A0A096M8D0_POEFO Loading...

Collagen alpha-1(XVI) chain

Involved in mediating cell attachment and inducing integrin-mediated cellular reactions, such as cell spreading and alterations in cell morphology.

AlphaFold DB , UniProt , Accession A0A096M8D0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 293 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.6	Very low	39.2	Very low	235 Å²	235	164.2 Å²	164.2	100%	1.158	80%	0.799	S	S	*	*				0	125.4	0	-152.3	149.3	75.6	0	0	106.8
2	N	31.9	Very low	39.8	Very low	154 Å²	154	159.5 Å²	159.5	82%	0.824	79%	0.787	S	S	*	*			trans	67.5	142.5	-173	-64.6	-2.4	0	0	0	115.1
3	C	32.2	Very low	39.8	Very low	94 Å²	94	164.6 Å²	164.6	64%	0.635	79%	0.793	S	S	*	*			cis	-163.7	123.8	0.7	-128.8	0	0	0	0	104.8
4	Y	39.3	Very low	40.4	Very low	250 Å²	250	163.3 Å²	163.3	98%	0.98	79%	0.789	S	S	*	*			trans	-106	116.1	168.2	-86.4	-80.1	0	0	0	109.5
5	L	39	Very low	40.9	Very low	136 Å²	136	160.6 Å²	160.6	71%	0.712	79%	0.787	S	S	*	*			trans	-94.7	149.9	-176.7	-128.8	84.4	0	0	0	109.9
6	I	40.5	Very low	41	Very low	145 Å²	145	159.3 Å²	159.3	74%	0.744	78%	0.784	S	S	*	*			trans	87	83.2	148.9	-53.4	154.3	0	0	0	118.4
7	R	38.1	Very low	41	Very low	206 Å²	206	157 Å²	157	78%	0.777	79%	0.787	S	S	*	*				21.3	118.4	106.7	-94.2	-162.3	92.2	166.8	7.2	120.7
8	W	36.3	Very low	41.3	Very low	191 Å²	191	155.6 Å²	155.6	72%	0.723	79%	0.788	S	S	*	*			trans	65.3	121.5	143.1	-58.5	78.2	0	0	0	122.3
9	V	44.3	Very low	41.5	Very low	134 Å²	134	153.2 Å²	153.2	81%	0.812	78%	0.784	S	S	*	*				-146.5	127.7	124.6	-178.4	0	0	0	0	109.2	F11	V9-F11 HydrophobicContact CG1-CD2 4.3Å; V9-F11 HydrophobicContact CG1-CE2 4.28Å
10	A	42.3	Very low	41.4	Very low	73 Å²	73	151.6 Å²	151.6	60%	0.603	79%	0.786	S	S	*	*			trans	-81.3	140.3	173.7	0	0	0	0	0	110.8
11	F	48.5	Very low	41.6	Very low	188 Å²	188	148.8 Å²	148.8	83%	0.825	79%	0.785	S	S	*	*			trans	-129.1	116.3	157.5	-99.2	-84.4	0	0	0	109.8	V9	V9-F11 HydrophobicContact CG1-CD2 4.3Å; V9-F11 HydrophobicContact CG1-CE2 4.28Å
12	V	46.8	Very low	42	Very low	108 Å²	108	147.1 Å²	147.1	66%	0.655	77%	0.772	S	S	*	*			trans	-74.3	126.9	176.8	171.8	0	0	0	0	108.7	I14	V12-I14 HydrophobicContact CG1-CD1 4.12Å; V12-I14 HydrophobicContact CG1-CG1 3.82Å
13	W	40.4	Very low	42.4	Very low	226 Å²	226	142.7 Å²	142.7	86%	0.856	76%	0.762	S	S	*	*			trans	-125.9	104.7	155.1	-82.2	94.2	0	0	0	108.3
14	I	47.2	Very low	42.9	Very low	146 Å²	146	146.7 Å²	146.7	75%	0.749	77%	0.774	S	S	*	*			trans	-78.8	118.7	167.6	-66.5	166.6	0	0	0	106.4	V12	V12-I14 HydrophobicContact CG1-CD1 4.12Å; V12-I14 HydrophobicContact CG1-CG1 3.82Å
15	V	48.5	Very low	42.8	Very low	123 Å²	123	141.1 Å²	141.1	75%	0.745	77%	0.765	S	S	*	*			trans	-125.9	118.5	158.7	-176.6	0	0	0	0	107.8
16	N	42.8	Very low	42.7	Very low	139 Å²	139	140.7 Å²	140.7	74%	0.743	77%	0.768	S	S	*	*			trans	-34.4	130.4	168.5	-103.5	-58.5	0	0	0	113.7
17	S	40.9	Very low	42.6	Very low	121 Å²	121	138.1 Å²	138.1	85%	0.846	76%	0.763	S	S	*	*			trans	-158.7	102.6	151.7	-73.6	0	0	0	0	109.7
18	V	46.1	Very low	42.8	Very low	132 Å²	132	136.5 Å²	136.5	80%	0.8	76%	0.764	S	S	*	*			trans	-116.3	149.7	167	177.8	0	0	0	0	105.9
19	P	45.5	Very low	43.2	Very low	109 Å²	109	132.5 Å²	132.5	71%	0.708	75%	0.753	S	S	*	*				-100.5	148.4	-78.2	28.8	-8.8	0	0	0	111	A21	P19-A21 PolarHBondContact O-N 3.07Å
20	C	39.3	Very low	43	Very low	122 Å²	122	132.6 Å²	132.6	82%	0.824	75%	0.754	S	S	*	*			trans	-68.7	101	160.8	-77.2	0	0	0	0	107.6	F22	C20-F22 PolarHBondContact O-N 3.02Å
21	A	45.1	Very low	43.5	Very low	92 Å²	92	131.1 Å²	131.1	76%	0.76	75%	0.747	S	S	*	*			trans	-54.3	110.5	157.3	0	0	0	0	0	106.5	P19 G23	P19-A21 PolarHBondContact O-N 3.07Å; A21-G23 PolarHBondContact O-N 2.93Å
22	F	47.3	Very low	44.1	Very low	201 Å²	201	122.9 Å²	122.9	88%	0.882	72%	0.715	S	S	*	*			trans	-61.6	93.1	160.1	-83.6	-92.6	0	0	0	105.6	C20 M24	C20-F22 PolarHBondContact O-N 3.02Å; F22-M24 PolarHBondContact O-N 2.9Å; F22-M24 VanDerWaalsContact O-N 3.08Å
23	G	39.1	Very low	45.6	Very low	60 Å²	60	122.9 Å²	122.9	62%	0.619	72%	0.715	S	S	*	*			trans	-54.5	116.3	159.4	0	0	0	0	0	105.8	A21 V25	A21-G23 PolarHBondContact O-N 2.93Å; G23-V25 PolarHBondContact O-N 2.88Å
24	M	43.7	Very low	47.9	Very low	179 Å²	179	113.7 Å²	113.7	88%	0.882	69%	0.685	S	S	*	*			trans	-60.4	102.2	159.6	-65.3	-170.8	-153.4	0	0	104.8	F22 V26	F22-M24 PolarHBondContact O-N 2.9Å; F22-M24 VanDerWaalsContact O-N 3.08Å; M24-V26 PolarHBondContact O-N 2.82Å
25	V	37.3	Very low	50	Low	133 Å²	133	109.4 Å²	109.4	81%	0.806	67%	0.666	S	S	*	*			trans	-61.8	100	158.1	171	0	0	0	0	103.8	G23 S27	G23-V25 PolarHBondContact O-N 2.88Å; V25-S27 VanDerWaalsContact C-N 3.26Å; V25-S27 PolarHBondContact O-N 2.92Å
26	V	37.6	Very low	52.1	Low	127 Å²	127	107.5 Å²	107.5	77%	0.77	66%	0.658	S	S	*	*			trans	-57.5	106.7	154.5	174.2	0	0	0	0	103.3	M24 E28	M24-V26 PolarHBondContact O-N 2.82Å; V26-E28 PolarHBondContact O-N 3.14Å
27	S	38.3	Very low	54.4	Low	91 Å²	91	101.7 Å²	101.7	64%	0.636	63%	0.627	S	S	*	*			trans	-59.8	100.6	167.2	179.9	0	0	0	0	105.1	V25 Q29	V25-S27 VanDerWaalsContact C-N 3.26Å; V25-S27 PolarHBondContact O-N 2.92Å; S27-Q29 PolarHBondContact O-N 3.44Å
28	E	40.7	Very low	56.5	Low	172 Å²	172	101.5 Å²	101.5	80%	0.804	63%	0.626	S	S	*	*			trans	-60.4	93.6	163.9	-167.1	168.3	-164.8	0	0	104.8	V26 T30	V26-E28 PolarHBondContact O-N 3.14Å; E28-T30 VanDerWaalsContact C-N 3.31Å; E28-T30 PolarHBondContact O-N 2.84Å
29	Q	44.6	Very low	58.3	Low	106 Å²	106	96.2 Å²	96.2	50%	0.495	59%	0.594	S	S	.	*			trans	-58.3	104.8	171.7	-83.4	177	-12.8	0	0	104.8	S27 G31 N98	S27-Q29 PolarHBondContact O-N 3.44Å; Q29-G31 PolarHBondContact O-N 3.15Å; Q29-N98 PolarHBondContact OE1-ND2 3.31Å
30	T	41.3	Very low	60	Low	136 Å²	136	95.2 Å²	95.2	83%	0.834	58%	0.58	S	S	*	*			trans	-63.4	86.8	172.8	45	0	0	0	0	107.2	E28	E28-T30 VanDerWaalsContact C-N 3.31Å; E28-T30 PolarHBondContact O-N 2.84Å
31	G	53.3	Low	61.6	Low	43 Å²	43	96.4 Å²	96.4	44%	0.443	58%	0.578	S	S	.	*	P	Polyproline II helix	trans	-53.7	138.5	166.3	0	0	0	0	0	108.3	Q29	Q29-G31 PolarHBondContact O-N 3.15Å
32	G	60.7	Low	62.9	Low	15 Å²	15	95.6 Å²	95.6	16%	0.155	56%	0.556	C	S	.	*	P	Polyproline II helix	trans	-53	143.6	179.6	0	0	0	0	0	112.1	C34 D94	G32-C34 PolarHBondContact O-N 2.88Å; G32-C34 VanDerWaalsContact O-N 3.17Å; G32-D94 WeakPolarHBondContact CA-O 3.19Å
33	V	78.4	Confident	64.5	Low	107 Å²	107	86.5 Å²	86.5	65%	0.648	52%	0.516	S	S	*	.	P	Polyproline II helix	trans	-63.1	119.6	176.7	178.4	0	0	0	0	108.7	D94	V33-D94 HydrophobicContact CB-CB 4.14Å
34	C	87.1	Confident	66.4	Low	34 Å²	34	84.1 Å²	84.1	23%	0.23	49%	0.488	C	S	.	.	P	Polyproline II helix	trans	-87.6	120.6	-176.5	-76.9	0	0	0	0	111.6	G32 C232	G32-C34 PolarHBondContact O-N 2.88Å; G32-C34 VanDerWaalsContact O-N 3.17Å; C34-C232 HydrophobicContact CB-CB 3.53Å; C34-C232 WeakPolarHBondContact CB-SG 3.25Å; C34-C232 WeakPolarHBondContact SG-CB 3.44Å; C34-C232 CovalentContact SG-SG 2.01Å; C34-C232 PolarHBondContact SG-SG 3.06Å
35	P	93	Very high	67.7	Low	56 Å²	56	77 Å²	77	36%	0.364	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-74.3	155.5	-178.8	28.8	-30.5	0	0	0	111	T55 G56 F57	P35-T55 CarbonylContact O-C 3.57Å; P35-T55 WeakPolarHBondContact O-CA 2.93Å; P35-T55 VanDerWaalsContact O-CB 3.25Å; P35-T55 WeakPolarHBondContact O-CB 3.4Å; P35-G56 WeakPolarHBondContact CG-O 3.45Å; P35-G56 PolarHBondContact O-N 3.26Å; P35-F57 HydrophobicContact CG-CD1 4.01Å; P35-F57 HydrophobicContact CG-CE1 3.69Å; P35-F57 HydrophobicContact CG-CZ 4.15Å
36	S	91.8	Very high	69.2	Low	82 Å²	82	75.2 Å²	75.2	57%	0.573	44%	0.442	S	S	*	.	B	Isolated β-bridge	trans	-64.2	136.2	172.6	-158.4	0	0	0	0	110.2
37	L	91.3	Very high	70.6	Confident	17 Å²	17	73 Å²	73	9%	0.089	43%	0.429	C	S	.	.			trans	-119.6	124.6	178.9	-180	66.9	0	0	0	109.2	V39 I54 D58 Y231	L37-V39 HydrophobicContact CD2-CG1 3.91Å; L37-V39 HydrophobicContact CG-CG1 3.88Å; L37-I54 HydrophobicContact CB-CG2 4.34Å; L37-I54 HydrophobicContact CD2-CG2 4.43Å; L37-I54 PolarHBondContact N-O 3.08Å; L37-D58 HydrophobicContact CD1-CB 3.91Å; L37-Y231 HydrophobicContact CD2-CD1 3.87Å; L37-Y231 HydrophobicContact CD2-CE1 3.65Å
38	S	85.9	Confident	72	Confident	117 Å²	117	70.6 Å²	70.6	82%	0.818	41%	0.408	S	S	*	.			trans	-87.5	125	172.7	-172.5	0	0	0	0	109.1
39	V	84	Confident	73	Confident	21 Å²	21	68.4 Å²	68.4	13%	0.127	40%	0.402	C	S	.	.			trans	-133.5	160.4	175.9	-62.7	0	0	0	0	108.9	L37 D41 F44 I54 L229 Y231	L37-V39 HydrophobicContact CD2-CG1 3.91Å; L37-V39 HydrophobicContact CG-CG1 3.88Å; V39-D41 PolarHBondContact O-N 3.22Å; V39-F44 HydrophobicContact CG2-CD2 4.44Å; V39-F44 HydrophobicContact CG2-CE2 3.83Å; V39-I54 HydrophobicContact CG2-CB 4.48Å; V39-I54 HydrophobicContact CG2-CD1 3.34Å; V39-I54 HydrophobicContact CG2-CG1 4.48Å; V39-I54 HydrophobicContact CG2-CG2 4.26Å; V39-L229 HydrophobicContact CG1-CD1 4.02Å; V39-Y231 HydrophobicContact CG1-CE1 4.09Å
40	E	81.3	Confident	73.6	Confident	89 Å²	89	73.5 Å²	73.5	42%	0.416	42%	0.417	S	S	.	.			trans	-67.1	132.3	180	-59.4	81.5	-175.5	0	0	111.8	Y42 R43	E40-Y42 HydrophobicContact CB-CD1 3.58Å; E40-Y42 HydrophobicContact CB-CE1 3.18Å; E40-Y42 HydrophobicContact CB-CG 4.43Å; E40-Y42 HydrophobicContact CG-CD1 4.45Å; E40-Y42 HydrophobicContact CG-CE1 3.65Å; E40-Y42 PolarHBondContact O-N 2.84Å; E40-Y42 VanDerWaalsContact O-N 3.08Å; E40-R43 WeakPolarHBondContact O-CB 3.47Å; E40-R43 WeakPolarHBondContact O-CG 3.33Å; E40-R43 PolarHBondContact O-N 3.44Å; E40-R43 VanDerWaalsContact O-N 3.07Å; E40-R43 IonicContact OE2-CZ 2.9Å; E40-R43 VanDerWaalsContact OE2-CZ 3.24Å; E40-R43 IonicContact OE2-NE 3.66Å; E40-R43 PolarHBondContact OE2-NE 3.36Å; E40-R43 IonicContact OE2-NH2 3.71Å; E40-R43 PolarHBondContact OE2-NH2 3.48Å
41	D	72	Confident	74.2	Confident	146 Å²	146	73 Å²	73	78%	0.781	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-56	-31.6	-173.9	-63.3	-34.3	0	0	0	113.8	V39 R43	V39-D41 PolarHBondContact O-N 3.22Å; D41-R43 PolarHBondContact O-N 2.92Å
42	Y	72.8	Confident	74.9	Confident	75 Å²	75	75.3 Å²	75.3	29%	0.294	42%	0.418	S	S	.	.	G	3₁₀ helix	trans	-65.3	-21.2	-177.8	66	-101.1	0	0	0	113	E40 F44 S45 N241 C243 E244	E40-Y42 HydrophobicContact CB-CD1 3.58Å; E40-Y42 HydrophobicContact CB-CE1 3.18Å; E40-Y42 HydrophobicContact CB-CG 4.43Å; E40-Y42 HydrophobicContact CG-CD1 4.45Å; E40-Y42 HydrophobicContact CG-CE1 3.65Å; E40-Y42 PolarHBondContact O-N 2.84Å; E40-Y42 VanDerWaalsContact O-N 3.08Å; Y42-F44 PolarHBondContact O-N 2.94Å; Y42-F44 VanDerWaalsContact O-N 3.12Å; Y42-S45 PolarHBondContact O-N 3.39Å; Y42-S45 PolarHBondContact O-OG 2.76Å; Y42-N241 VanDerWaalsContact O-CG 3.31Å; Y42-N241 PolarHBondContact O-ND2 2.7Å; Y42-N241 PolarHBondContact O-OD1 3.13Å; Y42-N241 VanDerWaalsContact O-OD1 3.09Å; Y42-C243 HydrophobicContact CD2-CB 3.98Å; Y42-C243 HydrophobicContact CE2-CB 4.4Å; Y42-E244 HydrophobicContact CE2-CB 4.19Å
43	R	79.9	Confident	76	Confident	11 Å²	11	81.9 Å²	81.9	4%	0.042	44%	0.444	C	S	.	.	G	3₁₀ helix	trans	-62.2	-23.1	-176.2	-69.8	-174.9	-173.7	-140.3	6.1	114.3	E40 D41 Q227 L229 E240 N241	E40-R43 WeakPolarHBondContact O-CB 3.47Å; E40-R43 WeakPolarHBondContact O-CG 3.33Å; E40-R43 PolarHBondContact O-N 3.44Å; E40-R43 VanDerWaalsContact O-N 3.07Å; E40-R43 IonicContact OE2-CZ 2.9Å; E40-R43 VanDerWaalsContact OE2-CZ 3.24Å; E40-R43 IonicContact OE2-NE 3.66Å; E40-R43 PolarHBondContact OE2-NE 3.36Å; E40-R43 IonicContact OE2-NH2 3.71Å; E40-R43 PolarHBondContact OE2-NH2 3.48Å; D41-R43 PolarHBondContact O-N 2.92Å; R43-Q227 VanDerWaalsContact CZ-NE2 3.28Å; R43-Q227 VanDerWaalsContact NH1-CD 3.25Å; R43-Q227 VanDerWaalsContact NH2-NE2 3.12Å; R43-L229 VanDerWaalsContact NH1-CD1 3.3Å; R43-E240 IonicContact NH1-OE1 2.68Å; R43-E240 IonicContact NH1-OE2 4Å; R43-E240 WeakPolarHBondContact O-CA 3.43Å; R43-N241 WeakPolarHBondContact CA-OD1 3.28Å; R43-N241 VanDerWaalsContact O-CG 3.31Å; R43-N241 PolarHBondContact O-N 3.08Å; R43-N241 PolarHBondContact O-OD1 3.07Å
44	F	79.7	Confident	76.6	Confident	9 Å²	9	77.7 Å²	77.7	4%	0.039	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	-124.8	14	-177.2	-56.2	-82.3	0	0	0	112	V39 Y42 D46 V47 L48 I54 Y231 M236 M239 E240	V39-F44 HydrophobicContact CG2-CD2 4.44Å; V39-F44 HydrophobicContact CG2-CE2 3.83Å; Y42-F44 PolarHBondContact O-N 2.94Å; Y42-F44 VanDerWaalsContact O-N 3.12Å; F44-D46 PolarHBondContact O-N 3.09Å; F44-D46 VanDerWaalsContact O-N 3.07Å; F44-V47 PolarHBondContact O-N 2.92Å; F44-V47 VanDerWaalsContact O-N 3.08Å; F44-L48 HydrophobicContact CB-CB 4.26Å; F44-L48 HydrophobicContact CB-CD1 3.69Å; F44-L48 HydrophobicContact CB-CG 4.02Å; F44-L48 HydrophobicContact CD1-CD1 4.33Å; F44-L48 HydrophobicContact CG-CD1 4.04Å; F44-L48 PolarHBondContact O-N 3.08Å; F44-I54 HydrophobicContact CD2-CD1 3.67Å; F44-I54 HydrophobicContact CE2-CD1 3.47Å; F44-I54 VanDerWaalsContact CE2-CD1 3.47Å; F44-I54 HydrophobicContact CZ-CD1 4.21Å; F44-Y231 HydrophobicContact CZ-CE1 4.39Å; F44-M236 HydrophobicContact CE1-CB 4.44Å; F44-M236 HydrophobicContact CE1-SD 3.77Å; F44-M236 HydrophobicContact CZ-SD 4Å; F44-M239 HydrophobicContact CD1-CB 3.99Å; F44-M239 HydrophobicContact CE1-CB 4.23Å; F44-E240 HydrophobicContact CD1-CG 4.45Å; F44-E240 HydrophobicContact CE1-CB 4.5Å; F44-E240 HydrophobicContact CE1-CG 3.62Å; F44-E240 HydrophobicContact CE2-CG 4.44Å; F44-E240 HydrophobicContact CZ-CG 3.62Å
45	S	71	Confident	76.9	Confident	30 Å²	30	78 Å²	78	21%	0.21	42%	0.419	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-22.6	-173.4	58.7	0	0	0	0	114.3	Y42 N241	Y42-S45 PolarHBondContact O-N 3.39Å; Y42-S45 PolarHBondContact O-OG 2.76Å; S45-N241 PolarHBondContact OG-ND2 2.82Å; S45-N241 VanDerWaalsContact OG-ND2 3.13Å
46	D	68.4	Low	77.1	Confident	95 Å²	95	75.4 Å²	75.4	51%	0.508	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-18.5	-177.6	-56.8	-28.9	0	0	0	112.5	F44 N241	F44-D46 PolarHBondContact O-N 3.09Å; F44-D46 VanDerWaalsContact O-N 3.07Å; D46-N241 WeakPolarHBondContact OD2-CB 3.32Å; D46-N241 PolarHBondContact OD2-ND2 3.02Å
47	V	67.6	Low	77.3	Confident	82 Å²	82	71.9 Å²	71.9	50%	0.497	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.9	-36.6	-170.4	-175.4	0	0	0	0	112.4	F44 M239	F44-V47 PolarHBondContact O-N 2.92Å; F44-V47 VanDerWaalsContact O-N 3.08Å; V47-M239 HydrophobicContact CG1-CB 4.37Å; V47-M239 HydrophobicContact CG1-CG 4.07Å; V47-M239 HydrophobicContact CG1-SD 4.02Å; V47-M239 HydrophobicContact CG2-CB 4.47Å
48	L	67.4	Low	77.5	Confident	40 Å²	40	73.2 Å²	73.2	21%	0.209	38%	0.384	C	S	.	.			trans	-106.8	116	-173.5	-61	179.6	0	0	0	111.7	F44 R50 L52	F44-L48 HydrophobicContact CB-CB 4.26Å; F44-L48 HydrophobicContact CB-CD1 3.69Å; F44-L48 HydrophobicContact CB-CG 4.02Å; F44-L48 HydrophobicContact CD1-CD1 4.33Å; F44-L48 HydrophobicContact CG-CD1 4.04Å; F44-L48 PolarHBondContact O-N 3.08Å; L48-R50 VanDerWaalsContact C-N 3.3Å; L48-R50 PolarHBondContact O-N 2.58Å; L48-L52 HydrophobicContact CD1-CB 4.17Å; L48-L52 HydrophobicContact CD1-CD1 3.66Å; L48-L52 HydrophobicContact CD1-CG 4.04Å; L48-L52 HydrophobicContact CD2-CD1 3.39Å; L48-L52 HydrophobicContact CD2-CG 4.05Å; L48-L52 HydrophobicContact CG-CD1 4.19Å
49	D	60.7	Low	78.1	Confident	126 Å²	126	67.6 Å²	67.6	67%	0.674	35%	0.345	S	S	*	.	S	Bend	trans	-77.6	-11.3	176.3	-98.3	-26.2	0	0	0	114.1	R256	D49-R256 IonicContact OD1-CZ 3.96Å; D49-R256 VanDerWaalsContact OD1-CZ 3.23Å; D49-R256 IonicContact OD1-NH1 3.69Å; D49-R256 PolarHBondContact OD1-NH1 2.79Å; D49-R256 IonicContact OD1-NH2 2.98Å; D49-R256 PolarHBondContact OD1-NH2 2.69Å
50	R	57.2	Low	78.7	Confident	212 Å²	212	67.1 Å²	67.1	80%	0.8	34%	0.342	S	S	*	.	S	Bend	trans	-150.6	153.7	-178.6	-66.9	-171.2	-173.2	-148.3	0.8	110.2	L48 L52	L48-R50 VanDerWaalsContact C-N 3.3Å; L48-R50 PolarHBondContact O-N 2.58Å; R50-L52 PolarHBondContact O-N 3.25Å
51	P	55.9	Low	79.3	Confident	126 Å²	126	69.1 Å²	69.1	82%	0.818	35%	0.352	S	S	*	.			trans	-67.3	107.4	-177.5	26.5	-32.5	0	0	0	110
52	L	68	Low	80.4	Confident	92 Å²	92	66.2 Å²	66.2	48%	0.482	33%	0.332	S	S	.	.			trans	-64.9	141.4	158.8	-74.4	175.4	0	0	0	107.6	L48 R50 I54	L48-L52 HydrophobicContact CD1-CB 4.17Å; L48-L52 HydrophobicContact CD1-CD1 3.66Å; L48-L52 HydrophobicContact CD1-CG 4.04Å; L48-L52 HydrophobicContact CD2-CD1 3.39Å; L48-L52 HydrophobicContact CD2-CG 4.05Å; L48-L52 HydrophobicContact CG-CD1 4.19Å; R50-L52 PolarHBondContact O-N 3.25Å; L52-I54 VanDerWaalsContact C-N 3.34Å; L52-I54 PolarHBondContact O-N 2.82Å
53	Q	83.4	Confident	81.5	Confident	152 Å²	152	63.1 Å²	63.1	71%	0.71	32%	0.32	S	S	*	.			trans	-68.5	99.6	167.9	-175.6	172.5	22.7	0	0	107.9	T55	Q53-T55 HydrophobicContact CG-CG2 4.43Å
54	I	90.4	Very high	82.2	Confident	20 Å²	20	63.4 Å²	63.4	10%	0.103	32%	0.322	C	S	.	.			trans	-75	132.5	178.1	-63.5	172.4	0	0	0	107.9	L37 V39 F44 L52 Y231	L37-I54 HydrophobicContact CB-CG2 4.34Å; L37-I54 HydrophobicContact CD2-CG2 4.43Å; L37-I54 PolarHBondContact N-O 3.08Å; V39-I54 HydrophobicContact CG2-CB 4.48Å; V39-I54 HydrophobicContact CG2-CD1 3.34Å; V39-I54 HydrophobicContact CG2-CG1 4.48Å; V39-I54 HydrophobicContact CG2-CG2 4.26Å; F44-I54 HydrophobicContact CD2-CD1 3.67Å; F44-I54 HydrophobicContact CE2-CD1 3.47Å; F44-I54 VanDerWaalsContact CE2-CD1 3.47Å; F44-I54 HydrophobicContact CZ-CD1 4.21Å; L52-I54 VanDerWaalsContact C-N 3.34Å; L52-I54 PolarHBondContact O-N 2.82Å; I54-Y231 HydrophobicContact CG2-CD1 3.55Å; I54-Y231 HydrophobicContact CG2-CE1 3.51Å
55	T	94.1	Very high	82.4	Confident	39 Å²	39	69.2 Å²	69.2	24%	0.239	35%	0.353	C	S	.	.	B	Isolated β-bridge	trans	-125	144.9	-179.5	59.8	0	0	0	0	110.4	P35 Q53 Y231 C232	P35-T55 CarbonylContact O-C 3.57Å; P35-T55 WeakPolarHBondContact O-CA 2.93Å; P35-T55 VanDerWaalsContact O-CB 3.25Å; P35-T55 WeakPolarHBondContact O-CB 3.4Å; Q53-T55 HydrophobicContact CG-CG2 4.43Å; T55-Y231 WeakPolarHBondContact O-CA 3.22Å; T55-C232 PolarHBondContact O-N 3.29Å
56	G	95.9	Very high	83.2	Confident	3 Å²	3	74.2 Å²	74.2	3%	0.031	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	156.6	-168.7	-173.6	0	0	0	0	0	114.2	P35 I230	P35-G56 WeakPolarHBondContact CG-O 3.45Å; P35-G56 PolarHBondContact O-N 3.26Å; G56-I230 CarbonylContact C-O 3.6Å; G56-I230 WeakPolarHBondContact CA-O 3.36Å
57	F	96.5	Very high	83.8	Confident	7 Å²	7	79.2 Å²	79.2	3%	0.031	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	123.7	-173.4	-54.3	-90	0	0	0	109.9	P35 L59 I91 F92 L96 I230	P35-F57 HydrophobicContact CG-CD1 4.01Å; P35-F57 HydrophobicContact CG-CE1 3.69Å; P35-F57 HydrophobicContact CG-CZ 4.15Å; F57-L59 HydrophobicContact CB-CD1 3.7Å; F57-L59 PolarHBondContact O-N 2.81Å; F57-I91 VanDerWaalsContact CD1-O 3.24Å; F57-I91 WeakPolarHBondContact CD1-O 3.32Å; F57-F92 HydrophobicContact CB-CE1 4.15Å; F57-F92 AromaticContact CD1-CD1 3.87Å; F57-F92 HydrophobicContact CD1-CD1 3.87Å; F57-F92 HydrophobicContact CD1-CE1 4.27Å; F57-F92 AromaticContact CD2-CD1 3.74Å; F57-F92 HydrophobicContact CD2-CD1 3.74Å; F57-F92 AromaticContact CD2-CE1 3.72Å; F57-F92 HydrophobicContact CD2-CE1 3.72Å; F57-F92 AromaticContact CE1-CD1 3.88Å; F57-F92 HydrophobicContact CE1-CD1 3.88Å; F57-F92 AromaticContact CE2-CD1 3.76Å; F57-F92 HydrophobicContact CE2-CD1 3.76Å; F57-F92 HydrophobicContact CE2-CE1 4.17Å; F57-F92 AromaticContact CG-CD1 3.8Å; F57-F92 HydrophobicContact CG-CD1 3.8Å; F57-F92 AromaticContact CG-CE1 3.78Å; F57-F92 HydrophobicContact CG-CE1 3.78Å; F57-F92 AromaticContact CZ-CD1 3.83Å; F57-F92 HydrophobicContact CZ-CD1 3.83Å; F57-L96 HydrophobicContact CE2-CD1 4.38Å; F57-I230 HydrophobicContact CD2-CG2 4.36Å; F57-I230 PolarHBondContact N-O 3.08Å; F57-I230 PolarHBondContact O-N 3.32Å
58	D	96.3	Very high	84.4	Confident	45 Å²	45	76 Å²	76	24%	0.241	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	95.4	167.9	-171.7	-15	0	0	0	109.9	L37 T60 E61 K62 L229	L37-D58 HydrophobicContact CD1-CB 3.91Å; D58-T60 PolarHBondContact O-N 3.26Å; D58-T60 VanDerWaalsContact OD1-CA 3.27Å; D58-T60 WeakPolarHBondContact OD1-CA 3.49Å; D58-T60 WeakPolarHBondContact OD1-CB 3.36Å; D58-T60 PolarHBondContact OD1-N 2.67Å; D58-T60 PolarHBondContact OD1-OG1 3.29Å; D58-E61 HydrophobicContact CB-CB 4.09Å; D58-E61 PolarHBondContact O-N 2.86Å; D58-E61 PolarHBondContact OD1-N 2.85Å; D58-K62 WeakPolarHBondContact O-CB 3.48Å; D58-K62 WeakPolarHBondContact O-CG 3.34Å; D58-K62 PolarHBondContact O-N 2.79Å; D58-L229 HydrophobicContact CB-CD2 3.86Å
