWaalsContact O-CG2 3.31Å; M30-V34 WeakPolarHBondContact O-CG2 3.31Å; M30-V34 PolarHBondContact O-N 2.84Å; V34-A37 PolarHBondContact O-N 3.45Å; V34-V38 HydrophobicContact CG1-CG2 4.26Å; V34-V38 WeakPolarHBondContact O-CB 3.22Å; V34-V38 WeakPolarHBondContact O-CG2 3.17Å; V34-V38 PolarHBondContact O-N 3.13Å; V34-K63 HydrophobicContact CG1-CG 4.17Å; V34-L66 HydrophobicContact CG1-CB 3.77Å; V34-L66 HydrophobicContact CG1-CD1 4.24Å; V34-L66 HydrophobicContact CG2-CB 4.36Å; V34-L67 HydrophobicContact CB-CD2 4.17Å; V34-L67 HydrophobicContact CG1-CD2 4.27Å; V34-L67 HydrophobicContact CG1-CG 4.13Å; V34-L67 HydrophobicContact CG2-CD2 4.12Å; V34-Y70 HydrophobicContact CG2-CD2 4.06Å; V34-Y70 HydrophobicContact CG2-CE2 4.46Å; V34-V124 HydrophobicContact CG2-CG1 4.12Å
35	S	96	Very high	85.1	Confident	22 Å²	22	35.3 Å²	35.3	15%	0.154	19%	0.191	C	C	.	.	H	α-helix	trans	-66	-40.5	178.4	-58.8	0	0	0	0	111.5	E31 A32 E33 V38 N39 K63	E31-S35 WeakPolarHBondContact O-CB 3.48Å; E31-S35 PolarHBondContact O-N 3.34Å; E31-S35 PolarHBondContact O-OG 3.02Å; A32-S35 PolarHBondContact O-N 3.01Å; E33-S35 VanDerWaalsContact C-N 3.31Å; E33-S35 PolarHBondContact O-N 2.89Å; S35-V38 PolarHBondContact O-N 2.94Å; S35-N39 VanDerWaalsContact O-CB 3.25Å; S35-N39 WeakPolarHBondContact O-CB 3.41Å; S35-N39 PolarHBondContact O-N 2.98Å; S35-N39 PolarHBondContact O-ND2 3.47Å; S35-K63 WeakPolarHBondContact OG-CE 3.33Å; S35-K63 PolarHBondContact OG-NZ 3.11Å
36	A	95.2	Very high	87.1	Confident	20 Å²	20	39.3 Å²	39.3	17%	0.165	21%	0.205	C	C	.	.	H	α-helix	trans	-60.8	-46.1	175.6	0	0	0	0	0	111.7	A32 E33 N39 F40 V129 Y143	A32-A36 WeakPolarHBondContact O-CB 3.44Å; A32-A36 PolarHBondContact O-N 3.02Å; E33-A36 PolarHBondContact O-N 2.7Å; A36-N39 PolarHBondContact O-N 3.29Å; A36-F40 WeakPolarHBondContact O-CB 3.29Å; A36-F40 PolarHBondContact O-N 3.2Å; A36-V129 HydrophobicContact CB-CG2 4.19Å; A36-Y143 HydrophobicContact CB-CD1 4.32Å; A36-Y143 HydrophobicContact CB-CD2 3.72Å; A36-Y143 HydrophobicContact CB-CE2 4.47Å; A36-Y143 HydrophobicContact CB-CG 3.63Å
37	A	97.5	Very high	88.9	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-61.6	-45.6	176.7	0	0	0	0	0	112.5	E33 V34 L41 L122 V124 V129	E33-A37 WeakPolarHBondContact O-CB 3.25Å; E33-A37 PolarHBondContact O-N 2.97Å; V34-A37 PolarHBondContact O-N 3.45Å; A37-L41 WeakPolarHBondContact O-CG 3.22Å; A37-L41 PolarHBondContact O-N 3.31Å; A37-L41 VanDerWaalsContact O-N 3.16Å; A37-L122 HydrophobicContact CB-CD2 3.81Å; A37-V124 HydrophobicContact CB-CG1 4.37Å; A37-V124 HydrophobicContact CB-CG2 3.54Å; A37-V129 HydrophobicContact CB-CG1 3.94Å
38	V	98	Very high	90.5	Very high	1 Å²	1	32 Å²	32	1%	0.006	17%	0.173	C	C	.	.	H	α-helix	trans	-65.5	-44.9	178.9	171.2	0	0	0	0	111.1	V34 S35 F40 L41 C42 R59 L62 K63 L66	V34-V38 HydrophobicContact CG1-CG2 4.26Å; V34-V38 WeakPolarHBondContact O-CB 3.22Å; V34-V38 WeakPolarHBondContact O-CG2 3.17Å; V34-V38 PolarHBondContact O-N 3.13Å; S35-V38 PolarHBondContact O-N 2.94Å; V38-F40 VanDerWaalsContact C-N 3.34Å; V38-F40 PolarHBondContact O-N 2.97Å; V38-L41 PolarHBondContact O-N 3.07Å; V38-C42 PolarHBondContact O-N 3.36Å; V38-C42 PolarHBondContact O-SG 3.27Å; V38-C42 VanDerWaalsContact O-SG 3.41Å; V38-R59 HydrophobicContact CG1-CB 4.3Å; V38-R59 HydrophobicContact CG1-CG 3.59Å; V38-L62 HydrophobicContact CG2-CB 4.31Å; V38-L62 HydrophobicContact CG2-CD2 4.1Å; V38-L62 HydrophobicContact CG2-CG 3.95Å; V38-K63 HydrophobicContact CG2-CB 4.19Å; V38-L66 HydrophobicContact CG2-CD1 3.91Å
39	N	95.8	Very high	91.6	Very high	64 Å²	64	36.9 Å²	36.9	34%	0.342	21%	0.206	S	C	.	.	H	α-helix	trans	-61.8	-45.2	179.5	-71.1	-16.2	0	0	0	111.1	S35 A36 L41 C42 D43 R59	S35-N39 VanDerWaalsContact O-CB 3.25Å; S35-N39 WeakPolarHBondContact O-CB 3.41Å; S35-N39 PolarHBondContact O-N 2.98Å; S35-N39 PolarHBondContact O-ND2 3.47Å; A36-N39 PolarHBondContact O-N 3.29Å; N39-L41 VanDerWaalsContact C-N 3.33Å; N39-L41 PolarHBondContact O-N 3.34Å; N39-C42 CarbonylContact O-C 3.41Å; N39-C42 PolarHBondContact O-N 3.33Å; N39-C42 VanDerWaalsContact O-N 3.13Å; N39-D43 PolarHBondContact O-N 2.83Å; N39-R59 PolarHBondContact OD1-NH1 3.13Å
40	F	95.7	Very high	92.1	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.009	19%	0.191	C	C	.	.	H	α-helix	trans	-55.3	-47.4	174.8	170	-105.4	0	0	0	112.2	A36 V38 C42 D43 L44 L122 V131 F133 I142 A304 L307	A36-F40 WeakPolarHBondContact O-CB 3.29Å; A36-F40 PolarHBondContact O-N 3.2Å; V38-F40 VanDerWaalsContact C-N 3.34Å; V38-F40 PolarHBondContact O-N 2.97Å; F40-C42 PolarHBondContact O-N 3.06Å; F40-D43 PolarHBondContact O-N 2.92Å; F40-L44 HydrophobicContact CE1-CD1 4.17Å; F40-L44 HydrophobicContact CE2-CD2 4.34Å; F40-L44 HydrophobicContact CZ-CD1 4.1Å; F40-L44 HydrophobicContact CZ-CD2 4.4Å; F40-L44 HydrophobicContact CZ-CG 4.44Å; F40-L44 WeakPolarHBondContact O-CG 3.33Å; F40-L44 PolarHBondContact O-N 3.4Å; F40-L122 HydrophobicContact CD1-CD1 3.95Å; F40-L122 HydrophobicContact CD1-CD2 4.16Å; F40-L122 HydrophobicContact CE1-CD1 4.13Å; F40-V131 HydrophobicContact CE1-CB 4.5Å; F40-V131 HydrophobicContact CE1-CG2 3.77Å; F40-V131 HydrophobicContact CZ-CG2 3.9Å; F40-F133 HydrophobicContact CE2-CZ 4.39Å; F40-F133 HydrophobicContact CZ-CE1 4.27Å; F40-F133 AromaticContact CZ-CZ 3.72Å; F40-F133 HydrophobicContact CZ-CZ 3.72Å; F40-I142 HydrophobicContact CB-CD1 3.57Å; F40-I142 HydrophobicContact CD1-CD1 3.81Å; F40-I142 HydrophobicContact CD2-CD1 3.96Å; F40-I142 HydrophobicContact CG-CD1 3.48Å; F40-I142 VanDerWaalsContact CG-CD1 3.48Å; F40-A304 HydrophobicContact CE2-CB 3.97Å; F40-L307 HydrophobicContact CB-CD1 4.38Å; F40-L307 HydrophobicContact CD2-CD1 3.71Å; F40-L307 HydrophobicContact CG-CD1 4.5Å
41	L	96.7	Very high	92	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.01	21%	0.21	C	C	.	.	H	α-helix	trans	-63.9	-40.2	176.7	-68.9	174.1	0	0	0	112.4	A37 V38 N39 D43 L44 L62 L88 V98 F116 L120 L122	A37-L41 WeakPolarHBondContact O-CG 3.22Å; A37-L41 PolarHBondContact O-N 3.31Å; A37-L41 VanDerWaalsContact O-N 3.16Å; V38-L41 PolarHBondContact O-N 3.07Å; N39-L41 VanDerWaalsContact C-N 3.33Å; N39-L41 PolarHBondContact O-N 3.34Å; L41-D43 VanDerWaalsContact C-N 3.35Å; L41-L44 WeakPolarHBondContact O-CB 3.29Å; L41-L44 PolarHBondContact O-N 3.16Å; L41-L62 HydrophobicContact CD1-CD2 3.78Å; L41-L88 HydrophobicContact CD1-CD1 3.96Å; L41-V98 HydrophobicContact CD1-CG2 4.41Å; L41-F116 HydrophobicContact CB-CZ 4.3Å; L41-F116 HydrophobicContact CD2-CE1 4.38Å; L41-F116 HydrophobicContact CD2-CZ 4.19Å; L41-F116 WeakPolarHBondContact O-CE1 3.42Å; L41-L120 HydrophobicContact CD2-CD2 4.08Å; L41-L122 HydrophobicContact CD1-CD2 4.15Å; L41-L122 HydrophobicContact CD2-CD2 4.37Å; L41-L122 HydrophobicContact CG-CD2 4.07Å
42	C	95.5	Very high	92	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-65.3	-36.1	175.6	-74	0	0	0	0	112.6	V38 N39 F40 L44 L45 V55	V38-C42 PolarHBondContact O-N 3.36Å; V38-C42 PolarHBondContact O-SG 3.27Å; V38-C42 VanDerWaalsContact O-SG 3.41Å; N39-C42 CarbonylContact O-C 3.41Å; N39-C42 PolarHBondContact O-N 3.33Å; N39-C42 VanDerWaalsContact O-N 3.13Å; F40-C42 PolarHBondContact O-N 3.06Å; C42-L44 VanDerWaalsContact C-N 3.26Å; C42-L44 PolarHBondContact O-N 3.47Å; C42-L45 WeakPolarHBondContact O-CA 3.46Å; C42-L45 VanDerWaalsContact O-CB 3.24Å; C42-L45 WeakPolarHBondContact O-CB 3.25Å; C42-L45 PolarHBondContact O-N 3.04Å; C42-V55 HydrophobicContact CB-CG1 4.22Å
43	D	92	Very high	91.9	Very high	49 Å²	49	44.1 Å²	44.1	26%	0.262	24%	0.244	S	C	.	.	H	α-helix	trans	-66	-32.4	178.4	-67.1	-16.8	0	0	0	111.3	N39 F40 L41 L45 L46	N39-D43 PolarHBondContact O-N 2.83Å; F40-D43 PolarHBondContact O-N 2.92Å; L41-D43 VanDerWaalsContact C-N 3.35Å; D43-L45 PolarHBondContact O-N 2.98Å; D43-L46 HydrophobicContact CB-CD1 4.48Å; D43-L46 WeakPolarHBondContact O-CB 3.23Å; D43-L46 WeakPolarHBondContact O-CG 3.41Å; D43-L46 PolarHBondContact O-N 3.3Å
44	L	91.4	Very high	91.8	Very high	2 Å²	2	43.6 Å²	43.6	1%	0.01	24%	0.241	C	C	.	.	H	α-helix	trans	-64	-28.1	170.6	-58.9	-174.6	0	0	0	112.4	F40 L41 C42 L46 F116 L120 C300 L303	F40-L44 HydrophobicContact CE1-CD1 4.17Å; F40-L44 HydrophobicContact CE2-CD2 4.34Å; F40-L44 HydrophobicContact CZ-CD1 4.1Å; F40-L44 HydrophobicContact CZ-CD2 4.4Å; F40-L44 HydrophobicContact CZ-CG 4.44Å; F40-L44 WeakPolarHBondContact O-CG 3.33Å; F40-L44 PolarHBondContact O-N 3.4Å; L41-L44 WeakPolarHBondContact O-CB 3.29Å; L41-L44 PolarHBondContact O-N 3.16Å; C42-L44 VanDerWaalsContact C-N 3.26Å; C42-L44 PolarHBondContact O-N 3.47Å; L44-L46 VanDerWaalsContact C-N 3.27Å; L44-L46 PolarHBondContact O-N 2.99Å; L44-F116 HydrophobicContact CB-CD1 3.88Å; L44-F116 HydrophobicContact CB-CE1 3.83Å; L44-F116 HydrophobicContact CD1-CD1 3.79Å; L44-F116 HydrophobicContact CD1-CE1 4.15Å; L44-F116 HydrophobicContact CG-CD1 4.49Å; L44-L120 HydrophobicContact CD1-CD2 4.14Å; L44-C300 HydrophobicContact CD2-CB 3.84Å; L44-L303 HydrophobicContact CD2-CD1 3.68Å
45	L	92.1	Very high	91.7	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-72.6	-17.3	178.9	-57.5	-178.1	0	0	0	113.3	C42 D43 K47 V48 L50 F58 I112 A115 F116	C42-L45 WeakPolarHBondContact O-CA 3.46Å; C42-L45 VanDerWaalsContact O-CB 3.24Å; C42-L45 WeakPolarHBondContact O-CB 3.25Å; C42-L45 PolarHBondContact O-N 3.04Å; D43-L45 PolarHBondContact O-N 2.98Å; L45-K47 PolarHBondContact O-N 3.2Å; L45-V48 PolarHBondContact O-N 3.24Å; L45-L50 HydrophobicContact CB-CD1 4.07Å; L45-L50 HydrophobicContact CD1-CD1 4.32Å; L45-L50 HydrophobicContact CD2-CD1 4.38Å; L45-L50 HydrophobicContact CG-CD1 4.49Å; L45-F58 HydrophobicContact CD1-CD1 3.71Å; L45-F58 HydrophobicContact CD1-CE1 3.87Å; L45-F58 HydrophobicContact CD1-CG 4.42Å; L45-I112 HydrophobicContact CD1-CD1 3.69Å; L45-I112 HydrophobicContact CD2-CD1 3.65Å; L45-I112 HydrophobicContact CD2-CG2 4.34Å; L45-I112 HydrophobicContact CG-CD1 4.34Å; L45-A115 HydrophobicContact CD2-CB 3.46Å; L45-A115 VanDerWaalsContact CD2-CB 3.46Å; L45-F116 HydrophobicContact CD2-CE1 3.63Å; L45-F116 HydrophobicContact CD2-CZ 3.81Å; L45-F116 HydrophobicContact CG-CE1 4.3Å; L45-F116 HydrophobicContact CG-CZ 4.49Å
46	L	85.1	Confident	91.7	Very high	126 Å²	126	47.1 Å²	47.1	66%	0.66	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-13.4	-178.2	-63.6	175.8	0	0	0	113.9	D43 L44	D43-L46 HydrophobicContact CB-CD1 4.48Å; D43-L46 WeakPolarHBondContact O-CB 3.23Å; D43-L46 WeakPolarHBondContact O-CG 3.41Å; D43-L46 PolarHBondContact O-N 3.3Å; L44-L46 VanDerWaalsContact C-N 3.27Å; L44-L46 PolarHBondContact O-N 2.99Å
47	K	79.9	Confident	91.8	Very high	145 Å²	145	51.4 Å²	51.4	63%	0.63	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-4.1	177.2	-64.5	-57.5	-174.3	-175.5	0	114.4	L45 H299	L45-K47 PolarHBondContact O-N 3.2Å; K47-H299 WeakPolarHBondContact CE-CE1 3.47Å; K47-H299 WeakPolarHBondContact CE-NE2 3.47Å; K47-H299 WeakPolarHBondContact CG-NE2 3.4Å
48	V	84.2	Confident	91.8	Very high	22 Å²	22	51.4 Å²	51.4	13%	0.133	27%	0.268	C	S	.	.	S	Bend	trans	-112.4	142.4	-177.3	-166.9	0	0	0	0	108.4	L45 L50 L111 A115	L45-V48 PolarHBondContact O-N 3.24Å; V48-L50 HydrophobicContact CB-CD1 4.44Å; V48-L50 PolarHBondContact O-N 3.39Å; V48-L111 HydrophobicContact CG1-CD1 3.32Å; V48-L111 HydrophobicContact CG1-CG 3.77Å; V48-A115 HydrophobicContact CG2-CB 3.38Å
49	P	85.7	Confident	91.7	Very high	124 Å²	124	53.9 Å²	53.9	81%	0.805	28%	0.277	S	S	*	.			trans	-70.1	80.4	180	29.3	-36.9	0	0	0	110.8
50	L	87.6	Confident	91.8	Very high	34 Å²	34	52.7 Å²	52.7	18%	0.178	28%	0.277	C	S	.	.			trans	-112.8	144.8	174.4	-72.4	170.1	0	0	0	109.5	L45 V48 V55 I107 L111 I112	L45-L50 HydrophobicContact CB-CD1 4.07Å; L45-L50 HydrophobicContact CD1-CD1 4.32Å; L45-L50 HydrophobicContact CD2-CD1 4.38Å; L45-L50 HydrophobicContact CG-CD1 4.49Å; V48-L50 HydrophobicContact CB-CD1 4.44Å; V48-L50 PolarHBondContact O-N 3.39Å; L50-V55 HydrophobicContact CB-CG2 3.85Å; L50-V55 HydrophobicContact CD1-CG2 4.3Å; L50-I107 HydrophobicContact CD2-CD1 4.36Å; L50-I107 HydrophobicContact CD2-CG2 3.6Å; L50-L111 HydrophobicContact CD2-CD2 3.36Å; L50-L111 HydrophobicContact CD2-CG 4.06Å; L50-L111 HydrophobicContact CG-CD2 4.17Å; L50-I112 HydrophobicContact CD1-CD1 4.13Å
51	D	88.5	Confident	91.9	Very high	80 Å²	80	52.9 Å²	52.9	43%	0.428	28%	0.278	S	S	.	.			trans	-69.1	139.9	170.9	62.6	138.1	0	0	0	110	D53 G54 V55 R57	D51-D53 PolarHBondContact O-N 3.47Å; D51-G54 VanDerWaalsContact CG-N 3.3Å; D51-G54 WeakPolarHBondContact O-CA 3.34Å; D51-G54 PolarHBondContact O-N 2.81Å; D51-G54 PolarHBondContact OD1-N 3.01Å; D51-G54 WeakPolarHBondContact OD2-CA 3.46Å; D51-G54 PolarHBondContact OD2-N 2.82Å; D51-V55 PolarHBondContact O-N 3.02Å; D51-R57 IonicContact OD1-NH2 3.67Å; D51-R57 PolarHBondContact OD1-NH2 3.16Å
52	T	90.3	Very high	91.9	Very high	108 Å²	108	52.8 Å²	52.8	66%	0.663	28%	0.278	S	S	*	.	H	α-helix	trans	-55.2	-40.3	177.9	-50.1	0	0	0	0	111.3	G54 V55 E56	T52-G54 VanDerWaalsContact C-N 3.31Å; T52-G54 PolarHBondContact O-N 2.92Å; T52-V55 PolarHBondContact O-N 2.85Å; T52-E56 WeakPolarHBondContact O-CG 3.43Å; T52-E56 PolarHBondContact O-N 3.32Å
53	D	92.2	Very high	92	Very high	113 Å²	113	54.6 Å²	54.6	60%	0.604	29%	0.285	S	S	*	.	H	α-helix	trans	-63.7	-36.9	178.3	-63.5	-21.3	0	0	0	112	D51 R57	D51-D53 PolarHBondContact O-N 3.47Å; D53-R57 VanDerWaalsContact C-NH1 3.34Å; D53-R57 WeakPolarHBondContact O-CG 3.49Å; D53-R57 PolarHBondContact O-N 3.06Å; D53-R57 PolarHBondContact O-NH1 2.93Å
54	G	92.5	Very high	92.2	Very high	0 Å²	0	53 Å²	53	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-63	-47.6	173.1	0	0	0	0	0	112.1	D51 T52 E56 R57 F58	D51-G54 VanDerWaalsContact CG-N 3.3Å; D51-G54 WeakPolarHBondContact O-CA 3.34Å; D51-G54 PolarHBondContact O-N 2.81Å; D51-G54 PolarHBondContact OD1-N 3.01Å; D51-G54 WeakPolarHBondContact OD2-CA 3.46Å; D51-G54 PolarHBondContact OD2-N 2.82Å; T52-G54 VanDerWaalsContact C-N 3.31Å; T52-G54 PolarHBondContact O-N 2.92Å; G54-E56 VanDerWaalsContact C-N 3.31Å; G54-E56 PolarHBondContact O-N 3.4Å; G54-R57 VanDerWaalsContact CA-NH2 3.25Å; G54-R57 PolarHBondContact O-N 3.48Å; G54-F58 WeakPolarHBondContact O-CB 3.42Å; G54-F58 PolarHBondContact O-N 3.09Å
55	V	94.7	Very high	92.5	Very high	11 Å²	11	53.3 Å²	53.3	7%	0.067	28%	0.281	C	S	.	.	H	α-helix	trans	-61.1	-40.7	177.4	178.7	0	0	0	0	111.2	C42 L50 D51 T52 F58 R59	C42-V55 HydrophobicContact CB-CG1 4.22Å; L50-V55 HydrophobicContact CB-CG2 3.85Å; L50-V55 HydrophobicContact CD1-CG2 4.3Å; D51-V55 PolarHBondContact O-N 3.02Å; T52-V55 PolarHBondContact O-N 2.85Å; V55-F58 WeakPolarHBondContact O-CB 2.98Å; V55-F58 PolarHBondContact O-N 3.02Å; V55-R59 WeakPolarHBondContact O-CB 3.41Å; V55-R59 PolarHBondContact O-N 2.88Å
56	E	95.6	Very high	92.8	Very high	86 Å²	86	53.3 Å²	53.3	40%	0.402	28%	0.28	S	S	.	.	H	α-helix	trans	-70.7	-37	177.7	-69.4	-52.1	129.4	0	0	113.1	T52 G54 F58 R59 A60	T52-E56 WeakPolarHBondContact O-CG 3.43Å; T52-E56 PolarHBondContact O-N 3.32Å; G54-E56 VanDerWaalsContact C-N 3.31Å; G54-E56 PolarHBondContact O-N 3.4Å; E56-F58 VanDerWaalsContact C-N 3.32Å; E56-F58 PolarHBondContact O-N 3.48Å; E56-R59 WeakPolarHBondContact O-CB 3.23Å; E56-R59 PolarHBondContact O-N 3.05Å; E56-R59 IonicContact OE1-CZ 2.79Å; E56-R59 IonicContact OE1-NE 3.16Å; E56-R59 PolarHBondContact OE1-NE 3.16Å; E56-R59 IonicContact OE1-NH2 3.42Å; E56-R59 PolarHBondContact OE1-NH2 3.34Å; E56-R59 WeakPolarHBondContact OE2-CD 3.4Å; E56-R59 IonicContact OE2-NE 3.82Å; E56-R59 PolarHBondContact OE2-NE 2.84Å; E56-A60 PolarHBondContact O-N 3.42Å
57	R	96.3	Very high	93.3	Very high	109 Å²	109	47.3 Å²	47.3	41%	0.411	25%	0.249	S	C	.	.	H	α-helix	trans	-60.2	-43.9	169.2	-74.8	-172.8	-58.4	-84.7	2.4	111.3	D51 D53 G54 A60 C61 S105	D51-R57 IonicContact OD1-NH2 3.67Å; D51-R57 PolarHBondContact OD1-NH2 3.16Å; D53-R57 VanDerWaalsContact C-NH1 3.34Å; D53-R57 WeakPolarHBondContact O-CG 3.49Å; D53-R57 PolarHBondContact O-N 3.06Å; D53-R57 PolarHBondContact O-NH1 2.93Å; G54-R57 VanDerWaalsContact CA-NH2 3.25Å; G54-R57 PolarHBondContact O-N 3.48Å; R57-A60 PolarHBondContact O-N 3.27Å; R57-C61 WeakPolarHBondContact O-CB 3.34Å; R57-C61 PolarHBondContact O-N 3.19Å; R57-C61 PolarHBondContact O-SG 3.42Å; R57-S105 VanDerWaalsContact C-OG 3.31Å; R57-S105 PolarHBondContact NE-O 3.08Å; R57-S105 PolarHBondContact O-OG 3.35Å
58	F	96.9	Very high	94	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-62.1	-45.5	177.1	177.6	-96.3	0	0	0	112.1	L45 G54 V55 E56 A60 C61 L62 V98 A101 A102 S105 I107 I112	L45-F58 HydrophobicContact CD1-CD1 3.71Å; L45-F58 HydrophobicContact CD1-CE1 3.87Å; L45-F58 HydrophobicContact CD1-CG 4.42Å; G54-F58 WeakPolarHBondContact O-CB 3.42Å; G54-F58 PolarHBondContact O-N 3.09Å; V55-F58 WeakPolarHBondContact O-CB 2.98Å; V55-F58 PolarHBondContact O-N 3.02Å; E56-F58 VanDerWaalsContact C-N 3.32Å; E56-F58 PolarHBondContact O-N 3.48Å; F58-A60 PolarHBondContact O-N 3.16Å; F58-C61 PolarHBondContact O-N 3.05Å; F58-L62 HydrophobicContact CE1-CD2 4.04Å; F58-L62 HydrophobicContact CZ-CD2 4.03Å; F58-L62 WeakPolarHBondContact O-CB 3.3Å; F58-L62 PolarHBondContact O-N 3.28Å; F58-V98 HydrophobicContact CE2-CG1 4.45Å; F58-V98 HydrophobicContact CZ-CG1 4.04Å; F58-A101 HydrophobicContact CD2-CB 3.93Å; F58-A101 HydrophobicContact CE2-CB 3.7Å; F58-A101 HydrophobicContact CZ-CB 4.48Å; F58-A102 HydrophobicContact CD2-CB 4.41Å; F58-A102 HydrophobicContact CE2-CB 4.19Å; F58-S105 WeakPolarHBondContact CA-OG 3.41Å; F58-S105 PolarHBondContact N-OG 3.45Å; F58-I107 HydrophobicContact CB-CD1 3.91Å; F58-I107 HydrophobicContact CG-CD1 4.48Å; F58-I112 HydrophobicContact CD2-CD1 4.47Å; F58-I112 HydrophobicContact CE2-CD1 4.43Å; F58-I112 HydrophobicContact CZ-CG2 4.4Å
