A0A077YXQ8_TRITR Loading...

Pre-mRNA-splicing factor RBM22

AlphaFold DB , UniProt , Accession A0A077YXQ8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 435 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.5	Very low	43.7	Very low	248 Å²	248	137.5 Å²	137.5	100%	1.222	75%	0.748	S	S	*	*				0	159.7	0	-70.2	174.1	174.8	0	0	109.3
2	A	35.4	Very low	44.6	Very low	102 Å²	102	132.2 Å²	132.2	84%	0.843	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-81.7	121	-176.7	0	0	0	0	0	111.5	S4	A2-S4 PolarHBondContact O-N 3.14Å
3	M	45.3	Very low	45.6	Very low	168 Å²	168	133.5 Å²	133.5	83%	0.828	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-70.8	120.2	160.8	-76.9	-118.5	147.9	0	0	108.2	L433	M3-L433 HydrophobicContact CE-CD1 4.35Å
4	S	40.6	Very low	47.2	Very low	94 Å²	94	128.6 Å²	128.6	66%	0.657	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-67.2	144.4	-173.4	48.3	0	0	0	0	111.9	A2 S6	A2-S4 PolarHBondContact O-N 3.14Å; S4-S6 PolarHBondContact O-N 3.11Å
5	K	44.8	Very low	49.2	Very low	205 Å²	205	128.6 Å²	128.6	89%	0.891	67%	0.672	S	S	*	*			trans	-77.2	51.2	176.2	-65.7	178.5	178.1	175.4	0	111.4	S7	K5-S7 PolarHBondContact O-N 2.86Å
6	S	39.3	Very low	50.8	Low	76 Å²	76	121.9 Å²	121.9	53%	0.531	64%	0.636	S	S	.	*			trans	-72.6	111.7	-173.3	41.5	0	0	0	0	113	S4 N8	S4-S6 PolarHBondContact O-N 3.11Å; S6-N8 PolarHBondContact O-N 3.05Å; S6-N8 VanDerWaalsContact O-N 3.16Å
7	S	41.9	Very low	52.7	Low	108 Å²	108	118.9 Å²	118.9	76%	0.755	62%	0.621	S	S	*	*	S	Bend	trans	57.5	32.3	146.4	59.8	0	0	0	0	119.9	K5	K5-S7 PolarHBondContact O-N 2.86Å
8	N	46.2	Very low	54.5	Low	85 Å²	85	112.8 Å²	112.8	46%	0.455	59%	0.59	S	S	.	*			trans	-142.2	22.1	177.7	-91.9	-74.9	0	0	0	116.4	S6 R12	S6-N8 PolarHBondContact O-N 3.05Å; S6-N8 VanDerWaalsContact O-N 3.16Å; N8-R12 VanDerWaalsContact OD1-CZ 3.29Å; N8-R12 PolarHBondContact OD1-NH2 3.14Å
9	T	47.3	Very low	56.3	Low	96 Å²	96	116 Å²	116	59%	0.589	60%	0.602	S	S	*	*			trans	-87.5	-19	-162.1	42.6	0	0	0	0	117.5
10	Y	47.8	Very low	58	Low	220 Å²	220	116.6 Å²	116.6	86%	0.863	60%	0.6	S	S	*	*	S	Bend	trans	-94.5	-6.4	-157.1	-93.4	-85.6	0	0	0	118.7
11	N	52.9	Low	59.7	Low	111 Å²	111	111.2 Å²	111.2	59%	0.594	57%	0.572	S	S	*	*	S	Bend	trans	-151.3	24.8	180	-135.5	-37.2	0	0	0	115.7	Q119	N11-Q119 PolarHBondContact O-NE2 3.39Å; N11-Q119 PolarHBondContact OD1-NE2 3.45Å
12	R	54.2	Low	62.4	Low	73 Å²	73	101.1 Å²	101.1	28%	0.275	52%	0.523	S	S	.	.			trans	-97.6	18	-177.9	-74.1	-175.6	169.5	174.6	0.9	114.7	N8 N14 D115	N8-R12 VanDerWaalsContact OD1-CZ 3.29Å; N8-R12 PolarHBondContact OD1-NH2 3.14Å; R12-N14 PolarHBondContact O-N 2.88Å; R12-N14 VanDerWaalsContact O-N 3.14Å; R12-D115 IonicContact CZ-OD2 2.67Å; R12-D115 VanDerWaalsContact CZ-OD2 3.23Å; R12-D115 IonicContact NE-OD2 2.81Å; R12-D115 PolarHBondContact NE-OD2 3.03Å; R12-D115 IonicContact NH2-OD1 3.92Å; R12-D115 IonicContact NH2-OD2 3.86Å; R12-D115 PolarHBondContact NH2-OD2 2.76Å
13	M	57.3	Low	65.2	Low	149 Å²	149	97.7 Å²	97.7	73%	0.734	49%	0.491	S	S	*	.			trans	-76.7	10	-174.9	-71.4	-64.5	-169.8	0	0	115.4	W15	M13-W15 VanDerWaalsContact O-CD1 3.23Å; M13-W15 PolarHBondContact O-N 3.34Å
14	N	68.4	Low	67.4	Low	65 Å²	65	90.6 Å²	90.6	35%	0.348	46%	0.457	S	S	.	.			trans	-86.2	100	169.7	-74.2	96.9	0	0	0	109.6	R12 Q119 E122	R12-N14 PolarHBondContact O-N 2.88Å; R12-N14 VanDerWaalsContact O-N 3.14Å; N14-Q119 PolarHBondContact OD1-NE2 3.08Å; N14-Q119 VanDerWaalsContact OD1-NE2 3.16Å; N14-E122 WeakPolarHBondContact CB-OE2 3.21Å; N14-E122 VanDerWaalsContact CG-OE2 3.29Å
15	W	76.9	Confident	69.9	Low	129 Å²	129	92.5 Å²	92.5	49%	0.489	46%	0.455	S	S	.	.			trans	-100	135.3	178.8	-60.4	80.9	0	0	0	110.8	M13 Y41 P51	M13-W15 VanDerWaalsContact O-CD1 3.23Å; M13-W15 PolarHBondContact O-N 3.34Å; W15-Y41 HydrophobicContact CB-CD1 4.31Å; W15-Y41 HydrophobicContact CB-CE1 3.61Å; W15-Y41 HydrophobicContact CB-CE2 4.48Å; W15-Y41 AromaticContact CE3-CD1 3.73Å; W15-Y41 HydrophobicContact CE3-CD1 3.73Å; W15-Y41 AromaticContact CE3-CD2 3.74Å; W15-Y41 HydrophobicContact CE3-CD2 3.74Å; W15-Y41 HydrophobicContact CE3-CE1 4.12Å; W15-Y41 HydrophobicContact CE3-CE2 4.11Å; W15-Y41 AromaticContact CE3-CG 3.53Å; W15-Y41 HydrophobicContact CE3-CG 3.53Å; W15-Y41 HydrophobicContact CG-CE1 4.49Å; W15-Y41 HydrophobicContact CZ3-CD2 4.12Å; W15-Y41 AromaticContact CZ3-CG 3.94Å; W15-Y41 HydrophobicContact CZ3-CG 3.94Å; W15-P51 HydrophobicContact CD2-CG 3.86Å; W15-P51 HydrophobicContact CE3-CB 3.67Å; W15-P51 HydrophobicContact CE3-CG 3.25Å; W15-P51 HydrophobicContact CH2-CB 4.46Å; W15-P51 HydrophobicContact CH2-CG 3.92Å; W15-P51 HydrophobicContact CZ2-CG 4.44Å; W15-P51 HydrophobicContact CZ3-CB 3.54Å; W15-P51 HydrophobicContact CZ3-CG 3.3Å
16	E	74.9	Confident	72.2	Confident	21 Å²	21	84 Å²	84	10%	0.098	42%	0.421	C	S	.	.	B	Isolated β-bridge	trans	-97.3	107	-176.5	-174.7	-168.6	99.8	0	0	113.3	A18 F52 T53 C71 Q72 T73	E16-A18 HydrophobicContact CG-CB 4.35Å; E16-F52 HydrophobicContact CB-CB 4.15Å; E16-T53 PolarHBondContact O-N 2.9Å; E16-T53 VanDerWaalsContact O-N 3.1Å; E16-T53 PolarHBondContact O-OG1 2.76Å; E16-C71 VanDerWaalsContact OE2-CB 3.26Å; E16-C71 WeakPolarHBondContact OE2-CB 3.45Å; E16-Q72 VanDerWaalsContact CD-CB 3.46Å; E16-Q72 WeakPolarHBondContact OE1-CB 3.15Å; E16-Q72 PolarHBondContact OE1-N 3.19Å; E16-Q72 WeakPolarHBondContact OE2-CA 3.39Å; E16-Q72 WeakPolarHBondContact OE2-CB 3.15Å; E16-Q72 PolarHBondContact OE2-N 3.05Å; E16-T73 PolarHBondContact OE2-N 2.7Å; E16-T73 VanDerWaalsContact OE2-N 3.1Å; E16-T73 PolarHBondContact OE2-OG1 3.39Å
17	D	83.1	Confident	74.7	Confident	71 Å²	71	80.3 Å²	80.3	38%	0.38	40%	0.395	S	S	.	.			trans	-102	63.4	172.6	-165	2.7	0	0	0	112.2	K38 K40 T53	D17-K38 WeakPolarHBondContact OD1-CE 3.26Å; D17-K38 IonicContact OD1-NZ 3.62Å; D17-K38 PolarHBondContact OD1-NZ 3.32Å; D17-K40 VanDerWaalsContact OD1-CE 3.31Å; D17-K40 WeakPolarHBondContact OD1-CE 3.35Å; D17-K40 IonicContact OD1-NZ 2.64Å; D17-K40 WeakPolarHBondContact OD2-CE 3.42Å; D17-K40 IonicContact OD2-NZ 3.86Å; D17-K40 PolarHBondContact OD2-NZ 3.4Å; D17-T53 WeakPolarHBondContact CA-OG1 3.26Å
18	A	84.8	Confident	77.1	Confident	9 Å²	9	77.2 Å²	77.2	7%	0.074	37%	0.37	C	S	.	.			trans	-66.5	142.4	174.1	0	0	0	0	0	111.5	E16 K38 F55	E16-A18 HydrophobicContact CG-CB 4.35Å; A18-K38 PolarHBondContact O-NZ 3.3Å; A18-F55 WeakPolarHBondContact O-CZ 3.4Å
19	E	88.8	Confident	79.2	Confident	174 Å²	174	73.6 Å²	73.6	81%	0.813	35%	0.353	S	S	*	.	S	Bend	trans	-79.5	-41.7	177.8	-174.4	169	-158.3	0	0	113.3	F55	E19-F55 WeakPolarHBondContact O-CE1 3.46Å; E19-F55 VanDerWaalsContact O-CZ 3.26Å; E19-F55 WeakPolarHBondContact O-CZ 3.35Å
20	F	91.6	Very high	81.2	Confident	128 Å²	128	76.3 Å²	76.3	56%	0.561	36%	0.357	S	S	*	.	S	Bend	trans	-135.3	141.7	-177.7	-168.6	-93.6	0	0	0	111.5	M36	F20-M36 HydrophobicContact CE2-CE 4.48Å
21	P	93.8	Very high	83.2	Confident	3 Å²	3	69.7 Å²	69.7	2%	0.019	34%	0.336	C	S	.	.			trans	-80	149.9	-176.7	31.4	-35.6	0	0	0	113.9	L23 M36 F55 T68	P21-L23 HydrophobicContact CB-CD1 4.13Å; P21-L23 HydrophobicContact CB-CD2 4.33Å; P21-L23 HydrophobicContact CB-CG 3.95Å; P21-L23 HydrophobicContact CG-CD1 3.65Å; P21-L23 HydrophobicContact CG-CG 3.99Å; P21-L23 PolarHBondContact O-N 3.18Å; P21-M36 HydrophobicContact CG-CE 3.62Å; P21-M36 HydrophobicContact CG-SD 3.66Å; P21-F55 HydrophobicContact CB-CB 4.24Å; P21-F55 HydrophobicContact CB-CD2 3.63Å; P21-F55 HydrophobicContact CB-CE2 4.07Å; P21-F55 HydrophobicContact CB-CG 3.97Å; P21-F55 HydrophobicContact CG-CB 3.99Å; P21-F55 HydrophobicContact CG-CD1 4.21Å; P21-F55 HydrophobicContact CG-CD2 3.98Å; P21-F55 HydrophobicContact CG-CE2 4.46Å; P21-F55 HydrophobicContact CG-CG 3.81Å; P21-T68 HydrophobicContact CB-CG2 3.72Å
22	I	94.3	Very high	85.1	Confident	36 Å²	36	69.9 Å²	69.9	19%	0.185	34%	0.344	C	S	.	.			trans	-86	104.3	175	-61.2	-179.9	0	0	0	109.3	Q72 S75 K76 Q82 L88	I22-Q72 HydrophobicContact CD1-CG 3.43Å; I22-Q72 VanDerWaalsContact CD1-CG 3.43Å; I22-Q72 HydrophobicContact CG1-CG 3.95Å; I22-S75 WeakPolarHBondContact CB-OG 3.35Å; I22-S75 WeakPolarHBondContact CG2-OG 3.37Å; I22-K76 HydrophobicContact CD1-CG 3.81Å; I22-Q82 HydrophobicContact CB-CG 4.31Å; I22-Q82 PolarHBondContact O-N 3.18Å; I22-L88 HydrophobicContact CG2-CD1 3.41Å; I22-L88 VanDerWaalsContact CG2-CD1 3.41Å; I22-L88 HydrophobicContact CG2-CD2 4.33Å; I22-L88 HydrophobicContact CG2-CG 4.47Å
23	L	94.3	Very high	86.8	Confident	31 Å²	31	75.8 Å²	75.8	16%	0.162	37%	0.367	C	S	.	.			trans	-132	144.1	-171.8	-59.2	176.3	0	0	0	112.2	P21 L28 M36 W57 T68 Q82	P21-L23 HydrophobicContact CB-CD1 4.13Å; P21-L23 HydrophobicContact CB-CD2 4.33Å; P21-L23 HydrophobicContact CB-CG 3.95Å; P21-L23 HydrophobicContact CG-CD1 3.65Å; P21-L23 HydrophobicContact CG-CG 3.99Å; P21-L23 PolarHBondContact O-N 3.18Å; L23-L28 HydrophobicContact CD1-CD1 4.07Å; L23-M36 HydrophobicContact CD1-CE 4.12Å; L23-W57 HydrophobicContact CD1-CD2 4.48Å; L23-W57 HydrophobicContact CD1-CE3 4.42Å; L23-W57 HydrophobicContact CD1-CH2 3.47Å; L23-W57 VanDerWaalsContact CD1-CH2 3.47Å; L23-W57 HydrophobicContact CD1-CZ2 3.51Å; L23-W57 HydrophobicContact CD1-CZ3 3.95Å; L23-W57 HydrophobicContact CD2-CH2 3.49Å; L23-W57 VanDerWaalsContact CD2-CH2 3.49Å; L23-W57 HydrophobicContact CD2-CZ2 3.9Å; L23-W57 HydrophobicContact CD2-CZ3 4.41Å; L23-W57 HydrophobicContact CG-CH2 4.14Å; L23-W57 HydrophobicContact CG-CZ2 4.34Å; L23-T68 HydrophobicContact CD2-CG2 4.37Å; L23-Q82 HydrophobicContact CD2-CB 4.42Å
24	C	93.4	Very high	88.3	Confident	18 Å²	18	71.2 Å²	71.2	12%	0.122	35%	0.345	C	S	.	.			trans	-87.8	153.8	168.4	69.2	0	0	0	0	111.6	T26 C27 L28 C81 C84 L88	C24-T26 PolarHBondContact O-N 3.09Å; C24-T26 VanDerWaalsContact O-N 3.1Å; C24-T26 PolarHBondContact SG-OG1 3.18Å; C24-C27 WeakPolarHBondContact O-CA 3.44Å; C24-C27 WeakPolarHBondContact O-CB 3.28Å; C24-C27 PolarHBondContact O-N 3.09Å; C24-L28 PolarHBondContact O-N 2.93Å; C24-C81 HydrophobicContact CB-CB 4.06Å; C24-C81 PolarHBondContact N-SG 3.37Å; C24-C81 VanDerWaalsContact N-SG 3.44Å; C24-C81 VanDerWaalsContact SG-SG 3.63Å; C24-C84 VanDerWaalsContact SG-SG 3.68Å; C24-L88 HydrophobicContact CB-CD2 4.07Å
25	Q	92	Very high	89.4	Confident	134 Å²	134	79 Å²	79	63%	0.626	37%	0.369	S	S	*	.	H	α-helix	trans	-56.3	-33.9	-174.2	-56.9	-62.9	5.3	0	0	113.4	C27 L28 G29	Q25-C27 PolarHBondContact O-N 3.23Å; Q25-L28 PolarHBondContact O-N 3.15Å; Q25-G29 PolarHBondContact O-N 3.35Å; Q25-G29 VanDerWaalsContact O-N 3.17Å
26	T	92.6	Very high	90.2	Very high	26 Å²	26	75.4 Å²	75.4	16%	0.16	36%	0.358	C	S	.	.	H	α-helix	trans	-61.3	-28.7	175	71	0	0	0	0	113.5	C24 P157 R161 N162	C24-T26 PolarHBondContact O-N 3.09Å; C24-T26 VanDerWaalsContact O-N 3.1Å; C24-T26 PolarHBondContact SG-OG1 3.18Å; T26-P157 HydrophobicContact CG2-CB 3.88Å; T26-R161 PolarHBondContact OG1-NH1 3.22Å; T26-N162 PolarHBondContact O-ND2 3.38Å; T26-N162 PolarHBondContact O-OD1 2.92Å
27	C	92.6	Very high	91.1	Very high	0 Å²	0	79.1 Å²	79.1	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-88.6	-31.8	177.2	-76.4	0	0	0	0	113	C24 Q25 W57 K66	C24-C27 WeakPolarHBondContact O-CA 3.44Å; C24-C27 WeakPolarHBondContact O-CB 3.28Å; C24-C27 PolarHBondContact O-N 3.09Å; Q25-C27 PolarHBondContact O-N 3.23Å; C27-W57 PolarHBondContact O-NE1 3.32Å; C27-K66 PolarHBondContact SG-NZ 3.46Å
28	L	92.2	Very high	91.7	Very high	42 Å²	42	79.8 Å²	79.8	22%	0.22	38%	0.377	C	S	.	.	H	α-helix	trans	-64.4	-51.1	178.3	-162.3	68.3	0	0	0	110.5	L23 C24 Q25 M34 W57 P59	L23-L28 HydrophobicContact CD1-CD1 4.07Å; C24-L28 PolarHBondContact O-N 2.93Å; Q25-L28 PolarHBondContact O-N 3.15Å; L28-M34 HydrophobicContact CD1-CG 4.47Å; L28-M34 HydrophobicContact CD1-SD 3.49Å; L28-M34 WeakPolarHBondContact CD1-SD 3.38Å; L28-M34 HydrophobicContact CG-SD 4.31Å; L28-W57 PolarHBondContact O-NE1 3.3Å; L28-P59 WeakPolarHBondContact O-CA 3.3Å; L28-P59 WeakPolarHBondContact O-CB 3.46Å
29	G	90.5	Very high	92.1	Very high	10 Å²	10	84.9 Å²	84.9	10%	0.103	40%	0.399	C	S	.	.			trans	133.5	-169.1	174.7	0	0	0	0	0	113.4	Q25 P59 Y159	Q25-G29 PolarHBondContact O-N 3.35Å; Q25-G29 VanDerWaalsContact O-N 3.17Å; G29-P59 WeakPolarHBondContact CA-O 3.2Å; G29-Y159 WeakPolarHBondContact O-CE1 3.37Å; G29-Y159 PolarHBondContact O-OH 3.15Å
30	K	89.5	Confident	92.3	Very high	153 Å²	153	82.4 Å²	82.4	67%	0.665	39%	0.385	S	S	*	.	S	Bend	trans	-98.3	-0.4	176.6	71.4	168.1	-176.9	171.7	0	114.1	P59 Y159	K30-P59 PolarHBondContact N-O 2.99Å; K30-Y159 HydrophobicContact CB-CD2 4.47Å; K30-Y159 HydrophobicContact CB-CE1 4.13Å; K30-Y159 HydrophobicContact CB-CE2 3.84Å
31	N	90.2	Very high	92.1	Very high	80 Å²	80	80.5 Å²	80.5	43%	0.428	38%	0.375	S	S	.	.			trans	-106.8	121.7	-177.8	-173.1	3.8	0	0	0	109.3	Y33	N31-Y33 PolarHBondContact ND2-O 3.25Å; N31-Y33 PolarHBondContact O-N 2.87Å; N31-Y33 PolarHBondContact OD1-N 3.1Å; N31-Y33 VanDerWaalsContact OD1-N 3.1Å
32	P	91.5	Very high	91.8	Very high	116 Å²	116	82 Å²	82	75%	0.753	39%	0.391	S	S	*	.	S	Bend	trans	-59.5	-32.5	173.2	-24.2	34.8	0	0	0	113
33	Y	91.4	Very high	91.5	Very high	196 Å²	196	81.3 Å²	81.3	77%	0.769	39%	0.393	S	S	*	.	S	Bend	trans	-92.9	108.7	-179.6	-54.5	-74.1	0	0	0	110.4	N31	N31-Y33 PolarHBondContact ND2-O 3.25Å; N31-Y33 PolarHBondContact O-N 2.87Å; N31-Y33 PolarHBondContact OD1-N 3.1Å; N31-Y33 VanDerWaalsContact OD1-N 3.1Å
34	M	88	Confident	91.3	Very high	54 Å²	54	84.3 Å²	84.3	27%	0.266	41%	0.406	S	S	.	.			trans	-125.7	144.1	-174.2	72.8	126.9	-61.8	0	0	112	L28 M36 W57	L28-M34 HydrophobicContact CD1-CG 4.47Å; L28-M34 HydrophobicContact CD1-SD 3.49Å; L28-M34 WeakPolarHBondContact CD1-SD 3.38Å; L28-M34 HydrophobicContact CG-SD 4.31Å; M34-M36 HydrophobicContact CE-CB 3.52Å; M34-M36 HydrophobicContact CE-CE 3.62Å; M34-M36 HydrophobicContact CE-CG 4.09Å; M34-M36 HydrophobicContact SD-CE 3.71Å; M34-W57 HydrophobicContact CE-CB 3.61Å; M34-W57 HydrophobicContact CE-CG 4.19Å
35	R	92.3	Very high	91.2	Very high	229 Å²	229	83.5 Å²	83.5	86%	0.864	40%	0.4	S	S	*	.			trans	-109.2	124.3	176.3	-67	-171.9	-69.4	171.6	-2.3	109.6	W57	R35-W57 WeakPolarHBondContact O-CB 3.3Å
36	M	93.5	Very high	91.2	Very high	52 Å²	52	80.5 Å²	80.5	26%	0.256	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	146.5	179.7	-151.6	167.9	-86.9	0	0	110.1	F20 P21 L23 M34 F55 R56 W57	F20-M36 HydrophobicContact CE2-CE 4.48Å; P21-M36 HydrophobicContact CG-CE 3.62Å; P21-M36 HydrophobicContact CG-SD 3.66Å; L23-M36 HydrophobicContact CD1-CE 4.12Å; M34-M36 HydrophobicContact CE-CB 3.52Å; M34-M36 HydrophobicContact CE-CE 3.62Å; M34-M36 HydrophobicContact CE-CG 4.09Å; M34-M36 HydrophobicContact SD-CE 3.71Å; M36-F55 HydrophobicContact CG-CB 4.17Å; M36-F55 HydrophobicContact CG-CD1 4.15Å; M36-F55 HydrophobicContact SD-CB 3.71Å; M36-F55 HydrophobicContact SD-CD1 3.43Å; M36-F55 WeakPolarHBondContact SD-CD1 3.38Å; M36-F55 HydrophobicContact SD-CE1 4.31Å; M36-F55 HydrophobicContact SD-CG 3.89Å; M36-R56 WeakPolarHBondContact CA-O 3.26Å; M36-W57 HydrophobicContact CE-CD2 4.13Å; M36-W57 HydrophobicContact CE-CE3 3.88Å; M36-W57 HydrophobicContact CE-CG 4.4Å; M36-W57 HydrophobicContact CE-CZ3 4.5Å; M36-W57 HydrophobicContact CG-CB 4.36Å; M36-W57 HydrophobicContact CG-CE3 4.48Å
37	M	94	Very high	91.1	Very high	100 Å²	100	79.3 Å²	79.3	49%	0.493	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	128.3	161.2	-62.4	173.5	-66.2	0	0	107.3	F55 R56	M37-F55 WeakPolarHBondContact O-CA 3.5Å; M37-R56 HydrophobicContact CE-CB 4.06Å; M37-R56 HydrophobicContact CE-CG 3.77Å; M37-R56 PolarHBondContact N-O 2.83Å; M37-R56 PolarHBondContact O-N 3.01Å
38	K	95	Very high	90.8	Very high	85 Å²	85	79.4 Å²	79.4	37%	0.37	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	124.4	171	169	168.6	166.8	160.1	0	108.5	D17 A18 T53 F55	D17-K38 WeakPolarHBondContact OD1-CE 3.26Å; D17-K38 IonicContact OD1-NZ 3.62Å; D17-K38 PolarHBondContact OD1-NZ 3.32Å; A18-K38 PolarHBondContact O-NZ 3.3Å; K38-T53 HydrophobicContact CD-CG2 3.91Å; K38-T53 HydrophobicContact CG-CG2 3.63Å; K38-F55 HydrophobicContact CB-CD1 3.98Å; K38-F55 HydrophobicContact CB-CE1 3.82Å; K38-F55 HydrophobicContact CD-CE1 3.83Å; K38-F55 HydrophobicContact CD-CZ 4.14Å; K38-F55 HydrophobicContact CG-CD1 4.34Å; K38-F55 HydrophobicContact CG-CE1 3.84Å; K38-F55 HydrophobicContact CG-CZ 4.37Å
39	E	93.6	Very high	90.6	Very high	115 Å²	115	79 Å²	79	54%	0.537	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	101.4	179.1	-168.3	178.8	173.3	0	0	108.6	Y41 G42 T54	E39-Y41 PolarHBondContact O-N 2.79Å; E39-Y41 VanDerWaalsContact O-N 3.14Å; E39-G42 PolarHBondContact O-N 2.84Å; E39-T54 PolarHBondContact N-O 3.08Å; E39-T54 PolarHBondContact O-N 3.26Å
40	K	91.9	Very high	90.4	Very high	123 Å²	123	79 Å²	79	54%	0.535	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	119.7	178.8	-66.8	-165.3	-178.8	-165.2	0	108.8	D17 G42	D17-K40 VanDerWaalsContact OD1-CE 3.31Å; D17-K40 WeakPolarHBondContact OD1-CE 3.35Å; D17-K40 IonicContact OD1-NZ 2.64Å; D17-K40 WeakPolarHBondContact OD2-CE 3.42Å; D17-K40 IonicContact OD2-NZ 3.86Å; D17-K40 PolarHBondContact OD2-NZ 3.4Å; K40-G42 PolarHBondContact O-N 2.81Å
41	Y	88.4	Confident	90.5	Very high	88 Å²	88	73.4 Å²	73.4	35%	0.345	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	61.7	18.7	178.4	-40.8	-45.7	0	0	0	116.1	W15 E39 G43 F52	W15-Y41 HydrophobicContact CB-CD1 4.31Å; W15-Y41 HydrophobicContact CB-CE1 3.61Å; W15-Y41 HydrophobicContact CB-CE2 4.48Å; W15-Y41 AromaticContact CE3-CD1 3.73Å; W15-Y41 HydrophobicContact CE3-CD1 3.73Å; W15-Y41 AromaticContact CE3-CD2 3.74Å; W15-Y41 HydrophobicContact CE3-CD2 3.74Å; W15-Y41 HydrophobicContact CE3-CE1 4.12Å; W15-Y41 HydrophobicContact CE3-CE2 4.11Å; W15-Y41 AromaticContact CE3-CG 3.53Å; W15-Y41 HydrophobicContact CE3-CG 3.53Å; W15-Y41 HydrophobicContact CG-CE1 4.49Å; W15-Y41 HydrophobicContact CZ3-CD2 4.12Å; W15-Y41 AromaticContact CZ3-CG 3.94Å; W15-Y41 HydrophobicContact CZ3-CG 3.94Å; E39-Y41 PolarHBondContact O-N 2.79Å; E39-Y41 VanDerWaalsContact O-N 3.14Å; Y41-G43 PolarHBondContact O-N 2.84Å; Y41-F52 VanDerWaalsContact CA-O 3.28Å; Y41-F52 WeakPolarHBondContact CA-O 3.45Å; Y41-F52 PolarHBondContact N-O 2.68Å
42	G	86.7	Confident	90.6	Very high	35 Å²	35	69.8 Å²	69.8	36%	0.361	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	6.2	179.9	0	0	0	0	0	116.5	E39 K40	E39-G42 PolarHBondContact O-N 2.84Å; K40-G42 PolarHBondContact O-N 2.81Å
43	G	87.4	Confident	90.7	Very high	21 Å²	21	64.2 Å²	64.2	22%	0.216	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.2	153.5	179.8	0	0	0	0	0	113.9	Y41 P51 F52 T54	Y41-G43 PolarHBondContact O-N 2.84Å; G43-P51 WeakPolarHBondContact O-CA 3.49Å; G43-F52 WeakPolarHBondContact O-CD1 3.35Å; G43-F52 PolarHBondContact O-N 2.85Å; G43-T54 PolarHBondContact N-OG1 2.97Å
44	E	91.1	Very high	90.8	Very high	94 Å²	94	55.3 Å²	55.3	44%	0.439	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	134.8	168.6	52	118.6	-131.8	0	0	111.7	K46 R50	E44-K46 PolarHBondContact O-N 3.21Å; E44-K46 IonicContact OE1-NZ 3.93Å; E44-K46 PolarHBondContact OE1-NZ 2.8Å; E44-R50 WeakPolarHBondContact CA-O 3.38Å
45	C	91.8	Very high	91.2	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	25%	0.254	C	S	.	.			trans	-69	126.6	179.2	164.3	0	0	0	0	110.6	I47 C48 S49 R50 F52 V70 C71	C45-I47 PolarHBondContact O-N 2.96Å; C45-C48 WeakPolarHBondContact CB-SG 3.41Å; C45-C48 PolarHBondContact O-N 2.81Å; C45-C48 PolarHBondContact SG-SG 2.87Å; C45-S49 WeakPolarHBondContact O-CA 3.44Å; C45-S49 PolarHBondContact O-N 2.89Å; C45-R50 PolarHBondContact N-O 3.47Å; C45-F52 HydrophobicContact CB-CD1 3.75Å; C45-F52 HydrophobicContact CB-CE1 3.95Å; C45-F52 HydrophobicContact CB-CG 4.49Å; C45-V70 VanDerWaalsContact SG-CA 3.58Å; C45-C71 HydrophobicContact CB-CB 3.96Å; C45-C71 PolarHBondContact SG-N 3.28Å; C45-C71 VanDerWaalsContact SG-N 3.39Å
46	K	90.5	Very high	91.3	Very high	71 Å²	71	47.7 Å²	47.7	31%	0.309	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-6.8	-171.3	-58	-59.1	171.2	-175	0	115.8	E44 E69 I200 R201	E44-K46 PolarHBondContact O-N 3.21Å; E44-K46 IonicContact OE1-NZ 3.93Å; E44-K46 PolarHBondContact OE1-NZ 2.8Å; K46-E69 PolarHBondContact N-O 3.43Å; K46-E69 VanDerWaalsContact N-O 3.15Å; K46-I200 HydrophobicContact CB-CG2 4.07Å; K46-R201 PolarHBondContact O-NE 3.32Å
47	I	90.4	Very high	91.4	Very high	2 Å²	2	45.3 Å²	45.3	1%	0.01	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-63.2	172.6	-51.7	-55.2	0	0	0	110.9	C45 V70 K114 R201 Y204 Y205	C45-I47 PolarHBondContact O-N 2.96Å; I47-V70 HydrophobicContact CG1-CG1 3.8Å; I47-K114 PolarHBondContact O-NZ 3.09Å; I47-R201 HydrophobicContact CD1-CG 4.1Å; I47-Y204 HydrophobicContact CD1-CD1 3.8Å; I47-Y204 HydrophobicContact CD1-CD2 4.27Å; I47-Y204 HydrophobicContact CD1-CG 3.6Å; I47-Y204 HydrophobicContact CG1-CD1 3.87Å; I47-Y204 HydrophobicContact CG1-CD2 3.93Å; I47-Y204 HydrophobicContact CG1-CE1 4.26Å; I47-Y204 HydrophobicContact CG1-CE2 4.29Å; I47-Y204 HydrophobicContact CG1-CG 3.71Å; I47-Y204 HydrophobicContact CG2-CD1 3.84Å; I47-Y204 HydrophobicContact CG2-CE1 3.66Å; I47-Y205 HydrophobicContact CG2-CE2 4.35Å
48	C	87.2	Confident	91.4	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.007	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-9.2	-172	72.9	0	0	0	0	114.6	C45 R50 C71 I118	C45-C48 WeakPolarHBondContact CB-SG 3.41Å; C45-C48 PolarHBondContact O-N 2.81Å; C45-C48 PolarHBondContact SG-SG 2.87Å; C48-R50 HydrophobicContact CB-CG 4.44Å; C48-R50 PolarHBondContact O-N 2.75Å; C48-R50 VanDerWaalsContact O-N 3.14Å; C48-C71 VanDerWaalsContact SG-SG 3.69Å; C48-I118 HydrophobicContact CB-CD1 3.52Å; C48-I118 HydrophobicContact CB-CG2 4.16Å
49	S	87.5	Confident	91.2	Very high	33 Å²	33	39 Å²	39	23%	0.231	20%	0.198	C	C	.	.			trans	53.4	27.7	-176.8	46.1	0	0	0	0	113.8	C45 K114	C45-S49 WeakPolarHBondContact O-CA 3.44Å; C45-S49 PolarHBondContact O-N 2.89Å; S49-K114 PolarHBondContact OG-NZ 3.08Å; S49-K114 VanDerWaalsContact OG-NZ 3.12Å
50	R	86.7	Confident	91	Very high	12 Å²	12	34.2 Å²	34.2	5%	0.045	18%	0.18	C	C	.	.			trans	-101.7	147.9	171.6	-62	-173.1	-178.8	-176.2	1.3	111	E44 C45 C48 D115 Q119 E122	E44-R50 WeakPolarHBondContact CA-O 3.38Å; C45-R50 PolarHBondContact N-O 3.47Å; C48-R50 HydrophobicContact CB-CG 4.44Å; C48-R50 PolarHBondContact O-N 2.75Å; C48-R50 VanDerWaalsContact O-N 3.14Å; R50-D115 PolarHBondContact NH2-O 3.45Å; R50-Q119 VanDerWaalsContact NH2-CB 3.3Å; R50-E122 IonicContact CZ-OE2 2.83Å; R50-E122 IonicContact NH1-OE1 3.68Å; R50-E122 PolarHBondContact NH1-OE1 2.96Å; R50-E122 IonicContact NH1-OE2 2.63Å; R50-E122 PolarHBondContact NH1-OE2 2.92Å; R50-E122 IonicContact NH2-OE2 3.18Å
51	P	91	Very high	90.9	Very high	35 Å²	35	38.4 Å²	38.4	23%	0.227	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	139.4	171.9	28.8	-34.6	0	0	0	111.2	W15 G43	W15-P51 HydrophobicContact CD2-CG 3.86Å; W15-P51 HydrophobicContact CE3-CB 3.67Å; W15-P51 HydrophobicContact CE3-CG 3.25Å; W15-P51 HydrophobicContact CH2-CB 4.46Å; W15-P51 HydrophobicContact CH2-CG 3.92Å; W15-P51 HydrophobicContact CZ2-CG 4.44Å; W15-P51 HydrophobicContact CZ3-CB 3.54Å; W15-P51 HydrophobicContact CZ3-CG 3.3Å; G43-P51 WeakPolarHBondContact O-CA 3.49Å
52	F	92.4	Very high	90.8	Very high	3 Å²	3	37.2 Å²	37.2	1%	0.013	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	162.3	179.6	76.7	-72.8	0	0	0	111.4	E16 Y41 G43 C45 T54 V70 C71	E16-F52 HydrophobicContact CB-CB 4.15Å; Y41-F52 VanDerWaalsContact CA-O 3.28Å; Y41-F52 WeakPolarHBondContact CA-O 3.45Å; Y41-F52 PolarHBondContact N-O 2.68Å; G43-F52 WeakPolarHBondContact O-CD1 3.35Å; G43-F52 PolarHBondContact O-N 2.85Å; C45-F52 HydrophobicContact CB-CD1 3.75Å; C45-F52 HydrophobicContact CB-CE1 3.95Å; C45-F52 HydrophobicContact CB-CG 4.49Å; F52-T54 PolarHBondContact O-N 2.95Å; F52-T54 VanDerWaalsContact O-N 3.13Å; F52-V70 VanDerWaalsContact CE2-O 3.25Å; F52-V70 WeakPolarHBondContact CE2-O 3.38Å; F52-C71 HydrophobicContact CB-CB 3.57Å; F52-C71 HydrophobicContact CD1-CB 4.32Å; F52-C71 HydrophobicContact CD2-CB 3.97Å; F52-C71 HydrophobicContact CG-CB 3.7Å
53	T	93.2	Very high	91	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	114	176.7	-65.5	0	0	0	0	111	E16 D17 K38 F55	E16-T53 PolarHBondContact O-N 2.9Å; E16-T53 VanDerWaalsContact O-N 3.1Å; E16-T53 PolarHBondContact O-OG1 2.76Å; D17-T53 WeakPolarHBondContact CA-OG1 3.26Å; K38-T53 HydrophobicContact CD-CG2 3.91Å; K38-T53 HydrophobicContact CG-CG2 3.63Å; T53-F55 HydrophobicContact CG2-CD2 4.15Å; T53-F55 HydrophobicContact CG2-CE1 4.21Å; T53-F55 HydrophobicContact CG2-CE2 3.56Å; T53-F55 HydrophobicContact CG2-CZ 3.6Å; T53-F55 WeakPolarHBondContact O-CD2 3.27Å