59	L	97.5	Very high	85	Confident	0 Å²	0	78.6 Å²	78.6	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-68.8	-26.7	177.7	-87.8	63.1	0	0	0	111	F57 K62 F63 I91 F92 W120 I211 I228 I230	F57-L59 HydrophobicContact CB-CD1 3.7Å; F57-L59 PolarHBondContact O-N 2.81Å; L59-K62 PolarHBondContact O-N 3Å; L59-F63 HydrophobicContact CB-CD2 4.23Å; L59-F63 HydrophobicContact CB-CE2 4.49Å; L59-F63 HydrophobicContact CD2-CE2 4.42Å; L59-F63 HydrophobicContact CG-CD2 4.48Å; L59-F63 HydrophobicContact CG-CE2 4.29Å; L59-F63 WeakPolarHBondContact O-CB 3.34Å; L59-F63 VanDerWaalsContact O-CD2 3.29Å; L59-F63 WeakPolarHBondContact O-CD2 3.43Å; L59-F63 PolarHBondContact O-N 2.84Å; L59-I91 HydrophobicContact CD1-CG2 4.1Å; L59-I91 HydrophobicContact CG-CG2 4.25Å; L59-F92 HydrophobicContact CD1-CE1 4.32Å; L59-F92 HydrophobicContact CD1-CZ 4.21Å; L59-W120 HydrophobicContact CD2-CG 4.39Å; L59-I211 HydrophobicContact CD2-CG2 4.43Å; L59-I228 HydrophobicContact CB-CB 4.4Å; L59-I228 HydrophobicContact CB-CG1 4.21Å; L59-I228 HydrophobicContact CB-CG2 3.63Å; L59-I228 WeakPolarHBondContact CB-O 3.44Å; L59-I228 HydrophobicContact CD2-CD1 4.17Å; L59-I228 HydrophobicContact CD2-CG1 4.26Å; L59-I228 PolarHBondContact N-O 2.74Å; L59-I230 HydrophobicContact CD1-CB 4.33Å; L59-I230 HydrophobicContact CD1-CD1 3.88Å; L59-I230 HydrophobicContact CD1-CG1 4.02Å; L59-I230 HydrophobicContact CD2-CD1 3.82Å; L59-I230 HydrophobicContact CD2-CG1 4.32Å
60	T	96	Very high	85.9	Confident	10 Å²	10	77.5 Å²	77.5	6%	0.061	38%	0.384	C	S	.	.	H	α-helix	trans	-59	-53.8	174.6	-33.5	0	0	0	0	110.3	D58 F63 L64 F77 Q227 I228	D58-T60 PolarHBondContact O-N 3.26Å; D58-T60 VanDerWaalsContact OD1-CA 3.27Å; D58-T60 WeakPolarHBondContact OD1-CA 3.49Å; D58-T60 WeakPolarHBondContact OD1-CB 3.36Å; D58-T60 PolarHBondContact OD1-N 2.67Å; D58-T60 PolarHBondContact OD1-OG1 3.29Å; T60-F63 PolarHBondContact O-N 2.66Å; T60-L64 HydrophobicContact CG2-CD1 3.88Å; T60-L64 VanDerWaalsContact O-CB 3.32Å; T60-L64 WeakPolarHBondContact O-CB 3.45Å; T60-L64 WeakPolarHBondContact O-CG 3.41Å; T60-L64 PolarHBondContact O-N 2.76Å; T60-F77 HydrophobicContact CG2-CD2 3.97Å; T60-F77 HydrophobicContact CG2-CE2 3.6Å; T60-F77 HydrophobicContact CG2-CZ 4.25Å; T60-Q227 WeakPolarHBondContact OG1-CA 3.27Å; T60-I228 PolarHBondContact N-O 2.83Å; T60-I228 PolarHBondContact OG1-N 3.39Å; T60-I228 PolarHBondContact OG1-O 3.41Å
61	E	93.9	Very high	86.4	Confident	131 Å²	131	69.7 Å²	69.7	61%	0.612	36%	0.36	S	S	*	.	H	α-helix	trans	-61.3	-49.5	177.1	-171.1	-170.9	172.7	0	0	110.2	D58 F63 L65	D58-E61 HydrophobicContact CB-CB 4.09Å; D58-E61 PolarHBondContact O-N 2.86Å; D58-E61 PolarHBondContact OD1-N 2.85Å; E61-F63 VanDerWaalsContact C-N 3.31Å; E61-F63 PolarHBondContact O-N 2.88Å; E61-L65 VanDerWaalsContact O-CD2 3.28Å; E61-L65 WeakPolarHBondContact O-CD2 3.47Å; E61-L65 PolarHBondContact O-N 3.21Å
62	K	95.7	Very high	87	Confident	86 Å²	86	67.6 Å²	67.6	37%	0.374	34%	0.339	S	S	.	.	H	α-helix	trans	-59.7	-37.4	-177.2	-68.6	-71.2	-179.6	-176.5	0	112.6	D58 L59 K86 I91	D58-K62 WeakPolarHBondContact O-CB 3.48Å; D58-K62 WeakPolarHBondContact O-CG 3.34Å; D58-K62 PolarHBondContact O-N 2.79Å; L59-K62 PolarHBondContact O-N 3Å; K62-K86 VanDerWaalsContact O-CE 3.23Å; K62-K86 WeakPolarHBondContact O-CE 3.46Å; K62-K86 PolarHBondContact O-NZ 2.85Å; K62-I91 HydrophobicContact CG-CG2 4.49Å
63	F	96.6	Very high	87.2	Confident	10 Å²	10	68.9 Å²	68.9	4%	0.044	35%	0.346	C	S	.	.	H	α-helix	trans	-89.3	-43	-177.9	-82.9	-77.8	0	0	0	113.8	L59 T60 E61 L84 K86 I91 T209 I211	L59-F63 HydrophobicContact CB-CD2 4.23Å; L59-F63 HydrophobicContact CB-CE2 4.49Å; L59-F63 HydrophobicContact CD2-CE2 4.42Å; L59-F63 HydrophobicContact CG-CD2 4.48Å; L59-F63 HydrophobicContact CG-CE2 4.29Å; L59-F63 WeakPolarHBondContact O-CB 3.34Å; L59-F63 VanDerWaalsContact O-CD2 3.29Å; L59-F63 WeakPolarHBondContact O-CD2 3.43Å; L59-F63 PolarHBondContact O-N 2.84Å; T60-F63 PolarHBondContact O-N 2.66Å; E61-F63 VanDerWaalsContact C-N 3.31Å; E61-F63 PolarHBondContact O-N 2.88Å; F63-L84 HydrophobicContact CD1-CB 3.87Å; F63-L84 HydrophobicContact CE1-CB 4.36Å; F63-L84 VanDerWaalsContact CE1-O 3.24Å; F63-L84 WeakPolarHBondContact CE1-O 3.32Å; F63-K86 HydrophobicContact CD1-CD 4.22Å; F63-K86 HydrophobicContact CD1-CG 4.08Å; F63-K86 HydrophobicContact CE1-CB 4.17Å; F63-K86 HydrophobicContact CE1-CD 4.39Å; F63-K86 HydrophobicContact CE1-CG 3.89Å; F63-I91 HydrophobicContact CD2-CD1 4.27Å; F63-I91 HydrophobicContact CE1-CD1 4.18Å; F63-I91 HydrophobicContact CE2-CD1 3.36Å; F63-I91 HydrophobicContact CZ-CD1 3.3Å; F63-T209 HydrophobicContact CE2-CG2 4.48Å; F63-T209 HydrophobicContact CZ-CG2 4.14Å; F63-I211 HydrophobicContact CB-CD1 3.82Å; F63-I211 HydrophobicContact CB-CG1 4.5Å; F63-I211 HydrophobicContact CD1-CD1 4.39Å; F63-I211 HydrophobicContact CD1-CG1 4.18Å; F63-I211 HydrophobicContact CD2-CD1 3.69Å; F63-I211 HydrophobicContact CD2-CG1 4Å; F63-I211 HydrophobicContact CD2-CG2 4.1Å; F63-I211 HydrophobicContact CE1-CG1 4.39Å; F63-I211 HydrophobicContact CE2-CD1 4.34Å; F63-I211 HydrophobicContact CE2-CG1 4.22Å; F63-I211 HydrophobicContact CE2-CG2 3.7Å; F63-I211 HydrophobicContact CG-CD1 3.71Å; F63-I211 HydrophobicContact CG-CG1 3.97Å; F63-I211 HydrophobicContact CZ-CG1 4.4Å; F63-I211 HydrophobicContact CZ-CG2 4.15Å
64	L	93.8	Very high	87	Confident	17 Å²	17	63.2 Å²	63.2	9%	0.089	32%	0.321	C	S	.	.	H	α-helix	trans	-92.2	-27.8	-163.2	-55.3	-175.4	0	0	0	113.5	T60 R66 F77 L79 L84 L225	T60-L64 HydrophobicContact CG2-CD1 3.88Å; T60-L64 VanDerWaalsContact O-CB 3.32Å; T60-L64 WeakPolarHBondContact O-CB 3.45Å; T60-L64 WeakPolarHBondContact O-CG 3.41Å; T60-L64 PolarHBondContact O-N 2.76Å; L64-R66 HydrophobicContact CB-CG 4.41Å; L64-R66 WeakPolarHBondContact O-CB 3.34Å; L64-R66 WeakPolarHBondContact O-CG 3.44Å; L64-R66 PolarHBondContact O-N 2.89Å; L64-F77 HydrophobicContact CB-CD1 4.21Å; L64-F77 HydrophobicContact CB-CE1 4.18Å; L64-F77 HydrophobicContact CD1-CB 3.52Å; L64-F77 HydrophobicContact CD1-CD1 3.48Å; L64-F77 VanDerWaalsContact CD1-CD1 3.48Å; L64-F77 HydrophobicContact CD1-CD2 3.64Å; L64-F77 HydrophobicContact CD1-CE1 3.98Å; L64-F77 HydrophobicContact CD1-CE2 4.16Å; L64-F77 HydrophobicContact CD1-CG 3.26Å; L64-F77 HydrophobicContact CD1-CZ 4.3Å; L64-F77 HydrophobicContact CG-CD1 4.46Å; L64-L79 HydrophobicContact CD1-CD2 4.1Å; L64-L79 HydrophobicContact CD2-CD2 3.67Å; L64-L84 HydrophobicContact CD2-CD1 3.78Å; L64-L84 HydrophobicContact CD2-CD2 3.94Å; L64-L225 HydrophobicContact CD1-CD2 4.36Å
65	L	85.2	Confident	86.8	Confident	131 Å²	131	65.2 Å²	65.2	69%	0.686	34%	0.335	S	S	*	.			trans	43	31.2	174.4	-59.5	176.8	0	0	0	114.5	E61	E61-L65 VanDerWaalsContact O-CD2 3.28Å; E61-L65 WeakPolarHBondContact O-CD2 3.47Å; E61-L65 PolarHBondContact O-N 3.21Å
66	R	85.8	Confident	86.8	Confident	134 Å²	134	63.7 Å²	63.7	51%	0.506	33%	0.326	S	S	.	.	S	Bend	trans	-144.2	160.6	-177.9	71.8	-175.5	174.2	141.6	-3.6	109.3	L64 F77 R78	L64-R66 HydrophobicContact CB-CG 4.41Å; L64-R66 WeakPolarHBondContact O-CB 3.34Å; L64-R66 WeakPolarHBondContact O-CG 3.44Å; L64-R66 PolarHBondContact O-N 2.89Å; R66-F77 HydrophobicContact CG-CD1 4.1Å; R66-F77 HydrophobicContact CG-CE1 3.88Å; R66-F77 VanDerWaalsContact O-CE1 3.25Å; R66-F77 WeakPolarHBondContact O-CE1 3.18Å; R66-R78 PolarHBondContact NH2-O 3.05Å
67	K	82.2	Confident	86.8	Confident	200 Å²	200	64.5 Å²	64.5	87%	0.87	33%	0.329	S	S	*	.	P	Polyproline II helix	trans	-75.4	136	170.8	-66.6	-173.1	177.4	-176	0	109.8
68	G	79.2	Confident	86.7	Confident	16 Å²	16	70.6 Å²	70.6	17%	0.165	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-65.8	157	173	0	0	0	0	0	111.2	S76	G68-S76 CarbonylContact C-O 3.59Å; G68-S76 WeakPolarHBondContact CA-O 3.32Å
69	T	80.1	Confident	86.7	Confident	94 Å²	94	69 Å²	69	58%	0.577	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.8	123.6	167.5	-50.6	0	0	0	0	107.7	T71 S76	T69-T71 HydrophobicContact CG2-CG2 4.29Å; T69-T71 PolarHBondContact O-N 3.49Å; T69-S76 PolarHBondContact N-O 2.91Å; T69-S76 PolarHBondContact O-N 2.96Å; T69-S76 PolarHBondContact O-OG 3.22Å
70	V	79.9	Confident	86.6	Confident	103 Å²	103	70.2 Å²	70.2	62%	0.624	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.6	116	178.3	-177.6	0	0	0	0	108.5
71	T	68.7	Low	86.6	Confident	47 Å²	47	74.9 Å²	74.9	29%	0.288	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	131	177.7	50.8	0	0	0	0	106.9	T69 D73 L74 S76	T69-T71 HydrophobicContact CG2-CG2 4.29Å; T69-T71 PolarHBondContact O-N 3.49Å; T71-D73 VanDerWaalsContact C-N 3.27Å; T71-D73 PolarHBondContact O-N 2.98Å; T71-L74 PolarHBondContact N-O 2.91Å; T71-L74 PolarHBondContact O-N 3.42Å; T71-S76 PolarHBondContact OG1-OG 3.35Å
72	E	67.5	Low	86.6	Confident	82 Å²	82	71.4 Å²	71.4	38%	0.383	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.2	43.8	-178.7	-52.5	156.5	-169.6	0	0	111.1	L74 R107 W171 R226	E72-L74 PolarHBondContact O-N 3.17Å; E72-R107 IonicContact OE1-NH1 2.71Å; E72-R107 PolarHBondContact OE1-NH1 3.4Å; E72-W171 PolarHBondContact OE2-NE1 2.98Å; E72-R226 IonicContact OE2-NH2 2.88Å; E72-R226 PolarHBondContact OE2-NH2 2.79Å
73	D	72.1	Confident	86.7	Confident	119 Å²	119	71.5 Å²	71.5	64%	0.636	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.7	-6	-178.4	-50.8	-35.3	0	0	0	117.7	T71 K249	T71-D73 VanDerWaalsContact C-N 3.27Å; T71-D73 PolarHBondContact O-N 2.98Å; D73-K249 IonicContact OD2-NZ 3.42Å; D73-K249 PolarHBondContact OD2-NZ 2.75Å
74	L	79.9	Confident	86.8	Confident	34 Å²	34	72.1 Å²	72.1	18%	0.178	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	143.8	-178.7	-69.2	169.9	0	0	0	111.4	T71 E72 S76 E244	T71-L74 PolarHBondContact N-O 2.91Å; T71-L74 PolarHBondContact O-N 3.42Å; E72-L74 PolarHBondContact O-N 3.17Å; L74-S76 PolarHBondContact O-N 3.09Å; L74-E244 HydrophobicContact CD1-CB 3.82Å
75	P	86.6	Confident	87	Confident	61 Å²	61	74 Å²	74	40%	0.396	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	130.8	174.6	27.5	-32.5	0	0	0	110.1
76	S	93.3	Very high	87.6	Confident	8 Å²	8	70.3 Å²	70.3	6%	0.056	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	156.9	173	72.4	0	0	0	0	111.5	G68 T69 T71 L74 L225	G68-S76 CarbonylContact C-O 3.59Å; G68-S76 WeakPolarHBondContact CA-O 3.32Å; T69-S76 PolarHBondContact N-O 2.91Å; T69-S76 PolarHBondContact O-N 2.96Å; T69-S76 PolarHBondContact O-OG 3.22Å; T71-S76 PolarHBondContact OG1-OG 3.35Å; L74-S76 PolarHBondContact O-N 3.09Å; S76-L225 CarbonylContact C-O 3.59Å
77	F	95.4	Very high	88.2	Confident	20 Å²	20	67.2 Å²	67.2	9%	0.088	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	115.1	-176.4	-59.1	-91	0	0	0	109.5	T60 L64 R66 L79 E224 L225	T60-F77 HydrophobicContact CG2-CD2 3.97Å; T60-F77 HydrophobicContact CG2-CE2 3.6Å; T60-F77 HydrophobicContact CG2-CZ 4.25Å; L64-F77 HydrophobicContact CB-CD1 4.21Å; L64-F77 HydrophobicContact CB-CE1 4.18Å; L64-F77 HydrophobicContact CD1-CB 3.52Å; L64-F77 HydrophobicContact CD1-CD1 3.48Å; L64-F77 VanDerWaalsContact CD1-CD1 3.48Å; L64-F77 HydrophobicContact CD1-CD2 3.64Å; L64-F77 HydrophobicContact CD1-CE1 3.98Å; L64-F77 HydrophobicContact CD1-CE2 4.16Å; L64-F77 HydrophobicContact CD1-CG 3.26Å; L64-F77 HydrophobicContact CD1-CZ 4.3Å; L64-F77 HydrophobicContact CG-CD1 4.46Å; R66-F77 HydrophobicContact CG-CD1 4.1Å; R66-F77 HydrophobicContact CG-CE1 3.88Å; R66-F77 VanDerWaalsContact O-CE1 3.25Å; R66-F77 WeakPolarHBondContact O-CE1 3.18Å; F77-L79 HydrophobicContact CB-CD2 4.01Å; F77-L79 PolarHBondContact O-N 2.94Å; F77-E224 WeakPolarHBondContact O-CA 3.19Å; F77-L225 WeakPolarHBondContact CD2-O 3.11Å; F77-L225 PolarHBondContact N-O 2.96Å; F77-L225 PolarHBondContact O-N 2.93Å
78	R	95.6	Very high	88.9	Confident	135 Å²	135	57.7 Å²	57.7	51%	0.509	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	123.1	166.8	-173.1	169.7	175.1	-159.1	-8.6	109.9	R66 D222 E224	R66-R78 PolarHBondContact NH2-O 3.05Å; R78-D222 IonicContact CZ-OD1 2.85Å; R78-D222 IonicContact NE-OD1 2.75Å; R78-D222 PolarHBondContact NE-OD1 2.82Å; R78-D222 IonicContact NH2-OD1 3.23Å; R78-D222 PolarHBondContact NH2-OD1 2.86Å; R78-D222 IonicContact NH2-OD2 2.96Å; R78-E224 HydrophobicContact CB-CG 4.4Å; R78-E224 HydrophobicContact CG-CG 4.45Å
79	L	96.8	Very high	89.8	Confident	10 Å²	10	63.1 Å²	63.1	5%	0.052	36%	0.355	C	S	.	.			trans	-103.5	-175.8	178.4	-50.9	-169.6	0	0	0	110.5	L64 F77 L84 I223 L225	L64-L79 HydrophobicContact CD1-CD2 4.1Å; L64-L79 HydrophobicContact CD2-CD2 3.67Å; F77-L79 HydrophobicContact CB-CD2 4.01Å; F77-L79 PolarHBondContact O-N 2.94Å; L79-L84 HydrophobicContact CD1-CD1 3.9Å; L79-L84 HydrophobicContact CD2-CD1 4.07Å; L79-L84 HydrophobicContact CG-CD1 4.43Å; L79-I223 HydrophobicContact CB-CG1 4.09Å; L79-I223 HydrophobicContact CD1-CD1 4.19Å; L79-I223 HydrophobicContact CD1-CG1 4.06Å; L79-I223 HydrophobicContact CG-CG1 4.25Å; L79-I223 PolarHBondContact N-O 2.76Å; L79-L225 HydrophobicContact CD1-CB 3.95Å; L79-L225 HydrophobicContact CD1-CD2 3.89Å; L79-L225 HydrophobicContact CG-CB 4.24Å
80	G	95.4	Very high	90.5	Very high	27 Å²	27	61.4 Å²	61.4	28%	0.278	35%	0.346	S	S	.	.			trans	96.7	-6.2	176.7	0	0	0	0	0	115.8	V221	G80-V221 WeakPolarHBondContact CA-O 3.43Å; G80-V221 PolarHBondContact N-O 2.96Å
81	S	94.2	Very high	91.3	Very high	107 Å²	107	56.5 Å²	56.5	75%	0.748	32%	0.317	S	S	*	.	S	Bend	trans	-84.7	-27.5	177.9	56.4	0	0	0	0	114.1
82	S	95.6	Very high	92.6	Very high	59 Å²	59	54.3 Å²	54.3	41%	0.413	30%	0.303	S	S	.	.	S	Bend	trans	-151.3	148.5	-173.7	54.5	0	0	0	0	111.3
83	P	97.3	Very high	93.8	Very high	88 Å²	88	53.3 Å²	53.3	57%	0.571	30%	0.304	S	S	*	.			trans	-59.8	135.8	174	-23.2	34	0	0	0	112.1	I85 P220	P83-I85 HydrophobicContact CB-CG2 4.26Å; P83-P220 HydrophobicContact CB-CG 4.44Å; P83-P220 HydrophobicContact CG-CG 4.01Å; P83-P220 VanDerWaalsContact N-CG 3.35Å
84	L	97.9	Very high	94.7	Very high	22 Å²	22	52.3 Å²	52.3	12%	0.115	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	81.2	176.8	-65.1	173.7	0	0	0	108.4	F63 L64 L79 L210 I211	F63-L84 HydrophobicContact CD1-CB 3.87Å; F63-L84 HydrophobicContact CE1-CB 4.36Å; F63-L84 VanDerWaalsContact CE1-O 3.24Å; F63-L84 WeakPolarHBondContact CE1-O 3.32Å; L64-L84 HydrophobicContact CD2-CD1 3.78Å; L64-L84 HydrophobicContact CD2-CD2 3.94Å; L79-L84 HydrophobicContact CD1-CD1 3.9Å; L79-L84 HydrophobicContact CD2-CD1 4.07Å; L79-L84 HydrophobicContact CG-CD1 4.43Å; L84-L210 WeakPolarHBondContact O-CA 3.3Å; L84-L210 WeakPolarHBondContact O-CB 3.36Å; L84-I211 HydrophobicContact CB-CD1 4.35Å; L84-I211 HydrophobicContact CB-CG1 3.61Å; L84-I211 HydrophobicContact CD1-CD1 3.89Å; L84-I211 HydrophobicContact CD1-CG1 3.85Å; L84-I211 HydrophobicContact CG-CG1 4.39Å; L84-I211 PolarHBondContact O-N 2.93Å
85	I	98.1	Very high	95.2	Very high	58 Å²	58	51.1 Å²	51.1	30%	0.297	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	128.3	-176.8	-177.3	173	0	0	0	110.6	P83 F123 R208 T209 L210	P83-I85 HydrophobicContact CB-CG2 4.26Å; I85-F123 HydrophobicContact CD1-CE1 3.94Å; I85-F123 HydrophobicContact CD1-CZ 3.59Å; I85-R208 HydrophobicContact CD1-CB 4.01Å; I85-R208 HydrophobicContact CG1-CB 4.05Å; I85-T209 CarbonylContact C-O 3.52Å; I85-T209 WeakPolarHBondContact CA-O 3.23Å; I85-L210 HydrophobicContact CB-CB 4.03Å; I85-L210 HydrophobicContact CG1-CB 4.15Å
86	K	98.3	Very high	95.5	Very high	53 Å²	53	48.8 Å²	48.8	23%	0.23	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	157.9	-179.3	-65.5	-167.7	173.9	-160	0	111.2	K62 F63 T88 I91 R208 T209	K62-K86 VanDerWaalsContact O-CE 3.23Å; K62-K86 WeakPolarHBondContact O-CE 3.46Å; K62-K86 PolarHBondContact O-NZ 2.85Å; F63-K86 HydrophobicContact CD1-CD 4.22Å; F63-K86 HydrophobicContact CD1-CG 4.08Å; F63-K86 HydrophobicContact CE1-CB 4.17Å; F63-K86 HydrophobicContact CE1-CD 4.39Å; F63-K86 HydrophobicContact CE1-CG 3.89Å; K86-T88 PolarHBondContact O-N 2.88Å; K86-I91 HydrophobicContact CB-CD1 4.24Å; K86-I91 HydrophobicContact CB-CG1 4.38Å; K86-R208 WeakPolarHBondContact O-CA 3.49Å; K86-T209 PolarHBondContact N-O 3.42Å; K86-T209 PolarHBondContact O-N 2.94Å
87	P	98.3	Very high	95.5	Very high	68 Å²	68	49.8 Å²	49.8	44%	0.442	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.9	133.6	170.2	-23.2	34	0	0	0	110.5	K89 S90	P87-K89 VanDerWaalsContact C-N 3.28Å; P87-K89 PolarHBondContact O-N 3.02Å; P87-S90 WeakPolarHBondContact O-CB 3.28Å; P87-S90 PolarHBondContact O-N 2.85Å; P87-S90 PolarHBondContact O-OG 2.89Å
88	T	98	Very high	95.3	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-58.2	-43.2	-175.8	-62.6	0	0	0	0	111.3	K86 S90 I91 F92 I122 I203 L205 G207 R208 T209	K86-T88 PolarHBondContact O-N 2.88Å; T88-S90 PolarHBondContact O-N 2.89Å; T88-S90 VanDerWaalsContact O-N 3.1Å; T88-I91 PolarHBondContact O-N 3.11Å; T88-F92 HydrophobicContact CG2-CD2 3.89Å; T88-F92 PolarHBondContact O-N 3.22Å; T88-I122 HydrophobicContact CG2-CD1 4.27Å; T88-I122 HydrophobicContact CG2-CG2 3.94Å; T88-I203 HydrophobicContact CG2-CD1 4.42Å; T88-L205 HydrophobicContact CG2-CD2 4.02Å; T88-G207 PolarHBondContact N-O 2.95Å; T88-G207 VanDerWaalsContact N-O 3.07Å; T88-G207 PolarHBondContact OG1-O 2.87Å; T88-R208 VanDerWaalsContact OG1-CA 3.23Å; T88-R208 WeakPolarHBondContact OG1-CA 3.44Å; T88-R208 PolarHBondContact OG1-N 3.3Å; T88-R208 PolarHBondContact OG1-O 3.29Å; T88-T209 WeakPolarHBondContact CA-OG1 2.92Å; T88-T209 WeakPolarHBondContact CB-OG1 3.49Å; T88-T209 PolarHBondContact OG1-N 2.84Å; T88-T209 PolarHBondContact OG1-OG1 3.04Å
89	K	96.7	Very high	95.3	Very high	131 Å²	131	47.5 Å²	47.5	57%	0.57	28%	0.282	S	S	*	.	H	α-helix	trans	-58.2	-21.9	174.8	-164.2	170.4	-173.8	171.6	0	115.1	P87 I91 P93 L205	P87-K89 VanDerWaalsContact C-N 3.28Å; P87-K89 PolarHBondContact O-N 3.02Å; K89-I91 VanDerWaalsContact C-N 3.33Å; K89-P93 WeakPolarHBondContact O-CA 3.45Å; K89-L205 HydrophobicContact CB-CB 4.38Å; K89-L205 PolarHBondContact N-O 3.49Å
90	S	96.1	Very high	95.3	Very high	57 Å²	57	47.3 Å²	47.3	40%	0.399	28%	0.281	S	S	.	.	H	α-helix	trans	-78.3	-20.6	175.5	73.1	0	0	0	0	113.3	P87 T88	P87-S90 WeakPolarHBondContact O-CB 3.28Å; P87-S90 PolarHBondContact O-N 2.85Å; P87-S90 PolarHBondContact O-OG 2.89Å; T88-S90 PolarHBondContact O-N 2.89Å; T88-S90 VanDerWaalsContact O-N 3.1Å
91	I	95.9	Very high	95.5	Very high	1 Å²	1	46 Å²	46	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-97.7	-46	177.9	-52.1	-172.9	0	0	0	109.6	F57 L59 K62 F63 K86 T88 K89 P93 T209	F57-I91 VanDerWaalsContact CD1-O 3.24Å; F57-I91 WeakPolarHBondContact CD1-O 3.32Å; L59-I91 HydrophobicContact CD1-CG2 4.1Å; L59-I91 HydrophobicContact CG-CG2 4.25Å; K62-I91 HydrophobicContact CG-CG2 4.49Å; F63-I91 HydrophobicContact CD2-CD1 4.27Å; F63-I91 HydrophobicContact CE1-CD1 4.18Å; F63-I91 HydrophobicContact CE2-CD1 3.36Å; F63-I91 HydrophobicContact CZ-CD1 3.3Å; K86-I91 HydrophobicContact CB-CD1 4.24Å; K86-I91 HydrophobicContact CB-CG1 4.38Å; T88-I91 PolarHBondContact O-N 3.11Å; K89-I91 VanDerWaalsContact C-N 3.33Å; I91-P93 VanDerWaalsContact O-CD 3.3Å; I91-P93 WeakPolarHBondContact O-CD 3.47Å; I91-T209 HydrophobicContact CD1-CG2 3.83Å
92	F	96	Very high	95.7	Very high	0 Å²	0	41 Å²	41	0%	0	23%	0.232	C	C	.	.			trans	-119.3	74	-177.6	-48.7	-71.4	0	0	0	109.4	F57 L59 T88 D94 G95 L96 W120 I122 L205 T209 I230	F57-F92 HydrophobicContact CB-CE1 4.15Å; F57-F92 AromaticContact CD1-CD1 3.87Å; F57-F92 HydrophobicContact CD1-CD1 3.87Å; F57-F92 HydrophobicContact CD1-CE1 4.27Å; F57-F92 AromaticContact CD2-CD1 3.74Å; F57-F92 HydrophobicContact CD2-CD1 3.74Å; F57-F92 AromaticContact CD2-CE1 3.72Å; F57-F92 HydrophobicContact CD2-CE1 3.72Å; F57-F92 AromaticContact CE1-CD1 3.88Å; F57-F92 HydrophobicContact CE1-CD1 3.88Å; F57-F92 AromaticContact CE2-CD1 3.76Å; F57-F92 HydrophobicContact CE2-CD1 3.76Å; F57-F92 HydrophobicContact CE2-CE1 4.17Å; F57-F92 AromaticContact CG-CD1 3.8Å; F57-F92 HydrophobicContact CG-CD1 3.8Å; F57-F92 AromaticContact CG-CE1 3.78Å; F57-F92 HydrophobicContact CG-CE1 3.78Å; F57-F92 AromaticContact CZ-CD1 3.83Å; F57-F92 HydrophobicContact CZ-CD1 3.83Å; L59-F92 HydrophobicContact CD1-CE1 4.32Å; L59-F92 HydrophobicContact CD1-CZ 4.21Å; T88-F92 HydrophobicContact CG2-CD2 3.89Å; T88-F92 PolarHBondContact O-N 3.22Å; F92-D94 VanDerWaalsContact C-N 3.27Å; F92-D94 PolarHBondContact O-N 3.27Å; F92-G95 PolarHBondContact O-N 3.01Å; F92-L96 HydrophobicContact CD1-CD1 4.38Å; F92-L96 HydrophobicContact CE1-CD1 4.18Å; F92-W120 HydrophobicContact CE2-CZ2 4.37Å; F92-W120 HydrophobicContact CZ-CZ2 4.1Å; F92-I122 HydrophobicContact CD2-CD1 4.11Å; F92-I122 HydrophobicContact CE2-CD1 3.75Å; F92-I122 HydrophobicContact CE2-CG1 4.41Å; F92-L205 HydrophobicContact CB-CD2 4.48Å; F92-T209 HydrophobicContact CE2-CG2 4.16Å; F92-I230 HydrophobicContact CE1-CD1 4.05Å; F92-I230 HydrophobicContact CZ-CD1 3.8Å