59	R	97.3	Very high	94.5	Very high	53 Å²	53	47.7 Å²	47.7	20%	0.2	24%	0.244	C	C	.	.	H	α-helix	trans	-54.2	-51.9	174.8	-166	-168.7	-59.9	-78.7	-3.4	111.1	V38 N39 V55 E56 K63	V38-R59 HydrophobicContact CG1-CB 4.3Å; V38-R59 HydrophobicContact CG1-CG 3.59Å; N39-R59 PolarHBondContact OD1-NH1 3.13Å; V55-R59 WeakPolarHBondContact O-CB 3.41Å; V55-R59 PolarHBondContact O-N 2.88Å; E56-R59 WeakPolarHBondContact O-CB 3.23Å; E56-R59 PolarHBondContact O-N 3.05Å; E56-R59 IonicContact OE1-CZ 2.79Å; E56-R59 IonicContact OE1-NE 3.16Å; E56-R59 PolarHBondContact OE1-NE 3.16Å; E56-R59 IonicContact OE1-NH2 3.42Å; E56-R59 PolarHBondContact OE1-NH2 3.34Å; E56-R59 WeakPolarHBondContact OE2-CD 3.4Å; E56-R59 IonicContact OE2-NE 3.82Å; E56-R59 PolarHBondContact OE2-NE 2.84Å; R59-K63 WeakPolarHBondContact O-CB 3.31Å; R59-K63 PolarHBondContact O-N 3.39Å
60	A	96.4	Very high	94.9	Very high	40 Å²	40	41.8 Å²	41.8	33%	0.331	21%	0.206	S	C	.	.	H	α-helix	trans	-64.5	-45.3	-179.9	0	0	0	0	0	112.5	E56 R57 F58 A64	E56-A60 PolarHBondContact O-N 3.42Å; R57-A60 PolarHBondContact O-N 3.27Å; F58-A60 PolarHBondContact O-N 3.16Å; A60-A64 WeakPolarHBondContact O-CB 3.3Å; A60-A64 PolarHBondContact O-N 3.36Å; A60-A64 VanDerWaalsContact O-N 3.08Å
61	C	97.9	Very high	95	Very high	6 Å²	6	44.8 Å²	44.8	4%	0.041	22%	0.218	C	C	.	.	H	α-helix	trans	-60.7	-49.1	178.3	-71.8	0	0	0	0	111.7	R57 F58 A64 I65 A101 S105	R57-C61 WeakPolarHBondContact O-CB 3.34Å; R57-C61 PolarHBondContact O-N 3.19Å; R57-C61 PolarHBondContact O-SG 3.42Å; F58-C61 PolarHBondContact O-N 3.05Å; C61-A64 PolarHBondContact O-N 2.99Å; C61-I65 WeakPolarHBondContact O-CD1 3.46Å; C61-I65 VanDerWaalsContact O-CG1 3.25Å; C61-I65 WeakPolarHBondContact O-CG1 3.4Å; C61-I65 PolarHBondContact O-N 3.03Å; C61-A101 HydrophobicContact CB-CB 4.14Å; C61-S105 PolarHBondContact SG-OG 3.07Å; C61-S105 VanDerWaalsContact SG-OG 3.36Å
62	L	98.3	Very high	95.1	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-64.8	-46.6	-177.8	-174.2	58.9	0	0	0	110.6	V38 L41 F58 A64 I65 L66 V98 A101	V38-L62 HydrophobicContact CG2-CB 4.31Å; V38-L62 HydrophobicContact CG2-CD2 4.1Å; V38-L62 HydrophobicContact CG2-CG 3.95Å; L41-L62 HydrophobicContact CD1-CD2 3.78Å; F58-L62 HydrophobicContact CE1-CD2 4.04Å; F58-L62 HydrophobicContact CZ-CD2 4.03Å; F58-L62 WeakPolarHBondContact O-CB 3.3Å; F58-L62 PolarHBondContact O-N 3.28Å; L62-A64 VanDerWaalsContact C-N 3.34Å; L62-A64 PolarHBondContact O-N 2.94Å; L62-I65 PolarHBondContact O-N 3.48Å; L62-I65 VanDerWaalsContact O-N 3.13Å; L62-L66 HydrophobicContact CD1-CD1 4.28Å; L62-L66 HydrophobicContact CD1-CD2 4.18Å; L62-L66 HydrophobicContact CD1-CG 4.06Å; L62-L66 HydrophobicContact CG-CD1 4.12Å; L62-L66 HydrophobicContact CG-CG 4.25Å; L62-L66 WeakPolarHBondContact O-CG 3.33Å; L62-L66 PolarHBondContact O-N 3.35Å; L62-V98 HydrophobicContact CD1-CG2 4.21Å; L62-A101 HydrophobicContact CB-CB 3.8Å; L62-A101 HydrophobicContact CD1-CB 4.01Å; L62-A101 HydrophobicContact CG-CB 4.46Å
63	K	97.6	Very high	95.2	Very high	38 Å²	38	42.6 Å²	42.6	17%	0.165	20%	0.2	C	C	.	.	H	α-helix	trans	-53.7	-49.7	175.9	-179.3	169.4	176.4	170.2	0	111.8	E31 V34 S35 V38 R59 I65 L66 L67	E31-K63 WeakPolarHBondContact OE1-CE 3.38Å; E31-K63 IonicContact OE1-NZ 2.63Å; E31-K63 PolarHBondContact OE1-NZ 3.08Å; V34-K63 HydrophobicContact CG1-CG 4.17Å; S35-K63 WeakPolarHBondContact OG-CE 3.33Å; S35-K63 PolarHBondContact OG-NZ 3.11Å; V38-K63 HydrophobicContact CG2-CB 4.19Å; R59-K63 WeakPolarHBondContact O-CB 3.31Å; R59-K63 PolarHBondContact O-N 3.39Å; K63-I65 VanDerWaalsContact C-N 3.35Å; K63-I65 PolarHBondContact O-N 2.93Å; K63-L66 PolarHBondContact O-N 3.2Å; K63-L67 HydrophobicContact CG-CD1 3.94Å; K63-L67 HydrophobicContact CG-CG 4.41Å; K63-L67 WeakPolarHBondContact O-CB 3.41Å; K63-L67 VanDerWaalsContact O-CG 3.3Å; K63-L67 WeakPolarHBondContact O-CG 3.48Å; K63-L67 PolarHBondContact O-N 2.88Å
64	A	95.9	Very high	95.4	Very high	15 Å²	15	38.5 Å²	38.5	12%	0.124	18%	0.177	C	C	.	.	H	α-helix	trans	-62.5	-39.4	178.8	0	0	0	0	0	112.9	A60 C61 L62 R68	A60-A64 WeakPolarHBondContact O-CB 3.3Å; A60-A64 PolarHBondContact O-N 3.36Å; A60-A64 VanDerWaalsContact O-N 3.08Å; C61-A64 PolarHBondContact O-N 2.99Å; L62-A64 VanDerWaalsContact C-N 3.34Å; L62-A64 PolarHBondContact O-N 2.94Å; A64-R68 WeakPolarHBondContact O-CB 3.31Å; A64-R68 PolarHBondContact O-N 3.5Å
65	I	97.4	Very high	95.4	Very high	9 Å²	9	41.3 Å²	41.3	5%	0.046	19%	0.187	C	C	.	.	H	α-helix	trans	-63.9	-46.8	176.9	-71.7	164.6	0	0	0	111	C61 L62 K63 R68 R69 L97 K100 A101 L104	C61-I65 WeakPolarHBondContact O-CD1 3.46Å; C61-I65 VanDerWaalsContact O-CG1 3.25Å; C61-I65 WeakPolarHBondContact O-CG1 3.4Å; C61-I65 PolarHBondContact O-N 3.03Å; L62-I65 PolarHBondContact O-N 3.48Å; L62-I65 VanDerWaalsContact O-N 3.13Å; K63-I65 VanDerWaalsContact C-N 3.35Å; K63-I65 PolarHBondContact O-N 2.93Å; I65-R68 PolarHBondContact O-N 2.85Å; I65-R69 VanDerWaalsContact O-CB 3.29Å; I65-R69 WeakPolarHBondContact O-CB 3.41Å; I65-R69 PolarHBondContact O-N 2.99Å; I65-L97 HydrophobicContact CG2-CB 3.9Å; I65-L97 HydrophobicContact CG2-CD1 4.43Å; I65-L97 HydrophobicContact CG2-CD2 3.81Å; I65-L97 HydrophobicContact CG2-CG 4.26Å; I65-K100 HydrophobicContact CD1-CB 4.4Å; I65-K100 HydrophobicContact CD1-CD 4.23Å; I65-K100 HydrophobicContact CD1-CG 4.01Å; I65-A101 HydrophobicContact CD1-CB 4.01Å; I65-L104 HydrophobicContact CD1-CD1 4.08Å
66	L	97.5	Very high	95.2	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-68.4	-46.3	-177.3	-62.8	-173.4	0	0	0	111.9	V34 V38 L62 K63 R68 R69 Y70 L88 L97	V34-L66 HydrophobicContact CG1-CB 3.77Å; V34-L66 HydrophobicContact CG1-CD1 4.24Å; V34-L66 HydrophobicContact CG2-CB 4.36Å; V38-L66 HydrophobicContact CG2-CD1 3.91Å; L62-L66 HydrophobicContact CD1-CD1 4.28Å; L62-L66 HydrophobicContact CD1-CD2 4.18Å; L62-L66 HydrophobicContact CD1-CG 4.06Å; L62-L66 HydrophobicContact CG-CD1 4.12Å; L62-L66 HydrophobicContact CG-CG 4.25Å; L62-L66 WeakPolarHBondContact O-CG 3.33Å; L62-L66 PolarHBondContact O-N 3.35Å; K63-L66 PolarHBondContact O-N 3.2Å; L66-R68 VanDerWaalsContact C-N 3.25Å; L66-R68 PolarHBondContact O-N 3.44Å; L66-R69 PolarHBondContact O-N 3.42Å; L66-Y70 HydrophobicContact CB-CD2 4.29Å; L66-Y70 HydrophobicContact CB-CE2 3.96Å; L66-Y70 HydrophobicContact CD2-CE2 4.22Å; L66-Y70 HydrophobicContact CG-CE2 4.43Å; L66-Y70 WeakPolarHBondContact O-CB 3.42Å; L66-Y70 VanDerWaalsContact O-CG 3.32Å; L66-Y70 PolarHBondContact O-N 2.87Å; L66-L88 HydrophobicContact CD1-CD1 4Å; L66-L88 HydrophobicContact CD2-CD1 4.28Å; L66-L88 HydrophobicContact CD2-CD2 3.81Å; L66-L97 HydrophobicContact CD2-CB 4.34Å; L66-L97 HydrophobicContact CD2-CD1 3.79Å
67	L	95.8	Very high	94.9	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.005	20%	0.197	C	C	.	.	H	α-helix	trans	-54.2	-44.7	175.5	-73.2	173.4	0	0	0	111.4	M30 E31 V34 K63 F71 Y225	M30-L67 HydrophobicContact CG-CD2 3.67Å; M30-L67 HydrophobicContact SD-CD2 4.06Å; E31-L67 HydrophobicContact CB-CD2 4.45Å; V34-L67 HydrophobicContact CB-CD2 4.17Å; V34-L67 HydrophobicContact CG1-CD2 4.27Å; V34-L67 HydrophobicContact CG1-CG 4.13Å; V34-L67 HydrophobicContact CG2-CD2 4.12Å; K63-L67 HydrophobicContact CG-CD1 3.94Å; K63-L67 HydrophobicContact CG-CG 4.41Å; K63-L67 WeakPolarHBondContact O-CB 3.41Å; K63-L67 VanDerWaalsContact O-CG 3.3Å; K63-L67 WeakPolarHBondContact O-CG 3.48Å; K63-L67 PolarHBondContact O-N 2.88Å; L67-F71 PolarHBondContact O-N 2.8Å; L67-Y225 HydrophobicContact CD1-CD1 4.43Å; L67-Y225 HydrophobicContact CD1-CE1 4.22Å
68	R	94.6	Very high	94.7	Very high	117 Å²	117	44.9 Å²	44.9	44%	0.442	21%	0.205	S	C	.	.	H	α-helix	trans	-68.5	-40	177.3	-173.3	177.7	-176.7	119.6	-0.6	112.4	A64 I65 L66	A64-R68 WeakPolarHBondContact O-CB 3.31Å; A64-R68 PolarHBondContact O-N 3.5Å; I65-R68 PolarHBondContact O-N 2.85Å; L66-R68 VanDerWaalsContact C-N 3.25Å; L66-R68 PolarHBondContact O-N 3.44Å
69	R	94.9	Very high	94.5	Very high	57 Å²	57	47 Å²	47	22%	0.215	22%	0.218	C	C	.	.	H	α-helix	trans	-65.4	-40.4	-178.8	178.9	67.9	174.3	160.6	-9.7	111.6	I65 L66 Y85 L97	I65-R69 VanDerWaalsContact O-CB 3.29Å; I65-R69 WeakPolarHBondContact O-CB 3.41Å; I65-R69 PolarHBondContact O-N 2.99Å; L66-R69 PolarHBondContact O-N 3.42Å; R69-Y85 VanDerWaalsContact CD-OH 3.24Å; R69-Y85 WeakPolarHBondContact CD-OH 3.46Å; R69-Y85 HydrophobicContact CG-CE1 4.02Å; R69-Y85 VanDerWaalsContact NE-CZ 3.28Å; R69-Y85 PolarHBondContact NE-OH 3.4Å; R69-Y85 VanDerWaalsContact NH1-CE2 3.31Å; R69-Y85 PolarHBondContact NH1-OH 3.46Å; R69-Y85 VanDerWaalsContact O-CE1 3.24Å; R69-Y85 WeakPolarHBondContact O-CE1 3.38Å; R69-Y85 PolarHBondContact O-OH 3.33Å; R69-L97 HydrophobicContact CB-CD1 4.33Å; R69-L97 HydrophobicContact CG-CD1 3.86Å
70	Y	95.3	Very high	94.3	Very high	1 Å²	1	48 Å²	48	0%	0.004	23%	0.228	C	C	.	.	H	α-helix	trans	-92.5	-10.4	-170.3	-58	-20.3	0	0	0	114.1	V34 L66 D72 H73 W74 Y85 R86 L88 V124	V34-Y70 HydrophobicContact CG2-CD2 4.06Å; V34-Y70 HydrophobicContact CG2-CE2 4.46Å; L66-Y70 HydrophobicContact CB-CD2 4.29Å; L66-Y70 HydrophobicContact CB-CE2 3.96Å; L66-Y70 HydrophobicContact CD2-CE2 4.22Å; L66-Y70 HydrophobicContact CG-CE2 4.43Å; L66-Y70 WeakPolarHBondContact O-CB 3.42Å; L66-Y70 VanDerWaalsContact O-CG 3.32Å; L66-Y70 PolarHBondContact O-N 2.87Å; Y70-D72 PolarHBondContact O-N 3.21Å; Y70-H73 CarbonylContact O-C 3.24Å; Y70-H73 VanDerWaalsContact O-C 3.24Å; Y70-H73 WeakPolarHBondContact O-CA 3.28Å; Y70-H73 PolarHBondContact O-N 2.79Å; Y70-W74 PolarHBondContact O-N 3.16Å; Y70-W74 VanDerWaalsContact O-N 3.15Å; Y70-Y85 HydrophobicContact CD1-CD1 4.39Å; Y70-Y85 HydrophobicContact CD1-CE1 4.15Å; Y70-R86 HydrophobicContact CD1-CB 4.11Å; Y70-R86 HydrophobicContact CD1-CG 3.59Å; Y70-R86 HydrophobicContact CD2-CG 4.35Å; Y70-R86 VanDerWaalsContact CE1-CA 3.48Å; Y70-R86 HydrophobicContact CE1-CB 3.82Å; Y70-R86 HydrophobicContact CE1-CG 3.83Å; Y70-R86 HydrophobicContact CE2-CB 4.25Å; Y70-R86 HydrophobicContact CG-CB 4.47Å; Y70-R86 HydrophobicContact CG-CG 3.89Å; Y70-R86 PolarHBondContact OH-O 2.66Å; Y70-L88 WeakPolarHBondContact OH-CD2 3.09Å; Y70-V124 HydrophobicContact CE2-CB 3.93Å; Y70-V124 HydrophobicContact CE2-CG1 4.17Å; Y70-V124 HydrophobicContact CE2-CG2 4.27Å
71	F	90.1	Very high	94.2	Very high	97 Å²	97	52.5 Å²	52.5	43%	0.425	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-49.2	-47.6	-174.5	176.2	-115.3	0	0	0	115.5	M30 L67 W230	M30-F71 HydrophobicContact CE-CB 4.22Å; M30-F71 HydrophobicContact CE-CD2 4.11Å; L67-F71 PolarHBondContact O-N 2.8Å; F71-W230 HydrophobicContact CB-CZ3 4.09Å; F71-W230 HydrophobicContact CD1-CZ3 4.45Å; F71-W230 HydrophobicContact CD2-CD2 4.34Å; F71-W230 AromaticContact CD2-CE3 3.22Å; F71-W230 HydrophobicContact CD2-CE3 3.22Å; F71-W230 HydrophobicContact CD2-CH2 4.04Å; F71-W230 AromaticContact CD2-CZ3 3.02Å; F71-W230 HydrophobicContact CD2-CZ3 3.02Å; F71-W230 AromaticContact CE2-CD2 3.99Å; F71-W230 HydrophobicContact CE2-CD2 3.99Å; F71-W230 AromaticContact CE2-CE3 3.03Å; F71-W230 HydrophobicContact CE2-CE3 3.03Å; F71-W230 AromaticContact CE2-CZ3 3.44Å; F71-W230 HydrophobicContact CE2-CZ3 3.44Å; F71-W230 VanDerWaalsContact CE2-CZ3 3.44Å; F71-W230 HydrophobicContact CG-CE3 4.08Å; F71-W230 AromaticContact CG-CZ3 3.6Å; F71-W230 HydrophobicContact CG-CZ3 3.6Å; F71-W230 AromaticContact CZ-CE3 3.76Å; F71-W230 HydrophobicContact CZ-CE3 3.76Å; F71-W230 HydrophobicContact CZ-CZ3 4.29Å
72	D	89.7	Confident	94	Very high	102 Å²	102	52.5 Å²	52.5	55%	0.545	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-93	3.4	180	65.4	-20.5	0	0	0	113.5	Y70	Y70-D72 PolarHBondContact O-N 3.21Å
73	H	93.1	Very high	93.9	Very high	39 Å²	39	52.9 Å²	52.9	18%	0.181	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-124.6	31.1	179.3	-68.6	74.5	0	0	0	111.4	Y70 Y75 Y85 R86	Y70-H73 CarbonylContact O-C 3.24Å; Y70-H73 VanDerWaalsContact O-C 3.24Å; Y70-H73 WeakPolarHBondContact O-CA 3.28Å; Y70-H73 PolarHBondContact O-N 2.79Å; H73-Y75 HydrophobicContact CB-CE2 4.39Å; H73-Y85 HydrophobicContact CB-CD1 3.64Å; H73-Y85 HydrophobicContact CB-CE1 3.59Å; H73-Y85 AromaticContact CD2-CD1 3.92Å; H73-Y85 AromaticContact CE1-CZ 3.91Å; H73-Y85 AromaticContact CG-CD1 3.69Å; H73-Y85 AromaticContact CG-CE1 3.47Å; H73-Y85 VanDerWaalsContact CG-CE1 3.47Å; H73-Y85 AromaticContact CG-CZ 3.85Å; H73-Y85 AromaticContact ND1-CE1 3.67Å; H73-Y85 AromaticContact ND1-CZ 3.65Å; H73-R86 PolarHBondContact O-NH1 3.45Å
74	W	94.8	Very high	93.7	Very high	28 Å²	28	53 Å²	53	11%	0.106	25%	0.248	C	C	.	.			trans	-107.1	116.1	176.1	-160.7	-109.9	0	0	0	110.5	L29 M30 E33 Y70 P76 V124 D125 P126	L29-W74 PolarHBondContact O-NE1 2.78Å; M30-W74 HydrophobicContact CB-CD2 3.55Å; M30-W74 HydrophobicContact CB-CE3 3.9Å; M30-W74 HydrophobicContact CB-CG 4.14Å; M30-W74 HydrophobicContact CB-CH2 3.77Å; M30-W74 HydrophobicContact CB-CZ2 3.37Å; M30-W74 HydrophobicContact CB-CZ3 4Å; E33-W74 HydrophobicContact CB-CH2 3.92Å; E33-W74 HydrophobicContact CB-CZ2 4.33Å; E33-W74 HydrophobicContact CG-CH2 4.15Å; E33-W74 HydrophobicContact CG-CZ2 4.18Å; Y70-W74 PolarHBondContact O-N 3.16Å; Y70-W74 VanDerWaalsContact O-N 3.15Å; W74-P76 WeakPolarHBondContact O-CD 3.46Å; W74-V124 HydrophobicContact CH2-CG1 4.4Å; W74-V124 HydrophobicContact CZ3-CG1 4.42Å; W74-V124 WeakPolarHBondContact CZ3-O 3.26Å; W74-D125 VanDerWaalsContact CH2-C 3.45Å; W74-P126 HydrophobicContact CD2-CG 3.82Å; W74-P126 HydrophobicContact CE3-CG 4.23Å; W74-P126 HydrophobicContact CG-CG 4.32Å; W74-P126 HydrophobicContact CH2-CG 4.21Å; W74-P126 HydrophobicContact CZ2-CB 3.88Å; W74-P126 HydrophobicContact CZ2-CG 3.81Å; W74-P126 HydrophobicContact CZ3-CG 4.41Å
75	Y	92.3	Very high	93.7	Very high	58 Å²	58	54.1 Å²	54.1	23%	0.227	25%	0.249	C	C	.	.			trans	-124.9	79.5	-172.8	-53.5	-78.7	0	0	0	112	H73 R77 H78 P79 R81	H73-Y75 HydrophobicContact CB-CE2 4.39Å; Y75-R77 VanDerWaalsContact C-N 3.26Å; Y75-R77 PolarHBondContact O-N 2.63Å; Y75-R77 VanDerWaalsContact O-N 3.14Å; Y75-H78 CarbonylContact O-C 2.97Å; Y75-H78 PolarHBondContact O-N 3.27Å; Y75-P79 WeakPolarHBondContact O-CA 3.32Å; Y75-P79 VanDerWaalsContact O-N 3.16Å; Y75-R81 HydrophobicContact CD2-CB 3.82Å; Y75-R81 HydrophobicContact CD2-CG 3.69Å; Y75-R81 WeakPolarHBondContact CD2-O 3.48Å; Y75-R81 HydrophobicContact CE2-CB 4.39Å; Y75-R81 HydrophobicContact CE2-CG 3.78Å; Y75-R81 HydrophobicContact CG-CB 4.13Å; Y75-R81 HydrophobicContact CG-CG 4.1Å
76	P	91.7	Very high	93.7	Very high	29 Å²	29	53.7 Å²	53.7	19%	0.188	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-35	-176.5	-28.6	35.8	0	0	0	115.2	W74 H78 P79	W74-P76 WeakPolarHBondContact O-CD 3.46Å; P76-H78 VanDerWaalsContact C-N 3.33Å; P76-P79 WeakPolarHBondContact O-CD 3.38Å; P76-P79 WeakPolarHBondContact O-CG 3.34Å
77	R	89	Confident	93.7	Very high	129 Å²	129	54.8 Å²	54.8	49%	0.487	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-21.3	176.8	-63.9	-172.1	-179	168.7	6.4	114.2	Y75 M149 E152	Y75-R77 VanDerWaalsContact C-N 3.26Å; Y75-R77 PolarHBondContact O-N 2.63Å; Y75-R77 VanDerWaalsContact O-N 3.14Å; R77-M149 HydrophobicContact CG-CE 4.19Å; R77-E152 IonicContact CZ-OE1 3.98Å; R77-E152 IonicContact CZ-OE2 3.3Å; R77-E152 IonicContact NH1-OE1 3.42Å; R77-E152 IonicContact NH1-OE2 3.39Å; R77-E152 IonicContact NH2-OE1 3.44Å; R77-E152 PolarHBondContact NH2-OE1 3.21Å; R77-E152 IonicContact NH2-OE2 2.66Å; R77-E152 PolarHBondContact NH2-OE2 2.86Å
78	H	92.3	Very high	93.9	Very high	123 Å²	123	54.9 Å²	54.9	57%	0.569	26%	0.255	S	S	*	.	S	Bend	trans	-136.3	69.6	178.6	-60.5	-59	0	0	0	108.9	Y75 P76 L80 R81	Y75-H78 CarbonylContact O-C 2.97Å; Y75-H78 PolarHBondContact O-N 3.27Å; P76-H78 VanDerWaalsContact C-N 3.33Å; H78-L80 PolarHBondContact O-N 3.19Å; H78-R81 HydrophobicContact CB-CB 3.99Å; H78-R81 VanDerWaalsContact O-CB 3.23Å; H78-R81 WeakPolarHBondContact O-CB 3.46Å; H78-R81 PolarHBondContact O-N 3.3Å
79	P	93.3	Very high	94	Very high	44 Å²	44	54.4 Å²	54.4	29%	0.286	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52	-38.1	-168.7	-30.3	36.5	0	0	0	113.4	Y75 P76 R81 R86 P126	Y75-P79 WeakPolarHBondContact O-CA 3.32Å; Y75-P79 VanDerWaalsContact O-N 3.16Å; P76-P79 WeakPolarHBondContact O-CD 3.38Å; P76-P79 WeakPolarHBondContact O-CG 3.34Å; P79-R81 VanDerWaalsContact C-N 3.3Å; P79-R81 PolarHBondContact O-N 3.31Å; P79-R86 PolarHBondContact O-NH2 2.89Å; P79-P126 HydrophobicContact CB-CB 4.13Å; P79-P126 HydrophobicContact CB-CG 4.23Å; P79-P126 WeakPolarHBondContact CB-O 3.38Å; P79-P126 HydrophobicContact CG-CB 4.33Å
80	L	92.7	Very high	94	Very high	76 Å²	76	52 Å²	52	40%	0.398	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-13.1	-177.2	-59.6	171.4	0	0	0	114.1	H78 G82 S83 M192	H78-L80 PolarHBondContact O-N 3.19Å; L80-G82 PolarHBondContact O-N 2.93Å; L80-S83 VanDerWaalsContact O-CB 3.29Å; L80-S83 WeakPolarHBondContact O-CB 3.34Å; L80-S83 PolarHBondContact O-N 2.92Å; L80-S83 VanDerWaalsContact O-N 3.1Å; L80-M192 HydrophobicContact CD1-CB 4.39Å; L80-M192 HydrophobicContact CD1-CE 3.14Å; L80-M192 HydrophobicContact CD1-CG 4.19Å; L80-M192 HydrophobicContact CG-CE 4.47Å
81	R	93.8	Very high	93.9	Very high	133 Å²	133	55.5 Å²	55.5	50%	0.502	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	124.4	171.9	-178.1	-179.8	172	172.6	-1.4	108.4	Y75 H78 P79 S83 R86	Y75-R81 HydrophobicContact CD2-CB 3.82Å; Y75-R81 HydrophobicContact CD2-CG 3.69Å; Y75-R81 WeakPolarHBondContact CD2-O 3.48Å; Y75-R81 HydrophobicContact CE2-CB 4.39Å; Y75-R81 HydrophobicContact CE2-CG 3.78Å; Y75-R81 HydrophobicContact CG-CB 4.13Å; Y75-R81 HydrophobicContact CG-CG 4.1Å; H78-R81 HydrophobicContact CB-CB 3.99Å; H78-R81 VanDerWaalsContact O-CB 3.23Å; H78-R81 WeakPolarHBondContact O-CB 3.46Å; H78-R81 PolarHBondContact O-N 3.3Å; P79-R81 VanDerWaalsContact C-N 3.3Å; P79-R81 PolarHBondContact O-N 3.31Å; R81-S83 PolarHBondContact O-N 3.23Å; R81-R86 PolarHBondContact O-NH1 2.86Å; R81-R86 PolarHBondContact O-NH2 2.98Å