54	T	94.2	Very high	91.2	Very high	8 Å²	8	42.1 Å²	42.1	5%	0.049	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	130.7	178.3	-65.1	0	0	0	0	109.2	E39 G43 F52 K67	E39-T54 PolarHBondContact N-O 3.08Å; E39-T54 PolarHBondContact O-N 3.26Å; G43-T54 PolarHBondContact N-OG1 2.97Å; F52-T54 PolarHBondContact O-N 2.95Å; F52-T54 VanDerWaalsContact O-N 3.13Å; T54-K67 HydrophobicContact CG2-CB 4.33Å; T54-K67 HydrophobicContact CG2-CD 4.38Å
55	F	96	Very high	91.3	Very high	4 Å²	4	43.9 Å²	43.9	2%	0.018	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	139.7	176.3	-66.5	-87.6	0	0	0	109.4	A18 E19 P21 M36 M37 K38 T53 W57 K67 T68	A18-F55 WeakPolarHBondContact O-CZ 3.4Å; E19-F55 WeakPolarHBondContact O-CE1 3.46Å; E19-F55 VanDerWaalsContact O-CZ 3.26Å; E19-F55 WeakPolarHBondContact O-CZ 3.35Å; P21-F55 HydrophobicContact CB-CB 4.24Å; P21-F55 HydrophobicContact CB-CD2 3.63Å; P21-F55 HydrophobicContact CB-CE2 4.07Å; P21-F55 HydrophobicContact CB-CG 3.97Å; P21-F55 HydrophobicContact CG-CB 3.99Å; P21-F55 HydrophobicContact CG-CD1 4.21Å; P21-F55 HydrophobicContact CG-CD2 3.98Å; P21-F55 HydrophobicContact CG-CE2 4.46Å; P21-F55 HydrophobicContact CG-CG 3.81Å; M36-F55 HydrophobicContact CG-CB 4.17Å; M36-F55 HydrophobicContact CG-CD1 4.15Å; M36-F55 HydrophobicContact SD-CB 3.71Å; M36-F55 HydrophobicContact SD-CD1 3.43Å; M36-F55 WeakPolarHBondContact SD-CD1 3.38Å; M36-F55 HydrophobicContact SD-CE1 4.31Å; M36-F55 HydrophobicContact SD-CG 3.89Å; M37-F55 WeakPolarHBondContact O-CA 3.5Å; K38-F55 HydrophobicContact CB-CD1 3.98Å; K38-F55 HydrophobicContact CB-CE1 3.82Å; K38-F55 HydrophobicContact CD-CE1 3.83Å; K38-F55 HydrophobicContact CD-CZ 4.14Å; K38-F55 HydrophobicContact CG-CD1 4.34Å; K38-F55 HydrophobicContact CG-CE1 3.84Å; K38-F55 HydrophobicContact CG-CZ 4.37Å; T53-F55 HydrophobicContact CG2-CD2 4.15Å; T53-F55 HydrophobicContact CG2-CE1 4.21Å; T53-F55 HydrophobicContact CG2-CE2 3.56Å; T53-F55 HydrophobicContact CG2-CZ 3.6Å; T53-F55 WeakPolarHBondContact O-CD2 3.27Å; F55-W57 HydrophobicContact CB-CE3 4.46Å; F55-W57 HydrophobicContact CB-CZ3 4.22Å; F55-W57 WeakPolarHBondContact O-CZ3 3.29Å; F55-K67 CarbonylContact O-C 3.51Å; F55-K67 WeakPolarHBondContact O-CA 3.39Å; F55-K67 WeakPolarHBondContact O-CB 3.42Å; F55-T68 HydrophobicContact CB-CG2 4.17Å; F55-T68 HydrophobicContact CD2-CG2 4.27Å; F55-T68 PolarHBondContact N-OG1 3.02Å; F55-T68 PolarHBondContact O-N 3.36Å; F55-T68 VanDerWaalsContact O-N 3.08Å
56	R	95.3	Very high	91.4	Very high	119 Å²	119	44.8 Å²	44.8	45%	0.449	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	130.2	-179.9	-179.7	176.6	167.1	-158.3	-3.8	112	M36 M37 Y65 K66 K67	M36-R56 WeakPolarHBondContact CA-O 3.26Å; M37-R56 HydrophobicContact CE-CB 4.06Å; M37-R56 HydrophobicContact CE-CG 3.77Å; M37-R56 PolarHBondContact N-O 2.83Å; M37-R56 PolarHBondContact O-N 3.01Å; R56-Y65 HydrophobicContact CG-CD1 4.31Å; R56-K66 VanDerWaalsContact CA-O 3.32Å; R56-K66 WeakPolarHBondContact CA-O 3.41Å; R56-K67 HydrophobicContact CB-CB 4.36Å
57	W	95.1	Very high	91.5	Very high	2 Å²	2	45.3 Å²	45.3	1%	0.008	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	170.1	-178	65.8	103.7	0	0	0	112	L23 C27 L28 M34 R35 M36 F55 Y65 K66 T68 T83	L23-W57 HydrophobicContact CD1-CD2 4.48Å; L23-W57 HydrophobicContact CD1-CE3 4.42Å; L23-W57 HydrophobicContact CD1-CH2 3.47Å; L23-W57 VanDerWaalsContact CD1-CH2 3.47Å; L23-W57 HydrophobicContact CD1-CZ2 3.51Å; L23-W57 HydrophobicContact CD1-CZ3 3.95Å; L23-W57 HydrophobicContact CD2-CH2 3.49Å; L23-W57 VanDerWaalsContact CD2-CH2 3.49Å; L23-W57 HydrophobicContact CD2-CZ2 3.9Å; L23-W57 HydrophobicContact CD2-CZ3 4.41Å; L23-W57 HydrophobicContact CG-CH2 4.14Å; L23-W57 HydrophobicContact CG-CZ2 4.34Å; C27-W57 PolarHBondContact O-NE1 3.32Å; L28-W57 PolarHBondContact O-NE1 3.3Å; M34-W57 HydrophobicContact CE-CB 3.61Å; M34-W57 HydrophobicContact CE-CG 4.19Å; R35-W57 WeakPolarHBondContact O-CB 3.3Å; M36-W57 HydrophobicContact CE-CD2 4.13Å; M36-W57 HydrophobicContact CE-CE3 3.88Å; M36-W57 HydrophobicContact CE-CG 4.4Å; M36-W57 HydrophobicContact CE-CZ3 4.5Å; M36-W57 HydrophobicContact CG-CB 4.36Å; M36-W57 HydrophobicContact CG-CE3 4.48Å; F55-W57 HydrophobicContact CB-CE3 4.46Å; F55-W57 HydrophobicContact CB-CZ3 4.22Å; F55-W57 WeakPolarHBondContact O-CZ3 3.29Å; W57-Y65 CarbonylContact O-C 3.59Å; W57-Y65 WeakPolarHBondContact O-CA 3.44Å; W57-K66 HydrophobicContact CD2-CB 4.47Å; W57-K66 HydrophobicContact CH2-CB 4.36Å; W57-K66 HydrophobicContact CZ2-CB 3.85Å; W57-K66 PolarHBondContact N-O 2.88Å; W57-K66 PolarHBondContact O-N 2.84Å; W57-T68 HydrophobicContact CH2-CG2 4.48Å; W57-T68 HydrophobicContact CZ3-CG2 4.3Å; W57-T83 VanDerWaalsContact CH2-OG1 3.31Å; W57-T83 WeakPolarHBondContact CH2-OG1 3.36Å
58	C	93.4	Very high	91.8	Very high	47 Å²	47	45.2 Å²	45.2	32%	0.318	23%	0.226	S	C	.	.			trans	-114.6	117.1	172.4	-174.8	0	0	0	0	110.2	G60 Y65	C58-G60 PolarHBondContact O-N 3.32Å; C58-G60 PolarHBondContact SG-O 3.44Å; C58-G60 VanDerWaalsContact SG-O 3.38Å; C58-Y65 HydrophobicContact CB-CD1 4.09Å; C58-Y65 HydrophobicContact CB-CE1 3.89Å
59	P	91.9	Very high	92.1	Very high	5 Å²	5	47.1 Å²	47.1	3%	0.032	24%	0.235	C	C	.	.			trans	-70.1	-6.4	-176.5	-21.6	33.3	0	0	0	116.6	L28 G29 K30 M63 R64 K66 N162	L28-P59 WeakPolarHBondContact O-CA 3.3Å; L28-P59 WeakPolarHBondContact O-CB 3.46Å; G29-P59 WeakPolarHBondContact CA-O 3.2Å; K30-P59 PolarHBondContact N-O 2.99Å; P59-M63 HydrophobicContact CB-CB 4.32Å; P59-M63 HydrophobicContact CB-CG 4.45Å; P59-M63 HydrophobicContact CG-CB 4.48Å; P59-R64 WeakPolarHBondContact CD-O 3.48Å; P59-K66 HydrophobicContact CG-CD 3.59Å; P59-K66 HydrophobicContact CG-CG 3.73Å; P59-N162 HydrophobicContact CB-CB 4.3Å; P59-N162 HydrophobicContact CG-CB 4.21Å
60	G	89.6	Confident	92.4	Very high	16 Å²	16	45.6 Å²	45.6	17%	0.165	22%	0.224	C	C	.	.	S	Bend	trans	155.6	172.7	179.3	0	0	0	0	0	113.9	C58 G62 M63	C58-G60 PolarHBondContact O-N 3.32Å; C58-G60 PolarHBondContact SG-O 3.44Å; C58-G60 VanDerWaalsContact SG-O 3.38Å; G60-G62 PolarHBondContact O-N 2.88Å; G60-M63 WeakPolarHBondContact O-CB 3.48Å; G60-M63 PolarHBondContact O-N 3.37Å; G60-M63 VanDerWaalsContact O-N 3.13Å
61	K	89.2	Confident	92.6	Very high	211 Å²	211	45.3 Å²	45.3	92%	0.917	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.6	131.2	175.6	-171.1	176.5	-178.6	179.9	0	110.2	M63	K61-M63 VanDerWaalsContact C-N 3.32Å; K61-M63 PolarHBondContact O-N 3.24Å
62	G	85.8	Confident	92.6	Very high	63 Å²	63	45.8 Å²	45.8	65%	0.649	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.7	10.1	-178.4	0	0	0	0	0	115.8	G60 P164	G60-G62 PolarHBondContact O-N 2.88Å; G62-P164 WeakPolarHBondContact O-CD 3.42Å
63	M	90.3	Very high	92.5	Very high	52 Å²	52	46.3 Å²	46.3	26%	0.256	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-100.7	154	178.4	-59.6	-64.1	167.3	0	0	111.9	P59 G60 K61 N162	P59-M63 HydrophobicContact CB-CB 4.32Å; P59-M63 HydrophobicContact CB-CG 4.45Å; P59-M63 HydrophobicContact CG-CB 4.48Å; G60-M63 WeakPolarHBondContact O-CB 3.48Å; G60-M63 PolarHBondContact O-N 3.37Å; G60-M63 VanDerWaalsContact O-N 3.13Å; K61-M63 VanDerWaalsContact C-N 3.32Å; K61-M63 PolarHBondContact O-N 3.24Å; M63-N162 CarbonylContact C-O 3.57Å; M63-N162 WeakPolarHBondContact CA-O 3.43Å; M63-N162 HydrophobicContact CB-CB 4.31Å; M63-N162 WeakPolarHBondContact CB-O 3.33Å; M63-N162 HydrophobicContact CG-CB 4.23Å; M63-N162 HydrophobicContact SD-CB 3.63Å
64	R	91.9	Very high	92.4	Very high	106 Å²	106	46.3 Å²	46.3	40%	0.4	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-64.8	142.4	171	-161.8	-168.5	163.1	-172.9	-0.7	110.1	P59 K66 N162 H165	P59-R64 WeakPolarHBondContact CD-O 3.48Å; R64-K66 PolarHBondContact O-N 2.89Å; R64-N162 PolarHBondContact N-O 3.3Å; R64-H165 PolarHBondContact NH1-NE2 3.4Å
65	Y	93.1	Very high	92.3	Very high	131 Å²	131	46 Å²	46	51%	0.514	22%	0.224	S	C	.	.	P	Polyproline II helix	trans	-58.8	123.5	159.1	-79	-90.2	0	0	0	109.6	R56 W57 C58	R56-Y65 HydrophobicContact CG-CD1 4.31Å; W57-Y65 CarbonylContact O-C 3.59Å; W57-Y65 WeakPolarHBondContact O-CA 3.44Å; C58-Y65 HydrophobicContact CB-CD1 4.09Å; C58-Y65 HydrophobicContact CB-CE1 3.89Å
66	K	93.8	Very high	92	Very high	20 Å²	20	47.4 Å²	47.4	9%	0.087	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	153.8	175.6	-56.2	-166	81.2	177.2	0	109.3	C27 R56 W57 P59 R64 T83 N162	C27-K66 PolarHBondContact SG-NZ 3.46Å; R56-K66 VanDerWaalsContact CA-O 3.32Å; R56-K66 WeakPolarHBondContact CA-O 3.41Å; W57-K66 HydrophobicContact CD2-CB 4.47Å; W57-K66 HydrophobicContact CH2-CB 4.36Å; W57-K66 HydrophobicContact CZ2-CB 3.85Å; W57-K66 PolarHBondContact N-O 2.88Å; W57-K66 PolarHBondContact O-N 2.84Å; P59-K66 HydrophobicContact CG-CD 3.59Å; P59-K66 HydrophobicContact CG-CG 3.73Å; R64-K66 PolarHBondContact O-N 2.89Å; K66-T83 HydrophobicContact CB-CG2 4.34Å; K66-N162 HydrophobicContact CD-CB 4.35Å; K66-N162 WeakPolarHBondContact CD-OD1 3.42Å; K66-N162 WeakPolarHBondContact CE-OD1 3.41Å; K66-N162 PolarHBondContact NZ-OD1 3.05Å
67	K	94.3	Very high	91.7	Very high	81 Å²	81	42.2 Å²	42.2	35%	0.352	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	167.9	171.7	64.2	167.2	-169.7	155	0	111.3	T54 F55 R56 E69 T83	T54-K67 HydrophobicContact CG2-CB 4.33Å; T54-K67 HydrophobicContact CG2-CD 4.38Å; F55-K67 CarbonylContact O-C 3.51Å; F55-K67 WeakPolarHBondContact O-CA 3.39Å; F55-K67 WeakPolarHBondContact O-CB 3.42Å; R56-K67 HydrophobicContact CB-CB 4.36Å; K67-E69 WeakPolarHBondContact CE-OE1 3.47Å; K67-E69 WeakPolarHBondContact CE-OE2 3.19Å; K67-E69 WeakPolarHBondContact CG-OE1 3.31Å; K67-E69 IonicContact NZ-OE1 3.73Å; K67-E69 IonicContact NZ-OE2 2.93Å; K67-E69 PolarHBondContact NZ-OE2 2.89Å; K67-T83 WeakPolarHBondContact O-CB 3.31Å; K67-T83 WeakPolarHBondContact O-CG2 3.29Å; K67-T83 PolarHBondContact O-OG1 3.05Å
68	T	95.5	Very high	91.4	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.006	21%	0.212	C	C	.	.			trans	-73.1	142.8	165.5	47.4	0	0	0	0	110.6	P21 L23 F55 W57 Q82	P21-T68 HydrophobicContact CB-CG2 3.72Å; L23-T68 HydrophobicContact CD2-CG2 4.37Å; F55-T68 HydrophobicContact CB-CG2 4.17Å; F55-T68 HydrophobicContact CD2-CG2 4.27Å; F55-T68 PolarHBondContact N-OG1 3.02Å; F55-T68 PolarHBondContact O-N 3.36Å; F55-T68 VanDerWaalsContact O-N 3.08Å; W57-T68 HydrophobicContact CH2-CG2 4.48Å; W57-T68 HydrophobicContact CZ3-CG2 4.3Å; T68-Q82 HydrophobicContact CG2-CB 3.71Å
69	E	93.5	Very high	91.3	Very high	41 Å²	41	40.9 Å²	40.9	19%	0.192	20%	0.201	C	C	.	.			trans	-119.1	-15.9	-179.3	-56	-68	174	0	0	112.4	K46 K67 Q82	K46-E69 PolarHBondContact N-O 3.43Å; K46-E69 VanDerWaalsContact N-O 3.15Å; K67-E69 WeakPolarHBondContact CE-OE1 3.47Å; K67-E69 WeakPolarHBondContact CE-OE2 3.19Å; K67-E69 WeakPolarHBondContact CG-OE1 3.31Å; K67-E69 IonicContact NZ-OE1 3.73Å; K67-E69 IonicContact NZ-OE2 2.93Å; K67-E69 PolarHBondContact NZ-OE2 2.89Å; E69-Q82 PolarHBondContact N-O 3.34Å
70	V	93.6	Very high	91.3	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.2	C	C	.	.	S	Bend	trans	-132.8	151.9	173.9	-60.5	0	0	0	0	111.8	C45 I47 F52 C74 Q82 L85	C45-V70 VanDerWaalsContact SG-CA 3.58Å; I47-V70 HydrophobicContact CG1-CG1 3.8Å; F52-V70 VanDerWaalsContact CE2-O 3.25Å; F52-V70 WeakPolarHBondContact CE2-O 3.38Å; V70-C74 HydrophobicContact CB-CB 4.37Å; V70-Q82 HydrophobicContact CG2-CB 4.29Å; V70-Q82 HydrophobicContact CG2-CG 4.35Å; V70-Q82 PolarHBondContact N-O 3.45Å; V70-Q82 WeakPolarHBondContact O-CG 3.5Å; V70-Q82 PolarHBondContact O-NE2 2.94Å; V70-L85 HydrophobicContact CB-CD2 4.41Å; V70-L85 HydrophobicContact CG1-CD2 3.85Å; V70-L85 HydrophobicContact CG2-CD2 3.62Å
71	C	92.3	Very high	91.6	Very high	6 Å²	6	39.9 Å²	39.9	4%	0.041	19%	0.192	C	C	.	.			trans	-69.8	161.2	178.8	72.8	0	0	0	0	112.6	E16 C45 C48 F52 T73 C74 S75	E16-C71 VanDerWaalsContact OE2-CB 3.26Å; E16-C71 WeakPolarHBondContact OE2-CB 3.45Å; C45-C71 HydrophobicContact CB-CB 3.96Å; C45-C71 PolarHBondContact SG-N 3.28Å; C45-C71 VanDerWaalsContact SG-N 3.39Å; C48-C71 VanDerWaalsContact SG-SG 3.69Å; F52-C71 HydrophobicContact CB-CB 3.57Å; F52-C71 HydrophobicContact CD1-CB 4.32Å; F52-C71 HydrophobicContact CD2-CB 3.97Å; F52-C71 HydrophobicContact CG-CB 3.7Å; C71-T73 VanDerWaalsContact C-N 3.28Å; C71-T73 PolarHBondContact O-N 3.15Å; C71-C74 PolarHBondContact O-N 2.94Å; C71-C74 VanDerWaalsContact SG-SG 3.69Å; C71-S75 PolarHBondContact O-N 3.23Å
72	Q	90.3	Very high	91.8	Very high	46 Å²	46	29.9 Å²	29.9	22%	0.215	15%	0.148	C	C	.	.	H	α-helix	trans	-60.4	-36.5	178	-153.8	-173.2	42.5	0	0	111.7	E16 I22 C74 S75 K76 Q82	E16-Q72 VanDerWaalsContact CD-CB 3.46Å; E16-Q72 WeakPolarHBondContact OE1-CB 3.15Å; E16-Q72 PolarHBondContact OE1-N 3.19Å; E16-Q72 WeakPolarHBondContact OE2-CA 3.39Å; E16-Q72 WeakPolarHBondContact OE2-CB 3.15Å; E16-Q72 PolarHBondContact OE2-N 3.05Å; I22-Q72 HydrophobicContact CD1-CG 3.43Å; I22-Q72 VanDerWaalsContact CD1-CG 3.43Å; I22-Q72 HydrophobicContact CG1-CG 3.95Å; Q72-C74 PolarHBondContact O-N 2.68Å; Q72-S75 WeakPolarHBondContact O-CB 3.21Å; Q72-S75 PolarHBondContact O-N 2.75Å; Q72-K76 HydrophobicContact CG-CD 4.33Å; Q72-K76 HydrophobicContact CG-CG 4.48Å; Q72-K76 WeakPolarHBondContact O-CB 3.3Å; Q72-K76 WeakPolarHBondContact O-CG 3.32Å; Q72-K76 PolarHBondContact O-N 3.04Å; Q72-Q82 VanDerWaalsContact CA-NE2 3.32Å; Q72-Q82 VanDerWaalsContact N-NE2 3.11Å
73	T	89.7	Confident	92.2	Very high	14 Å²	14	28 Å²	28	9%	0.086	12%	0.124	C	C	.	.	H	α-helix	trans	-56.8	-48.5	174.5	-44.6	0	0	0	0	112.4	E16 C71 L77 I118 E122 M125	E16-T73 PolarHBondContact OE2-N 2.7Å; E16-T73 VanDerWaalsContact OE2-N 3.1Å; E16-T73 PolarHBondContact OE2-OG1 3.39Å; C71-T73 VanDerWaalsContact C-N 3.28Å; C71-T73 PolarHBondContact O-N 3.15Å; T73-L77 PolarHBondContact O-N 3.06Å; T73-L77 VanDerWaalsContact O-N 3.13Å; T73-I118 HydrophobicContact CG2-CG2 4.19Å; T73-E122 HydrophobicContact CG2-CB 3.93Å; T73-M125 HydrophobicContact CG2-CE 3.5Å
74	C	90.9	Very high	92.3	Very high	0 Å²	0	26 Å²	26	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-70.3	-32.2	176.8	-70	0	0	0	0	112.4	V70 C71 Q72 Y204	V70-C74 HydrophobicContact CB-CB 4.37Å; C71-C74 PolarHBondContact O-N 2.94Å; C71-C74 VanDerWaalsContact SG-SG 3.69Å; Q72-C74 PolarHBondContact O-N 2.68Å; C74-Y204 HydrophobicContact CB-CE2 4.05Å; C74-Y204 PolarHBondContact O-OH 2.92Å
75	S	92.6	Very high	92.3	Very high	1 Å²	1	21.2 Å²	21.2	1%	0.007	10%	0.097	C	C	.	.	H	α-helix	trans	-64	-46.6	174.9	172.5	0	0	0	0	112.1	I22 C71 Q72 K78 N79 V80	I22-S75 WeakPolarHBondContact CB-OG 3.35Å; I22-S75 WeakPolarHBondContact CG2-OG 3.37Å; C71-S75 PolarHBondContact O-N 3.23Å; Q72-S75 WeakPolarHBondContact O-CB 3.21Å; Q72-S75 PolarHBondContact O-N 2.75Å; S75-K78 PolarHBondContact O-N 2.88Å; S75-N79 WeakPolarHBondContact O-CA 3.32Å; S75-N79 PolarHBondContact O-N 3.22Å; S75-V80 WeakPolarHBondContact CB-O 3.49Å; S75-V80 PolarHBondContact O-N 3.35Å; S75-V80 PolarHBondContact OG-O 3.06Å
76	K	90.2	Very high	92.3	Very high	34 Å²	34	15 Å²	15	15%	0.148	7%	0.074	C	C	.	.	H	α-helix	trans	-69.7	-34	179	-74.1	177.4	170.5	179.6	0	114	I22 Q72 K78 M125 G130 A134	I22-K76 HydrophobicContact CD1-CG 3.81Å; Q72-K76 HydrophobicContact CG-CD 4.33Å; Q72-K76 HydrophobicContact CG-CG 4.48Å; Q72-K76 WeakPolarHBondContact O-CB 3.3Å; Q72-K76 WeakPolarHBondContact O-CG 3.32Å; Q72-K76 PolarHBondContact O-N 3.04Å; K76-K78 VanDerWaalsContact C-N 3.27Å; K76-K78 PolarHBondContact O-N 2.81Å; K76-M125 HydrophobicContact CB-SD 3.46Å; K76-M125 WeakPolarHBondContact CB-SD 3.39Å; K76-M125 HydrophobicContact CD-SD 3.86Å; K76-M125 HydrophobicContact CG-SD 4.31Å; K76-G130 WeakPolarHBondContact CE-O 3.34Å; K76-G130 PolarHBondContact NZ-O 3.48Å; K76-A134 PolarHBondContact O-N 3.44Å
77	L	88.5	Confident	92.3	Very high	10 Å²	10	14.1 Å²	14.1	5%	0.052	7%	0.069	C	C	.	.	H	α-helix	trans	-62.6	-29.6	175.8	-91	170	0	0	0	114.1	T73 F117 A121 M125	T73-L77 PolarHBondContact O-N 3.06Å; T73-L77 VanDerWaalsContact O-N 3.13Å; L77-F117 HydrophobicContact CD1-CE1 4.22Å; L77-F117 HydrophobicContact CD2-CE1 4.13Å; L77-A121 HydrophobicContact CD1-CB 4.11Å; L77-A121 HydrophobicContact CD2-CB 3.89Å; L77-A121 HydrophobicContact CG-CB 4.31Å; L77-M125 HydrophobicContact CD1-CE 4.41Å; L77-M125 HydrophobicContact CD2-CE 4.38Å; L77-M125 HydrophobicContact CG-CE 3.84Å
78	K	88.4	Confident	92.1	Very high	4 Å²	4	13.1 Å²	13.1	2%	0.017	7%	0.068	C	C	.	.	H	α-helix	trans	-120.6	4.7	-175.2	-85.4	-64.1	-161	-178.5	0	113.9	S75 K76 V80 V94 R97 D98 D105 L137 Y204	S75-K78 PolarHBondContact O-N 2.88Å; K76-K78 VanDerWaalsContact C-N 3.27Å; K76-K78 PolarHBondContact O-N 2.81Å; K78-V80 HydrophobicContact CB-CG1 4.17Å; K78-V80 HydrophobicContact CB-CG2 3.97Å; K78-V80 WeakPolarHBondContact O-CG1 3.48Å; K78-V80 PolarHBondContact O-N 2.77Å; K78-V94 HydrophobicContact CD-CG1 3.98Å; K78-R97 VanDerWaalsContact O-CZ 3.3Å; K78-R97 PolarHBondContact O-NH1 3.27Å; K78-R97 VanDerWaalsContact O-NH1 3.14Å; K78-R97 PolarHBondContact O-NH2 3.5Å; K78-D98 IonicContact NZ-OD2 2.94Å; K78-D98 PolarHBondContact NZ-OD2 2.96Å; K78-D105 WeakPolarHBondContact CE-OD2 3.26Å; K78-D105 IonicContact NZ-OD2 2.65Å; K78-D105 PolarHBondContact NZ-OD2 2.88Å; K78-L137 VanDerWaalsContact C-CD2 3.47Å; K78-Y204 HydrophobicContact CB-CE2 4.18Å; K78-Y204 HydrophobicContact CG-CE1 4.4Å; K78-Y204 HydrophobicContact CG-CE2 4.11Å
79	N	90.7	Very high	91.8	Very high	17 Å²	17	17.4 Å²	17.4	9%	0.091	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.1	51.1	-172.5	-163.5	5.3	0	0	0	112.8	S75 D87 L88 E89 R97 S133 L137	S75-N79 WeakPolarHBondContact O-CA 3.32Å; S75-N79 PolarHBondContact O-N 3.22Å; N79-D87 WeakPolarHBondContact O-CA 3.42Å; N79-L88 PolarHBondContact O-N 2.62Å; N79-L88 WeakPolarHBondContact OD1-CD1 3.42Å; N79-E89 PolarHBondContact ND2-OE1 3.4Å; N79-R97 PolarHBondContact O-NH2 2.92Å; N79-S133 WeakPolarHBondContact CB-OG 3.15Å; N79-L137 HydrophobicContact CB-CD2 3.6Å
80	V	93.5	Very high	91.6	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	8%	0.083	C	C	.	.	B	Isolated β-bridge	trans	-123	145.2	-174.4	-70.2	0	0	0	0	114	S75 K78 Q82 L86 V94 Y204	S75-V80 WeakPolarHBondContact CB-O 3.49Å; S75-V80 PolarHBondContact O-N 3.35Å; S75-V80 PolarHBondContact OG-O 3.06Å; K78-V80 HydrophobicContact CB-CG1 4.17Å; K78-V80 HydrophobicContact CB-CG2 3.97Å; K78-V80 WeakPolarHBondContact O-CG1 3.48Å; K78-V80 PolarHBondContact O-N 2.77Å; V80-Q82 PolarHBondContact O-N 2.65Å; V80-L86 WeakPolarHBondContact CA-O 3.28Å; V80-V94 HydrophobicContact CG1-CG2 3.58Å; V80-Y204 HydrophobicContact CG2-CD2 4.49Å; V80-Y204 HydrophobicContact CG2-CE2 4.32Å
81	C	94.9	Very high	91.5	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.098	C	C	.	.			trans	-62.5	125.9	171.5	168	0	0	0	0	111.9	C24 T83 C84 L85 L86 L88	C24-C81 HydrophobicContact CB-CB 4.06Å; C24-C81 PolarHBondContact N-SG 3.37Å; C24-C81 VanDerWaalsContact N-SG 3.44Å; C24-C81 VanDerWaalsContact SG-SG 3.63Å; C81-T83 PolarHBondContact O-N 3.07Å; C81-C84 PolarHBondContact O-N 3.23Å; C81-L85 PolarHBondContact O-N 2.89Å; C81-L86 PolarHBondContact N-O 2.96Å; C81-L88 HydrophobicContact CB-CD2 3.71Å
82	Q	94.5	Very high	91.5	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-10.6	-174.6	-74.2	177.7	-43.6	0	0	115.8	I22 L23 T68 E69 V70 Q72 V80	I22-Q82 HydrophobicContact CB-CG 4.31Å; I22-Q82 PolarHBondContact O-N 3.18Å; L23-Q82 HydrophobicContact CD2-CB 4.42Å; T68-Q82 HydrophobicContact CG2-CB 3.71Å; E69-Q82 PolarHBondContact N-O 3.34Å; V70-Q82 HydrophobicContact CG2-CB 4.29Å; V70-Q82 HydrophobicContact CG2-CG 4.35Å; V70-Q82 PolarHBondContact N-O 3.45Å; V70-Q82 WeakPolarHBondContact O-CG 3.5Å; V70-Q82 PolarHBondContact O-NE2 2.94Å; Q72-Q82 VanDerWaalsContact CA-NE2 3.32Å; Q72-Q82 VanDerWaalsContact N-NE2 3.11Å; V80-Q82 PolarHBondContact O-N 2.65Å
83	T	93.3	Very high	91.6	Very high	24 Å²	24	15.8 Å²	15.8	15%	0.147	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116	-32	-177.1	-60.4	0	0	0	0	114.4	W57 K66 K67 C81	W57-T83 VanDerWaalsContact CH2-OG1 3.31Å; W57-T83 WeakPolarHBondContact CH2-OG1 3.36Å; K66-T83 HydrophobicContact CB-CG2 4.34Å; K67-T83 WeakPolarHBondContact O-CB 3.31Å; K67-T83 WeakPolarHBondContact O-CG2 3.29Å; K67-T83 PolarHBondContact O-OG1 3.05Å; C81-T83 PolarHBondContact O-N 3.07Å
84	C	91.8	Very high	91.7	Very high	9 Å²	9	15.1 Å²	15.1	6%	0.061	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.7	-10.6	-179	68.5	0	0	0	0	114.3	C24 C81 L86 R203	C24-C84 VanDerWaalsContact SG-SG 3.68Å; C81-C84 PolarHBondContact O-N 3.23Å; C84-L86 HydrophobicContact CB-CG 4.49Å; C84-L86 PolarHBondContact O-N 2.93Å; C84-R203 PolarHBondContact O-NH2 2.9Å
85	L	93.1	Very high	91.8	Very high	6 Å²	6	16.6 Å²	16.6	3%	0.031	9%	0.09	C	C	.	.			trans	52.6	36.2	-177.1	-51	-179.7	0	0	0	112.3	V70 C81 I200 Y204	V70-L85 HydrophobicContact CB-CD2 4.41Å; V70-L85 HydrophobicContact CG1-CD2 3.85Å; V70-L85 HydrophobicContact CG2-CD2 3.62Å; C81-L85 PolarHBondContact O-N 2.89Å; L85-I200 HydrophobicContact CD1-CG2 3.55Å; L85-Y204 HydrophobicContact CD2-CD2 4.44Å
86	L	93.8	Very high	91.7	Very high	2 Å²	2	16.5 Å²	16.5	1%	0.01	9%	0.09	C	C	.	.	B	Isolated β-bridge	trans	-111.2	155.1	166.6	-57.2	-169.6	0	0	0	107.9	V80 C81 C84 G91 L92 P93	V80-L86 WeakPolarHBondContact CA-O 3.28Å; C81-L86 PolarHBondContact N-O 2.96Å; C84-L86 HydrophobicContact CB-CG 4.49Å; C84-L86 PolarHBondContact O-N 2.93Å; L86-G91 WeakPolarHBondContact CD1-O 3.46Å; L86-L92 WeakPolarHBondContact CA-O 3.33Å; L86-L92 WeakPolarHBondContact CB-O 3.38Å; L86-P93 HydrophobicContact CD2-CB 4.15Å; L86-P93 HydrophobicContact CD2-CG 4.14Å
87	D	92.4	Very high	91.7	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.083	C	C	.	.	B	Isolated β-bridge	trans	-51.1	150.6	174.6	177.2	53.5	0	0	0	113.6	N79 E89 Y90 G91 L92 R97	N79-D87 WeakPolarHBondContact O-CA 3.42Å; D87-E89 PolarHBondContact OD2-N 3Å; D87-Y90 WeakPolarHBondContact OD2-CA 2.96Å; D87-Y90 WeakPolarHBondContact OD2-CB 3.22Å; D87-Y90 WeakPolarHBondContact OD2-CD2 3.48Å; D87-Y90 PolarHBondContact OD2-N 3.43Å; D87-G91 WeakPolarHBondContact O-CA 3.47Å; D87-L92 WeakPolarHBondContact CB-O 3.2Å; D87-L92 PolarHBondContact N-O 2.91Å; D87-R97 IonicContact OD1-CZ 2.83Å; D87-R97 VanDerWaalsContact OD1-CZ 3.26Å; D87-R97 IonicContact OD1-NE 3.51Å; D87-R97 PolarHBondContact OD1-NE 3.2Å; D87-R97 IonicContact OD1-NH2 2.63Å; D87-R97 PolarHBondContact OD1-NH2 3.45Å
88	L	90.9	Very high	91.7	Very high	61 Å²	61	15.2 Å²	15.2	32%	0.319	8%	0.084	S	C	.	.	S	Bend	trans	-86.3	-29.3	179.2	-63.2	-179.6	0	0	0	113.3	I22 C24 N79 C81	I22-L88 HydrophobicContact CG2-CD1 3.41Å; I22-L88 VanDerWaalsContact CG2-CD1 3.41Å; I22-L88 HydrophobicContact CG2-CD2 4.33Å; I22-L88 HydrophobicContact CG2-CG 4.47Å; C24-L88 HydrophobicContact CB-CD2 4.07Å; N79-L88 PolarHBondContact O-N 2.62Å; N79-L88 WeakPolarHBondContact OD1-CD1 3.42Å; C81-L88 HydrophobicContact CB-CD2 3.71Å
89	E	88.1	Confident	91.7	Very high	90 Å²	90	21.8 Å²	21.8	42%	0.421	11%	0.11	S	C	.	.	S	Bend	trans	-82.4	-64.4	-175.6	-69.4	163.6	-152.8	0	0	112.2	N79 D87	N79-E89 PolarHBondContact ND2-OE1 3.4Å; D87-E89 PolarHBondContact OD2-N 3Å
90	Y	89.5	Confident	91.6	Very high	23 Å²	23	22 Å²	22	9%	0.09	11%	0.114	C	C	.	.	S	Bend	trans	-91.8	-15.9	-176.2	-49.2	-77.9	0	0	0	112.8	D87 L92 P145 N146 L149 M150 A153	D87-Y90 WeakPolarHBondContact OD2-CA 2.96Å; D87-Y90 WeakPolarHBondContact OD2-CB 3.22Å; D87-Y90 WeakPolarHBondContact OD2-CD2 3.48Å; D87-Y90 PolarHBondContact OD2-N 3.43Å; Y90-L92 VanDerWaalsContact C-N 3.35Å; Y90-L92 HydrophobicContact CG-CD1 4.49Å; Y90-P145 WeakPolarHBondContact OH-CA 3.46Å; Y90-N146 PolarHBondContact OH-N 3.49Å; Y90-L149 HydrophobicContact CD1-CB 3.61Å; Y90-L149 HydrophobicContact CD2-CB 3.95Å; Y90-L149 HydrophobicContact CD2-CD1 3.8Å; Y90-L149 HydrophobicContact CD2-CG 4.48Å; Y90-L149 HydrophobicContact CE1-CB 3.8Å; Y90-L149 HydrophobicContact CE2-CB 4.17Å; Y90-L149 HydrophobicContact CE2-CD1 3.67Å; Y90-L149 HydrophobicContact CG-CB 3.7Å; Y90-L149 HydrophobicContact CG-CD1 4.43Å; Y90-M150 HydrophobicContact CD1-CG 4.28Å; Y90-M150 HydrophobicContact CD1-SD 3.78Å; Y90-M150 HydrophobicContact CE1-CG 3.88Å; Y90-M150 HydrophobicContact CE1-SD 3.65Å; Y90-A153 WeakPolarHBondContact O-CB 3.33Å