93	P	93.3	Very high	95.8	Very high	62 Å²	62	38.2 Å²	38.2	40%	0.403	21%	0.213	S	C	.	.	S	Bend	trans	-60.7	-37.8	-175	23.9	-33.6	0	0	0	112.8	K89 I91	K89-P93 WeakPolarHBondContact O-CA 3.45Å; I91-P93 VanDerWaalsContact O-CD 3.3Å; I91-P93 WeakPolarHBondContact O-CD 3.47Å
94	D	90.4	Very high	95.8	Very high	98 Å²	98	34 Å²	34	52%	0.524	19%	0.185	S	C	.	.	S	Bend	trans	-101.3	0.9	-179	-55	-55	0	0	0	112.4	G32 V33 F92	G32-D94 WeakPolarHBondContact CA-O 3.19Å; V33-D94 HydrophobicContact CB-CB 4.14Å; F92-D94 VanDerWaalsContact C-N 3.27Å; F92-D94 PolarHBondContact O-N 3.27Å
95	G	90.4	Very high	95.8	Very high	8 Å²	8	33 Å²	33	8%	0.082	18%	0.18	C	C	.	.			trans	102.9	-176.7	-177.8	0	0	0	0	0	114.6	F92	F92-G95 PolarHBondContact O-N 3.01Å
96	L	92.3	Very high	95.8	Very high	12 Å²	12	30.3 Å²	30.3	6%	0.063	17%	0.166	C	C	.	.			trans	-117.1	136.6	176.2	-179.9	64.7	0	0	0	107.9	F57 F92 Y100 W120 I203 I230	F57-L96 HydrophobicContact CE2-CD1 4.38Å; F92-L96 HydrophobicContact CD1-CD1 4.38Å; F92-L96 HydrophobicContact CE1-CD1 4.18Å; L96-Y100 HydrophobicContact CD1-CD1 4.46Å; L96-Y100 HydrophobicContact CD1-CG 4.29Å; L96-Y100 HydrophobicContact CD2-CD1 4.12Å; L96-Y100 HydrophobicContact CD2-CE1 3.89Å; L96-Y100 HydrophobicContact CD2-CE2 4.47Å; L96-Y100 HydrophobicContact CD2-CG 4.49Å; L96-Y100 HydrophobicContact CG-CD1 4.17Å; L96-Y100 HydrophobicContact CG-CE1 4.4Å; L96-Y100 HydrophobicContact CG-CG 4.48Å; L96-W120 HydrophobicContact CD2-CH2 3.71Å; L96-W120 HydrophobicContact CD2-CZ2 4.05Å; L96-I203 HydrophobicContact CB-CD1 3.5Å; L96-I203 VanDerWaalsContact CB-CD1 3.5Å; L96-I203 HydrophobicContact CB-CG1 4.18Å; L96-I203 HydrophobicContact CD2-CD1 4.45Å; L96-I230 HydrophobicContact CD1-CG2 3.67Å
97	S	92.8	Very high	95.7	Very high	29 Å²	29	30.1 Å²	30.1	20%	0.203	16%	0.164	C	C	.	.			trans	-58.5	148.8	173.7	-179.9	0	0	0	0	111.1	E99 Y100	S97-E99 WeakPolarHBondContact CB-O 3.29Å; S97-E99 PolarHBondContact O-N 3.24Å; S97-E99 PolarHBondContact OG-N 2.83Å; S97-E99 PolarHBondContact OG-O 2.81Å; S97-Y100 VanDerWaalsContact O-CD1 3.22Å; S97-Y100 WeakPolarHBondContact O-CD1 3.03Å
98	N	91.6	Very high	95.7	Very high	41 Å²	41	27 Å²	27	22%	0.219	14%	0.144	C	C	.	.	S	Bend	trans	-68.7	-27.9	176.4	-70.5	-25.9	0	0	0	112.2	Q29 R200	Q29-N98 PolarHBondContact OE1-ND2 3.31Å; N98-R200 PolarHBondContact O-NH1 3.23Å; N98-R200 VanDerWaalsContact O-NH1 3.07Å; N98-R200 PolarHBondContact O-NH2 2.87Å
99	E	95.9	Very high	95.6	Very high	67 Å²	67	30.9 Å²	30.9	31%	0.313	16%	0.158	S	C	.	.	S	Bend	trans	-112.5	128.9	170.3	-56.4	-171.4	120.8	0	0	109.3	S97 V178 H179 S180 C232 P234	S97-E99 WeakPolarHBondContact CB-O 3.29Å; S97-E99 PolarHBondContact O-N 3.24Å; S97-E99 PolarHBondContact OG-N 2.83Å; S97-E99 PolarHBondContact OG-O 2.81Å; E99-V178 CarbonylContact C-O 3.58Å; E99-V178 WeakPolarHBondContact CA-O 3.43Å; E99-H179 IonicContact OE1-ND1 2.76Å; E99-S180 WeakPolarHBondContact CG-OG 3.19Å; E99-S180 PolarHBondContact OE1-N 2.8Å; E99-S180 PolarHBondContact OE1-OG 2.91Å; E99-C232 VanDerWaalsContact O-O 3.08Å; E99-P234 HydrophobicContact CB-CB 4.25Å; E99-P234 HydrophobicContact CB-CG 3.96Å
100	Y	97.5	Very high	95.6	Very high	6 Å²	6	35 Å²	35	2%	0.024	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.6	171.6	-175.4	61.6	-88.1	0	0	0	109.2	L96 S97 W120 V131 V178 I230 Y231 P234	L96-Y100 HydrophobicContact CD1-CD1 4.46Å; L96-Y100 HydrophobicContact CD1-CG 4.29Å; L96-Y100 HydrophobicContact CD2-CD1 4.12Å; L96-Y100 HydrophobicContact CD2-CE1 3.89Å; L96-Y100 HydrophobicContact CD2-CE2 4.47Å; L96-Y100 HydrophobicContact CD2-CG 4.49Å; L96-Y100 HydrophobicContact CG-CD1 4.17Å; L96-Y100 HydrophobicContact CG-CE1 4.4Å; L96-Y100 HydrophobicContact CG-CG 4.48Å; S97-Y100 VanDerWaalsContact O-CD1 3.22Å; S97-Y100 WeakPolarHBondContact O-CD1 3.03Å; Y100-W120 HydrophobicContact CE2-CH2 4.16Å; Y100-W120 HydrophobicContact CE2-CZ3 4.08Å; Y100-V131 WeakPolarHBondContact OH-CG1 3.21Å; Y100-V178 HydrophobicContact CD1-CB 4.31Å; Y100-V178 HydrophobicContact CD1-CG1 4.38Å; Y100-V178 HydrophobicContact CD2-CB 4.46Å; Y100-V178 HydrophobicContact CD2-CG2 4.35Å; Y100-V178 HydrophobicContact CE1-CB 4.16Å; Y100-V178 HydrophobicContact CE1-CG1 3.93Å; Y100-V178 HydrophobicContact CE1-CG2 4.46Å; Y100-V178 HydrophobicContact CE2-CB 4.29Å; Y100-V178 HydrophobicContact CE2-CG2 3.86Å; Y100-V178 HydrophobicContact CG-CB 4.47Å; Y100-V178 PolarHBondContact N-O 2.89Å; Y100-V178 VanDerWaalsContact N-O 3.07Å; Y100-V178 WeakPolarHBondContact O-CA 3.36Å; Y100-V178 WeakPolarHBondContact O-CB 3.24Å; Y100-V178 PolarHBondContact O-N 3Å; Y100-I230 HydrophobicContact CD2-CG2 4.11Å; Y100-Y231 WeakPolarHBondContact CA-O 3.12Å; Y100-Y231 VanDerWaalsContact CB-O 3.23Å; Y100-Y231 WeakPolarHBondContact CB-O 3.24Å; Y100-P234 WeakPolarHBondContact O-CA 3.01Å
101	S	98.2	Very high	95.4	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	146.3	166.5	58.8	0	0	0	0	111.8	I176 I230 Y231 D233 M236 A237	S101-I176 CarbonylContact C-O 3.57Å; S101-I176 WeakPolarHBondContact CA-O 3.47Å; S101-I176 VanDerWaalsContact CB-O 3.27Å; S101-I176 WeakPolarHBondContact CB-O 3.42Å; S101-I230 CarbonylContact O-C 3.46Å; S101-I230 VanDerWaalsContact O-CA 3.27Å; S101-I230 WeakPolarHBondContact O-CA 3.41Å; S101-Y231 PolarHBondContact N-O 2.84Å; S101-Y231 PolarHBondContact O-N 3.08Å; S101-Y231 WeakPolarHBondContact OG-CB 3.24Å; S101-D233 PolarHBondContact OG-O 2.83Å; S101-M236 WeakPolarHBondContact OG-CB 3.39Å; S101-A237 PolarHBondContact OG-N 3.09Å
102	L	98.6	Very high	95.3	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	126.3	176.1	-178.7	155.3	0	0	0	108.2	T104 L119 W120 V133 G175 I176 L229 I230	L102-T104 HydrophobicContact CD2-CG2 4.31Å; L102-L119 HydrophobicContact CD2-CD2 4.05Å; L102-W120 HydrophobicContact CD1-CB 4.09Å; L102-W120 HydrophobicContact CD1-CD2 3.94Å; L102-W120 HydrophobicContact CD1-CE3 3.61Å; L102-W120 HydrophobicContact CD1-CG 4.18Å; L102-W120 HydrophobicContact CD1-CZ3 4.27Å; L102-V133 HydrophobicContact CD1-CG2 4.47Å; L102-G175 CarbonylContact O-C 3.46Å; L102-G175 WeakPolarHBondContact O-CA 3.47Å; L102-I176 HydrophobicContact CB-CB 4.39Å; L102-I176 HydrophobicContact CD2-CD1 4.5Å; L102-I176 PolarHBondContact N-O 2.87Å; L102-I176 PolarHBondContact O-N 2.94Å; L102-L229 WeakPolarHBondContact CA-O 3.3Å; L102-I230 HydrophobicContact CB-CG1 4.34Å; L102-I230 HydrophobicContact CD1-CD1 4.37Å; L102-I230 HydrophobicContact CD1-CG1 4.21Å; L102-I230 HydrophobicContact CG-CG1 4.22Å
103	V	98.2	Very high	95.3	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.006	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	131.2	175	178.7	0	0	0	0	109.3	K173 L174 I228 L229 Y231 A237	V103-K173 HydrophobicContact CG1-CD 3.9Å; V103-K173 HydrophobicContact CG1-CG 3.85Å; V103-L174 WeakPolarHBondContact CA-O 3.25Å; V103-I228 CarbonylContact O-C 3.53Å; V103-I228 WeakPolarHBondContact O-CA 3.23Å; V103-L229 PolarHBondContact N-O 2.92Å; V103-L229 PolarHBondContact O-N 2.85Å; V103-Y231 HydrophobicContact CB-CE2 4.08Å; V103-Y231 HydrophobicContact CG2-CD2 4.17Å; V103-Y231 HydrophobicContact CG2-CE2 3.78Å; V103-A237 HydrophobicContact CG2-CB 3.95Å
104	T	98.1	Very high	95.4	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	146.9	174.9	-175.2	0	0	0	0	111.1	L102 F106 L119 K173 L174 L225 Q227	L102-T104 HydrophobicContact CD2-CG2 4.31Å; T104-F106 HydrophobicContact CG2-CD1 3.64Å; T104-F106 HydrophobicContact CG2-CE1 3.79Å; T104-L119 HydrophobicContact CG2-CD1 4.03Å; T104-L119 HydrophobicContact CG2-CD2 3.59Å; T104-L119 HydrophobicContact CG2-CG 4.39Å; T104-K173 CarbonylContact O-C 3.58Å; T104-K173 WeakPolarHBondContact O-CA 3.4Å; T104-L174 HydrophobicContact CG2-CB 3.84Å; T104-L174 HydrophobicContact CG2-CD2 4.37Å; T104-L174 HydrophobicContact CG2-CG 4.44Å; T104-L174 PolarHBondContact N-O 2.87Å; T104-L174 PolarHBondContact O-N 3.23Å; T104-L225 WeakPolarHBondContact OG1-CD1 3.06Å; T104-Q227 CarbonylContact C-O 3.59Å; T104-Q227 VanDerWaalsContact CA-O 3.23Å; T104-Q227 WeakPolarHBondContact CA-O 3.42Å; T104-Q227 WeakPolarHBondContact CB-O 3.4Å; T104-Q227 PolarHBondContact OG1-O 2.9Å
105	I	97.3	Very high	95.8	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.005	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	117	168.2	-57.1	-176.3	0	0	0	108.4	W171 H172 K173 R226 Q227 E244 L245	I105-W171 HydrophobicContact CG2-CE3 3.92Å; I105-H172 WeakPolarHBondContact CA-O 3.1Å; I105-K173 HydrophobicContact CG1-CB 3.98Å; I105-K173 HydrophobicContact CG1-CG 3.95Å; I105-R226 HydrophobicContact CB-CB 4.08Å; I105-R226 HydrophobicContact CG2-CB 4.1Å; I105-R226 HydrophobicContact CG2-CG 4.43Å; I105-R226 PolarHBondContact O-N 2.9Å; I105-Q227 HydrophobicContact CB-CG 3.87Å; I105-Q227 HydrophobicContact CD1-CG 4.17Å; I105-Q227 HydrophobicContact CG1-CG 3.86Å; I105-Q227 PolarHBondContact N-O 3.47Å; I105-Q227 PolarHBondContact O-N 3.28Å; I105-E244 HydrophobicContact CD1-CG 3.5Å; I105-E244 VanDerWaalsContact CD1-CG 3.5Å; I105-E244 VanDerWaalsContact CD1-OE1 3.27Å; I105-E244 WeakPolarHBondContact CD1-OE1 3.37Å; I105-L245 HydrophobicContact CD1-CD2 4.39Å; I105-L245 HydrophobicContact CG2-CD2 4Å
106	F	97.8	Very high	96.2	Very high	1 Å²	1	43.7 Å²	43.7	0%	0.004	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	164.7	-179.3	70.5	-85.2	0	0	0	111.2	T104 V108 W117 L119 V135 L166 H172 L174 E224 L225	T104-F106 HydrophobicContact CG2-CD1 3.64Å; T104-F106 HydrophobicContact CG2-CE1 3.79Å; F106-V108 HydrophobicContact CD2-CG1 4.29Å; F106-V108 HydrophobicContact CE2-CG1 3.95Å; F106-W117 HydrophobicContact CD2-CH2 4.18Å; F106-W117 HydrophobicContact CD2-CZ2 4.2Å; F106-W117 HydrophobicContact CE2-CH2 4.11Å; F106-W117 AromaticContact CE2-CZ2 3.81Å; F106-W117 HydrophobicContact CE2-CZ2 3.81Å; F106-W117 HydrophobicContact CZ-CH2 4.47Å; F106-W117 HydrophobicContact CZ-CZ2 4.33Å; F106-L119 HydrophobicContact CD1-CD1 4.48Å; F106-V135 HydrophobicContact CZ-CG2 4.24Å; F106-L166 HydrophobicContact CZ-CD2 4.36Å; F106-H172 PolarHBondContact N-O 3.13Å; F106-H172 VanDerWaalsContact N-O 3.17Å; F106-H172 PolarHBondContact O-N 2.94Å; F106-H172 VanDerWaalsContact O-N 3.13Å; F106-L174 HydrophobicContact CE1-CB 4.1Å; F106-L174 HydrophobicContact CE1-CD2 4.22Å; F106-E224 CarbonylContact C-O 3.56Å; F106-E224 WeakPolarHBondContact CA-O 3.49Å; F106-E224 WeakPolarHBondContact CB-O 3.29Å; F106-L225 HydrophobicContact CB-CD1 4.04Å
107	R	97	Very high	96.5	Very high	50 Å²	50	43.1 Å²	43.1	19%	0.189	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	136.6	163.5	66.5	-179.5	-177.5	-165.9	-2.6	110.5	E72 Q170 W171 E224	E72-R107 IonicContact OE1-NH1 2.71Å; E72-R107 PolarHBondContact OE1-NH1 3.4Å; R107-Q170 WeakPolarHBondContact CB-O 3.36Å; R107-W171 HydrophobicContact CB-CD2 4.28Å; R107-W171 HydrophobicContact CB-CE3 4.13Å; R107-W171 HydrophobicContact CG-CD2 4.04Å; R107-W171 HydrophobicContact CG-CE3 4.02Å; R107-W171 HydrophobicContact CG-CH2 4.18Å; R107-W171 HydrophobicContact CG-CZ2 4.21Å; R107-W171 HydrophobicContact CG-CZ3 4.1Å; R107-W171 VanDerWaalsContact NH1-NE1 3.19Å; R107-E224 HydrophobicContact CG-CB 3.92Å; R107-E224 IonicContact CZ-OE2 3.87Å; R107-E224 PolarHBondContact N-O 3.27Å; R107-E224 IonicContact NE-OE2 2.66Å; R107-E224 PolarHBondContact NE-OE2 2.83Å; R107-E224 IonicContact NH2-OE2 3.23Å; R107-E224 PolarHBondContact NH2-OE2 3.33Å; R107-E224 PolarHBondContact O-N 2.86Å
108	V	97.6	Very high	96.8	Very high	3 Å²	3	43.9 Å²	43.9	2%	0.018	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	150.9	175.3	-62.1	0	0	0	0	110.8	F106 K113 R169	F106-V108 HydrophobicContact CD2-CG1 4.29Å; F106-V108 HydrophobicContact CE2-CG1 3.95Å; V108-K113 HydrophobicContact CG2-CB 4.35Å; V108-R169 HydrophobicContact CG2-CG 4.3Å; V108-R169 WeakPolarHBondContact O-CB 3.5Å; V108-R169 WeakPolarHBondContact O-CG 3.23Å
109	R	96.6	Very high	97.1	Very high	80 Å²	80	42.1 Å²	42.1	30%	0.302	18%	0.182	S	C	.	.			trans	-94.9	166.9	172.6	-60.8	-168.3	81.7	-131.1	2	110.6	T111 T112 K113 D222	R109-T111 PolarHBondContact O-N 2.97Å; R109-T112 PolarHBondContact N-OG1 2.82Å; R109-T112 VanDerWaalsContact N-OG1 3.14Å; R109-T112 PolarHBondContact O-N 3.07Å; R109-T112 VanDerWaalsContact O-N 3.07Å; R109-T112 PolarHBondContact O-OG1 2.91Å; R109-K113 PolarHBondContact O-N 2.68Å; R109-D222 WeakPolarHBondContact CB-O 3.34Å; R109-D222 VanDerWaalsContact CD-CG 3.47Å; R109-D222 WeakPolarHBondContact CD-OD1 2.99Å; R109-D222 WeakPolarHBondContact CD-OD2 3.27Å; R109-D222 WeakPolarHBondContact CG-O 3.34Å; R109-D222 IonicContact CZ-OD2 3.08Å; R109-D222 IonicContact NE-OD2 3.27Å; R109-D222 IonicContact NH1-OD1 2.84Å; R109-D222 IonicContact NH1-OD2 2.67Å; R109-D222 PolarHBondContact NH1-OD2 2.67Å
110	R	95.2	Very high	97.2	Very high	217 Å²	217	38.9 Å²	38.9	82%	0.819	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55	-36.8	179.1	-178.6	176.8	179.3	161.3	1	112.4	T112	R110-T112 VanDerWaalsContact C-N 3.32Å
111	T	93.2	Very high	97.3	Very high	96 Å²	96	39.3 Å²	39.3	59%	0.589	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-22.4	-178.6	41.4	0	0	0	0	113.6	R109 D222	R109-T111 PolarHBondContact O-N 2.97Å; T111-D222 PolarHBondContact OG1-OD2 2.82Å
112	T	93.7	Very high	97.3	Very high	2 Å²	2	39.3 Å²	39.3	1%	0.012	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.1	-0.5	-169.6	51.1	0	0	0	0	113.5	R109 R110 K114 D115 V221 D222	R109-T112 PolarHBondContact N-OG1 2.82Å; R109-T112 VanDerWaalsContact N-OG1 3.14Å; R109-T112 PolarHBondContact O-N 3.07Å; R109-T112 VanDerWaalsContact O-N 3.07Å; R109-T112 PolarHBondContact O-OG1 2.91Å; R110-T112 VanDerWaalsContact C-N 3.32Å; T112-K114 PolarHBondContact O-N 2.81Å; T112-K114 VanDerWaalsContact O-N 3.09Å; T112-D115 WeakPolarHBondContact O-CB 3.35Å; T112-D115 PolarHBondContact O-N 3.25Å; T112-V221 HydrophobicContact CG2-CG1 3.45Å; T112-V221 VanDerWaalsContact CG2-CG1 3.45Å; T112-D222 HydrophobicContact CG2-CB 3.94Å; T112-D222 VanDerWaalsContact CG2-O 3.25Å; T112-D222 WeakPolarHBondContact CG2-O 3.44Å; T112-D222 PolarHBondContact OG1-O 2.91Å
113	K	95	Very high	97.3	Very high	83 Å²	83	41 Å²	41	36%	0.361	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-27.1	-179.8	175.4	170.6	172.3	145.3	0	114.4	V108 R109 G137 F167	V108-K113 HydrophobicContact CG2-CB 4.35Å; R109-K113 PolarHBondContact O-N 2.68Å; K113-G137 CarbonylContact O-C 3.52Å; K113-G137 VanDerWaalsContact O-CA 3.25Å; K113-G137 WeakPolarHBondContact O-CA 3.34Å; K113-F167 WeakPolarHBondContact CD-O 3.5Å; K113-F167 WeakPolarHBondContact CE-O 3.38Å; K113-F167 HydrophobicContact CG-CB 4.46Å; K113-F167 PolarHBondContact NZ-O 3.13Å
114	K	96.9	Very high	97.1	Very high	152 Å²	152	42.3 Å²	42.3	66%	0.661	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.4	-2.8	179.8	-66.3	-169.2	175.4	-168.1	0	113.5	T112 D138	T112-K114 PolarHBondContact O-N 2.81Å; T112-K114 VanDerWaalsContact O-N 3.09Å; K114-D138 PolarHBondContact O-N 3.19Å
115	D	98	Very high	97	Very high	26 Å²	26	49.6 Å²	49.6	14%	0.139	22%	0.218	C	C	.	.			trans	-68.8	150.8	-177.2	-71	12.3	0	0	0	109.8	T112 G137 R214	T112-D115 WeakPolarHBondContact O-CB 3.35Å; T112-D115 PolarHBondContact O-N 3.25Å; D115-G137 PolarHBondContact O-N 2.97Å; D115-R214 IonicContact OD2-CZ 3.26Å; D115-R214 VanDerWaalsContact OD2-CZ 3.23Å; D115-R214 IonicContact OD2-NE 2.71Å; D115-R214 PolarHBondContact OD2-NE 2.78Å; D115-R214 IonicContact OD2-NH2 2.67Å; D115-R214 PolarHBondContact OD2-NH2 2.8Å
116	R	98.4	Very high	96.9	Very high	50 Å²	50	53.8 Å²	53.8	19%	0.189	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	119.7	164.5	-178.8	176.6	176.8	-90.9	-8.3	108.2	V134 V135 D136 E143 V215 E216	R116-V134 HydrophobicContact CG-CG1 3.52Å; R116-V135 WeakPolarHBondContact CA-O 3.47Å; R116-D136 HydrophobicContact CB-CB 4.42Å; R116-D136 WeakPolarHBondContact CD-OD2 2.97Å; R116-D136 HydrophobicContact CG-CB 4.01Å; R116-D136 IonicContact NE-OD2 3.38Å; R116-E143 IonicContact CZ-OE2 2.76Å; R116-E143 IonicContact NE-OE1 3.54Å; R116-E143 IonicContact NE-OE2 3.88Å; R116-E143 PolarHBondContact NE-OE2 3.34Å; R116-E143 IonicContact NH2-OE2 3.86Å; R116-E143 PolarHBondContact NH2-OE2 3.31Å; R116-V215 HydrophobicContact CG-CB 4.5Å; R116-V215 HydrophobicContact CG-CG2 4.1Å; R116-V215 WeakPolarHBondContact O-CG2 3.44Å; R116-V215 PolarHBondContact O-N 3.26Å; R116-E216 WeakPolarHBondContact CB-OE1 3.03Å; R116-E216 VanDerWaalsContact O-OE2 3.13Å
117	W	98.6	Very high	96.6	Very high	1 Å²	1	56.2 Å²	56.2	0%	0.004	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	147.5	-169.2	56.8	-77.2	0	0	0	112.6	F106 L119 V134 V135 T213 V221 I223	F106-W117 HydrophobicContact CD2-CH2 4.18Å; F106-W117 HydrophobicContact CD2-CZ2 4.2Å; F106-W117 HydrophobicContact CE2-CH2 4.11Å; F106-W117 AromaticContact CE2-CZ2 3.81Å; F106-W117 HydrophobicContact CE2-CZ2 3.81Å; F106-W117 HydrophobicContact CZ-CH2 4.47Å; F106-W117 HydrophobicContact CZ-CZ2 4.33Å; W117-L119 HydrophobicContact CE3-CB 4.48Å; W117-L119 HydrophobicContact CH2-CB 4.37Å; W117-L119 HydrophobicContact CH2-CD1 3.74Å; W117-L119 HydrophobicContact CZ3-CB 3.99Å; W117-L119 HydrophobicContact CZ3-CD1 3.74Å; W117-L119 PolarHBondContact O-N 2.74Å; W117-V134 CarbonylContact O-C 3.59Å; W117-V134 VanDerWaalsContact O-CA 3.3Å; W117-V134 WeakPolarHBondContact O-CA 3.33Å; W117-V135 HydrophobicContact CD2-CB 4.31Å; W117-V135 HydrophobicContact CH2-CG2 4.4Å; W117-V135 HydrophobicContact CZ2-CB 3.81Å; W117-V135 HydrophobicContact CZ2-CG1 3.93Å; W117-V135 HydrophobicContact CZ2-CG2 4.01Å; W117-V135 PolarHBondContact N-O 2.68Å; W117-V135 PolarHBondContact O-N 2.86Å; W117-T213 CarbonylContact C-O 3.52Å; W117-T213 WeakPolarHBondContact CA-O 3.37Å; W117-T213 WeakPolarHBondContact CB-O 3.34Å; W117-V221 HydrophobicContact CB-CB 4.5Å; W117-V221 HydrophobicContact CB-CG2 3.54Å; W117-V221 HydrophobicContact CD2-CG1 4.36Å; W117-V221 HydrophobicContact CG-CB 4.5Å; W117-V221 HydrophobicContact CG-CG1 4.2Å; W117-V221 HydrophobicContact CG-CG2 4.01Å; W117-I223 HydrophobicContact CH2-CD1 3.61Å; W117-I223 HydrophobicContact CH2-CG2 4.41Å; W117-I223 HydrophobicContact CZ2-CD1 4.45Å; W117-I223 HydrophobicContact CZ2-CG2 4.27Å; W117-I223 HydrophobicContact CZ3-CD1 3.74Å
118	Y	98.8	Very high	96.5	Very high	44 Å²	44	56.4 Å²	56.4	17%	0.173	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	108.7	169.4	-61.7	-67.9	0	0	0	108.8	W120 Q121 V134 L210 S212 T213 V215	Y118-W120 VanDerWaalsContact C-N 3.26Å; Y118-Q121 HydrophobicContact CD1-CB 3.96Å; Y118-Q121 HydrophobicContact CD1-CG 4.33Å; Y118-Q121 HydrophobicContact CE1-CG 4.47Å; Y118-Q121 VanDerWaalsContact CE1-NE2 3.34Å; Y118-Q121 HydrophobicContact CG-CB 4.11Å; Y118-V134 HydrophobicContact CD1-CG2 3.52Å; Y118-V134 HydrophobicContact CE1-CG2 3.64Å; Y118-V134 HydrophobicContact CG-CG2 4.49Å; Y118-L210 HydrophobicContact CD2-CD1 4.25Å; Y118-L210 HydrophobicContact CG-CD1 4.13Å; Y118-S212 WeakPolarHBondContact O-CA 3.36Å; Y118-S212 PolarHBondContact O-N 2.87Å; Y118-T213 PolarHBondContact N-O 2.03Å; Y118-T213 PolarHBondContact O-N 3.25Å; Y118-T213 VanDerWaalsContact O-N 3.16Å; Y118-V215 HydrophobicContact CD1-CG2 4.34Å; Y118-V215 HydrophobicContact CD2-CG2 3.88Å; Y118-V215 HydrophobicContact CE1-CG2 4.15Å; Y118-V215 HydrophobicContact CE2-CB 4.09Å; Y118-V215 HydrophobicContact CE2-CG1 3.99Å; Y118-V215 HydrophobicContact CE2-CG2 3.69Å; Y118-V215 HydrophobicContact CG-CG2 4.2Å