82	G	94.1	Very high	93.9	Very high	7 Å²	7	53.3 Å²	53.3	7%	0.072	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	72	11.7	-178.2	0	0	0	0	0	114.8	L80 A84 Y85 R86	L80-G82 PolarHBondContact O-N 2.93Å; G82-A84 VanDerWaalsContact C-N 3.28Å; G82-A84 PolarHBondContact O-N 2.96Å; G82-Y85 WeakPolarHBondContact O-CB 3.39Å; G82-Y85 PolarHBondContact O-N 3.37Å; G82-R86 PolarHBondContact O-N 3.33Å
83	S	95.5	Very high	94.1	Very high	8 Å²	8	53.4 Å²	53.4	6%	0.056	27%	0.272	C	S	.	.	H	α-helix	trans	-56.6	-40.1	178.6	176.8	0	0	0	0	112.3	L80 R81 Y85 R86 C87 W123 D125	L80-S83 VanDerWaalsContact O-CB 3.29Å; L80-S83 WeakPolarHBondContact O-CB 3.34Å; L80-S83 PolarHBondContact O-N 2.92Å; L80-S83 VanDerWaalsContact O-N 3.1Å; R81-S83 PolarHBondContact O-N 3.23Å; S83-Y85 VanDerWaalsContact C-N 3.29Å; S83-Y85 PolarHBondContact O-N 3.07Å; S83-R86 CarbonylContact O-C 3.58Å; S83-R86 PolarHBondContact O-N 3.06Å; S83-C87 PolarHBondContact O-N 3.31Å; S83-W123 VanDerWaalsContact OG-CD1 3.27Å; S83-D125 WeakPolarHBondContact CA-OD1 3.47Å; S83-D125 WeakPolarHBondContact CB-OD1 3.42Å; S83-D125 WeakPolarHBondContact CB-OD2 3.27Å; S83-D125 PolarHBondContact OG-OD1 3.48Å; S83-D125 PolarHBondContact OG-OD2 3.16Å
84	A	93.2	Very high	94.3	Very high	40 Å²	40	52.3 Å²	52.3	33%	0.331	27%	0.268	S	S	.	.	H	α-helix	trans	-63.1	-31.3	174.6	0	0	0	0	0	114.2	G82 R86 C87 L200	G82-A84 VanDerWaalsContact C-N 3.28Å; G82-A84 PolarHBondContact O-N 2.96Å; A84-R86 VanDerWaalsContact C-N 3.3Å; A84-C87 PolarHBondContact O-N 3.28Å; A84-L200 HydrophobicContact CB-CD1 3.54Å; A84-L200 HydrophobicContact CB-CG 4.33Å
85	Y	96.4	Very high	94.5	Very high	39 Å²	39	51.9 Å²	51.9	15%	0.153	27%	0.268	C	S	.	.	H	α-helix	trans	-71.9	-28.4	174.8	172.7	-86.4	0	0	0	111.9	R69 Y70 H73 G82 S83	R69-Y85 VanDerWaalsContact CD-OH 3.24Å; R69-Y85 WeakPolarHBondContact CD-OH 3.46Å; R69-Y85 HydrophobicContact CG-CE1 4.02Å; R69-Y85 VanDerWaalsContact NE-CZ 3.28Å; R69-Y85 PolarHBondContact NE-OH 3.4Å; R69-Y85 VanDerWaalsContact NH1-CE2 3.31Å; R69-Y85 PolarHBondContact NH1-OH 3.46Å; R69-Y85 VanDerWaalsContact O-CE1 3.24Å; R69-Y85 WeakPolarHBondContact O-CE1 3.38Å; R69-Y85 PolarHBondContact O-OH 3.33Å; Y70-Y85 HydrophobicContact CD1-CD1 4.39Å; Y70-Y85 HydrophobicContact CD1-CE1 4.15Å; H73-Y85 HydrophobicContact CB-CD1 3.64Å; H73-Y85 HydrophobicContact CB-CE1 3.59Å; H73-Y85 AromaticContact CD2-CD1 3.92Å; H73-Y85 AromaticContact CE1-CZ 3.91Å; H73-Y85 AromaticContact CG-CD1 3.69Å; H73-Y85 AromaticContact CG-CE1 3.47Å; H73-Y85 VanDerWaalsContact CG-CE1 3.47Å; H73-Y85 AromaticContact CG-CZ 3.85Å; H73-Y85 AromaticContact ND1-CE1 3.67Å; H73-Y85 AromaticContact ND1-CZ 3.65Å; G82-Y85 WeakPolarHBondContact O-CB 3.39Å; G82-Y85 PolarHBondContact O-N 3.37Å; S83-Y85 VanDerWaalsContact C-N 3.29Å; S83-Y85 PolarHBondContact O-N 3.07Å
86	R	97.8	Very high	94.7	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-94	-1.5	177	-56.4	-169.6	-59.5	-82.9	-12.4	113.9	Y70 H73 P79 R81 G82 S83 A84 L88 V124 D125	Y70-R86 HydrophobicContact CD1-CB 4.11Å; Y70-R86 HydrophobicContact CD1-CG 3.59Å; Y70-R86 HydrophobicContact CD2-CG 4.35Å; Y70-R86 VanDerWaalsContact CE1-CA 3.48Å; Y70-R86 HydrophobicContact CE1-CB 3.82Å; Y70-R86 HydrophobicContact CE1-CG 3.83Å; Y70-R86 HydrophobicContact CE2-CB 4.25Å; Y70-R86 HydrophobicContact CG-CB 4.47Å; Y70-R86 HydrophobicContact CG-CG 3.89Å; Y70-R86 PolarHBondContact OH-O 2.66Å; H73-R86 PolarHBondContact O-NH1 3.45Å; P79-R86 PolarHBondContact O-NH2 2.89Å; R81-R86 PolarHBondContact O-NH1 2.86Å; R81-R86 PolarHBondContact O-NH2 2.98Å; G82-R86 PolarHBondContact O-N 3.33Å; S83-R86 CarbonylContact O-C 3.58Å; S83-R86 PolarHBondContact O-N 3.06Å; A84-R86 VanDerWaalsContact C-N 3.3Å; R86-L88 PolarHBondContact O-N 3.36Å; R86-V124 WeakPolarHBondContact CB-O 3.47Å; R86-V124 WeakPolarHBondContact CD-O 3.42Å; R86-V124 PolarHBondContact NE-O 3.12Å; R86-D125 IonicContact CZ-OD1 2.94Å; R86-D125 IonicContact NE-OD1 3.79Å; R86-D125 PolarHBondContact NE-OD1 2.83Å; R86-D125 IonicContact NH2-OD1 3.76Å; R86-D125 PolarHBondContact NH2-OD1 3.24Å
87	C	98.1	Very high	95	Very high	22 Å²	22	53 Å²	53	15%	0.149	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	127	173.4	-176	0	0	0	0	109.9	S83 A84 L122	S83-C87 PolarHBondContact O-N 3.31Å; A84-C87 PolarHBondContact O-N 3.28Å; C87-L122 CarbonylContact C-O 3.49Å; C87-L122 WeakPolarHBondContact CA-O 3.46Å
88	L	98.4	Very high	95.5	Very high	4 Å²	4	46.8 Å²	46.8	2%	0.021	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	121	164.7	-57.5	178.3	0	0	0	108.1	L41 L66 Y70 R86 L97 V98 S121 L122	L41-L88 HydrophobicContact CD1-CD1 3.96Å; L66-L88 HydrophobicContact CD1-CD1 4Å; L66-L88 HydrophobicContact CD2-CD1 4.28Å; L66-L88 HydrophobicContact CD2-CD2 3.81Å; Y70-L88 WeakPolarHBondContact OH-CD2 3.09Å; R86-L88 PolarHBondContact O-N 3.36Å; L88-L97 HydrophobicContact CD2-CD1 4.14Å; L88-V98 HydrophobicContact CD1-CG2 4.41Å; L88-S121 WeakPolarHBondContact O-CA 3.43Å; L88-L122 HydrophobicContact CB-CB 4.38Å; L88-L122 HydrophobicContact CD1-CD2 4.38Å; L88-L122 PolarHBondContact N-O 3.47Å; L88-L122 PolarHBondContact O-N 2.96Å
89	R	97	Very high	95.7	Very high	107 Å²	107	42 Å²	42	40%	0.404	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	121.1	-175.7	-170.1	178.2	-174.7	93.6	-6.2	111.2	D95 E135	R89-D95 PolarHBondContact N-OD2 3.48Å; R89-D95 WeakPolarHBondContact O-CA 3.37Å; R89-D95 WeakPolarHBondContact O-CB 3.43Å; R89-D95 PolarHBondContact O-N 3.22Å; R89-E135 IonicContact CZ-OE1 3.66Å; R89-E135 IonicContact CZ-OE2 3.05Å; R89-E135 IonicContact NE-OE1 2.68Å; R89-E135 IonicContact NH1-OE2 2.89Å; R89-E135 IonicContact NH2-OE1 3.69Å; R89-E135 PolarHBondContact NH2-OE1 3.47Å; R89-E135 IonicContact NH2-OE2 3Å; R89-E135 PolarHBondContact NH2-OE2 3.13Å
90	I	96.3	Very high	95.9	Very high	6 Å²	6	41.7 Å²	41.7	3%	0.031	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	118.3	170.6	-64.2	154.5	0	0	0	106.8	T93 L94 F116 E119 L120	I90-T93 WeakPolarHBondContact CA-O 3.38Å; I90-L94 HydrophobicContact CD1-CD2 4.27Å; I90-L94 HydrophobicContact CG1-CD2 4.12Å; I90-L94 HydrophobicContact CG2-CD2 4.39Å; I90-F116 HydrophobicContact CD1-CB 4.27Å; I90-F116 HydrophobicContact CD1-CD2 3.42Å; I90-F116 VanDerWaalsContact CD1-CD2 3.42Å; I90-F116 HydrophobicContact CD1-CE2 4.01Å; I90-F116 HydrophobicContact CD1-CG 4.09Å; I90-E119 CarbonylContact O-C 3.58Å; I90-E119 WeakPolarHBondContact O-CA 3.25Å; I90-L120 HydrophobicContact CB-CB 4.2Å; I90-L120 HydrophobicContact CD1-CB 4.4Å; I90-L120 HydrophobicContact CD1-CD2 3.93Å; I90-L120 HydrophobicContact CD1-CG 4.44Å; I90-L120 PolarHBondContact N-O 3.08Å; I90-L120 PolarHBondContact O-N 2.83Å
91	N	93.1	Very high	96.2	Very high	74 Å²	74	38 Å²	38	40%	0.396	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	94.4	174.4	-176.9	-23	0	0	0	108	T93 A118 E135	N91-T93 PolarHBondContact N-O 2.87Å; N91-T93 PolarHBondContact O-N 2.97Å; N91-A118 CarbonylContact C-O 3.55Å; N91-A118 VanDerWaalsContact CA-O 3.22Å; N91-A118 WeakPolarHBondContact CA-O 3.34Å; N91-E135 PolarHBondContact ND2-OE1 2.92Å
92	G	89.6	Confident	96.3	Very high	51 Å²	51	31.7 Å²	31.7	53%	0.526	19%	0.19	S	C	.	.	S	Bend	trans	70	-34.7	-172.6	0	0	0	0	0	114.6	A118	G92-A118 PolarHBondContact N-O 3.42Å
93	T	94.2	Very high	96.5	Very high	104 Å²	104	35.8 Å²	35.8	64%	0.638	21%	0.214	S	C	*	.	S	Bend	trans	-120.7	154.5	173.7	58.9	0	0	0	0	110.9	I90 N91	I90-T93 WeakPolarHBondContact CA-O 3.38Å; N91-T93 PolarHBondContact N-O 2.87Å; N91-T93 PolarHBondContact O-N 2.97Å
94	L	97.1	Very high	96.5	Very high	17 Å²	17	38.8 Å²	38.8	9%	0.089	23%	0.229	C	C	.	.			trans	-67.4	153	174.4	-67.2	-175.1	0	0	0	112.2	I90 V98 A99 V109 I112 R113 F116	I90-L94 HydrophobicContact CD1-CD2 4.27Å; I90-L94 HydrophobicContact CG1-CD2 4.12Å; I90-L94 HydrophobicContact CG2-CD2 4.39Å; L94-V98 HydrophobicContact CD1-CG1 4.13Å; L94-V98 HydrophobicContact CD2-CG1 4.3Å; L94-A99 HydrophobicContact CB-CB 4.13Å; L94-A99 HydrophobicContact CD1-CB 4.47Å; L94-V109 HydrophobicContact CD1-CG1 3.84Å; L94-I112 HydrophobicContact CD1-CB 3.99Å; L94-I112 HydrophobicContact CD1-CG2 3.7Å; L94-I112 HydrophobicContact CD2-CG2 4.31Å; L94-R113 HydrophobicContact CD1-CB 4.38Å; L94-R113 HydrophobicContact CD2-CB 4.02Å; L94-R113 HydrophobicContact CD2-CG 4.47Å; L94-R113 HydrophobicContact CG-CB 3.97Å; L94-F116 HydrophobicContact CD2-CD2 3.61Å; L94-F116 HydrophobicContact CD2-CE2 4.02Å
95	D	98.3	Very high	96.6	Very high	18 Å²	18	36.9 Å²	36.9	10%	0.096	21%	0.213	C	C	.	.			trans	-56.1	137.2	163.4	-175.8	-81.8	0	0	0	110.1	R89 L97 V98 A99	R89-D95 PolarHBondContact N-OD2 3.48Å; R89-D95 WeakPolarHBondContact O-CA 3.37Å; R89-D95 WeakPolarHBondContact O-CB 3.43Å; R89-D95 PolarHBondContact O-N 3.22Å; D95-L97 PolarHBondContact O-N 3.01Å; D95-L97 VanDerWaalsContact O-N 3.14Å; D95-L97 VanDerWaalsContact OD1-CB 3.26Å; D95-L97 WeakPolarHBondContact OD1-CB 3.42Å; D95-L97 WeakPolarHBondContact OD1-CG 3.39Å; D95-L97 PolarHBondContact OD1-N 3.37Å; D95-V98 HydrophobicContact CB-CB 4.16Å; D95-V98 HydrophobicContact CB-CG2 3.88Å; D95-V98 WeakPolarHBondContact O-CB 3.48Å; D95-V98 PolarHBondContact O-N 2.75Å; D95-A99 PolarHBondContact O-N 2.87Å
96	P	97.7	Very high	96.6	Very high	94 Å²	94	40.1 Å²	40.1	61%	0.61	24%	0.242	S	C	*	.	H	α-helix	trans	-56	-31.4	-178.4	-27.8	35.5	0	0	0	114.7	K100	P96-K100 VanDerWaalsContact O-CB 3.26Å; P96-K100 WeakPolarHBondContact O-CB 3.41Å; P96-K100 PolarHBondContact O-N 3.4Å
97	L	98	Very high	96.4	Very high	16 Å²	16	40.6 Å²	40.6	8%	0.084	24%	0.244	C	C	.	.	H	α-helix	trans	-72.9	-39.6	178.2	-55.4	-177.8	0	0	0	111.1	I65 L66 R69 L88 D95 K100 A101 L212	I65-L97 HydrophobicContact CG2-CB 3.9Å; I65-L97 HydrophobicContact CG2-CD1 4.43Å; I65-L97 HydrophobicContact CG2-CD2 3.81Å; I65-L97 HydrophobicContact CG2-CG 4.26Å; L66-L97 HydrophobicContact CD2-CB 4.34Å; L66-L97 HydrophobicContact CD2-CD1 3.79Å; R69-L97 HydrophobicContact CB-CD1 4.33Å; R69-L97 HydrophobicContact CG-CD1 3.86Å; L88-L97 HydrophobicContact CD2-CD1 4.14Å; D95-L97 PolarHBondContact O-N 3.01Å; D95-L97 VanDerWaalsContact O-N 3.14Å; D95-L97 VanDerWaalsContact OD1-CB 3.26Å; D95-L97 WeakPolarHBondContact OD1-CB 3.42Å; D95-L97 WeakPolarHBondContact OD1-CG 3.39Å; D95-L97 PolarHBondContact OD1-N 3.37Å; L97-K100 PolarHBondContact O-N 2.99Å; L97-A101 PolarHBondContact O-N 3.29Å; L97-L212 HydrophobicContact CD2-CD2 4.3Å
98	V	98.3	Very high	96.3	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-67	-46.3	175.4	177.6	0	0	0	0	110.5	L41 F58 L62 L88 L94 D95 K100 A101 A102 I112 F116	L41-V98 HydrophobicContact CD1-CG2 4.41Å; F58-V98 HydrophobicContact CE2-CG1 4.45Å; F58-V98 HydrophobicContact CZ-CG1 4.04Å; L62-V98 HydrophobicContact CD1-CG2 4.21Å; L88-V98 HydrophobicContact CD1-CG2 4.41Å; L94-V98 HydrophobicContact CD1-CG1 4.13Å; L94-V98 HydrophobicContact CD2-CG1 4.3Å; D95-V98 HydrophobicContact CB-CB 4.16Å; D95-V98 HydrophobicContact CB-CG2 3.88Å; D95-V98 WeakPolarHBondContact O-CB 3.48Å; D95-V98 PolarHBondContact O-N 2.75Å; V98-K100 VanDerWaalsContact C-N 3.3Å; V98-K100 PolarHBondContact O-N 2.88Å; V98-A101 PolarHBondContact O-N 3.5Å; V98-A102 PolarHBondContact O-N 3.07Å; V98-I112 HydrophobicContact CG1-CG2 4.19Å; V98-F116 HydrophobicContact CG1-CE2 3.9Å
99	A	98	Very high	96.2	Very high	22 Å²	22	45.7 Å²	45.7	18%	0.182	28%	0.276	C	S	.	.	H	α-helix	trans	-59.8	-41.1	175.9	0	0	0	0	0	111.9	L94 D95 A102 T103 V109	L94-A99 HydrophobicContact CB-CB 4.13Å; L94-A99 HydrophobicContact CD1-CB 4.47Å; D95-A99 PolarHBondContact O-N 2.87Å; A99-A102 WeakPolarHBondContact O-CB 3.46Å; A99-A102 PolarHBondContact O-N 3.41Å; A99-T103 PolarHBondContact O-N 3.41Å; A99-T103 PolarHBondContact O-OG1 3.26Å; A99-V109 HydrophobicContact CB-CG1 4.36Å
100	K	97.5	Very high	96	Very high	37 Å²	37	46.3 Å²	46.3	16%	0.161	29%	0.287	C	S	.	.	H	α-helix	trans	-64.1	-44.1	175.1	178.7	173.5	172.1	-178.6	0	112.2	I65 P96 L97 V98 A102 T103 L104 L212 V215	I65-K100 HydrophobicContact CD1-CB 4.4Å; I65-K100 HydrophobicContact CD1-CD 4.23Å; I65-K100 HydrophobicContact CD1-CG 4.01Å; P96-K100 VanDerWaalsContact O-CB 3.26Å; P96-K100 WeakPolarHBondContact O-CB 3.41Å; P96-K100 PolarHBondContact O-N 3.4Å; L97-K100 PolarHBondContact O-N 2.99Å; V98-K100 VanDerWaalsContact C-N 3.3Å; V98-K100 PolarHBondContact O-N 2.88Å; K100-A102 VanDerWaalsContact C-N 3.27Å; K100-A102 PolarHBondContact O-N 3.27Å; K100-T103 PolarHBondContact O-N 3.44Å; K100-L104 HydrophobicContact CG-CD1 3.86Å; K100-L104 HydrophobicContact CG-CG 4.41Å; K100-L104 WeakPolarHBondContact O-CG 3.47Å; K100-L104 PolarHBondContact O-N 3.28Å; K100-L212 HydrophobicContact CD-CD2 3.61Å; K100-L212 VanDerWaalsContact NZ-CD2 3.33Å; K100-L212 PolarHBondContact NZ-O 3.37Å; K100-V215 VanDerWaalsContact NZ-CG2 3.27Å
101	A	97.9	Very high	95.9	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-60.1	-39.7	175.8	0	0	0	0	0	111.5	F58 C61 L62 I65 L97 V98 L104 S105	F58-A101 HydrophobicContact CD2-CB 3.93Å; F58-A101 HydrophobicContact CE2-CB 3.7Å; F58-A101 HydrophobicContact CZ-CB 4.48Å; C61-A101 HydrophobicContact CB-CB 4.14Å; L62-A101 HydrophobicContact CB-CB 3.8Å; L62-A101 HydrophobicContact CD1-CB 4.01Å; L62-A101 HydrophobicContact CG-CB 4.46Å; I65-A101 HydrophobicContact CD1-CB 4.01Å; L97-A101 PolarHBondContact O-N 3.29Å; V98-A101 PolarHBondContact O-N 3.5Å; A101-L104 PolarHBondContact O-N 3.36Å; A101-S105 WeakPolarHBondContact O-CB 3.42Å; A101-S105 PolarHBondContact O-N 3.05Å; A101-S105 VanDerWaalsContact O-N 3.08Å; A101-S105 PolarHBondContact O-OG 2.93Å
102	A	96.7	Very high	96	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-60.3	-48.8	175.1	0	0	0	0	0	111.8	F58 V98 A99 K100 L104 S105 S106 I107 V109 I112	F58-A102 HydrophobicContact CD2-CB 4.41Å; F58-A102 HydrophobicContact CE2-CB 4.19Å; V98-A102 PolarHBondContact O-N 3.07Å; A99-A102 WeakPolarHBondContact O-CB 3.46Å; A99-A102 PolarHBondContact O-N 3.41Å; K100-A102 VanDerWaalsContact C-N 3.27Å; K100-A102 PolarHBondContact O-N 3.27Å; A102-L104 PolarHBondContact O-N 3.17Å; A102-S105 PolarHBondContact O-N 3.27Å; A102-S105 VanDerWaalsContact O-N 3.15Å; A102-S106 PolarHBondContact O-N 3Å; A102-I107 CarbonylContact C-O 3.52Å; A102-I107 PolarHBondContact O-N 2.91Å; A102-V109 HydrophobicContact CB-CG2 4.32Å; A102-I112 HydrophobicContact CB-CG1 3.82Å
103	T	97	Very high	96.2	Very high	93 Å²	93	47.1 Å²	47.1	57%	0.571	27%	0.272	S	S	*	.	H	α-helix	trans	-60.8	-44.8	178.2	-59.8	0	0	0	0	112.2	A99 K100 S105 S106	A99-T103 PolarHBondContact O-N 3.41Å; A99-T103 PolarHBondContact O-OG1 3.26Å; K100-T103 PolarHBondContact O-N 3.44Å; T103-S105 PolarHBondContact O-N 3.2Å; T103-S106 PolarHBondContact O-N 2.92Å
104	L	96.5	Very high	96.2	Very high	70 Å²	70	44.3 Å²	44.3	37%	0.366	26%	0.257	S	S	.	.	H	α-helix	trans	-67.2	-22	179	-70.4	169.3	0	0	0	113.3	I65 K100 A101 A102 V217	I65-L104 HydrophobicContact CD1-CD1 4.08Å; K100-L104 HydrophobicContact CG-CD1 3.86Å; K100-L104 HydrophobicContact CG-CG 4.41Å; K100-L104 WeakPolarHBondContact O-CG 3.47Å; K100-L104 PolarHBondContact O-N 3.28Å; A101-L104 PolarHBondContact O-N 3.36Å; A102-L104 PolarHBondContact O-N 3.17Å; L104-V217 HydrophobicContact CD1-CG2 3.77Å
105	S	95.8	Very high	95.9	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.007	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96	3.6	-179.9	-51.4	0	0	0	0	113.1	R57 F58 C61 A101 A102 T103 I107	R57-S105 VanDerWaalsContact C-OG 3.31Å; R57-S105 PolarHBondContact NE-O 3.08Å; R57-S105 PolarHBondContact O-OG 3.35Å; F58-S105 WeakPolarHBondContact CA-OG 3.41Å; F58-S105 PolarHBondContact N-OG 3.45Å; C61-S105 PolarHBondContact SG-OG 3.07Å; C61-S105 VanDerWaalsContact SG-OG 3.36Å; A101-S105 WeakPolarHBondContact O-CB 3.42Å; A101-S105 PolarHBondContact O-N 3.05Å; A101-S105 VanDerWaalsContact O-N 3.08Å; A101-S105 PolarHBondContact O-OG 2.93Å; A102-S105 PolarHBondContact O-N 3.27Å; A102-S105 VanDerWaalsContact O-N 3.15Å; T103-S105 PolarHBondContact O-N 3.2Å; S105-I107 PolarHBondContact O-N 3.32Å
106	S	95	Very high	95.7	Very high	107 Å²	107	42.9 Å²	42.9	75%	0.748	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.5	30.9	-175.1	-55.4	0	0	0	0	113.8	A102 T103	A102-S106 PolarHBondContact O-N 3Å; T103-S106 PolarHBondContact O-N 2.92Å
107	I	94.8	Very high	95.4	Very high	9 Å²	9	38.4 Å²	38.4	5%	0.046	22%	0.221	C	C	.	.			trans	-100.4	130.8	173.4	-54.3	178.3	0	0	0	108.9	L50 F58 A102 S105 V109 L111 I112	L50-I107 HydrophobicContact CD2-CD1 4.36Å; L50-I107 HydrophobicContact CD2-CG2 3.6Å; F58-I107 HydrophobicContact CB-CD1 3.91Å; F58-I107 HydrophobicContact CG-CD1 4.48Å; A102-I107 CarbonylContact C-O 3.52Å; A102-I107 PolarHBondContact O-N 2.91Å; S105-I107 PolarHBondContact O-N 3.32Å; I107-V109 PolarHBondContact O-N 3.16Å; I107-L111 HydrophobicContact CG2-CD2 4.44Å; I107-I112 HydrophobicContact CB-CD1 4.39Å; I107-I112 HydrophobicContact CB-CG1 4.3Å; I107-I112 HydrophobicContact CD1-CD1 4.08Å; I107-I112 HydrophobicContact CG2-CD1 3.72Å; I107-I112 HydrophobicContact CG2-CG1 3.7Å
108	P	94.9	Very high	95.1	Very high	82 Å²	82	39.4 Å²	39.4	53%	0.532	23%	0.231	S	C	.	.			trans	-55.3	127.7	172.8	-24.6	34.1	0	0	0	111.5	D110 L111 I112	P108-D110 PolarHBondContact O-N 2.98Å; P108-L111 HydrophobicContact CB-CB 4.11Å; P108-L111 VanDerWaalsContact O-CB 3.31Å; P108-L111 WeakPolarHBondContact O-CB 3.47Å; P108-L111 PolarHBondContact O-N 3.11Å; P108-I112 PolarHBondContact O-N 3.41Å
109	V	95.7	Very high	94.8	Very high	52 Å²	52	42.7 Å²	42.7	32%	0.315	25%	0.246	S	C	.	.	H	α-helix	trans	-55.5	-40.4	-178.7	173.7	0	0	0	0	111.3	L94 A99 A102 I107 L111 I112 R113	L94-V109 HydrophobicContact CD1-CG1 3.84Å; A99-V109 HydrophobicContact CB-CG1 4.36Å; A102-V109 HydrophobicContact CB-CG2 4.32Å; I107-V109 PolarHBondContact O-N 3.16Å; V109-L111 VanDerWaalsContact C-N 3.26Å; V109-L111 PolarHBondContact O-N 2.86Å; V109-I112 PolarHBondContact O-N 3.15Å; V109-R113 WeakPolarHBondContact O-CB 3.43Å; V109-R113 PolarHBondContact O-N 3.02Å