91	G	91.2	Very high	91.2	Very high	32 Å²	32	23.3 Å²	23.3	33%	0.33	12%	0.121	S	C	.	.			trans	72.1	25.1	-178.2	0	0	0	0	0	114.5	L86 D87	L86-G91 WeakPolarHBondContact CD1-O 3.46Å; D87-G91 WeakPolarHBondContact O-CA 3.47Å
92	L	92.5	Very high	90.6	Very high	3 Å²	3	26.1 Å²	26.1	2%	0.016	15%	0.15	C	C	.	.			trans	-102.1	164.4	-172.6	-60.8	177.7	0	0	0	113.1	L86 D87 Y90 V96 L149 L152 L215	L86-L92 WeakPolarHBondContact CA-O 3.33Å; L86-L92 WeakPolarHBondContact CB-O 3.38Å; D87-L92 WeakPolarHBondContact CB-O 3.2Å; D87-L92 PolarHBondContact N-O 2.91Å; Y90-L92 VanDerWaalsContact C-N 3.35Å; Y90-L92 HydrophobicContact CG-CD1 4.49Å; L92-V96 HydrophobicContact CD1-CG1 4.44Å; L92-L149 HydrophobicContact CD1-CB 4.1Å; L92-L149 HydrophobicContact CD1-CD2 3.76Å; L92-L152 HydrophobicContact CD1-CB 3.91Å; L92-L152 HydrophobicContact CD2-CB 4.2Å; L92-L215 HydrophobicContact CD2-CD2 3.79Å
93	P	93.9	Very high	89.8	Confident	1 Å²	1	27 Å²	27	1%	0.006	15%	0.154	C	C	.	.	B	Isolated β-bridge	trans	-66.8	147.5	171.4	-16.2	30.3	0	0	0	112.1	L86 Q95 V96 R97 V211 A212 L215	L86-P93 HydrophobicContact CD2-CB 4.15Å; L86-P93 HydrophobicContact CD2-CG 4.14Å; P93-Q95 VanDerWaalsContact C-N 3.35Å; P93-Q95 PolarHBondContact O-N 2.81Å; P93-V96 HydrophobicContact CB-CG2 4.14Å; P93-V96 HydrophobicContact CG-CG2 4.04Å; P93-V96 WeakPolarHBondContact O-CB 3.42Å; P93-V96 PolarHBondContact O-N 3.4Å; P93-R97 PolarHBondContact O-N 3.3Å; P93-V211 HydrophobicContact CG-CG1 4.04Å; P93-A212 HydrophobicContact CB-CB 4.09Å; P93-A212 HydrophobicContact CG-CB 4.43Å; P93-L215 HydrophobicContact CG-CD2 4.38Å
94	V	91.7	Very high	88.9	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-52.6	-49.8	-178.5	176.9	0	0	0	0	111.5	K78 V80 V96 R97 D98	K78-V94 HydrophobicContact CD-CG1 3.98Å; V80-V94 HydrophobicContact CG1-CG2 3.58Å; V94-V96 PolarHBondContact O-N 3.43Å; V94-V96 VanDerWaalsContact O-N 3.1Å; V94-R97 PolarHBondContact O-N 2.98Å; V94-D98 WeakPolarHBondContact CG1-OD2 3.48Å; V94-D98 WeakPolarHBondContact O-CB 3.18Å; V94-D98 PolarHBondContact O-N 3.44Å; V94-D98 VanDerWaalsContact O-OD1 3.14Å
95	Q	91.8	Very high	87.9	Confident	31 Å²	31	35.5 Å²	35.5	15%	0.145	19%	0.19	C	C	.	.	H	α-helix	trans	-55	-31.5	177.6	-175.6	-179.4	-29.7	0	0	113.8	P93 Y99 G206 A212 D213	P93-Q95 VanDerWaalsContact C-N 3.35Å; P93-Q95 PolarHBondContact O-N 2.81Å; Q95-Y99 WeakPolarHBondContact O-CB 3.42Å; Q95-Y99 PolarHBondContact O-N 3.17Å; Q95-G206 WeakPolarHBondContact CB-O 3.49Å; Q95-G206 VanDerWaalsContact CG-O 3.3Å; Q95-G206 WeakPolarHBondContact CG-O 3.43Å; Q95-G206 PolarHBondContact OE1-O 2.98Å; Q95-A212 HydrophobicContact CB-CB 3.65Å; Q95-A212 HydrophobicContact CG-CB 3.94Å; Q95-D213 PolarHBondContact NE2-OD1 3.28Å
96	V	92.2	Very high	86.9	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-77	-42.5	178.1	-174.7	0	0	0	0	111	L92 P93 V94 A100 L149 L152 A212 L215 L216	L92-V96 HydrophobicContact CD1-CG1 4.44Å; P93-V96 HydrophobicContact CB-CG2 4.14Å; P93-V96 HydrophobicContact CG-CG2 4.04Å; P93-V96 WeakPolarHBondContact O-CB 3.42Å; P93-V96 PolarHBondContact O-N 3.4Å; V94-V96 PolarHBondContact O-N 3.43Å; V94-V96 VanDerWaalsContact O-N 3.1Å; V96-A100 PolarHBondContact O-N 3.14Å; V96-L149 HydrophobicContact CG1-CD2 4.18Å; V96-L152 HydrophobicContact CG1-CD1 3.78Å; V96-A212 HydrophobicContact CG2-CB 3.58Å; V96-L215 HydrophobicContact CG2-CB 3.91Å; V96-L215 HydrophobicContact CG2-CD2 4.16Å; V96-L216 HydrophobicContact CG1-CD2 4.26Å; V96-L216 HydrophobicContact CG2-CG 4.42Å
97	R	89.5	Confident	86.3	Confident	2 Å²	2	43.1 Å²	43.1	1%	0.008	23%	0.23	C	C	.	.	H	α-helix	trans	-64.3	-50.6	178.1	-164.1	-140	-66.5	121.4	-14.5	110.6	K78 N79 D87 P93 V94 Y99 A100 L101 L149	K78-R97 VanDerWaalsContact O-CZ 3.3Å; K78-R97 PolarHBondContact O-NH1 3.27Å; K78-R97 VanDerWaalsContact O-NH1 3.14Å; K78-R97 PolarHBondContact O-NH2 3.5Å; N79-R97 PolarHBondContact O-NH2 2.92Å; D87-R97 IonicContact OD1-CZ 2.83Å; D87-R97 VanDerWaalsContact OD1-CZ 3.26Å; D87-R97 IonicContact OD1-NE 3.51Å; D87-R97 PolarHBondContact OD1-NE 3.2Å; D87-R97 IonicContact OD1-NH2 2.63Å; D87-R97 PolarHBondContact OD1-NH2 3.45Å; P93-R97 PolarHBondContact O-N 3.3Å; V94-R97 PolarHBondContact O-N 2.98Å; R97-Y99 VanDerWaalsContact C-N 3.35Å; R97-Y99 PolarHBondContact O-N 3.36Å; R97-A100 PolarHBondContact O-N 2.93Å; R97-A100 VanDerWaalsContact O-N 3.15Å; R97-L101 HydrophobicContact CG-CD1 3.76Å; R97-L101 HydrophobicContact CG-CG 4.48Å; R97-L101 WeakPolarHBondContact O-CG 3.45Å; R97-L101 PolarHBondContact O-N 2.88Å; R97-L149 HydrophobicContact CB-CD1 4.36Å; R97-L149 HydrophobicContact CG-CD1 3.65Å
98	D	89.1	Confident	85.9	Confident	14 Å²	14	45 Å²	45	8%	0.075	24%	0.242	C	C	.	.	H	α-helix	trans	-66.4	-38.5	-173.9	-58.8	4.7	0	0	0	110.8	K78 V94 L101 G102 L103	K78-D98 IonicContact NZ-OD2 2.94Å; K78-D98 PolarHBondContact NZ-OD2 2.96Å; V94-D98 WeakPolarHBondContact CG1-OD2 3.48Å; V94-D98 WeakPolarHBondContact O-CB 3.18Å; V94-D98 PolarHBondContact O-N 3.44Å; V94-D98 VanDerWaalsContact O-OD1 3.14Å; D98-L101 PolarHBondContact O-N 3.17Å; D98-G102 PolarHBondContact O-N 2.86Å; D98-L103 HydrophobicContact CB-CB 4.2Å; D98-L103 PolarHBondContact O-N 3.16Å
99	Y	88.5	Confident	85.6	Confident	142 Å²	142	47.3 Å²	47.3	56%	0.557	25%	0.25	S	C	*	.	H	α-helix	trans	-59.4	-45.1	171.2	177.9	-93.8	0	0	0	112.9	Q95 R97 L101 G102 M148 L216	Q95-Y99 WeakPolarHBondContact O-CB 3.42Å; Q95-Y99 PolarHBondContact O-N 3.17Å; R97-Y99 VanDerWaalsContact C-N 3.35Å; R97-Y99 PolarHBondContact O-N 3.36Å; Y99-L101 VanDerWaalsContact C-N 3.35Å; Y99-G102 PolarHBondContact O-N 3.4Å; Y99-M148 HydrophobicContact CD1-CE 3.96Å; Y99-M148 HydrophobicContact CE1-CE 3.97Å; Y99-L216 HydrophobicContact CD1-CD2 3.41Å; Y99-L216 VanDerWaalsContact CD1-CD2 3.41Å; Y99-L216 HydrophobicContact CE1-CD2 3.91Å; Y99-L216 HydrophobicContact CG-CD2 3.88Å
100	A	86.9	Confident	85.4	Confident	22 Å²	22	48 Å²	48	18%	0.182	26%	0.261	C	S	.	.	H	α-helix	trans	-73.6	-24.6	-178.8	0	0	0	0	0	113.7	V96 R97 N146 M148 L149	V96-A100 PolarHBondContact O-N 3.14Å; R97-A100 PolarHBondContact O-N 2.93Å; R97-A100 VanDerWaalsContact O-N 3.15Å; A100-N146 PolarHBondContact O-ND2 3.26Å; A100-M148 HydrophobicContact CB-CG 4.45Å; A100-M148 HydrophobicContact CB-SD 3.86Å; A100-L149 HydrophobicContact CB-CD1 4.14Å; A100-L149 HydrophobicContact CB-CD2 3.57Å; A100-L149 HydrophobicContact CB-CG 3.74Å
101	L	85.6	Confident	85	Confident	28 Å²	28	49.7 Å²	49.7	15%	0.147	28%	0.284	C	S	.	.	H	α-helix	trans	-88	-7.5	174.3	-65	171.3	0	0	0	113	R97 D98 Y99 L103 L137 Y140 N146	R97-L101 HydrophobicContact CG-CD1 3.76Å; R97-L101 HydrophobicContact CG-CG 4.48Å; R97-L101 WeakPolarHBondContact O-CG 3.45Å; R97-L101 PolarHBondContact O-N 2.88Å; D98-L101 PolarHBondContact O-N 3.17Å; Y99-L101 VanDerWaalsContact C-N 3.35Å; L101-L103 HydrophobicContact CB-CB 4.42Å; L101-L103 HydrophobicContact CB-CD1 3.99Å; L101-L103 HydrophobicContact CB-CG 4.06Å; L101-L103 HydrophobicContact CD1-CD1 3.81Å; L101-L103 PolarHBondContact O-N 3.48Å; L101-L137 HydrophobicContact CD1-CD1 4.04Å; L101-Y140 HydrophobicContact CB-CD1 4.38Å; L101-Y140 WeakPolarHBondContact O-CE1 3.36Å; L101-N146 HydrophobicContact CD2-CB 4.34Å; L101-N146 WeakPolarHBondContact CD2-ND2 3.25Å
102	G	82.5	Confident	84.7	Confident	58 Å²	58	51.8 Å²	51.8	60%	0.598	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	69	13.9	-172.3	0	0	0	0	0	114	D98 Y99 K104	D98-G102 PolarHBondContact O-N 2.86Å; Y99-G102 PolarHBondContact O-N 3.4Å; G102-K104 PolarHBondContact O-N 3.38Å
103	L	78	Confident	84.4	Confident	18 Å²	18	56.9 Å²	56.9	9%	0.094	33%	0.326	C	S	.	.			trans	-72.7	120	-175.4	-87.9	170.2	0	0	0	111.6	D98 L101 L137 Y140	D98-L103 HydrophobicContact CB-CB 4.2Å; D98-L103 PolarHBondContact O-N 3.16Å; L101-L103 HydrophobicContact CB-CB 4.42Å; L101-L103 HydrophobicContact CB-CD1 3.99Å; L101-L103 HydrophobicContact CB-CG 4.06Å; L101-L103 HydrophobicContact CD1-CD1 3.81Å; L101-L103 PolarHBondContact O-N 3.48Å; L103-L137 HydrophobicContact CD1-CB 4.42Å; L103-L137 HydrophobicContact CD1-CD1 3.55Å; L103-Y140 HydrophobicContact CD1-CD2 4.12Å; L103-Y140 HydrophobicContact CD1-CG 4.32Å; L103-Y140 HydrophobicContact CD2-CD2 3.58Å; L103-Y140 HydrophobicContact CD2-CE2 3.42Å; L103-Y140 VanDerWaalsContact CD2-CE2 3.42Å; L103-Y140 HydrophobicContact CD2-CG 4.43Å; L103-Y140 HydrophobicContact CG-CD2 3.93Å; L103-Y140 HydrophobicContact CG-CE2 4.03Å; L103-Y140 HydrophobicContact CG-CG 4.31Å
104	K	74.7	Confident	84.1	Confident	182 Å²	182	57.9 Å²	57.9	79%	0.791	33%	0.33	S	S	*	.			trans	-102	85.9	165.7	-69	179	-178.8	176.3	0	108.7	G102 D106	G102-K104 PolarHBondContact O-N 3.38Å; K104-D106 PolarHBondContact O-N 3.01Å
105	D	71	Confident	83.7	Confident	31 Å²	31	58.9 Å²	58.9	17%	0.166	34%	0.336	C	S	.	.			trans	-84.2	87.7	178.7	-86.8	-3.5	0	0	0	110.4	K78 L107	K78-D105 WeakPolarHBondContact CE-OD2 3.26Å; K78-D105 IonicContact NZ-OD2 2.65Å; K78-D105 PolarHBondContact NZ-OD2 2.88Å; D105-L107 HydrophobicContact CB-CD1 3.9Å; D105-L107 PolarHBondContact O-N 3.06Å
106	D	71.8	Confident	83.6	Confident	147 Å²	147	65.5 Å²	65.5	79%	0.786	36%	0.361	S	S	*	.			trans	-72.8	48.9	-178.9	-66.1	-41.2	0	0	0	113.4	K104 P108	K104-D106 PolarHBondContact O-N 3.01Å; D106-P108 WeakPolarHBondContact O-CD 3.47Å
107	L	80.5	Confident	83.4	Confident	21 Å²	21	69 Å²	69	11%	0.11	38%	0.376	C	S	.	.			trans	-63.5	123.6	175.1	-90.3	75.9	0	0	0	110.4	D105 K109 F117 Y204 Y205	D105-L107 HydrophobicContact CB-CD1 3.9Å; D105-L107 PolarHBondContact O-N 3.06Å; L107-K109 PolarHBondContact O-N 3.17Å; L107-F117 HydrophobicContact CD1-CE1 4.39Å; L107-F117 HydrophobicContact CD1-CZ 4.35Å; L107-F117 HydrophobicContact CD2-CE1 4.29Å; L107-F117 HydrophobicContact CG-CD1 4.45Å; L107-F117 HydrophobicContact CG-CE1 3.79Å; L107-F117 HydrophobicContact CG-CZ 4.16Å; L107-Y204 HydrophobicContact CD2-CE1 4.13Å; L107-Y205 HydrophobicContact CB-CD1 4.27Å; L107-Y205 HydrophobicContact CB-CE1 4.02Å
108	P	85.2	Confident	83.3	Confident	38 Å²	38	69.2 Å²	69.2	25%	0.247	38%	0.377	C	S	.	.			trans	-59.8	127.3	177.1	-24.3	34.4	0	0	0	111.9	D106 N113 K114 F117 Y205	D106-P108 WeakPolarHBondContact O-CD 3.47Å; P108-N113 HydrophobicContact CB-CB 3.8Å; P108-N113 HydrophobicContact CG-CB 4.3Å; P108-K114 WeakPolarHBondContact O-CB 3.27Å; P108-K114 WeakPolarHBondContact O-CG 3.45Å; P108-F117 HydrophobicContact CG-CB 4.17Å; P108-F117 HydrophobicContact CG-CG 4.46Å; P108-Y205 PolarHBondContact O-OH 3.07Å
109	K	83.6	Confident	83.1	Confident	110 Å²	110	70 Å²	70	48%	0.478	38%	0.38	S	S	.	.			trans	-88.6	-17.9	-175.8	-58.6	-169	-179.5	-172.8	0	113.8	L107 Y205 S207	L107-K109 PolarHBondContact O-N 3.17Å; K109-Y205 HydrophobicContact CD-CD1 4.43Å; K109-Y205 HydrophobicContact CD-CD2 4.48Å; K109-Y205 HydrophobicContact CD-CG 4.24Å; K109-Y205 HydrophobicContact CG-CD1 4Å; K109-Y205 HydrophobicContact CG-CD2 4.42Å; K109-Y205 HydrophobicContact CG-CE1 3.98Å; K109-Y205 HydrophobicContact CG-CE2 4.43Å; K109-Y205 HydrophobicContact CG-CG 4.22Å; K109-S207 PolarHBondContact NZ-OG 3.13Å
110	T	83.5	Confident	83.1	Confident	106 Å²	106	65.3 Å²	65.3	65%	0.65	37%	0.371	S	S	*	.	S	Bend	trans	-130.2	149.1	-165.6	49.2	0	0	0	0	113.6	K114	T110-K114 PolarHBondContact O-N 3.06Å
111	G	81.5	Confident	83	Confident	57 Å²	57	64.6 Å²	64.6	59%	0.588	37%	0.365	S	S	*	.	H	α-helix	trans	54.9	-150.7	164	0	0	0	0	0	116.3	N113 K114	G111-N113 VanDerWaalsContact C-N 3.25Å; G111-N113 PolarHBondContact O-N 3.46Å; G111-K114 PolarHBondContact O-N 3.09Å
112	A	84.7	Confident	83	Confident	76 Å²	76	64.6 Å²	64.6	63%	0.628	36%	0.364	S	S	*	.	H	α-helix	trans	-61.4	-30.9	-178.1	0	0	0	0	0	113.2	K114 D115 Y116	A112-K114 VanDerWaalsContact C-N 3.3Å; A112-K114 PolarHBondContact O-N 3.19Å; A112-D115 PolarHBondContact O-N 2.93Å; A112-D115 VanDerWaalsContact O-N 3.16Å; A112-Y116 WeakPolarHBondContact O-CB 3.3Å; A112-Y116 PolarHBondContact O-N 2.73Å
113	N	87.3	Confident	83.2	Confident	111 Å²	111	69.8 Å²	69.8	59%	0.594	37%	0.366	S	S	*	.	H	α-helix	trans	-61.5	-39.1	-179.5	-61.5	9.7	0	0	0	111.5	P108 G111 F117	P108-N113 HydrophobicContact CB-CB 3.8Å; P108-N113 HydrophobicContact CG-CB 4.3Å; G111-N113 VanDerWaalsContact C-N 3.25Å; G111-N113 PolarHBondContact O-N 3.46Å; N113-F117 VanDerWaalsContact O-CB 3.29Å; N113-F117 WeakPolarHBondContact O-CB 3.44Å; N113-F117 PolarHBondContact O-N 3.34Å
114	K	85.9	Confident	83.5	Confident	22 Å²	22	74.7 Å²	74.7	10%	0.096	39%	0.388	C	S	.	.	H	α-helix	trans	-63	-49.5	173.3	-176.4	-159	72.4	171.6	0	111	I47 S49 P108 T110 G111 A112 Y116 F117 I118	I47-K114 PolarHBondContact O-NZ 3.09Å; S49-K114 PolarHBondContact OG-NZ 3.08Å; S49-K114 VanDerWaalsContact OG-NZ 3.12Å; P108-K114 WeakPolarHBondContact O-CB 3.27Å; P108-K114 WeakPolarHBondContact O-CG 3.45Å; T110-K114 PolarHBondContact O-N 3.06Å; G111-K114 PolarHBondContact O-N 3.09Å; A112-K114 VanDerWaalsContact C-N 3.3Å; A112-K114 PolarHBondContact O-N 3.19Å; K114-Y116 PolarHBondContact O-N 3.4Å; K114-F117 PolarHBondContact O-N 3.27Å; K114-I118 HydrophobicContact CG-CD1 4.01Å; K114-I118 WeakPolarHBondContact O-CB 3.04Å; K114-I118 VanDerWaalsContact O-CG1 3.28Å; K114-I118 WeakPolarHBondContact O-CG1 3.45Å; K114-I118 PolarHBondContact O-N 3.14Å
115	D	84.9	Confident	83.8	Confident	21 Å²	21	67.3 Å²	67.3	11%	0.112	36%	0.357	C	S	.	.	H	α-helix	trans	-67.6	-36.5	-175.8	-77.9	22.6	0	0	0	112.3	R12 R50 A112 Q119	R12-D115 IonicContact CZ-OD2 2.67Å; R12-D115 VanDerWaalsContact CZ-OD2 3.23Å; R12-D115 IonicContact NE-OD2 2.81Å; R12-D115 PolarHBondContact NE-OD2 3.03Å; R12-D115 IonicContact NH2-OD1 3.92Å; R12-D115 IonicContact NH2-OD2 3.86Å; R12-D115 PolarHBondContact NH2-OD2 2.76Å; R50-D115 PolarHBondContact NH2-O 3.45Å; A112-D115 PolarHBondContact O-N 2.93Å; A112-D115 VanDerWaalsContact O-N 3.16Å; D115-Q119 WeakPolarHBondContact O-CB 3.22Å; D115-Q119 PolarHBondContact O-N 2.91Å
116	Y	88.2	Confident	84.4	Confident	170 Å²	170	70 Å²	70	67%	0.667	38%	0.383	S	S	*	.	H	α-helix	trans	-67.2	-49.8	173.8	177.8	-94.6	0	0	0	111.9	A112 K114 I118 Q119 A120	A112-Y116 WeakPolarHBondContact O-CB 3.3Å; A112-Y116 PolarHBondContact O-N 2.73Å; K114-Y116 PolarHBondContact O-N 3.4Å; Y116-I118 VanDerWaalsContact C-N 3.26Å; Y116-I118 PolarHBondContact O-N 3.2Å; Y116-Q119 PolarHBondContact O-N 2.83Å; Y116-Q119 VanDerWaalsContact O-N 3.09Å; Y116-A120 PolarHBondContact O-N 3.14Å
117	F	88.1	Confident	85	Confident	73 Å²	73	71.4 Å²	71.4	32%	0.32	38%	0.382	S	S	.	.	H	α-helix	trans	-55.8	-43.6	176.4	178.8	-88.5	0	0	0	111.2	L77 L107 P108 N113 K114 A120 A121	L77-F117 HydrophobicContact CD1-CE1 4.22Å; L77-F117 HydrophobicContact CD2-CE1 4.13Å; L107-F117 HydrophobicContact CD1-CE1 4.39Å; L107-F117 HydrophobicContact CD1-CZ 4.35Å; L107-F117 HydrophobicContact CD2-CE1 4.29Å; L107-F117 HydrophobicContact CG-CD1 4.45Å; L107-F117 HydrophobicContact CG-CE1 3.79Å; L107-F117 HydrophobicContact CG-CZ 4.16Å; P108-F117 HydrophobicContact CG-CB 4.17Å; P108-F117 HydrophobicContact CG-CG 4.46Å; N113-F117 VanDerWaalsContact O-CB 3.29Å; N113-F117 WeakPolarHBondContact O-CB 3.44Å; N113-F117 PolarHBondContact O-N 3.34Å; K114-F117 PolarHBondContact O-N 3.27Å; F117-A120 PolarHBondContact O-N 3.09Å; F117-A121 WeakPolarHBondContact O-CB 3.26Å; F117-A121 PolarHBondContact O-N 3.13Å
118	I	86.8	Confident	84.9	Confident	6 Å²	6	72.6 Å²	72.6	3%	0.031	40%	0.4	C	S	.	.	H	α-helix	trans	-70.5	-33	179.2	-65.5	175.6	0	0	0	111.7	C48 T73 K114 Y116 E122	C48-I118 HydrophobicContact CB-CD1 3.52Å; C48-I118 HydrophobicContact CB-CG2 4.16Å; T73-I118 HydrophobicContact CG2-CG2 4.19Å; K114-I118 HydrophobicContact CG-CD1 4.01Å; K114-I118 WeakPolarHBondContact O-CB 3.04Å; K114-I118 VanDerWaalsContact O-CG1 3.28Å; K114-I118 WeakPolarHBondContact O-CG1 3.45Å; K114-I118 PolarHBondContact O-N 3.14Å; Y116-I118 VanDerWaalsContact C-N 3.26Å; Y116-I118 PolarHBondContact O-N 3.2Å; I118-E122 WeakPolarHBondContact O-CB 3.41Å; I118-E122 PolarHBondContact O-N 2.97Å
119	Q	86.9	Confident	84.6	Confident	30 Å²	30	78.1 Å²	78.1	14%	0.14	43%	0.427	C	S	.	.	H	α-helix	trans	-68.5	-36.8	172.2	-156.6	175.9	26.6	0	0	112.6	N11 N14 R50 D115 Y116 R123	N11-Q119 PolarHBondContact O-NE2 3.39Å; N11-Q119 PolarHBondContact OD1-NE2 3.45Å; N14-Q119 PolarHBondContact OD1-NE2 3.08Å; N14-Q119 VanDerWaalsContact OD1-NE2 3.16Å; R50-Q119 VanDerWaalsContact NH2-CB 3.3Å; D115-Q119 WeakPolarHBondContact O-CB 3.22Å; D115-Q119 PolarHBondContact O-N 2.91Å; Y116-Q119 PolarHBondContact O-N 2.83Å; Y116-Q119 VanDerWaalsContact O-N 3.09Å; Q119-R123 WeakPolarHBondContact O-CB 3.15Å; Q119-R123 PolarHBondContact O-N 2.94Å; Q119-R123 VanDerWaalsContact O-N 3.09Å
120	A	87.8	Confident	84.2	Confident	45 Å²	45	74.6 Å²	74.6	37%	0.372	42%	0.422	S	S	.	.	H	α-helix	trans	-67.2	-49.8	175.3	0	0	0	0	0	111.1	Y116 F117 E122 R123 E124	Y116-A120 PolarHBondContact O-N 3.14Å; F117-A120 PolarHBondContact O-N 3.09Å; A120-E122 VanDerWaalsContact C-N 3.34Å; A120-E122 PolarHBondContact O-N 2.79Å; A120-R123 WeakPolarHBondContact O-CB 3.21Å; A120-R123 PolarHBondContact O-N 2.67Å; A120-E124 PolarHBondContact O-N 2.83Å
121	A	85.6	Confident	83.8	Confident	6 Å²	6	75.9 Å²	75.9	5%	0.05	43%	0.429	C	S	.	.	H	α-helix	trans	-63.4	-36.6	178	0	0	0	0	0	113	L77 F117 E124 M125	L77-A121 HydrophobicContact CD1-CB 4.11Å; L77-A121 HydrophobicContact CD2-CB 3.89Å; L77-A121 HydrophobicContact CG-CB 4.31Å; F117-A121 WeakPolarHBondContact O-CB 3.26Å; F117-A121 PolarHBondContact O-N 3.13Å; A121-E124 PolarHBondContact O-N 3.13Å; A121-M125 HydrophobicContact CB-CE 4Å; A121-M125 WeakPolarHBondContact O-CB 3.3Å; A121-M125 VanDerWaalsContact O-CE 3.26Å; A121-M125 WeakPolarHBondContact O-CE 3.44Å; A121-M125 PolarHBondContact O-N 3.39Å
122	E	85.6	Confident	83.2	Confident	29 Å²	29	77.3 Å²	77.3	14%	0.136	43%	0.431	C	S	.	.	H	α-helix	trans	-63.3	-44.4	172.2	178.7	-178.3	-124.6	0	0	111.8	N14 R50 T73 I118 A120 E124 M125 A126	N14-E122 WeakPolarHBondContact CB-OE2 3.21Å; N14-E122 VanDerWaalsContact CG-OE2 3.29Å; R50-E122 IonicContact CZ-OE2 2.83Å; R50-E122 IonicContact NH1-OE1 3.68Å; R50-E122 PolarHBondContact NH1-OE1 2.96Å; R50-E122 IonicContact NH1-OE2 2.63Å; R50-E122 PolarHBondContact NH1-OE2 2.92Å; R50-E122 IonicContact NH2-OE2 3.18Å; T73-E122 HydrophobicContact CG2-CB 3.93Å; I118-E122 WeakPolarHBondContact O-CB 3.41Å; I118-E122 PolarHBondContact O-N 2.97Å; A120-E122 VanDerWaalsContact C-N 3.34Å; A120-E122 PolarHBondContact O-N 2.79Å; E122-E124 VanDerWaalsContact C-N 3.26Å; E122-E124 PolarHBondContact O-N 3.05Å; E122-M125 PolarHBondContact O-N 3.34Å; E122-A126 VanDerWaalsContact O-CB 3.29Å; E122-A126 WeakPolarHBondContact O-CB 3.45Å; E122-A126 PolarHBondContact O-N 3.43Å
123	R	86.6	Confident	82.4	Confident	167 Å²	167	74.9 Å²	74.9	63%	0.63	41%	0.409	S	S	*	.	H	α-helix	trans	-64.8	-29.8	175.1	-176	-175.4	-64.9	-175.2	-0.9	112.6	Q119 A120 K127	Q119-R123 WeakPolarHBondContact O-CB 3.15Å; Q119-R123 PolarHBondContact O-N 2.94Å; Q119-R123 VanDerWaalsContact O-N 3.09Å; A120-R123 WeakPolarHBondContact O-CB 3.21Å; A120-R123 PolarHBondContact O-N 2.67Å; R123-K127 WeakPolarHBondContact O-CG 3.26Å
124	E	84.4	Confident	81.4	Confident	121 Å²	121	70.2 Å²	70.2	57%	0.565	39%	0.386	S	S	*	.	H	α-helix	trans	-73.9	-49.6	173.6	-170.5	178.2	177.7	0	0	111.1	A120 A121 E122 A126 K127 G128	A120-E124 PolarHBondContact O-N 2.83Å; A121-E124 PolarHBondContact O-N 3.13Å; E122-E124 VanDerWaalsContact C-N 3.26Å; E122-E124 PolarHBondContact O-N 3.05Å; E124-A126 VanDerWaalsContact C-N 3.25Å; E124-A126 PolarHBondContact O-N 3.04Å; E124-K127 WeakPolarHBondContact O-CB 3.29Å; E124-K127 PolarHBondContact O-N 3.14Å; E124-G128 PolarHBondContact O-N 3.12Å
125	M	81	Confident	80.5	Confident	27 Å²	27	71 Å²	71	13%	0.133	40%	0.4	C	S	.	.	H	α-helix	trans	-60.5	-31	175.3	-82.6	-179.5	-89.9	0	0	113.7	T73 K76 L77 A121 E122 K127 A134	T73-M125 HydrophobicContact CG2-CE 3.5Å; K76-M125 HydrophobicContact CB-SD 3.46Å; K76-M125 WeakPolarHBondContact CB-SD 3.39Å; K76-M125 HydrophobicContact CD-SD 3.86Å; K76-M125 HydrophobicContact CG-SD 4.31Å; L77-M125 HydrophobicContact CD1-CE 4.41Å; L77-M125 HydrophobicContact CD2-CE 4.38Å; L77-M125 HydrophobicContact CG-CE 3.84Å; A121-M125 HydrophobicContact CB-CE 4Å; A121-M125 WeakPolarHBondContact O-CB 3.3Å; A121-M125 VanDerWaalsContact O-CE 3.26Å; A121-M125 WeakPolarHBondContact O-CE 3.44Å; A121-M125 PolarHBondContact O-N 3.39Å; E122-M125 PolarHBondContact O-N 3.34Å; M125-K127 PolarHBondContact O-N 2.79Å; M125-A134 HydrophobicContact CE-CB 4.18Å; M125-A134 HydrophobicContact CG-CB 3.39Å; M125-A134 HydrophobicContact SD-CB 3.75Å
126	A	82.7	Confident	79.6	Confident	86 Å²	86	73.3 Å²	73.3	71%	0.711	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-6.9	175.2	0	0	0	0	0	114.2	E122 E124	E122-A126 VanDerWaalsContact O-CB 3.29Å; E122-A126 WeakPolarHBondContact O-CB 3.45Å; E122-A126 PolarHBondContact O-N 3.43Å; E124-A126 VanDerWaalsContact C-N 3.25Å; E124-A126 PolarHBondContact O-N 3.04Å
127	K	84.5	Confident	78.6	Confident	177 Å²	177	65.3 Å²	65.3	77%	0.77	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.6	-22.1	173.3	-69.2	174.9	175.9	-172	0	113.8	R123 E124 M125	R123-K127 WeakPolarHBondContact O-CG 3.26Å; E124-K127 WeakPolarHBondContact O-CB 3.29Å; E124-K127 PolarHBondContact O-N 3.14Å; M125-K127 PolarHBondContact O-N 2.79Å
128	G	78.8	Confident	77.4	Confident	46 Å²	46	63.1 Å²	63.1	47%	0.474	38%	0.382	S	S	.	.	S	Bend	trans	-92.7	171.9	178	0	0	0	0	0	112.3	E124 G130	E124-G128 PolarHBondContact O-N 3.12Å; G128-G130 PolarHBondContact O-N 3.05Å
129	D	78.3	Confident	76.4	Confident	154 Å²	154	70.5 Å²	70.5	82%	0.824	41%	0.414	S	S	*	.			trans	-67.9	8.2	-172.8	-48	-55.4	0	0	0	115	V131	D129-V131 PolarHBondContact O-N 3.31Å
130	G	74.6	Confident	75.3	Confident	36 Å²	36	73.3 Å²	73.3	37%	0.371	42%	0.424	S	S	.	.	S	Bend	trans	70.2	-10	175.7	0	0	0	0	0	116.4	K76 G128	K76-G130 WeakPolarHBondContact CE-O 3.34Å; K76-G130 PolarHBondContact NZ-O 3.48Å; G128-G130 PolarHBondContact O-N 3.05Å
131	V	75.1	Confident	74.1	Confident	133 Å²	133	73.8 Å²	73.8	81%	0.806	42%	0.422	S	S	*	.	S	Bend	trans	-85	-48.1	-179.2	178.1	0	0	0	0	112.3	D129	D129-V131 PolarHBondContact O-N 3.31Å
132	S	68.7	Low	73	Confident	88 Å²	88	80.2 Å²	80.2	62%	0.615	46%	0.455	S	S	*	.	S	Bend	trans	-69.2	149.6	-172.9	-52.8	0	0	0	0	113.4
133	S	67.9	Low	72.1	Confident	25 Å²	25	84 Å²	84	18%	0.175	48%	0.481	C	S	.	.			trans	-62.9	148.7	164.4	-69.8	0	0	0	0	110.1	N79 A138	N79-S133 WeakPolarHBondContact CB-OG 3.15Å; S133-A138 WeakPolarHBondContact O-CB 3.2Å
134	A	66.3	Low	71.3	Confident	13 Å²	13	77.6 Å²	77.6	11%	0.107	47%	0.467	C	S	.	.			trans	-114	149.4	-172.9	0	0	0	0	0	113	K76 M125	K76-A134 PolarHBondContact O-N 3.44Å; M125-A134 HydrophobicContact CE-CB 4.18Å; M125-A134 HydrophobicContact CG-CB 3.39Å; M125-A134 HydrophobicContact SD-CB 3.75Å
135	G	67.4	Low	70.9	Confident	37 Å²	37	76.9 Å²	76.9	38%	0.381	47%	0.472	S	S	.	.	S	Bend	trans	79.9	-159.7	-177.9	0	0	0	0	0	113.8	L137 A138	G135-L137 PolarHBondContact O-N 2.65Å; G135-L137 VanDerWaalsContact O-N 3.1Å; G135-A138 WeakPolarHBondContact O-CB 3.38Å; G135-A138 PolarHBondContact O-N 3.33Å; G135-A138 VanDerWaalsContact O-N 3.1Å
136	S	65.6	Low	70.8	Confident	70 Å²	70	78 Å²	78	49%	0.49	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.9	-39.4	-172.2	-56.7	0	0	0	0	114.4	A138 Y140	S136-A138 VanDerWaalsContact C-N 3.26Å; S136-A138 PolarHBondContact O-N 3.47Å; S136-Y140 WeakPolarHBondContact O-CD2 3.27Å
137	L	67.1	Low	70.8	Confident	2 Å²	2	76.2 Å²	76.2	1%	0.01	46%	0.456	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-30.2	-177.2	-179.3	58.2	0	0	0	113.6	K78 N79 L101 L103 G135 K139 Y140 V141	K78-L137 VanDerWaalsContact C-CD2 3.47Å; N79-L137 HydrophobicContact CB-CD2 3.6Å; L101-L137 HydrophobicContact CD1-CD1 4.04Å; L103-L137 HydrophobicContact CD1-CB 4.42Å; L103-L137 HydrophobicContact CD1-CD1 3.55Å; G135-L137 PolarHBondContact O-N 2.65Å; G135-L137 VanDerWaalsContact O-N 3.1Å; L137-K139 VanDerWaalsContact C-N 3.33Å; L137-K139 PolarHBondContact O-N 2.9Å; L137-Y140 PolarHBondContact O-N 3.17Å; L137-V141 HydrophobicContact CG-CG2 4.45Å; L137-V141 PolarHBondContact O-N 2.79Å
138	A	63.8	Low	70.7	Confident	28 Å²	28	70.3 Å²	70.3	23%	0.231	43%	0.431	C	S	.	.	H	α-helix	trans	-53.9	-48.8	-177.8	0	0	0	0	0	112.1	S133 G135 S136 Y140 V141 D142	S133-A138 WeakPolarHBondContact O-CB 3.2Å; G135-A138 WeakPolarHBondContact O-CB 3.38Å; G135-A138 PolarHBondContact O-N 3.33Å; G135-A138 VanDerWaalsContact O-N 3.1Å; S136-A138 VanDerWaalsContact C-N 3.26Å; S136-A138 PolarHBondContact O-N 3.47Å; A138-Y140 PolarHBondContact O-N 3.31Å; A138-V141 PolarHBondContact O-N 2.85Å; A138-V141 VanDerWaalsContact O-N 3.16Å; A138-D142 PolarHBondContact O-N 3.46Å