119	L	98.8	Very high	96.4	Very high	4 Å²	4	58.1 Å²	58.1	2%	0.021	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	-46.5	163.3	173.5	67.2	0	0	0	109.1	L102 T104 F106 W117 V133 V135 L174 I211 S212 I228	L102-L119 HydrophobicContact CD2-CD2 4.05Å; T104-L119 HydrophobicContact CG2-CD1 4.03Å; T104-L119 HydrophobicContact CG2-CD2 3.59Å; T104-L119 HydrophobicContact CG2-CG 4.39Å; F106-L119 HydrophobicContact CD1-CD1 4.48Å; W117-L119 HydrophobicContact CE3-CB 4.48Å; W117-L119 HydrophobicContact CH2-CB 4.37Å; W117-L119 HydrophobicContact CH2-CD1 3.74Å; W117-L119 HydrophobicContact CZ3-CB 3.99Å; W117-L119 HydrophobicContact CZ3-CD1 3.74Å; W117-L119 PolarHBondContact O-N 2.74Å; L119-V133 HydrophobicContact CB-CB 4.43Å; L119-V133 HydrophobicContact CB-CG1 4.18Å; L119-V133 HydrophobicContact CD2-CG1 3.89Å; L119-V133 PolarHBondContact N-O 2.86Å; L119-V135 HydrophobicContact CB-CG2 4.18Å; L119-L174 HydrophobicContact CD2-CD2 3.94Å; L119-I211 VanDerWaalsContact O-CA 3.28Å; L119-I211 WeakPolarHBondContact O-CA 3.39Å; L119-I211 VanDerWaalsContact O-CB 3.3Å; L119-I211 WeakPolarHBondContact O-CB 3.3Å; L119-S212 PolarHBondContact O-N 2.71Å; L119-I228 HydrophobicContact CG-CD1 4.46Å
120	W	98.8	Very high	96.4	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	142	176	169.9	68.1	0	0	0	110.1	L59 F92 L96 Y100 L102 Y118 I122 V131 S132 V133 T209 L210 I211 I228 I230	L59-W120 HydrophobicContact CD2-CG 4.39Å; F92-W120 HydrophobicContact CE2-CZ2 4.37Å; F92-W120 HydrophobicContact CZ-CZ2 4.1Å; L96-W120 HydrophobicContact CD2-CH2 3.71Å; L96-W120 HydrophobicContact CD2-CZ2 4.05Å; Y100-W120 HydrophobicContact CE2-CH2 4.16Å; Y100-W120 HydrophobicContact CE2-CZ3 4.08Å; L102-W120 HydrophobicContact CD1-CB 4.09Å; L102-W120 HydrophobicContact CD1-CD2 3.94Å; L102-W120 HydrophobicContact CD1-CE3 3.61Å; L102-W120 HydrophobicContact CD1-CG 4.18Å; L102-W120 HydrophobicContact CD1-CZ3 4.27Å; Y118-W120 VanDerWaalsContact C-N 3.26Å; W120-I122 HydrophobicContact CH2-CD1 4.19Å; W120-I122 HydrophobicContact CH2-CG1 4.49Å; W120-I122 HydrophobicContact CZ2-CD1 3.51Å; W120-I122 HydrophobicContact CZ2-CG1 3.71Å; W120-V131 HydrophobicContact CE3-CG1 4.39Å; W120-V131 HydrophobicContact CH2-CB 4.43Å; W120-V131 HydrophobicContact CH2-CG1 3.79Å; W120-V131 HydrophobicContact CZ3-CB 4.48Å; W120-V131 HydrophobicContact CZ3-CG1 3.49Å; W120-V131 VanDerWaalsContact CZ3-CG1 3.49Å; W120-S132 WeakPolarHBondContact O-CA 3.41Å; W120-V133 HydrophobicContact CE3-CG2 4.11Å; W120-V133 PolarHBondContact N-O 2.9Å; W120-V133 PolarHBondContact O-N 2.9Å; W120-T209 VanDerWaalsContact NE1-CG2 3.31Å; W120-L210 WeakPolarHBondContact CA-O 3.44Å; W120-I211 HydrophobicContact CB-CG2 4.33Å; W120-I228 HydrophobicContact CB-CD1 4.28Å; W120-I230 HydrophobicContact CD2-CD1 4.34Å; W120-I230 HydrophobicContact CH2-CD1 4.13Å; W120-I230 HydrophobicContact CZ2-CD1 3.65Å
121	Q	98.6	Very high	96.5	Very high	14 Å²	14	44.6 Å²	44.6	7%	0.065	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	142.8	174.8	179.1	-179.4	49.1	0	0	110.9	Y118 F123 S129 V131 T209 L210	Y118-Q121 HydrophobicContact CD1-CB 3.96Å; Y118-Q121 HydrophobicContact CD1-CG 4.33Å; Y118-Q121 HydrophobicContact CE1-CG 4.47Å; Y118-Q121 VanDerWaalsContact CE1-NE2 3.34Å; Y118-Q121 HydrophobicContact CG-CB 4.11Å; Q121-F123 HydrophobicContact CG-CD1 4.32Å; Q121-S129 PolarHBondContact NE2-OG 3.07Å; Q121-V131 CarbonylContact C-O 3.57Å; Q121-V131 WeakPolarHBondContact CA-O 3.04Å; Q121-T209 CarbonylContact O-C 3.58Å; Q121-T209 WeakPolarHBondContact O-CA 3Å; Q121-T209 WeakPolarHBondContact O-CG2 3.25Å; Q121-L210 HydrophobicContact CB-CD1 3.7Å; Q121-L210 HydrophobicContact CB-CG 4.1Å; Q121-L210 PolarHBondContact N-O 3.06Å; Q121-L210 PolarHBondContact O-N 3.43Å
122	I	98.5	Very high	96.8	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	130.9	161.7	-57.8	-177.5	0	0	0	108.1	T88 F92 W120 Q130 V131 I203 T209	T88-I122 HydrophobicContact CG2-CD1 4.27Å; T88-I122 HydrophobicContact CG2-CG2 3.94Å; F92-I122 HydrophobicContact CD2-CD1 4.11Å; F92-I122 HydrophobicContact CE2-CD1 3.75Å; F92-I122 HydrophobicContact CE2-CG1 4.41Å; W120-I122 HydrophobicContact CH2-CD1 4.19Å; W120-I122 HydrophobicContact CH2-CG1 4.49Å; W120-I122 HydrophobicContact CZ2-CD1 3.51Å; W120-I122 HydrophobicContact CZ2-CG1 3.71Å; I122-Q130 HydrophobicContact CG2-CB 4.44Å; I122-Q130 PolarHBondContact O-N 3.36Å; I122-V131 PolarHBondContact N-O 2.97Å; I122-V131 PolarHBondContact O-N 2.93Å; I122-I203 HydrophobicContact CD1-CD1 3.64Å; I122-I203 HydrophobicContact CD1-CG2 4.48Å; I122-T209 HydrophobicContact CG1-CG2 4.05Å
123	F	97.4	Very high	97	Very high	35 Å²	35	40.3 Å²	40.3	15%	0.154	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	149.2	173.7	61.7	-90.3	0	0	0	110.4	I85 Q121 S128 G207 R208 L210	I85-F123 HydrophobicContact CD1-CE1 3.94Å; I85-F123 HydrophobicContact CD1-CZ 3.59Å; Q121-F123 HydrophobicContact CG-CD1 4.32Å; F123-S128 CarbonylContact C-O 3.52Å; F123-S128 WeakPolarHBondContact CA-O 3.3Å; F123-S128 VanDerWaalsContact CB-O 3.32Å; F123-S128 WeakPolarHBondContact CB-O 3.36Å; F123-G207 CarbonylContact O-C 3.4Å; F123-G207 WeakPolarHBondContact O-CA 3.25Å; F123-R208 WeakPolarHBondContact CD1-O 3.36Å; F123-R208 HydrophobicContact CE1-CB 3.94Å; F123-R208 HydrophobicContact CE2-CB 3.9Å; F123-R208 HydrophobicContact CE2-CG 4.27Å; F123-R208 HydrophobicContact CZ-CB 3.61Å; F123-R208 HydrophobicContact CZ-CG 4.3Å; F123-R208 PolarHBondContact N-O 3.02Å; F123-R208 PolarHBondContact O-N 2.8Å; F123-L210 HydrophobicContact CE1-CD2 3.84Å; F123-L210 HydrophobicContact CE1-CG 4.22Å
124	D	95.6	Very high	97.2	Very high	29 Å²	29	36.4 Å²	36.4	16%	0.155	20%	0.201	C	C	.	.			trans	-76.3	-177.3	-176.5	69.6	19.7	0	0	0	112.9	S126 G127 S128 Q130	D124-S126 VanDerWaalsContact CG-OG 3.28Å; D124-S126 PolarHBondContact O-N 3.09Å; D124-S126 VanDerWaalsContact OD1-CA 3.3Å; D124-S126 WeakPolarHBondContact OD1-CA 3.48Å; D124-S126 VanDerWaalsContact OD1-CB 3.32Å; D124-S126 WeakPolarHBondContact OD1-CB 3.4Å; D124-S126 PolarHBondContact OD1-N 2.73Å; D124-S126 PolarHBondContact OD1-OG 3.08Å; D124-S126 PolarHBondContact OD2-OG 2.76Å; D124-G127 PolarHBondContact O-N 3.2Å; D124-G127 VanDerWaalsContact O-N 3.09Å; D124-G127 PolarHBondContact OD1-N 3.16Å; D124-G127 VanDerWaalsContact OD1-N 3.08Å; D124-S128 PolarHBondContact N-O 2.75Å; D124-S128 PolarHBondContact OD1-N 3.42Å; D124-S128 WeakPolarHBondContact OD2-CB 3.24Å; D124-Q130 HydrophobicContact CB-CG 4.19Å
125	Q	95.8	Very high	97.3	Very high	153 Å²	153	29.1 Å²	29.1	72%	0.715	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-23.7	178.2	-68.9	-168.6	-12.5	0	0	114.2	G127 N206	Q125-G127 VanDerWaalsContact C-N 3.26Å; Q125-N206 HydrophobicContact CG-CB 3.92Å; Q125-N206 WeakPolarHBondContact CG-O 3.47Å; Q125-N206 PolarHBondContact NE2-O 3.17Å; Q125-N206 VanDerWaalsContact NE2-O 3.11Å
126	S	94.1	Very high	97.3	Very high	90 Å²	90	28 Å²	28	63%	0.629	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-9.2	176.7	78.5	0	0	0	0	112.8	D124 S128	D124-S126 VanDerWaalsContact CG-OG 3.28Å; D124-S126 PolarHBondContact O-N 3.09Å; D124-S126 VanDerWaalsContact OD1-CA 3.3Å; D124-S126 WeakPolarHBondContact OD1-CA 3.48Å; D124-S126 VanDerWaalsContact OD1-CB 3.32Å; D124-S126 WeakPolarHBondContact OD1-CB 3.4Å; D124-S126 PolarHBondContact OD1-N 2.73Å; D124-S126 PolarHBondContact OD1-OG 3.08Å; D124-S126 PolarHBondContact OD2-OG 2.76Å; S126-S128 PolarHBondContact OG-N 3.21Å; S126-S128 PolarHBondContact OG-OG 3.39Å
127	G	92.7	Very high	97.3	Very high	51 Å²	51	26 Å²	26	53%	0.526	16%	0.158	S	C	.	.	S	Bend	trans	88.1	5.5	-172.9	0	0	0	0	0	113.6	D124 Q125	D124-G127 PolarHBondContact O-N 3.2Å; D124-G127 VanDerWaalsContact O-N 3.09Å; D124-G127 PolarHBondContact OD1-N 3.16Å; D124-G127 VanDerWaalsContact OD1-N 3.08Å; Q125-G127 VanDerWaalsContact C-N 3.26Å
128	S	93.9	Very high	97.2	Very high	55 Å²	55	31.4 Å²	31.4	39%	0.385	19%	0.187	S	C	.	.			trans	-78.8	128.6	-179.6	-59.2	0	0	0	0	110.4	F123 D124 S126 Q130	F123-S128 CarbonylContact C-O 3.52Å; F123-S128 WeakPolarHBondContact CA-O 3.3Å; F123-S128 VanDerWaalsContact CB-O 3.32Å; F123-S128 WeakPolarHBondContact CB-O 3.36Å; D124-S128 PolarHBondContact N-O 2.75Å; D124-S128 PolarHBondContact OD1-N 3.42Å; D124-S128 WeakPolarHBondContact OD2-CB 3.24Å; S126-S128 PolarHBondContact OG-N 3.21Å; S126-S128 PolarHBondContact OG-OG 3.39Å; S128-Q130 PolarHBondContact O-N 2.89Å
129	S	95.8	Very high	97.2	Very high	38 Å²	38	34.1 Å²	34.1	27%	0.266	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	124.7	179.6	-168	0	0	0	0	110.6	Q121	Q121-S129 PolarHBondContact NE2-OG 3.07Å
130	Q	96.9	Very high	97.2	Very high	4 Å²	4	37.9 Å²	37.9	2%	0.019	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	-45.6	178.1	-60.4	-171.5	75.1	0	0	111	I122 D124 S128 S146 Q147 D204	I122-Q130 HydrophobicContact CG2-CB 4.44Å; I122-Q130 PolarHBondContact O-N 3.36Å; D124-Q130 HydrophobicContact CB-CG 4.19Å; S128-Q130 PolarHBondContact O-N 2.89Å; Q130-S146 CarbonylContact O-C 3.54Å; Q130-S146 VanDerWaalsContact O-CA 3.3Å; Q130-S146 WeakPolarHBondContact O-CA 3.5Å; Q130-Q147 PolarHBondContact O-N 2.8Å; Q130-D204 PolarHBondContact NE2-O 2.95Å
131	V	97.7	Very high	97.2	Very high	10 Å²	10	37.9 Å²	37.9	6%	0.061	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	139.1	175.5	178.7	0	0	0	0	108.5	Y100 W120 Q121 I122 F144 S145 I203	Y100-V131 WeakPolarHBondContact OH-CG1 3.21Å; W120-V131 HydrophobicContact CE3-CG1 4.39Å; W120-V131 HydrophobicContact CH2-CB 4.43Å; W120-V131 HydrophobicContact CH2-CG1 3.79Å; W120-V131 HydrophobicContact CZ3-CB 4.48Å; W120-V131 HydrophobicContact CZ3-CG1 3.49Å; W120-V131 VanDerWaalsContact CZ3-CG1 3.49Å; Q121-V131 CarbonylContact C-O 3.57Å; Q121-V131 WeakPolarHBondContact CA-O 3.04Å; I122-V131 PolarHBondContact N-O 2.97Å; I122-V131 PolarHBondContact O-N 2.93Å; V131-F144 HydrophobicContact CG1-CE2 4.08Å; V131-F144 HydrophobicContact CG1-CZ 4.5Å; V131-S145 CarbonylContact C-O 3.57Å; V131-S145 VanDerWaalsContact CA-O 3.29Å; V131-S145 WeakPolarHBondContact CA-O 3.2Å; V131-I203 HydrophobicContact CG2-CG2 3.86Å
132	S	98.6	Very high	97.2	Very high	5 Å²	5	37.2 Å²	37.2	4%	0.035	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	145.4	174.3	67.6	0	0	0	0	113	W120 F144 S145	W120-S132 WeakPolarHBondContact O-CA 3.41Å; S132-F144 CarbonylContact O-C 3.6Å; S132-F144 WeakPolarHBondContact O-CA 3.5Å; S132-S145 PolarHBondContact N-O 2.9Å; S132-S145 PolarHBondContact O-N 2.88Å; S132-S145 WeakPolarHBondContact OG-CB 3.46Å
133	V	98.8	Very high	97.2	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.012	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	120.2	164.3	179.2	0	0	0	0	108.1	L102 L119 W120 V142 E143 F144 I176	L102-V133 HydrophobicContact CD1-CG2 4.47Å; L119-V133 HydrophobicContact CB-CB 4.43Å; L119-V133 HydrophobicContact CB-CG1 4.18Å; L119-V133 HydrophobicContact CD2-CG1 3.89Å; L119-V133 PolarHBondContact N-O 2.86Å; W120-V133 HydrophobicContact CE3-CG2 4.11Å; W120-V133 PolarHBondContact N-O 2.9Å; W120-V133 PolarHBondContact O-N 2.9Å; V133-V142 HydrophobicContact CG1-CG1 4.13Å; V133-E143 CarbonylContact C-O 3.49Å; V133-E143 WeakPolarHBondContact CA-O 3.31Å; V133-F144 HydrophobicContact CG2-CD2 4.2Å; V133-I176 HydrophobicContact CB-CD1 4.24Å; V133-I176 HydrophobicContact CG1-CD1 3.45Å; V133-I176 VanDerWaalsContact CG1-CD1 3.45Å; V133-I176 HydrophobicContact CG2-CD1 3.71Å
134	V	98.9	Very high	97.2	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.006	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	134.5	178.6	175.2	0	0	0	0	109.5	R116 W117 Y118 V142 E143 V215	R116-V134 HydrophobicContact CG-CG1 3.52Å; W117-V134 CarbonylContact O-C 3.59Å; W117-V134 VanDerWaalsContact O-CA 3.3Å; W117-V134 WeakPolarHBondContact O-CA 3.33Å; Y118-V134 HydrophobicContact CD1-CG2 3.52Å; Y118-V134 HydrophobicContact CE1-CG2 3.64Å; Y118-V134 HydrophobicContact CG-CG2 4.49Å; V134-V142 CarbonylContact O-C 3.45Å; V134-V142 WeakPolarHBondContact O-CA 3.19Å; V134-E143 HydrophobicContact CB-CB 4.12Å; V134-E143 HydrophobicContact CB-CG 4.49Å; V134-E143 PolarHBondContact N-O 2.9Å; V134-E143 PolarHBondContact O-N 3.22Å; V134-V215 HydrophobicContact CG1-CG2 4.22Å; V134-V215 HydrophobicContact CG2-CG2 4.38Å
135	V	98.8	Very high	97.4	Very high	0 Å²	0	35 Å²	35	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	116.8	167.6	173.8	0	0	0	0	107	F106 R116 W117 L119 F167	F106-V135 HydrophobicContact CZ-CG2 4.24Å; R116-V135 WeakPolarHBondContact CA-O 3.47Å; W117-V135 HydrophobicContact CD2-CB 4.31Å; W117-V135 HydrophobicContact CH2-CG2 4.4Å; W117-V135 HydrophobicContact CZ2-CB 3.81Å; W117-V135 HydrophobicContact CZ2-CG1 3.93Å; W117-V135 HydrophobicContact CZ2-CG2 4.01Å; W117-V135 PolarHBondContact N-O 2.68Å; W117-V135 PolarHBondContact O-N 2.86Å; L119-V135 HydrophobicContact CB-CG2 4.18Å; V135-F167 HydrophobicContact CG1-CE1 3.49Å; V135-F167 VanDerWaalsContact CG1-CE1 3.49Å; V135-F167 HydrophobicContact CG1-CZ 3.92Å
136	D	98.7	Very high	97.4	Very high	3 Å²	3	27.9 Å²	27.9	2%	0.016	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	98.7	179.8	-174.5	-25.7	0	0	0	109.1	R116 D138 K139 K140 A141	R116-D136 HydrophobicContact CB-CB 4.42Å; R116-D136 WeakPolarHBondContact CD-OD2 2.97Å; R116-D136 HydrophobicContact CG-CB 4.01Å; R116-D136 IonicContact NE-OD2 3.38Å; D136-D138 PolarHBondContact OD1-N 3.3Å; D136-K139 HydrophobicContact CB-CB 4.43Å; D136-K139 PolarHBondContact OD1-N 3.32Å; D136-K139 WeakPolarHBondContact OD2-CD 3.4Å; D136-K139 WeakPolarHBondContact OD2-CE 3.37Å; D136-K139 WeakPolarHBondContact OD2-CG 3.49Å; D136-K139 IonicContact OD2-NZ 3.82Å; D136-K139 PolarHBondContact OD2-NZ 3.47Å; D136-K140 CarbonylContact O-C 3.52Å; D136-K140 VanDerWaalsContact O-CA 3.24Å; D136-K140 WeakPolarHBondContact O-CA 3.29Å; D136-K140 PolarHBondContact O-N 3.07Å; D136-A141 HydrophobicContact CB-CB 4.33Å; D136-A141 PolarHBondContact N-O 3.17Å; D136-A141 PolarHBondContact O-N 3.47Å
137	G	97.8	Very high	97.5	Very high	7 Å²	7	24.5 Å²	24.5	7%	0.072	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-27.8	-177.7	0	0	0	0	0	115.1	K113 D115	K113-G137 CarbonylContact O-C 3.52Å; K113-G137 VanDerWaalsContact O-CA 3.25Å; K113-G137 WeakPolarHBondContact O-CA 3.34Å; D115-G137 PolarHBondContact O-N 2.97Å
138	D	97.4	Very high	97.6	Very high	114 Å²	114	22.1 Å²	22.1	61%	0.61	12%	0.119	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-44.1	176.5	-170.5	61.7	0	0	0	110.6	K114 D136	K114-D138 PolarHBondContact O-N 3.19Å; D136-D138 PolarHBondContact OD1-N 3.3Å
139	K	98	Very high	97.5	Very high	101 Å²	101	23.2 Å²	23.2	44%	0.439	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-3.2	178.3	-58.2	-170.9	-158.7	112	0	114.3	D136 A141	D136-K139 HydrophobicContact CB-CB 4.43Å; D136-K139 PolarHBondContact OD1-N 3.32Å; D136-K139 WeakPolarHBondContact OD2-CD 3.4Å; D136-K139 WeakPolarHBondContact OD2-CE 3.37Å; D136-K139 WeakPolarHBondContact OD2-CG 3.49Å; D136-K139 IonicContact OD2-NZ 3.82Å; D136-K139 PolarHBondContact OD2-NZ 3.47Å; K139-A141 VanDerWaalsContact C-N 3.29Å; K139-A141 HydrophobicContact CB-CB 4.15Å; K139-A141 PolarHBondContact O-N 3.42Å
140	K	98.1	Very high	97.3	Very high	84 Å²	84	29 Å²	29	37%	0.365	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.6	50.7	-171.8	-57.3	-176.9	-177.4	-179.5	0	112.4	D136 H164 F167	D136-K140 CarbonylContact O-C 3.52Å; D136-K140 VanDerWaalsContact O-CA 3.24Å; D136-K140 WeakPolarHBondContact O-CA 3.29Å; D136-K140 PolarHBondContact O-N 3.07Å; K140-H164 HydrophobicContact CD-CB 4.41Å; K140-F167 VanDerWaalsContact CA-CE2 3.41Å; K140-F167 HydrophobicContact CB-CD2 3.92Å; K140-F167 HydrophobicContact CB-CE2 3.79Å; K140-F167 HydrophobicContact CG-CD2 4.06Å; K140-F167 HydrophobicContact CG-CE2 4.39Å; K140-F167 HydrophobicContact CG-CG 4.47Å
141	A	98.6	Very high	96.9	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	156.5	-171.5	0	0	0	0	0	111.6	D136 K139 T157 F158 K159	D136-A141 HydrophobicContact CB-CB 4.33Å; D136-A141 PolarHBondContact N-O 3.17Å; D136-A141 PolarHBondContact O-N 3.47Å; K139-A141 VanDerWaalsContact C-N 3.29Å; K139-A141 HydrophobicContact CB-CB 4.15Å; K139-A141 PolarHBondContact O-N 3.42Å; A141-T157 HydrophobicContact CB-CG2 4.06Å; A141-F158 VanDerWaalsContact CA-O 3.28Å; A141-F158 WeakPolarHBondContact CA-O 3.39Å; A141-F158 WeakPolarHBondContact CB-O 3.23Å; A141-K159 HydrophobicContact CB-CD 4.26Å; A141-K159 HydrophobicContact CB-CG 3.54Å
142	V	98.8	Very high	96.6	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	135.7	164.7	175.3	0	0	0	0	107.8	V133 V134 F158 L163 L166 L174 I176 I185	V133-V142 HydrophobicContact CG1-CG1 4.13Å; V134-V142 CarbonylContact O-C 3.45Å; V134-V142 WeakPolarHBondContact O-CA 3.19Å; V142-F158 PolarHBondContact N-O 3.39Å; V142-F158 VanDerWaalsContact N-O 3.08Å; V142-F158 WeakPolarHBondContact O-CD2 3.37Å; V142-F158 PolarHBondContact O-N 3.21Å; V142-L163 HydrophobicContact CB-CD2 4.48Å; V142-L163 HydrophobicContact CG2-CD2 3.9Å; V142-L166 HydrophobicContact CG2-CD1 3.93Å; V142-L174 HydrophobicContact CG2-CD1 4.47Å; V142-L174 HydrophobicContact CG2-CD2 4.3Å; V142-I176 HydrophobicContact CG1-CD1 4.46Å; V142-I185 HydrophobicContact CG1-CD1 4.2Å
143	E	98.8	Very high	96.4	Very high	5 Å²	5	40.9 Å²	40.9	2%	0.023	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	125.6	176.9	-45.3	176.7	158	0	0	109.3	R116 V133 V134 R155 Y156 T157	R116-E143 IonicContact CZ-OE2 2.76Å; R116-E143 IonicContact NE-OE1 3.54Å; R116-E143 IonicContact NE-OE2 3.88Å; R116-E143 PolarHBondContact NE-OE2 3.34Å; R116-E143 IonicContact NH2-OE2 3.86Å; R116-E143 PolarHBondContact NH2-OE2 3.31Å; V133-E143 CarbonylContact C-O 3.49Å; V133-E143 WeakPolarHBondContact CA-O 3.31Å; V134-E143 HydrophobicContact CB-CB 4.12Å; V134-E143 HydrophobicContact CB-CG 4.49Å; V134-E143 PolarHBondContact N-O 2.9Å; V134-E143 PolarHBondContact O-N 3.22Å; E143-R155 HydrophobicContact CB-CG 4.49Å; E143-Y156 CarbonylContact C-O 3.6Å; E143-Y156 VanDerWaalsContact CA-O 3.32Å; E143-Y156 WeakPolarHBondContact CA-O 3.46Å; E143-T157 HydrophobicContact CG-CG2 4.19Å
144	F	98.8	Very high	96.3	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	132.2	167	177.2	-103	0	0	0	108.3	V131 S132 V133 R155 Y156 F158 V178 V183	V131-F144 HydrophobicContact CG1-CE2 4.08Å; V131-F144 HydrophobicContact CG1-CZ 4.5Å; S132-F144 CarbonylContact O-C 3.6Å; S132-F144 WeakPolarHBondContact O-CA 3.5Å; V133-F144 HydrophobicContact CG2-CD2 4.2Å; F144-R155 WeakPolarHBondContact O-CA 3.28Å; F144-Y156 AromaticContact CD1-CD2 3.87Å; F144-Y156 HydrophobicContact CD1-CD2 3.87Å; F144-Y156 HydrophobicContact CD1-CE2 4.43Å; F144-Y156 PolarHBondContact N-O 2.9Å; F144-Y156 PolarHBondContact O-N 3.42Å; F144-F158 HydrophobicContact CB-CE2 4.06Å; F144-V178 HydrophobicContact CE2-CG2 4.01Å; F144-V178 HydrophobicContact CZ-CG1 3.96Å; F144-V178 HydrophobicContact CZ-CG2 4.24Å; F144-V183 HydrophobicContact CB-CG1 4.37Å; F144-V183 HydrophobicContact CD1-CB 4.46Å; F144-V183 HydrophobicContact CD1-CG1 4.39Å; F144-V183 HydrophobicContact CD1-CG2 3.7Å; F144-V183 HydrophobicContact CE1-CG2 3.68Å; F144-V183 HydrophobicContact CG-CG1 4.27Å; F144-V183 HydrophobicContact CG-CG2 4.32Å; F144-V183 HydrophobicContact CZ-CG2 4.26Å
145	S	98.2	Very high	96.3	Very high	13 Å²	13	50.3 Å²	50.3	9%	0.091	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	146.2	173	-50.4	0	0	0	0	110.7	V131 S132 F154 R155	V131-S145 CarbonylContact C-O 3.57Å; V131-S145 VanDerWaalsContact CA-O 3.29Å; V131-S145 WeakPolarHBondContact CA-O 3.2Å; S132-S145 PolarHBondContact N-O 2.9Å; S132-S145 PolarHBondContact O-N 2.88Å; S132-S145 WeakPolarHBondContact OG-CB 3.46Å; S145-F154 CarbonylContact C-O 3.56Å; S145-F154 WeakPolarHBondContact CA-O 3.36Å; S145-F154 VanDerWaalsContact CB-O 3.29Å; S145-F154 WeakPolarHBondContact CB-O 3.43Å; S145-R155 WeakPolarHBondContact OG-CG 3.4Å