110	D	94.2	Very high	94.7	Very high	119 Å²	119	41.7 Å²	41.7	64%	0.636	24%	0.238	S	C	*	.	H	α-helix	trans	-65.7	-28.3	179.3	-65.3	-40.6	0	0	0	113.4	P108 S114	P108-D110 PolarHBondContact O-N 2.98Å; D110-S114 WeakPolarHBondContact O-CB 3.38Å; D110-S114 PolarHBondContact O-N 3.47Å
111	L	93.9	Very high	94.6	Very high	51 Å²	51	40.1 Å²	40.1	27%	0.267	23%	0.232	S	C	.	.	H	α-helix	trans	-72.2	-44.9	177.3	-169.3	60.2	0	0	0	110.3	V48 L50 I107 P108 V109 S114 A115	V48-L111 HydrophobicContact CG1-CD1 3.32Å; V48-L111 HydrophobicContact CG1-CG 3.77Å; L50-L111 HydrophobicContact CD2-CD2 3.36Å; L50-L111 HydrophobicContact CD2-CG 4.06Å; L50-L111 HydrophobicContact CG-CD2 4.17Å; I107-L111 HydrophobicContact CG2-CD2 4.44Å; P108-L111 HydrophobicContact CB-CB 4.11Å; P108-L111 VanDerWaalsContact O-CB 3.31Å; P108-L111 WeakPolarHBondContact O-CB 3.47Å; P108-L111 PolarHBondContact O-N 3.11Å; V109-L111 VanDerWaalsContact C-N 3.26Å; V109-L111 PolarHBondContact O-N 2.86Å; L111-S114 PolarHBondContact O-N 2.84Å; L111-S114 PolarHBondContact O-OG 3.21Å; L111-A115 PolarHBondContact O-N 3.27Å
112	I	95.2	Very high	94.6	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-60.6	-46.1	171.6	-62.3	-63.1	0	0	0	110.6	L45 L50 F58 L94 V98 A102 I107 P108 V109 S114 A115 F116	L45-I112 HydrophobicContact CD1-CD1 3.69Å; L45-I112 HydrophobicContact CD2-CD1 3.65Å; L45-I112 HydrophobicContact CD2-CG2 4.34Å; L45-I112 HydrophobicContact CG-CD1 4.34Å; L50-I112 HydrophobicContact CD1-CD1 4.13Å; F58-I112 HydrophobicContact CD2-CD1 4.47Å; F58-I112 HydrophobicContact CE2-CD1 4.43Å; F58-I112 HydrophobicContact CZ-CG2 4.4Å; L94-I112 HydrophobicContact CD1-CB 3.99Å; L94-I112 HydrophobicContact CD1-CG2 3.7Å; L94-I112 HydrophobicContact CD2-CG2 4.31Å; V98-I112 HydrophobicContact CG1-CG2 4.19Å; A102-I112 HydrophobicContact CB-CG1 3.82Å; I107-I112 HydrophobicContact CB-CD1 4.39Å; I107-I112 HydrophobicContact CB-CG1 4.3Å; I107-I112 HydrophobicContact CD1-CD1 4.08Å; I107-I112 HydrophobicContact CG2-CD1 3.72Å; I107-I112 HydrophobicContact CG2-CG1 3.7Å; P108-I112 PolarHBondContact O-N 3.41Å; V109-I112 PolarHBondContact O-N 3.15Å; I112-S114 PolarHBondContact O-N 3.33Å; I112-A115 VanDerWaalsContact O-CB 3.28Å; I112-A115 WeakPolarHBondContact O-CB 3.41Å; I112-A115 PolarHBondContact O-N 2.88Å; I112-F116 HydrophobicContact CG2-CD2 4.15Å; I112-F116 HydrophobicContact CG2-CE2 3.41Å; I112-F116 VanDerWaalsContact CG2-CE2 3.41Å; I112-F116 HydrophobicContact CG2-CZ 3.78Å
113	R	94.2	Very high	94.7	Very high	98 Å²	98	42.1 Å²	42.1	37%	0.37	24%	0.239	S	C	.	.	H	α-helix	trans	-57.8	-36.9	175.8	-178.1	-126.6	49.4	77.9	-7.5	112.1	L94 V109 A115 F116	L94-R113 HydrophobicContact CD1-CB 4.38Å; L94-R113 HydrophobicContact CD2-CB 4.02Å; L94-R113 HydrophobicContact CD2-CG 4.47Å; L94-R113 HydrophobicContact CG-CB 3.97Å; V109-R113 WeakPolarHBondContact O-CB 3.43Å; V109-R113 PolarHBondContact O-N 3.02Å; R113-A115 PolarHBondContact O-N 3.38Å; R113-F116 PolarHBondContact O-N 3.29Å
114	S	92.7	Very high	94.7	Very high	44 Å²	44	37.7 Å²	37.7	31%	0.308	21%	0.212	S	C	.	.	H	α-helix	trans	-67.4	-23.3	178.3	78.4	0	0	0	0	114.3	D110 L111 I112 F116	D110-S114 WeakPolarHBondContact O-CB 3.38Å; D110-S114 PolarHBondContact O-N 3.47Å; L111-S114 PolarHBondContact O-N 2.84Å; L111-S114 PolarHBondContact O-OG 3.21Å; I112-S114 PolarHBondContact O-N 3.33Å; S114-F116 VanDerWaalsContact C-N 3.34Å
115	A	92.3	Very high	94.7	Very high	3 Å²	3	34.7 Å²	34.7	3%	0.025	20%	0.196	C	C	.	.	H	α-helix	trans	-77.5	-21.7	177.2	0	0	0	0	0	113.1	L45 V48 L111 I112 R113	L45-A115 HydrophobicContact CD2-CB 3.46Å; L45-A115 VanDerWaalsContact CD2-CB 3.46Å; V48-A115 HydrophobicContact CG2-CB 3.38Å; L111-A115 PolarHBondContact O-N 3.27Å; I112-A115 VanDerWaalsContact O-CB 3.28Å; I112-A115 WeakPolarHBondContact O-CB 3.41Å; I112-A115 PolarHBondContact O-N 2.88Å; R113-A115 PolarHBondContact O-N 3.38Å
116	F	93.5	Very high	94.6	Very high	2 Å²	2	35 Å²	35	1%	0.009	20%	0.199	C	C	.	.	S	Bend	trans	-104.2	147.9	-171.8	-59.3	-25.8	0	0	0	112	L41 L44 L45 I90 L94 V98 I112 R113 S114 L296	L41-F116 HydrophobicContact CB-CZ 4.3Å; L41-F116 HydrophobicContact CD2-CE1 4.38Å; L41-F116 HydrophobicContact CD2-CZ 4.19Å; L41-F116 WeakPolarHBondContact O-CE1 3.42Å; L44-F116 HydrophobicContact CB-CD1 3.88Å; L44-F116 HydrophobicContact CB-CE1 3.83Å; L44-F116 HydrophobicContact CD1-CD1 3.79Å; L44-F116 HydrophobicContact CD1-CE1 4.15Å; L44-F116 HydrophobicContact CG-CD1 4.49Å; L45-F116 HydrophobicContact CD2-CE1 3.63Å; L45-F116 HydrophobicContact CD2-CZ 3.81Å; L45-F116 HydrophobicContact CG-CE1 4.3Å; L45-F116 HydrophobicContact CG-CZ 4.49Å; I90-F116 HydrophobicContact CD1-CB 4.27Å; I90-F116 HydrophobicContact CD1-CD2 3.42Å; I90-F116 VanDerWaalsContact CD1-CD2 3.42Å; I90-F116 HydrophobicContact CD1-CE2 4.01Å; I90-F116 HydrophobicContact CD1-CG 4.09Å; L94-F116 HydrophobicContact CD2-CD2 3.61Å; L94-F116 HydrophobicContact CD2-CE2 4.02Å; V98-F116 HydrophobicContact CG1-CE2 3.9Å; I112-F116 HydrophobicContact CG2-CD2 4.15Å; I112-F116 HydrophobicContact CG2-CE2 3.41Å; I112-F116 VanDerWaalsContact CG2-CE2 3.41Å; I112-F116 HydrophobicContact CG2-CZ 3.78Å; R113-F116 PolarHBondContact O-N 3.29Å; S114-F116 VanDerWaalsContact C-N 3.34Å; F116-L296 VanDerWaalsContact C-CD2 3.44Å; F116-L296 VanDerWaalsContact O-CD2 3.25Å; F116-L296 WeakPolarHBondContact O-CD2 3.22Å
117	P	91.1	Very high	94.5	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.006	17%	0.167	C	C	.	.			trans	-43.5	144.7	163.3	-34.8	41.6	0	0	0	112.3	E119 L120 F133 N297 C300	P117-E119 PolarHBondContact O-N 2.94Å; P117-E119 VanDerWaalsContact O-N 3.16Å; P117-L120 HydrophobicContact CB-CB 4.24Å; P117-F133 HydrophobicContact CB-CD1 4.32Å; P117-F133 HydrophobicContact CG-CD1 3.7Å; P117-F133 HydrophobicContact CG-CE1 3.92Å; P117-N297 WeakPolarHBondContact CB-OD1 3.49Å; P117-C300 VanDerWaalsContact CD-SG 3.59Å; P117-C300 HydrophobicContact CG-CB 3.96Å; P117-C300 VanDerWaalsContact CG-SG 3.58Å
118	A	91.2	Very high	94.4	Very high	36 Å²	36	33.2 Å²	33.2	30%	0.298	18%	0.181	S	C	.	.	S	Bend	trans	-58.4	-31.2	175.4	0	0	0	0	0	112.1	N91 G92 N293	N91-A118 CarbonylContact C-O 3.55Å; N91-A118 VanDerWaalsContact CA-O 3.22Å; N91-A118 WeakPolarHBondContact CA-O 3.34Å; G92-A118 PolarHBondContact N-O 3.42Å; A118-N293 WeakPolarHBondContact CB-ND2 3.41Å; A118-N293 PolarHBondContact N-OD1 2.92Å
119	E	93	Very high	94.5	Very high	69 Å²	69	29.3 Å²	29.3	32%	0.322	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	112	179	-69.1	173.9	177.5	0	0	109.7	I90 P117 G134 E135	I90-E119 CarbonylContact O-C 3.58Å; I90-E119 WeakPolarHBondContact O-CA 3.25Å; P117-E119 PolarHBondContact O-N 2.94Å; P117-E119 VanDerWaalsContact O-N 3.16Å; E119-G134 PolarHBondContact O-N 2.84Å; E119-G134 VanDerWaalsContact OE2-CA 3.29Å; E119-G134 WeakPolarHBondContact OE2-CA 3.26Å; E119-E135 HydrophobicContact CG-CG 4.45Å; E119-E135 PolarHBondContact OE2-N 3.3Å
120	L	95.1	Very high	94.5	Very high	2 Å²	2	27.1 Å²	27.1	1%	0.01	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	129.3	179	173.7	63.6	0	0	0	109	L41 L44 I90 P117 V131 R132 F133	L41-L120 HydrophobicContact CD2-CD2 4.08Å; L44-L120 HydrophobicContact CD1-CD2 4.14Å; I90-L120 HydrophobicContact CB-CB 4.2Å; I90-L120 HydrophobicContact CD1-CB 4.4Å; I90-L120 HydrophobicContact CD1-CD2 3.93Å; I90-L120 HydrophobicContact CD1-CG 4.44Å; I90-L120 PolarHBondContact N-O 3.08Å; I90-L120 PolarHBondContact O-N 2.83Å; P117-L120 HydrophobicContact CB-CB 4.24Å; L120-V131 HydrophobicContact CD1-CG2 3.3Å; L120-R132 WeakPolarHBondContact CA-O 3.47Å; L120-F133 HydrophobicContact CD1-CD1 3.74Å; L120-F133 HydrophobicContact CD1-CE1 3.62Å; L120-F133 HydrophobicContact CD1-CZ 4.36Å
121	S	96.4	Very high	94.5	Very high	4 Å²	4	21.4 Å²	21.4	3%	0.028	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	132.4	169.5	-62.8	0	0	0	0	109.2	L88 W123 V131 R132	L88-S121 WeakPolarHBondContact O-CA 3.43Å; S121-W123 VanDerWaalsContact CB-CH2 3.42Å; S121-V131 CarbonylContact O-C 3.41Å; S121-V131 WeakPolarHBondContact O-CA 3.47Å; S121-R132 PolarHBondContact N-O 2.88Å; S121-R132 PolarHBondContact O-N 3.05Å
122	L	98.1	Very high	94.5	Very high	1 Å²	1	20.3 Å²	20.3	1%	0.005	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	118.3	-179.6	-173.7	72.3	0	0	0	109.1	A37 F40 L41 C87 L88 V129 S130 V131 I142	A37-L122 HydrophobicContact CB-CD2 3.81Å; F40-L122 HydrophobicContact CD1-CD1 3.95Å; F40-L122 HydrophobicContact CD1-CD2 4.16Å; F40-L122 HydrophobicContact CE1-CD1 4.13Å; L41-L122 HydrophobicContact CD1-CD2 4.15Å; L41-L122 HydrophobicContact CD2-CD2 4.37Å; L41-L122 HydrophobicContact CG-CD2 4.07Å; C87-L122 CarbonylContact C-O 3.49Å; C87-L122 WeakPolarHBondContact CA-O 3.46Å; L88-L122 HydrophobicContact CB-CB 4.38Å; L88-L122 HydrophobicContact CD1-CD2 4.38Å; L88-L122 PolarHBondContact N-O 3.47Å; L88-L122 PolarHBondContact O-N 2.96Å; L122-V129 HydrophobicContact CD1-CG1 3.85Å; L122-V129 HydrophobicContact CG-CG1 4.24Å; L122-S130 CarbonylContact C-O 3.51Å; L122-S130 WeakPolarHBondContact CA-O 3.49Å; L122-S130 WeakPolarHBondContact CD1-O 3.42Å; L122-V131 HydrophobicContact CD1-CB 3.77Å; L122-V131 HydrophobicContact CD1-CG2 3.93Å; L122-I142 HydrophobicContact CD1-CD1 3.84Å
123	W	98.3	Very high	94.3	Very high	41 Å²	41	20.4 Å²	20.4	16%	0.155	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	128.4	177.4	-64.4	-92.1	0	0	0	109.7	S83 S121 V129 S130 R132 V139	S83-W123 VanDerWaalsContact OG-CD1 3.27Å; S121-W123 VanDerWaalsContact CB-CH2 3.42Å; W123-V129 VanDerWaalsContact O-CA 3.31Å; W123-V129 WeakPolarHBondContact O-CA 3.24Å; W123-V129 WeakPolarHBondContact O-CG1 3.49Å; W123-S130 PolarHBondContact N-O 3.01Å; W123-S130 PolarHBondContact O-N 2.83Å; W123-S130 VanDerWaalsContact O-N 3.1Å; W123-R132 HydrophobicContact CH2-CB 3.87Å; W123-R132 HydrophobicContact CZ3-CB 3.66Å; W123-V139 HydrophobicContact CZ3-CG1 4.5Å; W123-V139 HydrophobicContact CZ3-CG2 4.42Å
124	V	97.5	Very high	94	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	90.9	177.8	-169.1	0	0	0	0	107.4	E33 V34 A37 Y70 W74 R86 V129	E33-V124 HydrophobicContact CB-CG1 3.99Å; V34-V124 HydrophobicContact CG2-CG1 4.12Å; A37-V124 HydrophobicContact CB-CG1 4.37Å; A37-V124 HydrophobicContact CB-CG2 3.54Å; Y70-V124 HydrophobicContact CE2-CB 3.93Å; Y70-V124 HydrophobicContact CE2-CG1 4.17Å; Y70-V124 HydrophobicContact CE2-CG2 4.27Å; W74-V124 HydrophobicContact CH2-CG1 4.4Å; W74-V124 HydrophobicContact CZ3-CG1 4.42Å; W74-V124 WeakPolarHBondContact CZ3-O 3.26Å; R86-V124 WeakPolarHBondContact CB-O 3.47Å; R86-V124 WeakPolarHBondContact CD-O 3.42Å; R86-V124 PolarHBondContact NE-O 3.12Å; V124-V129 HydrophobicContact CG1-CG2 4.42Å
125	D	96.2	Very high	93.7	Very high	6 Å²	6	16.8 Å²	16.8	3%	0.032	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	153.4	-173	-68.2	-22.1	0	0	0	110.7	W74 S83 R86 G127 E128	W74-D125 VanDerWaalsContact CH2-C 3.45Å; S83-D125 WeakPolarHBondContact CA-OD1 3.47Å; S83-D125 WeakPolarHBondContact CB-OD1 3.42Å; S83-D125 WeakPolarHBondContact CB-OD2 3.27Å; S83-D125 PolarHBondContact OG-OD1 3.48Å; S83-D125 PolarHBondContact OG-OD2 3.16Å; R86-D125 IonicContact CZ-OD1 2.94Å; R86-D125 IonicContact NE-OD1 3.79Å; R86-D125 PolarHBondContact NE-OD1 2.83Å; R86-D125 IonicContact NH2-OD1 3.76Å; R86-D125 PolarHBondContact NH2-OD1 3.24Å; D125-G127 PolarHBondContact O-N 3.13Å; D125-G127 VanDerWaalsContact O-N 3.15Å; D125-E128 CarbonylContact C-O 3.59Å; D125-E128 WeakPolarHBondContact CA-O 3.33Å; D125-E128 PolarHBondContact N-O 3.23Å; D125-E128 CarbonylContact O-C 3.51Å; D125-E128 PolarHBondContact O-N 2.91Å
126	P	94.5	Very high	93.4	Very high	9 Å²	9	23 Å²	23	6%	0.058	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	121.8	175.8	-23.3	29.7	0	0	0	112.2	W74 P79 E128	W74-P126 HydrophobicContact CD2-CG 3.82Å; W74-P126 HydrophobicContact CE3-CG 4.23Å; W74-P126 HydrophobicContact CG-CG 4.32Å; W74-P126 HydrophobicContact CH2-CG 4.21Å; W74-P126 HydrophobicContact CZ2-CB 3.88Å; W74-P126 HydrophobicContact CZ2-CG 3.81Å; W74-P126 HydrophobicContact CZ3-CG 4.41Å; P79-P126 HydrophobicContact CB-CB 4.13Å; P79-P126 HydrophobicContact CB-CG 4.23Å; P79-P126 WeakPolarHBondContact CB-O 3.38Å; P79-P126 HydrophobicContact CG-CB 4.33Å; P126-E128 VanDerWaalsContact C-N 3.28Å; P126-E128 PolarHBondContact O-N 3.37Å
127	G	92.1	Very high	92.9	Very high	9 Å²	9	23.2 Å²	23.2	9%	0.093	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.2	-5.3	-178.5	0	0	0	0	0	115.8	E33 D125 S144 C145	E33-G127 PolarHBondContact OE1-N 3.4Å; D125-G127 PolarHBondContact O-N 3.13Å; D125-G127 VanDerWaalsContact O-N 3.15Å; G127-S144 VanDerWaalsContact O-CA 3.31Å; G127-S144 WeakPolarHBondContact O-CA 3.42Å; G127-S144 PolarHBondContact O-OG 3.17Å; G127-C145 PolarHBondContact O-N 3.42Å
128	E	93.5	Very high	92.5	Very high	69 Å²	69	23.7 Å²	23.7	32%	0.322	13%	0.13	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	134.1	-175.7	-166	-178.7	103.4	0	0	113.4	D125 P126 V141 Y143	D125-E128 CarbonylContact C-O 3.59Å; D125-E128 WeakPolarHBondContact CA-O 3.33Å; D125-E128 PolarHBondContact N-O 3.23Å; D125-E128 CarbonylContact O-C 3.51Å; D125-E128 PolarHBondContact O-N 2.91Å; P126-E128 VanDerWaalsContact C-N 3.28Å; P126-E128 PolarHBondContact O-N 3.37Å; E128-V141 HydrophobicContact CG-CG1 3.75Å; E128-V141 HydrophobicContact CG-CG2 4.11Å; E128-Y143 WeakPolarHBondContact CA-O 3.23Å
129	V	95.7	Very high	92.4	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	123.3	162.9	-171.8	0	0	0	0	108.7	E33 A36 A37 L122 W123 V124 I142 Y143	E33-V129 HydrophobicContact CB-CG2 3.85Å; E33-V129 HydrophobicContact CG-CG2 4.42Å; E33-V129 VanDerWaalsContact O-CG2 3.32Å; E33-V129 WeakPolarHBondContact O-CG2 3.18Å; A36-V129 HydrophobicContact CB-CG2 4.19Å; A37-V129 HydrophobicContact CB-CG1 3.94Å; L122-V129 HydrophobicContact CD1-CG1 3.85Å; L122-V129 HydrophobicContact CG-CG1 4.24Å; W123-V129 VanDerWaalsContact O-CA 3.31Å; W123-V129 WeakPolarHBondContact O-CA 3.24Å; W123-V129 WeakPolarHBondContact O-CG1 3.49Å; V124-V129 HydrophobicContact CG1-CG2 4.42Å; V129-I142 HydrophobicContact CB-CD1 4.45Å; V129-I142 HydrophobicContact CB-CG1 3.99Å; V129-I142 HydrophobicContact CG1-CD1 3.79Å; V129-I142 HydrophobicContact CG1-CG1 3.81Å; V129-I142 WeakPolarHBondContact O-CG1 3.41Å; V129-I142 PolarHBondContact O-N 3.43Å; V129-Y143 HydrophobicContact CG2-CD1 4.06Å; V129-Y143 HydrophobicContact CG2-CG 4.39Å; V129-Y143 PolarHBondContact N-O 3.49Å; V129-Y143 PolarHBondContact O-N 3.37Å
130	S	95	Very high	92.2	Very high	5 Å²	5	19.8 Å²	19.8	4%	0.035	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	151.4	-178.5	59.8	0	0	0	0	111.9	L122 W123 G140	L122-S130 CarbonylContact C-O 3.51Å; L122-S130 WeakPolarHBondContact CA-O 3.49Å; L122-S130 WeakPolarHBondContact CD1-O 3.42Å; W123-S130 PolarHBondContact N-O 3.01Å; W123-S130 PolarHBondContact O-N 2.83Å; W123-S130 VanDerWaalsContact O-N 3.1Å; S130-G140 CarbonylContact C-O 3.58Å; S130-G140 VanDerWaalsContact CA-O 3.26Å; S130-G140 WeakPolarHBondContact CA-O 3.29Å; S130-G140 WeakPolarHBondContact CB-O 3.47Å
131	V	95.3	Very high	92	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	146.2	-171.5	71.9	0	0	0	0	111.5	F40 L120 S121 L122 F133 V139 G140 I142 A304	F40-V131 HydrophobicContact CE1-CB 4.5Å; F40-V131 HydrophobicContact CE1-CG2 3.77Å; F40-V131 HydrophobicContact CZ-CG2 3.9Å; L120-V131 HydrophobicContact CD1-CG2 3.3Å; S121-V131 CarbonylContact O-C 3.41Å; S121-V131 WeakPolarHBondContact O-CA 3.47Å; L122-V131 HydrophobicContact CD1-CB 3.77Å; L122-V131 HydrophobicContact CD1-CG2 3.93Å; V131-F133 HydrophobicContact CG1-CE2 3.86Å; V131-F133 HydrophobicContact CG1-CZ 4.4Å; V131-F133 HydrophobicContact CG2-CE1 4.43Å; V131-F133 HydrophobicContact CG2-CE2 4.09Å; V131-F133 HydrophobicContact CG2-CZ 4.06Å; V131-V139 CarbonylContact O-C 3.58Å; V131-V139 WeakPolarHBondContact O-CA 3.26Å; V131-G140 PolarHBondContact N-O 3.43Å; V131-G140 PolarHBondContact O-N 3.24Å; V131-I142 HydrophobicContact CB-CG2 4.35Å; V131-I142 HydrophobicContact CG1-CG2 3.61Å; V131-A304 HydrophobicContact CG1-CB 4.23Å
132	R	93.1	Very high	91.7	Very high	28 Å²	28	21.1 Å²	21.1	11%	0.106	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	132.8	171.7	-173.4	177.5	72.7	-157.1	12.7	110.8	L120 S121 W123 G134 E135 G137 V139	L120-R132 WeakPolarHBondContact CA-O 3.47Å; S121-R132 PolarHBondContact N-O 2.88Å; S121-R132 PolarHBondContact O-N 3.05Å; W123-R132 HydrophobicContact CH2-CB 3.87Å; W123-R132 HydrophobicContact CZ3-CB 3.66Å; R132-G134 WeakPolarHBondContact CG-O 3.43Å; R132-G134 PolarHBondContact NE-O 2.79Å; R132-E135 PolarHBondContact NE-O 2.81Å; R132-E135 IonicContact NH2-OE2 2.71Å; R132-E135 PolarHBondContact NH2-OE2 2.95Å; R132-E135 VanDerWaalsContact NH2-OE2 3.16Å; R132-G137 VanDerWaalsContact CD-O 3.23Å; R132-G137 WeakPolarHBondContact CD-O 3.41Å; R132-G137 WeakPolarHBondContact CG-O 3.36Å; R132-V139 HydrophobicContact CB-CG2 4.21Å; R132-V139 HydrophobicContact CG-CG2 4.39Å