139	K	65.2	Low	71.1	Confident	160 Å²	160	68.1 Å²	68.1	70%	0.696	41%	0.409	S	S	*	.	H	α-helix	trans	-58.5	-25.8	-179.2	-58.7	-177.2	180	-177.6	0	113.6	L137 T143	L137-K139 VanDerWaalsContact C-N 3.33Å; L137-K139 PolarHBondContact O-N 2.9Å; K139-T143 PolarHBondContact O-OG1 2.81Å
140	Y	64.2	Low	71.6	Confident	90 Å²	90	66.2 Å²	66.2	35%	0.353	40%	0.396	S	S	.	.	H	α-helix	trans	-92.9	-25.9	-176.6	-70.1	-88	0	0	0	113	L101 L103 S136 L137 A138 D142 T143	L101-Y140 HydrophobicContact CB-CD1 4.38Å; L101-Y140 WeakPolarHBondContact O-CE1 3.36Å; L103-Y140 HydrophobicContact CD1-CD2 4.12Å; L103-Y140 HydrophobicContact CD1-CG 4.32Å; L103-Y140 HydrophobicContact CD2-CD2 3.58Å; L103-Y140 HydrophobicContact CD2-CE2 3.42Å; L103-Y140 VanDerWaalsContact CD2-CE2 3.42Å; L103-Y140 HydrophobicContact CD2-CG 4.43Å; L103-Y140 HydrophobicContact CG-CD2 3.93Å; L103-Y140 HydrophobicContact CG-CE2 4.03Å; L103-Y140 HydrophobicContact CG-CG 4.31Å; S136-Y140 WeakPolarHBondContact O-CD2 3.27Å; L137-Y140 PolarHBondContact O-N 3.17Å; A138-Y140 PolarHBondContact O-N 3.31Å; Y140-D142 VanDerWaalsContact C-N 3.3Å; Y140-T143 WeakPolarHBondContact O-CB 3.43Å; Y140-T143 PolarHBondContact O-N 2.75Å
141	V	62.5	Low	72.1	Confident	54 Å²	54	68.8 Å²	68.8	33%	0.327	40%	0.395	S	S	.	.	H	α-helix	trans	-62	-43.8	168.4	177.3	0	0	0	0	109.5	L137 A138 T143 G144	L137-V141 HydrophobicContact CG-CG2 4.45Å; L137-V141 PolarHBondContact O-N 2.79Å; A138-V141 PolarHBondContact O-N 2.85Å; A138-V141 VanDerWaalsContact O-N 3.16Å; V141-T143 PolarHBondContact O-N 3.23Å; V141-G144 PolarHBondContact O-N 3.13Å
142	D	62.1	Low	72.8	Confident	141 Å²	141	63.3 Å²	63.3	75%	0.754	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-18.8	177.2	-59.2	-29.1	0	0	0	113.7	A138 Y140 G144	A138-D142 PolarHBondContact O-N 3.46Å; Y140-D142 VanDerWaalsContact C-N 3.3Å; D142-G144 PolarHBondContact O-N 2.81Å
143	T	67.9	Low	73.8	Confident	110 Å²	110	60.7 Å²	60.7	68%	0.675	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-11.4	-179.6	-59.4	0	0	0	0	112.7	K139 Y140 V141	K139-T143 PolarHBondContact O-OG1 2.81Å; Y140-T143 WeakPolarHBondContact O-CB 3.43Å; Y140-T143 PolarHBondContact O-N 2.75Å; V141-T143 PolarHBondContact O-N 3.23Å
144	G	69.3	Low	74.8	Confident	32 Å²	32	64 Å²	64	33%	0.33	35%	0.353	S	S	.	.			trans	97.5	173.2	171.5	0	0	0	0	0	115.6	V141 D142 N146	V141-G144 PolarHBondContact O-N 3.13Å; D142-G144 PolarHBondContact O-N 2.81Å; G144-N146 PolarHBondContact O-N 3.06Å
145	P	74.9	Confident	75.9	Confident	106 Å²	106	68.8 Å²	68.8	69%	0.688	39%	0.386	S	S	*	.			trans	-72.1	116.2	-164.3	26.9	-34.8	0	0	0	112.9	Y90 E147 M150	Y90-P145 WeakPolarHBondContact OH-CA 3.46Å; P145-E147 PolarHBondContact O-N 3.36Å; P145-M150 HydrophobicContact CB-CG 4.45Å
146	N	80.8	Confident	76.9	Confident	49 Å²	49	73.8 Å²	73.8	26%	0.262	40%	0.399	S	S	.	.			trans	-80.2	122.5	-170.1	-150.8	-1	0	0	0	111.4	Y90 A100 L101 G144 M148 L149 M150	Y90-N146 PolarHBondContact OH-N 3.49Å; A100-N146 PolarHBondContact O-ND2 3.26Å; L101-N146 HydrophobicContact CD2-CB 4.34Å; L101-N146 WeakPolarHBondContact CD2-ND2 3.25Å; G144-N146 PolarHBondContact O-N 3.06Å; N146-M148 PolarHBondContact O-N 2.91Å; N146-L149 HydrophobicContact CB-CD1 4.08Å; N146-L149 HydrophobicContact CB-CG 4.28Å; N146-L149 PolarHBondContact O-N 2.87Å; N146-M150 PolarHBondContact O-N 3.12Å
147	E	81.8	Confident	78	Confident	49 Å²	49	73.1 Å²	73.1	23%	0.229	39%	0.393	C	S	.	.	H	α-helix	trans	-60	-43.5	-167.7	164.2	155.2	-143.9	0	0	113.7	P145 L149 M150 R151 K294	P145-E147 PolarHBondContact O-N 3.36Å; E147-L149 PolarHBondContact O-N 3.01Å; E147-M150 PolarHBondContact O-N 3.25Å; E147-R151 HydrophobicContact CG-CG 4.26Å; E147-R151 WeakPolarHBondContact O-CG 3.47Å; E147-R151 PolarHBondContact O-N 3.02Å; E147-R151 IonicContact OE1-CZ 3.44Å; E147-R151 IonicContact OE1-NE 3.34Å; E147-R151 PolarHBondContact OE1-NE 3.05Å; E147-R151 IonicContact OE1-NH2 2.73Å; E147-R151 PolarHBondContact OE1-NH2 3.46Å; E147-K294 WeakPolarHBondContact OE1-CD 3.46Å; E147-K294 WeakPolarHBondContact OE1-CE 3.2Å; E147-K294 WeakPolarHBondContact OE1-CG 3.13Å; E147-K294 IonicContact OE1-NZ 2.68Å; E147-K294 VanDerWaalsContact OE2-CE 3.22Å; E147-K294 WeakPolarHBondContact OE2-CE 3.26Å; E147-K294 IonicContact OE2-NZ 3.13Å; E147-K294 PolarHBondContact OE2-NZ 3.1Å
148	M	83.3	Confident	79.1	Confident	53 Å²	53	75.4 Å²	75.4	26%	0.261	40%	0.402	S	S	.	.	H	α-helix	trans	-57.8	-38.5	178.1	179.1	-178.5	170.5	0	0	111.3	Y99 A100 N146 L152 L216 A219	Y99-M148 HydrophobicContact CD1-CE 3.96Å; Y99-M148 HydrophobicContact CE1-CE 3.97Å; A100-M148 HydrophobicContact CB-CG 4.45Å; A100-M148 HydrophobicContact CB-SD 3.86Å; N146-M148 PolarHBondContact O-N 2.91Å; M148-L152 HydrophobicContact CE-CD1 4.34Å; M148-L152 HydrophobicContact CG-CD1 4.21Å; M148-L152 WeakPolarHBondContact O-CD1 3.07Å; M148-L152 VanDerWaalsContact O-CG 3.27Å; M148-L152 WeakPolarHBondContact O-CG 3.29Å; M148-L152 PolarHBondContact O-N 3.45Å; M148-L216 HydrophobicContact CE-CD2 3.92Å; M148-A219 HydrophobicContact CE-CB 3.5Å
149	L	87.1	Confident	80.4	Confident	0 Å²	0	77.4 Å²	77.4	0%	0	40%	0.404	C	S	.	.	H	α-helix	trans	-73.8	-42.8	179	-59.6	-179.8	0	0	0	111.2	Y90 L92 V96 R97 A100 N146 E147 R151 L152 A153	Y90-L149 HydrophobicContact CD1-CB 3.61Å; Y90-L149 HydrophobicContact CD2-CB 3.95Å; Y90-L149 HydrophobicContact CD2-CD1 3.8Å; Y90-L149 HydrophobicContact CD2-CG 4.48Å; Y90-L149 HydrophobicContact CE1-CB 3.8Å; Y90-L149 HydrophobicContact CE2-CB 4.17Å; Y90-L149 HydrophobicContact CE2-CD1 3.67Å; Y90-L149 HydrophobicContact CG-CB 3.7Å; Y90-L149 HydrophobicContact CG-CD1 4.43Å; L92-L149 HydrophobicContact CD1-CB 4.1Å; L92-L149 HydrophobicContact CD1-CD2 3.76Å; V96-L149 HydrophobicContact CG1-CD2 4.18Å; R97-L149 HydrophobicContact CB-CD1 4.36Å; R97-L149 HydrophobicContact CG-CD1 3.65Å; A100-L149 HydrophobicContact CB-CD1 4.14Å; A100-L149 HydrophobicContact CB-CD2 3.57Å; A100-L149 HydrophobicContact CB-CG 3.74Å; N146-L149 HydrophobicContact CB-CD1 4.08Å; N146-L149 HydrophobicContact CB-CG 4.28Å; N146-L149 PolarHBondContact O-N 2.87Å; E147-L149 PolarHBondContact O-N 3.01Å; L149-R151 VanDerWaalsContact C-N 3.3Å; L149-R151 PolarHBondContact O-N 3.29Å; L149-L152 CarbonylContact O-C 3.57Å; L149-L152 PolarHBondContact O-N 3.1Å; L149-A153 WeakPolarHBondContact O-CB 3.39Å; L149-A153 PolarHBondContact O-N 3.33Å
150	M	87.5	Confident	81.6	Confident	114 Å²	114	73 Å²	73	56%	0.562	39%	0.388	S	S	*	.	H	α-helix	trans	-60.1	-36.6	173.3	-71.4	-61.3	-69.8	0	0	113.1	Y90 P145 N146 E147 L152	Y90-M150 HydrophobicContact CD1-CG 4.28Å; Y90-M150 HydrophobicContact CD1-SD 3.78Å; Y90-M150 HydrophobicContact CE1-CG 3.88Å; Y90-M150 HydrophobicContact CE1-SD 3.65Å; P145-M150 HydrophobicContact CB-CG 4.45Å; N146-M150 PolarHBondContact O-N 3.12Å; E147-M150 PolarHBondContact O-N 3.25Å; M150-L152 VanDerWaalsContact C-N 3.31Å; M150-L152 PolarHBondContact O-N 2.97Å
151	R	86.2	Confident	82.7	Confident	91 Å²	91	71 Å²	71	34%	0.343	38%	0.38	S	S	.	.	H	α-helix	trans	-70.8	-22.3	174.8	-70.7	177.8	179.7	-149.6	0.9	113.5	E147 L149 F222 F292	E147-R151 HydrophobicContact CG-CG 4.26Å; E147-R151 WeakPolarHBondContact O-CG 3.47Å; E147-R151 PolarHBondContact O-N 3.02Å; E147-R151 IonicContact OE1-CZ 3.44Å; E147-R151 IonicContact OE1-NE 3.34Å; E147-R151 PolarHBondContact OE1-NE 3.05Å; E147-R151 IonicContact OE1-NH2 2.73Å; E147-R151 PolarHBondContact OE1-NH2 3.46Å; L149-R151 VanDerWaalsContact C-N 3.3Å; L149-R151 PolarHBondContact O-N 3.29Å; R151-F222 HydrophobicContact CB-CE2 3.93Å; R151-F222 HydrophobicContact CB-CZ 3.99Å; R151-F292 PolarHBondContact NH2-O 2.65Å
152	L	88.5	Confident	84.1	Confident	18 Å²	18	68.5 Å²	68.5	9%	0.094	37%	0.365	C	S	.	.	H	α-helix	trans	-96.2	-23.1	177.5	-69.8	169.2	0	0	0	113.5	L92 V96 M148 L149 M150 A219 F222	L92-L152 HydrophobicContact CD1-CB 3.91Å; L92-L152 HydrophobicContact CD2-CB 4.2Å; V96-L152 HydrophobicContact CG1-CD1 3.78Å; M148-L152 HydrophobicContact CE-CD1 4.34Å; M148-L152 HydrophobicContact CG-CD1 4.21Å; M148-L152 WeakPolarHBondContact O-CD1 3.07Å; M148-L152 VanDerWaalsContact O-CG 3.27Å; M148-L152 WeakPolarHBondContact O-CG 3.29Å; M148-L152 PolarHBondContact O-N 3.45Å; L149-L152 CarbonylContact O-C 3.57Å; L149-L152 PolarHBondContact O-N 3.1Å; M150-L152 VanDerWaalsContact C-N 3.31Å; M150-L152 PolarHBondContact O-N 2.97Å; L152-A219 HydrophobicContact CD1-CB 3.95Å; L152-A219 HydrophobicContact CD2-CB 4.14Å; L152-A219 HydrophobicContact CG-CB 4.48Å; L152-F222 HydrophobicContact CD2-CE2 3.72Å; L152-F222 HydrophobicContact CD2-CZ 3.84Å; L152-F222 HydrophobicContact CG-CE2 3.98Å; L152-F222 HydrophobicContact CG-CZ 4.34Å
153	A	90.5	Very high	85.5	Confident	33 Å²	33	66.5 Å²	66.5	27%	0.273	35%	0.347	S	S	.	.	S	Bend	trans	-57.9	148.2	-178.3	0	0	0	0	0	112.2	Y90 L149	Y90-A153 WeakPolarHBondContact O-CB 3.33Å; L149-A153 WeakPolarHBondContact O-CB 3.39Å; L149-A153 PolarHBondContact O-N 3.33Å
154	R	89.7	Confident	86.6	Confident	94 Å²	94	62.2 Å²	62.2	36%	0.355	32%	0.321	S	S	.	.			trans	-93.3	115.7	178.8	-59.7	-172.2	-170.2	-159.8	4	110	H156 Y158 Y420	R154-H156 PolarHBondContact O-N 3.21Å; R154-Y158 VanDerWaalsContact NH1-CG 3.3Å; R154-Y420 VanDerWaalsContact NH2-CE2 3.35Å; R154-Y420 PolarHBondContact NH2-OH 3.07Å; R154-Y420 VanDerWaalsContact NH2-OH 3.13Å
155	S	88	Confident	87.6	Confident	113 Å²	113	62.1 Å²	62.1	79%	0.79	31%	0.312	S	S	*	.	S	Bend	trans	-63.1	-24.8	175.4	54.3	0	0	0	0	114.1
156	H	88.6	Confident	88.5	Confident	143 Å²	143	58.2 Å²	58.2	66%	0.662	29%	0.285	S	S	*	.	S	Bend	trans	-120.7	141.1	-175.7	-69.3	76.5	0	0	0	112.5	R154 Y158	R154-H156 PolarHBondContact O-N 3.21Å; H156-Y158 PolarHBondContact O-N 3.23Å
157	P	89.5	Confident	89.1	Confident	56 Å²	56	56.1 Å²	56.1	36%	0.364	27%	0.274	S	S	.	.			trans	-70.8	120.5	-175.6	27.1	-34.8	0	0	0	112.9	T26 Y159	T26-P157 HydrophobicContact CG2-CB 3.88Å; P157-Y159 VanDerWaalsContact C-N 3.34Å; P157-Y159 HydrophobicContact CB-CD1 4.48Å; P157-Y159 HydrophobicContact CB-CD2 4.49Å; P157-Y159 HydrophobicContact CB-CE1 3.94Å; P157-Y159 HydrophobicContact CB-CE2 3.97Å; P157-Y159 HydrophobicContact CG-CD2 4.32Å; P157-Y159 HydrophobicContact CG-CE1 4.32Å; P157-Y159 HydrophobicContact CG-CE2 3.53Å; P157-Y159 WeakPolarHBondContact CG-OH 3.47Å; P157-Y159 PolarHBondContact O-N 3.25Å
158	Y	89.9	Confident	89.5	Confident	49 Å²	49	56.8 Å²	56.8	19%	0.192	28%	0.284	C	S	.	.			trans	-81.3	72.8	-177.9	-170.1	-106.5	0	0	0	112.7	R154 H156 N160 R161 I418	R154-Y158 VanDerWaalsContact NH1-CG 3.3Å; H156-Y158 PolarHBondContact O-N 3.23Å; Y158-N160 HydrophobicContact CD1-CB 4.23Å; Y158-N160 HydrophobicContact CE1-CB 3.7Å; Y158-N160 HydrophobicContact CE2-CB 4.05Å; Y158-N160 PolarHBondContact O-N 2.99Å; Y158-R161 HydrophobicContact CD1-CB 4.33Å; Y158-R161 PolarHBondContact O-N 2.87Å; Y158-I418 PolarHBondContact OH-O 3.14Å
159	Y	91.3	Very high	90	Very high	70 Å²	70	59.9 Å²	59.9	28%	0.275	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-62	-13.8	-178	-63.3	-55.5	0	0	0	115	G29 K30 P157 R161 N162	G29-Y159 WeakPolarHBondContact O-CE1 3.37Å; G29-Y159 PolarHBondContact O-OH 3.15Å; K30-Y159 HydrophobicContact CB-CD2 4.47Å; K30-Y159 HydrophobicContact CB-CE1 4.13Å; K30-Y159 HydrophobicContact CB-CE2 3.84Å; P157-Y159 VanDerWaalsContact C-N 3.34Å; P157-Y159 HydrophobicContact CB-CD1 4.48Å; P157-Y159 HydrophobicContact CB-CD2 4.49Å; P157-Y159 HydrophobicContact CB-CE1 3.94Å; P157-Y159 HydrophobicContact CB-CE2 3.97Å; P157-Y159 HydrophobicContact CG-CD2 4.32Å; P157-Y159 HydrophobicContact CG-CE1 4.32Å; P157-Y159 HydrophobicContact CG-CE2 3.53Å; P157-Y159 WeakPolarHBondContact CG-OH 3.47Å; P157-Y159 PolarHBondContact O-N 3.25Å; Y159-R161 PolarHBondContact O-N 3.24Å; Y159-R161 VanDerWaalsContact O-N 3.13Å; Y159-N162 WeakPolarHBondContact O-CB 3.39Å; Y159-N162 PolarHBondContact O-N 2.92Å
160	N	89.6	Confident	90.3	Very high	67 Å²	67	64.3 Å²	64.3	36%	0.358	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-57.3	-26	173.3	-74.8	-7.2	0	0	0	112.9	Y158 N162 R163	Y158-N160 HydrophobicContact CD1-CB 4.23Å; Y158-N160 HydrophobicContact CE1-CB 3.7Å; Y158-N160 HydrophobicContact CE2-CB 4.05Å; Y158-N160 PolarHBondContact O-N 2.99Å; N160-N162 PolarHBondContact O-N 3.06Å; N160-R163 WeakPolarHBondContact O-CB 3.38Å; N160-R163 WeakPolarHBondContact O-CG 3.2Å; N160-R163 PolarHBondContact O-N 3.44Å; N160-R163 VanDerWaalsContact OD1-CZ 3.3Å; N160-R163 PolarHBondContact OD1-NE 3.39Å; N160-R163 PolarHBondContact OD1-NH2 3.34Å
161	R	88.6	Confident	90.5	Very high	48 Å²	48	62.3 Å²	62.3	18%	0.181	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-61.7	-17.6	171.7	-172.1	-177.9	-66.7	149.1	1.4	113.9	T26 Y158 Y159	T26-R161 PolarHBondContact OG1-NH1 3.22Å; Y158-R161 HydrophobicContact CD1-CB 4.33Å; Y158-R161 PolarHBondContact O-N 2.87Å; Y159-R161 PolarHBondContact O-N 3.24Å; Y159-R161 VanDerWaalsContact O-N 3.13Å
162	N	90.7	Very high	90.8	Very high	2 Å²	2	65 Å²	65	1%	0.011	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-98	-2.4	-178.2	-58.8	-14	0	0	0	112.9	T26 P59 M63 R64 K66 Y159 N160	T26-N162 PolarHBondContact O-ND2 3.38Å; T26-N162 PolarHBondContact O-OD1 2.92Å; P59-N162 HydrophobicContact CB-CB 4.3Å; P59-N162 HydrophobicContact CG-CB 4.21Å; M63-N162 CarbonylContact C-O 3.57Å; M63-N162 WeakPolarHBondContact CA-O 3.43Å; M63-N162 HydrophobicContact CB-CB 4.31Å; M63-N162 WeakPolarHBondContact CB-O 3.33Å; M63-N162 HydrophobicContact CG-CB 4.23Å; M63-N162 HydrophobicContact SD-CB 3.63Å; R64-N162 PolarHBondContact N-O 3.3Å; K66-N162 HydrophobicContact CD-CB 4.35Å; K66-N162 WeakPolarHBondContact CD-OD1 3.42Å; K66-N162 WeakPolarHBondContact CE-OD1 3.41Å; K66-N162 PolarHBondContact NZ-OD1 3.05Å; Y159-N162 WeakPolarHBondContact O-CB 3.39Å; Y159-N162 PolarHBondContact O-N 2.92Å; N160-N162 PolarHBondContact O-N 3.06Å
163	R	91.3	Very high	91	Very high	99 Å²	99	67.5 Å²	67.5	37%	0.374	35%	0.351	S	S	.	.	S	Bend	trans	-61.3	151	176.5	-69.3	178.1	-177.2	-146.5	-2	110.9	N160 R184	N160-R163 WeakPolarHBondContact O-CB 3.38Å; N160-R163 WeakPolarHBondContact O-CG 3.2Å; N160-R163 PolarHBondContact O-N 3.44Å; N160-R163 VanDerWaalsContact OD1-CZ 3.3Å; N160-R163 PolarHBondContact OD1-NE 3.39Å; N160-R163 PolarHBondContact OD1-NH2 3.34Å; R163-R184 VanDerWaalsContact CD-NH1 3.26Å
164	P	92.4	Very high	91.1	Very high	20 Å²	20	71.2 Å²	71.2	13%	0.13	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-62.6	158.1	172.3	18.1	-22.3	0	0	0	112.4	G62 P182 R184	G62-P164 WeakPolarHBondContact O-CD 3.42Å; P164-P182 WeakPolarHBondContact CB-O 3.48Å; P164-P182 WeakPolarHBondContact CG-O 3.38Å; P164-R184 HydrophobicContact CG-CG 3.88Å; P164-R184 PolarHBondContact O-NE 3.46Å
165	H	90.3	Very high	91.2	Very high	31 Å²	31	67.8 Å²	67.8	14%	0.144	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-62	162	171.6	-69.8	-41.7	0	0	0	110.9	R64 Y183 R184 S422 Q423	R64-H165 PolarHBondContact NH1-NE2 3.4Å; H165-Y183 HydrophobicContact CB-CD1 4.2Å; H165-Y183 CarbonylContact O-C 3.6Å; H165-Y183 WeakPolarHBondContact O-CA 3.38Å; H165-Y183 WeakPolarHBondContact O-CB 3.41Å; H165-R184 PolarHBondContact O-N 3.26Å; H165-S422 VanDerWaalsContact NE2-C 3.34Å; H165-S422 PolarHBondContact NE2-O 3.21Å; H165-S422 PolarHBondContact NE2-OG 3.49Å; H165-S422 VanDerWaalsContact NE2-OG 3.09Å; H165-Q423 WeakPolarHBondContact CE1-CG 3.31Å
166	I	92	Very high	91.5	Very high	23 Å²	23	72.6 Å²	72.6	12%	0.118	36%	0.36	C	S	.	.	B	Isolated β-bridge	trans	-71.4	144.8	173.8	-65.2	172.5	0	0	0	108.8	S168 V171 R184 E186 P188 Q423	I166-S168 PolarHBondContact O-N 3.25Å; I166-V171 HydrophobicContact CG2-CG2 3.69Å; I166-R184 WeakPolarHBondContact CA-O 3.49Å; I166-R184 HydrophobicContact CG1-CB 4.49Å; I166-E186 HydrophobicContact CD1-CG 3.84Å; I166-E186 HydrophobicContact CG1-CG 3.8Å; I166-E186 WeakPolarHBondContact CG2-O 3.43Å; I166-P188 HydrophobicContact CD1-CB 4.33Å; I166-P188 HydrophobicContact CD1-CG 4.33Å; I166-P188 HydrophobicContact CG2-CG 4.28Å; I166-Q423 VanDerWaalsContact CD1-OE1 3.24Å
167	C	93.5	Very high	91.7	Very high	5 Å²	5	71.1 Å²	71.1	3%	0.034	35%	0.348	C	S	.	.			trans	-77.3	109.9	179.4	-169.3	0	0	0	0	110	F169 W170 V171 C175 C181 R184	C167-F169 PolarHBondContact O-N 3.49Å; C167-W170 HydrophobicContact CB-CB 3.72Å; C167-W170 WeakPolarHBondContact O-CA 3.47Å; C167-W170 WeakPolarHBondContact O-CB 3.48Å; C167-W170 PolarHBondContact O-N 3.38Å; C167-V171 PolarHBondContact O-N 2.91Å; C167-V171 VanDerWaalsContact O-N 3.09Å; C167-C175 VanDerWaalsContact SG-SG 3.65Å; C167-C181 VanDerWaalsContact SG-SG 3.63Å; C167-R184 PolarHBondContact N-O 3.3Å
168	S	91.4	Very high	91.6	Very high	64 Å²	64	70.3 Å²	70.3	45%	0.448	35%	0.35	S	S	.	.	H	α-helix	trans	-57.4	-35.2	176.4	50.2	0	0	0	0	112.7	I166 W170 V171 K172	I166-S168 PolarHBondContact O-N 3.25Å; S168-W170 VanDerWaalsContact C-N 3.34Å; S168-V171 PolarHBondContact O-N 2.63Å; S168-K172 WeakPolarHBondContact O-CG 3.4Å; S168-K172 PolarHBondContact O-N 2.83Å
169	F	93.6	Very high	91.6	Very high	117 Å²	117	77.7 Å²	77.7	51%	0.513	39%	0.386	S	S	.	.	H	α-helix	trans	-66.6	-32.4	172.9	-62	-80	0	0	0	112.7	C167 K172 G173 E174 C175	C167-F169 PolarHBondContact O-N 3.49Å; F169-K172 PolarHBondContact O-N 2.63Å; F169-G173 PolarHBondContact O-N 3.15Å; F169-G173 VanDerWaalsContact O-N 3.16Å; F169-E174 HydrophobicContact CB-CB 4.5Å; F169-E174 HydrophobicContact CD1-CB 4.48Å; F169-E174 WeakPolarHBondContact O-CA 3.32Å; F169-E174 PolarHBondContact O-N 3.35Å; F169-C175 HydrophobicContact CB-CB 4.18Å; F169-C175 PolarHBondContact O-N 3.27Å
170	W	93.5	Very high	91.7	Very high	94 Å²	94	80.9 Å²	80.9	36%	0.356	40%	0.404	S	S	.	.	H	α-helix	trans	-72.6	-38.8	176.5	-179.5	85.5	0	0	0	111.7	C167 S168 K172 G173 C175 H185 E186	C167-W170 HydrophobicContact CB-CB 3.72Å; C167-W170 WeakPolarHBondContact O-CA 3.47Å; C167-W170 WeakPolarHBondContact O-CB 3.48Å; C167-W170 PolarHBondContact O-N 3.38Å; S168-W170 VanDerWaalsContact C-N 3.34Å; W170-K172 PolarHBondContact O-N 3.4Å; W170-G173 PolarHBondContact O-N 3.23Å; W170-C175 HydrophobicContact CB-CB 3.88Å; W170-H185 VanDerWaalsContact CB-CD2 3.41Å; W170-H185 WeakPolarHBondContact CB-CD2 3.5Å; W170-H185 AromaticContact CD1-CD2 3.59Å; W170-H185 AromaticContact CD1-CE1 3.95Å; W170-H185 AromaticContact CD1-CG 3.39Å; W170-H185 AromaticContact CD1-ND1 3.65Å; W170-H185 AromaticContact CD1-NE2 3.95Å; W170-H185 HydrophobicContact CD2-CB 3.86Å; W170-H185 HydrophobicContact CG-CB 3.88Å; W170-H185 AromaticContact CG-CD2 3.42Å; W170-H185 VanDerWaalsContact CG-CD2 3.42Å; W170-H185 AromaticContact CG-CG 3.61Å; W170-H185 AromaticContact CG-NE2 3.99Å; W170-H185 HydrophobicContact CZ2-CB 4.34Å; W170-H185 AromaticContact NE1-CG 3.8Å; W170-E186 VanDerWaalsContact CZ3-O 3.25Å; W170-E186 WeakPolarHBondContact CZ3-O 3.35Å
171	V	91.5	Very high	91.8	Very high	72 Å²	72	78.5 Å²	78.5	44%	0.436	39%	0.392	S	S	.	.	H	α-helix	trans	-60.6	-29.1	173.4	-179.9	0	0	0	0	111.6	I166 C167 S168 P188	I166-V171 HydrophobicContact CG2-CG2 3.69Å; C167-V171 PolarHBondContact O-N 2.91Å; C167-V171 VanDerWaalsContact O-N 3.09Å; S168-V171 PolarHBondContact O-N 2.63Å; V171-P188 HydrophobicContact CG1-CG 4.33Å; V171-P188 HydrophobicContact CG2-CG 3.77Å
172	K	92.7	Very high	91.8	Very high	148 Å²	148	79.8 Å²	79.8	64%	0.643	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-8.3	171.5	-66.9	-177.9	175.8	-168.4	0	115.2	S168 F169 W170 E174	S168-K172 WeakPolarHBondContact O-CG 3.4Å; S168-K172 PolarHBondContact O-N 2.83Å; F169-K172 PolarHBondContact O-N 2.63Å; W170-K172 PolarHBondContact O-N 3.4Å; K172-E174 VanDerWaalsContact C-N 3.3Å; K172-E174 HydrophobicContact CB-CB 4.46Å; K172-E174 HydrophobicContact CB-CG 3.96Å; K172-E174 WeakPolarHBondContact CD-OE2 3.42Å; K172-E174 PolarHBondContact O-N 3.19Å
173	G	91.4	Very high	92	Very high	70 Å²	70	85.3 Å²	85.3	72%	0.722	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.3	2.5	-171.1	0	0	0	0	0	115.8	F169 W170	F169-G173 PolarHBondContact O-N 3.15Å; F169-G173 VanDerWaalsContact O-N 3.16Å; W170-G173 PolarHBondContact O-N 3.23Å
174	E	93.5	Very high	92	Very high	111 Å²	111	82.1 Å²	82.1	52%	0.519	42%	0.416	S	S	.	.			trans	-93.4	7.3	-172.4	-58.9	-179.2	128.9	0	0	114.4	F169 K172 K176	F169-E174 HydrophobicContact CB-CB 4.5Å; F169-E174 HydrophobicContact CD1-CB 4.48Å; F169-E174 WeakPolarHBondContact O-CA 3.32Å; F169-E174 PolarHBondContact O-N 3.35Å; K172-E174 VanDerWaalsContact C-N 3.3Å; K172-E174 HydrophobicContact CB-CB 4.46Å; K172-E174 HydrophobicContact CB-CG 3.96Å; K172-E174 WeakPolarHBondContact CD-OE2 3.42Å; K172-E174 PolarHBondContact O-N 3.19Å; E174-K176 PolarHBondContact O-N 3.31Å
175	C	92.6	Very high	92	Very high	22 Å²	22	84.4 Å²	84.4	15%	0.149	43%	0.425	C	S	.	.			trans	-75.2	80.6	-170.4	-165.9	0	0	0	0	114.1	C167 F169 W170 R177 G178 H185	C167-C175 VanDerWaalsContact SG-SG 3.65Å; F169-C175 HydrophobicContact CB-CB 4.18Å; F169-C175 PolarHBondContact O-N 3.27Å; W170-C175 HydrophobicContact CB-CB 3.88Å; C175-R177 PolarHBondContact O-N 3.02Å; C175-G178 PolarHBondContact O-N 3.17Å; C175-H185 PolarHBondContact SG-NE2 3.38Å
176	K	93.5	Very high	92	Very high	214 Å²	214	85.8 Å²	85.8	93%	0.93	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-2.7	176.1	-59.4	-174.1	-177.3	-177.9	0	115.5	E174	E174-K176 PolarHBondContact O-N 3.31Å
177	R	91.8	Very high	91.7	Very high	112 Å²	112	91.4 Å²	91.4	42%	0.423	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-15.6	179.8	-63.4	-170.3	68	163.6	5.5	114.4	C175 E179 E180 C181 P182	C175-R177 PolarHBondContact O-N 3.02Å; R177-E179 PolarHBondContact O-N 2.94Å; R177-E180 IonicContact CZ-OE1 3.19Å; R177-E180 PolarHBondContact NH2-O 3.3Å; R177-E180 IonicContact NH2-OE1 2.7Å; R177-E180 PolarHBondContact NH2-OE1 3.09Å; R177-E180 WeakPolarHBondContact O-CB 3.25Å; R177-E180 PolarHBondContact O-N 2.7Å; R177-C181 HydrophobicContact CB-CB 3.95Å; R177-P182 VanDerWaalsContact CZ-CD 3.46Å
178	G	89.2	Confident	91.5	Very high	39 Å²	39	93.5 Å²	93.5	40%	0.402	47%	0.473	S	S	.	.	G	3₁₀ helix	trans	51	-131.2	-179	0	0	0	0	0	113	C175 E180 C181 H185	C175-G178 PolarHBondContact O-N 3.17Å; G178-E180 VanDerWaalsContact C-N 3.3Å; G178-E180 PolarHBondContact O-N 2.86Å; G178-C181 VanDerWaalsContact O-CB 3.3Å; G178-C181 WeakPolarHBondContact O-CB 3.48Å; G178-C181 PolarHBondContact O-N 3.49Å; G178-H185 PolarHBondContact O-CE1 3.06Å
179	E	89.7	Confident	91.1	Very high	203 Å²	203	92 Å²	92	95%	0.949	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-70.2	-17.9	178.7	60.4	-177	-169.3	0	0	115	R177 C181	R177-E179 PolarHBondContact O-N 2.94Å; E179-C181 PolarHBondContact O-N 3.35Å
180	E	92	Very high	90.7	Very high	137 Å²	137	91.7 Å²	91.7	64%	0.64	47%	0.466	S	S	*	.	G	3₁₀ helix	trans	-79.1	3.3	175.5	-157.6	-123.9	116.8	0	0	112.3	R177 G178 P182	R177-E180 IonicContact CZ-OE1 3.19Å; R177-E180 PolarHBondContact NH2-O 3.3Å; R177-E180 IonicContact NH2-OE1 2.7Å; R177-E180 PolarHBondContact NH2-OE1 3.09Å; R177-E180 WeakPolarHBondContact O-CB 3.25Å; R177-E180 PolarHBondContact O-N 2.7Å; G178-E180 VanDerWaalsContact C-N 3.3Å; G178-E180 PolarHBondContact O-N 2.86Å; E180-P182 WeakPolarHBondContact O-CD 3.08Å
181	C	91.6	Very high	90.2	Very high	18 Å²	18	92 Å²	92	12%	0.122	48%	0.48	C	S	.	.			trans	-73.8	119.3	177.1	-163.8	0	0	0	0	111.4	C167 R177 G178 E179 Y183 H185	C167-C181 VanDerWaalsContact SG-SG 3.63Å; R177-C181 HydrophobicContact CB-CB 3.95Å; G178-C181 VanDerWaalsContact O-CB 3.3Å; G178-C181 WeakPolarHBondContact O-CB 3.48Å; G178-C181 PolarHBondContact O-N 3.49Å; E179-C181 PolarHBondContact O-N 3.35Å; C181-Y183 PolarHBondContact O-N 3.49Å; C181-H185 WeakPolarHBondContact CB-NE2 3.39Å; C181-H185 PolarHBondContact SG-NE2 3.14Å; C181-H185 VanDerWaalsContact SG-NE2 3.37Å
182	P	90.4	Very high	89.8	Confident	75 Å²	75	95.6 Å²	95.6	49%	0.487	50%	0.497	S	S	.	.	S	Bend	trans	-78.1	1.6	176.1	34.3	-37.4	0	0	0	112.9	P164 R177 E180	P164-P182 WeakPolarHBondContact CB-O 3.48Å; P164-P182 WeakPolarHBondContact CG-O 3.38Å; R177-P182 VanDerWaalsContact CZ-CD 3.46Å; E180-P182 WeakPolarHBondContact O-CD 3.08Å
183	Y	93.2	Very high	89.3	Confident	118 Å²	118	91 Å²	91	46%	0.463	48%	0.479	S	S	.	.	S	Bend	trans	-102.6	152.2	175.6	-62.5	-83.1	0	0	0	109.8	H165 C181	H165-Y183 HydrophobicContact CB-CD1 4.2Å; H165-Y183 CarbonylContact O-C 3.6Å; H165-Y183 WeakPolarHBondContact O-CA 3.38Å; H165-Y183 WeakPolarHBondContact O-CB 3.41Å; C181-Y183 PolarHBondContact O-N 3.49Å