146	S	96.9	Very high	96.2	Very high	3 Å²	3	51.5 Å²	51.5	2%	0.021	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	155	179.4	57	0	0	0	0	110.8	Q130 F154 R200	Q130-S146 CarbonylContact O-C 3.54Å; Q130-S146 VanDerWaalsContact O-CA 3.3Å; Q130-S146 WeakPolarHBondContact O-CA 3.5Å; S146-F154 PolarHBondContact N-O 3.07Å; S146-F154 PolarHBondContact O-N 2.95Å; S146-R200 VanDerWaalsContact OG-CD 3.24Å; S146-R200 WeakPolarHBondContact OG-CD 3.49Å; S146-R200 WeakPolarHBondContact OG-CG 3.46Å
147	Q	95.7	Very high	96.2	Very high	19 Å²	19	53.3 Å²	53.3	9%	0.089	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	133.8	171.2	-174	165.2	71.8	0	0	110.1	Q130 K151 N152 R200 D201	Q130-Q147 PolarHBondContact O-N 2.8Å; Q147-K151 HydrophobicContact CG-CD 4.03Å; Q147-N152 CarbonylContact C-O 3.6Å; Q147-N152 WeakPolarHBondContact CA-O 3.16Å; Q147-R200 WeakPolarHBondContact O-CA 3.18Å; Q147-D201 PolarHBondContact O-N 2.79Å
148	G	93.7	Very high	96.3	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.261	C	S	.	.	B	Isolated β-bridge	trans	-85.2	171.2	172.3	0	0	0	0	0	112.6	L150 K151 N152 E199	G148-L150 PolarHBondContact O-N 3.18Å; G148-L150 VanDerWaalsContact O-N 3.14Å; G148-K151 WeakPolarHBondContact O-CA 3.4Å; G148-K151 PolarHBondContact O-N 2.88Å; G148-N152 PolarHBondContact N-O 2.84Å; G148-E199 WeakPolarHBondContact CA-O 3.43Å
149	L	91.9	Very high	96.3	Very high	79 Å²	79	53 Å²	53	41%	0.414	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-29.7	-179.1	-60.3	-174.2	0	0	0	114	K151 E199 D201	L149-K151 VanDerWaalsContact C-N 3.25Å; L149-K151 PolarHBondContact O-N 2.87Å; L149-E199 HydrophobicContact CD1-CG 3.98Å; L149-E199 WeakPolarHBondContact CD1-OE2 3.27Å; L149-E199 HydrophobicContact CD2-CG 4.45Å; L149-E199 HydrophobicContact CG-CG 4.1Å; L149-D201 HydrophobicContact CD2-CB 4.22Å
150	L	92.1	Very high	96.2	Very high	160 Å²	160	49.6 Å²	49.6	84%	0.838	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.7	19.4	178.2	-58.1	179.5	0	0	0	112.6	G148 N152	G148-L150 PolarHBondContact O-N 3.18Å; G148-L150 VanDerWaalsContact O-N 3.14Å; L150-N152 PolarHBondContact O-N 2.81Å
151	K	88.9	Confident	96.2	Very high	117 Å²	117	55.8 Å²	55.8	51%	0.509	27%	0.265	S	S	.	.	S	Bend	trans	59.3	15	-177.3	-57.7	-61	-171.7	-173.6	0	114.8	Q147 G148 L149 D201	Q147-K151 HydrophobicContact CG-CD 4.03Å; G148-K151 WeakPolarHBondContact O-CA 3.4Å; G148-K151 PolarHBondContact O-N 2.88Å; L149-K151 VanDerWaalsContact C-N 3.25Å; L149-K151 PolarHBondContact O-N 2.87Å; K151-D201 WeakPolarHBondContact CE-OD2 2.91Å; K151-D201 IonicContact NZ-OD2 3.73Å; K151-D201 PolarHBondContact NZ-OD2 2.84Å
152	N	92	Very high	96.1	Very high	64 Å²	64	59.8 Å²	59.8	34%	0.342	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-75.4	152.2	169.7	62.5	-53.4	0	0	0	110.8	Q147 G148 L150 F154	Q147-N152 CarbonylContact C-O 3.6Å; Q147-N152 WeakPolarHBondContact CA-O 3.16Å; G148-N152 PolarHBondContact N-O 2.84Å; L150-N152 PolarHBondContact O-N 2.81Å; N152-F154 WeakPolarHBondContact ND2-CE1 3.46Å; N152-F154 WeakPolarHBondContact ND2-CE2 3.46Å; N152-F154 WeakPolarHBondContact ND2-CZ 3.16Å
153	S	93.8	Very high	96	Very high	87 Å²	87	59.8 Å²	59.8	61%	0.608	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.5	124.2	179.2	-176	0	0	0	0	110.6
154	F	96.8	Very high	96	Very high	42 Å²	42	63.5 Å²	63.5	18%	0.184	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	138.9	170.8	-62	-65.1	0	0	0	109.9	S145 S146 N152 Y156 D198	S145-F154 CarbonylContact C-O 3.56Å; S145-F154 WeakPolarHBondContact CA-O 3.36Å; S145-F154 VanDerWaalsContact CB-O 3.29Å; S145-F154 WeakPolarHBondContact CB-O 3.43Å; S146-F154 PolarHBondContact N-O 3.07Å; S146-F154 PolarHBondContact O-N 2.95Å; N152-F154 WeakPolarHBondContact ND2-CE1 3.46Å; N152-F154 WeakPolarHBondContact ND2-CE2 3.46Å; N152-F154 WeakPolarHBondContact ND2-CZ 3.16Å; F154-Y156 HydrophobicContact CB-CE2 3.71Å; F154-D198 HydrophobicContact CD1-CB 4.16Å; F154-D198 WeakPolarHBondContact CD1-OD2 3.28Å; F154-D198 HydrophobicContact CD2-CB 3.88Å; F154-D198 HydrophobicContact CE1-CB 3.76Å; F154-D198 WeakPolarHBondContact CE1-OD2 3.3Å; F154-D198 HydrophobicContact CE2-CB 3.43Å; F154-D198 VanDerWaalsContact CE2-CB 3.43Å; F154-D198 HydrophobicContact CG-CB 4.2Å; F154-D198 HydrophobicContact CZ-CB 3.33Å
155	R	97.9	Very high	95.9	Very high	159 Å²	159	64.8 Å²	64.8	60%	0.6	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.9	127.9	177.2	178.9	178.4	65.9	-171.3	-4.8	110.5	E143 F144 S145	E143-R155 HydrophobicContact CB-CG 4.49Å; F144-R155 WeakPolarHBondContact O-CA 3.28Å; S145-R155 WeakPolarHBondContact OG-CG 3.4Å
156	Y	98.4	Very high	95.8	Very high	25 Å²	25	64.3 Å²	64.3	10%	0.098	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	119.8	179.9	-51.7	-86	0	0	0	109	E143 F144 F154 M196 T197 D198	E143-Y156 CarbonylContact C-O 3.6Å; E143-Y156 VanDerWaalsContact CA-O 3.32Å; E143-Y156 WeakPolarHBondContact CA-O 3.46Å; F144-Y156 AromaticContact CD1-CD2 3.87Å; F144-Y156 HydrophobicContact CD1-CD2 3.87Å; F144-Y156 HydrophobicContact CD1-CE2 4.43Å; F144-Y156 PolarHBondContact N-O 2.9Å; F144-Y156 PolarHBondContact O-N 3.42Å; F154-Y156 HydrophobicContact CB-CE2 3.71Å; Y156-M196 WeakPolarHBondContact CE1-O 3.4Å; Y156-T197 HydrophobicContact CD1-CG2 4.08Å; Y156-T197 HydrophobicContact CD2-CG2 3.96Å; Y156-T197 HydrophobicContact CE1-CG2 3.8Å; Y156-T197 HydrophobicContact CE2-CG2 3.66Å; Y156-T197 HydrophobicContact CG-CG2 4.15Å; Y156-T197 WeakPolarHBondContact OH-CA 3.21Å; Y156-T197 WeakPolarHBondContact OH-CB 3.39Å; Y156-D198 PolarHBondContact OH-N 2.89Å; Y156-D198 PolarHBondContact OH-OD2 3.48Å
157	T	98.6	Very high	95.8	Very high	41 Å²	41	64.3 Å²	64.3	25%	0.252	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	119	-176.9	-59.5	0	0	0	0	110.7	A141 E143 K159 K195	A141-T157 HydrophobicContact CB-CG2 4.06Å; E143-T157 HydrophobicContact CG-CG2 4.19Å; T157-K159 HydrophobicContact CG2-CD 4.03Å; T157-K159 HydrophobicContact CG2-CG 3.99Å; T157-K195 WeakPolarHBondContact O-CE 3.44Å; T157-K195 PolarHBondContact O-NZ 2.68Å
158	F	98.8	Very high	95.8	Very high	0 Å²	0	66.4 Å²	66.4	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	131.1	178.7	-56.5	-95.8	0	0	0	109.8	A141 V142 F144 L163 V183 I185 E193 K195	A141-F158 VanDerWaalsContact CA-O 3.28Å; A141-F158 WeakPolarHBondContact CA-O 3.39Å; A141-F158 WeakPolarHBondContact CB-O 3.23Å; V142-F158 PolarHBondContact N-O 3.39Å; V142-F158 VanDerWaalsContact N-O 3.08Å; V142-F158 WeakPolarHBondContact O-CD2 3.37Å; V142-F158 PolarHBondContact O-N 3.21Å; F144-F158 HydrophobicContact CB-CE2 4.06Å; F158-L163 HydrophobicContact CB-CD1 3.88Å; F158-L163 VanDerWaalsContact O-CD1 3.23Å; F158-L163 WeakPolarHBondContact O-CD1 3.5Å; F158-V183 HydrophobicContact CE2-CG1 4.12Å; F158-V183 HydrophobicContact CZ-CB 4.02Å; F158-V183 HydrophobicContact CZ-CG1 3.66Å; F158-I185 HydrophobicContact CB-CG1 4.1Å; F158-I185 HydrophobicContact CD1-CB 4.35Å; F158-I185 HydrophobicContact CD1-CG1 3.52Å; F158-I185 HydrophobicContact CD2-CD1 4.1Å; F158-I185 HydrophobicContact CD2-CG1 3.64Å; F158-I185 HydrophobicContact CE1-CG1 3.72Å; F158-I185 HydrophobicContact CE2-CD1 4.09Å; F158-I185 HydrophobicContact CE2-CG1 3.86Å; F158-I185 HydrophobicContact CG-CD1 4.41Å; F158-I185 HydrophobicContact CG-CG1 3.47Å; F158-I185 VanDerWaalsContact CG-CG1 3.47Å; F158-I185 HydrophobicContact CZ-CD1 4.37Å; F158-I185 HydrophobicContact CZ-CG1 3.9Å; F158-E193 VanDerWaalsContact CA-OE2 3.24Å; F158-E193 WeakPolarHBondContact CA-OE2 3.4Å; F158-E193 HydrophobicContact CD1-CB 3.83Å; F158-E193 HydrophobicContact CD1-CG 3.77Å; F158-E193 HydrophobicContact CE1-CG 4.49Å; F158-K195 HydrophobicContact CD1-CD 3.98Å; F158-K195 HydrophobicContact CD1-CG 4.17Å; F158-K195 HydrophobicContact CE1-CB 3.97Å; F158-K195 HydrophobicContact CE1-CD 3.67Å; F158-K195 HydrophobicContact CE1-CG 3.64Å; F158-K195 HydrophobicContact CE2-CD 4.45Å; F158-K195 HydrophobicContact CZ-CB 4.16Å; F158-K195 HydrophobicContact CZ-CD 3.92Å; F158-K195 HydrophobicContact CZ-CG 4.17Å
159	K	97.1	Very high	95.9	Very high	114 Å²	114	72.4 Å²	72.4	50%	0.496	35%	0.345	S	S	.	.			trans	-143.9	28.7	-169.7	-78.7	-178.2	176.3	179.3	0	113.2	A141 T157 E193	A141-K159 HydrophobicContact CB-CD 4.26Å; A141-K159 HydrophobicContact CB-CG 3.54Å; T157-K159 HydrophobicContact CG2-CD 4.03Å; T157-K159 HydrophobicContact CG2-CG 3.99Å; K159-E193 PolarHBondContact N-OE2 3.3Å
160	S	97	Very high	96.1	Very high	29 Å²	29	74 Å²	74	20%	0.203	35%	0.351	C	S	.	.			trans	-59.9	153.9	170	-176.1	0	0	0	0	112.2	D162 L163 E193	S160-D162 PolarHBondContact O-N 2.66Å; S160-D162 PolarHBondContact OG-N 3.4Å; S160-D162 PolarHBondContact OG-OD2 3.18Å; S160-L163 WeakPolarHBondContact O-CB 3.41Å; S160-L163 PolarHBondContact O-N 3.5Å; S160-E193 PolarHBondContact N-OE2 3.17Å
161	R	97.2	Very high	96.3	Very high	214 Å²	214	67.5 Å²	67.5	81%	0.808	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-61.1	-29.7	172.9	-70.8	-176.6	-178.5	177.1	1.8	112.2	L163 H164	R161-L163 PolarHBondContact O-N 3.19Å; R161-H164 WeakPolarHBondContact O-CB 3.47Å; R161-H164 PolarHBondContact O-N 2.7Å
162	D	96.4	Very high	96.6	Very high	85 Å²	85	62.6 Å²	62.6	46%	0.455	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-62	-30.1	179.9	-49.5	-51.1	0	0	0	111.5	S160 H164 A165 A192	S160-D162 PolarHBondContact O-N 2.66Å; S160-D162 PolarHBondContact OG-N 3.4Å; S160-D162 PolarHBondContact OG-OD2 3.18Å; D162-H164 PolarHBondContact O-N 3.04Å; D162-A165 PolarHBondContact O-N 2.68Å; D162-A192 HydrophobicContact CB-CB 3.91Å
163	L	97.5	Very high	96.9	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-66.1	-19.3	175.7	-64.4	168.4	0	0	0	113.4	V142 F158 S160 R161 A165 L166 F167 I185 V187	V142-L163 HydrophobicContact CB-CD2 4.48Å; V142-L163 HydrophobicContact CG2-CD2 3.9Å; F158-L163 HydrophobicContact CB-CD1 3.88Å; F158-L163 VanDerWaalsContact O-CD1 3.23Å; F158-L163 WeakPolarHBondContact O-CD1 3.5Å; S160-L163 WeakPolarHBondContact O-CB 3.41Å; S160-L163 PolarHBondContact O-N 3.5Å; R161-L163 PolarHBondContact O-N 3.19Å; L163-A165 PolarHBondContact O-N 2.73Å; L163-A165 VanDerWaalsContact O-N 3.17Å; L163-L166 HydrophobicContact CD2-CD1 3.97Å; L163-L166 WeakPolarHBondContact O-CB 3.44Å; L163-L166 WeakPolarHBondContact O-CG 3.47Å; L163-L166 PolarHBondContact O-N 3.14Å; L163-F167 VanDerWaalsContact O-CD2 3.28Å; L163-F167 WeakPolarHBondContact O-CD2 3.21Å; L163-F167 WeakPolarHBondContact O-CE2 3.22Å; L163-I185 HydrophobicContact CD2-CG2 3.76Å; L163-V187 HydrophobicContact CD2-CG2 3.65Å; L163-V187 HydrophobicContact CG-CG2 4.49Å
164	H	97.4	Very high	97.1	Very high	83 Å²	83	55.6 Å²	55.6	38%	0.384	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-61.4	-26.8	-177.9	-71.2	-172	0	0	0	112.8	K140 R161 D162 L166 F167	K140-H164 HydrophobicContact CD-CB 4.41Å; R161-H164 WeakPolarHBondContact O-CB 3.47Å; R161-H164 PolarHBondContact O-N 2.7Å; D162-H164 PolarHBondContact O-N 3.04Å; H164-L166 VanDerWaalsContact C-N 3.3Å; H164-L166 PolarHBondContact O-N 3.28Å; H164-F167 PolarHBondContact O-N 3.39Å
165	A	96.5	Very high	97.2	Very high	27 Å²	27	53.8 Å²	53.8	22%	0.223	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-57.6	-41.9	178.4	0	0	0	0	0	111.5	D162 L163 F167 D168 H172 V187	D162-A165 PolarHBondContact O-N 2.68Å; L163-A165 PolarHBondContact O-N 2.73Å; L163-A165 VanDerWaalsContact O-N 3.17Å; A165-F167 PolarHBondContact O-N 3.04Å; A165-D168 PolarHBondContact O-N 3.21Å; A165-H172 PolarHBondContact O-CD2 2.96Å; A165-H172 PolarHBondContact O-NE2 3.22Å; A165-V187 HydrophobicContact CB-CG1 4.33Å
166	L	97.7	Very high	97.2	Very high	2 Å²	2	46.3 Å²	46.3	1%	0.01	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-52.6	-16.7	178.3	-57.4	177.3	0	0	0	114.7	F106 V142 L163 H164 H172 L174 V187	F106-L166 HydrophobicContact CZ-CD2 4.36Å; V142-L166 HydrophobicContact CG2-CD1 3.93Å; L163-L166 HydrophobicContact CD2-CD1 3.97Å; L163-L166 WeakPolarHBondContact O-CB 3.44Å; L163-L166 WeakPolarHBondContact O-CG 3.47Å; L163-L166 PolarHBondContact O-N 3.14Å; H164-L166 VanDerWaalsContact C-N 3.3Å; H164-L166 PolarHBondContact O-N 3.28Å; L166-H172 HydrophobicContact CD2-CB 3.65Å; L166-L174 HydrophobicContact CD1-CD1 4.18Å; L166-L174 HydrophobicContact CD1-CD2 4.46Å; L166-L174 HydrophobicContact CD2-CB 4.27Å; L166-V187 HydrophobicContact CD1-CG2 4.38Å; L166-V187 HydrophobicContact CD2-CG1 4.18Å; L166-V187 HydrophobicContact CG-CG1 4.48Å; L166-V187 HydrophobicContact CG-CG2 4.43Å
167	F	97.2	Very high	97.3	Very high	3 Å²	3	45.1 Å²	45.1	1%	0.013	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-110.8	9.6	-175.6	-49	-78.3	0	0	0	113.7	K113 V135 K140 L163 H164 A165	K113-F167 WeakPolarHBondContact CD-O 3.5Å; K113-F167 WeakPolarHBondContact CE-O 3.38Å; K113-F167 HydrophobicContact CG-CB 4.46Å; K113-F167 PolarHBondContact NZ-O 3.13Å; V135-F167 HydrophobicContact CG1-CE1 3.49Å; V135-F167 VanDerWaalsContact CG1-CE1 3.49Å; V135-F167 HydrophobicContact CG1-CZ 3.92Å; K140-F167 VanDerWaalsContact CA-CE2 3.41Å; K140-F167 HydrophobicContact CB-CD2 3.92Å; K140-F167 HydrophobicContact CB-CE2 3.79Å; K140-F167 HydrophobicContact CG-CD2 4.06Å; K140-F167 HydrophobicContact CG-CE2 4.39Å; K140-F167 HydrophobicContact CG-CG 4.47Å; L163-F167 VanDerWaalsContact O-CD2 3.28Å; L163-F167 WeakPolarHBondContact O-CD2 3.21Å; L163-F167 WeakPolarHBondContact O-CE2 3.22Å; H164-F167 PolarHBondContact O-N 3.39Å; A165-F167 PolarHBondContact O-N 3.04Å
168	D	95.7	Very high	97.2	Very high	64 Å²	64	43.1 Å²	43.1	34%	0.342	20%	0.197	S	C	.	.	S	Bend	trans	-90.4	-9.2	-176.8	76.9	4.5	0	0	0	114.6	A165 Q170 H172	A165-D168 PolarHBondContact O-N 3.21Å; D168-Q170 WeakPolarHBondContact OD1-CA 3.27Å; D168-Q170 VanDerWaalsContact OD1-CB 3.27Å; D168-Q170 WeakPolarHBondContact OD1-CB 3.1Å; D168-Q170 WeakPolarHBondContact OD1-CG 3.22Å; D168-Q170 PolarHBondContact OD1-N 3.07Å; D168-H172 IonicContact OD1-CD2 3.87Å; D168-H172 IonicContact OD1-NE2 3.66Å; D168-H172 PolarHBondContact OD1-NE2 3.42Å; D168-H172 IonicContact OD2-CE1 2.77Å; D168-H172 IonicContact OD2-NE2 3.24Å; D168-H172 PolarHBondContact OD2-NE2 2.73Å
169	R	95.6	Very high	97.2	Very high	126 Å²	126	44.5 Å²	44.5	48%	0.475	20%	0.204	S	C	.	.	S	Bend	trans	80.5	10.5	-177.1	-47.1	169.9	-66.7	165.7	0.8	115	V108	V108-R169 HydrophobicContact CG2-CG 4.3Å; V108-R169 WeakPolarHBondContact O-CB 3.5Å; V108-R169 WeakPolarHBondContact O-CG 3.23Å
170	Q	95.4	Very high	97.1	Very high	112 Å²	112	42.2 Å²	42.2	52%	0.523	20%	0.202	S	C	.	.	S	Bend	trans	-87.3	167.2	166.4	-55.9	-51.6	-54.6	0	0	110.5	R107 D168 H172	R107-Q170 WeakPolarHBondContact CB-O 3.36Å; D168-Q170 WeakPolarHBondContact OD1-CA 3.27Å; D168-Q170 VanDerWaalsContact OD1-CB 3.27Å; D168-Q170 WeakPolarHBondContact OD1-CB 3.1Å; D168-Q170 WeakPolarHBondContact OD1-CG 3.22Å; D168-Q170 PolarHBondContact OD1-N 3.07Å; Q170-H172 PolarHBondContact O-CD2 2.94Å; Q170-H172 VanDerWaalsContact O-CD2 3.23Å; Q170-H172 PolarHBondContact O-N 2.98Å
171	W	95.6	Very high	97	Very high	24 Å²	24	44.9 Å²	44.9	9%	0.091	21%	0.214	C	C	.	.			trans	-71.4	124.9	173.9	-70.5	110.5	0	0	0	110	E72 I105 R107 E224 R226 L245	E72-W171 PolarHBondContact OE2-NE1 2.98Å; I105-W171 HydrophobicContact CG2-CE3 3.92Å; R107-W171 HydrophobicContact CB-CD2 4.28Å; R107-W171 HydrophobicContact CB-CE3 4.13Å; R107-W171 HydrophobicContact CG-CD2 4.04Å; R107-W171 HydrophobicContact CG-CE3 4.02Å; R107-W171 HydrophobicContact CG-CH2 4.18Å; R107-W171 HydrophobicContact CG-CZ2 4.21Å; R107-W171 HydrophobicContact CG-CZ3 4.1Å; R107-W171 VanDerWaalsContact NH1-NE1 3.19Å; W171-E224 HydrophobicContact CH2-CB 3.73Å; W171-E224 HydrophobicContact CZ2-CB 4.34Å; W171-E224 HydrophobicContact CZ3-CB 4.39Å; W171-E224 WeakPolarHBondContact CZ3-O 3.43Å; W171-R226 VanDerWaalsContact CD1-NH2 3.33Å; W171-R226 HydrophobicContact CD2-CG 4.49Å; W171-R226 HydrophobicContact CE3-CG 4.03Å; W171-R226 HydrophobicContact CH2-CG 3.67Å; W171-R226 HydrophobicContact CZ2-CG 4.14Å; W171-R226 HydrophobicContact CZ3-CB 4.21Å; W171-R226 HydrophobicContact CZ3-CG 3.59Å; W171-L245 HydrophobicContact CB-CD2 4.04Å
172	H	96.8	Very high	97.1	Very high	13 Å²	13	35 Å²	35	6%	0.06	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	148.4	174	-67.2	-70.6	0	0	0	110.7	I105 F106 A165 L166 D168 Q170 D188	I105-H172 WeakPolarHBondContact CA-O 3.1Å; F106-H172 PolarHBondContact N-O 3.13Å; F106-H172 VanDerWaalsContact N-O 3.17Å; F106-H172 PolarHBondContact O-N 2.94Å; F106-H172 VanDerWaalsContact O-N 3.13Å; A165-H172 PolarHBondContact O-CD2 2.96Å; A165-H172 PolarHBondContact O-NE2 3.22Å; L166-H172 HydrophobicContact CD2-CB 3.65Å; D168-H172 IonicContact OD1-CD2 3.87Å; D168-H172 IonicContact OD1-NE2 3.66Å; D168-H172 PolarHBondContact OD1-NE2 3.42Å; D168-H172 IonicContact OD2-CE1 2.77Å; D168-H172 IonicContact OD2-NE2 3.24Å; D168-H172 PolarHBondContact OD2-NE2 2.73Å; Q170-H172 PolarHBondContact O-CD2 2.94Å; Q170-H172 VanDerWaalsContact O-CD2 3.23Å; Q170-H172 PolarHBondContact O-N 2.98Å; H172-D188 VanDerWaalsContact CA-OD1 3.29Å; H172-D188 WeakPolarHBondContact CA-OD1 2.9Å; H172-D188 IonicContact CE1-OD2 3.86Å; H172-D188 IonicContact CG-OD1 3.44Å; H172-D188 IonicContact CG-OD2 2.67Å; H172-D188 IonicContact ND1-OD1 3.49Å; H172-D188 PolarHBondContact ND1-OD1 2.64Å; H172-D188 IonicContact ND1-OD2 2.7Å; H172-D188 PolarHBondContact ND1-OD2 2.89Å
173	K	97.5	Very high	97.2	Very high	5 Å²	5	31 Å²	31	2%	0.022	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	123	169.9	-174.5	-178.9	-59	-164.4	0	108.8	V103 T104 I105 V187 D188 E240 N241 E244 L245	V103-K173 HydrophobicContact CG1-CD 3.9Å; V103-K173 HydrophobicContact CG1-CG 3.85Å; T104-K173 CarbonylContact O-C 3.58Å; T104-K173 WeakPolarHBondContact O-CA 3.4Å; I105-K173 HydrophobicContact CG1-CB 3.98Å; I105-K173 HydrophobicContact CG1-CG 3.95Å; K173-V187 WeakPolarHBondContact O-CA 3.38Å; K173-D188 PolarHBondContact N-OD1 3.38Å; K173-D188 PolarHBondContact O-N 2.01Å; K173-E240 IonicContact NZ-OE2 3.83Å; K173-E240 PolarHBondContact NZ-OE2 2.76Å; K173-N241 PolarHBondContact NZ-O 2.86Å; K173-E244 WeakPolarHBondContact CE-OE1 3.48Å; K173-E244 VanDerWaalsContact NZ-CD 3.25Å; K173-E244 IonicContact NZ-OE1 3.83Å; K173-E244 PolarHBondContact NZ-OE1 2.81Å; K173-E244 IonicContact NZ-OE2 2.96Å; K173-E244 PolarHBondContact NZ-OE2 2.96Å; K173-L245 HydrophobicContact CB-CD1 3.85Å
174	L	98.6	Very high	97.2	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	118.4	170.5	174.5	64.3	0	0	0	108.4	V103 T104 F106 L119 V142 L166 I176 I185	V103-L174 WeakPolarHBondContact CA-O 3.25Å; T104-L174 HydrophobicContact CG2-CB 3.84Å; T104-L174 HydrophobicContact CG2-CD2 4.37Å; T104-L174 HydrophobicContact CG2-CG 4.44Å; T104-L174 PolarHBondContact N-O 2.87Å; T104-L174 PolarHBondContact O-N 3.23Å; F106-L174 HydrophobicContact CE1-CB 4.1Å; F106-L174 HydrophobicContact CE1-CD2 4.22Å; L119-L174 HydrophobicContact CD2-CD2 3.94Å; V142-L174 HydrophobicContact CG2-CD1 4.47Å; V142-L174 HydrophobicContact CG2-CD2 4.3Å; L166-L174 HydrophobicContact CD1-CD1 4.18Å; L166-L174 HydrophobicContact CD1-CD2 4.46Å; L166-L174 HydrophobicContact CD2-CB 4.27Å; L174-I176 HydrophobicContact CD1-CG1 4.49Å; L174-I176 HydrophobicContact CD2-CD1 4.47Å; L174-I176 HydrophobicContact CG-CG1 4.32Å; L174-I185 HydrophobicContact CD1-CG2 3.6Å
175	G	98.4	Very high	97.3	Very high	3 Å²	3	27.2 Å²	27.2	3%	0.031	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	140.4	171.6	0	0	0	0	0	110.8	L102 I185 Y186	L102-G175 CarbonylContact O-C 3.46Å; L102-G175 WeakPolarHBondContact O-CA 3.47Å; G175-I185 WeakPolarHBondContact O-CA 3.49Å; G175-Y186 PolarHBondContact N-O 3.29Å; G175-Y186 PolarHBondContact O-N 3.1Å