133	F	90.8	Very high	91.3	Very high	1 Å²	1	24 Å²	24	0%	0.004	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	115.5	176.8	-60.8	-80.4	0	0	0	110.9	F40 P117 L120 V131 G137 C300 R301 A304 W315	F40-F133 HydrophobicContact CE2-CZ 4.39Å; F40-F133 HydrophobicContact CZ-CE1 4.27Å; F40-F133 AromaticContact CZ-CZ 3.72Å; F40-F133 HydrophobicContact CZ-CZ 3.72Å; P117-F133 HydrophobicContact CB-CD1 4.32Å; P117-F133 HydrophobicContact CG-CD1 3.7Å; P117-F133 HydrophobicContact CG-CE1 3.92Å; L120-F133 HydrophobicContact CD1-CD1 3.74Å; L120-F133 HydrophobicContact CD1-CE1 3.62Å; L120-F133 HydrophobicContact CD1-CZ 4.36Å; V131-F133 HydrophobicContact CG1-CE2 3.86Å; V131-F133 HydrophobicContact CG1-CZ 4.4Å; V131-F133 HydrophobicContact CG2-CE1 4.43Å; V131-F133 HydrophobicContact CG2-CE2 4.09Å; V131-F133 HydrophobicContact CG2-CZ 4.06Å; F133-G137 VanDerWaalsContact O-CA 3.29Å; F133-G137 WeakPolarHBondContact O-CA 3.33Å; F133-C300 HydrophobicContact CD1-CB 4Å; F133-C300 HydrophobicContact CE1-CB 3.24Å; F133-C300 HydrophobicContact CZ-CB 3.64Å; F133-C300 WeakPolarHBondContact CZ-O 3.46Å; F133-R301 HydrophobicContact CB-CG 4.35Å; F133-R301 HydrophobicContact CD2-CG 3.59Å; F133-R301 HydrophobicContact CE2-CG 4Å; F133-R301 HydrophobicContact CG-CG 4.04Å; F133-R301 PolarHBondContact O-NH2 3.05Å; F133-R301 VanDerWaalsContact O-NH2 3.09Å; F133-A304 HydrophobicContact CE2-CB 4.08Å; F133-A304 HydrophobicContact CZ-CB 4.31Å; F133-W315 AromaticContact CD2-CH2 3.65Å; F133-W315 HydrophobicContact CD2-CH2 3.65Å; F133-W315 HydrophobicContact CD2-CZ3 4.26Å; F133-W315 AromaticContact CE2-CH2 3.57Å; F133-W315 HydrophobicContact CE2-CH2 3.57Å; F133-W315 HydrophobicContact CE2-CZ2 4.25Å
134	G	88.8	Confident	90.9	Very high	15 Å²	15	24.5 Å²	24.5	16%	0.155	14%	0.135	C	C	.	.	S	Bend	trans	86.1	153.9	-167.7	0	0	0	0	0	112.7	E119 R132 D136 G137	E119-G134 PolarHBondContact O-N 2.84Å; E119-G134 VanDerWaalsContact OE2-CA 3.29Å; E119-G134 WeakPolarHBondContact OE2-CA 3.26Å; R132-G134 WeakPolarHBondContact CG-O 3.43Å; R132-G134 PolarHBondContact NE-O 2.79Å; G134-D136 VanDerWaalsContact C-N 3.32Å; G134-G137 PolarHBondContact O-N 3.21Å
135	E	86.6	Confident	90.2	Very high	51 Å²	51	26.1 Å²	26.1	24%	0.238	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-40.5	173.7	-67.9	-61.7	167.4	0	0	112	R89 N91 E119 R132 G137	R89-E135 IonicContact CZ-OE1 3.66Å; R89-E135 IonicContact CZ-OE2 3.05Å; R89-E135 IonicContact NE-OE1 2.68Å; R89-E135 IonicContact NH1-OE2 2.89Å; R89-E135 IonicContact NH2-OE1 3.69Å; R89-E135 PolarHBondContact NH2-OE1 3.47Å; R89-E135 IonicContact NH2-OE2 3Å; R89-E135 PolarHBondContact NH2-OE2 3.13Å; N91-E135 PolarHBondContact ND2-OE1 2.92Å; E119-E135 HydrophobicContact CG-CG 4.45Å; E119-E135 PolarHBondContact OE2-N 3.3Å; R132-E135 PolarHBondContact NE-O 2.81Å; R132-E135 IonicContact NH2-OE2 2.71Å; R132-E135 PolarHBondContact NH2-OE2 2.95Å; R132-E135 VanDerWaalsContact NH2-OE2 3.16Å; E135-G137 VanDerWaalsContact C-N 3.29Å; E135-G137 PolarHBondContact O-N 3.26Å
136	D	84.9	Confident	89.2	Confident	135 Å²	135	32.9 Å²	32.9	72%	0.722	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.8	18.4	176.9	-59.7	-42.9	0	0	0	112.8	G134	G134-D136 VanDerWaalsContact C-N 3.32Å
137	G	82.9	Confident	87.8	Confident	6 Å²	6	36.1 Å²	36.1	6%	0.062	20%	0.204	C	C	.	.	P	Polyproline II helix	trans	-73.1	157.4	-179.8	0	0	0	0	0	114	R132 F133 G134 E135	R132-G137 VanDerWaalsContact CD-O 3.23Å; R132-G137 WeakPolarHBondContact CD-O 3.41Å; R132-G137 WeakPolarHBondContact CG-O 3.36Å; F133-G137 VanDerWaalsContact O-CA 3.29Å; F133-G137 WeakPolarHBondContact O-CA 3.33Å; G134-G137 PolarHBondContact O-N 3.21Å; E135-G137 VanDerWaalsContact C-N 3.29Å; E135-G137 PolarHBondContact O-N 3.26Å
138	S	83.7	Confident	86.1	Confident	11 Å²	11	40.3 Å²	40.3	8%	0.077	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-69	144.9	163.1	54.1	0	0	0	0	111.1	S316	S138-S316 WeakPolarHBondContact CB-O 3.42Å
139	V	88.5	Confident	84.4	Confident	22 Å²	22	41.8 Å²	41.8	13%	0.133	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	128.9	170.5	-177.3	0	0	0	0	108.4	W123 V131 R132	W123-V139 HydrophobicContact CZ3-CG1 4.5Å; W123-V139 HydrophobicContact CZ3-CG2 4.42Å; V131-V139 CarbonylContact O-C 3.58Å; V131-V139 WeakPolarHBondContact O-CA 3.26Å; R132-V139 HydrophobicContact CB-CG2 4.21Å; R132-V139 HydrophobicContact CG-CG2 4.39Å
140	G	89.1	Confident	82.4	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.01	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	141.9	173	0	0	0	0	0	110.8	S130 V131	S130-G140 CarbonylContact C-O 3.58Å; S130-G140 VanDerWaalsContact CA-O 3.26Å; S130-G140 WeakPolarHBondContact CA-O 3.29Å; S130-G140 WeakPolarHBondContact CB-O 3.47Å; V131-G140 PolarHBondContact N-O 3.43Å; V131-G140 PolarHBondContact O-N 3.24Å
141	V	90.4	Very high	80.2	Confident	22 Å²	22	51.7 Å²	51.7	13%	0.133	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	121.7	175.1	176.8	0	0	0	0	108.3	E128 Y143 V308 M313	E128-V141 HydrophobicContact CG-CG1 3.75Å; E128-V141 HydrophobicContact CG-CG2 4.11Å; V141-Y143 VanDerWaalsContact CG1-O 3.23Å; V141-Y143 WeakPolarHBondContact CG1-O 3.35Å; V141-V308 WeakPolarHBondContact O-CG2 3.38Å; V141-M313 VanDerWaalsContact O-O 3.1Å
142	I	90.2	Very high	77.9	Confident	12 Å²	12	57.8 Å²	57.8	6%	0.062	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	-16.3	179	60.3	166.4	0	0	0	112.7	F40 L122 V129 V131 A304 L307	F40-I142 HydrophobicContact CB-CD1 3.57Å; F40-I142 HydrophobicContact CD1-CD1 3.81Å; F40-I142 HydrophobicContact CD2-CD1 3.96Å; F40-I142 HydrophobicContact CG-CD1 3.48Å; F40-I142 VanDerWaalsContact CG-CD1 3.48Å; L122-I142 HydrophobicContact CD1-CD1 3.84Å; V129-I142 HydrophobicContact CB-CD1 4.45Å; V129-I142 HydrophobicContact CB-CG1 3.99Å; V129-I142 HydrophobicContact CG1-CD1 3.79Å; V129-I142 HydrophobicContact CG1-CG1 3.81Å; V129-I142 WeakPolarHBondContact O-CG1 3.41Å; V129-I142 PolarHBondContact O-N 3.43Å; V131-I142 HydrophobicContact CB-CG2 4.35Å; V131-I142 HydrophobicContact CG1-CG2 3.61Å; I142-A304 HydrophobicContact CG2-CB 3.8Å; I142-L307 HydrophobicContact CB-CD1 4.45Å
143	Y	90.3	Very high	75.6	Confident	62 Å²	62	65.4 Å²	65.4	24%	0.243	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	137.2	175.9	175.6	-89.3	0	0	0	108.9	A32 E33 A36 E128 V129 V141 C145	A32-Y143 VanDerWaalsContact CB-OH 3.29Å; A32-Y143 WeakPolarHBondContact CB-OH 3.48Å; E33-Y143 HydrophobicContact CG-CD1 4.21Å; E33-Y143 HydrophobicContact CG-CE1 3.87Å; A36-Y143 HydrophobicContact CB-CD1 4.32Å; A36-Y143 HydrophobicContact CB-CD2 3.72Å; A36-Y143 HydrophobicContact CB-CE2 4.47Å; A36-Y143 HydrophobicContact CB-CG 3.63Å; E128-Y143 WeakPolarHBondContact CA-O 3.23Å; V129-Y143 HydrophobicContact CG2-CD1 4.06Å; V129-Y143 HydrophobicContact CG2-CG 4.39Å; V129-Y143 PolarHBondContact N-O 3.49Å; V129-Y143 PolarHBondContact O-N 3.37Å; V141-Y143 VanDerWaalsContact CG1-O 3.23Å; V141-Y143 WeakPolarHBondContact CG1-O 3.35Å; Y143-C145 HydrophobicContact CE1-CB 4.05Å; Y143-C145 WeakPolarHBondContact OH-CB 3.47Å
144	S	89	Confident	73	Confident	51 Å²	51	74.4 Å²	74.4	36%	0.357	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	141.8	171.3	-177.2	0	0	0	0	108.9	G127	G127-S144 VanDerWaalsContact O-CA 3.31Å; G127-S144 WeakPolarHBondContact O-CA 3.42Å; G127-S144 PolarHBondContact O-OG 3.17Å
145	C	83.3	Confident	70.8	Confident	34 Å²	34	83.3 Å²	83.3	23%	0.23	44%	0.438	C	S	.	.			trans	-139.1	158.5	171.1	63.3	0	0	0	0	109.7	G127 Y143	G127-C145 PolarHBondContact O-N 3.42Å; Y143-C145 HydrophobicContact CE1-CB 4.05Å; Y143-C145 WeakPolarHBondContact OH-CB 3.47Å
146	D	75.8	Confident	68.1	Low	147 Å²	147	90.1 Å²	90.1	79%	0.786	47%	0.47	S	S	*	.			trans	-59.1	131.6	172.4	-68.6	-43	0	0	0	108.9	V148	D146-V148 PolarHBondContact O-N 2.94Å
147	P	63.9	Low	65.8	Low	78 Å²	78	88.3 Å²	88.3	51%	0.506	47%	0.474	S	S	.	.			trans	-57.7	117.7	-177.8	20.5	-30.4	0	0	0	109.1	M149	P147-M149 PolarHBondContact O-N 2.89Å
148	V	58.3	Low	63.4	Low	97 Å²	97	97 Å²	97	59%	0.588	51%	0.513	S	S	*	.			trans	-70.7	85.7	173.9	-175.5	0	0	0	0	107.6	L29 D146	L29-V148 HydrophobicContact CD2-CB 4.34Å; L29-V148 HydrophobicContact CD2-CG1 3.96Å; D146-V148 PolarHBondContact O-N 2.94Å
149	M	57.9	Low	61	Low	99 Å²	99	103 Å²	103	49%	0.488	55%	0.55	S	S	.	.			trans	-68.4	128.6	170.2	-65	-67.1	-75.4	0	0	107.5	R77 P147 V151	R77-M149 HydrophobicContact CG-CE 4.19Å; P147-M149 PolarHBondContact O-N 2.89Å; M149-V151 PolarHBondContact O-N 3.46Å; M149-V151 VanDerWaalsContact O-N 3.16Å
150	P	53.1	Low	58.4	Low	65 Å²	65	107.3 Å²	107.3	42%	0.422	58%	0.578	S	S	.	*			trans	-54.9	126.1	164.7	-18.7	29.6	0	0	0	107.8	E152	P150-E152 PolarHBondContact O-N 3.39Å
151	V	48.6	Very low	55.8	Low	149 Å²	149	113 Å²	113	90%	0.903	61%	0.614	S	S	*	*			trans	-56.8	107.1	172.5	-171.4	0	0	0	0	106.8	M149	M149-V151 PolarHBondContact O-N 3.46Å; M149-V151 VanDerWaalsContact O-N 3.16Å
152	E	46.4	Very low	53	Low	127 Å²	127	117.8 Å²	117.8	59%	0.593	65%	0.649	S	S	*	*			trans	-96	139	164	-77	-172.1	165	0	0	108	R77 P150 E154	R77-E152 IonicContact CZ-OE1 3.98Å; R77-E152 IonicContact CZ-OE2 3.3Å; R77-E152 IonicContact NH1-OE1 3.42Å; R77-E152 IonicContact NH1-OE2 3.39Å; R77-E152 IonicContact NH2-OE1 3.44Å; R77-E152 PolarHBondContact NH2-OE1 3.21Å; R77-E152 IonicContact NH2-OE2 2.66Å; R77-E152 PolarHBondContact NH2-OE2 2.86Å; P150-E152 PolarHBondContact O-N 3.39Å; E152-E154 PolarHBondContact O-N 3.19Å
153	E	44.2	Very low	50.5	Low	188 Å²	188	123.7 Å²	123.7	88%	0.879	69%	0.685	S	S	*	*			trans	-46.5	125.5	169	-71.3	173.6	162.5	0	0	109.1	F155	E153-F155 PolarHBondContact O-N 3.17Å
154	E	37.3	Very low	47.7	Very low	191 Å²	191	123.6 Å²	123.6	89%	0.893	70%	0.703	S	S	*	*			trans	-47.9	109.3	-175.8	-66.8	162.4	159.5	0	0	111.1	E152	E152-E154 PolarHBondContact O-N 3.19Å
155	F	42.6	Very low	45.2	Very low	201 Å²	201	127 Å²	127	88%	0.882	73%	0.727	S	S	*	*			trans	-95.5	108.4	150.6	-99.4	-90.5	0	0	0	107.1	E153 A157	E153-F155 PolarHBondContact O-N 3.17Å; F155-A157 PolarHBondContact O-N 3.28Å
156	E	30.7	Very low	43.6	Very low	195 Å²	195	130.8 Å²	130.8	91%	0.911	75%	0.751	S	S	*	*			trans	-45.6	105.3	178.8	-72.3	175.7	136.7	0	0	111.8
157	A	36.1	Very low	41.7	Very low	96 Å²	96	132.6 Å²	132.6	79%	0.793	76%	0.755	S	S	*	*			trans	-103.2	110.5	165.6	0	0	0	0	0	108.7	F155 T159	F155-A157 PolarHBondContact O-N 3.28Å; A157-T159 PolarHBondContact O-N 3.18Å
158	Q	33	Very low	40.6	Very low	190 Å²	190	137.5 Å²	137.5	89%	0.888	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-51.4	124.2	-178.7	-66.8	164.9	3.7	0	0	112.1
159	T	32.8	Very low	39.7	Very low	137 Å²	137	135 Å²	135	84%	0.84	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-64.8	127.7	175.5	13.7	0	0	0	0	111.4	A157	A157-T159 PolarHBondContact O-N 3.18Å
160	P	33.9	Very low	39.3	Very low	112 Å²	112	137.5 Å²	137.5	73%	0.727	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-77.2	150.4	163.6	0.4	16.5	0	0	0	110.3
161	P	33.3	Very low	39.2	Very low	120 Å²	120	137.6 Å²	137.6	78%	0.779	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-72.9	134.7	-169	27.8	-32	0	0	0	112.4	V163	P161-V163 PolarHBondContact O-N 2.91Å
162	S	33.2	Very low	40.1	Very low	122 Å²	122	135.6 Å²	135.6	85%	0.853	78%	0.783	S	S	*	*			trans	-63.6	114.8	174	-171.6	0	0	0	0	110.6
163	V	36.9	Very low	41	Very low	137 Å²	137	136.2 Å²	136.2	83%	0.83	78%	0.784	S	S	*	*			trans	-91.6	103.4	167	178.1	0	0	0	0	107	P161	P161-V163 PolarHBondContact O-N 2.91Å
164	G	31	Very low	41.9	Very low	60 Å²	60	132.4 Å²	132.4	62%	0.619	77%	0.766	S	S	*	*			trans	-70.3	145.5	170.1	0	0	0	0	0	111.2
165	S	37.8	Very low	43.5	Very low	121 Å²	121	133.5 Å²	133.5	85%	0.846	76%	0.762	S	S	*	*			trans	-169.9	158.9	157.1	-90.5	0	0	0	0	112.3
166	P	47.8	Very low	45.1	Very low	115 Å²	115	130.4 Å²	130.4	75%	0.747	75%	0.75	S	S	*	*			trans	-120.5	171.7	-132.2	40.5	-29.2	0	0	0	116.3
167	E	36.3	Very low	47.4	Very low	185 Å²	185	123.2 Å²	123.2	86%	0.864	72%	0.72	S	S	*	*			trans	18.6	126.3	154.2	-55.8	-147.6	136.5	0	0	123.7
168	L	40.5	Very low	49.1	Very low	180 Å²	180	121.2 Å²	121.2	94%	0.942	70%	0.703	S	S	*	*			trans	1.7	108.7	146	-105.2	70.9	0	0	0	118.6
169	G	40.9	Very low	51.3	Low	44 Å²	44	116.7 Å²	116.7	45%	0.454	68%	0.681	S	S	.	*			trans	-163.1	112.3	157.2	0	0	0	0	0	110.5	S171	G169-S171 PolarHBondContact O-N 3.45Å
170	T	48.4	Very low	53.6	Low	153 Å²	153	115.9 Å²	115.9	94%	0.939	67%	0.668	S	S	*	*			trans	-73.2	69.5	-179.7	41.7	0	0	0	0	111.6
171	S	51.8	Low	55.6	Low	66 Å²	66	116.1 Å²	116.1	46%	0.462	66%	0.66	S	S	.	*			trans	-86.5	150.9	170.6	170.6	0	0	0	0	110.8	G169 F173 H174	G169-S171 PolarHBondContact O-N 3.45Å; S171-F173 PolarHBondContact O-N 3.39Å; S171-H174 WeakPolarHBondContact O-CA 3.31Å; S171-H174 VanDerWaalsContact O-CB 3.25Å; S171-H174 WeakPolarHBondContact O-CB 3.11Å; S171-H174 PolarHBondContact O-N 3.35Å
172	P	66.6	Low	57.3	Low	108 Å²	108	113.9 Å²	113.9	70%	0.701	64%	0.639	S	S	*	*	H	α-helix	trans	-48.9	-31.1	173.1	-27.1	33.2	0	0	0	114	H174 R175 Q176	P172-H174 VanDerWaalsContact C-N 3.33Å; P172-H174 PolarHBondContact O-N 3.06Å; P172-R175 WeakPolarHBondContact O-CB 3.47Å; P172-R175 PolarHBondContact O-N 3.16Å; P172-Q176 PolarHBondContact O-N 3.49Å
173	F	66.7	Low	59.5	Low	140 Å²	140	113.3 Å²	113.3	61%	0.614	62%	0.622	S	S	*	*	H	α-helix	trans	-61.5	-38.9	174.1	-171.3	-102.4	0	0	0	112.5	S171 R175 Q176 V177	S171-F173 PolarHBondContact O-N 3.39Å; F173-R175 VanDerWaalsContact C-N 3.29Å; F173-R175 PolarHBondContact O-N 2.97Å; F173-Q176 PolarHBondContact O-N 2.83Å; F173-V177 HydrophobicContact CD1-CG2 4.07Å; F173-V177 HydrophobicContact CE1-CG2 3.78Å; F173-V177 HydrophobicContact CZ-CG2 4.19Å; F173-V177 WeakPolarHBondContact O-CG2 3.36Å; F173-V177 PolarHBondContact O-N 3.04Å
174	H	61.4	Low	61.6	Low	108 Å²	108	112.2 Å²	112.2	50%	0.5	61%	0.611	S	S	.	*	H	α-helix	trans	-64.5	-34.7	177.2	-126.2	85.6	0	0	0	111.9	S171 P172 Q176 V177 A178	S171-H174 WeakPolarHBondContact O-CA 3.31Å; S171-H174 VanDerWaalsContact O-CB 3.25Å; S171-H174 WeakPolarHBondContact O-CB 3.11Å; S171-H174 PolarHBondContact O-N 3.35Å; P172-H174 VanDerWaalsContact C-N 3.33Å; P172-H174 PolarHBondContact O-N 3.06Å; H174-Q176 VanDerWaalsContact C-N 3.34Å; H174-V177 PolarHBondContact O-N 2.98Å; H174-A178 VanDerWaalsContact O-CB 3.3Å; H174-A178 WeakPolarHBondContact O-CB 3.47Å; H174-A178 PolarHBondContact O-N 3.02Å
175	R	71.6	Confident	63.7	Low	213 Å²	213	116 Å²	116	80%	0.804	61%	0.612	S	S	*	*	H	α-helix	trans	-65.3	-40.1	175.5	-138.2	-172.9	-128.6	150.1	1.1	111.4	P172 F173 H179	P172-R175 WeakPolarHBondContact O-CB 3.47Å; P172-R175 PolarHBondContact O-N 3.16Å; F173-R175 VanDerWaalsContact C-N 3.29Å; F173-R175 PolarHBondContact O-N 2.97Å; R175-H179 WeakPolarHBondContact O-CB 3.43Å; R175-H179 PolarHBondContact O-N 3.29Å
176	Q	77.1	Confident	65.3	Low	136 Å²	136	112.4 Å²	112.4	64%	0.636	59%	0.586	S	S	*	*	H	α-helix	trans	-67.9	-42	176.8	-169.9	172.8	1.9	0	0	111.7	P172 F173 H174 H179 Q180	P172-Q176 PolarHBondContact O-N 3.49Å; F173-Q176 PolarHBondContact O-N 2.83Å; H174-Q176 VanDerWaalsContact C-N 3.34Å; Q176-H179 PolarHBondContact O-N 2.86Å; Q176-Q180 WeakPolarHBondContact O-CB 3.43Å; Q176-Q180 PolarHBondContact O-N 3.42Å
177	V	77.6	Confident	66.7	Low	45 Å²	45	109.7 Å²	109.7	27%	0.273	57%	0.573	S	S	.	*	H	α-helix	trans	-64.6	-45.2	175.8	174.8	0	0	0	0	111.3	F173 H174 H179 Q180 Q181	F173-V177 HydrophobicContact CD1-CG2 4.07Å; F173-V177 HydrophobicContact CE1-CG2 3.78Å; F173-V177 HydrophobicContact CZ-CG2 4.19Å; F173-V177 WeakPolarHBondContact O-CG2 3.36Å; F173-V177 PolarHBondContact O-N 3.04Å; H174-V177 PolarHBondContact O-N 2.98Å; V177-H179 VanDerWaalsContact C-N 3.33Å; V177-H179 PolarHBondContact O-N 3.47Å; V177-Q180 PolarHBondContact O-N 3.2Å; V177-Q181 PolarHBondContact O-N 3.14Å
178	A	73.3	Confident	68.6	Low	53 Å²	53	106.1 Å²	106.1	44%	0.438	56%	0.556	S	S	.	*	H	α-helix	trans	-60.4	-43.3	176.3	0	0	0	0	0	111.5	H174 Q180 Q181 Q182	H174-A178 VanDerWaalsContact O-CB 3.3Å; H174-A178 WeakPolarHBondContact O-CB 3.47Å; H174-A178 PolarHBondContact O-N 3.02Å; A178-Q180 PolarHBondContact O-N 3.39Å; A178-Q181 PolarHBondContact O-N 3.33Å; A178-Q182 VanDerWaalsContact O-CB 3.3Å; A178-Q182 WeakPolarHBondContact O-CB 3.42Å; A178-Q182 PolarHBondContact O-N 3.29Å
179	H	77.6	Confident	70.5	Confident	95 Å²	95	101.3 Å²	101.3	44%	0.44	53%	0.528	S	S	.	.	H	α-helix	trans	-65	-38.8	176	-163.7	68.5	0	0	0	112	R175 Q176 V177 Q182 Q183	R175-H179 WeakPolarHBondContact O-CB 3.43Å; R175-H179 PolarHBondContact O-N 3.29Å; Q176-H179 PolarHBondContact O-N 2.86Å; V177-H179 VanDerWaalsContact C-N 3.33Å; V177-H179 PolarHBondContact O-N 3.47Å; H179-Q182 PolarHBondContact O-N 2.98Å; H179-Q183 PolarHBondContact CD2-NE2 3.15Å; H179-Q183 PolarHBondContact NE2-NE2 3.45Å; H179-Q183 WeakPolarHBondContact O-CG 3.32Å; H179-Q183 PolarHBondContact O-N 3.24Å
180	Q	81.3	Confident	72.2	Confident	121 Å²	121	107.4 Å²	107.4	57%	0.565	54%	0.538	S	S	*	.	H	α-helix	trans	-66.8	-45.3	176	-174.7	170.9	33.6	0	0	112.2	Q176 V177 A178 Q182 Q183 L184	Q176-Q180 WeakPolarHBondContact O-CB 3.43Å; Q176-Q180 PolarHBondContact O-N 3.42Å; V177-Q180 PolarHBondContact O-N 3.2Å; A178-Q180 PolarHBondContact O-N 3.39Å; Q180-Q182 VanDerWaalsContact C-N 3.28Å; Q180-Q182 PolarHBondContact O-N 3.04Å; Q180-Q183 PolarHBondContact O-N 3Å; Q180-L184 WeakPolarHBondContact O-CG 3.47Å; Q180-L184 PolarHBondContact O-N 3.39Å
181	Q	75.4	Confident	73.8	Confident	117 Å²	117	106 Å²	106	55%	0.547	52%	0.52	S	S	.	.	H	α-helix	trans	-58.8	-42.6	173.3	-80.7	179.3	-8.5	0	0	110.9	V177 A178 Q183 L184 H185	V177-Q181 PolarHBondContact O-N 3.14Å; A178-Q181 PolarHBondContact O-N 3.33Å; Q181-Q183 PolarHBondContact O-N 3.27Å; Q181-L184 WeakPolarHBondContact O-CB 3.38Å; Q181-L184 PolarHBondContact O-N 3.25Å; Q181-H185 PolarHBondContact O-CD2 3.04Å; Q181-H185 PolarHBondContact O-N 3.44Å
182	Q	71.1	Confident	75.1	Confident	73 Å²	73	105.1 Å²	105.1	34%	0.341	51%	0.51	S	S	.	.	H	α-helix	trans	-62.4	-42.9	177.2	-169.5	177.8	19.5	0	0	112.5	A178 H179 Q180 L184 H185 V186 N318	A178-Q182 VanDerWaalsContact O-CB 3.3Å; A178-Q182 WeakPolarHBondContact O-CB 3.42Å; A178-Q182 PolarHBondContact O-N 3.29Å; H179-Q182 PolarHBondContact O-N 2.98Å; Q180-Q182 VanDerWaalsContact C-N 3.28Å; Q180-Q182 PolarHBondContact O-N 3.04Å; Q182-L184 VanDerWaalsContact C-N 3.31Å; Q182-L184 PolarHBondContact O-N 3.08Å; Q182-H185 PolarHBondContact O-N 2.71Å; Q182-V186 WeakPolarHBondContact O-CG2 3.24Å; Q182-V186 PolarHBondContact O-N 2.89Å; Q182-N318 VanDerWaalsContact CD-ND2 3.27Å; Q182-N318 PolarHBondContact NE2-ND2 2.84Å