184	R	91.7	Very high	88.8	Confident	31 Å²	31	91.9 Å²	91.9	12%	0.117	47%	0.472	C	S	.	.	B	Isolated β-bridge	trans	-77.2	138.2	-174.9	-60.6	-169.9	-69.6	139.6	18.9	111.7	R163 P164 H165 I166 C167 E186 Q423	R163-R184 VanDerWaalsContact CD-NH1 3.26Å; P164-R184 HydrophobicContact CG-CG 3.88Å; P164-R184 PolarHBondContact O-NE 3.46Å; H165-R184 PolarHBondContact O-N 3.26Å; I166-R184 WeakPolarHBondContact CA-O 3.49Å; I166-R184 HydrophobicContact CG1-CB 4.49Å; C167-R184 PolarHBondContact N-O 3.3Å; R184-E186 HydrophobicContact CB-CG 4.02Å; R184-E186 WeakPolarHBondContact CD-OE2 3.4Å; R184-E186 IonicContact CZ-OE1 2.64Å; R184-E186 IonicContact CZ-OE2 3.98Å; R184-E186 IonicContact NE-OE1 3.2Å; R184-E186 IonicContact NE-OE2 3.23Å; R184-E186 IonicContact NH1-OE1 2.71Å; R184-E186 PolarHBondContact NH1-OE1 2.93Å; R184-E186 IonicContact NH1-OE2 2.65Å; R184-E186 PolarHBondContact NH1-OE2 3.39Å; R184-E186 IonicContact NH2-OE1 3.98Å; R184-E186 PolarHBondContact NH2-OE1 2.89Å; R184-E186 IonicContact NH2-OE2 2.69Å; R184-Q423 VanDerWaalsContact NH2-NE2 3.18Å
185	H	92.7	Very high	88.3	Confident	69 Å²	69	87 Å²	87	32%	0.319	45%	0.449	S	S	.	.			trans	-99.9	73.9	172.4	-67.5	173.8	0	0	0	108.3	W170 C175 G178 C181	W170-H185 VanDerWaalsContact CB-CD2 3.41Å; W170-H185 WeakPolarHBondContact CB-CD2 3.5Å; W170-H185 AromaticContact CD1-CD2 3.59Å; W170-H185 AromaticContact CD1-CE1 3.95Å; W170-H185 AromaticContact CD1-CG 3.39Å; W170-H185 AromaticContact CD1-ND1 3.65Å; W170-H185 AromaticContact CD1-NE2 3.95Å; W170-H185 HydrophobicContact CD2-CB 3.86Å; W170-H185 HydrophobicContact CG-CB 3.88Å; W170-H185 AromaticContact CG-CD2 3.42Å; W170-H185 VanDerWaalsContact CG-CD2 3.42Å; W170-H185 AromaticContact CG-CG 3.61Å; W170-H185 AromaticContact CG-NE2 3.99Å; W170-H185 HydrophobicContact CZ2-CB 4.34Å; W170-H185 AromaticContact NE1-CG 3.8Å; C175-H185 PolarHBondContact SG-NE2 3.38Å; G178-H185 PolarHBondContact O-CE1 3.06Å; C181-H185 WeakPolarHBondContact CB-NE2 3.39Å; C181-H185 PolarHBondContact SG-NE2 3.14Å; C181-H185 VanDerWaalsContact SG-NE2 3.37Å
186	E	89.9	Confident	87.4	Confident	59 Å²	59	87.2 Å²	87.2	28%	0.276	45%	0.451	S	S	.	.	S	Bend	trans	-141.9	154.8	176.5	65.6	-177.4	-129.3	0	0	108.3	I166 W170 R184	I166-E186 HydrophobicContact CD1-CG 3.84Å; I166-E186 HydrophobicContact CG1-CG 3.8Å; I166-E186 WeakPolarHBondContact CG2-O 3.43Å; W170-E186 VanDerWaalsContact CZ3-O 3.25Å; W170-E186 WeakPolarHBondContact CZ3-O 3.35Å; R184-E186 HydrophobicContact CB-CG 4.02Å; R184-E186 WeakPolarHBondContact CD-OE2 3.4Å; R184-E186 IonicContact CZ-OE1 2.64Å; R184-E186 IonicContact CZ-OE2 3.98Å; R184-E186 IonicContact NE-OE1 3.2Å; R184-E186 IonicContact NE-OE2 3.23Å; R184-E186 IonicContact NH1-OE1 2.71Å; R184-E186 PolarHBondContact NH1-OE1 2.93Å; R184-E186 IonicContact NH1-OE2 2.65Å; R184-E186 PolarHBondContact NH1-OE2 3.39Å; R184-E186 IonicContact NH2-OE1 3.98Å; R184-E186 PolarHBondContact NH2-OE1 2.89Å; R184-E186 IonicContact NH2-OE2 2.69Å
187	M	87	Confident	86.4	Confident	141 Å²	141	82.5 Å²	82.5	70%	0.695	44%	0.44	S	S	*	.	P	Polyproline II helix	trans	-63.2	138.7	177.9	-164.2	64.9	80.9	0	0	110.5
188	P	87.9	Confident	85.8	Confident	50 Å²	50	78.9 Å²	78.9	33%	0.325	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-53.1	160.4	164.8	-26.2	36.3	0	0	0	112.4	I166 V171	I166-P188 HydrophobicContact CD1-CB 4.33Å; I166-P188 HydrophobicContact CD1-CG 4.33Å; I166-P188 HydrophobicContact CG2-CG 4.28Å; V171-P188 HydrophobicContact CG1-CG 4.33Å; V171-P188 HydrophobicContact CG2-CG 3.77Å
189	S	84.2	Confident	85.7	Confident	31 Å²	31	80.7 Å²	80.7	22%	0.217	43%	0.429	C	S	.	.	P	Polyproline II helix	trans	-69.3	145	162.1	-61.9	0	0	0	0	109.8	H419	S189-H419 PolarHBondContact OG-CE1 2.71Å; S189-H419 VanDerWaalsContact OG-CE1 3.31Å; S189-H419 PolarHBondContact OG-ND1 3.34Å
190	D	84	Confident	85.6	Confident	112 Å²	112	73.4 Å²	73.4	60%	0.599	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-55.8	133.6	179.6	-49	-70.9	0	0	0	109.9	D192 D193	D190-D192 PolarHBondContact O-N 3.34Å; D190-D193 PolarHBondContact O-N 2.9Å; D190-D193 VanDerWaalsContact O-N 3.14Å
191	P	83	Confident	85.4	Confident	100 Å²	100	73.4 Å²	73.4	65%	0.649	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-28.7	-177.9	26	-34.2	0	0	0	111.6	D193 S196	P191-D193 VanDerWaalsContact C-N 3.32Å; P191-D193 PolarHBondContact O-N 2.68Å; P191-S196 PolarHBondContact O-OG 3.05Å
192	D	82.9	Confident	85.3	Confident	148 Å²	148	75.1 Å²	75.1	79%	0.791	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-11.9	-179.9	-52.3	-59	0	0	0	114.3	D190 P194	D190-D192 PolarHBondContact O-N 3.34Å; D192-P194 WeakPolarHBondContact O-CD 3.46Å
193	D	84	Confident	85.4	Confident	51 Å²	51	73.2 Å²	73.2	27%	0.273	38%	0.381	S	S	.	.	S	Bend	trans	-67.2	119.7	167.4	179.9	-0.4	0	0	0	108.1	D190 P191 L195 S196	D190-D193 PolarHBondContact O-N 2.9Å; D190-D193 VanDerWaalsContact O-N 3.14Å; P191-D193 VanDerWaalsContact C-N 3.32Å; P191-D193 PolarHBondContact O-N 2.68Å; D193-L195 PolarHBondContact O-N 2.64Å; D193-L195 WeakPolarHBondContact OD1-CB 3.47Å; D193-L195 WeakPolarHBondContact OD1-CD1 3.32Å; D193-L195 PolarHBondContact OD1-N 3.06Å; D193-S196 VanDerWaalsContact O-CB 3.22Å; D193-S196 WeakPolarHBondContact O-CB 3.21Å; D193-S196 PolarHBondContact O-N 3.26Å; D193-S196 PolarHBondContact O-OG 3.07Å
194	P	80.4	Confident	85.3	Confident	89 Å²	89	67.6 Å²	67.6	58%	0.578	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-15.6	177.5	23.6	-34.7	0	0	0	113.5	D192 S196 P210	D192-P194 WeakPolarHBondContact O-CD 3.46Å; P194-S196 VanDerWaalsContact C-N 3.26Å; P194-S196 PolarHBondContact O-N 2.81Å; P194-P210 HydrophobicContact CB-CB 4.48Å; P194-P210 WeakPolarHBondContact O-CB 3.38Å; P194-P210 WeakPolarHBondContact O-CG 3.4Å
195	L	81.7	Confident	85.2	Confident	7 Å²	7	67.6 Å²	67.6	4%	0.037	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-10.1	171.4	-80.7	67.3	0	0	0	113.8	D193 Q198 P210 V211 K214 I418 P421	D193-L195 PolarHBondContact O-N 2.64Å; D193-L195 WeakPolarHBondContact OD1-CB 3.47Å; D193-L195 WeakPolarHBondContact OD1-CD1 3.32Å; D193-L195 PolarHBondContact OD1-N 3.06Å; L195-Q198 PolarHBondContact O-NE2 2.85Å; L195-P210 HydrophobicContact CD1-CB 4.46Å; L195-V211 HydrophobicContact CG-CG2 4.39Å; L195-K214 HydrophobicContact CD1-CD 3.91Å; L195-K214 HydrophobicContact CD2-CD 4.05Å; L195-I418 HydrophobicContact CD2-CG2 4Å; L195-P421 WeakPolarHBondContact O-CD 3.37Å
196	S	73.7	Confident	84.9	Confident	27 Å²	27	65.1 Å²	65.1	19%	0.189	35%	0.353	C	S	.	.	S	Bend	trans	-70.9	-43.5	179.4	76.7	0	0	0	0	112.3	P191 D193 P194 Q198	P191-S196 PolarHBondContact O-OG 3.05Å; D193-S196 VanDerWaalsContact O-CB 3.22Å; D193-S196 WeakPolarHBondContact O-CB 3.21Å; D193-S196 PolarHBondContact O-N 3.26Å; D193-S196 PolarHBondContact O-OG 3.07Å; P194-S196 VanDerWaalsContact C-N 3.26Å; P194-S196 PolarHBondContact O-N 2.81Å; S196-Q198 PolarHBondContact O-N 3.27Å
197	V	73.4	Confident	84.6	Confident	115 Å²	115	63.8 Å²	63.8	70%	0.697	35%	0.35	S	S	*	.			trans	-86.8	88	-173.9	-172.8	0	0	0	0	110.9
198	Q	79.5	Confident	84.4	Confident	36 Å²	36	65.6 Å²	65.6	17%	0.168	35%	0.354	C	S	.	.			trans	-113.2	93	-179.3	-69.7	-174.2	37.5	0	0	113.4	L195 S196	L195-Q198 PolarHBondContact O-NE2 2.85Å; S196-Q198 PolarHBondContact O-N 3.27Å
199	N	86.7	Confident	84.3	Confident	78 Å²	78	63.3 Å²	63.3	42%	0.417	34%	0.339	S	S	.	.			trans	-70.4	132.8	171.6	179.5	7.6	0	0	0	111.8	R201 D202 R203	N199-R201 VanDerWaalsContact C-N 3.3Å; N199-R201 PolarHBondContact O-N 3.2Å; N199-R201 PolarHBondContact OD1-N 3.16Å; N199-R201 VanDerWaalsContact OD1-N 3.09Å; N199-D202 HydrophobicContact CB-CB 4.15Å; N199-D202 VanDerWaalsContact CB-OD2 3.32Å; N199-D202 WeakPolarHBondContact CB-OD2 3.38Å; N199-D202 PolarHBondContact ND2-OD2 3.45Å; N199-D202 PolarHBondContact O-N 3.29Å; N199-R203 WeakPolarHBondContact O-CG 3.47Å; N199-R203 PolarHBondContact O-N 2.76Å
200	I	87.3	Confident	84.6	Confident	50 Å²	50	63 Å²	63	26%	0.256	34%	0.336	S	S	.	.	H	α-helix	trans	-59.1	-39.1	179.2	-57.7	179.8	0	0	0	111.6	K46 L85 Y204 L428	K46-I200 HydrophobicContact CB-CG2 4.07Å; L85-I200 HydrophobicContact CD1-CG2 3.55Å; I200-Y204 PolarHBondContact O-N 3.26Å; I200-L428 HydrophobicContact CD1-CD2 4.34Å
201	R	88.9	Confident	84.7	Confident	136 Å²	136	57.7 Å²	57.7	51%	0.513	31%	0.308	S	S	.	.	H	α-helix	trans	-72	-46.5	-177.5	-68.7	-178.6	-180	160.4	3.1	112	K46 I47 N199 R203 Y204 Y205	K46-R201 PolarHBondContact O-NE 3.32Å; I47-R201 HydrophobicContact CD1-CG 4.1Å; N199-R201 VanDerWaalsContact C-N 3.3Å; N199-R201 PolarHBondContact O-N 3.2Å; N199-R201 PolarHBondContact OD1-N 3.16Å; N199-R201 VanDerWaalsContact OD1-N 3.09Å; R201-R203 VanDerWaalsContact C-N 3.3Å; R201-R203 PolarHBondContact O-N 3.09Å; R201-Y204 PolarHBondContact O-N 2.86Å; R201-Y205 HydrophobicContact CB-CD2 4.28Å; R201-Y205 HydrophobicContact CB-CE2 4.43Å; R201-Y205 VanDerWaalsContact O-CD2 3.25Å; R201-Y205 WeakPolarHBondContact O-CD2 3.47Å; R201-Y205 PolarHBondContact O-N 2.95Å
202	D	89.8	Confident	85.1	Confident	55 Å²	55	53 Å²	53	29%	0.294	28%	0.277	S	S	.	.	H	α-helix	trans	-61	-40	-179	-70.8	-38.3	0	0	0	111.9	N199 Y204 G206 S207	N199-D202 HydrophobicContact CB-CB 4.15Å; N199-D202 VanDerWaalsContact CB-OD2 3.32Å; N199-D202 WeakPolarHBondContact CB-OD2 3.38Å; N199-D202 PolarHBondContact ND2-OD2 3.45Å; N199-D202 PolarHBondContact O-N 3.29Å; D202-Y204 PolarHBondContact O-N 2.82Å; D202-G206 PolarHBondContact O-N 2.95Å; D202-S207 VanDerWaalsContact CB-O 3.27Å; D202-S207 WeakPolarHBondContact CB-O 3.48Å; D202-S207 PolarHBondContact O-N 3.18Å
203	R	90.9	Very high	85.5	Confident	34 Å²	34	49.1 Å²	49.1	13%	0.128	26%	0.257	C	S	.	.	H	α-helix	trans	-67.4	-27.7	173.7	-67.5	-170.2	55	-114.9	-23.9	114.6	C84 N199 R201 D209	C84-R203 PolarHBondContact O-NH2 2.9Å; N199-R203 WeakPolarHBondContact O-CG 3.47Å; N199-R203 PolarHBondContact O-N 2.76Å; R201-R203 VanDerWaalsContact C-N 3.3Å; R201-R203 PolarHBondContact O-N 3.09Å; R203-D209 HydrophobicContact CG-CB 4.24Å; R203-D209 IonicContact NE-OD2 2.67Å; R203-D209 PolarHBondContact NE-OD2 2.92Å
204	Y	91.9	Very high	85.8	Confident	1 Å²	1	51.5 Å²	51.5	0%	0.004	26%	0.264	C	S	.	.	H	α-helix	trans	-80.7	-44.7	174.6	175.9	-90.4	0	0	0	112.5	I47 C74 K78 V80 L85 L107 I200 R201 D202 G206	I47-Y204 HydrophobicContact CD1-CD1 3.8Å; I47-Y204 HydrophobicContact CD1-CD2 4.27Å; I47-Y204 HydrophobicContact CD1-CG 3.6Å; I47-Y204 HydrophobicContact CG1-CD1 3.87Å; I47-Y204 HydrophobicContact CG1-CD2 3.93Å; I47-Y204 HydrophobicContact CG1-CE1 4.26Å; I47-Y204 HydrophobicContact CG1-CE2 4.29Å; I47-Y204 HydrophobicContact CG1-CG 3.71Å; I47-Y204 HydrophobicContact CG2-CD1 3.84Å; I47-Y204 HydrophobicContact CG2-CE1 3.66Å; C74-Y204 HydrophobicContact CB-CE2 4.05Å; C74-Y204 PolarHBondContact O-OH 2.92Å; K78-Y204 HydrophobicContact CB-CE2 4.18Å; K78-Y204 HydrophobicContact CG-CE1 4.4Å; K78-Y204 HydrophobicContact CG-CE2 4.11Å; V80-Y204 HydrophobicContact CG2-CD2 4.49Å; V80-Y204 HydrophobicContact CG2-CE2 4.32Å; L85-Y204 HydrophobicContact CD2-CD2 4.44Å; L107-Y204 HydrophobicContact CD2-CE1 4.13Å; I200-Y204 PolarHBondContact O-N 3.26Å; R201-Y204 PolarHBondContact O-N 2.86Å; D202-Y204 PolarHBondContact O-N 2.82Å; Y204-G206 PolarHBondContact O-N 3.3Å
205	Y	89.4	Confident	86.2	Confident	30 Å²	30	48 Å²	48	12%	0.118	24%	0.241	C	C	.	.	H	α-helix	trans	-78.7	-0.3	179.7	-72.5	-68.2	0	0	0	113.5	I47 L107 P108 K109 R201 S207	I47-Y205 HydrophobicContact CG2-CE2 4.35Å; L107-Y205 HydrophobicContact CB-CD1 4.27Å; L107-Y205 HydrophobicContact CB-CE1 4.02Å; P108-Y205 PolarHBondContact O-OH 3.07Å; K109-Y205 HydrophobicContact CD-CD1 4.43Å; K109-Y205 HydrophobicContact CD-CD2 4.48Å; K109-Y205 HydrophobicContact CD-CG 4.24Å; K109-Y205 HydrophobicContact CG-CD1 4Å; K109-Y205 HydrophobicContact CG-CD2 4.42Å; K109-Y205 HydrophobicContact CG-CE1 3.98Å; K109-Y205 HydrophobicContact CG-CE2 4.43Å; K109-Y205 HydrophobicContact CG-CG 4.22Å; R201-Y205 HydrophobicContact CB-CD2 4.28Å; R201-Y205 HydrophobicContact CB-CE2 4.43Å; R201-Y205 VanDerWaalsContact O-CD2 3.25Å; R201-Y205 WeakPolarHBondContact O-CD2 3.47Å; R201-Y205 PolarHBondContact O-N 2.95Å; Y205-S207 VanDerWaalsContact C-N 3.32Å; Y205-S207 PolarHBondContact O-N 2.89Å
206	G	85.6	Confident	86.7	Confident	18 Å²	18	48.3 Å²	48.3	19%	0.186	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.8	31.2	177.1	0	0	0	0	0	114	Q95 D202 Y204	Q95-G206 WeakPolarHBondContact CB-O 3.49Å; Q95-G206 VanDerWaalsContact CG-O 3.3Å; Q95-G206 WeakPolarHBondContact CG-O 3.43Å; Q95-G206 PolarHBondContact OE1-O 2.98Å; D202-G206 PolarHBondContact O-N 2.95Å; Y204-G206 PolarHBondContact O-N 3.3Å
207	S	84.6	Confident	87.5	Confident	31 Å²	31	51.3 Å²	51.3	22%	0.217	26%	0.256	C	S	.	.	S	Bend	trans	-126.1	116.3	-176.8	56.8	0	0	0	0	111.4	K109 D202 Y205	K109-S207 PolarHBondContact NZ-OG 3.13Å; D202-S207 VanDerWaalsContact CB-O 3.27Å; D202-S207 WeakPolarHBondContact CB-O 3.48Å; D202-S207 PolarHBondContact O-N 3.18Å; Y205-S207 VanDerWaalsContact C-N 3.32Å; Y205-S207 PolarHBondContact O-N 2.89Å
208	K	83.1	Confident	88.3	Confident	178 Å²	178	53.3 Å²	53.3	77%	0.774	25%	0.252	S	S	*	.	S	Bend	trans	64.6	43	-177.8	-50.7	-178.9	179.3	-177.3	0	113.8	P210	K208-P210 VanDerWaalsContact O-CD 3.26Å; K208-P210 WeakPolarHBondContact O-CD 3.42Å
209	D	85.7	Confident	88.8	Confident	2 Å²	2	52.1 Å²	52.1	1%	0.011	25%	0.248	C	C	.	.			trans	-85.5	107.3	166.8	-173.8	-8.2	0	0	0	109.8	R203 V211 A212 D213	R203-D209 HydrophobicContact CG-CB 4.24Å; R203-D209 IonicContact NE-OD2 2.67Å; R203-D209 PolarHBondContact NE-OD2 2.92Å; D209-V211 PolarHBondContact O-N 3.23Å; D209-V211 VanDerWaalsContact O-N 3.12Å; D209-V211 WeakPolarHBondContact OD1-CB 3.34Å; D209-V211 PolarHBondContact OD1-N 3.22Å; D209-A212 HydrophobicContact CB-CB 3.84Å; D209-A212 WeakPolarHBondContact O-CA 3.45Å; D209-A212 VanDerWaalsContact O-CB 3.29Å; D209-A212 WeakPolarHBondContact O-CB 3.37Å; D209-A212 PolarHBondContact O-N 2.8Å; D209-D213 PolarHBondContact O-N 2.31Å
210	P	89	Confident	88.8	Confident	24 Å²	24	55.3 Å²	55.3	16%	0.156	26%	0.258	C	S	.	.	H	α-helix	trans	-62.3	-23.8	-178.6	26.9	-35.7	0	0	0	112.5	P194 L195 K208 K214	P194-P210 HydrophobicContact CB-CB 4.48Å; P194-P210 WeakPolarHBondContact O-CB 3.38Å; P194-P210 WeakPolarHBondContact O-CG 3.4Å; L195-P210 HydrophobicContact CD1-CB 4.46Å; K208-P210 VanDerWaalsContact O-CD 3.26Å; K208-P210 WeakPolarHBondContact O-CD 3.42Å; P210-K214 WeakPolarHBondContact O-CB 3.41Å; P210-K214 PolarHBondContact O-N 3.09Å; P210-K214 VanDerWaalsContact O-N 3.14Å
211	V	88	Confident	88.9	Confident	2 Å²	2	56.9 Å²	56.9	1%	0.012	28%	0.278	C	S	.	.	H	α-helix	trans	-69.2	-39.8	172.1	177.7	0	0	0	0	110.8	P93 L195 D209 L215 Y420	P93-V211 HydrophobicContact CG-CG1 4.04Å; L195-V211 HydrophobicContact CG-CG2 4.39Å; D209-V211 PolarHBondContact O-N 3.23Å; D209-V211 VanDerWaalsContact O-N 3.12Å; D209-V211 WeakPolarHBondContact OD1-CB 3.34Å; D209-V211 PolarHBondContact OD1-N 3.22Å; V211-L215 PolarHBondContact O-N 3.29Å; V211-L215 VanDerWaalsContact O-N 3.12Å; V211-Y420 HydrophobicContact CB-CE1 4.35Å; V211-Y420 HydrophobicContact CG1-CE1 3.59Å; V211-Y420 HydrophobicContact CG1-CE2 4.37Å; V211-Y420 VanDerWaalsContact CG1-CZ 3.42Å; V211-Y420 WeakPolarHBondContact CG1-OH 3.35Å; V211-Y420 HydrophobicContact CG2-CD1 4.28Å; V211-Y420 HydrophobicContact CG2-CE1 3.92Å
212	A	90.8	Very high	88.6	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-67.5	-44.3	177.2	0	0	0	0	0	110.9	P93 Q95 V96 D209 K214 L215 L216	P93-A212 HydrophobicContact CB-CB 4.09Å; P93-A212 HydrophobicContact CG-CB 4.43Å; Q95-A212 HydrophobicContact CB-CB 3.65Å; Q95-A212 HydrophobicContact CG-CB 3.94Å; V96-A212 HydrophobicContact CG2-CB 3.58Å; D209-A212 HydrophobicContact CB-CB 3.84Å; D209-A212 WeakPolarHBondContact O-CA 3.45Å; D209-A212 VanDerWaalsContact O-CB 3.29Å; D209-A212 WeakPolarHBondContact O-CB 3.37Å; D209-A212 PolarHBondContact O-N 2.8Å; A212-K214 VanDerWaalsContact C-N 3.32Å; A212-K214 PolarHBondContact O-N 3.3Å; A212-L215 CarbonylContact O-C 3.57Å; A212-L215 WeakPolarHBondContact O-CA 3.37Å; A212-L215 WeakPolarHBondContact O-CB 3.05Å; A212-L215 PolarHBondContact O-N 3.29Å; A212-L216 WeakPolarHBondContact O-CG 3.3Å; A212-L216 PolarHBondContact O-N 3.19Å
213	D	90.5	Very high	88.2	Confident	68 Å²	68	54.2 Å²	54.2	36%	0.364	28%	0.277	S	S	.	.	H	α-helix	trans	-61	-40.6	178	-64.1	-31.9	0	0	0	111.7	Q95 D209 L215 L216 N217	Q95-D213 PolarHBondContact NE2-OD1 3.28Å; D209-D213 PolarHBondContact O-N 2.31Å; D213-L215 VanDerWaalsContact C-N 3.32Å; D213-L215 PolarHBondContact O-N 3.42Å; D213-L216 PolarHBondContact O-N 2.91Å; D213-N217 WeakPolarHBondContact O-CB 3.33Å; D213-N217 VanDerWaalsContact O-CG 3.24Å; D213-N217 PolarHBondContact O-N 3.02Å; D213-N217 PolarHBondContact O-ND2 3.25Å
214	K	90.1	Very high	87.7	Confident	100 Å²	100	57.9 Å²	57.9	44%	0.435	30%	0.302	S	S	.	.	H	α-helix	trans	-63.6	-34.3	173.3	-164.2	162.8	-173.7	164.7	0	112.6	L195 P210 A212 R218	L195-K214 HydrophobicContact CD1-CD 3.91Å; L195-K214 HydrophobicContact CD2-CD 4.05Å; P210-K214 WeakPolarHBondContact O-CB 3.41Å; P210-K214 PolarHBondContact O-N 3.09Å; P210-K214 VanDerWaalsContact O-N 3.14Å; A212-K214 VanDerWaalsContact C-N 3.32Å; A212-K214 PolarHBondContact O-N 3.3Å; K214-R218 PolarHBondContact O-N 2.71Å; K214-R218 VanDerWaalsContact O-N 3.14Å
215	L	90.2	Very high	87.1	Confident	15 Å²	15	58.5 Å²	58.5	8%	0.079	31%	0.306	C	S	.	.	H	α-helix	trans	-73.9	-40.9	173.7	-109.6	62	0	0	0	112.9	L92 P93 V96 V211 A212 D213 R218 A219	L92-L215 HydrophobicContact CD2-CD2 3.79Å; P93-L215 HydrophobicContact CG-CD2 4.38Å; V96-L215 HydrophobicContact CG2-CB 3.91Å; V96-L215 HydrophobicContact CG2-CD2 4.16Å; V211-L215 PolarHBondContact O-N 3.29Å; V211-L215 VanDerWaalsContact O-N 3.12Å; A212-L215 CarbonylContact O-C 3.57Å; A212-L215 WeakPolarHBondContact O-CA 3.37Å; A212-L215 WeakPolarHBondContact O-CB 3.05Å; A212-L215 PolarHBondContact O-N 3.29Å; D213-L215 VanDerWaalsContact C-N 3.32Å; D213-L215 PolarHBondContact O-N 3.42Å; L215-R218 WeakPolarHBondContact O-CB 3.48Å; L215-R218 PolarHBondContact O-N 2.97Å; L215-A219 WeakPolarHBondContact O-CB 3.44Å; L215-A219 PolarHBondContact O-N 2.77Å
216	L	90.8	Very high	86.7	Confident	14 Å²	14	65.9 Å²	65.9	7%	0.073	34%	0.338	C	S	.	.	H	α-helix	trans	-66.3	-37.9	176.5	-70.1	172.3	0	0	0	111.3	V96 Y99 M148 A212 D213 A219 K220	V96-L216 HydrophobicContact CG1-CD2 4.26Å; V96-L216 HydrophobicContact CG2-CG 4.42Å; Y99-L216 HydrophobicContact CD1-CD2 3.41Å; Y99-L216 VanDerWaalsContact CD1-CD2 3.41Å; Y99-L216 HydrophobicContact CE1-CD2 3.91Å; Y99-L216 HydrophobicContact CG-CD2 3.88Å; M148-L216 HydrophobicContact CE-CD2 3.92Å; A212-L216 WeakPolarHBondContact O-CG 3.3Å; A212-L216 PolarHBondContact O-N 3.19Å; D213-L216 PolarHBondContact O-N 2.91Å; L216-A219 WeakPolarHBondContact O-CB 3.19Å; L216-A219 PolarHBondContact O-N 3.25Å; L216-A219 VanDerWaalsContact O-N 3.17Å; L216-K220 WeakPolarHBondContact O-CG 3.35Å; L216-K220 PolarHBondContact O-N 3.18Å
217	N	91.5	Very high	86.4	Confident	90 Å²	90	68.4 Å²	68.4	48%	0.481	35%	0.352	S	S	.	.	H	α-helix	trans	-69.1	-36.7	173.7	-68.7	-19.7	0	0	0	112	D213 A219 K220 A221	D213-N217 WeakPolarHBondContact O-CB 3.33Å; D213-N217 VanDerWaalsContact O-CG 3.24Å; D213-N217 PolarHBondContact O-N 3.02Å; D213-N217 PolarHBondContact O-ND2 3.25Å; N217-A219 VanDerWaalsContact C-N 3.29Å; N217-A219 PolarHBondContact O-N 3.3Å; N217-K220 PolarHBondContact O-N 2.97Å; N217-K220 PolarHBondContact OD1-NZ 3.17Å; N217-A221 PolarHBondContact O-N 3.36Å
218	R	90.5	Very high	86.2	Confident	158 Å²	158	68 Å²	68	60%	0.596	35%	0.348	S	S	*	.	H	α-helix	trans	-61.7	-36	167.3	-178.5	-180	176.9	115.9	-0.9	112.2	K214 L215 A221 F222	K214-R218 PolarHBondContact O-N 2.71Å; K214-R218 VanDerWaalsContact O-N 3.14Å; L215-R218 WeakPolarHBondContact O-CB 3.48Å; L215-R218 PolarHBondContact O-N 2.97Å; R218-A221 PolarHBondContact O-N 2.73Å; R218-F222 PolarHBondContact O-N 3.42Å
219	A	88.9	Confident	86	Confident	11 Å²	11	68.7 Å²	68.7	9%	0.091	35%	0.354	C	S	.	.	H	α-helix	trans	-69.6	-43.3	179	0	0	0	0	0	112.6	M148 L152 L215 L216 N217 A221 F222	M148-A219 HydrophobicContact CE-CB 3.5Å; L152-A219 HydrophobicContact CD1-CB 3.95Å; L152-A219 HydrophobicContact CD2-CB 4.14Å; L152-A219 HydrophobicContact CG-CB 4.48Å; L215-A219 WeakPolarHBondContact O-CB 3.44Å; L215-A219 PolarHBondContact O-N 2.77Å; L216-A219 WeakPolarHBondContact O-CB 3.19Å; L216-A219 PolarHBondContact O-N 3.25Å; L216-A219 VanDerWaalsContact O-N 3.17Å; N217-A219 VanDerWaalsContact C-N 3.29Å; N217-A219 PolarHBondContact O-N 3.3Å; A219-A221 PolarHBondContact O-N 3.48Å; A219-F222 HydrophobicContact CB-CD2 4.32Å; A219-F222 HydrophobicContact CB-CE2 4.33Å; A219-F222 WeakPolarHBondContact O-CB 3.48Å; A219-F222 WeakPolarHBondContact O-CD2 3.35Å; A219-F222 PolarHBondContact O-N 3.32Å; A219-F222 VanDerWaalsContact O-N 3.07Å
220	K	88	Confident	85.9	Confident	145 Å²	145	73.2 Å²	73.2	63%	0.63	38%	0.378	S	S	*	.	H	α-helix	trans	-60.4	-27.3	172.3	-66.9	167	-166.6	164.9	0	112.7	L216 N217 F222	L216-K220 WeakPolarHBondContact O-CG 3.35Å; L216-K220 PolarHBondContact O-N 3.18Å; N217-K220 PolarHBondContact O-N 2.97Å; N217-K220 PolarHBondContact OD1-NZ 3.17Å; K220-F222 VanDerWaalsContact C-N 3.35Å
221	A	88.6	Confident	85.4	Confident	82 Å²	82	81.9 Å²	81.9	68%	0.678	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	0.5	176.7	0	0	0	0	0	114.1	N217 R218 A219	N217-A221 PolarHBondContact O-N 3.36Å; R218-A221 PolarHBondContact O-N 2.73Å; A219-A221 PolarHBondContact O-N 3.48Å
222	F	82.9	Confident	85.2	Confident	51 Å²	51	89 Å²	89	22%	0.224	45%	0.446	C	S	.	.	S	Bend	trans	-67.3	146.6	168.9	-72.7	-47.5	0	0	0	110.7	R151 L152 R218 A219 K220 V224	R151-F222 HydrophobicContact CB-CE2 3.93Å; R151-F222 HydrophobicContact CB-CZ 3.99Å; L152-F222 HydrophobicContact CD2-CE2 3.72Å; L152-F222 HydrophobicContact CD2-CZ 3.84Å; L152-F222 HydrophobicContact CG-CE2 3.98Å; L152-F222 HydrophobicContact CG-CZ 4.34Å; R218-F222 PolarHBondContact O-N 3.42Å; A219-F222 HydrophobicContact CB-CD2 4.32Å; A219-F222 HydrophobicContact CB-CE2 4.33Å; A219-F222 WeakPolarHBondContact O-CB 3.48Å; A219-F222 WeakPolarHBondContact O-CD2 3.35Å; A219-F222 PolarHBondContact O-N 3.32Å; A219-F222 VanDerWaalsContact O-N 3.07Å; K220-F222 VanDerWaalsContact C-N 3.35Å; F222-V224 PolarHBondContact O-N 3.23Å
223	P	81.8	Confident	85	Confident	85 Å²	85	89.9 Å²	89.9	55%	0.552	45%	0.45	S	S	*	.			trans	-63.7	129.5	169.9	28.4	-34.1	0	0	0	109.6	F292	P223-F292 HydrophobicContact CB-CE1 3.99Å; P223-F292 HydrophobicContact CB-CZ 4.15Å; P223-F292 HydrophobicContact CG-CE1 4.19Å; P223-F292 WeakPolarHBondContact O-CE1 3.37Å
224	V	79.3	Confident	84.9	Confident	111 Å²	111	87 Å²	87	67%	0.673	44%	0.435	S	S	*	.			trans	-123.1	140.2	171.4	178.8	0	0	0	0	107	F222 K226	F222-V224 PolarHBondContact O-N 3.23Å; V224-K226 PolarHBondContact O-N 3.39Å
225	L	79	Confident	85	Confident	13 Å²	13	84 Å²	84	7%	0.068	43%	0.425	C	S	.	.			trans	-74	112	169.2	-69.4	-179.7	0	0	0	108.3	C288 F292	L225-C288 HydrophobicContact CD1-CB 3.86Å; L225-F292 HydrophobicContact CD1-CB 3.84Å; L225-F292 HydrophobicContact CD1-CD2 3.6Å; L225-F292 HydrophobicContact CD1-CE2 4.36Å; L225-F292 HydrophobicContact CD1-CG 3.81Å; L225-F292 HydrophobicContact CD2-CD2 3.76Å; L225-F292 HydrophobicContact CD2-CE2 3.65Å; L225-F292 HydrophobicContact CD2-CG 4.37Å; L225-F292 HydrophobicContact CD2-CZ 4.19Å; L225-F292 HydrophobicContact CG-CB 4.17Å; L225-F292 HydrophobicContact CG-CD1 4.16Å; L225-F292 HydrophobicContact CG-CD2 3.52Å; L225-F292 HydrophobicContact CG-CE1 4.48Å; L225-F292 HydrophobicContact CG-CE2 3.89Å; L225-F292 HydrophobicContact CG-CG 3.67Å; L225-F292 HydrophobicContact CG-CZ 4.35Å
226	K	81.4	Confident	85	Confident	186 Å²	186	83.3 Å²	83.3	81%	0.809	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-65.3	131.9	161.6	-67.5	-174.8	177.5	-173.4	0	107.8	V224 W306	V224-K226 PolarHBondContact O-N 3.39Å; K226-W306 PolarHBondContact O-NE1 3.4Å
227	P	80.1	Confident	85.1	Confident	71 Å²	71	85.9 Å²	85.9	46%	0.461	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-65.9	156.2	173.3	30	-35.6	0	0	0	110.5	E285 W306	P227-E285 VanDerWaalsContact CB-OE1 3.26Å; P227-E285 WeakPolarHBondContact CB-OE1 3.41Å; P227-W306 HydrophobicContact CB-CZ2 4.42Å