176	I	98.7	Very high	97.4	Very high	2 Å²	2	26.7 Å²	26.7	1%	0.01	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	115.1	175.9	-53.1	-174	0	0	0	107	S101 L102 V133 V142 L174 V178 V183 S184 I185	S101-I176 CarbonylContact C-O 3.57Å; S101-I176 WeakPolarHBondContact CA-O 3.47Å; S101-I176 VanDerWaalsContact CB-O 3.27Å; S101-I176 WeakPolarHBondContact CB-O 3.42Å; L102-I176 HydrophobicContact CB-CB 4.39Å; L102-I176 HydrophobicContact CD2-CD1 4.5Å; L102-I176 PolarHBondContact N-O 2.87Å; L102-I176 PolarHBondContact O-N 2.94Å; V133-I176 HydrophobicContact CB-CD1 4.24Å; V133-I176 HydrophobicContact CG1-CD1 3.45Å; V133-I176 VanDerWaalsContact CG1-CD1 3.45Å; V133-I176 HydrophobicContact CG2-CD1 3.71Å; V142-I176 HydrophobicContact CG1-CD1 4.46Å; L174-I176 HydrophobicContact CD1-CG1 4.49Å; L174-I176 HydrophobicContact CD2-CD1 4.47Å; L174-I176 HydrophobicContact CG-CG1 4.32Å; I176-V178 HydrophobicContact CG2-CG2 3.82Å; I176-V183 HydrophobicContact CG2-CG1 3.9Å; I176-S184 CarbonylContact C-O 3.53Å; I176-S184 WeakPolarHBondContact CA-O 3.21Å; I176-I185 HydrophobicContact CB-CD1 4.16Å; I176-I185 HydrophobicContact CD1-CD1 3.9Å; I176-I185 HydrophobicContact CG1-CD1 3.62Å; I176-I185 HydrophobicContact CG2-CD1 3.85Å
177	S	98.6	Very high	97.4	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	126.3	171.9	174	0	0	0	0	109	H179 V183 S184 P234	S177-H179 PolarHBondContact OG-CD2 3.19Å; S177-H179 VanDerWaalsContact OG-CD2 3.25Å; S177-H179 PolarHBondContact OG-NE2 2.91Å; S177-V183 VanDerWaalsContact O-CA 3.31Å; S177-V183 WeakPolarHBondContact O-CA 3.49Å; S177-S184 PolarHBondContact N-O 3.39Å; S177-S184 PolarHBondContact O-N 3.14Å; S177-P234 WeakPolarHBondContact CB-O 3.4Å; S177-P234 PolarHBondContact OG-O 3.28Å
178	V	98.3	Very high	97.3	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	99.1	-175.9	-177.1	0	0	0	0	108.4	E99 Y100 F144 I176 V183	E99-V178 CarbonylContact C-O 3.58Å; E99-V178 WeakPolarHBondContact CA-O 3.43Å; Y100-V178 HydrophobicContact CD1-CB 4.31Å; Y100-V178 HydrophobicContact CD1-CG1 4.38Å; Y100-V178 HydrophobicContact CD2-CB 4.46Å; Y100-V178 HydrophobicContact CD2-CG2 4.35Å; Y100-V178 HydrophobicContact CE1-CB 4.16Å; Y100-V178 HydrophobicContact CE1-CG1 3.93Å; Y100-V178 HydrophobicContact CE1-CG2 4.46Å; Y100-V178 HydrophobicContact CE2-CB 4.29Å; Y100-V178 HydrophobicContact CE2-CG2 3.86Å; Y100-V178 HydrophobicContact CG-CB 4.47Å; Y100-V178 PolarHBondContact N-O 2.89Å; Y100-V178 VanDerWaalsContact N-O 3.07Å; Y100-V178 WeakPolarHBondContact O-CA 3.36Å; Y100-V178 WeakPolarHBondContact O-CB 3.24Å; Y100-V178 PolarHBondContact O-N 3Å; F144-V178 HydrophobicContact CE2-CG2 4.01Å; F144-V178 HydrophobicContact CZ-CG1 3.96Å; F144-V178 HydrophobicContact CZ-CG2 4.24Å; I176-V178 HydrophobicContact CG2-CG2 3.82Å; V178-V183 HydrophobicContact CB-CG2 4.47Å; V178-V183 HydrophobicContact CG1-CG2 4.13Å; V178-V183 HydrophobicContact CG2-CG2 4.28Å
179	H	97.6	Very high	97.3	Very high	28 Å²	28	28 Å²	28	13%	0.13	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	167.3	171.2	-70.6	-88.4	0	0	0	110.9	E99 S177 D181 T182 R200 Y235	E99-H179 IonicContact OE1-ND1 2.76Å; S177-H179 PolarHBondContact OG-CD2 3.19Å; S177-H179 VanDerWaalsContact OG-CD2 3.25Å; S177-H179 PolarHBondContact OG-NE2 2.91Å; H179-D181 PolarHBondContact O-N 2.98Å; H179-D181 VanDerWaalsContact O-N 3.17Å; H179-T182 WeakPolarHBondContact CA-O 3.45Å; H179-T182 WeakPolarHBondContact CB-O 3.27Å; H179-T182 PolarHBondContact N-O 3.26Å; H179-T182 PolarHBondContact O-N 3.35Å; H179-R200 VanDerWaalsContact C-NH2 3.31Å; H179-R200 PolarHBondContact O-NH2 3.13Å; H179-Y235 AromaticContact CE1-CE1 3.6Å; H179-Y235 AromaticContact CE1-CE2 3.93Å; H179-Y235 AromaticContact CE1-CZ 3.52Å
180	S	95	Very high	97.3	Very high	67 Å²	67	26.5 Å²	26.5	47%	0.469	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.4	-42.2	-179	-61.6	0	0	0	0	113.3	E99	E99-S180 WeakPolarHBondContact CG-OG 3.19Å; E99-S180 PolarHBondContact OE1-N 2.8Å; E99-S180 PolarHBondContact OE1-OG 2.91Å
181	D	95.7	Very high	97.4	Very high	84 Å²	84	25.2 Å²	25.2	45%	0.449	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.1	5.1	-174.3	71.1	-12.2	0	0	0	113.9	H179 M196 T197	H179-D181 PolarHBondContact O-N 2.98Å; H179-D181 VanDerWaalsContact O-N 3.17Å; D181-M196 HydrophobicContact CB-CE 4.38Å; D181-M196 CarbonylContact O-C 3.53Å; D181-M196 VanDerWaalsContact O-CA 3.29Å; D181-M196 WeakPolarHBondContact O-CA 3.43Å; D181-T197 PolarHBondContact O-N 2.89Å; D181-T197 PolarHBondContact O-OG1 3.45Å
182	T	98.2	Very high	97.5	Very high	8 Å²	8	24.7 Å²	24.7	5%	0.049	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	142.5	-170.7	-52.9	0	0	0	0	112.4	H179 K194 K195 T197	H179-T182 WeakPolarHBondContact CA-O 3.45Å; H179-T182 WeakPolarHBondContact CB-O 3.27Å; H179-T182 PolarHBondContact N-O 3.26Å; H179-T182 PolarHBondContact O-N 3.35Å; T182-K194 HydrophobicContact CG2-CD 3.9Å; T182-K194 HydrophobicContact CG2-CG 3.47Å; T182-K194 VanDerWaalsContact CG2-CG 3.47Å; T182-K195 WeakPolarHBondContact CA-O 3.48Å; T182-K195 WeakPolarHBondContact CG2-O 3.46Å; T182-T197 PolarHBondContact N-OG1 2.9Å
183	V	98.7	Very high	97.6	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	131.2	165.8	175.3	0	0	0	0	110.6	F144 F158 I176 S177 V178 I185 K194 K195 T197	F144-V183 HydrophobicContact CB-CG1 4.37Å; F144-V183 HydrophobicContact CD1-CB 4.46Å; F144-V183 HydrophobicContact CD1-CG1 4.39Å; F144-V183 HydrophobicContact CD1-CG2 3.7Å; F144-V183 HydrophobicContact CE1-CG2 3.68Å; F144-V183 HydrophobicContact CG-CG1 4.27Å; F144-V183 HydrophobicContact CG-CG2 4.32Å; F144-V183 HydrophobicContact CZ-CG2 4.26Å; F158-V183 HydrophobicContact CE2-CG1 4.12Å; F158-V183 HydrophobicContact CZ-CB 4.02Å; F158-V183 HydrophobicContact CZ-CG1 3.66Å; I176-V183 HydrophobicContact CG2-CG1 3.9Å; S177-V183 VanDerWaalsContact O-CA 3.31Å; S177-V183 WeakPolarHBondContact O-CA 3.49Å; V178-V183 HydrophobicContact CB-CG2 4.47Å; V178-V183 HydrophobicContact CG1-CG2 4.13Å; V178-V183 HydrophobicContact CG2-CG2 4.28Å; V183-I185 HydrophobicContact CG1-CD1 4.42Å; V183-K194 WeakPolarHBondContact O-CA 3.21Å; V183-K195 PolarHBondContact N-O 3.07Å; V183-K195 PolarHBondContact O-N 3.47Å; V183-T197 HydrophobicContact CB-CG2 4.09Å; V183-T197 HydrophobicContact CG2-CG2 3.66Å
184	S	98.8	Very high	97.6	Very high	4 Å²	4	32.2 Å²	32.2	3%	0.028	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	135	177.3	-56.5	0	0	0	0	110.4	I176 S177 K194	I176-S184 CarbonylContact C-O 3.53Å; I176-S184 WeakPolarHBondContact CA-O 3.21Å; S177-S184 PolarHBondContact N-O 3.39Å; S177-S184 PolarHBondContact O-N 3.14Å; S184-K194 WeakPolarHBondContact OG-CG 3.33Å
185	I	98.6	Very high	97.6	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	131.2	176.1	-56.6	-63.6	0	0	0	109.6	V142 F158 L163 L174 G175 I176 V183 A192 E193	V142-I185 HydrophobicContact CG1-CD1 4.2Å; F158-I185 HydrophobicContact CB-CG1 4.1Å; F158-I185 HydrophobicContact CD1-CB 4.35Å; F158-I185 HydrophobicContact CD1-CG1 3.52Å; F158-I185 HydrophobicContact CD2-CD1 4.1Å; F158-I185 HydrophobicContact CD2-CG1 3.64Å; F158-I185 HydrophobicContact CE1-CG1 3.72Å; F158-I185 HydrophobicContact CE2-CD1 4.09Å; F158-I185 HydrophobicContact CE2-CG1 3.86Å; F158-I185 HydrophobicContact CG-CD1 4.41Å; F158-I185 HydrophobicContact CG-CG1 3.47Å; F158-I185 VanDerWaalsContact CG-CG1 3.47Å; F158-I185 HydrophobicContact CZ-CD1 4.37Å; F158-I185 HydrophobicContact CZ-CG1 3.9Å; L163-I185 HydrophobicContact CD2-CG2 3.76Å; L174-I185 HydrophobicContact CD1-CG2 3.6Å; G175-I185 WeakPolarHBondContact O-CA 3.49Å; I176-I185 HydrophobicContact CB-CD1 4.16Å; I176-I185 HydrophobicContact CD1-CD1 3.9Å; I176-I185 HydrophobicContact CG1-CD1 3.62Å; I176-I185 HydrophobicContact CG2-CD1 3.85Å; V183-I185 HydrophobicContact CG1-CD1 4.42Å; I185-A192 WeakPolarHBondContact O-CB 3.23Å; I185-A192 PolarHBondContact O-N 3.33Å; I185-E193 PolarHBondContact N-O 3.37Å; I185-E193 PolarHBondContact O-N 3.09Å
186	Y	98.5	Very high	97.6	Very high	15 Å²	15	41.3 Å²	41.3	6%	0.059	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	134.7	176.9	-57	-103	0	0	0	109.1	G175 T190 L191 A237 E238	G175-Y186 PolarHBondContact N-O 3.29Å; G175-Y186 PolarHBondContact O-N 3.1Å; Y186-T190 CarbonylContact C-O 3.36Å; Y186-T190 WeakPolarHBondContact CA-O 3.47Å; Y186-L191 HydrophobicContact CD1-CB 4.02Å; Y186-L191 HydrophobicContact CD1-CD1 4.3Å; Y186-L191 HydrophobicContact CE1-CB 3.89Å; Y186-L191 HydrophobicContact CE1-CD1 3.9Å; Y186-L191 HydrophobicContact CE1-CG 4.48Å; Y186-L191 HydrophobicContact CE2-CD1 4.27Å; Y186-A237 HydrophobicContact CD2-CB 4.37Å; Y186-E238 HydrophobicContact CE1-CB 3.94Å; Y186-E238 HydrophobicContact CE1-CG 3.95Å; Y186-E238 PolarHBondContact OH-OE2 3.26Å
187	V	97.9	Very high	97.5	Very high	8 Å²	8	41.9 Å²	41.9	5%	0.048	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	127	171.7	179.1	0	0	0	0	107.5	L163 A165 L166 K173 C189 T190 A192	L163-V187 HydrophobicContact CD2-CG2 3.65Å; L163-V187 HydrophobicContact CG-CG2 4.49Å; A165-V187 HydrophobicContact CB-CG1 4.33Å; L166-V187 HydrophobicContact CD1-CG2 4.38Å; L166-V187 HydrophobicContact CD2-CG1 4.18Å; L166-V187 HydrophobicContact CG-CG1 4.48Å; L166-V187 HydrophobicContact CG-CG2 4.43Å; K173-V187 WeakPolarHBondContact O-CA 3.38Å; V187-C189 PolarHBondContact O-N 3.42Å; V187-T190 PolarHBondContact N-O 2.81Å; V187-T190 PolarHBondContact O-N 2.79Å; V187-A192 HydrophobicContact CG2-CB 4.14Å
188	D	96.1	Very high	97.4	Very high	51 Å²	51	46 Å²	46	27%	0.273	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.7	48.3	-178.2	-56.9	-27.3	0	0	0	111.3	H172 K173 T190 C242 L245	H172-D188 VanDerWaalsContact CA-OD1 3.29Å; H172-D188 WeakPolarHBondContact CA-OD1 2.9Å; H172-D188 IonicContact CE1-OD2 3.86Å; H172-D188 IonicContact CG-OD1 3.44Å; H172-D188 IonicContact CG-OD2 2.67Å; H172-D188 IonicContact ND1-OD1 3.49Å; H172-D188 PolarHBondContact ND1-OD1 2.64Å; H172-D188 IonicContact ND1-OD2 2.7Å; H172-D188 PolarHBondContact ND1-OD2 2.89Å; K173-D188 PolarHBondContact N-OD1 3.38Å; K173-D188 PolarHBondContact O-N 2.01Å; D188-T190 PolarHBondContact O-N 3.14Å; D188-T190 VanDerWaalsContact O-N 3.14Å; D188-C242 WeakPolarHBondContact CA-SG 3.29Å; D188-L245 HydrophobicContact CB-CD1 4.38Å; D188-L245 WeakPolarHBondContact OD1-CD1 3.29Å
189	C	94.9	Very high	97.2	Very high	37 Å²	37	52 Å²	52	25%	0.25	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	64	14.7	176.4	-53.4	0	0	0	0	115	V187 E240 N241 C242	V187-C189 PolarHBondContact O-N 3.42Å; C189-E240 WeakPolarHBondContact CB-O 3.34Å; C189-E240 PolarHBondContact SG-O 3.03Å; C189-N241 PolarHBondContact SG-O 3.24Å; C189-C242 HydrophobicContact CB-CB 3.88Å; C189-C242 WeakPolarHBondContact CB-SG 2.78Å; C189-C242 PolarHBondContact N-SG 3.08Å; C189-C242 WeakPolarHBondContact SG-CA 2.85Å; C189-C242 WeakPolarHBondContact SG-CB 3.19Å; C189-C242 PolarHBondContact SG-N 2.91Å; C189-C242 CovalentContact SG-SG 2.03Å; C189-C242 PolarHBondContact SG-SG 2.94Å
190	T	95.4	Very high	97	Very high	95 Å²	95	52 Å²	52	58%	0.583	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.6	134.5	173.9	-55	0	0	0	0	109.6	Y186 V187 D188 A192	Y186-T190 CarbonylContact C-O 3.36Å; Y186-T190 WeakPolarHBondContact CA-O 3.47Å; V187-T190 PolarHBondContact N-O 2.81Å; V187-T190 PolarHBondContact O-N 2.79Å; D188-T190 PolarHBondContact O-N 3.14Å; D188-T190 VanDerWaalsContact O-N 3.14Å; T190-A192 PolarHBondContact O-N 3.02Å
191	L	97.8	Very high	96.9	Very high	86 Å²	86	50.6 Å²	50.6	45%	0.45	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	118	175	178.1	67	0	0	0	109.9	Y186	Y186-L191 HydrophobicContact CD1-CB 4.02Å; Y186-L191 HydrophobicContact CD1-CD1 4.3Å; Y186-L191 HydrophobicContact CE1-CB 3.89Å; Y186-L191 HydrophobicContact CE1-CD1 3.9Å; Y186-L191 HydrophobicContact CE1-CG 4.48Å; Y186-L191 HydrophobicContact CE2-CD1 4.27Å
192	A	98.1	Very high	96.7	Very high	13 Å²	13	49.6 Å²	49.6	11%	0.107	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	-46.8	179.2	0	0	0	0	0	111.9	D162 I185 V187 T190	D162-A192 HydrophobicContact CB-CB 3.91Å; I185-A192 WeakPolarHBondContact O-CB 3.23Å; I185-A192 PolarHBondContact O-N 3.33Å; V187-A192 HydrophobicContact CG2-CB 4.14Å; T190-A192 PolarHBondContact O-N 3.02Å
193	E	98.4	Very high	96.5	Very high	46 Å²	46	50.5 Å²	50.5	22%	0.215	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.7	148.1	-178.3	-171.4	176.3	171.4	0	0	111.1	F158 K159 S160 I185 K195	F158-E193 VanDerWaalsContact CA-OE2 3.24Å; F158-E193 WeakPolarHBondContact CA-OE2 3.4Å; F158-E193 HydrophobicContact CD1-CB 3.83Å; F158-E193 HydrophobicContact CD1-CG 3.77Å; F158-E193 HydrophobicContact CE1-CG 4.49Å; K159-E193 PolarHBondContact N-OE2 3.3Å; S160-E193 PolarHBondContact N-OE2 3.17Å; I185-E193 PolarHBondContact N-O 3.37Å; I185-E193 PolarHBondContact O-N 3.09Å; E193-K195 WeakPolarHBondContact OE1-CE 3.42Å; E193-K195 IonicContact OE1-NZ 3.53Å; E193-K195 PolarHBondContact OE1-NZ 2.81Å
194	K	98.4	Very high	96.2	Very high	129 Å²	129	53.4 Å²	53.4	56%	0.561	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.1	139.7	179	178.8	174.4	-179.1	176	0	110	T182 V183 S184	T182-K194 HydrophobicContact CG2-CD 3.9Å; T182-K194 HydrophobicContact CG2-CG 3.47Å; T182-K194 VanDerWaalsContact CG2-CG 3.47Å; V183-K194 WeakPolarHBondContact O-CA 3.21Å; S184-K194 WeakPolarHBondContact OG-CG 3.33Å
195	K	98.6	Very high	96	Very high	60 Å²	60	55 Å²	55	26%	0.261	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	137.8	179	-68.7	179.7	-167.6	-76.2	0	111.7	T157 F158 T182 V183 E193	T157-K195 WeakPolarHBondContact O-CE 3.44Å; T157-K195 PolarHBondContact O-NZ 2.68Å; F158-K195 HydrophobicContact CD1-CD 3.98Å; F158-K195 HydrophobicContact CD1-CG 4.17Å; F158-K195 HydrophobicContact CE1-CB 3.97Å; F158-K195 HydrophobicContact CE1-CD 3.67Å; F158-K195 HydrophobicContact CE1-CG 3.64Å; F158-K195 HydrophobicContact CE2-CD 4.45Å; F158-K195 HydrophobicContact CZ-CB 4.16Å; F158-K195 HydrophobicContact CZ-CD 3.92Å; F158-K195 HydrophobicContact CZ-CG 4.17Å; T182-K195 WeakPolarHBondContact CA-O 3.48Å; T182-K195 WeakPolarHBondContact CG2-O 3.46Å; V183-K195 PolarHBondContact N-O 3.07Å; V183-K195 PolarHBondContact O-N 3.47Å; E193-K195 WeakPolarHBondContact OE1-CE 3.42Å; E193-K195 IonicContact OE1-NZ 3.53Å; E193-K195 PolarHBondContact OE1-NZ 2.81Å
196	M	98.4	Very high	95.9	Very high	134 Å²	134	59.7 Å²	59.7	66%	0.66	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.8	145.1	167.2	-57.6	-59.5	-72.7	0	0	109.9	Y156 D181	Y156-M196 WeakPolarHBondContact CE1-O 3.4Å; D181-M196 HydrophobicContact CB-CE 4.38Å; D181-M196 CarbonylContact O-C 3.53Å; D181-M196 VanDerWaalsContact O-CA 3.29Å; D181-M196 WeakPolarHBondContact O-CA 3.43Å
197	T	96.8	Very high	95.8	Very high	15 Å²	15	59.2 Å²	59.2	9%	0.092	31%	0.311	C	S	.	.			trans	-128.3	147.8	179	62.3	0	0	0	0	111.2	Y156 D181 T182 V183	Y156-T197 HydrophobicContact CD1-CG2 4.08Å; Y156-T197 HydrophobicContact CD2-CG2 3.96Å; Y156-T197 HydrophobicContact CE1-CG2 3.8Å; Y156-T197 HydrophobicContact CE2-CG2 3.66Å; Y156-T197 HydrophobicContact CG-CG2 4.15Å; Y156-T197 WeakPolarHBondContact OH-CA 3.21Å; Y156-T197 WeakPolarHBondContact OH-CB 3.39Å; D181-T197 PolarHBondContact O-N 2.89Å; D181-T197 PolarHBondContact O-OG1 3.45Å; T182-T197 PolarHBondContact N-OG1 2.9Å; V183-T197 HydrophobicContact CB-CG2 4.09Å; V183-T197 HydrophobicContact CG2-CG2 3.66Å
198	D	95.9	Very high	95.8	Very high	85 Å²	85	64 Å²	64	46%	0.455	33%	0.328	S	S	.	.			trans	-65.9	163.2	167.2	-60.9	-77.7	0	0	0	112	F154 Y156 R200	F154-D198 HydrophobicContact CD1-CB 4.16Å; F154-D198 WeakPolarHBondContact CD1-OD2 3.28Å; F154-D198 HydrophobicContact CD2-CB 3.88Å; F154-D198 HydrophobicContact CE1-CB 3.76Å; F154-D198 WeakPolarHBondContact CE1-OD2 3.3Å; F154-D198 HydrophobicContact CE2-CB 3.43Å; F154-D198 VanDerWaalsContact CE2-CB 3.43Å; F154-D198 HydrophobicContact CG-CB 4.2Å; F154-D198 HydrophobicContact CZ-CB 3.33Å; Y156-D198 PolarHBondContact OH-N 2.89Å; Y156-D198 PolarHBondContact OH-OD2 3.48Å; D198-R200 WeakPolarHBondContact O-CG 3.24Å
199	E	93.9	Very high	96	Very high	127 Å²	127	61.6 Å²	61.6	59%	0.593	32%	0.315	S	S	*	.			trans	-62.3	137.9	176.6	-168.2	174.6	-169.8	0	0	111.8	G148 L149	G148-E199 WeakPolarHBondContact CA-O 3.43Å; L149-E199 HydrophobicContact CD1-CG 3.98Å; L149-E199 WeakPolarHBondContact CD1-OE2 3.27Å; L149-E199 HydrophobicContact CD2-CG 4.45Å; L149-E199 HydrophobicContact CG-CG 4.1Å
200	R	93.5	Very high	96.1	Very high	27 Å²	27	60.5 Å²	60.5	10%	0.102	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-116.3	141.3	-169.7	-58.5	175.5	-75.8	117.5	2.9	109.9	N98 S146 Q147 H179 D198	N98-R200 PolarHBondContact O-NH1 3.23Å; N98-R200 VanDerWaalsContact O-NH1 3.07Å; N98-R200 PolarHBondContact O-NH2 2.87Å; S146-R200 VanDerWaalsContact OG-CD 3.24Å; S146-R200 WeakPolarHBondContact OG-CD 3.49Å; S146-R200 WeakPolarHBondContact OG-CG 3.46Å; Q147-R200 WeakPolarHBondContact O-CA 3.18Å; H179-R200 VanDerWaalsContact C-NH2 3.31Å; H179-R200 PolarHBondContact O-NH2 3.13Å; D198-R200 WeakPolarHBondContact O-CG 3.24Å
201	D	92.6	Very high	96.3	Very high	39 Å²	39	56.1 Å²	56.1	21%	0.209	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-79.8	157.3	173.6	-164.7	8.2	0	0	0	110.9	Q147 L149 K151	Q147-D201 PolarHBondContact O-N 2.79Å; L149-D201 HydrophobicContact CD2-CB 4.22Å; K151-D201 WeakPolarHBondContact CE-OD2 2.91Å; K151-D201 IonicContact NZ-OD2 3.73Å; K151-D201 PolarHBondContact NZ-OD2 2.84Å
202	S	91.7	Very high	96.3	Very high	63 Å²	63	52.2 Å²	52.2	44%	0.441	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-64.1	154.2	169	63.1	0	0	0	0	111.6
203	I	92.9	Very high	96.3	Very high	26 Å²	26	52.1 Å²	52.1	13%	0.133	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-82.3	136.7	178.1	60.7	163	0	0	0	112	T88 L96 I122 V131 L205	T88-I203 HydrophobicContact CG2-CD1 4.42Å; L96-I203 HydrophobicContact CB-CD1 3.5Å; L96-I203 VanDerWaalsContact CB-CD1 3.5Å; L96-I203 HydrophobicContact CB-CG1 4.18Å; L96-I203 HydrophobicContact CD2-CD1 4.45Å; I122-I203 HydrophobicContact CD1-CD1 3.64Å; I122-I203 HydrophobicContact CD1-CG2 4.48Å; V131-I203 HydrophobicContact CG2-CG2 3.86Å; I203-L205 HydrophobicContact CD1-CD2 3.62Å; I203-L205 HydrophobicContact CG1-CD2 3.87Å
204	D	92.8	Very high	96.3	Very high	62 Å²	62	52.6 Å²	52.6	33%	0.332	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-78.3	121.3	163.7	-179	7.9	0	0	0	110.3	Q130 N206	Q130-D204 PolarHBondContact NE2-O 2.95Å; D204-N206 VanDerWaalsContact C-N 3.3Å; D204-N206 PolarHBondContact O-N 3.27Å; D204-N206 WeakPolarHBondContact OD1-CB 3.3Å; D204-N206 VanDerWaalsContact OD1-CG 3.3Å; D204-N206 PolarHBondContact OD1-N 2.63Å; D204-N206 PolarHBondContact OD1-ND2 2.89Å
205	L	94.8	Very high	96.3	Very high	37 Å²	37	48.1 Å²	48.1	19%	0.194	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-9.4	-177.4	-52	-178.7	0	0	0	113.8	T88 K89 F92 I203 G207	T88-L205 HydrophobicContact CG2-CD2 4.02Å; K89-L205 HydrophobicContact CB-CB 4.38Å; K89-L205 PolarHBondContact N-O 3.49Å; F92-L205 HydrophobicContact CB-CD2 4.48Å; I203-L205 HydrophobicContact CD1-CD2 3.62Å; I203-L205 HydrophobicContact CG1-CD2 3.87Å; L205-G207 PolarHBondContact O-N 3.42Å
206	N	96.1	Very high	96.2	Very high	99 Å²	99	51 Å²	51	53%	0.529	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-9.6	-176.6	-70.7	-46.8	0	0	0	113.6	Q125 D204	Q125-N206 HydrophobicContact CG-CB 3.92Å; Q125-N206 WeakPolarHBondContact CG-O 3.47Å; Q125-N206 PolarHBondContact NE2-O 3.17Å; Q125-N206 VanDerWaalsContact NE2-O 3.11Å; D204-N206 VanDerWaalsContact C-N 3.3Å; D204-N206 PolarHBondContact O-N 3.27Å; D204-N206 WeakPolarHBondContact OD1-CB 3.3Å; D204-N206 VanDerWaalsContact OD1-CG 3.3Å; D204-N206 PolarHBondContact OD1-N 2.63Å; D204-N206 PolarHBondContact OD1-ND2 2.89Å
207	G	97.2	Very high	96.1	Very high	4 Å²	4	47.9 Å²	47.9	4%	0.041	24%	0.241	C	C	.	.	S	Bend	trans	-88.7	-149	179.2	0	0	0	0	0	115.1	T88 F123 L205	T88-G207 PolarHBondContact N-O 2.95Å; T88-G207 VanDerWaalsContact N-O 3.07Å; T88-G207 PolarHBondContact OG1-O 2.87Å; F123-G207 CarbonylContact O-C 3.4Å; F123-G207 WeakPolarHBondContact O-CA 3.25Å; L205-G207 PolarHBondContact O-N 3.42Å
208	R	98.4	Very high	96.1	Very high	110 Å²	110	49.5 Å²	49.5	42%	0.415	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	152.1	-178	-52.6	-175.6	74.7	118.7	0.2	111.3	I85 K86 T88 F123	I85-R208 HydrophobicContact CD1-CB 4.01Å; I85-R208 HydrophobicContact CG1-CB 4.05Å; K86-R208 WeakPolarHBondContact O-CA 3.49Å; T88-R208 VanDerWaalsContact OG1-CA 3.23Å; T88-R208 WeakPolarHBondContact OG1-CA 3.44Å; T88-R208 PolarHBondContact OG1-N 3.3Å; T88-R208 PolarHBondContact OG1-O 3.29Å; F123-R208 WeakPolarHBondContact CD1-O 3.36Å; F123-R208 HydrophobicContact CE1-CB 3.94Å; F123-R208 HydrophobicContact CE2-CB 3.9Å; F123-R208 HydrophobicContact CE2-CG 4.27Å; F123-R208 HydrophobicContact CZ-CB 3.61Å; F123-R208 HydrophobicContact CZ-CG 4.3Å; F123-R208 PolarHBondContact N-O 3.02Å; F123-R208 PolarHBondContact O-N 2.8Å