183	Q	78.1	Confident	75.5	Confident	109 Å²	109	103.4 Å²	103.4	51%	0.509	49%	0.492	S	S	.	.	H	α-helix	trans	-62.1	-38.3	174.8	-73.3	178.6	18	0	0	112.1	H179 Q180 Q181 V186 A187	H179-Q183 PolarHBondContact CD2-NE2 3.15Å; H179-Q183 PolarHBondContact NE2-NE2 3.45Å; H179-Q183 WeakPolarHBondContact O-CG 3.32Å; H179-Q183 PolarHBondContact O-N 3.24Å; Q180-Q183 PolarHBondContact O-N 3Å; Q181-Q183 PolarHBondContact O-N 3.27Å; Q183-V186 PolarHBondContact O-N 2.83Å; Q183-A187 WeakPolarHBondContact O-CB 3.36Å; Q183-A187 PolarHBondContact O-N 2.9Å
184	L	80.9	Confident	75.9	Confident	114 Å²	114	101.9 Å²	101.9	60%	0.597	49%	0.487	S	S	*	.	H	α-helix	trans	-64.6	-41.4	175.4	-69.9	171.4	0	0	0	111.9	Q180 Q181 Q182 V186 A187 H188	Q180-L184 WeakPolarHBondContact O-CG 3.47Å; Q180-L184 PolarHBondContact O-N 3.39Å; Q181-L184 WeakPolarHBondContact O-CB 3.38Å; Q181-L184 PolarHBondContact O-N 3.25Å; Q182-L184 VanDerWaalsContact C-N 3.31Å; Q182-L184 PolarHBondContact O-N 3.08Å; L184-V186 PolarHBondContact O-N 2.89Å; L184-A187 PolarHBondContact O-N 3.18Å; L184-H188 VanDerWaalsContact O-CB 3.27Å; L184-H188 WeakPolarHBondContact O-CB 3.25Å; L184-H188 PolarHBondContact O-N 3.3Å
185	H	75.6	Confident	76.5	Confident	139 Å²	139	102.4 Å²	102.4	64%	0.644	49%	0.485	S	S	*	.	H	α-helix	trans	-60.9	-43.5	173.9	-80.6	-76.4	0	0	0	112.2	Q181 Q182 H189	Q181-H185 PolarHBondContact O-CD2 3.04Å; Q181-H185 PolarHBondContact O-N 3.44Å; Q182-H185 PolarHBondContact O-N 2.71Å; H185-H189 WeakPolarHBondContact O-CB 3.31Å; H185-H189 PolarHBondContact O-N 3.3Å
186	V	72.1	Confident	76.6	Confident	47 Å²	47	93.5 Å²	93.5	29%	0.285	46%	0.458	S	S	.	.	H	α-helix	trans	-65.3	-45	177.4	173.5	0	0	0	0	111.3	Q182 Q183 L184 H189 R190	Q182-V186 WeakPolarHBondContact O-CG2 3.24Å; Q182-V186 PolarHBondContact O-N 2.89Å; Q183-V186 PolarHBondContact O-N 2.83Å; L184-V186 PolarHBondContact O-N 2.89Å; V186-H189 PolarHBondContact O-N 3.49Å; V186-R190 WeakPolarHBondContact O-CB 3.24Å; V186-R190 PolarHBondContact O-N 3.42Å
187	A	75.8	Confident	76.3	Confident	57 Å²	57	93.6 Å²	93.6	47%	0.471	46%	0.456	S	S	.	.	H	α-helix	trans	-62.2	-45.1	178.1	0	0	0	0	0	111.4	Q183 L184 H189 R190 Q191	Q183-A187 WeakPolarHBondContact O-CB 3.36Å; Q183-A187 PolarHBondContact O-N 2.9Å; L184-A187 PolarHBondContact O-N 3.18Å; A187-H189 PolarHBondContact O-N 3.48Å; A187-R190 PolarHBondContact O-N 3.39Å; A187-Q191 VanDerWaalsContact O-CB 3.32Å; A187-Q191 WeakPolarHBondContact O-CB 3.34Å; A187-Q191 PolarHBondContact O-N 3.3Å
188	H	77.8	Confident	76	Confident	111 Å²	111	96.7 Å²	96.7	51%	0.514	47%	0.468	S	S	.	.	H	α-helix	trans	-57.9	-49.1	174.4	-175.2	-99.6	0	0	0	110.4	L184 R190 Q191 M192	L184-H188 VanDerWaalsContact O-CB 3.27Å; L184-H188 WeakPolarHBondContact O-CB 3.25Å; L184-H188 PolarHBondContact O-N 3.3Å; H188-R190 PolarHBondContact O-N 3.3Å; H188-Q191 CarbonylContact O-C 3.59Å; H188-Q191 WeakPolarHBondContact O-CB 3.24Å; H188-Q191 PolarHBondContact O-N 3.19Å; H188-M192 WeakPolarHBondContact O-CG 3.23Å; H188-M192 PolarHBondContact O-N 3.42Å
189	H	79	Confident	75.9	Confident	79 Å²	79	97.1 Å²	97.1	37%	0.366	46%	0.461	S	S	.	.	H	α-helix	trans	-64	-41.1	179.7	-168.6	81.9	0	0	0	113.1	H185 V186 A187 Q191 M192 Q193	H185-H189 WeakPolarHBondContact O-CB 3.31Å; H185-H189 PolarHBondContact O-N 3.3Å; V186-H189 PolarHBondContact O-N 3.49Å; A187-H189 PolarHBondContact O-N 3.48Å; H189-Q191 VanDerWaalsContact C-N 3.33Å; H189-Q191 PolarHBondContact O-N 2.66Å; H189-M192 WeakPolarHBondContact O-CB 3.37Å; H189-M192 PolarHBondContact O-N 3.1Å; H189-M192 VanDerWaalsContact O-N 3.12Å; H189-Q193 PolarHBondContact CD2-NE2 3.39Å; H189-Q193 PolarHBondContact NE2-NE2 3.38Å; H189-Q193 WeakPolarHBondContact O-CG 3.2Å; H189-Q193 PolarHBondContact O-N 3.41Å
190	R	77.1	Confident	74.9	Confident	171 Å²	171	97.3 Å²	97.3	65%	0.645	46%	0.464	S	S	*	.	H	α-helix	trans	-62.9	-40.6	174.6	-170.9	178.1	-178	170.7	2.5	111.6	V186 A187 H188 M192 Q193 Q194	V186-R190 WeakPolarHBondContact O-CB 3.24Å; V186-R190 PolarHBondContact O-N 3.42Å; A187-R190 PolarHBondContact O-N 3.39Å; H188-R190 PolarHBondContact O-N 3.3Å; R190-M192 VanDerWaalsContact C-N 3.31Å; R190-Q193 PolarHBondContact O-N 3.02Å; R190-Q194 WeakPolarHBondContact O-CG 3.42Å; R190-Q194 PolarHBondContact O-N 2.69Å
191	Q	81.5	Confident	74.3	Confident	123 Å²	123	96.7 Å²	96.7	58%	0.575	47%	0.468	S	S	*	.	H	α-helix	trans	-63.1	-38.6	172.9	-173.3	-179.7	3.2	0	0	111.1	A187 H188 H189 Q194 Y195	A187-Q191 VanDerWaalsContact O-CB 3.32Å; A187-Q191 WeakPolarHBondContact O-CB 3.34Å; A187-Q191 PolarHBondContact O-N 3.3Å; H188-Q191 CarbonylContact O-C 3.59Å; H188-Q191 WeakPolarHBondContact O-CB 3.24Å; H188-Q191 PolarHBondContact O-N 3.19Å; H189-Q191 VanDerWaalsContact C-N 3.33Å; H189-Q191 PolarHBondContact O-N 2.66Å; Q191-Q194 PolarHBondContact O-N 2.84Å; Q191-Y195 WeakPolarHBondContact O-CB 3.25Å; Q191-Y195 PolarHBondContact O-N 2.95Å
192	M	79.8	Confident	73.8	Confident	49 Å²	49	98.2 Å²	98.2	24%	0.241	48%	0.476	C	S	.	.	H	α-helix	trans	-64.4	-39.4	175.1	-63.3	-38.5	-78.3	0	0	112.3	L80 H188 H189 R190 Y195 A196	L80-M192 HydrophobicContact CD1-CB 4.39Å; L80-M192 HydrophobicContact CD1-CE 3.14Å; L80-M192 HydrophobicContact CD1-CG 4.19Å; L80-M192 HydrophobicContact CG-CE 4.47Å; H188-M192 WeakPolarHBondContact O-CG 3.23Å; H188-M192 PolarHBondContact O-N 3.42Å; H189-M192 WeakPolarHBondContact O-CB 3.37Å; H189-M192 PolarHBondContact O-N 3.1Å; H189-M192 VanDerWaalsContact O-N 3.12Å; R190-M192 VanDerWaalsContact C-N 3.31Å; M192-Y195 PolarHBondContact O-N 2.84Å; M192-A196 WeakPolarHBondContact O-CB 3.45Å; M192-A196 PolarHBondContact O-N 3.48Å
193	Q	74.4	Confident	72.8	Confident	71 Å²	71	98.5 Å²	98.5	33%	0.332	48%	0.477	S	S	.	.	H	α-helix	trans	-63.3	-41.7	174.4	-69.4	178.4	8.6	0	0	111.8	H189 R190 A196 F197	H189-Q193 PolarHBondContact CD2-NE2 3.39Å; H189-Q193 PolarHBondContact NE2-NE2 3.38Å; H189-Q193 WeakPolarHBondContact O-CG 3.2Å; H189-Q193 PolarHBondContact O-N 3.41Å; R190-Q193 PolarHBondContact O-N 3.02Å; Q193-A196 PolarHBondContact O-N 2.96Å; Q193-F197 PolarHBondContact O-N 2.96Å
194	Q	74.5	Confident	71.1	Confident	108 Å²	108	98.2 Å²	98.2	51%	0.505	49%	0.485	S	S	.	.	H	α-helix	trans	-63.1	-46.5	174.8	-72.4	175.3	-23.5	0	0	111.3	R190 Q191 A196 F197 E198	R190-Q194 WeakPolarHBondContact O-CG 3.42Å; R190-Q194 PolarHBondContact O-N 2.69Å; Q191-Q194 PolarHBondContact O-N 2.84Å; Q194-A196 VanDerWaalsContact C-N 3.33Å; Q194-A196 PolarHBondContact O-N 2.94Å; Q194-F197 WeakPolarHBondContact O-CB 3.33Å; Q194-F197 PolarHBondContact O-N 3.23Å; Q194-F197 VanDerWaalsContact O-N 3.15Å; Q194-E198 WeakPolarHBondContact O-CG 3.33Å; Q194-E198 PolarHBondContact O-N 3.4Å
195	Y	75.1	Confident	69.4	Low	119 Å²	119	98 Å²	98	47%	0.467	49%	0.49	S	S	.	.	H	α-helix	trans	-61.6	-40.5	177	-177.2	-106.5	0	0	0	112.3	Q191 M192 F197 E198 Q199	Q191-Y195 WeakPolarHBondContact O-CB 3.25Å; Q191-Y195 PolarHBondContact O-N 2.95Å; M192-Y195 PolarHBondContact O-N 2.84Å; Y195-F197 VanDerWaalsContact C-N 3.33Å; Y195-F197 PolarHBondContact O-N 2.99Å; Y195-E198 PolarHBondContact O-N 3.27Å; Y195-Q199 HydrophobicContact CD1-CG 4.21Å; Y195-Q199 HydrophobicContact CE1-CG 3.91Å; Y195-Q199 HydrophobicContact CE2-CG 4.36Å; Y195-Q199 WeakPolarHBondContact O-CB 3.35Å; Y195-Q199 VanDerWaalsContact O-CG 3.24Å; Y195-Q199 WeakPolarHBondContact O-CG 3.37Å; Y195-Q199 PolarHBondContact O-N 2.84Å; Y195-Q199 PolarHBondContact OH-NE2 3.05Å
196	A	72.9	Confident	67.8	Low	27 Å²	27	95.9 Å²	95.9	22%	0.223	49%	0.488	C	S	.	.	H	α-helix	trans	-62.7	-39.6	174.9	0	0	0	0	0	112.1	M192 Q193 Q194 L200	M192-A196 WeakPolarHBondContact O-CB 3.45Å; M192-A196 PolarHBondContact O-N 3.48Å; Q193-A196 PolarHBondContact O-N 2.96Å; Q194-A196 VanDerWaalsContact C-N 3.33Å; Q194-A196 PolarHBondContact O-N 2.94Å; A196-L200 PolarHBondContact O-N 3Å; A196-L200 VanDerWaalsContact O-N 3.16Å
197	F	70.6	Confident	66.4	Low	138 Å²	138	104.6 Å²	104.6	61%	0.605	52%	0.516	S	S	*	.	H	α-helix	trans	-67.3	-43	174.7	-176.5	-95.2	0	0	0	112.2	Q193 Q194 Y195 Q199 L200 V201	Q193-F197 PolarHBondContact O-N 2.96Å; Q194-F197 WeakPolarHBondContact O-CB 3.33Å; Q194-F197 PolarHBondContact O-N 3.23Å; Q194-F197 VanDerWaalsContact O-N 3.15Å; Y195-F197 VanDerWaalsContact C-N 3.33Å; Y195-F197 PolarHBondContact O-N 2.99Å; F197-Q199 VanDerWaalsContact C-N 3.33Å; F197-Q199 PolarHBondContact O-N 2.75Å; F197-L200 WeakPolarHBondContact O-CA 3.33Å; F197-L200 WeakPolarHBondContact O-CB 3.44Å; F197-L200 PolarHBondContact O-N 2.89Å; F197-V201 HydrophobicContact CD1-CG2 4.43Å; F197-V201 HydrophobicContact CE1-CG2 4.07Å; F197-V201 HydrophobicContact CZ-CG2 4.46Å; F197-V201 PolarHBondContact O-N 3.45Å; F197-V201 VanDerWaalsContact O-N 3.17Å
198	E	71.9	Confident	64.7	Low	110 Å²	110	110.2 Å²	110.2	51%	0.514	53%	0.533	S	S	.	.	H	α-helix	trans	-62.9	-39.2	176.1	-73.3	177.8	177.8	0	0	112.2	Q194 Y195 L200 V201 Q202	Q194-E198 WeakPolarHBondContact O-CG 3.33Å; Q194-E198 PolarHBondContact O-N 3.4Å; Y195-E198 PolarHBondContact O-N 3.27Å; E198-L200 PolarHBondContact O-N 3.45Å; E198-V201 PolarHBondContact O-N 3.31Å; E198-Q202 PolarHBondContact O-N 2.93Å
199	Q	71	Confident	63	Low	62 Å²	62	107.7 Å²	107.7	29%	0.29	53%	0.525	S	S	.	.	H	α-helix	trans	-62.1	-33.2	172.4	-74.6	-73.4	4.2	0	0	112	Y195 F197 Q202 Q203	Y195-Q199 HydrophobicContact CD1-CG 4.21Å; Y195-Q199 HydrophobicContact CE1-CG 3.91Å; Y195-Q199 HydrophobicContact CE2-CG 4.36Å; Y195-Q199 WeakPolarHBondContact O-CB 3.35Å; Y195-Q199 VanDerWaalsContact O-CG 3.24Å; Y195-Q199 WeakPolarHBondContact O-CG 3.37Å; Y195-Q199 PolarHBondContact O-N 2.84Å; Y195-Q199 PolarHBondContact OH-NE2 3.05Å; F197-Q199 VanDerWaalsContact C-N 3.33Å; F197-Q199 PolarHBondContact O-N 2.75Å; Q199-Q202 PolarHBondContact O-N 2.78Å; Q199-Q203 WeakPolarHBondContact O-CG 3.46Å; Q199-Q203 PolarHBondContact O-N 2.92Å; Q199-Q203 VanDerWaalsContact O-N 3.11Å
200	L	58.1	Low	61.1	Low	99 Å²	99	114 Å²	114	52%	0.518	55%	0.546	S	S	.	.	H	α-helix	trans	-66.3	-41	176.7	-153	158.2	0	0	0	111.6	A84 A196 F197 E198 Q202	A84-L200 HydrophobicContact CB-CD1 3.54Å; A84-L200 HydrophobicContact CB-CG 4.33Å; A196-L200 PolarHBondContact O-N 3Å; A196-L200 VanDerWaalsContact O-N 3.16Å; F197-L200 WeakPolarHBondContact O-CA 3.33Å; F197-L200 WeakPolarHBondContact O-CB 3.44Å; F197-L200 PolarHBondContact O-N 2.89Å; E198-L200 PolarHBondContact O-N 3.45Å; L200-Q202 VanDerWaalsContact C-N 3.29Å; L200-Q202 PolarHBondContact O-N 3.11Å
201	V	67.8	Low	59.3	Low	107 Å²	107	109.8 Å²	109.8	65%	0.648	53%	0.532	S	S	*	.	H	α-helix	trans	-67.7	-30.6	177.5	177.7	0	0	0	0	111.8	F197 E198	F197-V201 HydrophobicContact CD1-CG2 4.43Å; F197-V201 HydrophobicContact CE1-CG2 4.07Å; F197-V201 HydrophobicContact CZ-CG2 4.46Å; F197-V201 PolarHBondContact O-N 3.45Å; F197-V201 VanDerWaalsContact O-N 3.17Å; E198-V201 PolarHBondContact O-N 3.31Å
202	Q	64.6	Low	57.3	Low	150 Å²	150	107.9 Å²	107.9	70%	0.701	53%	0.526	S	S	*	.	H	α-helix	trans	-88.1	-16.9	-178.6	-69.5	-171.7	54.8	0	0	114.4	E198 Q199 L200	E198-Q202 PolarHBondContact O-N 2.93Å; Q199-Q202 PolarHBondContact O-N 2.78Å; L200-Q202 VanDerWaalsContact C-N 3.29Å; L200-Q202 PolarHBondContact O-N 3.11Å
203	Q	49.5	Very low	55.6	Low	78 Å²	78	116 Å²	116	36%	0.364	55%	0.554	S	S	.	*	S	Bend	trans	-72.5	139.9	177.1	-78.6	-174.3	27.6	0	0	110.9	Q199	Q199-Q203 WeakPolarHBondContact O-CG 3.46Å; Q199-Q203 PolarHBondContact O-N 2.92Å; Q199-Q203 VanDerWaalsContact O-N 3.11Å
204	P	43.8	Very low	53.9	Low	104 Å²	104	117 Å²	117	68%	0.675	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-54.7	148.1	166.1	25.5	-32.4	0	0	0	108.3
205	P	43.8	Very low	52.4	Low	109 Å²	109	113.2 Å²	113.2	71%	0.708	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-49.4	138.4	179.6	21.9	-33.1	0	0	0	108.2	R207	P205-R207 PolarHBondContact O-N 3.22Å
206	P	42.9	Very low	50.7	Low	94 Å²	94	115.5 Å²	115.5	61%	0.61	56%	0.56	S	S	*	*	P	Polyproline II helix	trans	-47.9	121.9	177.4	-21.1	28.9	0	0	0	106	E208	P206-E208 VanDerWaalsContact C-N 3.3Å; P206-E208 PolarHBondContact O-N 2.97Å
207	R	42.2	Very low	49	Very low	231 Å²	231	116.6 Å²	116.6	87%	0.872	56%	0.564	S	S	*	*			trans	-52.3	112.9	167	-78.2	-176.9	176.5	174	0	103.1	P205 T209	P205-R207 PolarHBondContact O-N 3.22Å; R207-T209 VanDerWaalsContact C-N 3.25Å; R207-T209 PolarHBondContact O-N 2.87Å
208	E	40.2	Very low	47.4	Very low	174 Å²	174	115 Å²	115	81%	0.813	57%	0.566	S	S	*	*			trans	-46.2	108.8	166.7	-96.5	-178.2	168.3	0	0	103.3	P206 R210	P206-E208 VanDerWaalsContact C-N 3.3Å; P206-E208 PolarHBondContact O-N 2.97Å; E208-R210 PolarHBondContact O-N 3.23Å
209	T	41.9	Very low	45.8	Very low	58 Å²	58	115 Å²	115	36%	0.356	58%	0.577	S	S	.	*			trans	-65.7	101.5	179.5	44.3	0	0	0	0	102.1	R207 F211 L212	R207-T209 VanDerWaalsContact C-N 3.25Å; R207-T209 PolarHBondContact O-N 2.87Å; T209-F211 PolarHBondContact O-N 2.8Å; T209-L212 PolarHBondContact O-N 3.1Å; T209-L212 VanDerWaalsContact O-N 3.1Å
210	R	39.1	Very low	44.3	Very low	211 Å²	211	113.9 Å²	113.9	80%	0.796	58%	0.579	S	S	*	*	G	3₁₀ helix	trans	-51.7	-7.4	174.2	-81.9	-175	172.6	156.2	-2.5	112.1	E208	E208-R210 PolarHBondContact O-N 3.23Å
211	F	40.1	Very low	43.3	Very low	84 Å²	84	111.6 Å²	111.6	37%	0.368	57%	0.571	S	S	.	*	G	3₁₀ helix	trans	-96.4	6.8	-178.4	-63.3	-73.5	0	0	0	116.3	T209 R213 D214 F235	T209-F211 PolarHBondContact O-N 2.8Å; F211-R213 PolarHBondContact O-N 3.18Å; F211-D214 PolarHBondContact O-N 2.69Å; F211-F235 HydrophobicContact CE2-CE1 4.45Å; F211-F235 HydrophobicContact CE2-CZ 4.39Å
212	L	40.1	Very low	41.9	Very low	83 Å²	83	113.8 Å²	113.8	44%	0.435	57%	0.574	S	S	.	*	G	3₁₀ helix	trans	-62.3	-19.3	166.5	-92.9	171.5	0	0	0	112	L97 K100 T209	L97-L212 HydrophobicContact CD2-CD2 4.3Å; K100-L212 HydrophobicContact CD-CD2 3.61Å; K100-L212 VanDerWaalsContact NZ-CD2 3.33Å; K100-L212 PolarHBondContact NZ-O 3.37Å; T209-L212 PolarHBondContact O-N 3.1Å; T209-L212 VanDerWaalsContact O-N 3.1Å
213	R	42.7	Very low	40.8	Very low	219 Å²	219	109.7 Å²	109.7	83%	0.826	56%	0.562	S	S	*	*	S	Bend	trans	-80.3	-28	-179.4	-49.2	-179.1	-170.9	171.3	2.2	113.5	F211	F211-R213 PolarHBondContact O-N 3.18Å
214	D	38.4	Very low	40.5	Very low	93 Å²	93	109.5 Å²	109.5	50%	0.497	56%	0.564	S	S	.	*			trans	-100.7	16.1	-170.2	-60.9	-26.5	0	0	0	114.1	F211 H216	F211-D214 PolarHBondContact O-N 2.69Å; D214-H216 PolarHBondContact O-N 3.42Å
215	V	43.2	Very low	40.4	Very low	28 Å²	28	107 Å²	107	17%	0.17	54%	0.541	C	S	.	.			trans	-81.4	89.7	173.7	-174.9	0	0	0	0	108.4	K100 V217	K100-V215 VanDerWaalsContact NZ-CG2 3.27Å; V215-V217 HydrophobicContact CG1-CG2 4.04Å; V215-V217 PolarHBondContact O-N 2.93Å
216	H	39.3	Very low	40.1	Very low	166 Å²	166	110.1 Å²	110.1	77%	0.769	54%	0.539	S	S	*	.			trans	-73.1	109.7	158.2	-67.7	-80.7	0	0	0	107.7	D214 V218	D214-H216 PolarHBondContact O-N 3.42Å; H216-V218 VanDerWaalsContact C-N 3.29Å; H216-V218 PolarHBondContact O-N 3.34Å; H216-V218 VanDerWaalsContact O-N 3.11Å
217	V	38.8	Very low	40	Very low	51 Å²	51	111.7 Å²	111.7	31%	0.309	54%	0.542	S	S	.	.			trans	-78.4	90.9	163.7	-178.4	0	0	0	0	106.2	L104 V215	L104-V217 HydrophobicContact CD1-CG2 3.77Å; V215-V217 HydrophobicContact CG1-CG2 4.04Å; V215-V217 PolarHBondContact O-N 2.93Å
218	V	36.2	Very low	39.6	Very low	105 Å²	105	105.9 Å²	105.9	64%	0.636	52%	0.52	S	S	*	.			trans	-68.5	136.5	155	-169.1	0	0	0	0	104.8	H216 A220	H216-V218 VanDerWaalsContact C-N 3.29Å; H216-V218 PolarHBondContact O-N 3.34Å; H216-V218 VanDerWaalsContact O-N 3.11Å; V218-A220 PolarHBondContact O-N 3.13Å
219	S	37.6	Very low	39.5	Very low	109 Å²	109	103.1 Å²	103.1	76%	0.762	51%	0.511	S	S	*	.			trans	-56.5	90.5	168.1	53.7	0	0	0	0	107.8	S221	S219-S221 PolarHBondContact O-N 3.36Å
220	A	39.8	Very low	39.1	Very low	38 Å²	38	104.3 Å²	104.3	31%	0.314	51%	0.509	S	S	.	.			trans	-72.2	114.2	-176.4	0	0	0	0	0	106.9	V218 D224 Y225	V218-A220 PolarHBondContact O-N 3.13Å; A220-D224 WeakPolarHBondContact CA-OD2 3.31Å; A220-D224 HydrophobicContact CB-CB 3.73Å; A220-Y225 HydrophobicContact CB-CD2 4.29Å; A220-Y225 HydrophobicContact CB-CE2 3.8Å; A220-Y225 WeakPolarHBondContact O-CE2 3.21Å
221	S	38	Very low	38.7	Very low	51 Å²	51	95.9 Å²	95.9	36%	0.357	48%	0.483	S	S	.	.			trans	-60	160.3	165.6	62.5	0	0	0	0	109.7	S219 S223 D224 Y225	S219-S221 PolarHBondContact O-N 3.36Å; S221-S223 PolarHBondContact O-N 2.88Å; S221-S223 PolarHBondContact OG-OG 3.42Å; S221-D224 WeakPolarHBondContact CB-OD2 3.39Å; S221-D224 PolarHBondContact N-OD2 3.45Å; S221-D224 WeakPolarHBondContact O-CB 3.36Å; S221-D224 PolarHBondContact O-N 3.02Å; S221-D224 VanDerWaalsContact OG-CG 3.25Å; S221-D224 PolarHBondContact OG-N 3.35Å; S221-D224 PolarHBondContact OG-OD2 3.36Å; S221-Y225 WeakPolarHBondContact O-CD2 3.33Å; S221-Y225 PolarHBondContact O-N 3.32Å
222	E	38.5	Very low	38.7	Very low	154 Å²	154	97.7 Å²	97.7	72%	0.72	50%	0.503	S	S	*	.	H	α-helix	trans	-53.9	-29.1	175.1	-161.7	168.2	177.8	0	0	112.4	R226	E222-R226 PolarHBondContact O-N 2.89Å
223	S	41.4	Very low	38.6	Very low	64 Å²	64	98.5 Å²	98.5	45%	0.448	51%	0.511	S	S	.	.	H	α-helix	trans	-68.5	-32.7	171.3	30.2	0	0	0	0	114.8	S221 Y225 R226 N227	S221-S223 PolarHBondContact O-N 2.88Å; S221-S223 PolarHBondContact OG-OG 3.42Å; S223-Y225 VanDerWaalsContact C-N 3.29Å; S223-Y225 PolarHBondContact O-N 3.17Å; S223-R226 PolarHBondContact O-N 3.27Å; S223-N227 WeakPolarHBondContact O-CB 3.49Å; S223-N227 PolarHBondContact O-N 2.87Å