228	P	79.7	Confident	85.1	Confident	21 Å²	21	81.6 Å²	81.6	14%	0.136	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-67.2	144.4	177.3	27.8	-33.9	0	0	0	111.2	I233 R281 W306	P228-I233 HydrophobicContact CB-CB 4.21Å; P228-I233 HydrophobicContact CB-CD1 4.02Å; P228-I233 HydrophobicContact CG-CB 3.97Å; P228-I233 HydrophobicContact CG-CG2 4.22Å; P228-R281 PolarHBondContact O-NH1 3.16Å; P228-R281 PolarHBondContact O-NH2 3.49Å; P228-W306 VanDerWaalsContact CD-CD2 3.48Å; P228-W306 HydrophobicContact CG-CD2 4.16Å; P228-W306 HydrophobicContact CG-CE3 4.01Å; P228-W306 HydrophobicContact CG-CZ3 4.32Å
229	E	79.6	Confident	85	Confident	194 Å²	194	74.1 Å²	74.1	91%	0.907	38%	0.38	S	S	*	.	S	Bend	trans	-64.8	-44.9	171.9	-64.2	175	-167.3	0	0	109.6	R231	E229-R231 PolarHBondContact O-N 3.28Å
230	D	83.5	Confident	85	Confident	97 Å²	97	77.9 Å²	77.9	52%	0.519	40%	0.398	S	S	.	.	S	Bend	trans	-61.2	111.9	173.1	-67.8	-45.5	0	0	0	112.2	N232 I233	D230-N232 PolarHBondContact O-N 3.1Å; D230-N232 VanDerWaalsContact O-N 3.15Å; D230-I233 HydrophobicContact CB-CD1 3.68Å; D230-I233 HydrophobicContact CB-CG1 3.78Å; D230-I233 PolarHBondContact O-N 3.1Å
231	R	79.3	Confident	84.8	Confident	205 Å²	205	71.5 Å²	71.5	77%	0.774	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-15.8	-179	-58.8	-165.3	173	-160.8	-2.3	115.1	E229	E229-R231 PolarHBondContact O-N 3.28Å
232	N	83.3	Confident	84.3	Confident	151 Å²	151	68.8 Å²	68.8	81%	0.807	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-9.1	-176.1	-61	-12.7	0	0	0	113.2	D230 T234	D230-N232 PolarHBondContact O-N 3.1Å; D230-N232 VanDerWaalsContact O-N 3.15Å; N232-T234 PolarHBondContact O-N 3.4Å; N232-T234 VanDerWaalsContact O-N 3.09Å
233	I	85.5	Confident	84.1	Confident	20 Å²	20	73.7 Å²	73.7	10%	0.103	38%	0.375	C	S	.	.			trans	-79.4	93.9	179.4	-59.8	179	0	0	0	109.7	P228 D230 G307 P309	P228-I233 HydrophobicContact CB-CB 4.21Å; P228-I233 HydrophobicContact CB-CD1 4.02Å; P228-I233 HydrophobicContact CG-CB 3.97Å; P228-I233 HydrophobicContact CG-CG2 4.22Å; D230-I233 HydrophobicContact CB-CD1 3.68Å; D230-I233 HydrophobicContact CB-CG1 3.78Å; D230-I233 PolarHBondContact O-N 3.1Å; I233-G307 VanDerWaalsContact CG2-O 3.28Å; I233-G307 WeakPolarHBondContact CG2-O 3.28Å; I233-P309 HydrophobicContact CD1-CG 4.47Å
234	T	89.7	Confident	83.6	Confident	8 Å²	8	76.9 Å²	76.9	5%	0.049	38%	0.383	C	S	.	.			trans	-96.8	10.6	167.8	66.3	0	0	0	0	112.9	N232 Q277 F278	N232-T234 PolarHBondContact O-N 3.4Å; N232-T234 VanDerWaalsContact O-N 3.09Å; T234-Q277 WeakPolarHBondContact OG1-CG 3.34Å; T234-F278 VanDerWaalsContact CB-O 3.27Å; T234-F278 WeakPolarHBondContact CB-O 3.49Å; T234-F278 PolarHBondContact O-N 3.36Å; T234-F278 PolarHBondContact OG1-O 3.32Å
235	T	91	Very high	83.2	Confident	36 Å²	36	74.7 Å²	74.7	22%	0.221	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	124.2	-176.3	-51.1	0	0	0	0	111.6	F275 V276 G307	T235-F275 HydrophobicContact CG2-CB 4.11Å; T235-F275 HydrophobicContact CG2-CD1 4.18Å; T235-V276 CarbonylContact C-O 3.58Å; T235-V276 WeakPolarHBondContact CA-O 3.33Å; T235-G307 WeakPolarHBondContact O-CA 3.48Å; T235-G307 PolarHBondContact O-N 3.17Å
236	V	91.6	Very high	83.2	Confident	0 Å²	0	77.7 Å²	77.7	0%	0	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	128.9	174.1	-177.8	0	0	0	0	109.2	V238 F275 V276 F278 A284 I304	V236-V238 HydrophobicContact CG1-CG2 4.38Å; V236-F275 WeakPolarHBondContact O-CA 3.29Å; V236-V276 PolarHBondContact N-O 3.31Å; V236-V276 PolarHBondContact O-N 3.46Å; V236-F278 HydrophobicContact CG2-CD2 4.09Å; V236-F278 HydrophobicContact CG2-CE2 3.83Å; V236-A284 HydrophobicContact CG2-CB 4.21Å; V236-I304 HydrophobicContact CG1-CG2 3.65Å
237	Y	91.8	Very high	83.3	Confident	69 Å²	69	69.4 Å²	69.4	27%	0.271	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	132.5	171.3	165.4	-85.4	0	0	0	110	C273 F275 I304 R305	Y237-C273 HydrophobicContact CE2-CB 4.08Å; Y237-C273 VanDerWaalsContact CE2-SG 3.57Å; Y237-C273 PolarHBondContact OH-SG 3.45Å; Y237-F275 HydrophobicContact CD2-CD1 4.41Å; Y237-F275 AromaticContact CD2-CE1 3.77Å; Y237-F275 HydrophobicContact CD2-CE1 3.77Å; Y237-F275 AromaticContact CD2-CZ 4Å; Y237-F275 HydrophobicContact CD2-CZ 4Å; Y237-I304 WeakPolarHBondContact O-CA 3.48Å; Y237-R305 HydrophobicContact CD1-CB 3.83Å; Y237-R305 HydrophobicContact CD1-CG 4.02Å; Y237-R305 HydrophobicContact CE1-CG 4.42Å; Y237-R305 HydrophobicContact CG-CB 4.45Å; Y237-R305 PolarHBondContact N-O 2.93Å; Y237-R305 PolarHBondContact O-N 3.35Å
238	V	91.3	Very high	83.7	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	100.3	178.4	-172.7	0	0	0	0	108.4	V236 L241 F256 C273 A274 V276 L302 I304	V236-V238 HydrophobicContact CG1-CG2 4.38Å; V238-L241 HydrophobicContact CG1-CD2 4Å; V238-F256 HydrophobicContact CG2-CE2 3.79Å; V238-F256 HydrophobicContact CG2-CZ 3.75Å; V238-C273 CarbonylContact O-C 3.54Å; V238-C273 WeakPolarHBondContact O-CA 3.47Å; V238-A274 PolarHBondContact N-O 3.19Å; V238-A274 PolarHBondContact O-N 3.46Å; V238-V276 HydrophobicContact CG2-CG2 4.35Å; V238-L302 HydrophobicContact CG1-CB 4.07Å; V238-L302 HydrophobicContact CG1-CD1 3.78Å; V238-L302 HydrophobicContact CG1-CG 4.43Å; V238-I304 HydrophobicContact CG1-CG1 4.46Å
239	G	89.7	Confident	84.1	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	169.4	175.9	0	0	0	0	0	112.9	T303	G239-T303 WeakPolarHBondContact CA-OG1 3.42Å; G239-T303 PolarHBondContact N-O 3.09Å; G239-T303 PolarHBondContact O-N 3.09Å; G239-T303 PolarHBondContact O-OG1 2.95Å
240	N	87.3	Confident	84.5	Confident	90 Å²	90	69 Å²	69	48%	0.481	35%	0.352	S	S	.	.			trans	67.1	37.9	-177.4	-161.7	54.1	0	0	0	113.9	G272 R301 L302 T303	N240-G272 PolarHBondContact N-O 3.35Å; N240-G272 VanDerWaalsContact N-O 3.08Å; N240-R301 PolarHBondContact ND2-O 3.43Å; N240-L302 WeakPolarHBondContact O-CD2 3.45Å; N240-T303 HydrophobicContact CB-CG2 4.13Å
241	L	83.7	Confident	84.8	Confident	11 Å²	11	66.1 Å²	66.1	6%	0.058	34%	0.336	C	S	.	.			trans	-65	-32.1	168.5	-58.8	177	0	0	0	111.6	V238 I247 I252 G272 C273 A274 L302	V238-L241 HydrophobicContact CG1-CD2 4Å; L241-I247 HydrophobicContact CD2-CD1 4.47Å; L241-I247 HydrophobicContact CD2-CG2 4.07Å; L241-I252 HydrophobicContact CD1-CD1 4.01Å; L241-I252 HydrophobicContact CD2-CD1 3.77Å; L241-I252 HydrophobicContact CD2-CG1 4.44Å; L241-G272 PolarHBondContact N-O 2.97Å; L241-C273 VanDerWaalsContact CD1-C 3.45Å; L241-A274 HydrophobicContact CD1-CB 3.8Å; L241-L302 HydrophobicContact CD2-CD1 4.06Å; L241-L302 HydrophobicContact CD2-CD2 3.97Å
242	G	79.7	Confident	85.3	Confident	26 Å²	26	56.6 Å²	56.6	27%	0.268	30%	0.3	S	S	.	.			trans	86.2	-153.7	-177.1	0	0	0	0	0	112.8
243	E	77	Confident	85.7	Confident	153 Å²	153	55.7 Å²	55.7	72%	0.715	29%	0.286	S	S	*	.	S	Bend	trans	-72.3	161.4	-174.5	-68.9	172.4	-157.2	0	0	113.5
244	E	71.3	Confident	86	Confident	153 Å²	153	61.3 Å²	61.3	72%	0.715	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	136.1	-173.3	-71.1	-172	173.5	0	0	112.9	E246 P269	E244-E246 PolarHBondContact O-N 3.34Å; E244-P269 HydrophobicContact CG-CB 3.64Å; E244-P269 HydrophobicContact CG-CG 4.48Å; E244-P269 VanDerWaalsContact OE1-CB 3.3Å; E244-P269 WeakPolarHBondContact OE1-CB 3.49Å; E244-P269 WeakPolarHBondContact OE1-CG 3.08Å
245	G	71.8	Confident	86	Confident	64 Å²	64	64.3 Å²	64.3	66%	0.66	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.6	-23.5	177	0	0	0	0	0	115.6
246	E	79.6	Confident	86	Confident	77 Å²	77	62.6 Å²	62.6	36%	0.36	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-51	179.7	-88.6	-173.8	-108	0	0	112.6	E244 K298 R300	E244-E246 PolarHBondContact O-N 3.34Å; E246-K298 WeakPolarHBondContact O-CD 3.42Å; E246-K298 WeakPolarHBondContact O-CE 3.49Å; E246-K298 PolarHBondContact O-NZ 2.76Å; E246-R300 VanDerWaalsContact CD-NH2 3.33Å; E246-R300 IonicContact OE1-CZ 3.93Å; E246-R300 IonicContact OE1-NH1 2.98Å; E246-R300 PolarHBondContact OE1-NH1 2.89Å; E246-R300 IonicContact OE1-NH2 3.06Å; E246-R300 PolarHBondContact OE1-NH2 2.69Å; E246-R300 IonicContact OE2-CZ 3.15Å; E246-R300 IonicContact OE2-NE 3.23Å; E246-R300 PolarHBondContact OE2-NE 3.16Å; E246-R300 IonicContact OE2-NH1 2.68Å; E246-R300 PolarHBondContact OE2-NH1 3.05Å; E246-R300 IonicContact OE2-NH2 2.99Å; E246-R300 PolarHBondContact OE2-NH2 2.93Å
247	I	83.4	Confident	86	Confident	12 Å²	12	70.8 Å²	70.8	6%	0.062	35%	0.346	C	S	.	.	S	Bend	trans	-113.6	122.1	176.1	-60.6	178.7	0	0	0	109	L241 D251 I252 V297 K298 R300 L302	L241-I247 HydrophobicContact CD2-CD1 4.47Å; L241-I247 HydrophobicContact CD2-CG2 4.07Å; I247-D251 HydrophobicContact CG2-CB 4.32Å; I247-I252 HydrophobicContact CG2-CD1 4.16Å; I247-I252 HydrophobicContact CG2-CG1 3.83Å; I247-V297 HydrophobicContact CD1-CB 4.07Å; I247-V297 HydrophobicContact CD1-CG1 4.18Å; I247-V297 HydrophobicContact CG1-CG1 4.28Å; I247-V297 HydrophobicContact CG2-CG1 4.34Å; I247-K298 HydrophobicContact CG1-CD 4.45Å; I247-R300 HydrophobicContact CD1-CB 4.42Å; I247-L302 HydrophobicContact CD1-CD2 3.84Å
248	T	87.1	Confident	86	Confident	52 Å²	52	73.7 Å²	73.7	32%	0.319	36%	0.362	S	S	.	.			trans	-100.2	160.5	-178.3	70.9	0	0	0	0	111.4	K250 D251 I252	T248-K250 PolarHBondContact O-N 2.84Å; T248-D251 WeakPolarHBondContact CA-OD2 3.01Å; T248-D251 WeakPolarHBondContact CB-OD2 3.5Å; T248-D251 PolarHBondContact N-OD2 2.93Å; T248-D251 WeakPolarHBondContact O-CB 3.18Å; T248-D251 PolarHBondContact O-N 3.36Å; T248-D251 VanDerWaalsContact OG1-CG 3.3Å; T248-D251 PolarHBondContact OG1-N 3.43Å; T248-D251 PolarHBondContact OG1-OD2 3.37Å; T248-I252 PolarHBondContact O-N 3.23Å
249	E	88.3	Confident	86	Confident	76 Å²	76	75.5 Å²	75.5	36%	0.355	37%	0.369	S	S	.	.	H	α-helix	trans	-56.1	-35.1	175.5	-165.3	-151.4	125	0	0	111.6	I252 R253 V265 M267	E249-I252 PolarHBondContact O-N 3.44Å; E249-R253 WeakPolarHBondContact O-CB 3.39Å; E249-R253 PolarHBondContact O-N 2.75Å; E249-V265 HydrophobicContact CG-CB 3.87Å; E249-V265 HydrophobicContact CG-CG1 3.65Å; E249-M267 VanDerWaalsContact CA-SD 3.56Å; E249-M267 HydrophobicContact CB-CE 3.97Å; E249-M267 HydrophobicContact CB-CG 4.28Å; E249-M267 HydrophobicContact CB-SD 3.88Å; E249-M267 HydrophobicContact CG-CG 4.36Å; E249-M267 PolarHBondContact N-SD 2.88Å
250	K	89	Confident	86.1	Confident	150 Å²	150	76.7 Å²	76.7	65%	0.652	38%	0.382	S	S	*	.	H	α-helix	trans	-63.4	-42.9	177.4	-63.9	179.8	-179.6	177.5	0	111.7	T248 R253 H254	T248-K250 PolarHBondContact O-N 2.84Å; K250-R253 PolarHBondContact O-N 3.2Å; K250-H254 WeakPolarHBondContact O-CB 3.42Å; K250-H254 PolarHBondContact O-CD2 3.29Å; K250-H254 PolarHBondContact O-N 2.77Å; K250-H254 PolarHBondContact O-ND1 3.17Å
251	D	89.8	Confident	86.3	Confident	36 Å²	36	78.4 Å²	78.4	19%	0.193	39%	0.387	C	S	.	.	H	α-helix	trans	-60.3	-48	176	-56.4	-66	0	0	0	110.6	I247 T248 H255 V297 K298	I247-D251 HydrophobicContact CG2-CB 4.32Å; T248-D251 WeakPolarHBondContact CA-OD2 3.01Å; T248-D251 WeakPolarHBondContact CB-OD2 3.5Å; T248-D251 PolarHBondContact N-OD2 2.93Å; T248-D251 WeakPolarHBondContact O-CB 3.18Å; T248-D251 PolarHBondContact O-N 3.36Å; T248-D251 VanDerWaalsContact OG1-CG 3.3Å; T248-D251 PolarHBondContact OG1-N 3.43Å; T248-D251 PolarHBondContact OG1-OD2 3.37Å; D251-H255 WeakPolarHBondContact O-CB 3.42Å; D251-H255 PolarHBondContact O-CD2 3.27Å; D251-H255 PolarHBondContact O-N 3.17Å; D251-V297 HydrophobicContact CB-CG1 4.3Å; D251-K298 WeakPolarHBondContact OD1-CE 3.36Å; D251-K298 IonicContact OD1-NZ 3.04Å; D251-K298 PolarHBondContact OD1-NZ 2.87Å; D251-K298 IonicContact OD2-NZ 2.75Å; D251-K298 PolarHBondContact OD2-NZ 2.78Å
252	I	89.9	Confident	86.8	Confident	4 Å²	4	79.3 Å²	79.3	2%	0.021	39%	0.391	C	S	.	.	H	α-helix	trans	-60.8	-51.6	178.4	-61.9	176.4	0	0	0	110.1	L241 I247 T248 E249 H254 H255 F256 V265 M267 A274 V276	L241-I252 HydrophobicContact CD1-CD1 4.01Å; L241-I252 HydrophobicContact CD2-CD1 3.77Å; L241-I252 HydrophobicContact CD2-CG1 4.44Å; I247-I252 HydrophobicContact CG2-CD1 4.16Å; I247-I252 HydrophobicContact CG2-CG1 3.83Å; T248-I252 PolarHBondContact O-N 3.23Å; E249-I252 PolarHBondContact O-N 3.44Å; I252-H254 PolarHBondContact O-N 3.1Å; I252-H255 PolarHBondContact O-N 3.44Å; I252-F256 HydrophobicContact CG2-CD2 3.7Å; I252-F256 HydrophobicContact CG2-CE2 3.96Å; I252-F256 WeakPolarHBondContact O-CD2 3.38Å; I252-F256 PolarHBondContact O-N 2.82Å; I252-V265 HydrophobicContact CG2-CG1 4.31Å; I252-M267 HydrophobicContact CD1-CG 4.35Å; I252-M267 HydrophobicContact CD1-SD 3.8Å; I252-A274 HydrophobicContact CD1-CB 3.92Å; I252-V276 HydrophobicContact CG2-CG2 3.73Å
253	R	91.3	Very high	87.4	Confident	133 Å²	133	85 Å²	85	50%	0.502	41%	0.405	S	S	.	.	H	α-helix	trans	-61.1	-43.1	-177.8	-171.4	173.3	178.9	166.5	-1.4	111.9	E249 K250 F256 Y257 I262 V265	E249-R253 WeakPolarHBondContact O-CB 3.39Å; E249-R253 PolarHBondContact O-N 2.75Å; K250-R253 PolarHBondContact O-N 3.2Å; R253-F256 PolarHBondContact O-N 3.23Å; R253-Y257 VanDerWaalsContact O-CB 3.31Å; R253-Y257 WeakPolarHBondContact O-CB 3.34Å; R253-Y257 PolarHBondContact O-N 2.84Å; R253-I262 HydrophobicContact CG-CD1 4.1Å; R253-V265 HydrophobicContact CB-CG2 4.48Å
254	H	90.8	Very high	88.1	Confident	138 Å²	138	79.9 Å²	79.9	64%	0.639	39%	0.386	S	S	*	.	H	α-helix	trans	-62.7	-42.6	174.7	-65.6	169.1	0	0	0	112	K250 I252	K250-H254 WeakPolarHBondContact O-CB 3.42Å; K250-H254 PolarHBondContact O-CD2 3.29Å; K250-H254 PolarHBondContact O-N 2.77Å; K250-H254 PolarHBondContact O-ND1 3.17Å; I252-H254 PolarHBondContact O-N 3.1Å
255	H	89.5	Confident	89	Confident	70 Å²	70	73.6 Å²	73.6	32%	0.324	36%	0.358	S	S	.	.	H	α-helix	trans	-69.1	-30.6	179.1	-80.4	-55.5	0	0	0	114.4	D251 I252 Q258 Y259	D251-H255 WeakPolarHBondContact O-CB 3.42Å; D251-H255 PolarHBondContact O-CD2 3.27Å; D251-H255 PolarHBondContact O-N 3.17Å; I252-H255 PolarHBondContact O-N 3.44Å; H255-Q258 WeakPolarHBondContact O-CG 3.41Å; H255-Q258 PolarHBondContact O-NE2 3.2Å; H255-Y259 WeakPolarHBondContact O-CE2 3.4Å
256	F	91.8	Very high	90	Very high	1 Å²	1	74.6 Å²	74.6	0%	0.004	35%	0.351	C	S	.	.	H	α-helix	trans	-91	-23.3	-179.6	-79.5	-72.9	0	0	0	114.2	V238 I252 R253 Q258 Y259 I262 V276 F278 A287 T291 L295 I304	V238-F256 HydrophobicContact CG2-CE2 3.79Å; V238-F256 HydrophobicContact CG2-CZ 3.75Å; I252-F256 HydrophobicContact CG2-CD2 3.7Å; I252-F256 HydrophobicContact CG2-CE2 3.96Å; I252-F256 WeakPolarHBondContact O-CD2 3.38Å; I252-F256 PolarHBondContact O-N 2.82Å; R253-F256 PolarHBondContact O-N 3.23Å; F256-Q258 PolarHBondContact O-N 3.17Å; F256-Y259 AromaticContact CD1-CD2 3.91Å; F256-Y259 HydrophobicContact CD1-CD2 3.91Å; F256-Y259 HydrophobicContact CD1-CE2 4.07Å; F256-Y259 WeakPolarHBondContact O-CD2 3.36Å; F256-Y259 PolarHBondContact O-N 3.17Å; F256-I262 HydrophobicContact CB-CD1 3.83Å; F256-V276 HydrophobicContact CB-CG1 4.33Å; F256-V276 HydrophobicContact CD2-CG2 4.1Å; F256-V276 HydrophobicContact CE2-CG2 4.32Å; F256-V276 HydrophobicContact CG-CG1 4.38Å; F256-F278 HydrophobicContact CB-CZ 3.99Å; F256-F278 HydrophobicContact CD1-CE2 4.37Å; F256-F278 AromaticContact CD1-CZ 3.87Å; F256-F278 HydrophobicContact CD1-CZ 3.87Å; F256-F278 HydrophobicContact CG-CZ 4.28Å; F256-A287 HydrophobicContact CD1-CB 4.1Å; F256-A287 HydrophobicContact CE1-CB 4.3Å; F256-T291 HydrophobicContact CE1-CG2 4.01Å; F256-T291 HydrophobicContact CZ-CG2 4.49Å; F256-L295 HydrophobicContact CE2-CD2 4.21Å; F256-L295 HydrophobicContact CZ-CD2 4.05Å; F256-I304 HydrophobicContact CZ-CD1 4.19Å
257	Y	91.9	Very high	90.4	Very high	171 Å²	171	74.2 Å²	74.2	67%	0.671	35%	0.35	S	S	*	.	H	α-helix	trans	-56.3	-32.7	179.9	-177.7	-102.1	0	0	0	113.8	R253 Y259 G260	R253-Y257 VanDerWaalsContact O-CB 3.31Å; R253-Y257 WeakPolarHBondContact O-CB 3.34Å; R253-Y257 PolarHBondContact O-N 2.84Å; Y257-Y259 PolarHBondContact O-N 3.36Å; Y257-Y259 VanDerWaalsContact O-N 3.09Å; Y257-G260 PolarHBondContact O-N 2.9Å
258	Q	92.1	Very high	90.6	Very high	130 Å²	130	76.6 Å²	76.6	61%	0.607	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-9	177.6	70.9	-174.8	-27.8	0	0	115.1	H255 F256	H255-Q258 WeakPolarHBondContact O-CG 3.41Å; H255-Q258 PolarHBondContact O-NE2 3.2Å; F256-Q258 PolarHBondContact O-N 3.17Å
259	Y	91.1	Very high	90.5	Very high	39 Å²	39	77.1 Å²	77.1	15%	0.153	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-14.2	177.6	-51.4	-57.2	0	0	0	113.3	H255 F256 Y257 A283 I286 A287 K290 T291	H255-Y259 WeakPolarHBondContact O-CE2 3.4Å; F256-Y259 AromaticContact CD1-CD2 3.91Å; F256-Y259 HydrophobicContact CD1-CD2 3.91Å; F256-Y259 HydrophobicContact CD1-CE2 4.07Å; F256-Y259 WeakPolarHBondContact O-CD2 3.36Å; F256-Y259 PolarHBondContact O-N 3.17Å; Y257-Y259 PolarHBondContact O-N 3.36Å; Y257-Y259 VanDerWaalsContact O-N 3.09Å; Y259-A283 WeakPolarHBondContact O-CA 3.06Å; Y259-A283 WeakPolarHBondContact O-CB 3.25Å; Y259-I286 HydrophobicContact CD1-CG2 4.18Å; Y259-A287 HydrophobicContact CD2-CB 3.55Å; Y259-A287 HydrophobicContact CE2-CB 4.31Å; Y259-A287 HydrophobicContact CG-CB 3.8Å; Y259-K290 HydrophobicContact CD1-CD 3.94Å; Y259-K290 HydrophobicContact CE1-CB 3.84Å; Y259-K290 HydrophobicContact CE1-CD 3.6Å; Y259-K290 HydrophobicContact CE1-CG 4.36Å; Y259-T291 HydrophobicContact CE2-CG2 3.51Å; Y259-T291 WeakPolarHBondContact OH-CG2 3.47Å
260	G	91.1	Very high	90.3	Very high	25 Å²	25	78.2 Å²	78.2	26%	0.258	38%	0.383	S	S	.	.	S	Bend	trans	147.2	178.2	-179.4	0	0	0	0	0	112.7	Y257	Y257-G260 PolarHBondContact O-N 2.9Å
261	E	93.1	Very high	90.1	Very high	126 Å²	126	78.4 Å²	78.4	59%	0.589	38%	0.384	S	S	*	.			trans	-72.5	138.7	-174.9	-51.8	167.1	149.1	0	0	112.2	F278 T279	E261-F278 WeakPolarHBondContact O-CA 3.21Å; E261-F278 WeakPolarHBondContact O-CD1 3.48Å; E261-T279 HydrophobicContact CB-CG2 3.7Å; E261-T279 PolarHBondContact O-N 2.86Å; E261-T279 PolarHBondContact OE2-OG1 3.16Å; E261-T279 VanDerWaalsContact OE2-OG1 3.05Å
262	I	93.1	Very high	90	Very high	29 Å²	29	77.2 Å²	77.2	15%	0.149	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	121.3	-177.9	-59.1	165.8	0	0	0	108.5	R253 F256 S264 V265 V276 Q277 F278	R253-I262 HydrophobicContact CG-CD1 4.1Å; F256-I262 HydrophobicContact CB-CD1 3.83Å; I262-S264 WeakPolarHBondContact CG2-O 3.28Å; I262-V265 HydrophobicContact CG2-CG2 3.73Å; I262-V276 HydrophobicContact CD1-CG1 4.35Å; I262-V276 HydrophobicContact CG1-CG1 4.22Å; I262-V276 HydrophobicContact CG2-CG1 3.91Å; I262-Q277 CarbonylContact C-O 3.53Å; I262-Q277 WeakPolarHBondContact CA-O 3.38Å; I262-F278 HydrophobicContact CG1-CD1 4.28Å; I262-F278 HydrophobicContact CG1-CE1 3.97Å
263	R	92.1	Very high	90	Very high	146 Å²	146	77.5 Å²	77.5	55%	0.551	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.7	-45.8	172.5	-71.1	-176.5	-179.6	161.2	10.6	111.6	Q277 T279	R263-Q277 HydrophobicContact CB-CB 4.36Å; R263-Q277 HydrophobicContact CB-CG 4.34Å; R263-Q277 PolarHBondContact N-O 3.37Å; R263-T279 HydrophobicContact CG-CG2 3.69Å; R263-T279 PolarHBondContact NH2-O 3.32Å
264	S	91.7	Very high	90	Very high	45 Å²	45	71.2 Å²	71.2	32%	0.315	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	151.1	-176.8	60.7	0	0	0	0	111.7	I262 Q277	I262-S264 WeakPolarHBondContact CG2-O 3.28Å; S264-Q277 PolarHBondContact N-O 2.87Å; S264-Q277 PolarHBondContact O-N 3.13Å; S264-Q277 WeakPolarHBondContact OG-CB 3.47Å; S264-Q277 PolarHBondContact OG-OE1 3.12Å
265	V	91.8	Very high	90	Very high	22 Å²	22	67.4 Å²	67.4	13%	0.133	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	127.2	165.3	-175.3	0	0	0	0	106.9	E249 I252 R253 I262 M267 F275 V276	E249-V265 HydrophobicContact CG-CB 3.87Å; E249-V265 HydrophobicContact CG-CG1 3.65Å; I252-V265 HydrophobicContact CG2-CG1 4.31Å; R253-V265 HydrophobicContact CB-CG2 4.48Å; I262-V265 HydrophobicContact CG2-CG2 3.73Å; V265-M267 HydrophobicContact CG1-CG 4.44Å; V265-F275 WeakPolarHBondContact CA-O 3.33Å; V265-V276 HydrophobicContact CG1-CG2 4.28Å; V265-V276 HydrophobicContact CG2-CG1 4.5Å; V265-V276 HydrophobicContact CG2-CG2 4.45Å
266	V	91.2	Very high	90.2	Very high	84 Å²	84	64.1 Å²	64.1	51%	0.509	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	108	176	-179.3	0	0	0	0	107.8	A274 F275	V266-A274 CarbonylContact O-C 3.56Å; V266-A274 VanDerWaalsContact O-CA 3.26Å; V266-A274 WeakPolarHBondContact O-CA 3.38Å; V266-F275 PolarHBondContact N-O 3.03Å; V266-F275 PolarHBondContact O-N 3.32Å
267	M	88.3	Confident	90.3	Very high	69 Å²	69	66.9 Å²	66.9	34%	0.34	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	141.4	171.7	-57.3	-157.1	-52.5	0	0	110.5	E249 I252 V265 A274	E249-M267 VanDerWaalsContact CA-SD 3.56Å; E249-M267 HydrophobicContact CB-CE 3.97Å; E249-M267 HydrophobicContact CB-CG 4.28Å; E249-M267 HydrophobicContact CB-SD 3.88Å; E249-M267 HydrophobicContact CG-CG 4.36Å; E249-M267 PolarHBondContact N-SD 2.88Å; I252-M267 HydrophobicContact CD1-CG 4.35Å; I252-M267 HydrophobicContact CD1-SD 3.8Å; V265-M267 HydrophobicContact CG1-CG 4.44Å; M267-A274 HydrophobicContact CB-CB 4.47Å; M267-A274 HydrophobicContact CG-CB 4.07Å
268	L	88.8	Confident	90.4	Very high	62 Å²	62	58.7 Å²	58.7	33%	0.325	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	83.1	174.7	-172.8	64.3	0	0	0	108.2	S270 K271 G272 C273	L268-S270 VanDerWaalsContact C-N 3.28Å; L268-S270 PolarHBondContact O-N 3.44Å; L268-K271 HydrophobicContact CD2-CB 4.39Å; L268-K271 HydrophobicContact CD2-CD 3.78Å; L268-K271 HydrophobicContact CD2-CG 4.01Å; L268-K271 HydrophobicContact CG-CG 4.35Å; L268-K271 PolarHBondContact O-N 3.15Å; L268-K271 VanDerWaalsContact O-N 3.09Å; L268-G272 PolarHBondContact O-N 3.02Å; L268-C273 CarbonylContact C-O 3.52Å; L268-C273 PolarHBondContact N-O 2.94Å; L268-C273 PolarHBondContact O-N 3.48Å
269	P	84.4	Confident	90.4	Very high	64 Å²	64	54.9 Å²	54.9	42%	0.416	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-63.2	-33.9	-169.7	23.6	-33.4	0	0	0	112.9	E244 K271 G272	E244-P269 HydrophobicContact CG-CB 3.64Å; E244-P269 HydrophobicContact CG-CG 4.48Å; E244-P269 VanDerWaalsContact OE1-CB 3.3Å; E244-P269 WeakPolarHBondContact OE1-CB 3.49Å; E244-P269 WeakPolarHBondContact OE1-CG 3.08Å; P269-K271 PolarHBondContact O-N 2.62Å; P269-G272 PolarHBondContact O-N 3.43Å
270	S	83.9	Confident	90.4	Very high	99 Å²	99	55.1 Å²	55.1	69%	0.692	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-58.3	-10.6	174.6	59	0	0	0	0	115.3	L268	L268-S270 VanDerWaalsContact C-N 3.28Å; L268-S270 PolarHBondContact O-N 3.44Å
271	K	84.9	Confident	90.3	Very high	153 Å²	153	56.8 Å²	56.8	67%	0.665	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-122	3.7	171.6	-56.8	-168.7	-175.6	178.9	0	113.3	L268 P269 C273	L268-K271 HydrophobicContact CD2-CB 4.39Å; L268-K271 HydrophobicContact CD2-CD 3.78Å; L268-K271 HydrophobicContact CD2-CG 4.01Å; L268-K271 HydrophobicContact CG-CG 4.35Å; L268-K271 PolarHBondContact O-N 3.15Å; L268-K271 VanDerWaalsContact O-N 3.09Å; P269-K271 PolarHBondContact O-N 2.62Å; K271-C273 HydrophobicContact CB-CB 4.25Å; K271-C273 PolarHBondContact O-N 2.85Å; K271-C273 PolarHBondContact O-SG 3.39Å
272	G	86.6	Confident	90.2	Very high	12 Å²	12	57.3 Å²	57.3	12%	0.124	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.2	34.2	-172.7	0	0	0	0	0	113.2	N240 L241 L268 P269	N240-G272 PolarHBondContact N-O 3.35Å; N240-G272 VanDerWaalsContact N-O 3.08Å; L241-G272 PolarHBondContact N-O 2.97Å; L268-G272 PolarHBondContact O-N 3.02Å; P269-G272 PolarHBondContact O-N 3.43Å
273	C	90.1	Very high	90.1	Very high	10 Å²	10	56.4 Å²	56.4	7%	0.068	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	153	-170.5	-68	0	0	0	0	112.5	Y237 V238 L241 L268 K271	Y237-C273 HydrophobicContact CE2-CB 4.08Å; Y237-C273 VanDerWaalsContact CE2-SG 3.57Å; Y237-C273 PolarHBondContact OH-SG 3.45Å; V238-C273 CarbonylContact O-C 3.54Å; V238-C273 WeakPolarHBondContact O-CA 3.47Å; L241-C273 VanDerWaalsContact CD1-C 3.45Å; L268-C273 CarbonylContact C-O 3.52Å; L268-C273 PolarHBondContact N-O 2.94Å; L268-C273 PolarHBondContact O-N 3.48Å; K271-C273 HydrophobicContact CB-CB 4.25Å; K271-C273 PolarHBondContact O-N 2.85Å; K271-C273 PolarHBondContact O-SG 3.39Å
274	A	91.2	Very high	90.1	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	156.8	162.8	0	0	0	0	0	111.8	V238 L241 I252 V266 M267	V238-A274 PolarHBondContact N-O 3.19Å; V238-A274 PolarHBondContact O-N 3.46Å; L241-A274 HydrophobicContact CD1-CB 3.8Å; I252-A274 HydrophobicContact CD1-CB 3.92Å; V266-A274 CarbonylContact O-C 3.56Å; V266-A274 VanDerWaalsContact O-CA 3.26Å; V266-A274 WeakPolarHBondContact O-CA 3.38Å; M267-A274 HydrophobicContact CB-CB 4.47Å; M267-A274 HydrophobicContact CG-CB 4.07Å