209	T	98.6	Very high	96.2	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	136.2	175.8	-54.7	0	0	0	0	108.9	F63 I85 K86 T88 I91 F92 W120 Q121 I122	F63-T209 HydrophobicContact CE2-CG2 4.48Å; F63-T209 HydrophobicContact CZ-CG2 4.14Å; I85-T209 CarbonylContact C-O 3.52Å; I85-T209 WeakPolarHBondContact CA-O 3.23Å; K86-T209 PolarHBondContact N-O 3.42Å; K86-T209 PolarHBondContact O-N 2.94Å; T88-T209 WeakPolarHBondContact CA-OG1 2.92Å; T88-T209 WeakPolarHBondContact CB-OG1 3.49Å; T88-T209 PolarHBondContact OG1-N 2.84Å; T88-T209 PolarHBondContact OG1-OG1 3.04Å; I91-T209 HydrophobicContact CD1-CG2 3.83Å; F92-T209 HydrophobicContact CE2-CG2 4.16Å; W120-T209 VanDerWaalsContact NE1-CG2 3.31Å; Q121-T209 CarbonylContact O-C 3.58Å; Q121-T209 WeakPolarHBondContact O-CA 3Å; Q121-T209 WeakPolarHBondContact O-CG2 3.25Å; I122-T209 HydrophobicContact CG1-CG2 4.05Å
210	L	98.6	Very high	96.3	Very high	14 Å²	14	48.5 Å²	48.5	7%	0.073	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	161	175.4	63.2	71.6	0	0	0	112.3	L84 I85 Y118 W120 Q121 F123 T213	L84-L210 WeakPolarHBondContact O-CA 3.3Å; L84-L210 WeakPolarHBondContact O-CB 3.36Å; I85-L210 HydrophobicContact CB-CB 4.03Å; I85-L210 HydrophobicContact CG1-CB 4.15Å; Y118-L210 HydrophobicContact CD2-CD1 4.25Å; Y118-L210 HydrophobicContact CG-CD1 4.13Å; W120-L210 WeakPolarHBondContact CA-O 3.44Å; Q121-L210 HydrophobicContact CB-CD1 3.7Å; Q121-L210 HydrophobicContact CB-CG 4.1Å; Q121-L210 PolarHBondContact N-O 3.06Å; Q121-L210 PolarHBondContact O-N 3.43Å; F123-L210 HydrophobicContact CE1-CD2 3.84Å; F123-L210 HydrophobicContact CE1-CG 4.22Å; L210-T213 HydrophobicContact CD2-CG2 4.2Å
211	I	98.6	Very high	96.5	Very high	2 Å²	2	47.2 Å²	47.2	1%	0.01	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	160.2	169.7	62.2	169.7	0	0	0	110	L59 F63 L84 L119 W120 T213 I228	L59-I211 HydrophobicContact CD2-CG2 4.43Å; F63-I211 HydrophobicContact CB-CD1 3.82Å; F63-I211 HydrophobicContact CB-CG1 4.5Å; F63-I211 HydrophobicContact CD1-CD1 4.39Å; F63-I211 HydrophobicContact CD1-CG1 4.18Å; F63-I211 HydrophobicContact CD2-CD1 3.69Å; F63-I211 HydrophobicContact CD2-CG1 4Å; F63-I211 HydrophobicContact CD2-CG2 4.1Å; F63-I211 HydrophobicContact CE1-CG1 4.39Å; F63-I211 HydrophobicContact CE2-CD1 4.34Å; F63-I211 HydrophobicContact CE2-CG1 4.22Å; F63-I211 HydrophobicContact CE2-CG2 3.7Å; F63-I211 HydrophobicContact CG-CD1 3.71Å; F63-I211 HydrophobicContact CG-CG1 3.97Å; F63-I211 HydrophobicContact CZ-CG1 4.4Å; F63-I211 HydrophobicContact CZ-CG2 4.15Å; L84-I211 HydrophobicContact CB-CD1 4.35Å; L84-I211 HydrophobicContact CB-CG1 3.61Å; L84-I211 HydrophobicContact CD1-CD1 3.89Å; L84-I211 HydrophobicContact CD1-CG1 3.85Å; L84-I211 HydrophobicContact CG-CG1 4.39Å; L84-I211 PolarHBondContact O-N 2.93Å; L119-I211 VanDerWaalsContact O-CA 3.28Å; L119-I211 WeakPolarHBondContact O-CA 3.39Å; L119-I211 VanDerWaalsContact O-CB 3.3Å; L119-I211 WeakPolarHBondContact O-CB 3.3Å; W120-I211 HydrophobicContact CB-CG2 4.33Å; I211-T213 VanDerWaalsContact C-N 3.31Å; I211-T213 PolarHBondContact O-N 3.46Å; I211-T213 PolarHBondContact O-OG1 3.19Å; I211-T213 VanDerWaalsContact O-OG1 3.08Å; I211-I228 HydrophobicContact CD1-CG2 4.46Å; I211-I228 HydrophobicContact CG2-CD1 4.08Å
212	S	98.1	Very high	96.7	Very high	4 Å²	4	46.7 Å²	46.7	3%	0.028	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	53.2	42.1	169.5	-179.7	0	0	0	0	114.2	Y118 L119 V221	Y118-S212 WeakPolarHBondContact O-CA 3.36Å; Y118-S212 PolarHBondContact O-N 2.87Å; L119-S212 PolarHBondContact O-N 2.71Å; S212-V221 PolarHBondContact O-N 3.28Å; S212-V221 PolarHBondContact OG-O 3.22Å
213	T	98.5	Very high	97	Very high	11 Å²	11	43.8 Å²	43.8	7%	0.067	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	129.5	-175.9	-59	0	0	0	0	111.1	W117 Y118 L210 I211 G218	W117-T213 CarbonylContact C-O 3.52Å; W117-T213 WeakPolarHBondContact CA-O 3.37Å; W117-T213 WeakPolarHBondContact CB-O 3.34Å; Y118-T213 PolarHBondContact N-O 2.03Å; Y118-T213 PolarHBondContact O-N 3.25Å; Y118-T213 VanDerWaalsContact O-N 3.16Å; L210-T213 HydrophobicContact CD2-CG2 4.2Å; I211-T213 VanDerWaalsContact C-N 3.31Å; I211-T213 PolarHBondContact O-N 3.46Å; I211-T213 PolarHBondContact O-OG1 3.19Å; I211-T213 VanDerWaalsContact O-OG1 3.08Å; T213-G218 WeakPolarHBondContact CG2-O 3.4Å
214	R	98.3	Very high	97.2	Very high	57 Å²	57	44 Å²	44	22%	0.215	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	138	-179.5	-173.6	176.5	-59.3	143.6	-5	110.7	D115 E216 D217 G218 R219 V221	D115-R214 IonicContact OD2-CZ 3.26Å; D115-R214 VanDerWaalsContact OD2-CZ 3.23Å; D115-R214 IonicContact OD2-NE 2.71Å; D115-R214 PolarHBondContact OD2-NE 2.78Å; D115-R214 IonicContact OD2-NH2 2.67Å; D115-R214 PolarHBondContact OD2-NH2 2.8Å; R214-E216 WeakPolarHBondContact CD-OE2 3.21Å; R214-E216 HydrophobicContact CG-CB 4.44Å; R214-E216 WeakPolarHBondContact CG-OE2 3.44Å; R214-D217 WeakPolarHBondContact CB-OD1 3.25Å; R214-D217 WeakPolarHBondContact CD-OD1 3.19Å; R214-D217 IonicContact NH1-OD1 2.68Å; R214-D217 IonicContact NH1-OD2 3.47Å; R214-D217 PolarHBondContact NH1-OD2 2.71Å; R214-G218 VanDerWaalsContact O-CA 3.3Å; R214-G218 WeakPolarHBondContact O-CA 3.42Å; R214-G218 PolarHBondContact O-N 2.75Å; R214-G218 VanDerWaalsContact O-N 3.09Å; R214-R219 WeakPolarHBondContact CB-O 2.85Å; R214-R219 PolarHBondContact N-O 3.21Å; R214-V221 HydrophobicContact CB-CG2 3.75Å
215	V	98	Very high	97.4	Very high	34 Å²	34	41.3 Å²	41.3	21%	0.206	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-35.3	-176	-175.7	0	0	0	0	111.7	R116 Y118 V134	R116-V215 HydrophobicContact CG-CB 4.5Å; R116-V215 HydrophobicContact CG-CG2 4.1Å; R116-V215 WeakPolarHBondContact O-CG2 3.44Å; R116-V215 PolarHBondContact O-N 3.26Å; Y118-V215 HydrophobicContact CD1-CG2 4.34Å; Y118-V215 HydrophobicContact CD2-CG2 3.88Å; Y118-V215 HydrophobicContact CE1-CG2 4.15Å; Y118-V215 HydrophobicContact CE2-CB 4.09Å; Y118-V215 HydrophobicContact CE2-CG1 3.99Å; Y118-V215 HydrophobicContact CE2-CG2 3.69Å; Y118-V215 HydrophobicContact CG-CG2 4.2Å; V134-V215 HydrophobicContact CG1-CG2 4.22Å; V134-V215 HydrophobicContact CG2-CG2 4.38Å
216	E	96.3	Very high	97.4	Very high	120 Å²	120	40.7 Å²	40.7	56%	0.561	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-41.3	-172.8	-66.6	70.8	-152.5	0	0	113.7	R116 R214	R116-E216 WeakPolarHBondContact CB-OE1 3.03Å; R116-E216 VanDerWaalsContact O-OE2 3.13Å; R214-E216 WeakPolarHBondContact CD-OE2 3.21Å; R214-E216 HydrophobicContact CG-CB 4.44Å; R214-E216 WeakPolarHBondContact CG-OE2 3.44Å
217	D	96.2	Very high	97.3	Very high	70 Å²	70	36.7 Å²	36.7	37%	0.374	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-130.2	0.4	-168.7	65	10.2	0	0	0	113.9	R214 R219	R214-D217 WeakPolarHBondContact CB-OD1 3.25Å; R214-D217 WeakPolarHBondContact CD-OD1 3.19Å; R214-D217 IonicContact NH1-OD1 2.68Å; R214-D217 IonicContact NH1-OD2 3.47Å; R214-D217 PolarHBondContact NH1-OD2 2.71Å; D217-R219 HydrophobicContact CB-CG 4.3Å; D217-R219 PolarHBondContact O-N 2.67Å; D217-R219 VanDerWaalsContact OD1-CB 3.25Å; D217-R219 WeakPolarHBondContact OD1-CB 3.28Å; D217-R219 WeakPolarHBondContact OD1-CG 3.23Å; D217-R219 PolarHBondContact OD1-N 2.66Å; D217-R219 WeakPolarHBondContact OD2-CD 3.4Å; D217-R219 IonicContact OD2-NE 3.07Å
218	G	96.8	Very high	97.4	Very high	48 Å²	48	36.6 Å²	36.6	50%	0.495	18%	0.179	S	C	.	.			trans	67.2	12.5	-178.6	0	0	0	0	0	114.4	T213 R214	T213-G218 WeakPolarHBondContact CG2-O 3.4Å; R214-G218 VanDerWaalsContact O-CA 3.3Å; R214-G218 WeakPolarHBondContact O-CA 3.42Å; R214-G218 PolarHBondContact O-N 2.75Å; R214-G218 VanDerWaalsContact O-N 3.09Å
219	R	97.4	Very high	97.3	Very high	161 Å²	161	31.5 Å²	31.5	61%	0.608	16%	0.16	S	C	*	.	P	Polyproline II helix	trans	-82.3	152.2	-179.1	-64.9	-176.3	-177.5	179.9	0.2	111.8	R214 D217	R214-R219 WeakPolarHBondContact CB-O 2.85Å; R214-R219 PolarHBondContact N-O 3.21Å; D217-R219 HydrophobicContact CB-CG 4.3Å; D217-R219 PolarHBondContact O-N 2.67Å; D217-R219 VanDerWaalsContact OD1-CB 3.25Å; D217-R219 WeakPolarHBondContact OD1-CB 3.28Å; D217-R219 WeakPolarHBondContact OD1-CG 3.23Å; D217-R219 PolarHBondContact OD1-N 2.66Å; D217-R219 WeakPolarHBondContact OD2-CD 3.4Å; D217-R219 IonicContact OD2-NE 3.07Å
220	P	97.8	Very high	97.3	Very high	31 Å²	31	31.5 Å²	31.5	20%	0.201	16%	0.16	C	C	.	.	B	Isolated β-bridge	trans	-62.2	141.5	172.9	-20.7	33.8	0	0	0	111.6	P83	P83-P220 HydrophobicContact CB-CG 4.44Å; P83-P220 HydrophobicContact CG-CG 4.01Å; P83-P220 VanDerWaalsContact N-CG 3.35Å
221	V	97.3	Very high	97.2	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.156	C	C	.	.	P	Polyproline II helix	trans	-97.9	131.8	-179.5	-177	0	0	0	0	109.5	G80 T112 W117 S212 R214 I223	G80-V221 WeakPolarHBondContact CA-O 3.43Å; G80-V221 PolarHBondContact N-O 2.96Å; T112-V221 HydrophobicContact CG2-CG1 3.45Å; T112-V221 VanDerWaalsContact CG2-CG1 3.45Å; W117-V221 HydrophobicContact CB-CB 4.5Å; W117-V221 HydrophobicContact CB-CG2 3.54Å; W117-V221 HydrophobicContact CD2-CG1 4.36Å; W117-V221 HydrophobicContact CG-CB 4.5Å; W117-V221 HydrophobicContact CG-CG1 4.2Å; W117-V221 HydrophobicContact CG-CG2 4.01Å; S212-V221 PolarHBondContact O-N 3.28Å; S212-V221 PolarHBondContact OG-O 3.22Å; R214-V221 HydrophobicContact CB-CG2 3.75Å; V221-I223 HydrophobicContact CG1-CG2 3.83Å; V221-I223 PolarHBondContact O-N 2.85Å; V221-I223 VanDerWaalsContact O-N 3.13Å
222	D	97.2	Very high	97.1	Very high	28 Å²	28	31.5 Å²	31.5	15%	0.15	16%	0.161	C	C	.	.			trans	-76.4	91.8	176.5	-177.1	29.5	0	0	0	110.7	R78 R109 T111 T112	R78-D222 IonicContact CZ-OD1 2.85Å; R78-D222 IonicContact NE-OD1 2.75Å; R78-D222 PolarHBondContact NE-OD1 2.82Å; R78-D222 IonicContact NH2-OD1 3.23Å; R78-D222 PolarHBondContact NH2-OD1 2.86Å; R78-D222 IonicContact NH2-OD2 2.96Å; R109-D222 WeakPolarHBondContact CB-O 3.34Å; R109-D222 VanDerWaalsContact CD-CG 3.47Å; R109-D222 WeakPolarHBondContact CD-OD1 2.99Å; R109-D222 WeakPolarHBondContact CD-OD2 3.27Å; R109-D222 WeakPolarHBondContact CG-O 3.34Å; R109-D222 IonicContact CZ-OD2 3.08Å; R109-D222 IonicContact NE-OD2 3.27Å; R109-D222 IonicContact NH1-OD1 2.84Å; R109-D222 IonicContact NH1-OD2 2.67Å; R109-D222 PolarHBondContact NH1-OD2 2.67Å; T111-D222 PolarHBondContact OG1-OD2 2.82Å; T112-D222 HydrophobicContact CG2-CB 3.94Å; T112-D222 VanDerWaalsContact CG2-O 3.25Å; T112-D222 WeakPolarHBondContact CG2-O 3.44Å; T112-D222 PolarHBondContact OG1-O 2.91Å
223	I	97.8	Very high	96.9	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.005	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	170	173.3	66.5	172.4	0	0	0	110.3	L79 W117 V221	L79-I223 HydrophobicContact CB-CG1 4.09Å; L79-I223 HydrophobicContact CD1-CD1 4.19Å; L79-I223 HydrophobicContact CD1-CG1 4.06Å; L79-I223 HydrophobicContact CG-CG1 4.25Å; L79-I223 PolarHBondContact N-O 2.76Å; W117-I223 HydrophobicContact CH2-CD1 3.61Å; W117-I223 HydrophobicContact CH2-CG2 4.41Å; W117-I223 HydrophobicContact CZ2-CD1 4.45Å; W117-I223 HydrophobicContact CZ2-CG2 4.27Å; W117-I223 HydrophobicContact CZ3-CD1 3.74Å; V221-I223 HydrophobicContact CG1-CG2 3.83Å; V221-I223 PolarHBondContact O-N 2.85Å; V221-I223 VanDerWaalsContact O-N 3.13Å
224	E	97.3	Very high	96.8	Very high	32 Å²	32	33.6 Å²	33.6	15%	0.15	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	129.9	165.2	-66	175.9	-176	0	0	109.2	F77 R78 F106 R107 W171	F77-E224 WeakPolarHBondContact O-CA 3.19Å; R78-E224 HydrophobicContact CB-CG 4.4Å; R78-E224 HydrophobicContact CG-CG 4.45Å; F106-E224 CarbonylContact C-O 3.56Å; F106-E224 WeakPolarHBondContact CA-O 3.49Å; F106-E224 WeakPolarHBondContact CB-O 3.29Å; R107-E224 HydrophobicContact CG-CB 3.92Å; R107-E224 IonicContact CZ-OE2 3.87Å; R107-E224 PolarHBondContact N-O 3.27Å; R107-E224 IonicContact NE-OE2 2.66Å; R107-E224 PolarHBondContact NE-OE2 2.83Å; R107-E224 IonicContact NH2-OE2 3.23Å; R107-E224 PolarHBondContact NH2-OE2 3.33Å; R107-E224 PolarHBondContact O-N 2.86Å; W171-E224 HydrophobicContact CH2-CB 3.73Å; W171-E224 HydrophobicContact CZ2-CB 4.34Å; W171-E224 HydrophobicContact CZ3-CB 4.39Å; W171-E224 WeakPolarHBondContact CZ3-O 3.43Å
225	L	97.3	Very high	96.6	Very high	4 Å²	4	37 Å²	37	2%	0.021	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	127.7	-175.5	-178	72.8	0	0	0	108.3	L64 S76 F77 L79 T104 F106 Q227 I228	L64-L225 HydrophobicContact CD1-CD2 4.36Å; S76-L225 CarbonylContact C-O 3.59Å; F77-L225 WeakPolarHBondContact CD2-O 3.11Å; F77-L225 PolarHBondContact N-O 2.96Å; F77-L225 PolarHBondContact O-N 2.93Å; L79-L225 HydrophobicContact CD1-CB 3.95Å; L79-L225 HydrophobicContact CD1-CD2 3.89Å; L79-L225 HydrophobicContact CG-CB 4.24Å; T104-L225 WeakPolarHBondContact OG1-CD1 3.06Å; F106-L225 HydrophobicContact CB-CD1 4.04Å; L225-Q227 VanDerWaalsContact CD1-O 3.28Å; L225-Q227 WeakPolarHBondContact CD1-O 3.12Å; L225-I228 HydrophobicContact CD1-CB 4.46Å; L225-I228 HydrophobicContact CD2-CG2 3.94Å
226	R	94.6	Very high	96.4	Very high	24 Å²	24	35.8 Å²	35.8	9%	0.091	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	-44.8	165.4	-79.8	172.4	-176.9	-172.7	-0.1	109.7	E72 I105 W171 E244	E72-R226 IonicContact OE2-NH2 2.88Å; E72-R226 PolarHBondContact OE2-NH2 2.79Å; I105-R226 HydrophobicContact CB-CB 4.08Å; I105-R226 HydrophobicContact CG2-CB 4.1Å; I105-R226 HydrophobicContact CG2-CG 4.43Å; I105-R226 PolarHBondContact O-N 2.9Å; W171-R226 VanDerWaalsContact CD1-NH2 3.33Å; W171-R226 HydrophobicContact CD2-CG 4.49Å; W171-R226 HydrophobicContact CE3-CG 4.03Å; W171-R226 HydrophobicContact CH2-CG 3.67Å; W171-R226 HydrophobicContact CZ2-CG 4.14Å; W171-R226 HydrophobicContact CZ3-CB 4.21Å; W171-R226 HydrophobicContact CZ3-CG 3.59Å; R226-E244 PolarHBondContact NH1-O 3.06Å; R226-E244 VanDerWaalsContact NH1-O 3.08Å
227	Q	94.2	Very high	96.3	Very high	15 Å²	15	30.2 Å²	30.2	7%	0.07	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.7	156.7	-175.6	54.6	168.5	-22.8	0	0	114.2	R43 T60 T104 I105 L225 L229	R43-Q227 VanDerWaalsContact CZ-NE2 3.28Å; R43-Q227 VanDerWaalsContact NH1-CD 3.25Å; R43-Q227 VanDerWaalsContact NH2-NE2 3.12Å; T60-Q227 WeakPolarHBondContact OG1-CA 3.27Å; T104-Q227 CarbonylContact C-O 3.59Å; T104-Q227 VanDerWaalsContact CA-O 3.23Å; T104-Q227 WeakPolarHBondContact CA-O 3.42Å; T104-Q227 WeakPolarHBondContact CB-O 3.4Å; T104-Q227 PolarHBondContact OG1-O 2.9Å; I105-Q227 HydrophobicContact CB-CG 3.87Å; I105-Q227 HydrophobicContact CD1-CG 4.17Å; I105-Q227 HydrophobicContact CG1-CG 3.86Å; I105-Q227 PolarHBondContact N-O 3.47Å; I105-Q227 PolarHBondContact O-N 3.28Å; L225-Q227 VanDerWaalsContact CD1-O 3.28Å; L225-Q227 WeakPolarHBondContact CD1-O 3.12Å; Q227-L229 VanDerWaalsContact OE1-CD1 3.29Å
228	I	97.9	Very high	96.2	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.01	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	117.7	166.3	-179.8	167.6	0	0	0	108.5	L59 T60 V103 L119 W120 I211 L225	L59-I228 HydrophobicContact CB-CB 4.4Å; L59-I228 HydrophobicContact CB-CG1 4.21Å; L59-I228 HydrophobicContact CB-CG2 3.63Å; L59-I228 WeakPolarHBondContact CB-O 3.44Å; L59-I228 HydrophobicContact CD2-CD1 4.17Å; L59-I228 HydrophobicContact CD2-CG1 4.26Å; L59-I228 PolarHBondContact N-O 2.74Å; T60-I228 PolarHBondContact N-O 2.83Å; T60-I228 PolarHBondContact OG1-N 3.39Å; T60-I228 PolarHBondContact OG1-O 3.41Å; V103-I228 CarbonylContact O-C 3.53Å; V103-I228 WeakPolarHBondContact O-CA 3.23Å; L119-I228 HydrophobicContact CG-CD1 4.46Å; W120-I228 HydrophobicContact CB-CD1 4.28Å; I211-I228 HydrophobicContact CD1-CG2 4.46Å; I211-I228 HydrophobicContact CG2-CD1 4.08Å; L225-I228 HydrophobicContact CD1-CB 4.46Å; L225-I228 HydrophobicContact CD2-CG2 3.94Å
229	L	97.6	Very high	95.9	Very high	4 Å²	4	31.6 Å²	31.6	2%	0.021	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	147.2	-176.6	-57.8	-179.2	0	0	0	109.2	V39 R43 D58 L102 V103 Q227 Y231	V39-L229 HydrophobicContact CG1-CD1 4.02Å; R43-L229 VanDerWaalsContact NH1-CD1 3.3Å; D58-L229 HydrophobicContact CB-CD2 3.86Å; L102-L229 WeakPolarHBondContact CA-O 3.3Å; V103-L229 PolarHBondContact N-O 2.92Å; V103-L229 PolarHBondContact O-N 2.85Å; Q227-L229 VanDerWaalsContact OE1-CD1 3.29Å; L229-Y231 HydrophobicContact CB-CE2 4.28Å; L229-Y231 VanDerWaalsContact CD1-OH 3.23Å; L229-Y231 WeakPolarHBondContact CD1-OH 3.45Å
230	I	98	Very high	95.4	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	117.1	166.9	-67.4	178.1	0	0	0	107.6	G56 F57 L59 F92 L96 Y100 S101 L102 W120	G56-I230 CarbonylContact C-O 3.6Å; G56-I230 WeakPolarHBondContact CA-O 3.36Å; F57-I230 HydrophobicContact CD2-CG2 4.36Å; F57-I230 PolarHBondContact N-O 3.08Å; F57-I230 PolarHBondContact O-N 3.32Å; L59-I230 HydrophobicContact CD1-CB 4.33Å; L59-I230 HydrophobicContact CD1-CD1 3.88Å; L59-I230 HydrophobicContact CD1-CG1 4.02Å; L59-I230 HydrophobicContact CD2-CD1 3.82Å; L59-I230 HydrophobicContact CD2-CG1 4.32Å; F92-I230 HydrophobicContact CE1-CD1 4.05Å; F92-I230 HydrophobicContact CZ-CD1 3.8Å; L96-I230 HydrophobicContact CD1-CG2 3.67Å; Y100-I230 HydrophobicContact CD2-CG2 4.11Å; S101-I230 CarbonylContact O-C 3.46Å; S101-I230 VanDerWaalsContact O-CA 3.27Å; S101-I230 WeakPolarHBondContact O-CA 3.41Å; L102-I230 HydrophobicContact CB-CG1 4.34Å; L102-I230 HydrophobicContact CD1-CD1 4.37Å; L102-I230 HydrophobicContact CD1-CG1 4.21Å; L102-I230 HydrophobicContact CG-CG1 4.22Å; W120-I230 HydrophobicContact CD2-CD1 4.34Å; W120-I230 HydrophobicContact CH2-CD1 4.13Å; W120-I230 HydrophobicContact CZ2-CD1 3.65Å
231	Y	96.9	Very high	94.8	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	143.8	170.8	-57.7	-78.1	0	0	0	110	L37 V39 F44 I54 T55 Y100 S101 V103 L229 D233 M236 E240	L37-Y231 HydrophobicContact CD2-CD1 3.87Å; L37-Y231 HydrophobicContact CD2-CE1 3.65Å; V39-Y231 HydrophobicContact CG1-CE1 4.09Å; F44-Y231 HydrophobicContact CZ-CE1 4.39Å; I54-Y231 HydrophobicContact CG2-CD1 3.55Å; I54-Y231 HydrophobicContact CG2-CE1 3.51Å; T55-Y231 WeakPolarHBondContact O-CA 3.22Å; Y100-Y231 WeakPolarHBondContact CA-O 3.12Å; Y100-Y231 VanDerWaalsContact CB-O 3.23Å; Y100-Y231 WeakPolarHBondContact CB-O 3.24Å; S101-Y231 PolarHBondContact N-O 2.84Å; S101-Y231 PolarHBondContact O-N 3.08Å; S101-Y231 WeakPolarHBondContact OG-CB 3.24Å; V103-Y231 HydrophobicContact CB-CE2 4.08Å; V103-Y231 HydrophobicContact CG2-CD2 4.17Å; V103-Y231 HydrophobicContact CG2-CE2 3.78Å; L229-Y231 HydrophobicContact CB-CE2 4.28Å; L229-Y231 VanDerWaalsContact CD1-OH 3.23Å; L229-Y231 WeakPolarHBondContact CD1-OH 3.45Å; Y231-D233 PolarHBondContact O-N 3.28Å; Y231-M236 HydrophobicContact CD1-CB 4.15Å; Y231-M236 HydrophobicContact CD1-CG 4.13Å; Y231-M236 HydrophobicContact CD2-CB 3.56Å; Y231-M236 HydrophobicContact CD2-CG 4.38Å; Y231-M236 HydrophobicContact CE2-CB 4.22Å; Y231-M236 HydrophobicContact CG-CB 3.53Å; Y231-M236 HydrophobicContact CG-CG 3.83Å; Y231-E240 VanDerWaalsContact CE2-OE1 3.22Å; Y231-E240 WeakPolarHBondContact CE2-OE1 3.25Å; Y231-E240 PolarHBondContact OH-OE1 3.01Å
232	C	95.2	Very high	94.4	Very high	15 Å²	15	24.2 Å²	24.2	10%	0.101	12%	0.116	C	C	.	.	S	Bend	trans	-76.9	-10.4	173.9	-74.2	0	0	0	0	114.1	C34 T55 E99	C34-C232 HydrophobicContact CB-CB 3.53Å; C34-C232 WeakPolarHBondContact CB-SG 3.25Å; C34-C232 WeakPolarHBondContact SG-CB 3.44Å; C34-C232 CovalentContact SG-SG 2.01Å; C34-C232 PolarHBondContact SG-SG 3.06Å; T55-C232 PolarHBondContact O-N 3.29Å; E99-C232 VanDerWaalsContact O-O 3.08Å