224	D	42.9	Very low	38.1	Very low	74 Å²	74	93.7 Å²	93.7	40%	0.396	50%	0.502	S	S	.	.	H	α-helix	trans	-68.1	-33.1	177.1	-64.3	-48.4	0	0	0	110.9	A220 S221 N227 W228	A220-D224 WeakPolarHBondContact CA-OD2 3.31Å; A220-D224 HydrophobicContact CB-CB 3.73Å; S221-D224 WeakPolarHBondContact CB-OD2 3.39Å; S221-D224 PolarHBondContact N-OD2 3.45Å; S221-D224 WeakPolarHBondContact O-CB 3.36Å; S221-D224 PolarHBondContact O-N 3.02Å; S221-D224 VanDerWaalsContact OG-CG 3.25Å; S221-D224 PolarHBondContact OG-N 3.35Å; S221-D224 PolarHBondContact OG-OD2 3.36Å; D224-N227 PolarHBondContact O-N 3.35Å; D224-W228 PolarHBondContact O-N 3.03Å; D224-W228 VanDerWaalsContact O-N 3.15Å
225	Y	40.6	Very low	37.9	Very low	50 Å²	50	96.4 Å²	96.4	20%	0.196	51%	0.51	C	S	.	.	H	α-helix	trans	-66.8	-40.5	171.8	-68.6	-81.4	0	0	0	112.2	L67 A220 S221 S223 N227 W228	L67-Y225 HydrophobicContact CD1-CD1 4.43Å; L67-Y225 HydrophobicContact CD1-CE1 4.22Å; A220-Y225 HydrophobicContact CB-CD2 4.29Å; A220-Y225 HydrophobicContact CB-CE2 3.8Å; A220-Y225 WeakPolarHBondContact O-CE2 3.21Å; S221-Y225 WeakPolarHBondContact O-CD2 3.33Å; S221-Y225 PolarHBondContact O-N 3.32Å; S223-Y225 VanDerWaalsContact C-N 3.29Å; S223-Y225 PolarHBondContact O-N 3.17Å; Y225-N227 VanDerWaalsContact C-N 3.31Å; Y225-N227 PolarHBondContact O-N 3.4Å; Y225-W228 HydrophobicContact CD1-CE3 4.47Å; Y225-W228 HydrophobicContact CD1-CZ3 4.45Å; Y225-W228 HydrophobicContact CE1-CZ3 4.49Å; Y225-W228 PolarHBondContact O-N 2.66Å
226	R	39	Very low	37.4	Very low	175 Å²	175	100 Å²	100	66%	0.66	54%	0.536	S	S	*	.	H	α-helix	trans	-66.8	-32.3	176	-70.3	-175.2	177.4	-170.5	0.7	112.9	E222 S223	E222-R226 PolarHBondContact O-N 2.89Å; S223-R226 PolarHBondContact O-N 3.27Å
227	N	39	Very low	37.2	Very low	128 Å²	128	95.8 Å²	95.8	68%	0.684	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-2.6	-179.2	-71.9	-16.4	0	0	0	113.7	S223 D224 Y225 N229	S223-N227 WeakPolarHBondContact O-CB 3.49Å; S223-N227 PolarHBondContact O-N 2.87Å; D224-N227 PolarHBondContact O-N 3.35Å; Y225-N227 VanDerWaalsContact C-N 3.31Å; Y225-N227 PolarHBondContact O-N 3.4Å; N227-N229 PolarHBondContact O-N 2.91Å
228	W	35	Very low	36.8	Very low	108 Å²	108	102.4 Å²	102.4	41%	0.409	55%	0.554	S	S	.	*			trans	-68.3	85.2	161.2	-110	-23.6	0	0	0	108.4	D224 Y225 W230	D224-W228 PolarHBondContact O-N 3.03Å; D224-W228 VanDerWaalsContact O-N 3.15Å; Y225-W228 HydrophobicContact CD1-CE3 4.47Å; Y225-W228 HydrophobicContact CD1-CZ3 4.45Å; Y225-W228 HydrophobicContact CE1-CZ3 4.49Å; Y225-W228 PolarHBondContact O-N 2.66Å; W228-W230 PolarHBondContact O-N 3.03Å
229	N	36.8	Very low	36.6	Very low	116 Å²	116	105.1 Å²	105.1	62%	0.62	56%	0.56	S	S	*	*			trans	-66.4	102.6	174.1	-166.5	4.9	0	0	0	107.5	N227 S231	N227-N229 PolarHBondContact O-N 2.91Å; N229-S231 PolarHBondContact O-N 2.87Å
230	W	33.6	Very low	36.4	Very low	83 Å²	83	108.8 Å²	108.8	31%	0.314	57%	0.565	S	S	.	*			trans	-66.5	62.2	172.1	-57.5	102.4	0	0	0	110.3	P28 M30 F71 W228	P28-W230 HydrophobicContact CB-CZ2 3.66Å; P28-W230 HydrophobicContact CG-CZ2 3.49Å; P28-W230 VanDerWaalsContact CG-CZ2 3.49Å; M30-W230 HydrophobicContact CE-CH2 4.07Å; M30-W230 HydrophobicContact CE-CZ3 4.46Å; F71-W230 HydrophobicContact CB-CZ3 4.09Å; F71-W230 HydrophobicContact CD1-CZ3 4.45Å; F71-W230 HydrophobicContact CD2-CD2 4.34Å; F71-W230 AromaticContact CD2-CE3 3.22Å; F71-W230 HydrophobicContact CD2-CE3 3.22Å; F71-W230 HydrophobicContact CD2-CH2 4.04Å; F71-W230 AromaticContact CD2-CZ3 3.02Å; F71-W230 HydrophobicContact CD2-CZ3 3.02Å; F71-W230 AromaticContact CE2-CD2 3.99Å; F71-W230 HydrophobicContact CE2-CD2 3.99Å; F71-W230 AromaticContact CE2-CE3 3.03Å; F71-W230 HydrophobicContact CE2-CE3 3.03Å; F71-W230 AromaticContact CE2-CZ3 3.44Å; F71-W230 HydrophobicContact CE2-CZ3 3.44Å; F71-W230 VanDerWaalsContact CE2-CZ3 3.44Å; F71-W230 HydrophobicContact CG-CE3 4.08Å; F71-W230 AromaticContact CG-CZ3 3.6Å; F71-W230 HydrophobicContact CG-CZ3 3.6Å; F71-W230 AromaticContact CZ-CE3 3.76Å; F71-W230 HydrophobicContact CZ-CE3 3.76Å; F71-W230 HydrophobicContact CZ-CZ3 4.29Å; W228-W230 PolarHBondContact O-N 3.03Å
231	S	31.3	Very low	36.1	Very low	35 Å²	35	115.8 Å²	115.8	25%	0.245	59%	0.591	C	S	.	*			trans	-93.4	132.5	166.9	88.7	0	0	0	0	108.3	N229 T233	N229-S231 PolarHBondContact O-N 2.87Å; S231-T233 PolarHBondContact O-N 3.41Å; S231-T233 PolarHBondContact OG-OG1 3.01Å
232	P	39.7	Very low	35.8	Very low	122 Å²	122	121.4 Å²	121.4	79%	0.792	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.6	-11.5	173.8	-25.4	34.3	0	0	0	114.3
233	T	38.1	Very low	35.4	Very low	100 Å²	100	123.1 Å²	123.1	61%	0.613	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.7	-7.4	-170.1	36.3	0	0	0	0	116	S231 F235 S236	S231-T233 PolarHBondContact O-N 3.41Å; S231-T233 PolarHBondContact OG-OG1 3.01Å; T233-F235 PolarHBondContact O-N 3.44Å; T233-F235 VanDerWaalsContact O-N 3.08Å; T233-S236 PolarHBondContact O-N 3.01Å
234	D	32.3	Very low	34.7	Very low	117 Å²	117	125.2 Å²	125.2	63%	0.626	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	-3.7	-176.9	-121	-0.2	0	0	0	114.4
235	F	34.2	Very low	34.1	Very low	151 Å²	151	127.1 Å²	127.1	66%	0.662	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	-17.2	168.4	-114.3	-90.4	0	0	0	113.7	F211 T233	F211-F235 HydrophobicContact CE2-CE1 4.45Å; F211-F235 HydrophobicContact CE2-CZ 4.39Å; T233-F235 PolarHBondContact O-N 3.44Å; T233-F235 VanDerWaalsContact O-N 3.08Å
236	S	32.2	Very low	33.6	Very low	104 Å²	104	130.7 Å²	130.7	73%	0.727	69%	0.685	S	S	*	*	S	Bend	trans	-83.3	-17	-175.5	-162.6	0	0	0	0	114.2	T233	T233-S236 PolarHBondContact O-N 3.01Å
237	A	35.2	Very low	33	Very low	76 Å²	76	131.3 Å²	131.3	63%	0.628	70%	0.695	S	S	*	*	S	Bend	trans	-91.2	-17.6	-170.9	0	0	0	0	0	115.1
238	K	31.4	Very low	32.4	Very low	190 Å²	190	134 Å²	134	83%	0.826	70%	0.703	S	S	*	*	S	Bend	trans	-102	9	-176.9	-72.8	-170.6	177.2	-178	0	115.6
239	H	32.4	Very low	31.9	Very low	162 Å²	162	137.4 Å²	137.4	75%	0.75	72%	0.724	S	S	*	*	S	Bend	trans	-96.4	11.7	175.4	-98.8	46.5	0	0	0	115.3
240	Q	32.6	Very low	31.5	Very low	186 Å²	186	142.9 Å²	142.9	87%	0.869	74%	0.738	S	S	*	*	S	Bend	trans	-104.8	7.1	179.6	-111	176.9	20.7	0	0	116.5
241	Q	33	Very low	31.4	Very low	185 Å²	185	144.6 Å²	144.6	86%	0.864	76%	0.757	S	S	*	*	S	Bend	trans	-133.4	11.9	-179	-88.7	-166.1	-18.9	0	0	118.4
242	L	33.2	Very low	31.2	Very low	170 Å²	170	150.5 Å²	150.5	89%	0.89	79%	0.786	S	S	*	*			trans	-101.4	89.6	166.2	-82.8	154.7	0	0	0	109.6	S244	L242-S244 PolarHBondContact O-N 3.15Å
243	Q	28.9	Very low	30.7	Very low	189 Å²	189	149.5 Å²	149.5	88%	0.883	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-55.1	122.5	166.8	-67.3	179.3	10	0	0	108.8
244	S	26.6	Very low	30.5	Very low	108 Å²	108	155.7 Å²	155.7	76%	0.755	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-59.7	127	-179.8	49.1	0	0	0	0	112.2	L242	L242-S244 PolarHBondContact O-N 3.15Å
245	P	30.7	Very low	30.3	Very low	115 Å²	115	158.9 Å²	158.9	75%	0.747	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-72.9	155.3	159	8	6.6	0	0	0	110.3
246	P	29.4	Very low	30.2	Very low	125 Å²	125	161.2 Å²	161.2	81%	0.812	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-71.9	145.8	-162.5	23.6	-27.5	0	0	0	114.1	Q248	P246-Q248 PolarHBondContact O-N 2.95Å
247	Q	26.3	Very low	30.3	Very low	188 Å²	188	162.5 Å²	162.5	88%	0.879	82%	0.818	S	S	*	*			trans	-50.3	110.7	-177.8	-63.2	174.3	-12.3	0	0	112.8
248	Q	28.3	Very low	29.9	Very low	184 Å²	184	169.9 Å²	169.9	86%	0.86	83%	0.83	S	S	*	*			trans	-91.3	111.6	153.9	-76.3	-174.3	-15	0	0	108.1	P246 Y250	P246-Q248 PolarHBondContact O-N 2.95Å; Q248-Y250 PolarHBondContact O-N 2.92Å
249	Q	24.5	Very low	29.9	Very low	180 Å²	180	168 Å²	168	84%	0.841	83%	0.827	S	S	*	*			trans	-59	98.6	175	-71.8	170.1	-55.3	0	0	109.6	V251	Q249-V251 PolarHBondContact O-N 3.29Å; Q249-V251 VanDerWaalsContact O-N 3.15Å
250	Y	28	Very low	29.9	Very low	231 Å²	231	165.3 Å²	165.3	91%	0.906	82%	0.824	S	S	*	*			trans	-75.9	102.6	169.1	-133.1	-95.4	0	0	0	107.9	Q248 N252	Q248-Y250 PolarHBondContact O-N 2.92Å; Y250-N252 PolarHBondContact O-N 3.42Å
251	V	30.1	Very low	29.9	Very low	118 Å²	118	162 Å²	162	72%	0.715	82%	0.819	S	S	*	*			trans	-65.6	116	178	-157.2	0	0	0	0	107.9	Q249 S253	Q249-V251 PolarHBondContact O-N 3.29Å; Q249-V251 VanDerWaalsContact O-N 3.15Å; V251-S253 VanDerWaalsContact C-N 3.28Å; V251-S253 PolarHBondContact O-N 3.45Å
252	N	27.8	Very low	30	Very low	159 Å²	159	159.4 Å²	159.4	85%	0.85	82%	0.818	S	S	*	*			trans	-80	74.4	-176.7	-159.4	7.2	0	0	0	110	Y250	Y250-N252 PolarHBondContact O-N 3.42Å
253	S	29.8	Very low	30.2	Very low	102 Å²	102	158 Å²	158	71%	0.713	82%	0.817	S	S	*	*			trans	-105.3	81.5	173.8	-66.9	0	0	0	0	109.9	V251	V251-S253 VanDerWaalsContact C-N 3.28Å; V251-S253 PolarHBondContact O-N 3.45Å
254	R	32.7	Very low	30.5	Very low	230 Å²	230	157.2 Å²	157.2	87%	0.868	81%	0.813	S	S	*	*			trans	-123	86.3	155.1	-82.1	-173.1	172.3	-179.1	-2	107.8	F256	R254-F256 PolarHBondContact O-N 2.86Å
255	E	28.7	Very low	31	Very low	184 Å²	184	163.2 Å²	163.2	86%	0.86	82%	0.821	S	S	*	*			trans	-50	125	160.1	-82	174.5	130.9	0	0	108.7	V257	E255-V257 PolarHBondContact O-N 3.34Å
256	F	33.3	Very low	31.4	Very low	200 Å²	200	166 Å²	166	88%	0.877	82%	0.824	S	S	*	*			trans	-63	99.2	169.5	-79.2	-98.3	0	0	0	108.2	R254 R258	R254-F256 PolarHBondContact O-N 2.86Å; F256-R258 VanDerWaalsContact C-N 3.3Å; F256-R258 PolarHBondContact O-N 2.65Å
257	V	32.5	Very low	31.4	Very low	131 Å²	131	169.2 Å²	169.2	79%	0.794	83%	0.827	S	S	*	*			trans	-63	97.8	163.7	177.9	0	0	0	0	106.6	E255 I259	E255-V257 PolarHBondContact O-N 3.34Å; V257-I259 PolarHBondContact O-N 2.96Å; V257-I259 VanDerWaalsContact O-N 3.11Å
258	R	27.7	Very low	32	Very low	231 Å²	231	166.2 Å²	166.2	87%	0.872	82%	0.822	S	S	*	*			trans	-64.3	108.1	171.5	-72.9	-165.3	-175.8	-149	4	108	F256 P260	F256-R258 VanDerWaalsContact C-N 3.3Å; F256-R258 PolarHBondContact O-N 2.65Å; R258-P260 WeakPolarHBondContact O-CD 3.49Å
259	I	30.6	Very low	32.1	Very low	150 Å²	150	163 Å²	163	77%	0.769	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-75	118.1	166.3	-55.9	176.8	0	0	0	106.7	V257	V257-I259 PolarHBondContact O-N 2.96Å; V257-I259 VanDerWaalsContact O-N 3.11Å
260	P	32.2	Very low	32.4	Very low	106 Å²	106	160 Å²	160	69%	0.688	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-69.7	149	178.3	27.3	-31.8	0	0	0	111.3	R258	R258-P260 WeakPolarHBondContact O-CD 3.49Å
261	P	33.2	Very low	32.5	Very low	115 Å²	115	154.6 Å²	154.6	75%	0.747	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-69.5	152.6	-174.8	29.3	-34.2	0	0	0	111.9	T263	P261-T263 PolarHBondContact O-N 2.86Å
262	P	35.1	Very low	32.7	Very low	132 Å²	132	154.9 Å²	154.9	86%	0.857	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-63.5	120	-174.5	23.3	-30.9	0	0	0	111.5
263	T	38.2	Very low	32.9	Very low	140 Å²	140	153 Å²	153	86%	0.859	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-60.7	140.3	172.3	5.6	0	0	0	0	111.3	P261	P261-T263 PolarHBondContact O-N 2.86Å
264	Q	34.6	Very low	33.1	Very low	172 Å²	172	152.9 Å²	152.9	80%	0.804	82%	0.818	S	S	*	*			trans	-45	136.5	-173.4	-71.3	164.4	-31.3	0	0	114.6	H266	Q264-H266 PolarHBondContact O-N 2.99Å
265	Y	36.9	Very low	33	Very low	235 Å²	235	150.5 Å²	150.5	92%	0.922	82%	0.816	S	S	*	*			trans	-52.3	105.8	172.1	-66.4	-90	0	0	0	111.4	H267	Y265-H267 PolarHBondContact O-N 3.33Å
266	H	39	Very low	33.2	Very low	174 Å²	174	149.7 Å²	149.7	81%	0.806	82%	0.817	S	S	*	*			trans	-75	116.9	162	-78.2	-74.3	0	0	0	108.8	Q264 V268	Q264-H266 PolarHBondContact O-N 2.99Å; H266-V268 PolarHBondContact O-N 2.96Å; H266-V268 VanDerWaalsContact O-N 3.12Å
267	H	30.9	Very low	32.9	Very low	191 Å²	191	144.8 Å²	144.8	88%	0.884	81%	0.807	S	S	*	*			trans	-48.1	110.7	170.8	-103.8	-89.4	0	0	0	110.9	Y265	Y265-H267 PolarHBondContact O-N 3.33Å
268	V	37.2	Very low	33	Very low	126 Å²	126	144.4 Å²	144.4	76%	0.764	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-99.5	125.2	163.6	-173	0	0	0	0	107.2	H266	H266-V268 PolarHBondContact O-N 2.96Å; H266-V268 VanDerWaalsContact O-N 3.12Å
269	P	31.5	Very low	33.2	Very low	115 Å²	115	141.8 Å²	141.8	75%	0.747	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-71.5	143.4	-168	28.1	-36.1	0	0	0	113.3
270	S	29.6	Very low	33.3	Very low	117 Å²	117	143.6 Å²	143.6	82%	0.818	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-62.7	133.8	-176.9	-50.8	0	0	0	0	112.8
271	P	31.8	Very low	33.1	Very low	119 Å²	119	147.2 Å²	147.2	77%	0.773	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-72.7	152.1	174.5	28.6	-31.6	0	0	0	111.7
272	P	33.2	Very low	32.8	Very low	124 Å²	124	152.8 Å²	152.8	81%	0.805	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-71.5	145.6	-171	27	-32.2	0	0	0	113	A274	P272-A274 PolarHBondContact O-N 2.71Å
273	S	32.3	Very low	32.4	Very low	119 Å²	119	155.3 Å²	155.3	83%	0.832	83%	0.829	S	S	*	*			trans	-58.4	96.8	-178	-52.1	0	0	0	0	112.4	Q275	S273-Q275 PolarHBondContact O-N 2.73Å; S273-Q275 VanDerWaalsContact O-N 3.14Å
274	A	34.2	Very low	32	Very low	100 Å²	100	153.9 Å²	153.9	83%	0.826	83%	0.825	S	S	*	*			trans	-76.6	96.8	166.1	0	0	0	0	0	108.9	P272 L276	P272-A274 PolarHBondContact O-N 2.71Å; A274-L276 PolarHBondContact O-N 2.73Å
275	Q	29.7	Very low	32	Very low	180 Å²	180	150.1 Å²	150.1	84%	0.841	82%	0.815	S	S	*	*			trans	-64.4	121.3	160.7	-59	-178	-74.5	0	0	108	S273	S273-Q275 PolarHBondContact O-N 2.73Å; S273-Q275 VanDerWaalsContact O-N 3.14Å
276	L	32.8	Very low	31.9	Very low	166 Å²	166	146.3 Å²	146.3	87%	0.869	81%	0.811	S	S	*	*			trans	-171.1	112.3	149	-103.3	142	0	0	0	112.4	A274	A274-L276 PolarHBondContact O-N 2.73Å
277	S	28	Very low	31.7	Very low	97 Å²	97	147 Å²	147	68%	0.678	81%	0.812	S	S	*	*			trans	38	123.8	147.7	-72.9	0	0	0	0	121.8	H279	S277-H279 PolarHBondContact O-N 3.1Å
278	S	34.8	Very low	32.2	Very low	123 Å²	123	141.4 Å²	141.4	86%	0.86	81%	0.805	S	S	*	*			trans	-38.4	92.2	156.3	54.6	0	0	0	0	113.9
279	H	31.2	Very low	32.9	Very low	177 Å²	177	139 Å²	139	82%	0.819	80%	0.799	S	S	*	*			trans	-99.7	117.1	150.5	-91.8	-81.3	0	0	0	107.6	S277 M281	S277-H279 PolarHBondContact O-N 3.1Å; H279-M281 PolarHBondContact O-N 2.67Å
280	H	32.3	Very low	34.5	Very low	188 Å²	188	137.5 Å²	137.5	87%	0.87	79%	0.785	S	S	*	*			trans	-30	108.1	164.5	-101.4	-75.7	0	0	0	110.1	R282	H280-R282 VanDerWaalsContact C-N 3.28Å; H280-R282 PolarHBondContact O-N 3.2Å
281	M	27.9	Very low	36.4	Very low	182 Å²	182	136.7 Å²	136.7	90%	0.897	78%	0.776	S	S	*	*			trans	-57.7	102	161.4	-76.2	-102.3	-169.3	0	0	105.2	H279 E283	H279-M281 PolarHBondContact O-N 2.67Å; M281-E283 PolarHBondContact O-N 3.39Å; M281-E283 VanDerWaalsContact O-N 3.14Å
282	R	27.2	Very low	38.5	Very low	231 Å²	231	135.2 Å²	135.2	87%	0.872	77%	0.765	S	S	*	*			trans	-53.7	120.2	164.6	-83.4	179.5	162.7	173.6	-5.1	105.6	H280 S284	H280-R282 VanDerWaalsContact C-N 3.28Å; H280-R282 PolarHBondContact O-N 3.2Å; R282-S284 PolarHBondContact O-N 2.85Å; R282-S284 VanDerWaalsContact O-N 3.08Å
283	E	27.7	Very low	40.5	Very low	186 Å²	186	131.3 Å²	131.3	87%	0.869	74%	0.738	S	S	*	*			trans	-45.5	120.7	168.6	-73.1	175.9	161.7	0	0	107.6	M281	M281-E283 PolarHBondContact O-N 3.39Å; M281-E283 VanDerWaalsContact O-N 3.14Å
284	S	29.4	Very low	42.6	Very low	109 Å²	109	127.2 Å²	127.2	76%	0.762	71%	0.711	S	S	*	*			trans	-59.5	129.2	171.8	-68.3	0	0	0	0	106.7	R282 N286	R282-S284 PolarHBondContact O-N 2.85Å; R282-S284 VanDerWaalsContact O-N 3.08Å; S284-N286 PolarHBondContact O-N 3.36Å
285	P	33.6	Very low	44.7	Very low	94 Å²	94	128.7 Å²	128.7	61%	0.61	70%	0.701	S	S	*	*			trans	-58.2	128.9	-179.9	-16	27.1	0	0	0	107.8	F287	P285-F287 HydrophobicContact CB-CD2 4.07Å; P285-F287 HydrophobicContact CB-CE2 4.03Å; P285-F287 HydrophobicContact CG-CE2 4.1Å; P285-F287 WeakPolarHBondContact O-CD2 3.5Å; P285-F287 PolarHBondContact O-N 3.15Å
286	N	35.8	Very low	47.1	Very low	155 Å²	155	121.9 Å²	121.9	83%	0.829	67%	0.67	S	S	*	*			trans	-65.3	80.4	175.7	-161.4	7.8	0	0	0	108.6	S284 G288	S284-N286 PolarHBondContact O-N 3.36Å; N286-G288 PolarHBondContact O-N 2.92Å; N286-G288 VanDerWaalsContact O-N 3.14Å
287	F	35.5	Very low	49.4	Very low	189 Å²	189	115.2 Å²	115.2	83%	0.829	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	104.2	174.9	-88.3	-85.1	0	0	0	107.6	P285	P285-F287 HydrophobicContact CB-CD2 4.07Å; P285-F287 HydrophobicContact CB-CE2 4.03Å; P285-F287 HydrophobicContact CG-CE2 4.1Å; P285-F287 WeakPolarHBondContact O-CD2 3.5Å; P285-F287 PolarHBondContact O-N 3.15Å
288	G	40.5	Very low	51.8	Low	72 Å²	72	117.7 Å²	117.7	74%	0.742	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	124.8	16.9	149.5	0	0	0	0	0	118.6	N286 D290	N286-G288 PolarHBondContact O-N 2.92Å; N286-G288 VanDerWaalsContact O-N 3.14Å; G288-D290 VanDerWaalsContact C-N 3.35Å; G288-D290 PolarHBondContact O-N 3.27Å
289	A	51.8	Low	54	Low	76 Å²	76	114.4 Å²	114.4	63%	0.628	60%	0.601	S	S	*	*			trans	-70.8	97.2	160.2	0	0	0	0	0	108.3	P291	A289-P291 VanDerWaalsContact O-N 3.14Å
290	D	64.3	Low	56.3	Low	83 Å²	83	106 Å²	106	44%	0.444	56%	0.562	S	S	.	*			trans	-50.5	120.3	173.6	-178.8	-17.3	0	0	0	109	G288 T292 N293 A294	G288-D290 VanDerWaalsContact C-N 3.35Å; G288-D290 PolarHBondContact O-N 3.27Å; D290-T292 PolarHBondContact O-N 3.22Å; D290-T292 VanDerWaalsContact O-N 3.11Å; D290-T292 WeakPolarHBondContact OD1-CB 3.5Å; D290-T292 WeakPolarHBondContact OD1-CG2 3.36Å; D290-T292 PolarHBondContact OD1-N 3.2Å; D290-T292 PolarHBondContact OD1-OG1 2.9Å; D290-T292 PolarHBondContact OD2-OG1 3.28Å; D290-N293 HydrophobicContact CB-CB 4.15Å; D290-N293 PolarHBondContact O-N 2.9Å; D290-A294 PolarHBondContact O-N 3.07Å
291	P	71.4	Confident	58.6	Low	100 Å²	100	100.7 Å²	100.7	65%	0.649	53%	0.534	S	S	*	.	H	α-helix	trans	-58.1	-27.6	-177.7	23.3	-34.2	0	0	0	112.4	A289 A294 Q295	A289-P291 VanDerWaalsContact O-N 3.14Å; P291-A294 PolarHBondContact O-N 3.14Å; P291-Q295 PolarHBondContact O-N 3.46Å