275	F	92.6	Very high	90	Very high	59 Å²	59	49.6 Å²	49.6	26%	0.259	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	126.4	172.3	-60.5	-89.4	0	0	0	108.6	T235 V236 Y237 V265 V266	T235-F275 HydrophobicContact CG2-CB 4.11Å; T235-F275 HydrophobicContact CG2-CD1 4.18Å; V236-F275 WeakPolarHBondContact O-CA 3.29Å; Y237-F275 HydrophobicContact CD2-CD1 4.41Å; Y237-F275 AromaticContact CD2-CE1 3.77Å; Y237-F275 HydrophobicContact CD2-CE1 3.77Å; Y237-F275 AromaticContact CD2-CZ 4Å; Y237-F275 HydrophobicContact CD2-CZ 4Å; V265-F275 WeakPolarHBondContact CA-O 3.33Å; V266-F275 PolarHBondContact N-O 3.03Å; V266-F275 PolarHBondContact O-N 3.32Å
276	V	93	Very high	89.9	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	117.8	178	-179.5	0	0	0	0	107.8	T235 V236 V238 I252 F256 I262 V265 F278	T235-V276 CarbonylContact C-O 3.58Å; T235-V276 WeakPolarHBondContact CA-O 3.33Å; V236-V276 PolarHBondContact N-O 3.31Å; V236-V276 PolarHBondContact O-N 3.46Å; V238-V276 HydrophobicContact CG2-CG2 4.35Å; I252-V276 HydrophobicContact CG2-CG2 3.73Å; F256-V276 HydrophobicContact CB-CG1 4.33Å; F256-V276 HydrophobicContact CD2-CG2 4.1Å; F256-V276 HydrophobicContact CE2-CG2 4.32Å; F256-V276 HydrophobicContact CG-CG1 4.38Å; I262-V276 HydrophobicContact CD1-CG1 4.35Å; I262-V276 HydrophobicContact CG1-CG1 4.22Å; I262-V276 HydrophobicContact CG2-CG1 3.91Å; V265-V276 HydrophobicContact CG1-CG2 4.28Å; V265-V276 HydrophobicContact CG2-CG1 4.5Å; V265-V276 HydrophobicContact CG2-CG2 4.45Å; V276-F278 HydrophobicContact CG1-CD2 4.44Å; V276-F278 HydrophobicContact CG1-CE2 3.89Å; V276-F278 HydrophobicContact CG1-CZ 4.12Å
277	Q	92.6	Very high	89.8	Confident	59 Å²	59	48 Å²	48	28%	0.276	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	125.6	178.3	-168.7	-175.6	24.9	0	0	110.6	T234 I262 R263 S264	T234-Q277 WeakPolarHBondContact OG1-CG 3.34Å; I262-Q277 CarbonylContact C-O 3.53Å; I262-Q277 WeakPolarHBondContact CA-O 3.38Å; R263-Q277 HydrophobicContact CB-CB 4.36Å; R263-Q277 HydrophobicContact CB-CG 4.34Å; R263-Q277 PolarHBondContact N-O 3.37Å; S264-Q277 PolarHBondContact N-O 2.87Å; S264-Q277 PolarHBondContact O-N 3.13Å; S264-Q277 WeakPolarHBondContact OG-CB 3.47Å; S264-Q277 PolarHBondContact OG-OE1 3.12Å
278	F	94	Very high	89.8	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	160.7	176.9	-72.4	-87.4	0	0	0	113.3	T234 V236 F256 E261 I262 V276 S280 A283 A284 A287	T234-F278 VanDerWaalsContact CB-O 3.27Å; T234-F278 WeakPolarHBondContact CB-O 3.49Å; T234-F278 PolarHBondContact O-N 3.36Å; T234-F278 PolarHBondContact OG1-O 3.32Å; V236-F278 HydrophobicContact CG2-CD2 4.09Å; V236-F278 HydrophobicContact CG2-CE2 3.83Å; F256-F278 HydrophobicContact CB-CZ 3.99Å; F256-F278 HydrophobicContact CD1-CE2 4.37Å; F256-F278 AromaticContact CD1-CZ 3.87Å; F256-F278 HydrophobicContact CD1-CZ 3.87Å; F256-F278 HydrophobicContact CG-CZ 4.28Å; E261-F278 WeakPolarHBondContact O-CA 3.21Å; E261-F278 WeakPolarHBondContact O-CD1 3.48Å; I262-F278 HydrophobicContact CG1-CD1 4.28Å; I262-F278 HydrophobicContact CG1-CE1 3.97Å; V276-F278 HydrophobicContact CG1-CD2 4.44Å; V276-F278 HydrophobicContact CG1-CE2 3.89Å; V276-F278 HydrophobicContact CG1-CZ 4.12Å; F278-S280 WeakPolarHBondContact CB-O 3.39Å; F278-A283 HydrophobicContact CB-CB 4.3Å; F278-A283 HydrophobicContact CD1-CB 3.84Å; F278-A283 HydrophobicContact CG-CB 4.23Å; F278-A284 HydrophobicContact CB-CB 4.2Å; F278-A284 HydrophobicContact CD2-CB 3.74Å; F278-A284 HydrophobicContact CG-CB 4.21Å; F278-A287 HydrophobicContact CE2-CB 3.9Å; F278-A287 HydrophobicContact CZ-CB 3.71Å
279	T	92.3	Very high	89.7	Confident	49 Å²	49	46.1 Å²	46.1	30%	0.301	25%	0.245	S	C	.	.	S	Bend	trans	-72.6	-37.5	171	61.3	0	0	0	0	112.5	E261 R263	E261-T279 HydrophobicContact CB-CG2 3.7Å; E261-T279 PolarHBondContact O-N 2.86Å; E261-T279 PolarHBondContact OE2-OG1 3.16Å; E261-T279 VanDerWaalsContact OE2-OG1 3.05Å; R263-T279 HydrophobicContact CG-CG2 3.69Å; R263-T279 PolarHBondContact NH2-O 3.32Å
280	S	91.2	Very high	89.8	Confident	44 Å²	44	48.5 Å²	48.5	31%	0.308	25%	0.249	S	C	.	.	S	Bend	trans	-112.6	149	-179.7	176	0	0	0	0	112.4	F278 E282 A284	F278-S280 WeakPolarHBondContact CB-O 3.39Å; S280-E282 PolarHBondContact OG-N 3.31Å; S280-A284 PolarHBondContact O-N 2.83Å
281	R	89.3	Confident	89.9	Confident	60 Å²	60	43.9 Å²	43.9	23%	0.226	22%	0.216	C	C	.	.	H	α-helix	trans	-64	-43.9	169.3	176.6	-177.3	170.8	124	8	111.2	P228 A283 A284 E285	P228-R281 PolarHBondContact O-NH1 3.16Å; P228-R281 PolarHBondContact O-NH2 3.49Å; R281-A283 VanDerWaalsContact C-N 3.3Å; R281-A283 PolarHBondContact O-N 3.5Å; R281-A284 WeakPolarHBondContact O-CA 3.32Å; R281-A284 WeakPolarHBondContact O-CB 3.44Å; R281-A284 PolarHBondContact O-N 3.04Å; R281-E285 HydrophobicContact CG-CG 4.22Å; R281-E285 IonicContact CZ-OE1 3.26Å; R281-E285 VanDerWaalsContact NE-CD 3.28Å; R281-E285 IonicContact NE-OE1 2.93Å; R281-E285 PolarHBondContact NE-OE1 3.38Å; R281-E285 IonicContact NE-OE2 2.68Å; R281-E285 PolarHBondContact NE-OE2 3.47Å; R281-E285 IonicContact NH2-OE1 3.49Å; R281-E285 PolarHBondContact NH2-OE1 3.49Å; R281-E285 PolarHBondContact O-N 3.27Å
282	E	91	Very high	89.9	Confident	138 Å²	138	37.9 Å²	37.9	65%	0.645	19%	0.19	S	C	*	.	H	α-helix	trans	-61.3	-41.1	-176.1	-61.2	171.9	174.9	0	0	111	S280 A284 E285 I286	S280-E282 PolarHBondContact OG-N 3.31Å; E282-A284 VanDerWaalsContact C-N 3.34Å; E282-A284 PolarHBondContact O-N 3.33Å; E282-E285 PolarHBondContact O-N 3.27Å; E282-I286 VanDerWaalsContact O-CB 3.3Å; E282-I286 WeakPolarHBondContact O-CB 3.31Å; E282-I286 WeakPolarHBondContact O-CD1 3.32Å; E282-I286 WeakPolarHBondContact O-CG1 3.49Å; E282-I286 PolarHBondContact O-N 2.91Å
283	A	92	Very high	89.5	Confident	9 Å²	9	38.4 Å²	38.4	7%	0.074	20%	0.195	C	C	.	.	H	α-helix	trans	-60.1	-42.2	173.2	0	0	0	0	0	112.1	Y259 F278 R281 A287	Y259-A283 WeakPolarHBondContact O-CA 3.06Å; Y259-A283 WeakPolarHBondContact O-CB 3.25Å; F278-A283 HydrophobicContact CB-CB 4.3Å; F278-A283 HydrophobicContact CD1-CB 3.84Å; F278-A283 HydrophobicContact CG-CB 4.23Å; R281-A283 VanDerWaalsContact C-N 3.3Å; R281-A283 PolarHBondContact O-N 3.5Å; A283-A287 WeakPolarHBondContact O-CB 3.26Å; A283-A287 PolarHBondContact O-N 3.02Å
284	A	90.4	Very high	88.9	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-68.5	-37.8	177	0	0	0	0	0	112.5	V236 F278 S280 R281 E282 C288 W306	V236-A284 HydrophobicContact CG2-CB 4.21Å; F278-A284 HydrophobicContact CB-CB 4.2Å; F278-A284 HydrophobicContact CD2-CB 3.74Å; F278-A284 HydrophobicContact CG-CB 4.21Å; S280-A284 PolarHBondContact O-N 2.83Å; R281-A284 WeakPolarHBondContact O-CA 3.32Å; R281-A284 WeakPolarHBondContact O-CB 3.44Å; R281-A284 PolarHBondContact O-N 3.04Å; E282-A284 VanDerWaalsContact C-N 3.34Å; E282-A284 PolarHBondContact O-N 3.33Å; A284-C288 VanDerWaalsContact O-CB 3.29Å; A284-C288 WeakPolarHBondContact O-CB 3.19Å; A284-C288 PolarHBondContact O-N 3.13Å; A284-C288 PolarHBondContact O-SG 3.43Å; A284-W306 HydrophobicContact CB-CH2 4Å; A284-W306 HydrophobicContact CB-CZ3 3.81Å; A284-W306 WeakPolarHBondContact O-CH2 3.36Å
285	E	90	Very high	88.5	Confident	48 Å²	48	43.9 Å²	43.9	22%	0.224	22%	0.219	C	C	.	.	H	α-helix	trans	-67.7	-48.8	177.1	-71.8	179.3	139.4	0	0	110.8	P227 R281 E282 A287 C288 D289 W306	P227-E285 VanDerWaalsContact CB-OE1 3.26Å; P227-E285 WeakPolarHBondContact CB-OE1 3.41Å; R281-E285 HydrophobicContact CG-CG 4.22Å; R281-E285 IonicContact CZ-OE1 3.26Å; R281-E285 VanDerWaalsContact NE-CD 3.28Å; R281-E285 IonicContact NE-OE1 2.93Å; R281-E285 PolarHBondContact NE-OE1 3.38Å; R281-E285 IonicContact NE-OE2 2.68Å; R281-E285 PolarHBondContact NE-OE2 3.47Å; R281-E285 IonicContact NH2-OE1 3.49Å; R281-E285 PolarHBondContact NH2-OE1 3.49Å; R281-E285 PolarHBondContact O-N 3.27Å; E282-E285 PolarHBondContact O-N 3.27Å; E285-A287 VanDerWaalsContact C-N 3.3Å; E285-A287 PolarHBondContact O-N 3.05Å; E285-C288 PolarHBondContact O-N 3.38Å; E285-D289 PolarHBondContact O-N 3.34Å; E285-W306 HydrophobicContact CB-CH2 4.23Å; E285-W306 HydrophobicContact CB-CZ2 4.41Å; E285-W306 HydrophobicContact CG-CH2 3.54Å; E285-W306 HydrophobicContact CG-CZ2 3.79Å
286	I	89.5	Confident	88.2	Confident	74 Å²	74	46 Å²	46	38%	0.379	23%	0.232	S	C	.	.	H	α-helix	trans	-60.1	-39.4	175.1	-69	167.4	0	0	0	111.4	Y259 E282 K290	Y259-I286 HydrophobicContact CD1-CG2 4.18Å; E282-I286 VanDerWaalsContact O-CB 3.3Å; E282-I286 WeakPolarHBondContact O-CB 3.31Å; E282-I286 WeakPolarHBondContact O-CD1 3.32Å; E282-I286 WeakPolarHBondContact O-CG1 3.49Å; E282-I286 PolarHBondContact O-N 2.91Å; I286-K290 HydrophobicContact CG2-CD 3.76Å; I286-K290 VanDerWaalsContact O-CB 3.3Å; I286-K290 WeakPolarHBondContact O-CB 3.45Å; I286-K290 VanDerWaalsContact O-CG 3.29Å; I286-K290 WeakPolarHBondContact O-CG 3.4Å; I286-K290 PolarHBondContact O-N 3.47Å; I286-K290 VanDerWaalsContact O-N 3.16Å
287	A	90.2	Very high	87.8	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-64.5	-51.8	174.4	0	0	0	0	0	111.4	F256 Y259 F278 A283 E285 D289 T291	F256-A287 HydrophobicContact CD1-CB 4.1Å; F256-A287 HydrophobicContact CE1-CB 4.3Å; Y259-A287 HydrophobicContact CD2-CB 3.55Å; Y259-A287 HydrophobicContact CE2-CB 4.31Å; Y259-A287 HydrophobicContact CG-CB 3.8Å; F278-A287 HydrophobicContact CE2-CB 3.9Å; F278-A287 HydrophobicContact CZ-CB 3.71Å; A283-A287 WeakPolarHBondContact O-CB 3.26Å; A283-A287 PolarHBondContact O-N 3.02Å; E285-A287 VanDerWaalsContact C-N 3.3Å; E285-A287 PolarHBondContact O-N 3.05Å; A287-D289 PolarHBondContact O-N 3.24Å; A287-T291 VanDerWaalsContact O-CB 3.3Å; A287-T291 WeakPolarHBondContact O-CB 3.44Å; A287-T291 VanDerWaalsContact O-CG2 3.26Å; A287-T291 WeakPolarHBondContact O-CG2 3.33Å; A287-T291 PolarHBondContact O-N 3.01Å; A287-T291 PolarHBondContact O-OG1 3.03Å
288	C	88.6	Confident	87.4	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-53.8	-54.1	177.8	-86.8	0	0	0	0	111.6	L225 A284 E285 T291 F292 W306	L225-C288 HydrophobicContact CD1-CB 3.86Å; A284-C288 VanDerWaalsContact O-CB 3.29Å; A284-C288 WeakPolarHBondContact O-CB 3.19Å; A284-C288 PolarHBondContact O-N 3.13Å; A284-C288 PolarHBondContact O-SG 3.43Å; E285-C288 PolarHBondContact O-N 3.38Å; C288-T291 PolarHBondContact O-N 3.2Å; C288-T291 PolarHBondContact O-OG1 3.08Å; C288-F292 WeakPolarHBondContact O-CB 3.38Å; C288-F292 PolarHBondContact O-N 3.38Å; C288-W306 HydrophobicContact CB-CH2 4.19Å; C288-W306 HydrophobicContact CB-CZ2 3.67Å; C288-W306 VanDerWaalsContact SG-CE2 3.56Å; C288-W306 VanDerWaalsContact SG-CZ2 3.56Å
289	D	86.3	Confident	86.8	Confident	90 Å²	90	52.4 Å²	52.4	48%	0.481	28%	0.279	S	S	.	.	H	α-helix	trans	-65.1	-44.7	-175.4	-74.4	-15.7	0	0	0	112.5	E285 A287 T291	E285-D289 PolarHBondContact O-N 3.34Å; A287-D289 PolarHBondContact O-N 3.24Å; D289-T291 VanDerWaalsContact C-N 3.31Å; D289-T291 PolarHBondContact O-N 2.9Å
290	K	85.4	Confident	86.5	Confident	115 Å²	115	53.7 Å²	53.7	50%	0.5	28%	0.278	S	S	.	.	H	α-helix	trans	-70.3	-25.7	-178.9	-70.7	176.1	179.8	170.3	0	113.4	Y259 I286 K294	Y259-K290 HydrophobicContact CD1-CD 3.94Å; Y259-K290 HydrophobicContact CE1-CB 3.84Å; Y259-K290 HydrophobicContact CE1-CD 3.6Å; Y259-K290 HydrophobicContact CE1-CG 4.36Å; I286-K290 HydrophobicContact CG2-CD 3.76Å; I286-K290 VanDerWaalsContact O-CB 3.3Å; I286-K290 WeakPolarHBondContact O-CB 3.45Å; I286-K290 VanDerWaalsContact O-CG 3.29Å; I286-K290 WeakPolarHBondContact O-CG 3.4Å; I286-K290 PolarHBondContact O-N 3.47Å; I286-K290 VanDerWaalsContact O-N 3.16Å; K290-K294 WeakPolarHBondContact O-CD 3.13Å
291	T	85.9	Confident	86.3	Confident	2 Å²	2	58.8 Å²	58.8	1%	0.012	29%	0.291	C	S	.	.	H	α-helix	trans	-99.5	-23.9	-177.1	61.6	0	0	0	0	113.8	F256 Y259 A287 C288 D289 G293 K294 L295 I304	F256-T291 HydrophobicContact CE1-CG2 4.01Å; F256-T291 HydrophobicContact CZ-CG2 4.49Å; Y259-T291 HydrophobicContact CE2-CG2 3.51Å; Y259-T291 WeakPolarHBondContact OH-CG2 3.47Å; A287-T291 VanDerWaalsContact O-CB 3.3Å; A287-T291 WeakPolarHBondContact O-CB 3.44Å; A287-T291 VanDerWaalsContact O-CG2 3.26Å; A287-T291 WeakPolarHBondContact O-CG2 3.33Å; A287-T291 PolarHBondContact O-N 3.01Å; A287-T291 PolarHBondContact O-OG1 3.03Å; C288-T291 PolarHBondContact O-N 3.2Å; C288-T291 PolarHBondContact O-OG1 3.08Å; D289-T291 VanDerWaalsContact C-N 3.31Å; D289-T291 PolarHBondContact O-N 2.9Å; T291-G293 PolarHBondContact O-N 2.91Å; T291-K294 PolarHBondContact O-N 2.93Å; T291-L295 HydrophobicContact CG2-CD2 4.31Å; T291-L295 PolarHBondContact O-N 2.68Å; T291-I304 HydrophobicContact CG2-CD1 4.41Å; T291-I304 WeakPolarHBondContact OG1-CD1 3.26Å
292	F	85.4	Confident	86.3	Confident	26 Å²	26	56.1 Å²	56.1	11%	0.114	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	110.5	-169.9	179	-108.7	0	0	0	113.8	R151 P223 L225 C288 K294 I304	R151-F292 PolarHBondContact NH2-O 2.65Å; P223-F292 HydrophobicContact CB-CE1 3.99Å; P223-F292 HydrophobicContact CB-CZ 4.15Å; P223-F292 HydrophobicContact CG-CE1 4.19Å; P223-F292 WeakPolarHBondContact O-CE1 3.37Å; L225-F292 HydrophobicContact CD1-CB 3.84Å; L225-F292 HydrophobicContact CD1-CD2 3.6Å; L225-F292 HydrophobicContact CD1-CE2 4.36Å; L225-F292 HydrophobicContact CD1-CG 3.81Å; L225-F292 HydrophobicContact CD2-CD2 3.76Å; L225-F292 HydrophobicContact CD2-CE2 3.65Å; L225-F292 HydrophobicContact CD2-CG 4.37Å; L225-F292 HydrophobicContact CD2-CZ 4.19Å; L225-F292 HydrophobicContact CG-CB 4.17Å; L225-F292 HydrophobicContact CG-CD1 4.16Å; L225-F292 HydrophobicContact CG-CD2 3.52Å; L225-F292 HydrophobicContact CG-CE1 4.48Å; L225-F292 HydrophobicContact CG-CE2 3.89Å; L225-F292 HydrophobicContact CG-CG 3.67Å; L225-F292 HydrophobicContact CG-CZ 4.35Å; C288-F292 WeakPolarHBondContact O-CB 3.38Å; C288-F292 PolarHBondContact O-N 3.38Å; F292-K294 PolarHBondContact O-N 3.46Å; F292-I304 VanDerWaalsContact CD2-O 3.26Å; F292-I304 WeakPolarHBondContact CD2-O 3.43Å; F292-I304 WeakPolarHBondContact CE2-O 3.37Å
293	G	78	Confident	86.2	Confident	23 Å²	23	52.9 Å²	52.9	24%	0.237	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.5	-4.3	-178	0	0	0	0	0	114.5	T291 R301	T291-G293 PolarHBondContact O-N 2.91Å; G293-R301 VanDerWaalsContact O-CZ 3.29Å; G293-R301 PolarHBondContact O-NE 3.01Å; G293-R301 PolarHBondContact O-NH2 2.67Å
294	K	78.8	Confident	86.2	Confident	105 Å²	105	52.5 Å²	52.5	46%	0.457	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-40	176.5	-93.4	174.3	154.7	170.4	0	113.2	E147 K290 T291 F292 I296	E147-K294 WeakPolarHBondContact OE1-CD 3.46Å; E147-K294 WeakPolarHBondContact OE1-CE 3.2Å; E147-K294 WeakPolarHBondContact OE1-CG 3.13Å; E147-K294 IonicContact OE1-NZ 2.68Å; E147-K294 VanDerWaalsContact OE2-CE 3.22Å; E147-K294 WeakPolarHBondContact OE2-CE 3.26Å; E147-K294 IonicContact OE2-NZ 3.13Å; E147-K294 PolarHBondContact OE2-NZ 3.1Å; K290-K294 WeakPolarHBondContact O-CD 3.13Å; T291-K294 PolarHBondContact O-N 2.93Å; F292-K294 PolarHBondContact O-N 3.46Å; K294-I296 PolarHBondContact O-N 3.41Å; K294-I296 VanDerWaalsContact O-N 3.13Å
295	L	82.7	Confident	86.1	Confident	21 Å²	21	59.3 Å²	59.3	11%	0.11	29%	0.293	C	S	.	.			trans	-65.4	115.6	-165.3	-174.4	59.5	0	0	0	111.5	F256 T291 V297 R301 L302 I304	F256-L295 HydrophobicContact CE2-CD2 4.21Å; F256-L295 HydrophobicContact CZ-CD2 4.05Å; T291-L295 HydrophobicContact CG2-CD2 4.31Å; T291-L295 PolarHBondContact O-N 2.68Å; L295-V297 HydrophobicContact CD1-CG2 3.84Å; L295-V297 HydrophobicContact CD2-CG2 4.31Å; L295-V297 HydrophobicContact CG-CG2 3.91Å; L295-R301 WeakPolarHBondContact O-CA 3.44Å; L295-L302 HydrophobicContact CD2-CB 4.43Å; L295-L302 HydrophobicContact CD2-CD1 3.91Å; L295-L302 HydrophobicContact CG-CB 4.47Å; L295-L302 HydrophobicContact CG-CD1 4.24Å; L295-L302 PolarHBondContact O-N 2.89Å; L295-I304 HydrophobicContact CB-CD1 3.98Å; L295-I304 HydrophobicContact CD2-CD1 3.8Å
296	I	85.7	Confident	86.1	Confident	102 Å²	102	58.8 Å²	58.8	52%	0.523	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	115.4	172.9	-64.1	169.7	0	0	0	106.8	K294 R300 R301	K294-I296 PolarHBondContact O-N 3.41Å; K294-I296 VanDerWaalsContact O-N 3.13Å; I296-R300 CarbonylContact C-O 3.49Å; I296-R300 VanDerWaalsContact CA-O 3.28Å; I296-R300 WeakPolarHBondContact CA-O 3.47Å; I296-R301 HydrophobicContact CG1-CB 4.12Å; I296-R301 HydrophobicContact CG1-CG 4.2Å
297	V	84.8	Confident	85.7	Confident	5 Å²	5	55.5 Å²	55.5	3%	0.03	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	127.8	178.2	-179	0	0	0	0	107.4	I247 D251 L295 G299 R300 L302	I247-V297 HydrophobicContact CD1-CB 4.07Å; I247-V297 HydrophobicContact CD1-CG1 4.18Å; I247-V297 HydrophobicContact CG1-CG1 4.28Å; I247-V297 HydrophobicContact CG2-CG1 4.34Å; D251-V297 HydrophobicContact CB-CG1 4.3Å; L295-V297 HydrophobicContact CD1-CG2 3.84Å; L295-V297 HydrophobicContact CD2-CG2 4.31Å; L295-V297 HydrophobicContact CG-CG2 3.91Å; V297-G299 PolarHBondContact O-N 2.94Å; V297-R300 PolarHBondContact N-O 2.86Å; V297-R300 PolarHBondContact O-N 3.14Å; V297-L302 HydrophobicContact CB-CD1 4.18Å; V297-L302 HydrophobicContact CG2-CD1 3.72Å; V297-L302 HydrophobicContact CG2-CG 4.41Å
298	K	84.4	Confident	85.3	Confident	121 Å²	121	66.3 Å²	66.3	53%	0.526	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.3	33.8	-178.2	-67	169.7	169.8	171.9	0	113.8	E246 I247 D251 R300	E246-K298 WeakPolarHBondContact O-CD 3.42Å; E246-K298 WeakPolarHBondContact O-CE 3.49Å; E246-K298 PolarHBondContact O-NZ 2.76Å; I247-K298 HydrophobicContact CG1-CD 4.45Å; D251-K298 WeakPolarHBondContact OD1-CE 3.36Å; D251-K298 IonicContact OD1-NZ 3.04Å; D251-K298 PolarHBondContact OD1-NZ 2.87Å; D251-K298 IonicContact OD2-NZ 2.75Å; D251-K298 PolarHBondContact OD2-NZ 2.78Å; K298-R300 VanDerWaalsContact C-N 3.33Å; K298-R300 PolarHBondContact O-N 3.38Å
299	G	82.1	Confident	84.4	Confident	68 Å²	68	70.6 Å²	70.6	70%	0.701	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.6	-13.6	-178.5	0	0	0	0	0	115.7	V297	V297-G299 PolarHBondContact O-N 2.94Å
300	R	84.2	Confident	83.3	Confident	76 Å²	76	74.7 Å²	74.7	29%	0.287	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	131.8	175.9	-73	-172.2	168.3	152	11	111.9	E246 I247 I296 V297 K298	E246-R300 VanDerWaalsContact CD-NH2 3.33Å; E246-R300 IonicContact OE1-CZ 3.93Å; E246-R300 IonicContact OE1-NH1 2.98Å; E246-R300 PolarHBondContact OE1-NH1 2.89Å; E246-R300 IonicContact OE1-NH2 3.06Å; E246-R300 PolarHBondContact OE1-NH2 2.69Å; E246-R300 IonicContact OE2-CZ 3.15Å; E246-R300 IonicContact OE2-NE 3.23Å; E246-R300 PolarHBondContact OE2-NE 3.16Å; E246-R300 IonicContact OE2-NH1 2.68Å; E246-R300 PolarHBondContact OE2-NH1 3.05Å; E246-R300 IonicContact OE2-NH2 2.99Å; E246-R300 PolarHBondContact OE2-NH2 2.93Å; I247-R300 HydrophobicContact CD1-CB 4.42Å; I296-R300 CarbonylContact C-O 3.49Å; I296-R300 VanDerWaalsContact CA-O 3.28Å; I296-R300 WeakPolarHBondContact CA-O 3.47Å; V297-R300 PolarHBondContact N-O 2.86Å; V297-R300 PolarHBondContact O-N 3.14Å; K298-R300 VanDerWaalsContact C-N 3.33Å; K298-R300 PolarHBondContact O-N 3.38Å
301	R	87.9	Confident	81.5	Confident	152 Å²	152	72 Å²	72	57%	0.574	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.9	119.1	176.9	-170.5	-175	-171	-163.2	5.6	110.3	N240 G293 L295 I296	N240-R301 PolarHBondContact ND2-O 3.43Å; G293-R301 VanDerWaalsContact O-CZ 3.29Å; G293-R301 PolarHBondContact O-NE 3.01Å; G293-R301 PolarHBondContact O-NH2 2.67Å; L295-R301 WeakPolarHBondContact O-CA 3.44Å; I296-R301 HydrophobicContact CG1-CB 4.12Å; I296-R301 HydrophobicContact CG1-CG 4.2Å
302	L	89.6	Confident	79.2	Confident	3 Å²	3	78.3 Å²	78.3	2%	0.016	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-85.9	143.4	-178.3	-56	-172.6	0	0	0	111.3	V238 N240 L241 I247 L295 V297	V238-L302 HydrophobicContact CG1-CB 4.07Å; V238-L302 HydrophobicContact CG1-CD1 3.78Å; V238-L302 HydrophobicContact CG1-CG 4.43Å; N240-L302 WeakPolarHBondContact O-CD2 3.45Å; L241-L302 HydrophobicContact CD2-CD1 4.06Å; L241-L302 HydrophobicContact CD2-CD2 3.97Å; I247-L302 HydrophobicContact CD1-CD2 3.84Å; L295-L302 HydrophobicContact CD2-CB 4.43Å; L295-L302 HydrophobicContact CD2-CD1 3.91Å; L295-L302 HydrophobicContact CG-CB 4.47Å; L295-L302 HydrophobicContact CG-CD1 4.24Å; L295-L302 PolarHBondContact O-N 2.89Å; V297-L302 HydrophobicContact CB-CD1 4.18Å; V297-L302 HydrophobicContact CG2-CD1 3.72Å; V297-L302 HydrophobicContact CG2-CG 4.41Å
303	T	89	Confident	76.9	Confident	70 Å²	70	86.2 Å²	86.2	43%	0.429	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	112.8	-178.8	58.1	0	0	0	0	109.7	G239 N240	G239-T303 WeakPolarHBondContact CA-OG1 3.42Å; G239-T303 PolarHBondContact N-O 3.09Å; G239-T303 PolarHBondContact O-N 3.09Å; G239-T303 PolarHBondContact O-OG1 2.95Å; N240-T303 HydrophobicContact CB-CG2 4.13Å
304	I	90.9	Very high	74.6	Confident	1 Å²	1	90.3 Å²	90.3	1%	0.005	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	137.1	-167.6	-63.7	171.9	0	0	0	110.2	V236 Y237 V238 F256 T291 F292 L295	V236-I304 HydrophobicContact CG1-CG2 3.65Å; Y237-I304 WeakPolarHBondContact O-CA 3.48Å; V238-I304 HydrophobicContact CG1-CG1 4.46Å; F256-I304 HydrophobicContact CZ-CD1 4.19Å; T291-I304 HydrophobicContact CG2-CD1 4.41Å; T291-I304 WeakPolarHBondContact OG1-CD1 3.26Å; F292-I304 VanDerWaalsContact CD2-O 3.26Å; F292-I304 WeakPolarHBondContact CD2-O 3.43Å; F292-I304 WeakPolarHBondContact CE2-O 3.37Å; L295-I304 HydrophobicContact CB-CD1 3.98Å; L295-I304 HydrophobicContact CD2-CD1 3.8Å
305	R	88.9	Confident	72.6	Confident	144 Å²	144	90 Å²	90	54%	0.543	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	162.7	-179.6	-60.2	-66.4	-175.5	170.4	4.3	109.6	Y237	Y237-R305 HydrophobicContact CD1-CB 3.83Å; Y237-R305 HydrophobicContact CD1-CG 4.02Å; Y237-R305 HydrophobicContact CE1-CG 4.42Å; Y237-R305 HydrophobicContact CG-CB 4.45Å; Y237-R305 PolarHBondContact N-O 2.93Å; Y237-R305 PolarHBondContact O-N 3.35Å
306	W	89.4	Confident	70.3	Confident	36 Å²	36	98.4 Å²	98.4	14%	0.136	51%	0.507	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	133.6	163.2	-69	109.1	0	0	0	110.6	K226 P227 P228 A284 E285 C288	K226-W306 PolarHBondContact O-NE1 3.4Å; P227-W306 HydrophobicContact CB-CZ2 4.42Å; P228-W306 VanDerWaalsContact CD-CD2 3.48Å; P228-W306 HydrophobicContact CG-CD2 4.16Å; P228-W306 HydrophobicContact CG-CE3 4.01Å; P228-W306 HydrophobicContact CG-CZ3 4.32Å; A284-W306 HydrophobicContact CB-CH2 4Å; A284-W306 HydrophobicContact CB-CZ3 3.81Å; A284-W306 WeakPolarHBondContact O-CH2 3.36Å; E285-W306 HydrophobicContact CB-CH2 4.23Å; E285-W306 HydrophobicContact CB-CZ2 4.41Å; E285-W306 HydrophobicContact CG-CH2 3.54Å; E285-W306 HydrophobicContact CG-CZ2 3.79Å; C288-W306 HydrophobicContact CB-CH2 4.19Å; C288-W306 HydrophobicContact CB-CZ2 3.67Å; C288-W306 VanDerWaalsContact SG-CE2 3.56Å; C288-W306 VanDerWaalsContact SG-CZ2 3.56Å
307	G	82.1	Confident	68.1	Low	5 Å²	5	101.6 Å²	101.6	5%	0.052	52%	0.52	C	S	.	.	P	Polyproline II helix	trans	-67.5	138.3	173	0	0	0	0	0	110.3	I233 T235	I233-G307 VanDerWaalsContact CG2-O 3.28Å; I233-G307 WeakPolarHBondContact CG2-O 3.28Å; T235-G307 WeakPolarHBondContact O-CA 3.48Å; T235-G307 PolarHBondContact O-N 3.17Å
308	R	80.9	Confident	65.7	Low	228 Å²	228	108 Å²	108	86%	0.86	56%	0.559	S	S	*	*	P	Polyproline II helix	trans	-82.8	144.4	167.6	-63.6	-176.1	180	-160.3	-2.3	108.7	Q310	R308-Q310 PolarHBondContact O-N 3.43Å
309	P	70.4	Confident	63.4	Low	90 Å²	90	109.7 Å²	109.7	58%	0.584	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-62.8	130.1	173	27.7	-32.7	0	0	0	108.9	I233 G311	I233-P309 HydrophobicContact CD1-CG 4.47Å; P309-G311 PolarHBondContact O-N 2.99Å; P309-G311 VanDerWaalsContact O-N 3.08Å
310	Q	63.9	Low	61.2	Low	175 Å²	175	114.9 Å²	114.9	82%	0.818	59%	0.586	S	S	*	*			trans	-75.1	93.5	165.3	-74.7	-177.5	-23.8	0	0	107.7	R308	R308-Q310 PolarHBondContact O-N 3.43Å
311	G	47.4	Very low	59	Low	60 Å²	60	113.6 Å²	113.6	62%	0.619	60%	0.596	S	S	*	*			trans	-59.8	136.6	157.2	0	0	0	0	0	108.6	P309 M313	P309-G311 PolarHBondContact O-N 2.99Å; P309-G311 VanDerWaalsContact O-N 3.08Å; G311-M313 PolarHBondContact O-N 3.24Å
312	N	36.1	Very low	56.9	Low	134 Å²	134	112.4 Å²	112.4	72%	0.717	61%	0.606	S	S	*	*			trans	-49.2	99.9	-167	-69.1	-1.7	0	0	0	113.9
313	M	37.1	Very low	54.9	Low	191 Å²	191	117 Å²	117	94%	0.941	64%	0.636	S	S	*	*			trans	-97	47	156.3	-74.8	-167	159	0	0	110	G311	G311-M313 PolarHBondContact O-N 3.24Å