233	D	94.6	Very high	93.8	Very high	51 Å²	51	23.2 Å²	23.2	27%	0.273	11%	0.111	S	C	.	.	S	Bend	trans	-98.8	122.7	173.7	-178.3	-21.5	0	0	0	109.2	S101 Y231 Y235 M236	S101-D233 PolarHBondContact OG-O 2.83Å; Y231-D233 PolarHBondContact O-N 3.28Å; D233-Y235 PolarHBondContact O-N 2.84Å; D233-Y235 WeakPolarHBondContact OD1-CB 3.12Å; D233-Y235 VanDerWaalsContact OD1-CD2 3.25Å; D233-Y235 WeakPolarHBondContact OD1-CD2 3.39Å; D233-Y235 PolarHBondContact OD1-N 1.97Å; D233-M236 HydrophobicContact CB-CE 3.88Å; D233-M236 HydrophobicContact CB-CG 3.75Å; D233-M236 PolarHBondContact O-N 3.39Å; D233-M236 WeakPolarHBondContact OD2-CE 3.36Å
234	P	96.3	Very high	92.9	Very high	9 Å²	9	23.7 Å²	23.7	6%	0.058	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-21.2	179.4	30.8	-38.5	0	0	0	113.8	E99 Y100 S177 M236	E99-P234 HydrophobicContact CB-CB 4.25Å; E99-P234 HydrophobicContact CB-CG 3.96Å; Y100-P234 WeakPolarHBondContact O-CA 3.01Å; S177-P234 WeakPolarHBondContact CB-O 3.4Å; S177-P234 PolarHBondContact OG-O 3.28Å; P234-M236 VanDerWaalsContact C-N 3.33Å; P234-M236 PolarHBondContact O-N 2.77Å
235	Y	94.8	Very high	92.1	Very high	127 Å²	127	24.2 Å²	24.2	50%	0.498	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-14.8	-179.1	-63	-78	0	0	0	113.1	H179 D233 A237 E238 M239	H179-Y235 AromaticContact CE1-CE1 3.6Å; H179-Y235 AromaticContact CE1-CE2 3.93Å; H179-Y235 AromaticContact CE1-CZ 3.52Å; D233-Y235 PolarHBondContact O-N 2.84Å; D233-Y235 WeakPolarHBondContact OD1-CB 3.12Å; D233-Y235 VanDerWaalsContact OD1-CD2 3.25Å; D233-Y235 WeakPolarHBondContact OD1-CD2 3.39Å; D233-Y235 PolarHBondContact OD1-N 1.97Å; Y235-A237 VanDerWaalsContact C-N 3.32Å; Y235-A237 PolarHBondContact O-N 3.23Å; Y235-E238 WeakPolarHBondContact O-CB 3.35Å; Y235-E238 PolarHBondContact O-N 3.21Å; Y235-M239 WeakPolarHBondContact O-CG 3.49Å; Y235-M239 PolarHBondContact O-N 3.12Å; Y235-M239 VanDerWaalsContact O-N 3.14Å
236	M	93.8	Very high	91	Very high	9 Å²	9	27.9 Å²	27.9	4%	0.044	14%	0.136	C	C	.	.	H	α-helix	trans	-62.6	-36	-173.6	-65.3	-75.6	158.5	0	0	113.2	F44 S101 Y231 D233 P234 E238 M239 E240	F44-M236 HydrophobicContact CE1-CB 4.44Å; F44-M236 HydrophobicContact CE1-SD 3.77Å; F44-M236 HydrophobicContact CZ-SD 4Å; S101-M236 WeakPolarHBondContact OG-CB 3.39Å; Y231-M236 HydrophobicContact CD1-CB 4.15Å; Y231-M236 HydrophobicContact CD1-CG 4.13Å; Y231-M236 HydrophobicContact CD2-CB 3.56Å; Y231-M236 HydrophobicContact CD2-CG 4.38Å; Y231-M236 HydrophobicContact CE2-CB 4.22Å; Y231-M236 HydrophobicContact CG-CB 3.53Å; Y231-M236 HydrophobicContact CG-CG 3.83Å; D233-M236 HydrophobicContact CB-CE 3.88Å; D233-M236 HydrophobicContact CB-CG 3.75Å; D233-M236 PolarHBondContact O-N 3.39Å; D233-M236 WeakPolarHBondContact OD2-CE 3.36Å; P234-M236 VanDerWaalsContact C-N 3.33Å; P234-M236 PolarHBondContact O-N 2.77Å; M236-E238 VanDerWaalsContact C-N 3.25Å; M236-E238 PolarHBondContact O-N 3.07Å; M236-M239 HydrophobicContact CE-CE 3.61Å; M236-M239 HydrophobicContact CG-CE 4.27Å; M236-M239 PolarHBondContact O-N 2.76Å; M236-M239 HydrophobicContact SD-CE 3.62Å; M236-E240 PolarHBondContact O-N 3.11Å; M236-E240 VanDerWaalsContact O-N 3.09Å
237	A	94.3	Very high	89.5	Confident	4 Å²	4	34.5 Å²	34.5	3%	0.033	17%	0.168	C	C	.	.	H	α-helix	trans	-65.1	-25.9	175.2	0	0	0	0	0	114	S101 V103 Y186 Y235	S101-A237 PolarHBondContact OG-N 3.09Å; V103-A237 HydrophobicContact CG2-CB 3.95Å; Y186-A237 HydrophobicContact CD2-CB 4.37Å; Y235-A237 VanDerWaalsContact C-N 3.32Å; Y235-A237 PolarHBondContact O-N 3.23Å
238	E	92.6	Very high	87.6	Confident	111 Å²	111	38.1 Å²	38.1	52%	0.519	19%	0.193	S	C	.	.	H	α-helix	trans	-80.4	-34.4	174.7	-178	173.2	177.4	0	0	111.8	Y186 Y235 M236	Y186-E238 HydrophobicContact CE1-CB 3.94Å; Y186-E238 HydrophobicContact CE1-CG 3.95Å; Y186-E238 PolarHBondContact OH-OE2 3.26Å; Y235-E238 WeakPolarHBondContact O-CB 3.35Å; Y235-E238 PolarHBondContact O-N 3.21Å; M236-E238 VanDerWaalsContact C-N 3.25Å; M236-E238 PolarHBondContact O-N 3.07Å
239	M	90.3	Very high	85.5	Confident	36 Å²	36	42.4 Å²	42.4	18%	0.177	21%	0.212	C	C	.	.	H	α-helix	trans	-84	-16.6	-175.9	-64.4	-172.1	-69.8	0	0	114.2	F44 V47 Y235 M236	F44-M239 HydrophobicContact CD1-CB 3.99Å; F44-M239 HydrophobicContact CE1-CB 4.23Å; V47-M239 HydrophobicContact CG1-CB 4.37Å; V47-M239 HydrophobicContact CG1-CG 4.07Å; V47-M239 HydrophobicContact CG1-SD 4.02Å; V47-M239 HydrophobicContact CG2-CB 4.47Å; Y235-M239 WeakPolarHBondContact O-CG 3.49Å; Y235-M239 PolarHBondContact O-N 3.12Å; Y235-M239 VanDerWaalsContact O-N 3.14Å; M236-M239 HydrophobicContact CE-CE 3.61Å; M236-M239 HydrophobicContact CG-CE 4.27Å; M236-M239 PolarHBondContact O-N 2.76Å; M236-M239 HydrophobicContact SD-CE 3.62Å
240	E	86.9	Confident	83.4	Confident	6 Å²	6	48.7 Å²	48.7	3%	0.028	24%	0.244	C	C	.	.			trans	-65.6	133.8	176.5	-86.4	-156.7	-149.8	0	0	111.8	R43 F44 K173 C189 Y231 M236	R43-E240 IonicContact NH1-OE1 2.68Å; R43-E240 IonicContact NH1-OE2 4Å; R43-E240 WeakPolarHBondContact O-CA 3.43Å; F44-E240 HydrophobicContact CD1-CG 4.45Å; F44-E240 HydrophobicContact CE1-CB 4.5Å; F44-E240 HydrophobicContact CE1-CG 3.62Å; F44-E240 HydrophobicContact CE2-CG 4.44Å; F44-E240 HydrophobicContact CZ-CG 3.62Å; K173-E240 IonicContact NZ-OE2 3.83Å; K173-E240 PolarHBondContact NZ-OE2 2.76Å; C189-E240 WeakPolarHBondContact CB-O 3.34Å; C189-E240 PolarHBondContact SG-O 3.03Å; Y231-E240 VanDerWaalsContact CE2-OE1 3.22Å; Y231-E240 WeakPolarHBondContact CE2-OE1 3.25Å; Y231-E240 PolarHBondContact OH-OE1 3.01Å; M236-E240 PolarHBondContact O-N 3.11Å; M236-E240 VanDerWaalsContact O-N 3.09Å
241	N	86.4	Confident	81.2	Confident	12 Å²	12	56 Å²	56	6%	0.064	28%	0.278	C	S	.	.			trans	-90.5	168.5	166.5	63.7	29.8	0	0	0	111.6	Y42 R43 S45 D46 K173 C189 C243	Y42-N241 VanDerWaalsContact O-CG 3.31Å; Y42-N241 PolarHBondContact O-ND2 2.7Å; Y42-N241 PolarHBondContact O-OD1 3.13Å; Y42-N241 VanDerWaalsContact O-OD1 3.09Å; R43-N241 WeakPolarHBondContact CA-OD1 3.28Å; R43-N241 VanDerWaalsContact O-CG 3.31Å; R43-N241 PolarHBondContact O-N 3.08Å; R43-N241 PolarHBondContact O-OD1 3.07Å; S45-N241 PolarHBondContact OG-ND2 2.82Å; S45-N241 VanDerWaalsContact OG-ND2 3.13Å; D46-N241 WeakPolarHBondContact OD2-CB 3.32Å; D46-N241 PolarHBondContact OD2-ND2 3.02Å; K173-N241 PolarHBondContact NZ-O 2.86Å; C189-N241 PolarHBondContact SG-O 3.24Å; N241-C243 PolarHBondContact ND2-SG 3.49Å; N241-C243 VanDerWaalsContact ND2-SG 3.39Å; N241-C243 PolarHBondContact OD1-SG 2.99Å
242	C	88.8	Confident	79.3	Confident	19 Å²	19	57.5 Å²	57.5	13%	0.128	29%	0.288	C	S	.	.			trans	-113.9	33.4	-171.9	-85.9	0	0	0	0	112.9	D188 C189 E244 L245	D188-C242 WeakPolarHBondContact CA-SG 3.29Å; C189-C242 HydrophobicContact CB-CB 3.88Å; C189-C242 WeakPolarHBondContact CB-SG 2.78Å; C189-C242 PolarHBondContact N-SG 3.08Å; C189-C242 WeakPolarHBondContact SG-CA 2.85Å; C189-C242 WeakPolarHBondContact SG-CB 3.19Å; C189-C242 PolarHBondContact SG-N 2.91Å; C189-C242 CovalentContact SG-SG 2.03Å; C189-C242 PolarHBondContact SG-SG 2.94Å; C242-E244 VanDerWaalsContact C-N 3.27Å; C242-E244 PolarHBondContact O-N 3.39Å; C242-L245 HydrophobicContact CB-CD1 4.13Å; C242-L245 HydrophobicContact CB-CG 4.47Å; C242-L245 WeakPolarHBondContact O-CB 3.34Å; C242-L245 PolarHBondContact O-N 3.33Å
243	C	83.7	Confident	77.1	Confident	6 Å²	6	59.1 Å²	59.1	4%	0.041	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-57.4	-36.7	-175.6	-64.3	0	0	0	0	114.7	Y42 N241 L245 L246 C252	Y42-C243 HydrophobicContact CD2-CB 3.98Å; Y42-C243 HydrophobicContact CE2-CB 4.4Å; N241-C243 PolarHBondContact ND2-SG 3.49Å; N241-C243 VanDerWaalsContact ND2-SG 3.39Å; N241-C243 PolarHBondContact OD1-SG 2.99Å; C243-L245 PolarHBondContact O-N 3.27Å; C243-L246 PolarHBondContact O-N 2.85Å; C243-C252 WeakPolarHBondContact CA-SG 3.41Å; C243-C252 HydrophobicContact CB-CB 3.15Å; C243-C252 WeakPolarHBondContact CB-SG 3.44Å; C243-C252 WeakPolarHBondContact SG-CB 3.16Å; C243-C252 CovalentContact SG-SG 1.97Å; C243-C252 PolarHBondContact SG-SG 3.45Å
244	E	80	Confident	74.7	Confident	12 Å²	12	60.1 Å²	60.1	6%	0.056	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-72.6	-8.8	179.5	68.7	-91.5	-128.8	0	0	114	Y42 L74 I105 K173 R226 C242	Y42-E244 HydrophobicContact CE2-CB 4.19Å; L74-E244 HydrophobicContact CD1-CB 3.82Å; I105-E244 HydrophobicContact CD1-CG 3.5Å; I105-E244 VanDerWaalsContact CD1-CG 3.5Å; I105-E244 VanDerWaalsContact CD1-OE1 3.27Å; I105-E244 WeakPolarHBondContact CD1-OE1 3.37Å; K173-E244 WeakPolarHBondContact CE-OE1 3.48Å; K173-E244 VanDerWaalsContact NZ-CD 3.25Å; K173-E244 IonicContact NZ-OE1 3.83Å; K173-E244 PolarHBondContact NZ-OE1 2.81Å; K173-E244 IonicContact NZ-OE2 2.96Å; K173-E244 PolarHBondContact NZ-OE2 2.96Å; R226-E244 PolarHBondContact NH1-O 3.06Å; R226-E244 VanDerWaalsContact NH1-O 3.08Å; C242-E244 VanDerWaalsContact C-N 3.27Å; C242-E244 PolarHBondContact O-N 3.39Å
245	L	81	Confident	72	Confident	43 Å²	43	66.8 Å²	66.8	23%	0.225	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-97	-14	175.1	-56.2	-176.2	0	0	0	112.7	I105 W171 K173 D188 C242 C243	I105-L245 HydrophobicContact CD1-CD2 4.39Å; I105-L245 HydrophobicContact CG2-CD2 4Å; W171-L245 HydrophobicContact CB-CD2 4.04Å; K173-L245 HydrophobicContact CB-CD1 3.85Å; D188-L245 HydrophobicContact CB-CD1 4.38Å; D188-L245 WeakPolarHBondContact OD1-CD1 3.29Å; C242-L245 HydrophobicContact CB-CD1 4.13Å; C242-L245 HydrophobicContact CB-CG 4.47Å; C242-L245 WeakPolarHBondContact O-CB 3.34Å; C242-L245 PolarHBondContact O-N 3.33Å; C243-L245 PolarHBondContact O-N 3.27Å
246	L	73.7	Confident	69.6	Low	80 Å²	80	66.8 Å²	66.8	42%	0.419	35%	0.349	S	S	.	.			trans	-88.5	127.5	-175.6	-61.7	177.4	0	0	0	111.8	C243 K249 Q251	C243-L246 PolarHBondContact O-N 2.85Å; L246-K249 PolarHBondContact O-N 3.41Å; L246-Q251 HydrophobicContact CD1-CB 4.08Å
247	E	62	Low	66.7	Low	164 Å²	164	71.6 Å²	71.6	77%	0.766	38%	0.379	S	S	*	.	S	Bend	trans	-112.7	127.8	160.9	-70.1	-159.9	172.9	0	0	110.4
248	P	55.5	Low	64	Low	91 Å²	91	79.7 Å²	79.7	59%	0.591	41%	0.414	S	S	*	.	S	Bend	cis	-77.2	146.9	-7.8	31.8	-32.6	0	0	0	111.9	I250	P248-I250 HydrophobicContact CB-CD1 3.89Å; P248-I250 HydrophobicContact CB-CG1 4.05Å; P248-I250 HydrophobicContact CG-CD1 3.92Å; P248-I250 HydrophobicContact CG-CG1 4.33Å; P248-I250 PolarHBondContact O-N 3Å
249	K	53.1	Low	61.5	Low	92 Å²	92	81.3 Å²	81.3	40%	0.4	43%	0.425	S	S	.	.	G	3₁₀ helix	trans	-59	6	179.8	-64.8	172.8	179.3	162.2	0	115.7	D73 L246 Q251 C252	D73-K249 IonicContact OD2-NZ 3.42Å; D73-K249 PolarHBondContact OD2-NZ 2.75Å; L246-K249 PolarHBondContact O-N 3.41Å; K249-Q251 PolarHBondContact O-N 3.5Å; K249-C252 PolarHBondContact O-N 3.41Å
250	I	53.3	Low	59	Low	135 Å²	135	82.1 Å²	82.1	69%	0.692	44%	0.442	S	S	*	.	G	3₁₀ helix	trans	-64.8	-20.9	-175.5	-62.5	170.1	0	0	0	111.6	P248 C252	P248-I250 HydrophobicContact CB-CD1 3.89Å; P248-I250 HydrophobicContact CB-CG1 4.05Å; P248-I250 HydrophobicContact CG-CD1 3.92Å; P248-I250 HydrophobicContact CG-CG1 4.33Å; P248-I250 PolarHBondContact O-N 3Å; I250-C252 PolarHBondContact O-N 3.21Å
251	Q	53	Low	56.8	Low	155 Å²	155	87.5 Å²	87.5	72%	0.724	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-82.7	-11.1	-175.9	-138.9	68	43.5	0	0	114.8	L246 K249	L246-Q251 HydrophobicContact CD1-CB 4.08Å; K249-Q251 PolarHBondContact O-N 3.5Å
252	C	55.9	Low	54.7	Low	30 Å²	30	91.2 Å²	91.2	20%	0.203	50%	0.503	C	S	.	.	G	3₁₀ helix	trans	-112.4	25.8	-175.8	-85.9	0	0	0	0	114.8	C243 K249 I250	C243-C252 WeakPolarHBondContact CA-SG 3.41Å; C243-C252 HydrophobicContact CB-CB 3.15Å; C243-C252 WeakPolarHBondContact CB-SG 3.44Å; C243-C252 WeakPolarHBondContact SG-CB 3.16Å; C243-C252 CovalentContact SG-SG 1.97Å; C243-C252 PolarHBondContact SG-SG 3.45Å; K249-C252 PolarHBondContact O-N 3.41Å; I250-C252 PolarHBondContact O-N 3.21Å
253	G	49	Very low	52.8	Low	49 Å²	49	95.8 Å²	95.8	51%	0.505	53%	0.532	S	S	.	.	S	Bend	trans	-101.3	116.8	146.5	0	0	0	0	0	105.9	N255	G253-N255 PolarHBondContact O-N 2.93Å
254	V	43.4	Very low	50.6	Low	72 Å²	72	101 Å²	101	44%	0.436	57%	0.566	S	S	.	*			trans	-50.2	116.2	157.8	-173.8	0	0	0	0	105.1	R256	V254-R256 HydrophobicContact CB-CG 3.85Å; V254-R256 HydrophobicContact CG1-CB 4.29Å; V254-R256 HydrophobicContact CG1-CG 3.32Å; V254-R256 PolarHBondContact O-N 2.75Å
255	N	40.9	Very low	48.6	Very low	150 Å²	150	108.1 Å²	108.1	80%	0.802	60%	0.603	S	S	*	*			trans	-59.7	77.7	151.7	-84.4	-25.4	0	0	0	105.4	G253 T257	G253-N255 PolarHBondContact O-N 2.93Å; N255-T257 PolarHBondContact O-N 2.84Å
256	R	44.2	Very low	46.5	Very low	127 Å²	127	112.2 Å²	112.2	48%	0.479	63%	0.63	S	S	.	*			trans	-73.6	70.1	157	-67	-169.4	-174.8	-158.9	-4.3	103.5	D49 V254 F258	D49-R256 IonicContact OD1-CZ 3.96Å; D49-R256 VanDerWaalsContact OD1-CZ 3.23Å; D49-R256 IonicContact OD1-NH1 3.69Å; D49-R256 PolarHBondContact OD1-NH1 2.79Å; D49-R256 IonicContact OD1-NH2 2.98Å; D49-R256 PolarHBondContact OD1-NH2 2.69Å; V254-R256 HydrophobicContact CB-CG 3.85Å; V254-R256 HydrophobicContact CG1-CB 4.29Å; V254-R256 HydrophobicContact CG1-CG 3.32Å; V254-R256 PolarHBondContact O-N 2.75Å; R256-F258 HydrophobicContact CB-CD2 4.32Å; R256-F258 HydrophobicContact CB-CE2 4.47Å; R256-F258 PolarHBondContact O-N 2.88Å
257	T	31.8	Very low	44.7	Very low	109 Å²	109	113.7 Å²	113.7	67%	0.669	64%	0.642	S	S	*	*			trans	-57.6	93.5	146.6	-30.5	0	0	0	0	102.3	N255 I259	N255-T257 PolarHBondContact O-N 2.84Å; T257-I259 PolarHBondContact O-N 2.82Å
258	F	39.4	Very low	43.5	Very low	174 Å²	174	110 Å²	110	76%	0.763	64%	0.64	S	S	*	*			trans	-54.5	96.5	155.8	-89.3	-95	0	0	0	103.5	R256 G260	R256-F258 HydrophobicContact CB-CD2 4.32Å; R256-F258 HydrophobicContact CB-CE2 4.47Å; R256-F258 PolarHBondContact O-N 2.88Å; F258-G260 PolarHBondContact O-N 2.74Å
259	I	40	Very low	42.6	Very low	146 Å²	146	113.7 Å²	113.7	75%	0.749	65%	0.649	S	S	*	*			trans	-68	70.5	144.2	-56.4	177.1	0	0	0	103.1	T257 T261	T257-I259 PolarHBondContact O-N 2.82Å; I259-T261 PolarHBondContact O-N 2.89Å
260	G	37.5	Very low	41.6	Very low	53 Å²	53	114.6 Å²	114.6	55%	0.546	67%	0.667	S	S	.	*			trans	-65.4	86	153.9	0	0	0	0	0	103.4	F258 S262	F258-G260 PolarHBondContact O-N 2.74Å; G260-S262 PolarHBondContact O-N 2.85Å
261	T	40.2	Very low	40.7	Very low	118 Å²	118	113.9 Å²	113.9	72%	0.724	67%	0.671	S	S	*	*			trans	-60.1	94	148.3	-31.5	0	0	0	0	103	I259	I259-T261 PolarHBondContact O-N 2.89Å
262	S	42.4	Very low	39.9	Very low	91 Å²	91	114.4 Å²	114.4	64%	0.636	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-46.2	128.2	164.3	30.1	0	0	0	0	106.2	G260	G260-S262 PolarHBondContact O-N 2.85Å
263	P	48.6	Very low	38.7	Very low	115 Å²	115	121.6 Å²	121.6	75%	0.747	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-53.4	136.7	166.3	21.8	-29.1	0	0	0	106.6	L265	P263-L265 PolarHBondContact O-N 2.8Å
264	P	38.7	Very low	38	Very low	115 Å²	115	124.5 Å²	124.5	75%	0.747	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-52.4	131.6	-175.6	15.5	-25.1	0	0	0	108.6	V266	P264-V266 VanDerWaalsContact C-N 3.31Å; P264-V266 PolarHBondContact O-N 3.17Å
265	L	37.4	Very low	37.6	Very low	161 Å²	161	126.5 Å²	126.5	84%	0.843	74%	0.738	S	S	*	*			trans	-57.1	99.3	175.6	-150.3	89.7	0	0	0	106.4	P263 T267	P263-L265 PolarHBondContact O-N 2.8Å; L265-T267 VanDerWaalsContact C-N 3.29Å; L265-T267 PolarHBondContact O-N 2.91Å
266	V	36.8	Very low	37.2	Very low	130 Å²	130	127.8 Å²	127.8	79%	0.788	74%	0.74	S	S	*	*			trans	-65.7	102.7	167.2	174.9	0	0	0	0	104.3	P264 A268	P264-V266 VanDerWaalsContact C-N 3.31Å; P264-V266 PolarHBondContact O-N 3.17Å; V266-A268 PolarHBondContact O-N 2.79Å
267	T	36.3	Very low	36.9	Very low	110 Å²	110	126.9 Å²	126.9	68%	0.675	75%	0.75	S	S	*	*			trans	-59.9	91.6	169.3	-44.6	0	0	0	0	106.8	L265 Q269	L265-T267 VanDerWaalsContact C-N 3.29Å; L265-T267 PolarHBondContact O-N 2.91Å; T267-Q269 HydrophobicContact CG2-CG 4.38Å; T267-Q269 PolarHBondContact O-N 2.87Å
268	A	35.9	Very low	36.7	Very low	87 Å²	87	127 Å²	127	72%	0.719	75%	0.75	S	S	*	*			trans	-67.5	88.7	166.2	0	0	0	0	0	106.7	V266 S270	V266-A268 PolarHBondContact O-N 2.79Å; A268-S270 PolarHBondContact O-N 3.1Å; A268-S270 VanDerWaalsContact O-N 3.1Å
269	Q	36.4	Very low	36.3	Very low	169 Å²	169	123.5 Å²	123.5	79%	0.79	75%	0.748	S	S	*	*			trans	-63.6	107.1	159.7	-71.2	-178.2	-9.7	0	0	106.2	T267 P271	T267-Q269 HydrophobicContact CG2-CG 4.38Å; T267-Q269 PolarHBondContact O-N 2.87Å; Q269-P271 WeakPolarHBondContact O-CD 3.19Å
270	S	32.6	Very low	35.9	Very low	110 Å²	110	125.1 Å²	125.1	77%	0.769	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-59	119.2	163.9	-72.6	0	0	0	0	108.4	A268 L272	A268-S270 PolarHBondContact O-N 3.1Å; A268-S270 VanDerWaalsContact O-N 3.1Å; S270-L272 PolarHBondContact O-N 3.39Å
271	P	34	Very low	35.9	Very low	121 Å²	121	127.5 Å²	127.5	79%	0.786	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-73.6	123.9	168.7	-11.1	28.7	0	0	0	108.3	Q269 M273	Q269-P271 WeakPolarHBondContact O-CD 3.19Å; P271-M273 PolarHBondContact O-N 3.36Å
272	L	36.3	Very low	35.7	Very low	166 Å²	166	129.6 Å²	129.6	87%	0.869	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-55.8	127.9	161.5	-117.1	96.1	0	0	0	108.3	S270 P274	S270-L272 PolarHBondContact O-N 3.39Å; L272-P274 VanDerWaalsContact O-CD 3.31Å; L272-P274 WeakPolarHBondContact O-CD 3.31Å
273	M	31.4	Very low	35.6	Very low	180 Å²	180	132 Å²	132	89%	0.887	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-50	136	170.8	-82.4	-88.1	-156.5	0	0	112.3	P271	P271-M273 PolarHBondContact O-N 3.36Å
274	P	34.3	Very low	34.9	Very low	111 Å²	111	132.6 Å²	132.6	72%	0.721	77%	0.773	S	S	*	*			trans	-116.2	128.8	141.3	4	18.3	0	0	0	110.4	L272	L272-P274 VanDerWaalsContact O-CD 3.31Å; L272-P274 WeakPolarHBondContact O-CD 3.31Å
275	S	33.8	Very low	34.9	Very low	114 Å²	114	132.9 Å²	132.9	80%	0.797	78%	0.776	S	S	*	*			trans	-2.9	131.3	160	49.8	0	0	0	0	120.1
276	Q	33.4	Very low	34.9	Very low	177 Å²	177	133.9 Å²	133.9	83%	0.827	78%	0.776	S	S	*	*			trans	-50.2	164.5	158.6	-109.8	173.3	-81.2	0	0	113.4
277	P	38.5	Very low	35.1	Very low	107 Å²	107	133.6 Å²	133.6	70%	0.695	78%	0.779	S	S	*	*			cis	-147.5	162.1	42.1	37.6	-14.6	0	0	0	120.8
278	T	26.9	Very low	35.8	Very low	111 Å²	111	134.4 Å²	134.4	68%	0.681	79%	0.786	S	S	*	*			trans	78.6	122	138.6	44.6	0	0	0	0	124.3
279	S	31.5	Very low	36	Very low	102 Å²	102	134 Å²	134	71%	0.713	79%	0.79	S	S	*	*			trans	77.3	140.3	139.4	86.5	0	0	0	0	115.9
280	Q	30.7	Very low	36.1	Very low	180 Å²	180	135.4 Å²	135.4	84%	0.841	80%	0.796	S	S	*	*			cis	-150.3	155.8	26.8	-79.3	167.9	-19.5	0	0	110.7
281	S	38.7	Very low	36.5	Very low	102 Å²	102	140 Å²	140	71%	0.713	80%	0.803	S	S	*	*			trans	-46.5	151.3	162.5	51.6	0	0	0	0	114.6
282	I	36	Very low	36.9	Very low	162 Å²	162	141.2 Å²	141.2	83%	0.831	81%	0.807	S	S	*	*				-172.1	135.2	119.7	-89.6	149	0	0	0	109.6
283	D	38.7	Very low	36.9	Very low	141 Å²	141	145.5 Å²	145.5	75%	0.754	82%	0.823	S	S	*	*			trans	-53.6	156.3	174.9	-65.8	-62.2	0	0	0	115
284	T	35.1	Very low	37.2	Very low	129 Å²	129	143.8 Å²	143.8	79%	0.791	82%	0.82	S	S	*	*				140.1	118.7	108.5	-25.1	0	0	0	0	111.5
285	C	38.3	Very low	37.3	Very low	120 Å²	120	145.5 Å²	145.5	81%	0.811	83%	0.825	S	S	*	*			trans	-79.1	142.3	164.5	-65.6	0	0	0	0	110.1
286	H	37.8	Very low	37.5	Very low	182 Å²	182	147.2 Å²	147.2	84%	0.843	83%	0.826	S	S	*	*			trans	-149.3	128.4	156.5	-110.7	35.5	0	0	0	112
287	C	41.5	Very low	37.8	Very low	124 Å²	124	145.5 Å²	145.5	84%	0.838	83%	0.826	S	S	*	*			trans	-103.1	151.3	159.2	-70.9	0	0	0	0	108.2
288	P	49.5	Very low	37.7	Very low	128 Å²	128	147.9 Å²	147.9	83%	0.831	83%	0.834	S	S	*	*			trans	-132.5	147.3	146	24.7	-6.1	0	0	0	113.5
289	G	39.8	Very low	38.5	Very low	77 Å²	77	150.3 Å²	150.3	79%	0.794	85%	0.845	S	S	*	*			trans	-94.1	-175.3	-177.2	0	0	0	0	0	116.2
290	E	40.2	Very low	39	Very low	199 Å²	199	153.8 Å²	153.8	93%	0.93	85%	0.854	S	S	*	*			trans	22.1	132.5	163.8	-77.4	179.3	146.1	0	0	122
291	K	40.8	Very low	39.6	Very low	208 Å²	208	151.8 Å²	151.8	90%	0.904	86%	0.855	S	S	*	*			trans	-118.7	129	159.5	-75.8	-170.5	176.4	-174.6	0	109.8
292	V	42.3	Very low	39.7	Very low	145 Å²	145	155.9 Å²	155.9	88%	0.879	87%	0.867	S	S	*	*			trans	-128.4	131.8	147.9	176.9	0	0	0	0	107.2
293	Q	36.1	Very low	40	Very low	256 Å²	256	155.4 Å²	155.4	100%	1.196	87%	0.87	S	S	*	*			trans	-116.8	0	153.2	-178.6	164.5	9.2	0	0	106.8

Retrieved 293 of 293 residues in 792.4 ms (Link to these results)

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