292	T	75.9	Confident	61.2	Low	88 Å²	88	93.9 Å²	93.9	54%	0.54	51%	0.507	S	S	.	.	H	α-helix	trans	-67.2	-44.3	176.1	69.2	0	0	0	0	111.2	D290 Q295 L296	D290-T292 PolarHBondContact O-N 3.22Å; D290-T292 VanDerWaalsContact O-N 3.11Å; D290-T292 WeakPolarHBondContact OD1-CB 3.5Å; D290-T292 WeakPolarHBondContact OD1-CG2 3.36Å; D290-T292 PolarHBondContact OD1-N 3.2Å; D290-T292 PolarHBondContact OD1-OG1 2.9Å; D290-T292 PolarHBondContact OD2-OG1 3.28Å; T292-Q295 PolarHBondContact O-N 2.99Å; T292-L296 WeakPolarHBondContact O-CB 3.3Å; T292-L296 PolarHBondContact O-N 3.42Å
293	N	74.5	Confident	63.7	Low	43 Å²	43	85.1 Å²	85.1	23%	0.23	48%	0.477	C	S	.	.	H	α-helix	trans	-67	-37.6	176.2	-169.6	20.1	0	0	0	111.3	A118 D290 Q295 L296 N297	A118-N293 WeakPolarHBondContact CB-ND2 3.41Å; A118-N293 PolarHBondContact N-OD1 2.92Å; D290-N293 HydrophobicContact CB-CB 4.15Å; D290-N293 PolarHBondContact O-N 2.9Å; N293-Q295 PolarHBondContact O-N 2.85Å; N293-L296 PolarHBondContact O-N 2.94Å; N293-N297 VanDerWaalsContact O-CB 3.31Å; N293-N297 WeakPolarHBondContact O-CB 3.49Å; N293-N297 PolarHBondContact O-N 3.08Å; N293-N297 PolarHBondContact O-ND2 3.25Å
294	A	75.8	Confident	66.1	Low	33 Å²	33	76.2 Å²	76.2	27%	0.273	44%	0.436	S	S	.	.	H	α-helix	trans	-62.5	-41.4	174.6	0	0	0	0	0	112.4	D290 P291 R298	D290-A294 PolarHBondContact O-N 3.07Å; P291-A294 PolarHBondContact O-N 3.14Å; A294-R298 WeakPolarHBondContact O-CG 3.15Å; A294-R298 PolarHBondContact O-N 2.98Å; A294-R298 VanDerWaalsContact O-N 3.16Å
295	Q	79.2	Confident	68.4	Low	131 Å²	131	75.3 Å²	75.3	61%	0.612	42%	0.419	S	S	*	.	H	α-helix	trans	-67.1	-42.4	174.8	-175.8	174.9	2.8	0	0	112.1	P291 T292 N293 R298 H299	P291-Q295 PolarHBondContact O-N 3.46Å; T292-Q295 PolarHBondContact O-N 2.99Å; N293-Q295 PolarHBondContact O-N 2.85Å; Q295-R298 PolarHBondContact O-N 3.06Å; Q295-H299 PolarHBondContact O-N 3.41Å
296	L	79.8	Confident	70.4	Confident	37 Å²	37	75.6 Å²	75.6	19%	0.194	41%	0.413	C	S	.	.	H	α-helix	trans	-60.9	-47.6	176.3	-173.9	58.2	0	0	0	111.2	F116 T292 N293 R298 H299 C300	F116-L296 VanDerWaalsContact C-CD2 3.44Å; F116-L296 VanDerWaalsContact O-CD2 3.25Å; F116-L296 WeakPolarHBondContact O-CD2 3.22Å; T292-L296 WeakPolarHBondContact O-CB 3.3Å; T292-L296 PolarHBondContact O-N 3.42Å; N293-L296 PolarHBondContact O-N 2.94Å; L296-R298 VanDerWaalsContact C-N 3.34Å; L296-R298 PolarHBondContact O-N 3.11Å; L296-H299 WeakPolarHBondContact O-CB 3.47Å; L296-H299 PolarHBondContact O-N 2.7Å; L296-C300 PolarHBondContact O-N 2.71Å; L296-C300 PolarHBondContact O-SG 3.42Å
297	N	80.5	Confident	72.1	Confident	25 Å²	25	70.9 Å²	70.9	13%	0.134	39%	0.387	C	S	.	.	H	α-helix	trans	-55.3	-45.7	175.2	-76	-22.6	0	0	0	112.7	P117 N293 H299 C300 R301	P117-N297 WeakPolarHBondContact CB-OD1 3.49Å; N293-N297 VanDerWaalsContact O-CB 3.31Å; N293-N297 WeakPolarHBondContact O-CB 3.49Å; N293-N297 PolarHBondContact O-N 3.08Å; N293-N297 PolarHBondContact O-ND2 3.25Å; N297-H299 VanDerWaalsContact C-N 3.31Å; N297-H299 PolarHBondContact O-N 3.01Å; N297-C300 PolarHBondContact O-N 2.79Å; N297-R301 WeakPolarHBondContact O-CB 3.29Å; N297-R301 WeakPolarHBondContact O-CG 3.29Å; N297-R301 PolarHBondContact O-N 3.15Å
298	R	79.6	Confident	73.5	Confident	150 Å²	150	62.8 Å²	62.8	57%	0.566	35%	0.353	S	S	*	.	H	α-helix	trans	-60.3	-42.4	175.7	-75	-167.9	-61	-87.8	1.9	111.6	A294 Q295 L296 A302	A294-R298 WeakPolarHBondContact O-CG 3.15Å; A294-R298 PolarHBondContact O-N 2.98Å; A294-R298 VanDerWaalsContact O-N 3.16Å; Q295-R298 PolarHBondContact O-N 3.06Å; L296-R298 VanDerWaalsContact C-N 3.34Å; L296-R298 PolarHBondContact O-N 3.11Å; R298-A302 PolarHBondContact O-N 2.82Å
299	H	80.1	Confident	74.9	Confident	54 Å²	54	65.5 Å²	65.5	25%	0.25	35%	0.35	C	S	.	.	H	α-helix	trans	-66.6	-46.2	179.8	-179.5	52.1	0	0	0	112.5	K47 Q295 L296 N297 R301 A302 L303	K47-H299 WeakPolarHBondContact CE-CE1 3.47Å; K47-H299 WeakPolarHBondContact CE-NE2 3.47Å; K47-H299 WeakPolarHBondContact CG-NE2 3.4Å; Q295-H299 PolarHBondContact O-N 3.41Å; L296-H299 WeakPolarHBondContact O-CB 3.47Å; L296-H299 PolarHBondContact O-N 2.7Å; N297-H299 VanDerWaalsContact C-N 3.31Å; N297-H299 PolarHBondContact O-N 3.01Å; H299-R301 VanDerWaalsContact C-N 3.3Å; H299-R301 PolarHBondContact O-N 2.7Å; H299-A302 WeakPolarHBondContact O-CB 3.47Å; H299-A302 PolarHBondContact O-N 3.2Å; H299-L303 WeakPolarHBondContact NE2-CD1 3.46Å; H299-L303 PolarHBondContact O-N 2.69Å
300	C	80.6	Confident	75.5	Confident	1 Å²	1	68.3 Å²	68.3	1%	0.007	36%	0.355	C	S	.	.	H	α-helix	trans	-65	-35.8	179.4	-55.1	0	0	0	0	112	L44 P117 F133 L296 N297 L303 A304	L44-C300 HydrophobicContact CD2-CB 3.84Å; P117-C300 VanDerWaalsContact CD-SG 3.59Å; P117-C300 HydrophobicContact CG-CB 3.96Å; P117-C300 VanDerWaalsContact CG-SG 3.58Å; F133-C300 HydrophobicContact CD1-CB 4Å; F133-C300 HydrophobicContact CE1-CB 3.24Å; F133-C300 HydrophobicContact CZ-CB 3.64Å; F133-C300 WeakPolarHBondContact CZ-O 3.46Å; L296-C300 PolarHBondContact O-N 2.71Å; L296-C300 PolarHBondContact O-SG 3.42Å; N297-C300 PolarHBondContact O-N 2.79Å; C300-L303 PolarHBondContact O-N 3.49Å; C300-A304 PolarHBondContact O-N 3.42Å
301	R	79.2	Confident	74.9	Confident	75 Å²	75	67.7 Å²	67.7	28%	0.283	37%	0.368	S	S	.	.	H	α-helix	trans	-61.3	-47.7	171	-75.3	-176.3	-173.5	127.8	4.3	111.7	F133 N297 H299 L303 A304 E305 W315	F133-R301 HydrophobicContact CB-CG 4.35Å; F133-R301 HydrophobicContact CD2-CG 3.59Å; F133-R301 HydrophobicContact CE2-CG 4Å; F133-R301 HydrophobicContact CG-CG 4.04Å; F133-R301 PolarHBondContact O-NH2 3.05Å; F133-R301 VanDerWaalsContact O-NH2 3.09Å; N297-R301 WeakPolarHBondContact O-CB 3.29Å; N297-R301 WeakPolarHBondContact O-CG 3.29Å; N297-R301 PolarHBondContact O-N 3.15Å; H299-R301 VanDerWaalsContact C-N 3.3Å; H299-R301 PolarHBondContact O-N 2.7Å; R301-L303 VanDerWaalsContact C-N 3.3Å; R301-L303 PolarHBondContact O-N 2.77Å; R301-A304 PolarHBondContact O-N 2.73Å; R301-A304 VanDerWaalsContact O-N 3.13Å; R301-E305 WeakPolarHBondContact O-CG 3.3Å; R301-E305 PolarHBondContact O-N 3.38Å; R301-W315 HydrophobicContact CB-CH2 4.33Å; R301-W315 HydrophobicContact CG-CH2 3.96Å
302	A	82.1	Confident	73.7	Confident	40 Å²	40	63.6 Å²	63.6	33%	0.331	34%	0.344	S	S	.	.	H	α-helix	trans	-59.3	-40	177.5	0	0	0	0	0	112.3	R298 H299 E305 Q306	R298-A302 PolarHBondContact O-N 2.82Å; H299-A302 WeakPolarHBondContact O-CB 3.47Å; H299-A302 PolarHBondContact O-N 3.2Å; A302-E305 PolarHBondContact O-N 2.68Å; A302-Q306 VanDerWaalsContact O-CG 3.31Å; A302-Q306 WeakPolarHBondContact O-CG 3.46Å; A302-Q306 PolarHBondContact O-N 2.94Å
303	L	80.4	Confident	72	Confident	46 Å²	46	66 Å²	66	24%	0.241	35%	0.35	C	S	.	.	H	α-helix	trans	-62.5	-44.8	174.4	-76.9	174.8	0	0	0	112.2	L44 H299 C300 R301 Q306 L307	L44-L303 HydrophobicContact CD2-CD1 3.68Å; H299-L303 WeakPolarHBondContact NE2-CD1 3.46Å; H299-L303 PolarHBondContact O-N 2.69Å; C300-L303 PolarHBondContact O-N 3.49Å; R301-L303 VanDerWaalsContact C-N 3.3Å; R301-L303 PolarHBondContact O-N 2.77Å; L303-Q306 PolarHBondContact O-N 3.23Å; L303-L307 PolarHBondContact O-N 3.02Å
304	A	78	Confident	70.4	Confident	0 Å²	0	71 Å²	71	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-65.1	-36.9	176.1	0	0	0	0	0	112.3	F40 V131 F133 I142 C300 R301 L307 V308 W315	F40-A304 HydrophobicContact CE2-CB 3.97Å; V131-A304 HydrophobicContact CG1-CB 4.23Å; F133-A304 HydrophobicContact CE2-CB 4.08Å; F133-A304 HydrophobicContact CZ-CB 4.31Å; I142-A304 HydrophobicContact CG2-CB 3.8Å; C300-A304 PolarHBondContact O-N 3.42Å; R301-A304 PolarHBondContact O-N 2.73Å; R301-A304 VanDerWaalsContact O-N 3.13Å; A304-L307 PolarHBondContact O-N 3.33Å; A304-V308 WeakPolarHBondContact O-CG2 3.38Å; A304-V308 PolarHBondContact O-N 3.16Å; A304-V308 VanDerWaalsContact O-N 3.08Å; A304-W315 HydrophobicContact CB-CH2 4.27Å; A304-W315 HydrophobicContact CB-CZ2 3.49Å; A304-W315 VanDerWaalsContact CB-CZ2 3.49Å
305	E	77.6	Confident	68.6	Low	89 Å²	89	71.1 Å²	71.1	42%	0.416	37%	0.37	S	S	.	.	H	α-helix	trans	-64.2	-37.8	171.6	-72.2	169.2	-173.9	0	0	112.9	R301 A302 V308 L309 W315	R301-E305 WeakPolarHBondContact O-CG 3.3Å; R301-E305 PolarHBondContact O-N 3.38Å; A302-E305 PolarHBondContact O-N 2.68Å; E305-V308 WeakPolarHBondContact O-CB 3.41Å; E305-V308 PolarHBondContact O-N 3.25Å; E305-L309 WeakPolarHBondContact O-CG 2.95Å; E305-L309 PolarHBondContact O-N 2.73Å; E305-W315 HydrophobicContact CG-CZ2 4.16Å
306	Q	75.9	Confident	66.7	Low	100 Å²	100	67.2 Å²	67.2	47%	0.467	36%	0.357	S	S	.	.	H	α-helix	trans	-65.7	-38.4	174.5	-70.4	-60.6	-52.2	0	0	112.1	A302 L303 V308 L309 N310	A302-Q306 VanDerWaalsContact O-CG 3.31Å; A302-Q306 WeakPolarHBondContact O-CG 3.46Å; A302-Q306 PolarHBondContact O-N 2.94Å; L303-Q306 PolarHBondContact O-N 3.23Å; Q306-V308 VanDerWaalsContact C-N 3.29Å; Q306-V308 PolarHBondContact O-N 2.93Å; Q306-L309 PolarHBondContact O-N 2.81Å; Q306-N310 WeakPolarHBondContact O-CB 3.44Å; Q306-N310 VanDerWaalsContact O-CG 3.25Å; Q306-N310 PolarHBondContact O-N 2.68Å; Q306-N310 PolarHBondContact O-ND2 3.4Å; Q306-N310 VanDerWaalsContact O-ND2 3.16Å
307	L	71.5	Confident	64.6	Low	57 Å²	57	68.5 Å²	68.5	30%	0.298	37%	0.373	S	S	.	.	H	α-helix	trans	-63.1	-37.6	173.3	-69.5	173.2	0	0	0	111.8	F40 I142 L303 A304 N310 G311 G312	F40-L307 HydrophobicContact CB-CD1 4.38Å; F40-L307 HydrophobicContact CD2-CD1 3.71Å; F40-L307 HydrophobicContact CG-CD1 4.5Å; I142-L307 HydrophobicContact CB-CD1 4.45Å; L303-L307 PolarHBondContact O-N 3.02Å; A304-L307 PolarHBondContact O-N 3.33Å; L307-N310 PolarHBondContact O-N 3.4Å; L307-G311 PolarHBondContact O-N 3.47Å; L307-G312 PolarHBondContact O-N 3.26Å; L307-G312 VanDerWaalsContact O-N 3.13Å
308	V	64.1	Low	62.2	Low	18 Å²	18	71.1 Å²	71.1	11%	0.109	39%	0.387	C	S	.	.	H	α-helix	trans	-61.2	-52.4	171.6	169.3	0	0	0	0	110.9	V141 A304 E305 Q306 N310 G311 G312 M313	V141-V308 WeakPolarHBondContact O-CG2 3.38Å; A304-V308 WeakPolarHBondContact O-CG2 3.38Å; A304-V308 PolarHBondContact O-N 3.16Å; A304-V308 VanDerWaalsContact O-N 3.08Å; E305-V308 WeakPolarHBondContact O-CB 3.41Å; E305-V308 PolarHBondContact O-N 3.25Å; Q306-V308 VanDerWaalsContact C-N 3.29Å; Q306-V308 PolarHBondContact O-N 2.93Å; V308-N310 PolarHBondContact O-N 3.15Å; V308-G311 CarbonylContact O-C 3.47Å; V308-G311 PolarHBondContact O-N 3.43Å; V308-G312 CarbonylContact C-O 3.6Å; V308-G312 WeakPolarHBondContact CA-O 3.16Å; V308-G312 VanDerWaalsContact CG1-O 3.25Å; V308-G312 WeakPolarHBondContact CG1-O 3.33Å; V308-G312 CarbonylContact O-C 3.56Å; V308-G312 PolarHBondContact O-N 3.02Å; V308-M313 WeakPolarHBondContact CG2-O 3.49Å
309	L	69.9	Low	59.9	Low	130 Å²	130	68 Å²	68	68%	0.681	38%	0.381	S	S	*	.	H	α-helix	trans	-61.2	-29	179.5	-69.6	171.5	0	0	0	113.5	E305 Q306 G311	E305-L309 WeakPolarHBondContact O-CG 2.95Å; E305-L309 PolarHBondContact O-N 2.73Å; Q306-L309 PolarHBondContact O-N 2.81Å; L309-G311 VanDerWaalsContact C-N 3.26Å; L309-G311 PolarHBondContact O-N 2.97Å
310	N	65.1	Low	57.7	Low	135 Å²	135	68.2 Å²	68.2	72%	0.722	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	5	175.8	-68.6	-29.2	0	0	0	114	Q306 L307 V308	Q306-N310 WeakPolarHBondContact O-CB 3.44Å; Q306-N310 VanDerWaalsContact O-CG 3.25Å; Q306-N310 PolarHBondContact O-N 2.68Å; Q306-N310 PolarHBondContact O-ND2 3.4Å; Q306-N310 VanDerWaalsContact O-ND2 3.16Å; L307-N310 PolarHBondContact O-N 3.4Å; V308-N310 PolarHBondContact O-N 3.15Å
311	G	51.8	Low	55.3	Low	70 Å²	70	70.5 Å²	70.5	72%	0.722	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	133.1	3	174.8	0	0	0	0	0	116.6	L307 V308 L309	L307-G311 PolarHBondContact O-N 3.47Å; V308-G311 CarbonylContact O-C 3.47Å; V308-G311 PolarHBondContact O-N 3.43Å; L309-G311 VanDerWaalsContact C-N 3.26Å; L309-G311 PolarHBondContact O-N 2.97Å
312	G	46.5	Very low	53.2	Low	14 Å²	14	75.8 Å²	75.8	14%	0.144	45%	0.446	C	S	.	.	P	Polyproline II helix	trans	-84.2	154.8	168.1	0	0	0	0	0	112.6	L307 V308	L307-G312 PolarHBondContact O-N 3.26Å; L307-G312 VanDerWaalsContact O-N 3.13Å; V308-G312 CarbonylContact C-O 3.6Å; V308-G312 WeakPolarHBondContact CA-O 3.16Å; V308-G312 VanDerWaalsContact CG1-O 3.25Å; V308-G312 WeakPolarHBondContact CG1-O 3.33Å; V308-G312 CarbonylContact O-C 3.56Å; V308-G312 PolarHBondContact O-N 3.02Å
313	M	39.1	Very low	50.6	Low	138 Å²	138	77.4 Å²	77.4	68%	0.68	47%	0.466	S	S	*	.	P	Polyproline II helix	trans	-82.3	156	177.4	-85.7	-167.6	-162.6	0	0	113.9	V141 V308	V141-M313 VanDerWaalsContact O-O 3.1Å; V308-M313 WeakPolarHBondContact CG2-O 3.49Å
314	L	40.8	Very low	48.2	Very low	148 Å²	148	77.7 Å²	77.7	78%	0.775	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-51.4	147.2	-168.8	-160.6	76.4	0	0	0	116
315	W	38.1	Very low	45.7	Very low	35 Å²	35	86.5 Å²	86.5	13%	0.133	52%	0.517	C	S	.	.	P	Polyproline II helix	trans	-69	140.8	166.4	-71	73	0	0	0	112.3	F133 R301 A304 E305 A317	F133-W315 AromaticContact CD2-CH2 3.65Å; F133-W315 HydrophobicContact CD2-CH2 3.65Å; F133-W315 HydrophobicContact CD2-CZ3 4.26Å; F133-W315 AromaticContact CE2-CH2 3.57Å; F133-W315 HydrophobicContact CE2-CH2 3.57Å; F133-W315 HydrophobicContact CE2-CZ2 4.25Å; R301-W315 HydrophobicContact CB-CH2 4.33Å; R301-W315 HydrophobicContact CG-CH2 3.96Å; A304-W315 HydrophobicContact CB-CH2 4.27Å; A304-W315 HydrophobicContact CB-CZ2 3.49Å; A304-W315 VanDerWaalsContact CB-CZ2 3.49Å; E305-W315 HydrophobicContact CG-CZ2 4.16Å; W315-A317 PolarHBondContact O-N 3.25Å
316	S	39.6	Very low	43.4	Very low	50 Å²	50	88.1 Å²	88.1	35%	0.35	53%	0.532	S	S	.	.			trans	-83	105.5	166.8	-175	0	0	0	0	110.1	S138 N318	S138-S316 WeakPolarHBondContact CB-O 3.42Å; S316-N318 PolarHBondContact O-N 3.3Å; S316-N318 VanDerWaalsContact O-N 3.16Å
317	A	35.3	Very low	41.1	Very low	63 Å²	63	91.6 Å²	91.6	52%	0.521	55%	0.55	S	S	.	*	G	3₁₀ helix	trans	-66.4	-9.6	-177	0	0	0	0	0	115.2	W315 N319	W315-A317 PolarHBondContact O-N 3.25Å; A317-N319 PolarHBondContact O-N 2.95Å
318	N	31.2	Very low	39	Very low	81 Å²	81	96.9 Å²	96.9	43%	0.433	57%	0.574	S	S	.	*	G	3₁₀ helix	trans	-95.8	21.5	-167.3	-71	-2	0	0	0	115.3	Q182 S316	Q182-N318 VanDerWaalsContact CD-ND2 3.27Å; Q182-N318 PolarHBondContact NE2-ND2 2.84Å; S316-N318 PolarHBondContact O-N 3.3Å; S316-N318 VanDerWaalsContact O-N 3.16Å
319	N	31.6	Very low	37.3	Very low	84 Å²	84	101.6 Å²	101.6	45%	0.449	60%	0.603	S	S	.	*	G	3₁₀ helix	trans	-124.5	17.9	173.3	-132	35.1	0	0	0	113.6	A317 G321	A317-N319 PolarHBondContact O-N 2.95Å; N319-G321 PolarHBondContact O-N 3.27Å; N319-G321 VanDerWaalsContact O-N 3.07Å
320	C	33.4	Very low	35.1	Very low	59 Å²	59	100.5 Å²	100.5	40%	0.399	60%	0.601	S	S	.	*			trans	-68.4	104.2	165.9	-62.5	0	0	0	0	108.4	D322 A324	C320-D322 PolarHBondContact O-N 3.02Å; C320-A324 HydrophobicContact CB-CB 3.71Å
321	G	29.2	Very low	33.2	Very low	48 Å²	48	100.3 Å²	100.3	50%	0.495	61%	0.605	S	S	.	*			trans	-48.2	139.2	160.9	0	0	0	0	0	109.4	N319 G323	N319-G321 PolarHBondContact O-N 3.27Å; N319-G321 VanDerWaalsContact O-N 3.07Å; G321-G323 PolarHBondContact O-N 3.08Å
322	D	35.1	Very low	32.2	Very low	186 Å²	186	107.5 Å²	107.5	100%	0.995	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-38.7	101.4	-176.6	-97.7	-33.1	0	0	0	111.2	C320	C320-D322 PolarHBondContact O-N 3.02Å
323	G	29.2	Very low	31.4	Very low	74 Å²	74	112.2 Å²	112.2	76%	0.763	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	160.4	-23.5	-175.5	0	0	0	0	0	115.9	G321 Q325	G321-G323 PolarHBondContact O-N 3.08Å; G323-Q325 PolarHBondContact O-N 2.94Å
324	A	29.7	Very low	31	Very low	52 Å²	52	110.8 Å²	110.8	43%	0.43	65%	0.649	S	S	.	*			trans	-92.3	87.2	171.9	0	0	0	0	0	110.2	C320 V326	C320-A324 HydrophobicContact CB-CB 3.71Å; A324-V326 PolarHBondContact O-N 2.98Å; A324-V326 VanDerWaalsContact O-N 3.11Å
325	Q	26	Very low	30.5	Very low	186 Å²	186	108.8 Å²	108.8	87%	0.869	64%	0.642	S	S	*	*			trans	-60.7	114.6	159.7	-74.8	-175	-8.4	0	0	107.7	G323 M327	G323-Q325 PolarHBondContact O-N 2.94Å; Q325-M327 PolarHBondContact O-N 3.38Å
326	V	28.7	Very low	30.1	Very low	123 Å²	123	113.1 Å²	113.1	75%	0.745	67%	0.672	S	S	*	*			trans	-58.5	102.8	171.1	177.2	0	0	0	0	107.3	A324 E328	A324-V326 PolarHBondContact O-N 2.98Å; A324-V326 VanDerWaalsContact O-N 3.11Å; V326-E328 PolarHBondContact O-N 2.8Å; V326-E328 VanDerWaalsContact O-N 3.13Å
327	M	26.9	Very low	29.5	Very low	172 Å²	172	117.1 Å²	117.1	85%	0.847	69%	0.692	S	S	*	*			trans	-74.2	98.4	162.9	-92.4	-170.2	166.1	0	0	107	Q325 T329	Q325-M327 PolarHBondContact O-N 3.38Å; M327-T329 VanDerWaalsContact C-N 3.32Å; M327-T329 PolarHBondContact O-N 3.19Å
328	E	27.9	Very low	29.1	Very low	168 Å²	168	120.7 Å²	120.7	79%	0.785	70%	0.704	S	S	*	*			trans	-59.6	100.1	161.7	-165.3	171.6	-151.8	0	0	106.7	V326 V330	V326-E328 PolarHBondContact O-N 2.8Å; V326-E328 VanDerWaalsContact O-N 3.13Å; E328-V330 VanDerWaalsContact C-N 3.27Å; E328-V330 PolarHBondContact O-N 3.18Å
329	T	28.3	Very low	28.9	Very low	118 Å²	118	123.5 Å²	123.5	72%	0.724	72%	0.723	S	S	*	*			trans	-75.3	92.7	173.2	-53.7	0	0	0	0	105.8	M327 V331	M327-T329 VanDerWaalsContact C-N 3.32Å; M327-T329 PolarHBondContact O-N 3.19Å; T329-V331 PolarHBondContact O-N 3.38Å
330	V	24.4	Very low	28.7	Very low	107 Å²	107	126.5 Å²	126.5	65%	0.648	74%	0.744	S	S	*	*			trans	-62	105.5	166.7	178.4	0	0	0	0	106.4	E328 N332	E328-V330 VanDerWaalsContact C-N 3.27Å; E328-V330 PolarHBondContact O-N 3.18Å; V330-N332 PolarHBondContact O-N 2.95Å
331	V	25	Very low	28.3	Very low	131 Å²	131	132.2 Å²	132.2	79%	0.794	77%	0.773	S	S	*	*			trans	-70	111.3	168.9	-166.7	0	0	0	0	106.5	T329	T329-V331 PolarHBondContact O-N 3.38Å
332	N	29.5	Very low	28.2	Very low	221 Å²	221	139.8 Å²	139.8	100%	1.182	80%	0.798	S	S	*	*			trans	-137.4	0	160	-101.3	-12.2	0	0	0	108.7	V330	V330-N332 PolarHBondContact O-N 2.95Å

Retrieved 332 of 332 residues in 172.4 ms (Link to these results)

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