314	T	31.1	Very low	52.7	Low	109 Å²	109	122.6 Å²	122.6	67%	0.669	66%	0.657	S	S	*	*			trans	-127.4	42.8	179.5	41.6	0	0	0	0	110.1
315	S	35.6	Very low	50.9	Low	99 Å²	99	131.8 Å²	131.8	69%	0.692	69%	0.693	S	S	*	*			trans	-146.6	39.2	174	-55.8	0	0	0	0	112
316	Q	35.7	Very low	49.5	Very low	197 Å²	197	132.3 Å²	132.3	92%	0.921	71%	0.706	S	S	*	*			trans	-121.6	62.6	153.4	-76.3	-173.1	-22.3	0	0	107.8
317	Q	38.3	Very low	48	Very low	170 Å²	170	136 Å²	136	79%	0.794	74%	0.735	S	S	*	*			trans	-76.6	121.3	157.9	-76	178.4	-35.9	0	0	107	D319	Q317-D319 PolarHBondContact O-N 2.81Å
318	T	34.1	Very low	46.9	Very low	140 Å²	140	141.7 Å²	141.7	86%	0.859	77%	0.768	S	S	*	*			trans	27.5	90.3	147.1	56.7	0	0	0	0	116.3
319	D	37.6	Very low	45.8	Very low	156 Å²	156	137 Å²	137	83%	0.834	77%	0.768	S	S	*	*			trans	-111.1	126.8	144.6	-168	13.8	0	0	0	107.2	Q317 G321	Q317-D319 PolarHBondContact O-N 2.81Å; D319-G321 PolarHBondContact O-N 2.89Å; D319-G321 VanDerWaalsContact O-N 3.14Å
320	D	35.1	Very low	45.1	Very low	177 Å²	177	136.2 Å²	136.2	95%	0.947	78%	0.776	S	S	*	*			trans	-91.1	52.4	-178	-159.3	10.4	0	0	0	109
321	G	37.5	Very low	44.6	Very low	49 Å²	49	135.4 Å²	135.4	51%	0.505	78%	0.776	S	S	.	*			trans	-102.6	123.1	-173.7	0	0	0	0	0	111.3	D319	D319-G321 PolarHBondContact O-N 2.89Å; D319-G321 VanDerWaalsContact O-N 3.14Å
322	T	44.5	Very low	45	Very low	127 Å²	127	138.4 Å²	138.4	78%	0.779	79%	0.785	S	S	*	*			trans	-59.3	132.1	172.9	47.2	0	0	0	0	110.6	E324	T322-E324 PolarHBondContact O-N 3.1Å
323	P	47.8	Very low	45.7	Very low	99 Å²	99	136.9 Å²	136.9	64%	0.643	79%	0.791	S	S	*	*			trans	-72.8	90.5	179.7	30	-34.9	0	0	0	110.7	Y325	P323-Y325 HydrophobicContact CB-CD2 4.16Å; P323-Y325 HydrophobicContact CB-CE2 3.77Å; P323-Y325 HydrophobicContact CG-CE2 4.15Å; P323-Y325 WeakPolarHBondContact O-CD2 3.39Å; P323-Y325 PolarHBondContact O-N 2.85Å
324	E	41.6	Very low	46.5	Very low	187 Å²	187	132.3 Å²	132.3	87%	0.874	78%	0.783	S	S	*	*			trans	-69.8	94.6	168.1	-172.5	165.9	-156.7	0	0	108.7	T322	T322-E324 PolarHBondContact O-N 3.1Å
325	Y	54.1	Low	47.5	Very low	195 Å²	195	135.2 Å²	135.2	77%	0.765	79%	0.794	S	S	*	*			trans	-79.2	120.7	174.9	-77.1	-82.1	0	0	0	110.2	P323	P323-Y325 HydrophobicContact CB-CD2 4.16Å; P323-Y325 HydrophobicContact CB-CE2 3.77Å; P323-Y325 HydrophobicContact CG-CE2 4.15Å; P323-Y325 WeakPolarHBondContact O-CD2 3.39Å; P323-Y325 PolarHBondContact O-N 2.85Å
326	D	59.5	Low	48.5	Very low	154 Å²	154	136.2 Å²	136.2	82%	0.824	80%	0.798	S	S	*	*			trans	-49.4	121.4	167.9	-77.6	-56.8	0	0	0	110.5	V328	D326-V328 PolarHBondContact O-N 2.93Å; D326-V328 VanDerWaalsContact O-N 3.11Å
327	P	58.5	Low	49.4	Very low	115 Å²	115	132.6 Å²	132.6	75%	0.747	79%	0.789	S	S	*	*			trans	-71.5	111.2	-176.8	27.1	-33.3	0	0	0	110.4	P329	P327-P329 WeakPolarHBondContact O-CD 3.29Å; P327-P329 VanDerWaalsContact O-N 3.12Å
328	V	58	Low	50	Low	123 Å²	123	131.2 Å²	131.2	75%	0.745	79%	0.792	S	S	*	*			trans	-53.4	115.5	178.1	179.3	0	0	0	0	110.3	D326 G330	D326-V328 PolarHBondContact O-N 2.93Å; D326-V328 VanDerWaalsContact O-N 3.11Å; V328-G330 PolarHBondContact O-N 2.84Å; V328-G330 VanDerWaalsContact O-N 3.14Å
329	P	57.6	Low	50.7	Low	130 Å²	130	131.7 Å²	131.7	84%	0.844	79%	0.789	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	116.1	-177.4	-23.2	34.8	0	0	0	111.5	P327	P327-P329 WeakPolarHBondContact O-CD 3.29Å; P327-P329 VanDerWaalsContact O-N 3.12Å
330	G	56.4	Low	51.2	Low	73 Å²	73	133.4 Å²	133.4	75%	0.753	79%	0.79	S	S	*	*	T	Hydrogen-bonded Turn	trans	136.1	-8.3	169.6	0	0	0	0	0	117.2	V328	V328-G330 PolarHBondContact O-N 2.84Å; V328-G330 VanDerWaalsContact O-N 3.14Å
331	L	54	Low	51.8	Low	159 Å²	159	133.9 Å²	133.9	83%	0.832	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-94.1	124.3	178.5	-121.2	73.4	0	0	0	112.6
332	P	54.5	Low	51.7	Low	123 Å²	123	135 Å²	135	80%	0.799	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-73.6	153.1	171.3	30.9	-34.1	0	0	0	111.8
333	A	50.7	Low	51.6	Low	102 Å²	102	136.3 Å²	136.3	84%	0.843	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-76.3	145.7	-165.3	0	0	0	0	0	115.8
334	A	54.6	Low	51.2	Low	94 Å²	94	139.9 Å²	139.9	78%	0.777	81%	0.805	S	S	*	*			trans	32.4	120.9	153.2	0	0	0	0	0	120.5
335	L	50.9	Low	51.1	Low	171 Å²	171	136.5 Å²	136.5	90%	0.895	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-98	133.8	153.5	-66.5	174	0	0	0	109.4
336	P	56.5	Low	50.3	Low	119 Å²	119	131.4 Å²	131.4	77%	0.773	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-75.8	162.9	175.8	31.6	-35	0	0	0	112.7
337	T	55	Low	49.5	Very low	121 Å²	121	129 Å²	129	74%	0.742	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-72.1	163.6	-178	45.4	0	0	0	0	113.9
338	V	50.8	Low	48.7	Very low	142 Å²	142	131.6 Å²	131.6	86%	0.861	80%	0.797	S	S	*	*			trans	-123	103.2	173.6	-75.6	0	0	0	0	110.6
339	D	49.7	Very low	47.8	Very low	149 Å²	149	131.3 Å²	131.3	80%	0.797	80%	0.796	S	S	*	*			trans	-90.6	133.7	175.6	-68.1	-65	0	0	0	111.1
340	F	47.4	Very low	46.9	Very low	192 Å²	192	131.5 Å²	131.5	84%	0.842	80%	0.795	S	S	*	*			trans	-100	-12.7	-161.6	179	-123.6	0	0	0	115.5
341	F	47.3	Very low	46.3	Very low	188 Å²	188	136.4 Å²	136.4	83%	0.825	80%	0.798	S	S	*	*			trans	-131.1	121.8	177.8	-99.3	-96	0	0	0	110.7
342	G	37	Very low	45.8	Very low	73 Å²	73	133.9 Å²	133.9	75%	0.753	79%	0.791	S	S	*	*			trans	-114.4	149.4	-172	0	0	0	0	0	114.3
343	L	41.4	Very low	45.2	Very low	154 Å²	154	138 Å²	138	81%	0.806	80%	0.796	S	S	*	*			trans	-144.8	116.8	156.6	-144.3	76.3	0	0	0	108.6
344	Q	39	Very low	44.6	Very low	174 Å²	174	144.5 Å²	144.5	81%	0.813	80%	0.799	S	S	*	*			trans	21.8	119.4	150.1	-54.2	166.4	30.5	0	0	115.9
345	S	39.9	Very low	44	Very low	116 Å²	116	145.2 Å²	145.2	81%	0.811	80%	0.796	S	S	*	*			cis	159.9	163.4	47.7	44.1	0	0	0	0	106.9
346	A	37.8	Very low	43.6	Very low	88 Å²	88	147.5 Å²	147.5	73%	0.727	79%	0.792	S	S	*	*			cis	-162.5	174.6	-13.4	0	0	0	0	0	108.5
347	S	41.9	Very low	43	Very low	102 Å²	102	148 Å²	148	71%	0.713	79%	0.788	S	S	*	*			trans	65.7	151.1	-176.8	-68	0	0	0	0	115.8
348	E	41.2	Very low	42.4	Very low	170 Å²	170	148.2 Å²	148.2	79%	0.794	79%	0.785	S	S	*	*			cis	-164.4	-176.8	-21.1	-112.1	163.9	95.1	0	0	108.5
349	T	39.5	Very low	41.9	Very low	117 Å²	117	149.1 Å²	149.1	72%	0.718	78%	0.78	S	S	*	*				-149.4	167.6	-77.6	-69.4	0	0	0	0	109
350	V	39.9	Very low	41.7	Very low	134 Å²	134	148 Å²	148	81%	0.812	78%	0.778	S	S	*	*			trans	78.8	143.1	172.1	-167.2	0	0	0	0	116.2
351	Q	43.6	Very low	41.7	Very low	176 Å²	176	144.6 Å²	144.6	82%	0.822	77%	0.773	S	S	*	*			cis	-162.8	165.8	-43.9	-95.3	-116.4	1.4	0	0	109.8
352	P	42.2	Very low	41.9	Very low	106 Å²	106	141.3 Å²	141.3	69%	0.688	77%	0.77	S	S	*	*			trans	-123.2	-176	-160.7	43.5	-31.7	0	0	0	117.1
353	K	43	Very low	42.1	Very low	209 Å²	209	142.2 Å²	142.2	91%	0.909	77%	0.771	S	S	*	*			trans	-159.4	157.8	158.9	-108.3	158.3	-173.3	174.9	0	114.2
354	R	37.3	Very low	42.2	Very low	240 Å²	240	140 Å²	140	91%	0.906	77%	0.768	S	S	*	*			trans	-147.8	-156.5	176	-55.7	180	168.2	-177.3	-4.2	108.2
355	P	43.3	Very low	42.4	Very low	108 Å²	108	136.5 Å²	136.5	70%	0.701	76%	0.763	S	S	*	*			cis	-139.2	-162.2	-20.1	27.3	-0.5	0	0	0	115.2
356	R	42.2	Very low	42.7	Very low	219 Å²	219	139.1 Å²	139.1	83%	0.826	76%	0.764	S	S	*	*			trans	86.9	150.2	155.2	-66.6	-149.1	148.4	161.2	-8	119.9
357	L	44.5	Very low	42.9	Very low	130 Å²	130	142.2 Å²	142.2	68%	0.681	77%	0.768	S	S	*	*			cis	-174.8	172.4	-21.7	-135.2	73.1	0	0	0	108.7
358	D	40.7	Very low	43.2	Very low	126 Å²	126	148.4 Å²	148.4	67%	0.674	78%	0.777	S	S	*	*			cis	-130.3	-104.6	-18.4	-154.3	-78	0	0	0	111.4
359	E	41.1	Very low	43.1	Very low	161 Å²	161	146.7 Å²	146.7	75%	0.752	78%	0.778	S	S	*	*			cis	-163.8	133.3	-13.5	-151.5	162.3	114.2	0	0	114.2
360	V	46.5	Very low	43.9	Very low	125 Å²	125	148 Å²	148	76%	0.758	79%	0.786	S	S	*	*			trans	58.7	143.9	146.4	160.1	0	0	0	0	124.7
361	T	47	Very low	44.2	Very low	120 Å²	120	147.2 Å²	147.2	74%	0.736	78%	0.784	S	S	*	*			cis	-160.1	-161.3	-43	-10	0	0	0	0	111
362	P	50.5	Low	44.3	Very low	119 Å²	119	144.7 Å²	144.7	77%	0.773	78%	0.783	S	S	*	*			trans	-135.1	-155	-150.9	46.6	-23.3	0	0	0	118.4
363	A	41.6	Very low	44.6	Very low	92 Å²	92	145 Å²	145	76%	0.76	79%	0.788	S	S	*	*			trans	115.8	151.9	156.8	0	0	0	0	0	117.8
364	S	44.6	Very low	44.6	Very low	107 Å²	107	143.2 Å²	143.2	75%	0.748	78%	0.782	S	S	*	*			cis	-154.3	150.7	19.4	-60.5	0	0	0	0	116.4
365	S	41.5	Very low	45.1	Very low	101 Å²	101	140 Å²	140	71%	0.706	78%	0.782	S	S	*	*			trans	62.5	155	139.3	-66.4	0	0	0	0	122.8
366	M	47.8	Very low	44.9	Very low	171 Å²	171	138.3 Å²	138.3	84%	0.842	78%	0.784	S	S	*	*			cis	-139	174.7	3.2	-92.3	-39.8	178.5	0	0	112.6
367	L	40.8	Very low	44.9	Very low	154 Å²	154	139.8 Å²	139.8	81%	0.806	79%	0.789	S	S	*	*			trans	-121.7	168.2	-178.2	-72.5	158.3	0	0	0	113.1
368	Y	48.5	Very low	44.9	Very low	231 Å²	231	139.7 Å²	139.7	91%	0.906	80%	0.796	S	S	*	*			trans	-175	137.4	136	-84.6	-52	0	0	0	113.6
369	T	38.7	Very low	44.9	Very low	134 Å²	134	138.1 Å²	138.1	82%	0.822	80%	0.801	S	S	*	*			trans	-158.2	138.2	179.8	-54.7	0	0	0	0	112.4
370	V	56.8	Low	45.3	Very low	144 Å²	144	135.8 Å²	135.8	87%	0.873	80%	0.8	S	S	*	*			trans	-158.7	166.6	167.7	-102.6	0	0	0	0	112.3
371	P	45.8	Very low	45.1	Very low	118 Å²	118	137.9 Å²	137.9	77%	0.766	81%	0.806	S	S	*	*			trans	-131	-174.1	-136.5	45.6	-30.6	0	0	0	117.5
372	P	46.6	Very low	44.7	Very low	124 Å²	124	141.9 Å²	141.9	81%	0.805	81%	0.813	S	S	*	*			trans	-113.3	165	179.9	40.6	-32.1	0	0	0	116.6
373	S	48.3	Very low	44.3	Very low	113 Å²	113	142.5 Å²	142.5	79%	0.79	82%	0.817	S	S	*	*			trans	-164.1	162.1	169.6	-84.3	0	0	0	0	109.1
374	Q	43.3	Very low	44.1	Very low	170 Å²	170	142.8 Å²	142.8	79%	0.794	82%	0.82	S	S	*	*			cis	171.9	164.4	-28.7	-105.8	-161.8	52.1	0	0	105.9
375	I	46.3	Very low	44.2	Very low	174 Å²	174	143.5 Å²	143.5	89%	0.892	82%	0.82	S	S	*	*			trans	73.9	141.3	176.3	-50.7	157.5	0	0	0	114.5
376	G	40.6	Very low	44.1	Very low	72 Å²	72	145.7 Å²	145.7	74%	0.742	82%	0.824	S	S	*	*			cis	-165.5	-176.5	0.8	0	0	0	0	0	114.4
377	R	41.3	Very low	43.8	Very low	250 Å²	250	142.4 Å²	142.4	94%	0.943	82%	0.817	S	S	*	*			trans	-116.1	-174	-176.5	-93.4	-176.6	173.2	-173.2	-0.2	110.6
378	P	44.5	Very low	43.8	Very low	128 Å²	128	139.5 Å²	139.5	83%	0.831	81%	0.81	S	S	*	*			cis	-138.6	-154	10.6	44.1	-22.9	0	0	0	115.4
379	A	41.4	Very low	43.6	Very low	93 Å²	93	135.8 Å²	135.8	77%	0.769	81%	0.805	S	S	*	*			trans	-147	155.3	174.7	0	0	0	0	0	113.8
380	P	49.8	Very low	43.9	Very low	112 Å²	112	136.2 Å²	136.2	73%	0.727	81%	0.807	S	S	*	*			trans	-99.3	134.5	172.4	36.7	-30.6	0	0	0	112.7
381	L	41.4	Very low	42.9	Very low	169 Å²	169	134.3 Å²	134.3	89%	0.885	80%	0.801	S	S	*	*				85.8	126.3	77.1	-71.4	165.6	0	0	0	115.9
382	F	39.1	Very low	42.7	Very low	203 Å²	203	140.4 Å²	140.4	89%	0.89	81%	0.808	S	S	*	*			trans	-102	169.2	168	-71	-92	0	0	0	110.4
383	P	42.3	Very low	42.4	Very low	133 Å²	133	140 Å²	140	86%	0.864	80%	0.803	S	S	*	*				-143.4	-170.2	109.8	38.3	-23.4	0	0	0	114.3
384	A	37.1	Very low	41.9	Very low	98 Å²	98	142 Å²	142	81%	0.81	81%	0.805	S	S	*	*			trans	-144.6	164.8	-176.8	0	0	0	0	0	112.4
385	T	46.4	Very low	41.8	Very low	122 Å²	122	139.4 Å²	139.4	75%	0.748	80%	0.802	S	S	*	*			trans	-149.7	134	175.1	52.8	0	0	0	0	112
386	D	39.2	Very low	41.5	Very low	147 Å²	147	136.5 Å²	136.5	79%	0.786	79%	0.794	S	S	*	*			trans	37.8	150.3	130.8	-52.2	-46.6	0	0	0	121.7
387	S	41.4	Very low	41.2	Very low	102 Å²	102	137.2 Å²	137.2	71%	0.713	79%	0.788	S	S	*	*			cis	-175.2	175.4	-4.9	-110.9	0	0	0	0	107.7
388	S	41.3	Very low	41.1	Very low	92 Å²	92	132 Å²	132	64%	0.643	78%	0.783	S	S	*	*			cis	-166.3	-160.9	-11.4	57.8	0	0	0	0	108.5
389	L	43	Very low	40.7	Very low	154 Å²	154	136.7 Å²	136.7	81%	0.806	79%	0.785	S	S	*	*			trans	58.9	113.4	163.7	-67.1	164.9	0	0	0	117.7
390	T	45.6	Very low	40.7	Very low	142 Å²	142	139.5 Å²	139.5	87%	0.871	79%	0.785	S	S	*	*				-168.4	-178.4	58.5	42.5	0	0	0	0	111.2
391	S	35.4	Very low	40.1	Very low	105 Å²	105	139.9 Å²	139.9	73%	0.734	78%	0.781	S	S	*	*			trans	-123.1	144.7	-165.6	178.7	0	0	0	0	115.8
392	R	41.8	Very low	39.9	Very low	245 Å²	245	137.6 Å²	137.6	93%	0.925	78%	0.777	S	S	*	*			trans	-166.5	88.3	154.3	-109.8	170.4	-168.8	-165.7	2.9	115.5
393	V	40	Very low	39.9	Very low	115 Å²	115	135.9 Å²	135.9	70%	0.697	77%	0.771	S	S	*	*			trans	42	106.1	132.5	-172.7	0	0	0	0	121.9
394	L	38.6	Very low	39.6	Very low	157 Å²	157	134.9 Å²	134.9	82%	0.822	76%	0.762	S	S	*	*			trans	61.9	164	139.6	-64.8	175.3	0	0	0	122
395	P	40.3	Very low	39.7	Very low	115 Å²	115	134.1 Å²	134.1	75%	0.747	75%	0.748	S	S	*	*			cis	-117	-146.4	-3.5	48.1	-34.5	0	0	0	111.9
396	P	41.9	Very low	39.4	Very low	112 Å²	112	133 Å²	133	73%	0.727	75%	0.752	S	S	*	*			trans	-120.8	140	-130.1	26.3	-1.2	0	0	0	118.7
397	S	33.9	Very low	39.4	Very low	87 Å²	87	136.7 Å²	136.7	61%	0.608	75%	0.754	S	S	*	*			trans	38.4	108.3	139.4	-60.7	0	0	0	0	121.8
398	V	38.1	Very low	39.2	Very low	140 Å²	140	137.2 Å²	137.2	85%	0.848	75%	0.749	S	S	*	*				-117.6	103	123.3	177.9	0	0	0	0	107.6	I400	V398-I400 PolarHBondContact O-N 3.31Å
399	R	35.6	Very low	39.3	Very low	227 Å²	227	139.7 Å²	139.7	86%	0.857	75%	0.751	S	S	*	*			trans	-88.9	99.6	-179.1	-71.8	-173.8	179	-172.9	-0.3	110.9
400	I	42.3	Very low	39.2	Very low	153 Å²	153	140.7 Å²	140.7	79%	0.785	75%	0.751	S	S	*	*			trans	-94.4	122.3	158.8	-59.9	179.7	0	0	0	107.3	V398 P402	V398-I400 PolarHBondContact O-N 3.31Å; I400-P402 WeakPolarHBondContact O-CD 3.18Å
401	N	36.4	Very low	38.8	Very low	120 Å²	120	142.8 Å²	142.8	64%	0.642	75%	0.753	S	S	*	*			trans	-78.4	113.9	-165.7	-170.3	9.6	0	0	0	112.6	Q403	N401-Q403 PolarHBondContact O-N 2.94Å
402	P	37.8	Very low	39.1	Very low	121 Å²	121	142.9 Å²	142.9	79%	0.786	74%	0.744	S	S	*	*			trans	-95	32.7	-166.8	39.4	-37	0	0	0	114.2	I400	I400-P402 WeakPolarHBondContact O-CD 3.18Å
403	Q	39.3	Very low	38.8	Very low	166 Å²	166	134 Å²	134	78%	0.776	72%	0.715	S	S	*	*			trans	-113.6	6.1	-170.8	-72.1	-163	-39.8	0	0	116.2	N401	N401-Q403 PolarHBondContact O-N 2.94Å
404	V	37.1	Very low	38.9	Very low	112 Å²	112	133 Å²	133	68%	0.679	71%	0.713	S	S	*	*	S	Bend	trans	-115.6	150.7	175.7	-167.7	0	0	0	0	109.7
405	T	38.8	Very low	39.1	Very low	82 Å²	82	135.2 Å²	135.2	50%	0.503	71%	0.711	S	S	.	*			trans	79	18.3	178.9	77	0	0	0	0	119.3	R407 D408	T405-R407 VanDerWaalsContact C-N 3.27Å; T405-R407 PolarHBondContact O-N 3.13Å; T405-D408 VanDerWaalsContact CA-OD2 3.26Å; T405-D408 WeakPolarHBondContact CA-OD2 3.46Å
406	A	39	Very low	39	Very low	100 Å²	100	138.2 Å²	138.2	83%	0.826	71%	0.708	S	S	*	*	S	Bend	trans	-73.8	-13.7	165.2	0	0	0	0	0	114.1
407	R	40.6	Very low	38.9	Very low	224 Å²	224	140.3 Å²	140.3	85%	0.845	70%	0.702	S	S	*	*	S	Bend	trans	-109.7	-22.1	179.4	-81.1	-178.6	165.6	160.9	-3.3	114.6	T405 Q409	T405-R407 VanDerWaalsContact C-N 3.27Å; T405-R407 PolarHBondContact O-N 3.13Å; R407-Q409 PolarHBondContact O-N 2.9Å; R407-Q409 VanDerWaalsContact O-N 3.17Å
408	D	36.2	Very low	39	Very low	112 Å²	112	138.5 Å²	138.5	60%	0.599	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	5	-172.6	-51.5	-68.4	0	0	0	114.3	T405 E410	T405-D408 VanDerWaalsContact CA-OD2 3.26Å; T405-D408 WeakPolarHBondContact CA-OD2 3.46Å; D408-E410 VanDerWaalsContact C-N 3.32Å; D408-E410 PolarHBondContact O-N 3.1Å
409	Q	42.8	Very low	38.9	Very low	145 Å²	145	134.2 Å²	134.2	68%	0.678	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	-7.6	-178	-62.9	-169.9	7.1	0	0	114.1	R407	R407-Q409 PolarHBondContact O-N 2.9Å; R407-Q409 VanDerWaalsContact O-N 3.17Å
410	E	41.3	Very low	39.3	Very low	174 Å²	174	124.5 Å²	124.5	81%	0.813	62%	0.619	S	S	*	*	S	Bend	trans	-98.7	-10.8	-169.6	-57.7	-163.1	124.8	0	0	114.8	D408	D408-E410 VanDerWaalsContact C-N 3.32Å; D408-E410 PolarHBondContact O-N 3.1Å
411	M	36.7	Very low	39.3	Very low	186 Å²	186	117.6 Å²	117.6	92%	0.916	58%	0.584	S	S	*	*			trans	-108.5	25	-174.8	-69.3	-167.3	69.5	0	0	115.9
412	I	43	Very low	39.6	Very low	107 Å²	107	115.2 Å²	115.2	55%	0.549	58%	0.576	S	S	.	*	S	Bend	trans	-91.1	110.2	168.5	-58	177.8	0	0	0	109.3	S414	I412-S414 PolarHBondContact O-N 2.98Å
413	D	35.6	Very low	39.8	Very low	59 Å²	59	111.4 Å²	111.4	32%	0.316	55%	0.548	S	S	.	.			trans	-42.4	128.7	176.3	178.4	-28.1	0	0	0	111.4	R415 Y416	D413-R415 PolarHBondContact O-N 3.35Å; D413-R415 VanDerWaalsContact O-N 3.08Å; D413-R415 VanDerWaalsContact OD1-CB 3.31Å; D413-R415 WeakPolarHBondContact OD1-CB 3.22Å; D413-R415 WeakPolarHBondContact OD1-CG 3.49Å; D413-R415 IonicContact OD1-CZ 2.9Å; D413-R415 PolarHBondContact OD1-N 3.5Å; D413-R415 IonicContact OD1-NE 2.7Å; D413-R415 PolarHBondContact OD1-NE 2.83Å; D413-R415 IonicContact OD1-NH2 3.34Å; D413-R415 IonicContact OD2-CZ 3.17Å; D413-R415 IonicContact OD2-NE 3.93Å; D413-R415 PolarHBondContact OD2-NE 3.39Å; D413-R415 VanDerWaalsContact OD2-NE 3.15Å; D413-R415 IonicContact OD2-NH2 3.26Å; D413-R415 PolarHBondContact OD2-NH2 3.19Å; D413-Y416 HydrophobicContact CB-CD2 3.94Å; D413-Y416 HydrophobicContact CB-CE2 4.28Å; D413-Y416 PolarHBondContact O-N 2.9Å; D413-Y416 VanDerWaalsContact O-N 3.09Å
414	S	41.6	Very low	39.7	Very low	94 Å²	94	107 Å²	107	66%	0.657	53%	0.53	S	S	*	.	G	3₁₀ helix	trans	-54.7	-30.9	-173.2	51.2	0	0	0	0	112.8	I412 Y416 R417	I412-S414 PolarHBondContact O-N 2.98Å; S414-Y416 PolarHBondContact O-N 3.27Å; S414-Y416 VanDerWaalsContact O-N 3.14Å; S414-R417 PolarHBondContact O-N 3.38Å
415	R	42.4	Very low	39.7	Very low	204 Å²	204	105.5 Å²	105.5	77%	0.77	52%	0.523	S	S	*	.	G	3₁₀ helix	trans	-65.2	-13.3	-179	-64.1	175	-74.4	-167.4	0.8	114.3	D413	D413-R415 PolarHBondContact O-N 3.35Å; D413-R415 VanDerWaalsContact O-N 3.08Å; D413-R415 VanDerWaalsContact OD1-CB 3.31Å; D413-R415 WeakPolarHBondContact OD1-CB 3.22Å; D413-R415 WeakPolarHBondContact OD1-CG 3.49Å; D413-R415 IonicContact OD1-CZ 2.9Å; D413-R415 PolarHBondContact OD1-N 3.5Å; D413-R415 IonicContact OD1-NE 2.7Å; D413-R415 PolarHBondContact OD1-NE 2.83Å; D413-R415 IonicContact OD1-NH2 3.34Å; D413-R415 IonicContact OD2-CZ 3.17Å; D413-R415 IonicContact OD2-NE 3.93Å; D413-R415 PolarHBondContact OD2-NE 3.39Å; D413-R415 VanDerWaalsContact OD2-NE 3.15Å; D413-R415 IonicContact OD2-NH2 3.26Å; D413-R415 PolarHBondContact OD2-NH2 3.19Å
416	Y	38.4	Very low	40	Very low	178 Å²	178	108.3 Å²	108.3	70%	0.698	53%	0.53	S	S	*	.	G	3₁₀ helix	trans	-104.8	2	-179.5	-63.4	-83.5	0	0	0	114.6	D413 S414 I418	D413-Y416 HydrophobicContact CB-CD2 3.94Å; D413-Y416 HydrophobicContact CB-CE2 4.28Å; D413-Y416 PolarHBondContact O-N 2.9Å; D413-Y416 VanDerWaalsContact O-N 3.09Å; S414-Y416 PolarHBondContact O-N 3.27Å; S414-Y416 VanDerWaalsContact O-N 3.14Å; Y416-I418 PolarHBondContact O-N 3.47Å; Y416-I418 VanDerWaalsContact O-N 3.09Å
417	R	39.4	Very low	40.3	Very low	156 Å²	156	110.1 Å²	110.1	59%	0.589	52%	0.521	S	S	*	.			trans	-77.1	96.3	177.6	-67.5	-175	177.7	-165.1	-2	110.8	S414 H419	S414-R417 PolarHBondContact O-N 3.38Å; R417-H419 VanDerWaalsContact C-N 3.33Å; R417-H419 PolarHBondContact O-N 3.41Å
418	I	36	Very low	40.3	Very low	48 Å²	48	105.4 Å²	105.4	25%	0.246	51%	0.512	C	S	.	.			trans	-65	94.2	168.9	-53.3	177.9	0	0	0	109	Y158 L195 Y416 Y420	Y158-I418 PolarHBondContact OH-O 3.14Å; L195-I418 HydrophobicContact CD2-CG2 4Å; Y416-I418 PolarHBondContact O-N 3.47Å; Y416-I418 VanDerWaalsContact O-N 3.09Å; I418-Y420 HydrophobicContact CG2-CD2 4.19Å; I418-Y420 HydrophobicContact CG2-CE2 3.78Å
419	H	36.5	Very low	40.3	Very low	51 Å²	51	103.7 Å²	103.7	24%	0.236	52%	0.521	C	S	.	.			trans	-71.3	156.1	170	-167.8	-123.8	0	0	0	110.3	S189 R417 Q423	S189-H419 PolarHBondContact OG-CE1 2.71Å; S189-H419 VanDerWaalsContact OG-CE1 3.31Å; S189-H419 PolarHBondContact OG-ND1 3.34Å; R417-H419 VanDerWaalsContact C-N 3.33Å; R417-H419 PolarHBondContact O-N 3.41Å; H419-Q423 PolarHBondContact CE1-NE2 3.3Å; H419-Q423 PolarHBondContact CE1-OE1 3.14Å; H419-Q423 PolarHBondContact NE2-NE2 2.86Å; H419-Q423 VanDerWaalsContact NE2-NE2 3.19Å
420	Y	43.8	Very low	39.9	Very low	23 Å²	23	100.8 Å²	100.8	9%	0.09	52%	0.522	C	S	.	.			trans	-128.8	94.4	175.3	-83.5	-116.3	0	0	0	107.8	R154 V211 I418 S422	R154-Y420 VanDerWaalsContact NH2-CE2 3.35Å; R154-Y420 PolarHBondContact NH2-OH 3.07Å; R154-Y420 VanDerWaalsContact NH2-OH 3.13Å; V211-Y420 HydrophobicContact CB-CE1 4.35Å; V211-Y420 HydrophobicContact CG1-CE1 3.59Å; V211-Y420 HydrophobicContact CG1-CE2 4.37Å; V211-Y420 VanDerWaalsContact CG1-CZ 3.42Å; V211-Y420 WeakPolarHBondContact CG1-OH 3.35Å; V211-Y420 HydrophobicContact CG2-CD1 4.28Å; V211-Y420 HydrophobicContact CG2-CE1 3.92Å; I418-Y420 HydrophobicContact CG2-CD2 4.19Å; I418-Y420 HydrophobicContact CG2-CE2 3.78Å; Y420-S422 PolarHBondContact O-N 3.16Å
421	P	43.4	Very low	39.5	Very low	7 Å²	7	101.3 Å²	101.3	5%	0.045	52%	0.516	C	S	.	.			trans	-72.5	92.5	172.7	-11.5	28.2	0	0	0	109.8	L195 Q423	L195-P421 WeakPolarHBondContact O-CD 3.37Å; P421-Q423 HydrophobicContact CB-CB 4.14Å; P421-Q423 HydrophobicContact CB-CG 4.45Å; P421-Q423 PolarHBondContact O-N 3.21Å
422	S	41.6	Very low	39.5	Very low	70 Å²	70	100.1 Å²	100.1	49%	0.49	51%	0.514	S	S	.	.			trans	-84	36.3	153.9	55.7	0	0	0	0	110.4	H165 Y420	H165-S422 VanDerWaalsContact NE2-C 3.34Å; H165-S422 PolarHBondContact NE2-O 3.21Å; H165-S422 PolarHBondContact NE2-OG 3.49Å; H165-S422 VanDerWaalsContact NE2-OG 3.09Å; Y420-S422 PolarHBondContact O-N 3.16Å
423	Q	41.9	Very low	39.2	Very low	41 Å²	41	102.1 Å²	102.1	19%	0.192	53%	0.525	C	S	.	.			trans	-118.1	48.9	-148.1	-68.4	176.7	14.2	0	0	113.4	H165 I166 R184 H419 P421	H165-Q423 WeakPolarHBondContact CE1-CG 3.31Å; I166-Q423 VanDerWaalsContact CD1-OE1 3.24Å; R184-Q423 VanDerWaalsContact NH2-NE2 3.18Å; H419-Q423 PolarHBondContact CE1-NE2 3.3Å; H419-Q423 PolarHBondContact CE1-OE1 3.14Å; H419-Q423 PolarHBondContact NE2-NE2 2.86Å; H419-Q423 VanDerWaalsContact NE2-NE2 3.19Å; P421-Q423 HydrophobicContact CB-CB 4.14Å; P421-Q423 HydrophobicContact CB-CG 4.45Å; P421-Q423 PolarHBondContact O-N 3.21Å
424	D	36.9	Very low	39.1	Very low	73 Å²	73	105.4 Å²	105.4	39%	0.39	55%	0.551	S	S	.	*			trans	-143.5	113.8	157.3	-154.6	-22.3	0	0	0	112.8	Q426	D424-Q426 PolarHBondContact O-N 2.7Å; D424-Q426 WeakPolarHBondContact OD1-CB 3.17Å; D424-Q426 PolarHBondContact OD1-N 2.74Å
425	P	38.8	Very low	38.9	Very low	82 Å²	82	112.3 Å²	112.3	53%	0.532	58%	0.581	S	S	.	*	S	Bend	trans	-61.6	-27.1	167.4	-21.3	34	0	0	0	113.3	L428	P425-L428 PolarHBondContact O-N 3.4Å
426	Q	43.6	Very low	38.7	Very low	141 Å²	141	107.8 Å²	107.8	66%	0.659	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	-21.9	-172.1	-55.8	-165.4	-108.7	0	0	113.1	D424	D424-Q426 PolarHBondContact O-N 2.7Å; D424-Q426 WeakPolarHBondContact OD1-CB 3.17Å; D424-Q426 PolarHBondContact OD1-N 2.74Å
427	H	46.1	Very low	38.7	Very low	138 Å²	138	104.1 Å²	104.1	64%	0.639	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.7	-0.6	170.5	-105.3	-82.8	0	0	0	114.2	G429	H427-G429 VanDerWaalsContact C-N 3.28Å; H427-G429 PolarHBondContact O-N 2.64Å; H427-G429 VanDerWaalsContact O-N 3.17Å
428	L	40.9	Very low	38.7	Very low	125 Å²	125	101.2 Å²	101.2	65%	0.654	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	55.1	175	-74.8	167.3	0	0	0	112.6	I200 P425	I200-L428 HydrophobicContact CD1-CD2 4.34Å; P425-L428 PolarHBondContact O-N 3.4Å
429	G	34.9	Very low	38.9	Very low	76 Å²	76	104.3 Å²	104.3	78%	0.784	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	76.3	35	162.6	0	0	0	0	0	116.5	H427	H427-G429 VanDerWaalsContact C-N 3.28Å; H427-G429 PolarHBondContact O-N 2.64Å; H427-G429 VanDerWaalsContact O-N 3.17Å
430	A	34.6	Very low	39	Very low	84 Å²	84	107.6 Å²	107.6	69%	0.694	60%	0.603	S	S	*	*			trans	-117	42.1	174.3	0	0	0	0	0	112.3
431	R	33.4	Very low	38.7	Very low	185 Å²	185	113.3 Å²	113.3	70%	0.698	64%	0.638	S	S	*	*			trans	-126.7	153.1	167.3	-84.4	-179.1	161.2	144.3	-5.7	108.5
432	D	36.1	Very low	38.4	Very low	160 Å²	160	120.9 Å²	120.9	86%	0.856	68%	0.68	S	S	*	*	S	Bend	trans	72.4	146	-171.7	-43.8	-27.4	0	0	0	114
433	L	37.6	Very low	38.1	Very low	149 Å²	149	124.8 Å²	124.8	78%	0.78	69%	0.694	S	S	*	*			trans	73.7	48.7	-172.1	-52.2	176.9	0	0	0	117.2	M3	M3-L433 HydrophobicContact CE-CD1 4.35Å
434	C	33	Very low	37.8	Very low	129 Å²	129	131.8 Å²	131.8	87%	0.872	74%	0.736	S	S	*	*			trans	-141.6	47.6	160.9	-86.6	0	0	0	0	111.9
435	D	37.6	Very low	37.9	Very low	239 Å²	239	137.1 Å²	137.1	100%	1.278	77%	0.768	S	S	*	*			trans	-149.4	0	156.9	-91.2	-47.7	0	0	0	106.7

Retrieved 435 of 435 residues in 327.3 ms (Link to these results)

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